USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 775 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 45 LYS NZ :NH3+ -143:sc= 0.64 (180deg=0) USER MOD Set 1.2: A 80 GLN : amide:sc= 0.295 K(o=1.8,f=-6.4!) USER MOD Set 1.3: A 84 THR OG1 : rot -90:sc= 0.859 USER MOD Set 2.1: A 50 HIS : no HE2:sc= 0.41 K(o=0.88,f=-0.045) USER MOD Set 2.2: A 105 CYS SG : rot 51:sc= 0.467 USER MOD Set 3.1: A 44 SER OG : rot 25:sc= 2.15 USER MOD Set 3.2: A 51 SER OG : rot 90:sc= 0.81 USER MOD Set 3.3: A 52 THR OG1 : rot -6:sc= 1.22 USER MOD Single : A 38 ASN : amide:sc=-0.00103 X(o=-0.001,f=-0.072) USER MOD Single : A 41 MET CE :methyl -165:sc= -14.1! (180deg=-16!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -4:sc= -0.527 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -1:sc= 0.734! USER MOD Single : A 65 TYR OH : rot -66:sc= 0.173 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.73 X(o=-0.73,f=-0.73) USER MOD Single : A 78 SER OG : rot -82:sc= -0.0502 USER MOD Single : A 87 SER OG : rot -163:sc= 0.602 USER MOD Single : A 88 ASN : amide:sc= -0.252 K(o=-0.25,f=-2!) USER MOD Single : A 89 GLN : amide:sc= -2.58 K(o=-2.6,f=-1.6) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0807 USER MOD Single : A 94 ASN : amide:sc= -4.52! C(o=-4.5!,f=-5.1!) USER MOD Single : A 98 ASN : amide:sc= -6.54! C(o=-6.5!,f=-14!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.395 X(o=-0.4,f=-0.39) USER MOD Single : A 108 THR OG1 : rot -127:sc= -1.45 USER MOD Single : A 110 GLN : amide:sc= -1.74 K(o=-1.7,f=-2.9!) USER MOD Single : A 112 HIS : no HD1:sc= -0.387 X(o=-0.39,f=-0.64) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 ASN : amide:sc= 0.134 X(o=0.13,f=0) USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 119 LYS NZ :NH3+ -151:sc= 0 (180deg=-1.03) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 27 3.177 -2.426 -5.553 1.00 51.44 N ATOM 66 CA LEU A 27 4.290 -3.228 -6.050 1.00 33.20 C ATOM 67 C LEU A 27 3.821 -4.201 -7.127 1.00 72.02 C ATOM 68 O LEU A 27 4.297 -4.163 -8.262 1.00 31.01 O ATOM 69 CB LEU A 27 4.943 -3.997 -4.901 1.00 54.22 C ATOM 70 CG LEU A 27 5.816 -5.187 -5.300 1.00 73.11 C ATOM 71 CD1 LEU A 27 7.249 -4.978 -4.836 1.00 75.53 C ATOM 72 CD2 LEU A 27 5.251 -6.479 -4.728 1.00 12.04 C ATOM 0 HA LEU A 27 5.024 -2.553 -6.491 1.00 33.20 H new ATOM 0 HB2 LEU A 27 5.553 -3.301 -4.325 1.00 54.22 H new ATOM 0 HB3 LEU A 27 4.156 -4.356 -4.237 1.00 54.22 H new ATOM 0 HG LEU A 27 5.816 -5.264 -6.387 1.00 73.11 H new ATOM 0 HD11 LEU A 27 7.855 -5.835 -5.129 1.00 75.53 H new ATOM 0 HD12 LEU A 27 7.652 -4.075 -5.295 1.00 75.53 H new ATOM 0 HD13 LEU A 27 7.269 -4.874 -3.751 1.00 75.53 H new ATOM 0 HD21 LEU A 27 5.885 -7.315 -5.022 1.00 12.04 H new ATOM 0 HD22 LEU A 27 5.220 -6.412 -3.640 1.00 12.04 H new ATOM 0 HD23 LEU A 27 4.243 -6.636 -5.111 1.00 12.04 H new ATOM 84 N ARG A 28 2.884 -5.071 -6.764 1.00 12.43 N ATOM 85 CA ARG A 28 2.350 -6.053 -7.699 1.00 70.21 C ATOM 86 C ARG A 28 1.861 -5.378 -8.977 1.00 60.42 C ATOM 87 O ARG A 28 2.049 -5.899 -10.077 1.00 50.51 O ATOM 88 CB ARG A 28 1.205 -6.835 -7.052 1.00 42.03 C ATOM 89 CG ARG A 28 1.010 -8.224 -7.638 1.00 20.32 C ATOM 90 CD ARG A 28 0.532 -8.160 -9.079 1.00 42.42 C ATOM 91 NE ARG A 28 -0.534 -9.122 -9.346 1.00 54.24 N ATOM 92 CZ ARG A 28 -0.352 -10.437 -9.353 1.00 62.54 C ATOM 93 NH1 ARG A 28 0.848 -10.946 -9.108 1.00 51.40 N ATOM 94 NH2 ARG A 28 -1.372 -11.249 -9.605 1.00 4.21 N ATOM 0 H ARG A 28 2.479 -5.115 -5.829 1.00 12.43 H new ATOM 0 HA ARG A 28 3.152 -6.744 -7.958 1.00 70.21 H new ATOM 0 HB2 ARG A 28 1.396 -6.924 -5.983 1.00 42.03 H new ATOM 0 HB3 ARG A 28 0.280 -6.269 -7.165 1.00 42.03 H new ATOM 0 HG2 ARG A 28 1.949 -8.775 -7.590 1.00 20.32 H new ATOM 0 HG3 ARG A 28 0.286 -8.775 -7.038 1.00 20.32 H new ATOM 0 HD2 ARG A 28 0.175 -7.154 -9.298 1.00 42.42 H new ATOM 0 HD3 ARG A 28 1.371 -8.353 -9.748 1.00 42.42 H new ATOM 0 HE ARG A 28 -1.470 -8.764 -9.538 1.00 54.24 H new ATOM 0 HH11 ARG A 28 1.635 -10.327 -8.913 1.00 51.40 H new ATOM 0 HH12 ARG A 28 0.984 -11.957 -9.114 1.00 51.40 H new ATOM 0 HH21 ARG A 28 -2.297 -10.863 -9.794 1.00 4.21 H new ATOM 0 HH22 ARG A 28 -1.231 -12.259 -9.610 1.00 4.21 H new ATOM 108 N ARG A 29 1.233 -4.217 -8.823 1.00 70.12 N ATOM 109 CA ARG A 29 0.714 -3.472 -9.964 1.00 4.12 C ATOM 110 C ARG A 29 1.823 -3.179 -10.971 1.00 63.43 C ATOM 111 O ARG A 29 1.561 -2.985 -12.159 1.00 25.43 O ATOM 112 CB ARG A 29 0.077 -2.162 -9.497 1.00 44.14 C ATOM 113 CG ARG A 29 -1.364 -1.990 -9.950 1.00 25.30 C ATOM 114 CD ARG A 29 -2.245 -1.482 -8.821 1.00 35.44 C ATOM 115 NE ARG A 29 -3.639 -1.338 -9.236 1.00 24.12 N ATOM 116 CZ ARG A 29 -4.589 -0.831 -8.459 1.00 5.34 C ATOM 117 NH1 ARG A 29 -4.298 -0.421 -7.231 1.00 22.10 N ATOM 118 NH2 ARG A 29 -5.832 -0.731 -8.908 1.00 54.32 N ATOM 0 H ARG A 29 1.071 -3.772 -7.920 1.00 70.12 H new ATOM 0 HA ARG A 29 -0.045 -4.084 -10.452 1.00 4.12 H new ATOM 0 HB2 ARG A 29 0.115 -2.117 -8.409 1.00 44.14 H new ATOM 0 HB3 ARG A 29 0.669 -1.326 -9.871 1.00 44.14 H new ATOM 0 HG2 ARG A 29 -1.403 -1.292 -10.786 1.00 25.30 H new ATOM 0 HG3 ARG A 29 -1.749 -2.943 -10.313 1.00 25.30 H new ATOM 0 HD2 ARG A 29 -2.187 -2.171 -7.978 1.00 35.44 H new ATOM 0 HD3 ARG A 29 -1.869 -0.520 -8.473 1.00 35.44 H new ATOM 0 HE ARG A 29 -3.896 -1.644 -10.174 1.00 24.12 H new ATOM 0 HH11 ARG A 29 -3.343 -0.495 -6.882 1.00 22.10 H new ATOM 0 HH12 ARG A 29 -5.030 -0.032 -6.636 1.00 22.10 H new ATOM 0 HH21 ARG A 29 -6.060 -1.044 -9.852 1.00 54.32 H new ATOM 0 HH22 ARG A 29 -6.561 -0.341 -8.310 1.00 54.32 H new ATOM 132 N ARG A 30 3.061 -3.149 -10.488 1.00 60.54 N ATOM 133 CA ARG A 30 4.209 -2.880 -11.346 1.00 5.14 C ATOM 134 C ARG A 30 4.715 -4.163 -11.997 1.00 24.43 C ATOM 135 O ARG A 30 5.140 -4.161 -13.154 1.00 12.24 O ATOM 136 CB ARG A 30 5.333 -2.226 -10.539 1.00 33.23 C ATOM 137 CG ARG A 30 5.695 -0.831 -11.018 1.00 50.45 C ATOM 138 CD ARG A 30 7.118 -0.459 -10.629 1.00 52.22 C ATOM 139 NE ARG A 30 7.168 0.782 -9.860 1.00 45.12 N ATOM 140 CZ ARG A 30 6.898 1.976 -10.374 1.00 52.13 C ATOM 141 NH1 ARG A 30 6.560 2.091 -11.651 1.00 14.22 N ATOM 142 NH2 ARG A 30 6.966 3.059 -9.611 1.00 12.21 N ATOM 0 H ARG A 30 3.295 -3.308 -9.508 1.00 60.54 H new ATOM 0 HA ARG A 30 3.890 -2.196 -12.133 1.00 5.14 H new ATOM 0 HB2 ARG A 30 5.035 -2.175 -9.492 1.00 33.23 H new ATOM 0 HB3 ARG A 30 6.219 -2.859 -10.588 1.00 33.23 H new ATOM 0 HG2 ARG A 30 5.587 -0.778 -12.101 1.00 50.45 H new ATOM 0 HG3 ARG A 30 5.000 -0.107 -10.593 1.00 50.45 H new ATOM 0 HD2 ARG A 30 7.557 -1.267 -10.043 1.00 52.22 H new ATOM 0 HD3 ARG A 30 7.724 -0.353 -11.529 1.00 52.22 H new ATOM 0 HE ARG A 30 7.424 0.728 -8.874 1.00 45.12 H new ATOM 0 HH11 ARG A 30 6.507 1.261 -12.241 1.00 14.22 H new ATOM 0 HH12 ARG A 30 6.353 3.010 -12.043 1.00 14.22 H new ATOM 0 HH21 ARG A 30 7.226 2.975 -8.628 1.00 12.21 H new ATOM 0 HH22 ARG A 30 6.758 3.976 -10.007 1.00 12.21 H new ATOM 156 N LEU A 31 4.669 -5.258 -11.246 1.00 61.34 N ATOM 157 CA LEU A 31 5.123 -6.550 -11.750 1.00 64.14 C ATOM 158 C LEU A 31 4.245 -7.026 -12.903 1.00 12.22 C ATOM 159 O LEU A 31 4.728 -7.649 -13.848 1.00 54.11 O ATOM 160 CB LEU A 31 5.116 -7.588 -10.626 1.00 73.45 C ATOM 161 CG LEU A 31 5.599 -7.102 -9.260 1.00 40.13 C ATOM 162 CD1 LEU A 31 5.685 -8.263 -8.280 1.00 0.41 C ATOM 163 CD2 LEU A 31 6.947 -6.407 -9.387 1.00 14.24 C ATOM 0 H LEU A 31 4.322 -5.277 -10.287 1.00 61.34 H new ATOM 0 HA LEU A 31 6.141 -6.430 -12.120 1.00 64.14 H new ATOM 0 HB2 LEU A 31 4.100 -7.968 -10.516 1.00 73.45 H new ATOM 0 HB3 LEU A 31 5.739 -8.429 -10.931 1.00 73.45 H new ATOM 0 HG LEU A 31 4.877 -6.382 -8.876 1.00 40.13 H new ATOM 0 HD11 LEU A 31 6.031 -7.898 -7.313 1.00 0.41 H new ATOM 0 HD12 LEU A 31 4.700 -8.717 -8.166 1.00 0.41 H new ATOM 0 HD13 LEU A 31 6.386 -9.007 -8.658 1.00 0.41 H new ATOM 0 HD21 LEU A 31 7.275 -6.068 -8.405 1.00 14.24 H new ATOM 0 HD22 LEU A 31 7.679 -7.105 -9.793 1.00 14.24 H new ATOM 0 HD23 LEU A 31 6.853 -5.550 -10.054 1.00 14.24 H new ATOM 175 N ARG A 32 2.953 -6.725 -12.817 1.00 54.24 N ATOM 176 CA ARG A 32 2.007 -7.120 -13.854 1.00 71.34 C ATOM 177 C ARG A 32 1.981 -6.097 -14.986 1.00 61.23 C ATOM 178 O ARG A 32 1.638 -6.423 -16.123 1.00 62.22 O ATOM 179 CB ARG A 32 0.605 -7.276 -13.262 1.00 72.34 C ATOM 180 CG ARG A 32 0.372 -8.622 -12.594 1.00 4.22 C ATOM 181 CD ARG A 32 0.243 -9.739 -13.617 1.00 53.55 C ATOM 182 NE ARG A 32 -0.927 -10.576 -13.369 1.00 70.31 N ATOM 183 CZ ARG A 32 -1.122 -11.756 -13.948 1.00 21.02 C ATOM 184 NH1 ARG A 32 -0.229 -12.234 -14.803 1.00 34.31 N ATOM 185 NH2 ARG A 32 -2.212 -12.460 -13.670 1.00 34.20 N ATOM 0 H ARG A 32 2.538 -6.210 -12.041 1.00 54.24 H new ATOM 0 HA ARG A 32 2.332 -8.078 -14.261 1.00 71.34 H new ATOM 0 HB2 ARG A 32 0.438 -6.484 -12.532 1.00 72.34 H new ATOM 0 HB3 ARG A 32 -0.132 -7.140 -14.054 1.00 72.34 H new ATOM 0 HG2 ARG A 32 1.198 -8.841 -11.917 1.00 4.22 H new ATOM 0 HG3 ARG A 32 -0.533 -8.576 -11.988 1.00 4.22 H new ATOM 0 HD2 ARG A 32 0.176 -9.309 -14.616 1.00 53.55 H new ATOM 0 HD3 ARG A 32 1.141 -10.356 -13.595 1.00 53.55 H new ATOM 0 HE ARG A 32 -1.633 -10.237 -12.716 1.00 70.31 H new ATOM 0 HH11 ARG A 32 0.610 -11.696 -15.018 1.00 34.31 H new ATOM 0 HH12 ARG A 32 -0.381 -13.140 -15.246 1.00 34.31 H new ATOM 0 HH21 ARG A 32 -2.901 -12.095 -13.012 1.00 34.20 H new ATOM 0 HH22 ARG A 32 -2.361 -13.366 -14.115 1.00 34.20 H new ATOM 199 N ASP A 33 2.345 -4.861 -14.667 1.00 42.42 N ATOM 200 CA ASP A 33 2.365 -3.790 -15.657 1.00 2.34 C ATOM 201 C ASP A 33 3.651 -3.832 -16.477 1.00 41.21 C ATOM 202 O ASP A 33 3.668 -3.440 -17.645 1.00 53.11 O ATOM 203 CB ASP A 33 2.228 -2.430 -14.970 1.00 42.35 C ATOM 204 CG ASP A 33 0.784 -2.069 -14.684 1.00 33.40 C ATOM 205 OD1 ASP A 33 -0.079 -2.969 -14.760 1.00 61.01 O ATOM 206 OD2 ASP A 33 0.516 -0.888 -14.382 1.00 50.22 O ATOM 0 H ASP A 33 2.630 -4.575 -13.730 1.00 42.42 H new ATOM 0 HA ASP A 33 1.521 -3.935 -16.331 1.00 2.34 H new ATOM 0 HB2 ASP A 33 2.789 -2.440 -14.035 1.00 42.35 H new ATOM 0 HB3 ASP A 33 2.674 -1.661 -15.601 1.00 42.35 H new ATOM 211 N LEU A 34 4.726 -4.309 -15.860 1.00 13.04 N ATOM 212 CA LEU A 34 6.017 -4.401 -16.532 1.00 33.30 C ATOM 213 C LEU A 34 5.901 -5.205 -17.824 1.00 3.33 C ATOM 214 O LEU A 34 6.608 -4.938 -18.796 1.00 22.21 O ATOM 215 CB LEU A 34 7.051 -5.048 -15.607 1.00 51.33 C ATOM 216 CG LEU A 34 8.342 -4.259 -15.391 1.00 24.24 C ATOM 217 CD1 LEU A 34 9.350 -5.089 -14.609 1.00 14.51 C ATOM 218 CD2 LEU A 34 8.930 -3.820 -16.724 1.00 73.34 C ATOM 0 H LEU A 34 4.729 -4.638 -14.895 1.00 13.04 H new ATOM 0 HA LEU A 34 6.343 -3.391 -16.781 1.00 33.30 H new ATOM 0 HB2 LEU A 34 6.585 -5.218 -14.636 1.00 51.33 H new ATOM 0 HB3 LEU A 34 7.310 -6.026 -16.012 1.00 51.33 H new ATOM 0 HG LEU A 34 8.107 -3.367 -14.810 1.00 24.24 H new ATOM 0 HD11 LEU A 34 10.263 -4.511 -14.465 1.00 14.51 H new ATOM 0 HD12 LEU A 34 8.930 -5.352 -13.638 1.00 14.51 H new ATOM 0 HD13 LEU A 34 9.580 -5.999 -15.163 1.00 14.51 H new ATOM 0 HD21 LEU A 34 9.849 -3.260 -16.550 1.00 73.34 H new ATOM 0 HD22 LEU A 34 9.150 -4.698 -17.331 1.00 73.34 H new ATOM 0 HD23 LEU A 34 8.213 -3.187 -17.247 1.00 73.34 H new ATOM 230 N ILE A 35 5.005 -6.185 -17.827 1.00 11.22 N ATOM 231 CA ILE A 35 4.794 -7.023 -19.000 1.00 64.51 C ATOM 232 C ILE A 35 4.073 -6.256 -20.102 1.00 60.33 C ATOM 233 O ILE A 35 4.168 -6.604 -21.279 1.00 4.40 O ATOM 234 CB ILE A 35 3.984 -8.286 -18.653 1.00 13.40 C ATOM 235 CG1 ILE A 35 4.685 -9.081 -17.551 1.00 21.53 C ATOM 236 CG2 ILE A 35 3.785 -9.147 -19.891 1.00 42.43 C ATOM 237 CD1 ILE A 35 3.942 -9.073 -16.232 1.00 50.13 C ATOM 0 H ILE A 35 4.413 -6.418 -17.030 1.00 11.22 H new ATOM 0 HA ILE A 35 5.780 -7.321 -19.355 1.00 64.51 H new ATOM 0 HB ILE A 35 3.004 -7.981 -18.287 1.00 13.40 H new ATOM 0 HG12 ILE A 35 4.810 -10.112 -17.882 1.00 21.53 H new ATOM 0 HG13 ILE A 35 5.684 -8.672 -17.398 1.00 21.53 H new ATOM 0 HG21 ILE A 35 3.211 -10.035 -19.628 1.00 42.43 H new ATOM 0 HG22 ILE A 35 3.246 -8.577 -20.648 1.00 42.43 H new ATOM 0 HG23 ILE A 35 4.756 -9.446 -20.286 1.00 42.43 H new ATOM 0 HD11 ILE A 35 4.498 -9.656 -15.498 1.00 50.13 H new ATOM 0 HD12 ILE A 35 3.840 -8.047 -15.878 1.00 50.13 H new ATOM 0 HD13 ILE A 35 2.953 -9.510 -16.369 1.00 50.13 H new ATOM 249 N GLU A 36 3.352 -5.209 -19.713 1.00 23.21 N ATOM 250 CA GLU A 36 2.614 -4.392 -20.668 1.00 43.33 C ATOM 251 C GLU A 36 3.533 -3.371 -21.334 1.00 2.12 C ATOM 252 O GLU A 36 3.295 -2.950 -22.465 1.00 73.35 O ATOM 253 CB GLU A 36 1.456 -3.674 -19.972 1.00 41.12 C ATOM 254 CG GLU A 36 0.310 -3.322 -20.905 1.00 75.02 C ATOM 255 CD GLU A 36 0.286 -1.852 -21.274 1.00 3.32 C ATOM 256 OE1 GLU A 36 1.358 -1.211 -21.222 1.00 1.22 O ATOM 257 OE2 GLU A 36 -0.801 -1.340 -21.612 1.00 52.02 O ATOM 0 H GLU A 36 3.264 -4.907 -18.743 1.00 23.21 H new ATOM 0 HA GLU A 36 2.213 -5.051 -21.438 1.00 43.33 H new ATOM 0 HB2 GLU A 36 1.078 -4.306 -19.168 1.00 41.12 H new ATOM 0 HB3 GLU A 36 1.831 -2.761 -19.510 1.00 41.12 H new ATOM 0 HG2 GLU A 36 0.390 -3.919 -21.813 1.00 75.02 H new ATOM 0 HG3 GLU A 36 -0.634 -3.589 -20.430 1.00 75.02 H new ATOM 264 N GLY A 37 4.585 -2.976 -20.622 1.00 72.31 N ATOM 265 CA GLY A 37 5.523 -2.009 -21.159 1.00 53.33 C ATOM 266 C GLY A 37 6.575 -2.649 -22.042 1.00 42.01 C ATOM 267 O GLY A 37 7.328 -1.955 -22.724 1.00 25.34 O ATOM 0 H GLY A 37 4.803 -3.309 -19.683 1.00 72.31 H new ATOM 0 HA2 GLY A 37 4.978 -1.260 -21.733 1.00 53.33 H new ATOM 0 HA3 GLY A 37 6.012 -1.487 -20.337 1.00 53.33 H new ATOM 271 N ASN A 38 6.627 -3.977 -22.029 1.00 61.24 N ATOM 272 CA ASN A 38 7.597 -4.711 -22.834 1.00 52.43 C ATOM 273 C ASN A 38 7.001 -6.019 -23.345 1.00 53.21 C ATOM 274 O ASN A 38 6.390 -6.773 -22.586 1.00 50.22 O ATOM 275 CB ASN A 38 8.858 -4.997 -22.016 1.00 1.42 C ATOM 276 CG ASN A 38 9.919 -3.929 -22.196 1.00 43.30 C ATOM 277 OD1 ASN A 38 10.385 -3.682 -23.309 1.00 11.43 O ATOM 278 ND2 ASN A 38 10.305 -3.289 -21.099 1.00 4.43 N ATOM 0 H ASN A 38 6.010 -4.566 -21.471 1.00 61.24 H new ATOM 0 HA ASN A 38 7.861 -4.093 -23.692 1.00 52.43 H new ATOM 0 HB2 ASN A 38 8.595 -5.069 -20.961 1.00 1.42 H new ATOM 0 HB3 ASN A 38 9.266 -5.964 -22.309 1.00 1.42 H new ATOM 0 HD21 ASN A 38 11.015 -2.559 -21.158 1.00 4.43 H new ATOM 0 HD22 ASN A 38 9.891 -3.527 -20.198 1.00 4.43 H new ATOM 285 N ARG A 39 7.184 -6.282 -24.634 1.00 73.35 N ATOM 286 CA ARG A 39 6.663 -7.499 -25.247 1.00 63.43 C ATOM 287 C ARG A 39 7.006 -8.722 -24.402 1.00 15.22 C ATOM 288 O ARG A 39 6.124 -9.496 -24.024 1.00 53.14 O ATOM 289 CB ARG A 39 7.230 -7.667 -26.658 1.00 53.10 C ATOM 290 CG ARG A 39 6.162 -7.780 -27.734 1.00 34.23 C ATOM 291 CD ARG A 39 5.751 -9.226 -27.963 1.00 25.02 C ATOM 292 NE ARG A 39 5.968 -9.644 -29.345 1.00 73.13 N ATOM 293 CZ ARG A 39 5.272 -9.172 -30.373 1.00 72.14 C ATOM 294 NH1 ARG A 39 4.319 -8.271 -30.175 1.00 44.42 N ATOM 295 NH2 ARG A 39 5.528 -9.601 -31.602 1.00 53.42 N ATOM 0 H ARG A 39 7.689 -5.670 -25.275 1.00 73.35 H new ATOM 0 HA ARG A 39 5.578 -7.411 -25.306 1.00 63.43 H new ATOM 0 HB2 ARG A 39 7.874 -6.818 -26.885 1.00 53.10 H new ATOM 0 HB3 ARG A 39 7.857 -8.558 -26.685 1.00 53.10 H new ATOM 0 HG2 ARG A 39 5.289 -7.194 -27.445 1.00 34.23 H new ATOM 0 HG3 ARG A 39 6.536 -7.355 -28.665 1.00 34.23 H new ATOM 0 HD2 ARG A 39 6.318 -9.874 -27.295 1.00 25.02 H new ATOM 0 HD3 ARG A 39 4.698 -9.348 -27.708 1.00 25.02 H new ATOM 0 HE ARG A 39 6.694 -10.336 -29.531 1.00 73.13 H new ATOM 0 HH11 ARG A 39 4.119 -7.939 -29.231 1.00 44.42 H new ATOM 0 HH12 ARG A 39 3.786 -7.910 -30.966 1.00 44.42 H new ATOM 0 HH21 ARG A 39 6.260 -10.294 -31.758 1.00 53.42 H new ATOM 0 HH22 ARG A 39 4.993 -9.238 -32.391 1.00 53.42 H new ATOM 309 N VAL A 40 8.291 -8.892 -24.107 1.00 15.00 N ATOM 310 CA VAL A 40 8.749 -10.020 -23.306 1.00 34.33 C ATOM 311 C VAL A 40 9.172 -9.568 -21.912 1.00 33.55 C ATOM 312 O VAL A 40 10.004 -8.674 -21.764 1.00 72.15 O ATOM 313 CB VAL A 40 9.930 -10.744 -23.979 1.00 60.32 C ATOM 314 CG1 VAL A 40 10.256 -12.033 -23.242 1.00 64.10 C ATOM 315 CG2 VAL A 40 9.619 -11.021 -25.442 1.00 63.23 C ATOM 0 H VAL A 40 9.033 -8.262 -24.411 1.00 15.00 H new ATOM 0 HA VAL A 40 7.910 -10.710 -23.222 1.00 34.33 H new ATOM 0 HB VAL A 40 10.805 -10.096 -23.933 1.00 60.32 H new ATOM 0 HG11 VAL A 40 11.093 -12.531 -23.732 1.00 64.10 H new ATOM 0 HG12 VAL A 40 10.523 -11.805 -22.210 1.00 64.10 H new ATOM 0 HG13 VAL A 40 9.386 -12.689 -23.255 1.00 64.10 H new ATOM 0 HG21 VAL A 40 10.464 -11.533 -25.903 1.00 63.23 H new ATOM 0 HG22 VAL A 40 8.731 -11.650 -25.513 1.00 63.23 H new ATOM 0 HG23 VAL A 40 9.439 -10.079 -25.960 1.00 63.23 H new ATOM 325 N MET A 41 8.593 -10.194 -20.892 1.00 74.21 N ATOM 326 CA MET A 41 8.911 -9.858 -19.510 1.00 11.25 C ATOM 327 C MET A 41 9.224 -11.114 -18.702 1.00 33.02 C ATOM 328 O MET A 41 8.433 -12.057 -18.674 1.00 73.42 O ATOM 329 CB MET A 41 7.749 -9.099 -18.866 1.00 24.41 C ATOM 330 CG MET A 41 8.193 -7.994 -17.922 1.00 11.33 C ATOM 331 SD MET A 41 9.118 -6.693 -18.761 1.00 61.21 S ATOM 332 CE MET A 41 10.483 -6.461 -17.625 1.00 20.13 C ATOM 0 H MET A 41 7.901 -10.936 -20.997 1.00 74.21 H new ATOM 0 HA MET A 41 9.795 -9.220 -19.512 1.00 11.25 H new ATOM 0 HB2 MET A 41 7.128 -8.667 -19.651 1.00 24.41 H new ATOM 0 HB3 MET A 41 7.124 -9.804 -18.318 1.00 24.41 H new ATOM 0 HG2 MET A 41 7.317 -7.559 -17.441 1.00 11.33 H new ATOM 0 HG3 MET A 41 8.811 -8.422 -17.133 1.00 11.33 H new ATOM 0 HE1 MET A 41 10.993 -5.525 -17.855 1.00 20.13 H new ATOM 0 HE2 MET A 41 10.104 -6.427 -16.603 1.00 20.13 H new ATOM 0 HE3 MET A 41 11.184 -7.290 -17.724 1.00 20.13 H new ATOM 342 N ILE A 42 10.380 -11.119 -18.048 1.00 13.15 N ATOM 343 CA ILE A 42 10.794 -12.259 -17.239 1.00 52.42 C ATOM 344 C ILE A 42 11.490 -11.803 -15.962 1.00 25.02 C ATOM 345 O ILE A 42 12.085 -10.726 -15.917 1.00 4.01 O ATOM 346 CB ILE A 42 11.740 -13.189 -18.022 1.00 30.11 C ATOM 347 CG1 ILE A 42 13.086 -12.502 -18.260 1.00 2.04 C ATOM 348 CG2 ILE A 42 11.107 -13.597 -19.344 1.00 75.10 C ATOM 349 CD1 ILE A 42 14.149 -13.429 -18.806 1.00 10.23 C ATOM 0 H ILE A 42 11.047 -10.347 -18.062 1.00 13.15 H new ATOM 0 HA ILE A 42 9.889 -12.808 -16.980 1.00 52.42 H new ATOM 0 HB ILE A 42 11.912 -14.088 -17.430 1.00 30.11 H new ATOM 0 HG12 ILE A 42 12.945 -11.675 -18.956 1.00 2.04 H new ATOM 0 HG13 ILE A 42 13.437 -12.073 -17.321 1.00 2.04 H new ATOM 0 HG21 ILE A 42 11.787 -14.254 -19.886 1.00 75.10 H new ATOM 0 HG22 ILE A 42 10.171 -14.122 -19.153 1.00 75.10 H new ATOM 0 HG23 ILE A 42 10.908 -12.708 -19.942 1.00 75.10 H new ATOM 0 HD11 ILE A 42 15.076 -12.874 -18.950 1.00 10.23 H new ATOM 0 HD12 ILE A 42 14.319 -14.243 -18.101 1.00 10.23 H new ATOM 0 HD13 ILE A 42 13.819 -13.839 -19.761 1.00 10.23 H new ATOM 361 N PHE A 43 11.413 -12.631 -14.925 1.00 43.55 N ATOM 362 CA PHE A 43 12.038 -12.313 -13.646 1.00 34.11 C ATOM 363 C PHE A 43 12.927 -13.461 -13.175 1.00 0.25 C ATOM 364 O PHE A 43 12.657 -14.627 -13.461 1.00 32.43 O ATOM 365 CB PHE A 43 10.968 -12.017 -12.593 1.00 22.52 C ATOM 366 CG PHE A 43 10.144 -10.799 -12.901 1.00 61.30 C ATOM 367 CD1 PHE A 43 9.283 -10.786 -13.986 1.00 30.31 C ATOM 368 CD2 PHE A 43 10.231 -9.669 -12.104 1.00 55.41 C ATOM 369 CE1 PHE A 43 8.524 -9.667 -14.272 1.00 45.42 C ATOM 370 CE2 PHE A 43 9.474 -8.546 -12.385 1.00 40.13 C ATOM 371 CZ PHE A 43 8.619 -8.546 -13.470 1.00 41.03 C ATOM 0 H PHE A 43 10.925 -13.526 -14.945 1.00 43.55 H new ATOM 0 HA PHE A 43 12.659 -11.428 -13.783 1.00 34.11 H new ATOM 0 HB2 PHE A 43 10.308 -12.880 -12.505 1.00 22.52 H new ATOM 0 HB3 PHE A 43 11.450 -11.884 -11.624 1.00 22.52 H new ATOM 0 HD1 PHE A 43 9.204 -11.660 -14.615 1.00 30.31 H new ATOM 0 HD2 PHE A 43 10.897 -9.665 -11.254 1.00 55.41 H new ATOM 0 HE1 PHE A 43 7.857 -9.669 -15.122 1.00 45.42 H new ATOM 0 HE2 PHE A 43 9.551 -7.671 -11.757 1.00 40.13 H new ATOM 0 HZ PHE A 43 8.026 -7.671 -13.691 1.00 41.03 H new ATOM 381 N SER A 44 13.988 -13.120 -12.451 1.00 65.01 N ATOM 382 CA SER A 44 14.921 -14.120 -11.944 1.00 42.30 C ATOM 383 C SER A 44 15.548 -13.661 -10.631 1.00 31.23 C ATOM 384 O SER A 44 15.024 -12.775 -9.955 1.00 75.32 O ATOM 385 CB SER A 44 16.016 -14.397 -12.976 1.00 42.33 C ATOM 386 OG SER A 44 16.183 -15.789 -13.182 1.00 52.15 O ATOM 0 H SER A 44 14.223 -12.159 -12.202 1.00 65.01 H new ATOM 0 HA SER A 44 14.365 -15.039 -11.760 1.00 42.30 H new ATOM 0 HB2 SER A 44 15.761 -13.915 -13.920 1.00 42.33 H new ATOM 0 HB3 SER A 44 16.956 -13.961 -12.639 1.00 42.33 H new ATOM 0 HG SER A 44 15.352 -16.256 -12.953 1.00 52.15 H new ATOM 392 N LYS A 45 16.673 -14.271 -10.275 1.00 22.44 N ATOM 393 CA LYS A 45 17.374 -13.928 -9.043 1.00 53.45 C ATOM 394 C LYS A 45 18.881 -13.865 -9.275 1.00 51.23 C ATOM 395 O LYS A 45 19.349 -13.969 -10.409 1.00 0.34 O ATOM 396 CB LYS A 45 17.057 -14.949 -7.950 1.00 21.00 C ATOM 397 CG LYS A 45 15.772 -14.655 -7.196 1.00 10.21 C ATOM 398 CD LYS A 45 15.941 -14.866 -5.701 1.00 20.14 C ATOM 399 CE LYS A 45 14.871 -15.791 -5.144 1.00 35.14 C ATOM 400 NZ LYS A 45 15.003 -15.970 -3.672 1.00 25.25 N ATOM 0 H LYS A 45 17.120 -15.006 -10.823 1.00 22.44 H new ATOM 0 HA LYS A 45 17.032 -12.944 -8.721 1.00 53.45 H new ATOM 0 HB2 LYS A 45 16.986 -15.939 -8.400 1.00 21.00 H new ATOM 0 HB3 LYS A 45 17.885 -14.979 -7.242 1.00 21.00 H new ATOM 0 HG2 LYS A 45 15.465 -13.627 -7.387 1.00 10.21 H new ATOM 0 HG3 LYS A 45 14.976 -15.300 -7.567 1.00 10.21 H new ATOM 0 HD2 LYS A 45 16.927 -15.286 -5.501 1.00 20.14 H new ATOM 0 HD3 LYS A 45 15.895 -13.905 -5.189 1.00 20.14 H new ATOM 0 HE2 LYS A 45 13.886 -15.386 -5.373 1.00 35.14 H new ATOM 0 HE3 LYS A 45 14.939 -16.762 -5.635 1.00 35.14 H new ATOM 0 HZ1 LYS A 45 14.767 -16.951 -3.419 1.00 25.25 H new ATOM 0 HZ2 LYS A 45 15.981 -15.764 -3.384 1.00 25.25 H new ATOM 0 HZ3 LYS A 45 14.354 -15.320 -3.184 1.00 25.25 H new ATOM 414 N SER A 46 19.634 -13.696 -8.193 1.00 34.13 N ATOM 415 CA SER A 46 21.087 -13.618 -8.279 1.00 4.13 C ATOM 416 C SER A 46 21.697 -15.005 -8.446 1.00 63.55 C ATOM 417 O SER A 46 22.478 -15.246 -9.369 1.00 31.35 O ATOM 418 CB SER A 46 21.657 -12.945 -7.028 1.00 63.23 C ATOM 419 OG SER A 46 22.715 -12.063 -7.361 1.00 41.10 O ATOM 0 H SER A 46 19.262 -13.611 -7.247 1.00 34.13 H new ATOM 0 HA SER A 46 21.343 -13.020 -9.154 1.00 4.13 H new ATOM 0 HB2 SER A 46 20.868 -12.394 -6.516 1.00 63.23 H new ATOM 0 HB3 SER A 46 22.017 -13.705 -6.335 1.00 63.23 H new ATOM 0 HG SER A 46 23.061 -11.644 -6.545 1.00 41.10 H new ATOM 425 N TYR A 47 21.337 -15.916 -7.549 1.00 62.22 N ATOM 426 CA TYR A 47 21.850 -17.280 -7.595 1.00 52.11 C ATOM 427 C TYR A 47 20.712 -18.293 -7.518 1.00 13.02 C ATOM 428 O TYR A 47 20.567 -19.007 -6.525 1.00 64.15 O ATOM 429 CB TYR A 47 22.835 -17.515 -6.449 1.00 65.21 C ATOM 430 CG TYR A 47 22.566 -16.659 -5.232 1.00 52.13 C ATOM 431 CD1 TYR A 47 21.470 -16.905 -4.414 1.00 43.24 C ATOM 432 CD2 TYR A 47 23.407 -15.604 -4.901 1.00 10.42 C ATOM 433 CE1 TYR A 47 21.220 -16.124 -3.302 1.00 14.21 C ATOM 434 CE2 TYR A 47 23.165 -14.818 -3.790 1.00 71.22 C ATOM 435 CZ TYR A 47 22.070 -15.082 -2.995 1.00 12.02 C ATOM 436 OH TYR A 47 21.824 -14.303 -1.888 1.00 3.44 O ATOM 0 H TYR A 47 20.691 -15.734 -6.781 1.00 62.22 H new ATOM 0 HA TYR A 47 22.368 -17.415 -8.544 1.00 52.11 H new ATOM 0 HB2 TYR A 47 22.798 -18.565 -6.159 1.00 65.21 H new ATOM 0 HB3 TYR A 47 23.846 -17.318 -6.805 1.00 65.21 H new ATOM 0 HD1 TYR A 47 20.803 -17.720 -4.651 1.00 43.24 H new ATOM 0 HD2 TYR A 47 24.265 -15.394 -5.523 1.00 10.42 H new ATOM 0 HE1 TYR A 47 20.364 -16.328 -2.677 1.00 14.21 H new ATOM 0 HE2 TYR A 47 23.829 -14.002 -3.546 1.00 71.22 H new ATOM 0 HH TYR A 47 22.517 -13.614 -1.813 1.00 3.44 H new ATOM 446 N CYS A 48 19.906 -18.349 -8.572 1.00 45.32 N ATOM 447 CA CYS A 48 18.780 -19.274 -8.627 1.00 30.25 C ATOM 448 C CYS A 48 18.610 -19.843 -10.031 1.00 70.30 C ATOM 449 O CYS A 48 18.064 -19.199 -10.927 1.00 34.21 O ATOM 450 CB CYS A 48 17.494 -18.570 -8.190 1.00 61.31 C ATOM 451 SG CYS A 48 17.539 -17.933 -6.498 1.00 62.04 S ATOM 0 H CYS A 48 20.011 -17.764 -9.401 1.00 45.32 H new ATOM 0 HA CYS A 48 18.986 -20.098 -7.944 1.00 30.25 H new ATOM 0 HB2 CYS A 48 17.295 -17.744 -8.873 1.00 61.31 H new ATOM 0 HB3 CYS A 48 16.661 -19.267 -8.282 1.00 61.31 H new ATOM 0 HG CYS A 48 18.658 -18.279 -5.934 1.00 62.04 H new ATOM 457 N PRO A 49 19.090 -21.079 -10.230 1.00 65.31 N ATOM 458 CA PRO A 49 19.006 -21.762 -11.525 1.00 33.41 C ATOM 459 C PRO A 49 17.576 -22.156 -11.880 1.00 14.34 C ATOM 460 O PRO A 49 16.677 -22.092 -11.040 1.00 24.23 O ATOM 461 CB PRO A 49 19.869 -23.010 -11.324 1.00 75.42 C ATOM 462 CG PRO A 49 19.840 -23.260 -9.856 1.00 5.33 C ATOM 463 CD PRO A 49 19.755 -21.906 -9.208 1.00 14.01 C ATOM 0 HA PRO A 49 19.338 -21.125 -12.345 1.00 33.41 H new ATOM 0 HB2 PRO A 49 19.471 -23.860 -11.878 1.00 75.42 H new ATOM 0 HB3 PRO A 49 20.887 -22.848 -11.678 1.00 75.42 H new ATOM 0 HG2 PRO A 49 18.985 -23.878 -9.582 1.00 5.33 H new ATOM 0 HG3 PRO A 49 20.735 -23.792 -9.533 1.00 5.33 H new ATOM 0 HD2 PRO A 49 19.181 -21.939 -8.282 1.00 14.01 H new ATOM 0 HD3 PRO A 49 20.742 -21.518 -8.957 1.00 14.01 H new ATOM 471 N HIS A 50 17.370 -22.562 -13.128 1.00 25.51 N ATOM 472 CA HIS A 50 16.049 -22.967 -13.594 1.00 72.20 C ATOM 473 C HIS A 50 15.225 -21.752 -14.009 1.00 74.44 C ATOM 474 O HIS A 50 14.644 -21.726 -15.094 1.00 1.21 O ATOM 475 CB HIS A 50 15.317 -23.746 -12.501 1.00 14.52 C ATOM 476 CG HIS A 50 14.372 -24.779 -13.033 1.00 32.41 C ATOM 477 ND1 HIS A 50 14.527 -26.130 -12.803 1.00 25.44 N ATOM 478 CD2 HIS A 50 13.254 -24.653 -13.786 1.00 24.30 C ATOM 479 CE1 HIS A 50 13.547 -26.790 -13.393 1.00 13.15 C ATOM 480 NE2 HIS A 50 12.761 -25.917 -13.996 1.00 75.14 N ATOM 0 H HIS A 50 18.102 -22.619 -13.836 1.00 25.51 H new ATOM 0 HA HIS A 50 16.178 -23.611 -14.464 1.00 72.20 H new ATOM 0 HB2 HIS A 50 16.051 -24.233 -11.860 1.00 14.52 H new ATOM 0 HB3 HIS A 50 14.763 -23.046 -11.876 1.00 14.52 H new ATOM 0 HD1 HIS A 50 15.281 -26.553 -12.262 1.00 25.44 H new ATOM 0 HD2 HIS A 50 12.829 -23.730 -14.153 1.00 24.30 H new ATOM 0 HE1 HIS A 50 13.412 -27.861 -13.384 1.00 13.15 H new ATOM 488 N SER A 51 15.176 -20.750 -13.138 1.00 4.33 N ATOM 489 CA SER A 51 14.419 -19.534 -13.412 1.00 70.05 C ATOM 490 C SER A 51 15.173 -18.631 -14.384 1.00 43.04 C ATOM 491 O SER A 51 14.571 -17.841 -15.112 1.00 1.54 O ATOM 492 CB SER A 51 14.136 -18.779 -12.112 1.00 63.55 C ATOM 493 OG SER A 51 14.161 -17.378 -12.320 1.00 2.52 O ATOM 0 H SER A 51 15.652 -20.756 -12.236 1.00 4.33 H new ATOM 0 HA SER A 51 13.473 -19.821 -13.870 1.00 70.05 H new ATOM 0 HB2 SER A 51 13.162 -19.074 -11.721 1.00 63.55 H new ATOM 0 HB3 SER A 51 14.877 -19.052 -11.361 1.00 63.55 H new ATOM 0 HG SER A 51 13.263 -17.067 -12.559 1.00 2.52 H new ATOM 499 N THR A 52 16.496 -18.755 -14.391 1.00 23.33 N ATOM 500 CA THR A 52 17.335 -17.951 -15.271 1.00 61.01 C ATOM 501 C THR A 52 17.451 -18.587 -16.652 1.00 52.33 C ATOM 502 O THR A 52 17.386 -17.898 -17.670 1.00 62.45 O ATOM 503 CB THR A 52 18.747 -17.763 -14.685 1.00 15.01 C ATOM 504 OG1 THR A 52 18.694 -16.890 -13.551 1.00 40.43 O ATOM 505 CG2 THR A 52 19.694 -17.190 -15.728 1.00 61.51 C ATOM 0 H THR A 52 17.010 -19.405 -13.797 1.00 23.33 H new ATOM 0 HA THR A 52 16.855 -16.977 -15.361 1.00 61.01 H new ATOM 0 HB THR A 52 19.121 -18.739 -14.375 1.00 15.01 H new ATOM 0 HG1 THR A 52 17.789 -16.524 -13.462 1.00 40.43 H new ATOM 0 HG21 THR A 52 20.685 -17.066 -15.291 1.00 61.51 H new ATOM 0 HG22 THR A 52 19.755 -17.870 -16.577 1.00 61.51 H new ATOM 0 HG23 THR A 52 19.322 -16.222 -16.064 1.00 61.51 H new ATOM 513 N ARG A 53 17.622 -19.904 -16.679 1.00 71.24 N ATOM 514 CA ARG A 53 17.747 -20.632 -17.935 1.00 62.54 C ATOM 515 C ARG A 53 16.615 -20.267 -18.892 1.00 21.44 C ATOM 516 O ARG A 53 16.830 -20.107 -20.093 1.00 74.21 O ATOM 517 CB ARG A 53 17.746 -22.141 -17.678 1.00 51.13 C ATOM 518 CG ARG A 53 16.837 -22.918 -18.616 1.00 73.03 C ATOM 519 CD ARG A 53 16.912 -24.414 -18.353 1.00 40.32 C ATOM 520 NE ARG A 53 16.958 -25.186 -19.592 1.00 11.33 N ATOM 521 CZ ARG A 53 16.761 -26.498 -19.647 1.00 22.32 C ATOM 522 NH1 ARG A 53 16.506 -27.182 -18.539 1.00 3.42 N ATOM 523 NH2 ARG A 53 16.820 -27.131 -20.812 1.00 72.11 N ATOM 0 H ARG A 53 17.677 -20.489 -15.845 1.00 71.24 H new ATOM 0 HA ARG A 53 18.694 -20.350 -18.396 1.00 62.54 H new ATOM 0 HB2 ARG A 53 18.764 -22.518 -17.777 1.00 51.13 H new ATOM 0 HB3 ARG A 53 17.436 -22.326 -16.649 1.00 51.13 H new ATOM 0 HG2 ARG A 53 15.809 -22.577 -18.493 1.00 73.03 H new ATOM 0 HG3 ARG A 53 17.119 -22.715 -19.649 1.00 73.03 H new ATOM 0 HD2 ARG A 53 17.797 -24.633 -17.756 1.00 40.32 H new ATOM 0 HD3 ARG A 53 16.047 -24.723 -17.766 1.00 40.32 H new ATOM 0 HE ARG A 53 17.152 -24.690 -20.462 1.00 11.33 H new ATOM 0 HH11 ARG A 53 16.461 -26.700 -17.641 1.00 3.42 H new ATOM 0 HH12 ARG A 53 16.355 -28.190 -18.585 1.00 3.42 H new ATOM 0 HH21 ARG A 53 17.017 -26.610 -21.666 1.00 72.11 H new ATOM 0 HH22 ARG A 53 16.669 -28.139 -20.853 1.00 72.11 H new ATOM 537 N VAL A 54 15.408 -20.138 -18.348 1.00 64.04 N ATOM 538 CA VAL A 54 14.243 -19.792 -19.152 1.00 34.01 C ATOM 539 C VAL A 54 14.506 -18.551 -19.998 1.00 0.04 C ATOM 540 O VAL A 54 13.877 -18.348 -21.036 1.00 43.24 O ATOM 541 CB VAL A 54 13.006 -19.543 -18.268 1.00 34.21 C ATOM 542 CG1 VAL A 54 13.104 -18.190 -17.580 1.00 72.43 C ATOM 543 CG2 VAL A 54 11.732 -19.639 -19.094 1.00 71.34 C ATOM 0 H VAL A 54 15.213 -20.268 -17.355 1.00 64.04 H new ATOM 0 HA VAL A 54 14.049 -20.640 -19.808 1.00 34.01 H new ATOM 0 HB VAL A 54 12.971 -20.314 -17.498 1.00 34.21 H new ATOM 0 HG11 VAL A 54 12.221 -18.032 -16.960 1.00 72.43 H new ATOM 0 HG12 VAL A 54 13.996 -18.164 -16.954 1.00 72.43 H new ATOM 0 HG13 VAL A 54 13.165 -17.403 -18.332 1.00 72.43 H new ATOM 0 HG21 VAL A 54 10.869 -19.460 -18.453 1.00 71.34 H new ATOM 0 HG22 VAL A 54 11.756 -18.892 -19.887 1.00 71.34 H new ATOM 0 HG23 VAL A 54 11.658 -20.633 -19.534 1.00 71.34 H new ATOM 553 N LYS A 55 15.442 -17.722 -19.545 1.00 74.34 N ATOM 554 CA LYS A 55 15.792 -16.501 -20.260 1.00 51.34 C ATOM 555 C LYS A 55 16.620 -16.816 -21.502 1.00 44.31 C ATOM 556 O LYS A 55 16.541 -16.110 -22.507 1.00 51.13 O ATOM 557 CB LYS A 55 16.569 -15.553 -19.343 1.00 73.51 C ATOM 558 CG LYS A 55 18.075 -15.711 -19.441 1.00 44.44 C ATOM 559 CD LYS A 55 18.791 -14.907 -18.368 1.00 22.54 C ATOM 560 CE LYS A 55 20.272 -15.247 -18.312 1.00 63.44 C ATOM 561 NZ LYS A 55 21.019 -14.665 -19.462 1.00 13.31 N ATOM 0 H LYS A 55 15.971 -17.874 -18.686 1.00 74.34 H new ATOM 0 HA LYS A 55 14.868 -16.016 -20.574 1.00 51.34 H new ATOM 0 HB2 LYS A 55 16.303 -14.525 -19.588 1.00 73.51 H new ATOM 0 HB3 LYS A 55 16.260 -15.725 -18.312 1.00 73.51 H new ATOM 0 HG2 LYS A 55 18.338 -16.764 -19.344 1.00 44.44 H new ATOM 0 HG3 LYS A 55 18.412 -15.387 -20.426 1.00 44.44 H new ATOM 0 HD2 LYS A 55 18.668 -13.842 -18.567 1.00 22.54 H new ATOM 0 HD3 LYS A 55 18.334 -15.105 -17.398 1.00 22.54 H new ATOM 0 HE2 LYS A 55 20.695 -14.875 -17.379 1.00 63.44 H new ATOM 0 HE3 LYS A 55 20.396 -16.330 -18.309 1.00 63.44 H new ATOM 0 HZ1 LYS A 55 22.025 -14.919 -19.387 1.00 13.31 H new ATOM 0 HZ2 LYS A 55 20.632 -15.039 -20.352 1.00 13.31 H new ATOM 0 HZ3 LYS A 55 20.922 -13.630 -19.451 1.00 13.31 H new ATOM 575 N GLU A 56 17.415 -17.879 -21.424 1.00 71.20 N ATOM 576 CA GLU A 56 18.257 -18.286 -22.543 1.00 22.44 C ATOM 577 C GLU A 56 17.412 -18.601 -23.774 1.00 40.23 C ATOM 578 O GLU A 56 17.913 -18.607 -24.899 1.00 54.34 O ATOM 579 CB GLU A 56 19.095 -19.508 -22.160 1.00 42.53 C ATOM 580 CG GLU A 56 20.541 -19.421 -22.620 1.00 24.23 C ATOM 581 CD GLU A 56 20.834 -20.330 -23.797 1.00 63.21 C ATOM 582 OE1 GLU A 56 20.585 -19.913 -24.946 1.00 61.34 O ATOM 583 OE2 GLU A 56 21.315 -21.460 -23.568 1.00 22.13 O ATOM 0 H GLU A 56 17.493 -18.473 -20.599 1.00 71.20 H new ATOM 0 HA GLU A 56 18.923 -17.457 -22.784 1.00 22.44 H new ATOM 0 HB2 GLU A 56 19.073 -19.628 -21.077 1.00 42.53 H new ATOM 0 HB3 GLU A 56 18.639 -20.400 -22.589 1.00 42.53 H new ATOM 0 HG2 GLU A 56 20.770 -18.391 -22.895 1.00 24.23 H new ATOM 0 HG3 GLU A 56 21.198 -19.683 -21.791 1.00 24.23 H new ATOM 590 N LEU A 57 16.128 -18.861 -23.552 1.00 51.10 N ATOM 591 CA LEU A 57 15.212 -19.177 -24.643 1.00 21.42 C ATOM 592 C LEU A 57 14.954 -17.950 -25.510 1.00 54.12 C ATOM 593 O LEU A 57 15.295 -17.930 -26.694 1.00 15.14 O ATOM 594 CB LEU A 57 13.891 -19.710 -24.086 1.00 72.41 C ATOM 595 CG LEU A 57 13.827 -21.216 -23.834 1.00 21.42 C ATOM 596 CD1 LEU A 57 15.065 -21.685 -23.084 1.00 64.43 C ATOM 597 CD2 LEU A 57 12.566 -21.575 -23.061 1.00 61.42 C ATOM 0 H LEU A 57 15.698 -18.859 -22.627 1.00 51.10 H new ATOM 0 HA LEU A 57 15.674 -19.945 -25.263 1.00 21.42 H new ATOM 0 HB2 LEU A 57 13.682 -19.196 -23.148 1.00 72.41 H new ATOM 0 HB3 LEU A 57 13.094 -19.444 -24.780 1.00 72.41 H new ATOM 0 HG LEU A 57 13.796 -21.725 -24.798 1.00 21.42 H new ATOM 0 HD11 LEU A 57 15.002 -22.760 -22.914 1.00 64.43 H new ATOM 0 HD12 LEU A 57 15.954 -21.463 -23.674 1.00 64.43 H new ATOM 0 HD13 LEU A 57 15.127 -21.169 -22.126 1.00 64.43 H new ATOM 0 HD21 LEU A 57 12.538 -22.651 -22.891 1.00 61.42 H new ATOM 0 HD22 LEU A 57 12.567 -21.056 -22.103 1.00 61.42 H new ATOM 0 HD23 LEU A 57 11.689 -21.275 -23.635 1.00 61.42 H new ATOM 609 N PHE A 58 14.353 -16.926 -24.914 1.00 32.01 N ATOM 610 CA PHE A 58 14.050 -15.693 -25.631 1.00 2.01 C ATOM 611 C PHE A 58 15.274 -15.193 -26.393 1.00 73.23 C ATOM 612 O PHE A 58 15.194 -14.880 -27.581 1.00 23.45 O ATOM 613 CB PHE A 58 13.566 -14.616 -24.657 1.00 63.43 C ATOM 614 CG PHE A 58 12.311 -14.993 -23.924 1.00 11.42 C ATOM 615 CD1 PHE A 58 11.073 -14.879 -24.537 1.00 63.12 C ATOM 616 CD2 PHE A 58 12.367 -15.459 -22.620 1.00 1.42 C ATOM 617 CE1 PHE A 58 9.916 -15.224 -23.865 1.00 71.41 C ATOM 618 CE2 PHE A 58 11.213 -15.806 -21.943 1.00 2.20 C ATOM 619 CZ PHE A 58 9.987 -15.687 -22.566 1.00 75.44 C ATOM 0 H PHE A 58 14.066 -16.926 -23.935 1.00 32.01 H new ATOM 0 HA PHE A 58 13.258 -15.905 -26.349 1.00 2.01 H new ATOM 0 HB2 PHE A 58 14.354 -14.412 -23.932 1.00 63.43 H new ATOM 0 HB3 PHE A 58 13.392 -13.691 -25.207 1.00 63.43 H new ATOM 0 HD1 PHE A 58 11.012 -14.516 -25.552 1.00 63.12 H new ATOM 0 HD2 PHE A 58 13.323 -15.552 -22.127 1.00 1.42 H new ATOM 0 HE1 PHE A 58 8.958 -15.132 -24.355 1.00 71.41 H new ATOM 0 HE2 PHE A 58 11.270 -16.170 -20.928 1.00 2.20 H new ATOM 0 HZ PHE A 58 9.084 -15.956 -22.038 1.00 75.44 H new ATOM 629 N SER A 59 16.405 -15.119 -25.700 1.00 63.20 N ATOM 630 CA SER A 59 17.645 -14.653 -26.308 1.00 64.11 C ATOM 631 C SER A 59 17.963 -15.447 -27.572 1.00 53.52 C ATOM 632 O SER A 59 18.280 -14.874 -28.615 1.00 63.52 O ATOM 633 CB SER A 59 18.803 -14.772 -25.315 1.00 31.34 C ATOM 634 OG SER A 59 19.921 -14.010 -25.739 1.00 73.52 O ATOM 0 H SER A 59 16.488 -15.376 -24.716 1.00 63.20 H new ATOM 0 HA SER A 59 17.514 -13.605 -26.580 1.00 64.11 H new ATOM 0 HB2 SER A 59 18.479 -14.431 -24.332 1.00 31.34 H new ATOM 0 HB3 SER A 59 19.091 -15.818 -25.211 1.00 31.34 H new ATOM 0 HG SER A 59 20.646 -14.102 -25.086 1.00 73.52 H new ATOM 640 N SER A 60 17.873 -16.769 -27.472 1.00 22.34 N ATOM 641 CA SER A 60 18.155 -17.643 -28.604 1.00 54.41 C ATOM 642 C SER A 60 16.991 -17.643 -29.591 1.00 73.33 C ATOM 643 O SER A 60 17.059 -18.268 -30.651 1.00 3.01 O ATOM 644 CB SER A 60 18.428 -19.068 -28.121 1.00 23.41 C ATOM 645 OG SER A 60 18.381 -19.990 -29.196 1.00 43.43 O ATOM 0 H SER A 60 17.607 -17.259 -26.618 1.00 22.34 H new ATOM 0 HA SER A 60 19.042 -17.264 -29.112 1.00 54.41 H new ATOM 0 HB2 SER A 60 19.407 -19.112 -27.643 1.00 23.41 H new ATOM 0 HB3 SER A 60 17.692 -19.347 -27.367 1.00 23.41 H new ATOM 0 HG SER A 60 18.171 -19.514 -30.026 1.00 43.43 H new ATOM 651 N LEU A 61 15.921 -16.939 -29.236 1.00 24.44 N ATOM 652 CA LEU A 61 14.741 -16.858 -30.089 1.00 34.14 C ATOM 653 C LEU A 61 14.735 -15.558 -30.887 1.00 41.13 C ATOM 654 O LEU A 61 13.738 -15.210 -31.518 1.00 50.21 O ATOM 655 CB LEU A 61 13.469 -16.957 -29.244 1.00 5.13 C ATOM 656 CG LEU A 61 12.355 -17.837 -29.810 1.00 34.13 C ATOM 657 CD1 LEU A 61 12.169 -17.574 -31.295 1.00 63.15 C ATOM 658 CD2 LEU A 61 12.658 -19.307 -29.560 1.00 73.20 C ATOM 0 H LEU A 61 15.847 -16.416 -28.363 1.00 24.44 H new ATOM 0 HA LEU A 61 14.771 -17.693 -30.789 1.00 34.14 H new ATOM 0 HB2 LEU A 61 13.740 -17.337 -28.259 1.00 5.13 H new ATOM 0 HB3 LEU A 61 13.073 -15.952 -29.100 1.00 5.13 H new ATOM 0 HG LEU A 61 11.425 -17.586 -29.299 1.00 34.13 H new ATOM 0 HD11 LEU A 61 11.372 -18.210 -31.680 1.00 63.15 H new ATOM 0 HD12 LEU A 61 11.905 -16.528 -31.449 1.00 63.15 H new ATOM 0 HD13 LEU A 61 13.097 -17.796 -31.823 1.00 63.15 H new ATOM 0 HD21 LEU A 61 11.854 -19.919 -29.970 1.00 73.20 H new ATOM 0 HD22 LEU A 61 13.598 -19.572 -30.043 1.00 73.20 H new ATOM 0 HD23 LEU A 61 12.739 -19.485 -28.488 1.00 73.20 H new ATOM 670 N GLY A 62 15.857 -14.845 -30.856 1.00 62.40 N ATOM 671 CA GLY A 62 15.961 -13.593 -31.582 1.00 61.24 C ATOM 672 C GLY A 62 14.999 -12.542 -31.064 1.00 45.24 C ATOM 673 O GLY A 62 14.800 -11.506 -31.700 1.00 10.53 O ATOM 0 H GLY A 62 16.696 -15.112 -30.341 1.00 62.40 H new ATOM 0 HA2 GLY A 62 16.981 -13.216 -31.507 1.00 61.24 H new ATOM 0 HA3 GLY A 62 15.764 -13.772 -32.639 1.00 61.24 H new ATOM 677 N VAL A 63 14.400 -12.807 -29.908 1.00 65.40 N ATOM 678 CA VAL A 63 13.454 -11.875 -29.306 1.00 22.44 C ATOM 679 C VAL A 63 14.027 -11.252 -28.038 1.00 63.23 C ATOM 680 O VAL A 63 14.276 -11.943 -27.051 1.00 24.30 O ATOM 681 CB VAL A 63 12.122 -12.571 -28.965 1.00 64.04 C ATOM 682 CG1 VAL A 63 11.188 -11.611 -28.244 1.00 63.42 C ATOM 683 CG2 VAL A 63 11.470 -13.117 -30.226 1.00 75.41 C ATOM 0 H VAL A 63 14.553 -13.660 -29.369 1.00 65.40 H new ATOM 0 HA VAL A 63 13.270 -11.092 -30.041 1.00 22.44 H new ATOM 0 HB VAL A 63 12.328 -13.408 -28.298 1.00 64.04 H new ATOM 0 HG11 VAL A 63 10.252 -12.120 -28.011 1.00 63.42 H new ATOM 0 HG12 VAL A 63 11.657 -11.272 -27.320 1.00 63.42 H new ATOM 0 HG13 VAL A 63 10.985 -10.752 -28.884 1.00 63.42 H new ATOM 0 HG21 VAL A 63 10.530 -13.605 -29.968 1.00 75.41 H new ATOM 0 HG22 VAL A 63 11.275 -12.298 -30.919 1.00 75.41 H new ATOM 0 HG23 VAL A 63 12.137 -13.839 -30.697 1.00 75.41 H new ATOM 693 N VAL A 64 14.234 -9.940 -28.073 1.00 3.32 N ATOM 694 CA VAL A 64 14.777 -9.221 -26.927 1.00 5.33 C ATOM 695 C VAL A 64 13.801 -9.235 -25.756 1.00 22.32 C ATOM 696 O VAL A 64 12.585 -9.264 -25.948 1.00 44.55 O ATOM 697 CB VAL A 64 15.110 -7.761 -27.286 1.00 12.53 C ATOM 698 CG1 VAL A 64 15.819 -7.074 -26.129 1.00 44.31 C ATOM 699 CG2 VAL A 64 15.954 -7.701 -28.550 1.00 32.33 C ATOM 0 H VAL A 64 14.034 -9.353 -28.883 1.00 3.32 H new ATOM 0 HA VAL A 64 15.694 -9.734 -26.638 1.00 5.33 H new ATOM 0 HB VAL A 64 14.176 -7.231 -27.475 1.00 12.53 H new ATOM 0 HG11 VAL A 64 16.046 -6.043 -26.402 1.00 44.31 H new ATOM 0 HG12 VAL A 64 15.174 -7.083 -25.250 1.00 44.31 H new ATOM 0 HG13 VAL A 64 16.746 -7.602 -25.905 1.00 44.31 H new ATOM 0 HG21 VAL A 64 16.179 -6.661 -28.788 1.00 32.33 H new ATOM 0 HG22 VAL A 64 16.884 -8.247 -28.393 1.00 32.33 H new ATOM 0 HG23 VAL A 64 15.404 -8.151 -29.376 1.00 32.33 H new ATOM 709 N TYR A 65 14.341 -9.215 -24.542 1.00 73.35 N ATOM 710 CA TYR A 65 13.517 -9.229 -23.339 1.00 50.14 C ATOM 711 C TYR A 65 14.199 -8.470 -22.204 1.00 61.43 C ATOM 712 O TYR A 65 15.356 -8.071 -22.318 1.00 2.14 O ATOM 713 CB TYR A 65 13.231 -10.668 -22.907 1.00 1.22 C ATOM 714 CG TYR A 65 14.479 -11.484 -22.656 1.00 10.33 C ATOM 715 CD1 TYR A 65 15.202 -12.027 -23.711 1.00 34.45 C ATOM 716 CD2 TYR A 65 14.935 -11.711 -21.364 1.00 3.33 C ATOM 717 CE1 TYR A 65 16.342 -12.774 -23.486 1.00 4.53 C ATOM 718 CE2 TYR A 65 16.075 -12.455 -21.129 1.00 31.34 C ATOM 719 CZ TYR A 65 16.775 -12.984 -22.193 1.00 61.52 C ATOM 720 OH TYR A 65 17.911 -13.727 -21.965 1.00 51.02 O ATOM 0 H TYR A 65 15.345 -9.189 -24.365 1.00 73.35 H new ATOM 0 HA TYR A 65 12.574 -8.733 -23.569 1.00 50.14 H new ATOM 0 HB2 TYR A 65 12.628 -10.653 -21.999 1.00 1.22 H new ATOM 0 HB3 TYR A 65 12.635 -11.158 -23.677 1.00 1.22 H new ATOM 0 HD1 TYR A 65 14.867 -11.862 -24.724 1.00 34.45 H new ATOM 0 HD2 TYR A 65 14.389 -11.299 -20.528 1.00 3.33 H new ATOM 0 HE1 TYR A 65 16.891 -13.191 -24.317 1.00 4.53 H new ATOM 0 HE2 TYR A 65 16.416 -12.621 -20.118 1.00 31.34 H new ATOM 0 HH TYR A 65 17.757 -14.654 -22.245 1.00 51.02 H new ATOM 730 N ASN A 66 13.471 -8.278 -21.110 1.00 10.33 N ATOM 731 CA ASN A 66 14.004 -7.568 -19.952 1.00 1.40 C ATOM 732 C ASN A 66 14.303 -8.536 -18.811 1.00 41.41 C ATOM 733 O ASN A 66 13.443 -9.320 -18.407 1.00 45.43 O ATOM 734 CB ASN A 66 13.014 -6.499 -19.484 1.00 3.14 C ATOM 735 CG ASN A 66 13.417 -5.105 -19.924 1.00 40.24 C ATOM 736 OD1 ASN A 66 13.996 -4.341 -19.152 1.00 14.21 O ATOM 737 ND2 ASN A 66 13.113 -4.769 -21.172 1.00 54.41 N ATOM 0 H ASN A 66 12.511 -8.604 -21.000 1.00 10.33 H new ATOM 0 HA ASN A 66 14.935 -7.086 -20.249 1.00 1.40 H new ATOM 0 HB2 ASN A 66 12.023 -6.729 -19.876 1.00 3.14 H new ATOM 0 HB3 ASN A 66 12.941 -6.527 -18.397 1.00 3.14 H new ATOM 0 HD21 ASN A 66 13.360 -3.845 -21.526 1.00 54.41 H new ATOM 0 HD22 ASN A 66 12.632 -5.435 -21.777 1.00 54.41 H new ATOM 744 N ILE A 67 15.526 -8.474 -18.296 1.00 30.12 N ATOM 745 CA ILE A 67 15.937 -9.343 -17.201 1.00 25.34 C ATOM 746 C ILE A 67 15.984 -8.580 -15.881 1.00 24.20 C ATOM 747 O ILE A 67 16.754 -7.631 -15.727 1.00 2.40 O ATOM 748 CB ILE A 67 17.320 -9.969 -17.467 1.00 53.35 C ATOM 749 CG1 ILE A 67 17.375 -10.550 -18.882 1.00 30.43 C ATOM 750 CG2 ILE A 67 17.622 -11.043 -16.434 1.00 62.01 C ATOM 751 CD1 ILE A 67 18.214 -9.733 -19.839 1.00 44.11 C ATOM 0 H ILE A 67 16.249 -7.831 -18.619 1.00 30.12 H new ATOM 0 HA ILE A 67 15.194 -10.137 -17.133 1.00 25.34 H new ATOM 0 HB ILE A 67 18.079 -9.191 -17.384 1.00 53.35 H new ATOM 0 HG12 ILE A 67 17.775 -11.563 -18.835 1.00 30.43 H new ATOM 0 HG13 ILE A 67 16.361 -10.626 -19.274 1.00 30.43 H new ATOM 0 HG21 ILE A 67 18.602 -11.476 -16.635 1.00 62.01 H new ATOM 0 HG22 ILE A 67 17.618 -10.601 -15.438 1.00 62.01 H new ATOM 0 HG23 ILE A 67 16.863 -11.823 -16.488 1.00 62.01 H new ATOM 0 HD11 ILE A 67 18.207 -10.204 -20.822 1.00 44.11 H new ATOM 0 HD12 ILE A 67 17.802 -8.727 -19.916 1.00 44.11 H new ATOM 0 HD13 ILE A 67 19.238 -9.678 -19.470 1.00 44.11 H new ATOM 763 N LEU A 68 15.157 -9.001 -14.931 1.00 70.12 N ATOM 764 CA LEU A 68 15.104 -8.359 -13.622 1.00 63.41 C ATOM 765 C LEU A 68 15.254 -9.387 -12.506 1.00 14.04 C ATOM 766 O LEU A 68 14.557 -10.401 -12.486 1.00 34.41 O ATOM 767 CB LEU A 68 13.788 -7.598 -13.459 1.00 32.21 C ATOM 768 CG LEU A 68 13.187 -7.014 -14.737 1.00 73.12 C ATOM 769 CD1 LEU A 68 12.037 -7.879 -15.230 1.00 41.13 C ATOM 770 CD2 LEU A 68 12.720 -5.584 -14.503 1.00 32.43 C ATOM 0 H LEU A 68 14.513 -9.785 -15.042 1.00 70.12 H new ATOM 0 HA LEU A 68 15.933 -7.655 -13.555 1.00 63.41 H new ATOM 0 HB2 LEU A 68 13.056 -8.270 -13.012 1.00 32.21 H new ATOM 0 HB3 LEU A 68 13.948 -6.784 -12.752 1.00 32.21 H new ATOM 0 HG LEU A 68 13.960 -7.001 -15.506 1.00 73.12 H new ATOM 0 HD11 LEU A 68 11.622 -7.448 -16.141 1.00 41.13 H new ATOM 0 HD12 LEU A 68 12.402 -8.885 -15.439 1.00 41.13 H new ATOM 0 HD13 LEU A 68 11.262 -7.925 -14.464 1.00 41.13 H new ATOM 0 HD21 LEU A 68 12.295 -5.185 -15.424 1.00 32.43 H new ATOM 0 HD22 LEU A 68 11.963 -5.572 -13.719 1.00 32.43 H new ATOM 0 HD23 LEU A 68 13.567 -4.970 -14.198 1.00 32.43 H new ATOM 782 N GLU A 69 16.164 -9.116 -11.576 1.00 1.10 N ATOM 783 CA GLU A 69 16.403 -10.017 -10.455 1.00 34.43 C ATOM 784 C GLU A 69 15.774 -9.473 -9.175 1.00 40.13 C ATOM 785 O GLU A 69 16.063 -8.350 -8.757 1.00 74.43 O ATOM 786 CB GLU A 69 17.905 -10.226 -10.250 1.00 21.23 C ATOM 787 CG GLU A 69 18.494 -11.316 -11.130 1.00 22.24 C ATOM 788 CD GLU A 69 18.740 -10.848 -12.551 1.00 22.21 C ATOM 789 OE1 GLU A 69 17.759 -10.718 -13.312 1.00 32.42 O ATOM 790 OE2 GLU A 69 19.915 -10.611 -12.901 1.00 42.31 O ATOM 0 H GLU A 69 16.748 -8.280 -11.577 1.00 1.10 H new ATOM 0 HA GLU A 69 15.939 -10.975 -10.688 1.00 34.43 H new ATOM 0 HB2 GLU A 69 18.424 -9.289 -10.450 1.00 21.23 H new ATOM 0 HB3 GLU A 69 18.089 -10.475 -9.205 1.00 21.23 H new ATOM 0 HG2 GLU A 69 19.433 -11.660 -10.697 1.00 22.24 H new ATOM 0 HG3 GLU A 69 17.818 -12.171 -11.145 1.00 22.24 H new ATOM 797 N LEU A 70 14.914 -10.274 -8.558 1.00 74.31 N ATOM 798 CA LEU A 70 14.242 -9.874 -7.326 1.00 45.02 C ATOM 799 C LEU A 70 15.119 -10.161 -6.111 1.00 54.50 C ATOM 800 O LEU A 70 14.723 -9.903 -4.974 1.00 24.44 O ATOM 801 CB LEU A 70 12.905 -10.604 -7.190 1.00 23.21 C ATOM 802 CG LEU A 70 12.042 -10.664 -8.450 1.00 54.42 C ATOM 803 CD1 LEU A 70 12.369 -11.906 -9.264 1.00 3.35 C ATOM 804 CD2 LEU A 70 10.565 -10.638 -8.086 1.00 13.53 C ATOM 0 H LEU A 70 14.665 -11.206 -8.890 1.00 74.31 H new ATOM 0 HA LEU A 70 14.058 -8.801 -7.373 1.00 45.02 H new ATOM 0 HB2 LEU A 70 13.103 -11.624 -6.860 1.00 23.21 H new ATOM 0 HB3 LEU A 70 12.328 -10.120 -6.402 1.00 23.21 H new ATOM 0 HG LEU A 70 12.262 -9.787 -9.059 1.00 54.42 H new ATOM 0 HD11 LEU A 70 11.744 -11.931 -10.157 1.00 3.35 H new ATOM 0 HD12 LEU A 70 13.419 -11.884 -9.556 1.00 3.35 H new ATOM 0 HD13 LEU A 70 12.179 -12.795 -8.663 1.00 3.35 H new ATOM 0 HD21 LEU A 70 9.965 -10.681 -8.995 1.00 13.53 H new ATOM 0 HD22 LEU A 70 10.331 -11.496 -7.455 1.00 13.53 H new ATOM 0 HD23 LEU A 70 10.339 -9.718 -7.546 1.00 13.53 H new ATOM 816 N ASP A 71 16.310 -10.693 -6.360 1.00 31.42 N ATOM 817 CA ASP A 71 17.244 -11.012 -5.287 1.00 35.45 C ATOM 818 C ASP A 71 18.234 -9.873 -5.070 1.00 42.11 C ATOM 819 O ASP A 71 19.040 -9.906 -4.141 1.00 62.22 O ATOM 820 CB ASP A 71 17.996 -12.306 -5.604 1.00 3.41 C ATOM 821 CG ASP A 71 18.176 -13.186 -4.383 1.00 34.04 C ATOM 822 OD1 ASP A 71 17.271 -13.197 -3.522 1.00 30.51 O ATOM 823 OD2 ASP A 71 19.220 -13.865 -4.289 1.00 41.44 O ATOM 0 H ASP A 71 16.652 -10.913 -7.296 1.00 31.42 H new ATOM 0 HA ASP A 71 16.671 -11.149 -4.370 1.00 35.45 H new ATOM 0 HB2 ASP A 71 17.453 -12.860 -6.370 1.00 3.41 H new ATOM 0 HB3 ASP A 71 18.974 -12.062 -6.019 1.00 3.41 H new ATOM 828 N GLN A 72 18.168 -8.865 -5.936 1.00 32.43 N ATOM 829 CA GLN A 72 19.060 -7.717 -5.840 1.00 51.54 C ATOM 830 C GLN A 72 18.268 -6.427 -5.644 1.00 30.42 C ATOM 831 O GLN A 72 18.795 -5.435 -5.142 1.00 14.14 O ATOM 832 CB GLN A 72 19.926 -7.610 -7.097 1.00 30.44 C ATOM 833 CG GLN A 72 19.206 -8.028 -8.369 1.00 34.12 C ATOM 834 CD GLN A 72 19.594 -7.180 -9.564 1.00 73.11 C ATOM 835 OE1 GLN A 72 18.821 -6.336 -10.018 1.00 74.32 O ATOM 836 NE2 GLN A 72 20.797 -7.400 -10.080 1.00 54.40 N ATOM 0 H GLN A 72 17.506 -8.822 -6.711 1.00 32.43 H new ATOM 0 HA GLN A 72 19.705 -7.862 -4.974 1.00 51.54 H new ATOM 0 HB2 GLN A 72 20.269 -6.581 -7.205 1.00 30.44 H new ATOM 0 HB3 GLN A 72 20.813 -8.231 -6.971 1.00 30.44 H new ATOM 0 HG2 GLN A 72 19.430 -9.073 -8.582 1.00 34.12 H new ATOM 0 HG3 GLN A 72 18.130 -7.958 -8.213 1.00 34.12 H new ATOM 0 HE21 GLN A 72 21.405 -8.110 -9.672 1.00 54.40 H new ATOM 0 HE22 GLN A 72 21.113 -6.859 -10.885 1.00 54.40 H new ATOM 845 N VAL A 73 17.001 -6.451 -6.043 1.00 52.53 N ATOM 846 CA VAL A 73 16.137 -5.284 -5.911 1.00 33.50 C ATOM 847 C VAL A 73 16.027 -4.844 -4.456 1.00 33.15 C ATOM 848 O VAL A 73 16.690 -5.397 -3.577 1.00 51.15 O ATOM 849 CB VAL A 73 14.724 -5.567 -6.458 1.00 24.03 C ATOM 850 CG1 VAL A 73 14.788 -5.943 -7.930 1.00 35.12 C ATOM 851 CG2 VAL A 73 14.049 -6.662 -5.647 1.00 30.32 C ATOM 0 H VAL A 73 16.550 -7.265 -6.460 1.00 52.53 H new ATOM 0 HA VAL A 73 16.592 -4.485 -6.496 1.00 33.50 H new ATOM 0 HB VAL A 73 14.128 -4.659 -6.366 1.00 24.03 H new ATOM 0 HG11 VAL A 73 13.782 -6.139 -8.299 1.00 35.12 H new ATOM 0 HG12 VAL A 73 15.229 -5.123 -8.496 1.00 35.12 H new ATOM 0 HG13 VAL A 73 15.400 -6.837 -8.051 1.00 35.12 H new ATOM 0 HG21 VAL A 73 13.052 -6.849 -6.047 1.00 30.32 H new ATOM 0 HG22 VAL A 73 14.641 -7.575 -5.706 1.00 30.32 H new ATOM 0 HG23 VAL A 73 13.969 -6.347 -4.606 1.00 30.32 H new ATOM 861 N ASP A 74 15.186 -3.846 -4.207 1.00 3.53 N ATOM 862 CA ASP A 74 14.988 -3.332 -2.857 1.00 1.24 C ATOM 863 C ASP A 74 13.812 -4.027 -2.177 1.00 43.32 C ATOM 864 O ASP A 74 13.873 -4.358 -0.993 1.00 1.22 O ATOM 865 CB ASP A 74 14.752 -1.821 -2.893 1.00 60.01 C ATOM 866 CG ASP A 74 15.864 -1.044 -2.216 1.00 63.11 C ATOM 867 OD1 ASP A 74 17.039 -1.245 -2.589 1.00 44.41 O ATOM 868 OD2 ASP A 74 15.560 -0.237 -1.314 1.00 4.11 O ATOM 0 H ASP A 74 14.631 -3.377 -4.922 1.00 3.53 H new ATOM 0 HA ASP A 74 15.890 -3.538 -2.281 1.00 1.24 H new ATOM 0 HB2 ASP A 74 14.664 -1.495 -3.929 1.00 60.01 H new ATOM 0 HB3 ASP A 74 13.804 -1.593 -2.405 1.00 60.01 H new ATOM 873 N ASP A 75 12.743 -4.244 -2.935 1.00 11.34 N ATOM 874 CA ASP A 75 11.551 -4.899 -2.406 1.00 63.30 C ATOM 875 C ASP A 75 11.595 -6.401 -2.671 1.00 41.32 C ATOM 876 O ASP A 75 10.559 -7.044 -2.829 1.00 52.20 O ATOM 877 CB ASP A 75 10.293 -4.295 -3.028 1.00 75.03 C ATOM 878 CG ASP A 75 10.424 -2.805 -3.273 1.00 2.24 C ATOM 879 OD1 ASP A 75 11.009 -2.112 -2.413 1.00 43.53 O ATOM 880 OD2 ASP A 75 9.944 -2.331 -4.323 1.00 44.51 O ATOM 0 H ASP A 75 12.677 -3.976 -3.917 1.00 11.34 H new ATOM 0 HA ASP A 75 11.526 -4.739 -1.328 1.00 63.30 H new ATOM 0 HB2 ASP A 75 10.081 -4.798 -3.972 1.00 75.03 H new ATOM 0 HB3 ASP A 75 9.443 -4.478 -2.371 1.00 75.03 H new ATOM 885 N GLY A 76 12.803 -6.953 -2.720 1.00 22.40 N ATOM 886 CA GLY A 76 12.960 -8.375 -2.967 1.00 51.04 C ATOM 887 C GLY A 76 12.086 -9.221 -2.063 1.00 13.40 C ATOM 888 O GLY A 76 11.787 -10.372 -2.377 1.00 75.34 O ATOM 0 H GLY A 76 13.676 -6.441 -2.593 1.00 22.40 H new ATOM 0 HA2 GLY A 76 12.715 -8.589 -4.007 1.00 51.04 H new ATOM 0 HA3 GLY A 76 14.004 -8.653 -2.821 1.00 51.04 H new ATOM 892 N ALA A 77 11.676 -8.649 -0.936 1.00 15.30 N ATOM 893 CA ALA A 77 10.830 -9.358 0.017 1.00 45.42 C ATOM 894 C ALA A 77 9.389 -9.430 -0.475 1.00 42.43 C ATOM 895 O ALA A 77 8.789 -10.504 -0.514 1.00 44.10 O ATOM 896 CB ALA A 77 10.892 -8.684 1.380 1.00 0.30 C ATOM 0 H ALA A 77 11.916 -7.697 -0.660 1.00 15.30 H new ATOM 0 HA ALA A 77 11.205 -10.377 0.110 1.00 45.42 H new ATOM 0 HB1 ALA A 77 10.256 -9.223 2.082 1.00 0.30 H new ATOM 0 HB2 ALA A 77 11.920 -8.691 1.743 1.00 0.30 H new ATOM 0 HB3 ALA A 77 10.545 -7.654 1.293 1.00 0.30 H new ATOM 902 N SER A 78 8.839 -8.279 -0.851 1.00 35.53 N ATOM 903 CA SER A 78 7.465 -8.212 -1.337 1.00 20.13 C ATOM 904 C SER A 78 7.401 -8.526 -2.828 1.00 63.54 C ATOM 905 O SER A 78 6.614 -9.367 -3.264 1.00 65.33 O ATOM 906 CB SER A 78 6.875 -6.827 -1.070 1.00 12.34 C ATOM 907 OG SER A 78 7.891 -5.840 -1.027 1.00 11.54 O ATOM 0 H SER A 78 9.323 -7.381 -0.828 1.00 35.53 H new ATOM 0 HA SER A 78 6.879 -8.958 -0.801 1.00 20.13 H new ATOM 0 HB2 SER A 78 6.155 -6.578 -1.850 1.00 12.34 H new ATOM 0 HB3 SER A 78 6.332 -6.836 -0.125 1.00 12.34 H new ATOM 0 HG SER A 78 8.305 -5.835 -0.139 1.00 11.54 H new ATOM 913 N VAL A 79 8.235 -7.843 -3.607 1.00 74.31 N ATOM 914 CA VAL A 79 8.274 -8.049 -5.050 1.00 50.31 C ATOM 915 C VAL A 79 8.348 -9.534 -5.392 1.00 0.45 C ATOM 916 O VAL A 79 7.740 -9.987 -6.361 1.00 22.41 O ATOM 917 CB VAL A 79 9.476 -7.326 -5.687 1.00 62.22 C ATOM 918 CG1 VAL A 79 10.748 -8.140 -5.502 1.00 10.54 C ATOM 919 CG2 VAL A 79 9.216 -7.058 -7.162 1.00 11.01 C ATOM 0 H VAL A 79 8.892 -7.143 -3.263 1.00 74.31 H new ATOM 0 HA VAL A 79 7.352 -7.632 -5.455 1.00 50.31 H new ATOM 0 HB VAL A 79 9.609 -6.368 -5.185 1.00 62.22 H new ATOM 0 HG11 VAL A 79 11.586 -7.614 -5.958 1.00 10.54 H new ATOM 0 HG12 VAL A 79 10.941 -8.277 -4.438 1.00 10.54 H new ATOM 0 HG13 VAL A 79 10.629 -9.114 -5.977 1.00 10.54 H new ATOM 0 HG21 VAL A 79 10.075 -6.547 -7.596 1.00 11.01 H new ATOM 0 HG22 VAL A 79 9.056 -8.003 -7.681 1.00 11.01 H new ATOM 0 HG23 VAL A 79 8.330 -6.432 -7.267 1.00 11.01 H new ATOM 929 N GLN A 80 9.097 -10.283 -4.590 1.00 10.23 N ATOM 930 CA GLN A 80 9.250 -11.716 -4.808 1.00 24.53 C ATOM 931 C GLN A 80 8.127 -12.494 -4.128 1.00 44.33 C ATOM 932 O GLN A 80 7.807 -13.614 -4.525 1.00 10.43 O ATOM 933 CB GLN A 80 10.606 -12.192 -4.282 1.00 12.53 C ATOM 934 CG GLN A 80 11.168 -13.384 -5.039 1.00 73.43 C ATOM 935 CD GLN A 80 11.961 -14.320 -4.148 1.00 72.23 C ATOM 936 OE1 GLN A 80 13.033 -13.966 -3.656 1.00 63.43 O ATOM 937 NE2 GLN A 80 11.437 -15.522 -3.935 1.00 52.32 N ATOM 0 H GLN A 80 9.607 -9.922 -3.784 1.00 10.23 H new ATOM 0 HA GLN A 80 9.198 -11.901 -5.881 1.00 24.53 H new ATOM 0 HB2 GLN A 80 11.318 -11.368 -4.338 1.00 12.53 H new ATOM 0 HB3 GLN A 80 10.506 -12.455 -3.229 1.00 12.53 H new ATOM 0 HG2 GLN A 80 10.349 -13.935 -5.501 1.00 73.43 H new ATOM 0 HG3 GLN A 80 11.808 -13.028 -5.846 1.00 73.43 H new ATOM 0 HE21 GLN A 80 10.546 -15.773 -4.363 1.00 52.32 H new ATOM 0 HE22 GLN A 80 11.926 -16.194 -3.343 1.00 52.32 H new ATOM 946 N GLU A 81 7.534 -11.892 -3.102 1.00 52.30 N ATOM 947 CA GLU A 81 6.447 -12.528 -2.368 1.00 64.30 C ATOM 948 C GLU A 81 5.202 -12.658 -3.240 1.00 65.14 C ATOM 949 O GLU A 81 4.527 -13.688 -3.231 1.00 25.42 O ATOM 950 CB GLU A 81 6.118 -11.729 -1.106 1.00 12.40 C ATOM 951 CG GLU A 81 6.526 -12.427 0.181 1.00 10.32 C ATOM 952 CD GLU A 81 5.769 -11.912 1.390 1.00 45.53 C ATOM 953 OE1 GLU A 81 5.798 -10.686 1.629 1.00 54.33 O ATOM 954 OE2 GLU A 81 5.148 -12.733 2.096 1.00 4.40 O ATOM 0 H GLU A 81 7.788 -10.965 -2.761 1.00 52.30 H new ATOM 0 HA GLU A 81 6.774 -13.528 -2.082 1.00 64.30 H new ATOM 0 HB2 GLU A 81 6.617 -10.761 -1.158 1.00 12.40 H new ATOM 0 HB3 GLU A 81 5.046 -11.534 -1.079 1.00 12.40 H new ATOM 0 HG2 GLU A 81 6.354 -13.499 0.079 1.00 10.32 H new ATOM 0 HG3 GLU A 81 7.595 -12.290 0.341 1.00 10.32 H new ATOM 961 N VAL A 82 4.903 -11.605 -3.995 1.00 65.21 N ATOM 962 CA VAL A 82 3.741 -11.601 -4.875 1.00 44.14 C ATOM 963 C VAL A 82 4.069 -12.232 -6.224 1.00 42.00 C ATOM 964 O VAL A 82 3.179 -12.693 -6.939 1.00 43.23 O ATOM 965 CB VAL A 82 3.217 -10.171 -5.104 1.00 54.34 C ATOM 966 CG1 VAL A 82 1.714 -10.184 -5.336 1.00 40.21 C ATOM 967 CG2 VAL A 82 3.574 -9.277 -3.926 1.00 21.32 C ATOM 0 H VAL A 82 5.450 -10.744 -4.014 1.00 65.21 H new ATOM 0 HA VAL A 82 2.968 -12.190 -4.381 1.00 44.14 H new ATOM 0 HB VAL A 82 3.696 -9.767 -5.996 1.00 54.34 H new ATOM 0 HG11 VAL A 82 1.362 -9.165 -5.496 1.00 40.21 H new ATOM 0 HG12 VAL A 82 1.487 -10.789 -6.214 1.00 40.21 H new ATOM 0 HG13 VAL A 82 1.215 -10.608 -4.465 1.00 40.21 H new ATOM 0 HG21 VAL A 82 3.196 -8.271 -4.105 1.00 21.32 H new ATOM 0 HG22 VAL A 82 3.125 -9.677 -3.017 1.00 21.32 H new ATOM 0 HG23 VAL A 82 4.657 -9.242 -3.811 1.00 21.32 H new ATOM 977 N LEU A 83 5.353 -12.249 -6.566 1.00 23.15 N ATOM 978 CA LEU A 83 5.801 -12.825 -7.829 1.00 74.12 C ATOM 979 C LEU A 83 5.944 -14.340 -7.717 1.00 75.13 C ATOM 980 O LEU A 83 5.434 -15.087 -8.553 1.00 14.44 O ATOM 981 CB LEU A 83 7.134 -12.206 -8.250 1.00 52.11 C ATOM 982 CG LEU A 83 7.528 -12.393 -9.716 1.00 32.21 C ATOM 983 CD1 LEU A 83 7.701 -13.870 -10.037 1.00 12.02 C ATOM 984 CD2 LEU A 83 6.489 -11.765 -10.632 1.00 13.43 C ATOM 0 H LEU A 83 6.102 -11.870 -5.986 1.00 23.15 H new ATOM 0 HA LEU A 83 5.049 -12.605 -8.587 1.00 74.12 H new ATOM 0 HB2 LEU A 83 7.099 -11.137 -8.038 1.00 52.11 H new ATOM 0 HB3 LEU A 83 7.921 -12.629 -7.626 1.00 52.11 H new ATOM 0 HG LEU A 83 8.481 -11.891 -9.883 1.00 32.21 H new ATOM 0 HD11 LEU A 83 7.981 -13.984 -11.084 1.00 12.02 H new ATOM 0 HD12 LEU A 83 8.482 -14.291 -9.404 1.00 12.02 H new ATOM 0 HD13 LEU A 83 6.763 -14.395 -9.853 1.00 12.02 H new ATOM 0 HD21 LEU A 83 6.786 -11.908 -11.671 1.00 13.43 H new ATOM 0 HD22 LEU A 83 5.522 -12.238 -10.463 1.00 13.43 H new ATOM 0 HD23 LEU A 83 6.414 -10.699 -10.420 1.00 13.43 H new ATOM 996 N THR A 84 6.639 -14.788 -6.677 1.00 31.41 N ATOM 997 CA THR A 84 6.848 -16.213 -6.455 1.00 24.12 C ATOM 998 C THR A 84 5.521 -16.962 -6.403 1.00 64.20 C ATOM 999 O THR A 84 5.462 -18.158 -6.688 1.00 2.13 O ATOM 1000 CB THR A 84 7.622 -16.471 -5.147 1.00 11.22 C ATOM 1001 OG1 THR A 84 8.980 -16.042 -5.289 1.00 24.31 O ATOM 1002 CG2 THR A 84 7.586 -17.946 -4.779 1.00 73.51 C ATOM 0 H THR A 84 7.067 -14.184 -5.975 1.00 31.41 H new ATOM 0 HA THR A 84 7.437 -16.580 -7.295 1.00 24.12 H new ATOM 0 HB THR A 84 7.144 -15.903 -4.349 1.00 11.22 H new ATOM 0 HG1 THR A 84 9.524 -16.785 -5.624 1.00 24.31 H new ATOM 0 HG21 THR A 84 8.139 -18.104 -3.853 1.00 73.51 H new ATOM 0 HG22 THR A 84 6.552 -18.262 -4.643 1.00 73.51 H new ATOM 0 HG23 THR A 84 8.042 -18.531 -5.577 1.00 73.51 H new ATOM 1010 N GLU A 85 4.460 -16.251 -6.038 1.00 0.22 N ATOM 1011 CA GLU A 85 3.134 -16.850 -5.948 1.00 72.43 C ATOM 1012 C GLU A 85 2.523 -17.029 -7.336 1.00 12.42 C ATOM 1013 O GLU A 85 1.738 -17.950 -7.566 1.00 1.20 O ATOM 1014 CB GLU A 85 2.215 -15.985 -5.083 1.00 54.34 C ATOM 1015 CG GLU A 85 0.744 -16.344 -5.208 1.00 23.24 C ATOM 1016 CD GLU A 85 0.479 -17.815 -4.950 1.00 42.01 C ATOM 1017 OE1 GLU A 85 1.189 -18.408 -4.112 1.00 63.43 O ATOM 1018 OE2 GLU A 85 -0.439 -18.372 -5.587 1.00 12.30 O ATOM 0 H GLU A 85 4.492 -15.260 -5.800 1.00 0.22 H new ATOM 0 HA GLU A 85 3.238 -17.831 -5.485 1.00 72.43 H new ATOM 0 HB2 GLU A 85 2.516 -16.081 -4.040 1.00 54.34 H new ATOM 0 HB3 GLU A 85 2.350 -14.939 -5.359 1.00 54.34 H new ATOM 0 HG2 GLU A 85 0.167 -15.745 -4.503 1.00 23.24 H new ATOM 0 HG3 GLU A 85 0.394 -16.085 -6.207 1.00 23.24 H new ATOM 1025 N ILE A 86 2.889 -16.142 -8.256 1.00 32.33 N ATOM 1026 CA ILE A 86 2.378 -16.202 -9.619 1.00 72.00 C ATOM 1027 C ILE A 86 2.596 -17.583 -10.228 1.00 23.44 C ATOM 1028 O ILE A 86 1.738 -18.099 -10.945 1.00 64.32 O ATOM 1029 CB ILE A 86 3.048 -15.146 -10.518 1.00 71.03 C ATOM 1030 CG1 ILE A 86 2.874 -13.749 -9.918 1.00 33.30 C ATOM 1031 CG2 ILE A 86 2.468 -15.201 -11.924 1.00 33.03 C ATOM 1032 CD1 ILE A 86 3.397 -12.641 -10.805 1.00 72.41 C ATOM 0 H ILE A 86 3.537 -15.374 -8.082 1.00 32.33 H new ATOM 0 HA ILE A 86 1.309 -15.996 -9.564 1.00 72.00 H new ATOM 0 HB ILE A 86 4.114 -15.365 -10.578 1.00 71.03 H new ATOM 0 HG12 ILE A 86 1.816 -13.576 -9.720 1.00 33.30 H new ATOM 0 HG13 ILE A 86 3.388 -13.708 -8.958 1.00 33.30 H new ATOM 0 HG21 ILE A 86 2.952 -14.449 -12.547 1.00 33.03 H new ATOM 0 HG22 ILE A 86 2.639 -16.190 -12.350 1.00 33.03 H new ATOM 0 HG23 ILE A 86 1.397 -15.004 -11.884 1.00 33.03 H new ATOM 0 HD11 ILE A 86 3.241 -11.679 -10.316 1.00 72.41 H new ATOM 0 HD12 ILE A 86 4.462 -12.789 -10.982 1.00 72.41 H new ATOM 0 HD13 ILE A 86 2.866 -12.655 -11.757 1.00 72.41 H new ATOM 1044 N SER A 87 3.748 -18.178 -9.935 1.00 62.23 N ATOM 1045 CA SER A 87 4.080 -19.499 -10.454 1.00 62.21 C ATOM 1046 C SER A 87 4.100 -20.534 -9.333 1.00 63.35 C ATOM 1047 O SER A 87 4.091 -21.739 -9.586 1.00 12.33 O ATOM 1048 CB SER A 87 5.437 -19.467 -11.159 1.00 64.01 C ATOM 1049 OG SER A 87 5.931 -18.142 -11.257 1.00 13.44 O ATOM 0 H SER A 87 4.467 -17.766 -9.341 1.00 62.23 H new ATOM 0 HA SER A 87 3.312 -19.783 -11.173 1.00 62.21 H new ATOM 0 HB2 SER A 87 6.149 -20.084 -10.611 1.00 64.01 H new ATOM 0 HB3 SER A 87 5.342 -19.898 -12.156 1.00 64.01 H new ATOM 0 HG SER A 87 6.648 -18.109 -11.924 1.00 13.44 H new ATOM 1055 N ASN A 88 4.129 -20.055 -8.095 1.00 3.12 N ATOM 1056 CA ASN A 88 4.152 -20.938 -6.934 1.00 51.34 C ATOM 1057 C ASN A 88 5.291 -21.947 -7.040 1.00 42.35 C ATOM 1058 O ASN A 88 5.104 -23.137 -6.791 1.00 51.32 O ATOM 1059 CB ASN A 88 2.816 -21.672 -6.799 1.00 42.02 C ATOM 1060 CG ASN A 88 2.396 -21.847 -5.353 1.00 63.50 C ATOM 1061 OD1 ASN A 88 2.800 -21.078 -4.480 1.00 65.42 O ATOM 1062 ND2 ASN A 88 1.581 -22.862 -5.093 1.00 22.40 N ATOM 0 H ASN A 88 4.137 -19.060 -7.869 1.00 3.12 H new ATOM 0 HA ASN A 88 4.314 -20.326 -6.047 1.00 51.34 H new ATOM 0 HB2 ASN A 88 2.045 -21.118 -7.334 1.00 42.02 H new ATOM 0 HB3 ASN A 88 2.893 -22.650 -7.273 1.00 42.02 H new ATOM 0 HD21 ASN A 88 1.264 -23.030 -4.138 1.00 22.40 H new ATOM 0 HD22 ASN A 88 1.272 -23.474 -5.848 1.00 22.40 H new ATOM 1069 N GLN A 89 6.472 -21.462 -7.411 1.00 40.14 N ATOM 1070 CA GLN A 89 7.642 -22.321 -7.550 1.00 55.32 C ATOM 1071 C GLN A 89 8.790 -21.823 -6.678 1.00 71.03 C ATOM 1072 O GLN A 89 8.914 -20.626 -6.421 1.00 10.22 O ATOM 1073 CB GLN A 89 8.084 -22.383 -9.013 1.00 4.41 C ATOM 1074 CG GLN A 89 7.466 -23.534 -9.788 1.00 42.53 C ATOM 1075 CD GLN A 89 6.491 -23.065 -10.850 1.00 40.34 C ATOM 1076 OE1 GLN A 89 5.365 -23.556 -10.935 1.00 74.33 O ATOM 1077 NE2 GLN A 89 6.919 -22.110 -11.667 1.00 54.21 N ATOM 0 H GLN A 89 6.644 -20.479 -7.621 1.00 40.14 H new ATOM 0 HA GLN A 89 7.368 -23.323 -7.219 1.00 55.32 H new ATOM 0 HB2 GLN A 89 7.823 -21.445 -9.503 1.00 4.41 H new ATOM 0 HB3 GLN A 89 9.170 -22.471 -9.052 1.00 4.41 H new ATOM 0 HG2 GLN A 89 8.258 -24.117 -10.259 1.00 42.53 H new ATOM 0 HG3 GLN A 89 6.950 -24.199 -9.095 1.00 42.53 H new ATOM 0 HE21 GLN A 89 7.860 -21.732 -11.560 1.00 54.21 H new ATOM 0 HE22 GLN A 89 6.307 -21.755 -12.401 1.00 54.21 H new ATOM 1086 N LYS A 90 9.629 -22.750 -6.227 1.00 73.13 N ATOM 1087 CA LYS A 90 10.768 -22.407 -5.386 1.00 10.25 C ATOM 1088 C LYS A 90 11.499 -21.184 -5.932 1.00 22.21 C ATOM 1089 O LYS A 90 11.848 -20.271 -5.184 1.00 4.44 O ATOM 1090 CB LYS A 90 11.733 -23.590 -5.289 1.00 73.51 C ATOM 1091 CG LYS A 90 12.036 -24.014 -3.862 1.00 72.34 C ATOM 1092 CD LYS A 90 13.020 -25.171 -3.822 1.00 1.23 C ATOM 1093 CE LYS A 90 13.418 -25.513 -2.394 1.00 65.55 C ATOM 1094 NZ LYS A 90 13.048 -26.910 -2.035 1.00 1.35 N ATOM 0 H LYS A 90 9.540 -23.746 -6.431 1.00 73.13 H new ATOM 0 HA LYS A 90 10.393 -22.170 -4.390 1.00 10.25 H new ATOM 0 HB2 LYS A 90 11.311 -24.438 -5.829 1.00 73.51 H new ATOM 0 HB3 LYS A 90 12.667 -23.328 -5.787 1.00 73.51 H new ATOM 0 HG2 LYS A 90 12.445 -23.168 -3.309 1.00 72.34 H new ATOM 0 HG3 LYS A 90 11.111 -24.304 -3.363 1.00 72.34 H new ATOM 0 HD2 LYS A 90 12.575 -26.046 -4.296 1.00 1.23 H new ATOM 0 HD3 LYS A 90 13.909 -24.914 -4.397 1.00 1.23 H new ATOM 0 HE2 LYS A 90 14.493 -25.380 -2.275 1.00 65.55 H new ATOM 0 HE3 LYS A 90 12.933 -24.821 -1.706 1.00 65.55 H new ATOM 0 HZ1 LYS A 90 13.336 -27.104 -1.055 1.00 1.35 H new ATOM 0 HZ2 LYS A 90 12.019 -27.030 -2.124 1.00 1.35 H new ATOM 0 HZ3 LYS A 90 13.531 -27.572 -2.675 1.00 1.35 H new ATOM 1108 N THR A 91 11.728 -21.173 -7.241 1.00 11.50 N ATOM 1109 CA THR A 91 12.417 -20.063 -7.888 1.00 35.44 C ATOM 1110 C THR A 91 11.439 -18.959 -8.274 1.00 33.41 C ATOM 1111 O THR A 91 10.259 -19.012 -7.928 1.00 73.31 O ATOM 1112 CB THR A 91 13.173 -20.528 -9.146 1.00 70.24 C ATOM 1113 OG1 THR A 91 12.608 -21.750 -9.634 1.00 60.21 O ATOM 1114 CG2 THR A 91 14.650 -20.731 -8.846 1.00 20.03 C ATOM 0 H THR A 91 11.446 -21.921 -7.875 1.00 11.50 H new ATOM 0 HA THR A 91 13.135 -19.672 -7.166 1.00 35.44 H new ATOM 0 HB THR A 91 13.076 -19.754 -9.907 1.00 70.24 H new ATOM 0 HG1 THR A 91 13.093 -22.038 -10.435 1.00 60.21 H new ATOM 0 HG21 THR A 91 15.163 -21.059 -9.750 1.00 20.03 H new ATOM 0 HG22 THR A 91 15.084 -19.792 -8.503 1.00 20.03 H new ATOM 0 HG23 THR A 91 14.763 -21.488 -8.069 1.00 20.03 H new ATOM 1122 N VAL A 92 11.938 -17.960 -8.995 1.00 53.24 N ATOM 1123 CA VAL A 92 11.107 -16.844 -9.431 1.00 74.12 C ATOM 1124 C VAL A 92 10.990 -16.807 -10.951 1.00 30.10 C ATOM 1125 O VAL A 92 11.252 -15.790 -11.594 1.00 14.01 O ATOM 1126 CB VAL A 92 11.671 -15.499 -8.938 1.00 2.51 C ATOM 1127 CG1 VAL A 92 10.554 -14.479 -8.773 1.00 34.54 C ATOM 1128 CG2 VAL A 92 12.430 -15.686 -7.633 1.00 2.54 C ATOM 0 H VAL A 92 12.913 -17.901 -9.289 1.00 53.24 H new ATOM 0 HA VAL A 92 10.119 -16.996 -8.997 1.00 74.12 H new ATOM 0 HB VAL A 92 12.368 -15.121 -9.686 1.00 2.51 H new ATOM 0 HG11 VAL A 92 10.972 -13.535 -8.424 1.00 34.54 H new ATOM 0 HG12 VAL A 92 10.058 -14.324 -9.731 1.00 34.54 H new ATOM 0 HG13 VAL A 92 9.830 -14.846 -8.045 1.00 34.54 H new ATOM 0 HG21 VAL A 92 12.822 -14.725 -7.299 1.00 2.54 H new ATOM 0 HG22 VAL A 92 11.757 -16.087 -6.875 1.00 2.54 H new ATOM 0 HG23 VAL A 92 13.256 -16.380 -7.789 1.00 2.54 H new ATOM 1138 N PRO A 93 10.585 -17.942 -11.541 1.00 42.45 N ATOM 1139 CA PRO A 93 10.423 -18.064 -12.993 1.00 33.24 C ATOM 1140 C PRO A 93 9.239 -17.256 -13.514 1.00 42.20 C ATOM 1141 O PRO A 93 8.110 -17.425 -13.057 1.00 23.24 O ATOM 1142 CB PRO A 93 10.179 -19.562 -13.197 1.00 14.41 C ATOM 1143 CG PRO A 93 9.609 -20.033 -11.904 1.00 4.54 C ATOM 1144 CD PRO A 93 10.255 -19.191 -10.836 1.00 40.14 C ATOM 0 HA PRO A 93 11.288 -17.681 -13.534 1.00 33.24 H new ATOM 0 HB2 PRO A 93 9.490 -19.742 -14.022 1.00 14.41 H new ATOM 0 HB3 PRO A 93 11.105 -20.085 -13.435 1.00 14.41 H new ATOM 0 HG2 PRO A 93 8.525 -19.917 -11.890 1.00 4.54 H new ATOM 0 HG3 PRO A 93 9.819 -21.091 -11.747 1.00 4.54 H new ATOM 0 HD2 PRO A 93 9.579 -19.014 -10.000 1.00 40.14 H new ATOM 0 HD3 PRO A 93 11.145 -19.671 -10.430 1.00 40.14 H new ATOM 1152 N ASN A 94 9.506 -16.376 -14.474 1.00 20.53 N ATOM 1153 CA ASN A 94 8.462 -15.541 -15.058 1.00 31.31 C ATOM 1154 C ASN A 94 8.574 -15.515 -16.579 1.00 2.10 C ATOM 1155 O ASN A 94 9.565 -15.036 -17.130 1.00 52.33 O ATOM 1156 CB ASN A 94 8.550 -14.117 -14.503 1.00 74.24 C ATOM 1157 CG ASN A 94 7.357 -13.760 -13.638 1.00 3.33 C ATOM 1158 OD1 ASN A 94 6.830 -12.649 -13.716 1.00 63.11 O ATOM 1159 ND2 ASN A 94 6.925 -14.702 -12.807 1.00 12.31 N ATOM 0 H ASN A 94 10.436 -16.223 -14.864 1.00 20.53 H new ATOM 0 HA ASN A 94 7.496 -15.969 -14.791 1.00 31.31 H new ATOM 0 HB2 ASN A 94 9.464 -14.014 -13.918 1.00 74.24 H new ATOM 0 HB3 ASN A 94 8.620 -13.411 -15.330 1.00 74.24 H new ATOM 0 HD21 ASN A 94 6.126 -14.519 -12.200 1.00 12.31 H new ATOM 0 HD22 ASN A 94 7.392 -15.608 -12.776 1.00 12.31 H new ATOM 1166 N ILE A 95 7.551 -16.032 -17.251 1.00 71.00 N ATOM 1167 CA ILE A 95 7.533 -16.065 -18.708 1.00 61.32 C ATOM 1168 C ILE A 95 6.196 -15.577 -19.253 1.00 0.42 C ATOM 1169 O ILE A 95 5.205 -16.307 -19.242 1.00 51.51 O ATOM 1170 CB ILE A 95 7.805 -17.485 -19.241 1.00 51.33 C ATOM 1171 CG1 ILE A 95 7.343 -18.532 -18.226 1.00 11.31 C ATOM 1172 CG2 ILE A 95 9.283 -17.659 -19.555 1.00 32.04 C ATOM 1173 CD1 ILE A 95 8.393 -18.876 -17.194 1.00 3.14 C ATOM 0 H ILE A 95 6.724 -16.434 -16.810 1.00 71.00 H new ATOM 0 HA ILE A 95 8.325 -15.399 -19.049 1.00 61.32 H new ATOM 0 HB ILE A 95 7.239 -17.626 -20.162 1.00 51.33 H new ATOM 0 HG12 ILE A 95 6.452 -18.165 -17.717 1.00 11.31 H new ATOM 0 HG13 ILE A 95 7.056 -19.440 -18.757 1.00 11.31 H new ATOM 0 HG21 ILE A 95 9.459 -18.667 -19.930 1.00 32.04 H new ATOM 0 HG22 ILE A 95 9.582 -16.933 -20.311 1.00 32.04 H new ATOM 0 HG23 ILE A 95 9.868 -17.502 -18.649 1.00 32.04 H new ATOM 0 HD11 ILE A 95 7.997 -19.624 -16.507 1.00 3.14 H new ATOM 0 HD12 ILE A 95 9.277 -19.273 -17.693 1.00 3.14 H new ATOM 0 HD13 ILE A 95 8.663 -17.979 -16.637 1.00 3.14 H new ATOM 1185 N PHE A 96 6.175 -14.337 -19.732 1.00 4.23 N ATOM 1186 CA PHE A 96 4.960 -13.750 -20.283 1.00 13.40 C ATOM 1187 C PHE A 96 5.280 -12.863 -21.483 1.00 71.23 C ATOM 1188 O PHE A 96 5.920 -11.821 -21.347 1.00 2.24 O ATOM 1189 CB PHE A 96 4.232 -12.935 -19.212 1.00 13.20 C ATOM 1190 CG PHE A 96 4.007 -13.690 -17.934 1.00 14.54 C ATOM 1191 CD1 PHE A 96 5.034 -13.853 -17.020 1.00 0.32 C ATOM 1192 CD2 PHE A 96 2.766 -14.237 -17.646 1.00 53.53 C ATOM 1193 CE1 PHE A 96 4.830 -14.548 -15.842 1.00 41.30 C ATOM 1194 CE2 PHE A 96 2.556 -14.932 -16.470 1.00 33.20 C ATOM 1195 CZ PHE A 96 3.588 -15.087 -15.567 1.00 41.42 C ATOM 0 H PHE A 96 6.987 -13.719 -19.749 1.00 4.23 H new ATOM 0 HA PHE A 96 4.313 -14.561 -20.616 1.00 13.40 H new ATOM 0 HB2 PHE A 96 4.809 -12.036 -18.997 1.00 13.20 H new ATOM 0 HB3 PHE A 96 3.269 -12.609 -19.606 1.00 13.20 H new ATOM 0 HD1 PHE A 96 6.006 -13.432 -17.230 1.00 0.32 H new ATOM 0 HD2 PHE A 96 1.954 -14.119 -18.349 1.00 53.53 H new ATOM 0 HE1 PHE A 96 5.640 -14.669 -15.138 1.00 41.30 H new ATOM 0 HE2 PHE A 96 1.585 -15.354 -16.258 1.00 33.20 H new ATOM 0 HZ PHE A 96 3.425 -15.629 -14.647 1.00 41.42 H new ATOM 1205 N VAL A 97 4.829 -13.287 -22.660 1.00 51.23 N ATOM 1206 CA VAL A 97 5.066 -12.532 -23.885 1.00 72.11 C ATOM 1207 C VAL A 97 3.755 -12.050 -24.495 1.00 50.33 C ATOM 1208 O VAL A 97 2.743 -12.747 -24.449 1.00 21.50 O ATOM 1209 CB VAL A 97 5.824 -13.377 -24.927 1.00 33.42 C ATOM 1210 CG1 VAL A 97 4.866 -14.297 -25.668 1.00 11.50 C ATOM 1211 CG2 VAL A 97 6.572 -12.477 -25.898 1.00 61.53 C ATOM 0 H VAL A 97 4.298 -14.148 -22.791 1.00 51.23 H new ATOM 0 HA VAL A 97 5.676 -11.670 -23.613 1.00 72.11 H new ATOM 0 HB VAL A 97 6.554 -13.997 -24.406 1.00 33.42 H new ATOM 0 HG11 VAL A 97 5.420 -14.886 -26.400 1.00 11.50 H new ATOM 0 HG12 VAL A 97 4.380 -14.965 -24.957 1.00 11.50 H new ATOM 0 HG13 VAL A 97 4.111 -13.700 -26.179 1.00 11.50 H new ATOM 0 HG21 VAL A 97 7.102 -13.090 -26.627 1.00 61.53 H new ATOM 0 HG22 VAL A 97 5.863 -11.830 -26.414 1.00 61.53 H new ATOM 0 HG23 VAL A 97 7.288 -11.865 -25.349 1.00 61.53 H new ATOM 1221 N ASN A 98 3.782 -10.850 -25.067 1.00 54.53 N ATOM 1222 CA ASN A 98 2.594 -10.273 -25.687 1.00 42.53 C ATOM 1223 C ASN A 98 1.455 -10.157 -24.679 1.00 42.32 C ATOM 1224 O ASN A 98 0.283 -10.296 -25.029 1.00 44.24 O ATOM 1225 CB ASN A 98 2.150 -11.124 -26.879 1.00 10.03 C ATOM 1226 CG ASN A 98 3.252 -11.301 -27.905 1.00 50.03 C ATOM 1227 OD1 ASN A 98 4.352 -11.748 -27.581 1.00 44.23 O ATOM 1228 ND2 ASN A 98 2.961 -10.949 -29.153 1.00 35.31 N ATOM 0 H ASN A 98 4.612 -10.259 -25.114 1.00 54.53 H new ATOM 0 HA ASN A 98 2.848 -9.273 -26.038 1.00 42.53 H new ATOM 0 HB2 ASN A 98 1.828 -12.103 -26.523 1.00 10.03 H new ATOM 0 HB3 ASN A 98 1.287 -10.657 -27.354 1.00 10.03 H new ATOM 0 HD21 ASN A 98 3.663 -11.045 -29.887 1.00 35.31 H new ATOM 0 HD22 ASN A 98 2.036 -10.583 -29.377 1.00 35.31 H new ATOM 1235 N LYS A 99 1.809 -9.899 -23.424 1.00 35.41 N ATOM 1236 CA LYS A 99 0.817 -9.762 -22.363 1.00 70.11 C ATOM 1237 C LYS A 99 0.099 -11.084 -22.115 1.00 21.54 C ATOM 1238 O LYS A 99 -1.007 -11.110 -21.574 1.00 62.35 O ATOM 1239 CB LYS A 99 -0.199 -8.677 -22.724 1.00 74.41 C ATOM 1240 CG LYS A 99 -0.128 -7.454 -21.826 1.00 73.34 C ATOM 1241 CD LYS A 99 -1.304 -6.520 -22.062 1.00 32.14 C ATOM 1242 CE LYS A 99 -2.510 -6.921 -21.226 1.00 53.41 C ATOM 1243 NZ LYS A 99 -3.709 -7.180 -22.070 1.00 51.33 N ATOM 0 H LYS A 99 2.774 -9.781 -23.117 1.00 35.41 H new ATOM 0 HA LYS A 99 1.337 -9.475 -21.449 1.00 70.11 H new ATOM 0 HB2 LYS A 99 -0.037 -8.369 -23.757 1.00 74.41 H new ATOM 0 HB3 LYS A 99 -1.203 -9.099 -22.671 1.00 74.41 H new ATOM 0 HG2 LYS A 99 -0.115 -7.768 -20.782 1.00 73.34 H new ATOM 0 HG3 LYS A 99 0.804 -6.920 -22.010 1.00 73.34 H new ATOM 0 HD2 LYS A 99 -1.014 -5.498 -21.817 1.00 32.14 H new ATOM 0 HD3 LYS A 99 -1.572 -6.531 -23.118 1.00 32.14 H new ATOM 0 HE2 LYS A 99 -2.271 -7.815 -20.650 1.00 53.41 H new ATOM 0 HE3 LYS A 99 -2.734 -6.131 -20.510 1.00 53.41 H new ATOM 0 HZ1 LYS A 99 -4.509 -7.450 -21.463 1.00 51.33 H new ATOM 0 HZ2 LYS A 99 -3.952 -6.319 -22.601 1.00 51.33 H new ATOM 0 HZ3 LYS A 99 -3.504 -7.951 -22.737 1.00 51.33 H new ATOM 1257 N VAL A 100 0.735 -12.182 -22.512 1.00 1.04 N ATOM 1258 CA VAL A 100 0.158 -13.509 -22.330 1.00 20.12 C ATOM 1259 C VAL A 100 1.013 -14.357 -21.396 1.00 70.21 C ATOM 1260 O VAL A 100 2.195 -14.076 -21.192 1.00 33.03 O ATOM 1261 CB VAL A 100 0.003 -14.243 -23.675 1.00 43.34 C ATOM 1262 CG1 VAL A 100 1.193 -15.157 -23.924 1.00 61.25 C ATOM 1263 CG2 VAL A 100 -1.299 -15.028 -23.706 1.00 55.13 C ATOM 0 H VAL A 100 1.650 -12.179 -22.962 1.00 1.04 H new ATOM 0 HA VAL A 100 -0.828 -13.367 -21.886 1.00 20.12 H new ATOM 0 HB VAL A 100 -0.028 -13.501 -24.473 1.00 43.34 H new ATOM 0 HG11 VAL A 100 1.066 -15.667 -24.879 1.00 61.25 H new ATOM 0 HG12 VAL A 100 2.108 -14.565 -23.948 1.00 61.25 H new ATOM 0 HG13 VAL A 100 1.259 -15.895 -23.124 1.00 61.25 H new ATOM 0 HG21 VAL A 100 -1.392 -15.540 -24.664 1.00 55.13 H new ATOM 0 HG22 VAL A 100 -1.301 -15.762 -22.900 1.00 55.13 H new ATOM 0 HG23 VAL A 100 -2.139 -14.345 -23.577 1.00 55.13 H new ATOM 1273 N HIS A 101 0.408 -15.398 -20.831 1.00 4.55 N ATOM 1274 CA HIS A 101 1.116 -16.289 -19.918 1.00 11.02 C ATOM 1275 C HIS A 101 1.638 -17.519 -20.655 1.00 54.52 C ATOM 1276 O HIS A 101 0.884 -18.212 -21.338 1.00 72.32 O ATOM 1277 CB HIS A 101 0.195 -16.718 -18.775 1.00 71.11 C ATOM 1278 CG HIS A 101 -1.145 -17.204 -19.235 1.00 5.40 C ATOM 1279 ND1 HIS A 101 -2.258 -16.392 -19.298 1.00 32.22 N ATOM 1280 CD2 HIS A 101 -1.547 -18.425 -19.659 1.00 2.44 C ATOM 1281 CE1 HIS A 101 -3.287 -17.094 -19.738 1.00 1.42 C ATOM 1282 NE2 HIS A 101 -2.882 -18.330 -19.964 1.00 73.43 N ATOM 0 H HIS A 101 -0.569 -15.645 -20.989 1.00 4.55 H new ATOM 0 HA HIS A 101 1.966 -15.746 -19.506 1.00 11.02 H new ATOM 0 HB2 HIS A 101 0.682 -17.508 -18.204 1.00 71.11 H new ATOM 0 HB3 HIS A 101 0.054 -15.876 -18.098 1.00 71.11 H new ATOM 0 HD2 HIS A 101 -0.932 -19.309 -19.742 1.00 2.44 H new ATOM 0 HE1 HIS A 101 -4.289 -16.720 -19.887 1.00 1.42 H new ATOM 0 HE2 HIS A 101 -3.467 -19.091 -20.309 1.00 73.43 H new ATOM 1290 N VAL A 102 2.933 -17.783 -20.513 1.00 54.13 N ATOM 1291 CA VAL A 102 3.556 -18.929 -21.165 1.00 35.05 C ATOM 1292 C VAL A 102 3.563 -20.146 -20.248 1.00 10.23 C ATOM 1293 O VAL A 102 3.256 -21.259 -20.672 1.00 51.11 O ATOM 1294 CB VAL A 102 5.001 -18.614 -21.594 1.00 2.12 C ATOM 1295 CG1 VAL A 102 5.574 -19.756 -22.418 1.00 3.34 C ATOM 1296 CG2 VAL A 102 5.053 -17.307 -22.370 1.00 3.50 C ATOM 0 H VAL A 102 3.571 -17.219 -19.952 1.00 54.13 H new ATOM 0 HA VAL A 102 2.962 -19.150 -22.052 1.00 35.05 H new ATOM 0 HB VAL A 102 5.612 -18.502 -20.698 1.00 2.12 H new ATOM 0 HG11 VAL A 102 6.596 -19.516 -22.712 1.00 3.34 H new ATOM 0 HG12 VAL A 102 5.573 -20.670 -21.824 1.00 3.34 H new ATOM 0 HG13 VAL A 102 4.965 -19.903 -23.310 1.00 3.34 H new ATOM 0 HG21 VAL A 102 6.082 -17.100 -22.665 1.00 3.50 H new ATOM 0 HG22 VAL A 102 4.429 -17.387 -23.260 1.00 3.50 H new ATOM 0 HG23 VAL A 102 4.686 -16.496 -21.741 1.00 3.50 H new ATOM 1306 N GLY A 103 3.915 -19.926 -18.984 1.00 64.53 N ATOM 1307 CA GLY A 103 3.956 -21.014 -18.025 1.00 22.40 C ATOM 1308 C GLY A 103 5.354 -21.265 -17.492 1.00 75.30 C ATOM 1309 O GLY A 103 5.688 -20.841 -16.387 1.00 30.20 O ATOM 0 H GLY A 103 4.172 -19.013 -18.608 1.00 64.53 H new ATOM 0 HA2 GLY A 103 3.289 -20.787 -17.194 1.00 22.40 H new ATOM 0 HA3 GLY A 103 3.581 -21.923 -18.495 1.00 22.40 H new ATOM 1313 N GLY A 104 6.171 -21.959 -18.279 1.00 74.11 N ATOM 1314 CA GLY A 104 7.528 -22.256 -17.861 1.00 43.44 C ATOM 1315 C GLY A 104 7.615 -23.516 -17.024 1.00 71.32 C ATOM 1316 O GLY A 104 6.612 -23.976 -16.477 1.00 30.22 O ATOM 0 H GLY A 104 5.917 -22.321 -19.198 1.00 74.11 H new ATOM 0 HA2 GLY A 104 8.161 -22.365 -18.742 1.00 43.44 H new ATOM 0 HA3 GLY A 104 7.920 -21.416 -17.288 1.00 43.44 H new ATOM 1320 N CYS A 105 8.815 -24.077 -16.926 1.00 31.04 N ATOM 1321 CA CYS A 105 9.029 -25.294 -16.152 1.00 20.14 C ATOM 1322 C CYS A 105 8.309 -26.478 -16.789 1.00 70.21 C ATOM 1323 O CYS A 105 8.194 -27.545 -16.186 1.00 62.11 O ATOM 1324 CB CYS A 105 8.543 -25.101 -14.714 1.00 1.40 C ATOM 1325 SG CYS A 105 9.324 -26.207 -13.516 1.00 30.04 S ATOM 0 H CYS A 105 9.655 -23.708 -17.373 1.00 31.04 H new ATOM 0 HA CYS A 105 10.098 -25.505 -16.142 1.00 20.14 H new ATOM 0 HB2 CYS A 105 8.728 -24.069 -14.415 1.00 1.40 H new ATOM 0 HB3 CYS A 105 7.464 -25.253 -14.683 1.00 1.40 H new ATOM 0 HG CYS A 105 10.616 -26.145 -13.647 1.00 30.04 H new ATOM 1331 N ASP A 106 7.824 -26.281 -18.010 1.00 12.22 N ATOM 1332 CA ASP A 106 7.114 -27.331 -18.729 1.00 64.45 C ATOM 1333 C ASP A 106 6.539 -26.800 -20.039 1.00 22.52 C ATOM 1334 O ASP A 106 6.620 -27.459 -21.076 1.00 12.01 O ATOM 1335 CB ASP A 106 5.993 -27.906 -17.862 1.00 5.31 C ATOM 1336 CG ASP A 106 5.303 -26.843 -17.031 1.00 33.02 C ATOM 1337 OD1 ASP A 106 4.528 -26.051 -17.606 1.00 52.43 O ATOM 1338 OD2 ASP A 106 5.537 -26.803 -15.804 1.00 74.31 O ATOM 0 H ASP A 106 7.910 -25.403 -18.522 1.00 12.22 H new ATOM 0 HA ASP A 106 7.826 -28.123 -18.960 1.00 64.45 H new ATOM 0 HB2 ASP A 106 5.259 -28.397 -18.501 1.00 5.31 H new ATOM 0 HB3 ASP A 106 6.403 -28.670 -17.202 1.00 5.31 H new ATOM 1343 N ARG A 107 5.957 -25.607 -19.983 1.00 4.31 N ATOM 1344 CA ARG A 107 5.367 -24.988 -21.164 1.00 34.30 C ATOM 1345 C ARG A 107 6.431 -24.275 -21.994 1.00 14.05 C ATOM 1346 O ARG A 107 6.617 -24.573 -23.174 1.00 70.32 O ATOM 1347 CB ARG A 107 4.275 -23.998 -20.754 1.00 44.34 C ATOM 1348 CG ARG A 107 2.972 -24.178 -21.517 1.00 4.34 C ATOM 1349 CD ARG A 107 3.170 -23.977 -23.011 1.00 55.51 C ATOM 1350 NE ARG A 107 1.943 -24.227 -23.763 1.00 50.02 N ATOM 1351 CZ ARG A 107 0.948 -23.352 -23.859 1.00 25.30 C ATOM 1352 NH1 ARG A 107 1.034 -22.177 -23.253 1.00 44.53 N ATOM 1353 NH2 ARG A 107 -0.137 -23.653 -24.562 1.00 43.03 N ATOM 0 H ARG A 107 5.881 -25.049 -19.132 1.00 4.31 H new ATOM 0 HA ARG A 107 4.924 -25.775 -21.774 1.00 34.30 H new ATOM 0 HB2 ARG A 107 4.080 -24.107 -19.687 1.00 44.34 H new ATOM 0 HB3 ARG A 107 4.640 -22.983 -20.909 1.00 44.34 H new ATOM 0 HG2 ARG A 107 2.576 -25.176 -21.332 1.00 4.34 H new ATOM 0 HG3 ARG A 107 2.232 -23.468 -21.148 1.00 4.34 H new ATOM 0 HD2 ARG A 107 3.509 -22.958 -23.198 1.00 55.51 H new ATOM 0 HD3 ARG A 107 3.955 -24.644 -23.366 1.00 55.51 H new ATOM 0 HE ARG A 107 1.845 -25.123 -24.241 1.00 50.02 H new ATOM 0 HH11 ARG A 107 1.866 -21.942 -22.711 1.00 44.53 H new ATOM 0 HH12 ARG A 107 0.269 -21.507 -23.328 1.00 44.53 H new ATOM 0 HH21 ARG A 107 -0.207 -24.557 -25.029 1.00 43.03 H new ATOM 0 HH22 ARG A 107 -0.900 -22.980 -24.635 1.00 43.03 H new ATOM 1367 N THR A 108 7.126 -23.330 -21.369 1.00 5.52 N ATOM 1368 CA THR A 108 8.170 -22.573 -22.049 1.00 32.00 C ATOM 1369 C THR A 108 9.343 -23.470 -22.425 1.00 53.24 C ATOM 1370 O THR A 108 10.144 -23.129 -23.296 1.00 33.12 O ATOM 1371 CB THR A 108 8.685 -21.414 -21.174 1.00 33.44 C ATOM 1372 OG1 THR A 108 7.585 -20.768 -20.521 1.00 64.23 O ATOM 1373 CG2 THR A 108 9.449 -20.402 -22.012 1.00 63.35 C ATOM 0 H THR A 108 6.985 -23.070 -20.393 1.00 5.52 H new ATOM 0 HA THR A 108 7.724 -22.164 -22.955 1.00 32.00 H new ATOM 0 HB THR A 108 9.361 -21.825 -20.425 1.00 33.44 H new ATOM 0 HG1 THR A 108 7.619 -19.805 -20.698 1.00 64.23 H new ATOM 0 HG21 THR A 108 9.803 -19.593 -21.373 1.00 63.35 H new ATOM 0 HG22 THR A 108 10.301 -20.890 -22.485 1.00 63.35 H new ATOM 0 HG23 THR A 108 8.792 -19.996 -22.781 1.00 63.35 H new ATOM 1381 N PHE A 109 9.439 -24.619 -21.765 1.00 73.30 N ATOM 1382 CA PHE A 109 10.515 -25.566 -22.032 1.00 25.05 C ATOM 1383 C PHE A 109 10.174 -26.459 -23.220 1.00 33.22 C ATOM 1384 O PHE A 109 11.015 -26.710 -24.082 1.00 61.33 O ATOM 1385 CB PHE A 109 10.784 -26.426 -20.794 1.00 44.23 C ATOM 1386 CG PHE A 109 11.721 -25.784 -19.810 1.00 60.33 C ATOM 1387 CD1 PHE A 109 12.914 -25.223 -20.234 1.00 65.53 C ATOM 1388 CD2 PHE A 109 11.406 -25.741 -18.461 1.00 63.52 C ATOM 1389 CE1 PHE A 109 13.778 -24.634 -19.330 1.00 60.14 C ATOM 1390 CE2 PHE A 109 12.266 -25.153 -17.554 1.00 12.03 C ATOM 1391 CZ PHE A 109 13.452 -24.597 -17.989 1.00 62.22 C ATOM 0 H PHE A 109 8.785 -24.917 -21.041 1.00 73.30 H new ATOM 0 HA PHE A 109 11.413 -24.997 -22.275 1.00 25.05 H new ATOM 0 HB2 PHE A 109 9.838 -26.639 -20.297 1.00 44.23 H new ATOM 0 HB3 PHE A 109 11.201 -27.383 -21.109 1.00 44.23 H new ATOM 0 HD1 PHE A 109 13.172 -25.246 -21.282 1.00 65.53 H new ATOM 0 HD2 PHE A 109 10.478 -26.172 -18.115 1.00 63.52 H new ATOM 0 HE1 PHE A 109 14.707 -24.203 -19.672 1.00 60.14 H new ATOM 0 HE2 PHE A 109 12.010 -25.128 -16.505 1.00 12.03 H new ATOM 0 HZ PHE A 109 14.124 -24.134 -17.282 1.00 62.22 H new ATOM 1401 N GLN A 110 8.933 -26.935 -23.258 1.00 3.20 N ATOM 1402 CA GLN A 110 8.480 -27.800 -24.340 1.00 34.25 C ATOM 1403 C GLN A 110 8.211 -26.995 -25.606 1.00 12.40 C ATOM 1404 O GLN A 110 8.741 -27.301 -26.674 1.00 31.21 O ATOM 1405 CB GLN A 110 7.216 -28.555 -23.923 1.00 40.42 C ATOM 1406 CG GLN A 110 7.496 -29.839 -23.160 1.00 62.23 C ATOM 1407 CD GLN A 110 8.633 -29.692 -22.169 1.00 24.42 C ATOM 1408 OE1 GLN A 110 9.803 -29.644 -22.551 1.00 63.01 O ATOM 1409 NE2 GLN A 110 8.296 -29.620 -20.886 1.00 41.04 N ATOM 0 H GLN A 110 8.224 -26.736 -22.552 1.00 3.20 H new ATOM 0 HA GLN A 110 9.272 -28.519 -24.551 1.00 34.25 H new ATOM 0 HB2 GLN A 110 6.601 -27.902 -23.304 1.00 40.42 H new ATOM 0 HB3 GLN A 110 6.634 -28.791 -24.814 1.00 40.42 H new ATOM 0 HG2 GLN A 110 6.594 -30.146 -22.630 1.00 62.23 H new ATOM 0 HG3 GLN A 110 7.736 -30.633 -23.867 1.00 62.23 H new ATOM 0 HE21 GLN A 110 7.314 -29.664 -20.613 1.00 41.04 H new ATOM 0 HE22 GLN A 110 9.019 -29.521 -20.174 1.00 41.04 H new ATOM 1418 N ALA A 111 7.385 -25.962 -25.479 1.00 53.44 N ATOM 1419 CA ALA A 111 7.047 -25.110 -26.613 1.00 73.32 C ATOM 1420 C ALA A 111 8.302 -24.649 -27.346 1.00 40.34 C ATOM 1421 O ALA A 111 8.274 -24.409 -28.555 1.00 25.14 O ATOM 1422 CB ALA A 111 6.234 -23.910 -26.149 1.00 33.22 C ATOM 0 H ALA A 111 6.937 -25.695 -24.602 1.00 53.44 H new ATOM 0 HA ALA A 111 6.445 -25.695 -27.308 1.00 73.32 H new ATOM 0 HB1 ALA A 111 5.989 -23.283 -27.006 1.00 33.22 H new ATOM 0 HB2 ALA A 111 5.314 -24.254 -25.677 1.00 33.22 H new ATOM 0 HB3 ALA A 111 6.816 -23.332 -25.431 1.00 33.22 H new ATOM 1428 N HIS A 112 9.401 -24.526 -26.609 1.00 55.41 N ATOM 1429 CA HIS A 112 10.667 -24.092 -27.190 1.00 11.12 C ATOM 1430 C HIS A 112 11.180 -25.115 -28.198 1.00 73.34 C ATOM 1431 O HIS A 112 11.648 -24.755 -29.278 1.00 44.42 O ATOM 1432 CB HIS A 112 11.708 -23.875 -26.092 1.00 24.13 C ATOM 1433 CG HIS A 112 13.074 -23.552 -26.616 1.00 32.11 C ATOM 1434 ND1 HIS A 112 13.352 -22.410 -27.335 1.00 64.14 N ATOM 1435 CD2 HIS A 112 14.241 -24.230 -26.521 1.00 24.05 C ATOM 1436 CE1 HIS A 112 14.632 -22.399 -27.661 1.00 61.34 C ATOM 1437 NE2 HIS A 112 15.195 -23.492 -27.178 1.00 75.42 N ATOM 0 H HIS A 112 9.441 -24.721 -25.609 1.00 55.41 H new ATOM 0 HA HIS A 112 10.496 -23.149 -27.710 1.00 11.12 H new ATOM 0 HB2 HIS A 112 11.376 -23.065 -25.443 1.00 24.13 H new ATOM 0 HB3 HIS A 112 11.767 -24.773 -25.476 1.00 24.13 H new ATOM 0 HD2 HIS A 112 14.394 -25.175 -26.022 1.00 24.05 H new ATOM 0 HE1 HIS A 112 15.133 -21.627 -28.226 1.00 61.34 H new ATOM 0 HE2 HIS A 112 16.178 -23.746 -27.277 1.00 75.42 H new ATOM 1445 N GLN A 113 11.088 -26.391 -27.839 1.00 62.32 N ATOM 1446 CA GLN A 113 11.545 -27.465 -28.712 1.00 71.32 C ATOM 1447 C GLN A 113 10.430 -27.914 -29.652 1.00 43.30 C ATOM 1448 O GLN A 113 10.689 -28.508 -30.698 1.00 51.31 O ATOM 1449 CB GLN A 113 12.037 -28.652 -27.883 1.00 33.32 C ATOM 1450 CG GLN A 113 10.931 -29.620 -27.488 1.00 43.43 C ATOM 1451 CD GLN A 113 11.425 -30.732 -26.585 1.00 75.43 C ATOM 1452 OE1 GLN A 113 11.446 -31.900 -26.975 1.00 5.02 O ATOM 1453 NE2 GLN A 113 11.822 -30.376 -25.369 1.00 45.42 N ATOM 0 H GLN A 113 10.701 -26.706 -26.949 1.00 62.32 H new ATOM 0 HA GLN A 113 12.371 -27.084 -29.312 1.00 71.32 H new ATOM 0 HB2 GLN A 113 12.795 -29.192 -28.451 1.00 33.32 H new ATOM 0 HB3 GLN A 113 12.521 -28.278 -26.981 1.00 33.32 H new ATOM 0 HG2 GLN A 113 10.137 -29.071 -26.982 1.00 43.43 H new ATOM 0 HG3 GLN A 113 10.495 -30.054 -28.388 1.00 43.43 H new ATOM 0 HE21 GLN A 113 11.788 -29.396 -25.088 1.00 45.42 H new ATOM 0 HE22 GLN A 113 12.161 -31.082 -24.716 1.00 45.42 H new ATOM 1462 N ASN A 114 9.191 -27.626 -29.271 1.00 15.51 N ATOM 1463 CA ASN A 114 8.036 -28.000 -30.079 1.00 51.23 C ATOM 1464 C ASN A 114 7.733 -26.930 -31.124 1.00 31.20 C ATOM 1465 O ASN A 114 7.010 -27.176 -32.089 1.00 20.43 O ATOM 1466 CB ASN A 114 6.812 -28.219 -29.187 1.00 44.15 C ATOM 1467 CG ASN A 114 6.746 -29.629 -28.632 1.00 62.24 C ATOM 1468 OD1 ASN A 114 6.210 -30.535 -29.271 1.00 42.22 O ATOM 1469 ND2 ASN A 114 7.292 -29.820 -27.437 1.00 14.44 N ATOM 0 H ASN A 114 8.960 -27.135 -28.407 1.00 15.51 H new ATOM 0 HA ASN A 114 8.272 -28.930 -30.596 1.00 51.23 H new ATOM 0 HB2 ASN A 114 6.835 -27.507 -28.362 1.00 44.15 H new ATOM 0 HB3 ASN A 114 5.907 -28.014 -29.759 1.00 44.15 H new ATOM 0 HD21 ASN A 114 7.278 -30.747 -27.012 1.00 14.44 H new ATOM 0 HD22 ASN A 114 7.725 -29.040 -26.944 1.00 14.44 H new ATOM 1476 N GLY A 115 8.292 -25.741 -30.924 1.00 63.15 N ATOM 1477 CA GLY A 115 8.072 -24.651 -31.857 1.00 73.03 C ATOM 1478 C GLY A 115 6.885 -23.791 -31.473 1.00 75.21 C ATOM 1479 O GLY A 115 6.671 -22.722 -32.045 1.00 4.53 O ATOM 0 H GLY A 115 8.893 -25.513 -30.132 1.00 63.15 H new ATOM 0 HA2 GLY A 115 8.967 -24.030 -31.903 1.00 73.03 H new ATOM 0 HA3 GLY A 115 7.914 -25.058 -32.856 1.00 73.03 H new ATOM 1483 N LEU A 116 6.107 -24.258 -30.502 1.00 14.20 N ATOM 1484 CA LEU A 116 4.933 -23.525 -30.042 1.00 41.22 C ATOM 1485 C LEU A 116 5.335 -22.207 -29.388 1.00 2.11 C ATOM 1486 O LEU A 116 4.526 -21.285 -29.274 1.00 23.21 O ATOM 1487 CB LEU A 116 4.132 -24.374 -29.054 1.00 72.33 C ATOM 1488 CG LEU A 116 2.782 -23.801 -28.616 1.00 64.24 C ATOM 1489 CD1 LEU A 116 2.968 -22.811 -27.477 1.00 32.25 C ATOM 1490 CD2 LEU A 116 2.078 -23.140 -29.791 1.00 52.41 C ATOM 0 H LEU A 116 6.268 -25.141 -30.018 1.00 14.20 H new ATOM 0 HA LEU A 116 4.311 -23.304 -30.909 1.00 41.22 H new ATOM 0 HB2 LEU A 116 3.960 -25.353 -29.503 1.00 72.33 H new ATOM 0 HB3 LEU A 116 4.742 -24.533 -28.165 1.00 72.33 H new ATOM 0 HG LEU A 116 2.158 -24.621 -28.259 1.00 64.24 H new ATOM 0 HD11 LEU A 116 1.998 -22.414 -27.178 1.00 32.25 H new ATOM 0 HD12 LEU A 116 3.430 -23.315 -26.628 1.00 32.25 H new ATOM 0 HD13 LEU A 116 3.609 -21.993 -27.807 1.00 32.25 H new ATOM 0 HD21 LEU A 116 1.120 -22.738 -29.462 1.00 52.41 H new ATOM 0 HD22 LEU A 116 2.697 -22.331 -30.178 1.00 52.41 H new ATOM 0 HD23 LEU A 116 1.912 -23.877 -30.577 1.00 52.41 H new ATOM 1502 N LEU A 117 6.590 -22.124 -28.961 1.00 43.25 N ATOM 1503 CA LEU A 117 7.102 -20.917 -28.321 1.00 41.21 C ATOM 1504 C LEU A 117 7.657 -19.944 -29.356 1.00 23.41 C ATOM 1505 O LEU A 117 7.287 -18.770 -29.380 1.00 33.45 O ATOM 1506 CB LEU A 117 8.190 -21.277 -27.307 1.00 41.01 C ATOM 1507 CG LEU A 117 8.257 -20.400 -26.055 1.00 72.52 C ATOM 1508 CD1 LEU A 117 6.960 -20.496 -25.267 1.00 32.20 C ATOM 1509 CD2 LEU A 117 9.442 -20.801 -25.188 1.00 13.41 C ATOM 0 H LEU A 117 7.272 -22.878 -29.046 1.00 43.25 H new ATOM 0 HA LEU A 117 6.275 -20.432 -27.802 1.00 41.21 H new ATOM 0 HB2 LEU A 117 8.040 -22.311 -26.995 1.00 41.01 H new ATOM 0 HB3 LEU A 117 9.156 -21.233 -27.810 1.00 41.01 H new ATOM 0 HG LEU A 117 8.393 -19.364 -26.365 1.00 72.52 H new ATOM 0 HD11 LEU A 117 7.026 -19.866 -24.380 1.00 32.20 H new ATOM 0 HD12 LEU A 117 6.130 -20.161 -25.890 1.00 32.20 H new ATOM 0 HD13 LEU A 117 6.793 -21.530 -24.966 1.00 32.20 H new ATOM 0 HD21 LEU A 117 9.475 -20.167 -24.302 1.00 13.41 H new ATOM 0 HD22 LEU A 117 9.336 -21.843 -24.886 1.00 13.41 H new ATOM 0 HD23 LEU A 117 10.365 -20.680 -25.755 1.00 13.41 H new ATOM 1521 N GLN A 118 8.547 -20.441 -30.211 1.00 55.00 N ATOM 1522 CA GLN A 118 9.150 -19.615 -31.249 1.00 44.03 C ATOM 1523 C GLN A 118 8.080 -18.965 -32.119 1.00 52.13 C ATOM 1524 O GLN A 118 8.233 -17.826 -32.564 1.00 31.41 O ATOM 1525 CB GLN A 118 10.089 -20.455 -32.117 1.00 51.34 C ATOM 1526 CG GLN A 118 9.362 -21.369 -33.090 1.00 10.12 C ATOM 1527 CD GLN A 118 10.311 -22.135 -33.991 1.00 55.12 C ATOM 1528 OE1 GLN A 118 10.936 -23.109 -33.570 1.00 43.40 O ATOM 1529 NE2 GLN A 118 10.422 -21.698 -35.241 1.00 25.33 N ATOM 0 H GLN A 118 8.865 -21.410 -30.204 1.00 55.00 H new ATOM 0 HA GLN A 118 9.724 -18.826 -30.762 1.00 44.03 H new ATOM 0 HB2 GLN A 118 10.745 -19.789 -32.678 1.00 51.34 H new ATOM 0 HB3 GLN A 118 10.725 -21.059 -31.470 1.00 51.34 H new ATOM 0 HG2 GLN A 118 8.749 -22.075 -32.530 1.00 10.12 H new ATOM 0 HG3 GLN A 118 8.684 -20.775 -33.703 1.00 10.12 H new ATOM 0 HE21 GLN A 118 9.885 -20.887 -35.547 1.00 25.33 H new ATOM 0 HE22 GLN A 118 11.044 -22.174 -35.894 1.00 25.33 H new ATOM 1538 N LYS A 119 6.996 -19.695 -32.360 1.00 51.12 N ATOM 1539 CA LYS A 119 5.899 -19.190 -33.176 1.00 51.04 C ATOM 1540 C LYS A 119 5.130 -18.098 -32.440 1.00 14.04 C ATOM 1541 O LYS A 119 4.446 -17.280 -33.057 1.00 43.14 O ATOM 1542 CB LYS A 119 4.950 -20.330 -33.554 1.00 70.04 C ATOM 1543 CG LYS A 119 4.365 -21.057 -32.356 1.00 2.40 C ATOM 1544 CD LYS A 119 2.883 -20.763 -32.195 1.00 12.32 C ATOM 1545 CE LYS A 119 2.639 -19.673 -31.162 1.00 44.51 C ATOM 1546 NZ LYS A 119 1.387 -19.909 -30.391 1.00 62.20 N ATOM 0 H LYS A 119 6.854 -20.639 -32.001 1.00 51.12 H new ATOM 0 HA LYS A 119 6.323 -18.762 -34.084 1.00 51.04 H new ATOM 0 HB2 LYS A 119 4.136 -19.929 -34.158 1.00 70.04 H new ATOM 0 HB3 LYS A 119 5.486 -21.046 -34.177 1.00 70.04 H new ATOM 0 HG2 LYS A 119 4.513 -22.131 -32.473 1.00 2.40 H new ATOM 0 HG3 LYS A 119 4.897 -20.758 -31.453 1.00 2.40 H new ATOM 0 HD2 LYS A 119 2.466 -20.457 -33.154 1.00 12.32 H new ATOM 0 HD3 LYS A 119 2.361 -21.672 -31.896 1.00 12.32 H new ATOM 0 HE2 LYS A 119 3.485 -19.627 -30.476 1.00 44.51 H new ATOM 0 HE3 LYS A 119 2.581 -18.706 -31.661 1.00 44.51 H new ATOM 0 HZ1 LYS A 119 0.991 -18.998 -30.084 1.00 62.20 H new ATOM 0 HZ2 LYS A 119 0.696 -20.401 -30.993 1.00 62.20 H new ATOM 0 HZ3 LYS A 119 1.598 -20.494 -29.557 1.00 62.20 H new ATOM 1560 N LEU A 120 5.247 -18.089 -31.116 1.00 53.52 N ATOM 1561 CA LEU A 120 4.563 -17.096 -30.295 1.00 14.44 C ATOM 1562 C LEU A 120 5.385 -15.815 -30.193 1.00 53.40 C ATOM 1563 O LEU A 120 4.899 -14.726 -30.502 1.00 35.11 O ATOM 1564 CB LEU A 120 4.297 -17.657 -28.897 1.00 32.22 C ATOM 1565 CG LEU A 120 3.940 -16.633 -27.819 1.00 31.53 C ATOM 1566 CD1 LEU A 120 2.748 -15.795 -28.254 1.00 0.33 C ATOM 1567 CD2 LEU A 120 3.651 -17.330 -26.497 1.00 0.33 C ATOM 0 H LEU A 120 5.809 -18.758 -30.589 1.00 53.52 H new ATOM 0 HA LEU A 120 3.612 -16.859 -30.772 1.00 14.44 H new ATOM 0 HB2 LEU A 120 3.484 -18.380 -28.966 1.00 32.22 H new ATOM 0 HB3 LEU A 120 5.183 -18.203 -28.572 1.00 32.22 H new ATOM 0 HG LEU A 120 4.793 -15.969 -27.678 1.00 31.53 H new ATOM 0 HD11 LEU A 120 2.508 -15.072 -27.475 1.00 0.33 H new ATOM 0 HD12 LEU A 120 2.991 -15.267 -29.176 1.00 0.33 H new ATOM 0 HD13 LEU A 120 1.889 -16.444 -28.423 1.00 0.33 H new ATOM 0 HD21 LEU A 120 3.399 -16.586 -25.741 1.00 0.33 H new ATOM 0 HD22 LEU A 120 2.814 -18.017 -26.623 1.00 0.33 H new ATOM 0 HD23 LEU A 120 4.533 -17.886 -26.179 1.00 0.33 H new ATOM 1579 N LEU A 121 6.633 -15.952 -29.758 1.00 63.13 N ATOM 1580 CA LEU A 121 7.525 -14.806 -29.618 1.00 72.10 C ATOM 1581 C LEU A 121 7.800 -14.161 -30.973 1.00 10.25 C ATOM 1582 O LEU A 121 8.203 -13.001 -31.046 1.00 43.25 O ATOM 1583 CB LEU A 121 8.841 -15.235 -28.968 1.00 30.00 C ATOM 1584 CG LEU A 121 8.725 -16.226 -27.809 1.00 31.23 C ATOM 1585 CD1 LEU A 121 10.078 -16.429 -27.144 1.00 31.53 C ATOM 1586 CD2 LEU A 121 7.698 -15.744 -26.795 1.00 73.13 C ATOM 0 H LEU A 121 7.050 -16.845 -29.496 1.00 63.13 H new ATOM 0 HA LEU A 121 7.034 -14.071 -28.979 1.00 72.10 H new ATOM 0 HB2 LEU A 121 9.475 -15.678 -29.736 1.00 30.00 H new ATOM 0 HB3 LEU A 121 9.353 -14.343 -28.607 1.00 30.00 H new ATOM 0 HG LEU A 121 8.390 -17.184 -28.207 1.00 31.23 H new ATOM 0 HD11 LEU A 121 9.977 -17.137 -26.322 1.00 31.53 H new ATOM 0 HD12 LEU A 121 10.787 -16.820 -27.874 1.00 31.53 H new ATOM 0 HD13 LEU A 121 10.441 -15.476 -26.759 1.00 31.53 H new ATOM 0 HD21 LEU A 121 7.629 -16.462 -25.978 1.00 73.13 H new ATOM 0 HD22 LEU A 121 8.003 -14.774 -26.402 1.00 73.13 H new ATOM 0 HD23 LEU A 121 6.726 -15.650 -27.278 1.00 73.13 H new