USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 808 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 972 MET CE :methyl 159:sc= -0.063 (180deg=-0.88) USER MOD Set 1.2: A 981 CYS SG : rot 144:sc= -0.0356 USER MOD Set 2.1: A 939 TYR OH : rot 180:sc= -0.362 USER MOD Set 2.2: A 971 MET CE :methyl 169:sc= -2.44 (180deg=-2.65) USER MOD Set 3.1: A 948 GLN : amide:sc= -3.23! K(o=-4.9!,f=-1.6) USER MOD Set 3.2: A 955 GLN : amide:sc= -1.7 K(o=-4.9,f=-2.1) USER MOD Set 4.1: A 915 CYS SG : rot 58:sc= -7.12! USER MOD Set 4.2: A 930 ASN : amide:sc= -5.01! C(o=-13!,f=-25!) USER MOD Set 4.3: A 932 THR OG1 : rot -160:sc= -1.37 USER MOD Set 5.1: A 909 ASN : amide:sc= -2.46! C(o=-8.8!,f=-10!) USER MOD Set 5.2: A 966 GLN : amide:sc= -1.06 K(o=-8.8,f=-12!) USER MOD Set 5.3: A 986 ASN : amide:sc= -5.3! C(o=-8.8!,f=-8!) USER MOD Set 6.1: A 907 CYS SG : rot 124:sc= 0.97 USER MOD Set 6.2: A 962 CYS SG : rot -171:sc= 1.34! USER MOD Single : A 898 ASN : amide:sc= -1.55! K(o=-1.5!,f=-0.78) USER MOD Single : A 899 ASN : amide:sc= -0.426 K(o=-0.43,f=-2.7) USER MOD Single : A 901 SER OG : rot 180:sc= -0.375 USER MOD Single : A 904 THR OG1 : rot 180:sc= -0.453 USER MOD Single : A 908 LYS NZ :NH3+ -149:sc= 1.14 (180deg=0.162) USER MOD Single : A 911 SER OG : rot -55:sc= 0.995 USER MOD Single : A 916 SER OG : rot 27:sc= 0.34 USER MOD Single : A 921 HIS : no HD1:sc= -0.115 K(o=-0.11,f=-0.68) USER MOD Single : A 931 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 936 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 944 ASN : amide:sc= -14.6! C(o=-15!,f=-11!) USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 957 ASN : amide:sc= -1.89 K(o=-1.9,f=-0.071) USER MOD Single : A 963 LYS NZ :NH3+ 147:sc= -11.1! (180deg=-13.2!) USER MOD Single : A 970 THR OG1 : rot 180:sc= 0 USER MOD Single : A 974 HIS : no HE2:sc= -2.92! C(o=-2.9!,f=-7.9!) USER MOD Single : A 975 LYS NZ :NH3+ -152:sc= -0.175 (180deg=-0.866) USER MOD Single : A 983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 997 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 998 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 999 GLN : amide:sc= -1.47! K(o=-1.5!,f=-0.93) USER MOD Single : A1000 TYR OH : rot 180:sc= 0 USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 LYS NZ :NH3+ 152:sc= -0.165 (180deg=-0.846) USER MOD Single : A1009 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 101 N ASN A 898 16.205 -8.502 -4.373 1.00 3.43 N ATOM 102 CA ASN A 898 17.125 -9.581 -4.691 1.00 10.24 C ATOM 103 C ASN A 898 17.638 -10.207 -3.392 1.00 42.32 C ATOM 104 O ASN A 898 18.834 -10.457 -3.250 1.00 70.51 O ATOM 105 CB ASN A 898 18.332 -9.063 -5.475 1.00 50.30 C ATOM 106 CG ASN A 898 18.087 -9.155 -6.982 1.00 70.15 C ATOM 107 OD1 ASN A 898 17.826 -8.172 -7.657 1.00 30.25 O ATOM 108 ND2 ASN A 898 18.185 -10.388 -7.472 1.00 2.21 N ATOM 0 HA ASN A 898 16.590 -10.313 -5.296 1.00 10.24 H new ATOM 0 HB2 ASN A 898 18.533 -8.028 -5.198 1.00 50.30 H new ATOM 0 HB3 ASN A 898 19.217 -9.641 -5.211 1.00 50.30 H new ATOM 0 HD21 ASN A 898 18.039 -10.554 -8.468 1.00 2.21 H new ATOM 0 HD22 ASN A 898 18.406 -11.167 -6.852 1.00 2.21 H new ATOM 115 N ASN A 899 16.708 -10.441 -2.478 1.00 5.01 N ATOM 116 CA ASN A 899 17.052 -11.033 -1.196 1.00 12.20 C ATOM 117 C ASN A 899 16.176 -12.264 -0.957 1.00 20.32 C ATOM 118 O ASN A 899 14.950 -12.169 -0.963 1.00 33.04 O ATOM 119 CB ASN A 899 16.806 -10.048 -0.051 1.00 72.12 C ATOM 120 CG ASN A 899 17.905 -10.153 1.008 1.00 32.11 C ATOM 121 OD1 ASN A 899 18.232 -11.222 1.497 1.00 73.10 O ATOM 122 ND2 ASN A 899 18.455 -8.987 1.334 1.00 31.02 N ATOM 0 H ASN A 899 15.717 -10.232 -2.599 1.00 5.01 H new ATOM 0 HA ASN A 899 18.108 -11.301 -1.220 1.00 12.20 H new ATOM 0 HB2 ASN A 899 16.769 -9.031 -0.443 1.00 72.12 H new ATOM 0 HB3 ASN A 899 15.836 -10.249 0.405 1.00 72.12 H new ATOM 0 HD21 ASN A 899 19.198 -8.951 2.032 1.00 31.02 H new ATOM 0 HD22 ASN A 899 18.134 -8.129 0.886 1.00 31.02 H new ATOM 129 N PRO A 900 16.858 -13.422 -0.747 1.00 34.34 N ATOM 130 CA PRO A 900 16.155 -14.671 -0.506 1.00 21.12 C ATOM 131 C PRO A 900 15.579 -14.712 0.911 1.00 25.12 C ATOM 132 O PRO A 900 14.963 -15.701 1.306 1.00 1.53 O ATOM 133 CB PRO A 900 17.187 -15.758 -0.760 1.00 33.13 C ATOM 134 CG PRO A 900 18.542 -15.074 -0.679 1.00 14.04 C ATOM 135 CD PRO A 900 18.310 -13.573 -0.733 1.00 12.24 C ATOM 0 HA PRO A 900 15.291 -14.800 -1.158 1.00 21.12 H new ATOM 0 HB2 PRO A 900 17.106 -16.554 -0.019 1.00 33.13 H new ATOM 0 HB3 PRO A 900 17.039 -16.216 -1.738 1.00 33.13 H new ATOM 0 HG2 PRO A 900 19.054 -15.348 0.244 1.00 14.04 H new ATOM 0 HG3 PRO A 900 19.180 -15.392 -1.504 1.00 14.04 H new ATOM 0 HD2 PRO A 900 18.752 -13.073 0.129 1.00 12.24 H new ATOM 0 HD3 PRO A 900 18.762 -13.134 -1.622 1.00 12.24 H new ATOM 143 N SER A 901 15.801 -13.626 1.637 1.00 20.22 N ATOM 144 CA SER A 901 15.312 -13.526 3.002 1.00 50.52 C ATOM 145 C SER A 901 13.860 -13.044 3.003 1.00 52.20 C ATOM 146 O SER A 901 13.120 -13.295 3.953 1.00 55.33 O ATOM 147 CB SER A 901 16.185 -12.582 3.831 1.00 11.14 C ATOM 148 OG SER A 901 15.980 -12.757 5.231 1.00 71.12 O ATOM 0 H SER A 901 16.313 -12.808 1.306 1.00 20.22 H new ATOM 0 HA SER A 901 15.360 -14.515 3.457 1.00 50.52 H new ATOM 0 HB2 SER A 901 17.234 -12.756 3.594 1.00 11.14 H new ATOM 0 HB3 SER A 901 15.964 -11.550 3.558 1.00 11.14 H new ATOM 0 HG SER A 901 16.556 -12.138 5.726 1.00 71.12 H new ATOM 154 N LEU A 902 13.496 -12.361 1.928 1.00 53.42 N ATOM 155 CA LEU A 902 12.145 -11.842 1.793 1.00 42.53 C ATOM 156 C LEU A 902 11.261 -12.899 1.130 1.00 73.41 C ATOM 157 O LEU A 902 10.048 -12.917 1.335 1.00 50.44 O ATOM 158 CB LEU A 902 12.158 -10.501 1.056 1.00 52.23 C ATOM 159 CG LEU A 902 13.327 -9.568 1.380 1.00 72.33 C ATOM 160 CD1 LEU A 902 13.634 -8.644 0.200 1.00 65.54 C ATOM 161 CD2 LEU A 902 13.063 -8.785 2.667 1.00 12.11 C ATOM 0 H LEU A 902 14.113 -12.155 1.142 1.00 53.42 H new ATOM 0 HA LEU A 902 11.716 -11.637 2.774 1.00 42.53 H new ATOM 0 HB2 LEU A 902 12.163 -10.698 -0.016 1.00 52.23 H new ATOM 0 HB3 LEU A 902 11.229 -9.977 1.279 1.00 52.23 H new ATOM 0 HG LEU A 902 14.214 -10.178 1.551 1.00 72.33 H new ATOM 0 HD11 LEU A 902 14.469 -7.991 0.456 1.00 65.54 H new ATOM 0 HD12 LEU A 902 13.896 -9.243 -0.672 1.00 65.54 H new ATOM 0 HD13 LEU A 902 12.756 -8.039 -0.026 1.00 65.54 H new ATOM 0 HD21 LEU A 902 13.909 -8.130 2.874 1.00 12.11 H new ATOM 0 HD22 LEU A 902 12.160 -8.186 2.550 1.00 12.11 H new ATOM 0 HD23 LEU A 902 12.931 -9.481 3.496 1.00 12.11 H new ATOM 173 N ILE A 903 11.902 -13.756 0.349 1.00 62.21 N ATOM 174 CA ILE A 903 11.189 -14.815 -0.345 1.00 51.23 C ATOM 175 C ILE A 903 11.278 -16.105 0.472 1.00 13.14 C ATOM 176 O ILE A 903 12.247 -16.318 1.199 1.00 13.25 O ATOM 177 CB ILE A 903 11.705 -14.958 -1.778 1.00 61.24 C ATOM 178 CG1 ILE A 903 13.035 -15.714 -1.809 1.00 71.30 C ATOM 179 CG2 ILE A 903 11.805 -13.594 -2.464 1.00 64.22 C ATOM 180 CD1 ILE A 903 13.907 -15.243 -2.975 1.00 31.13 C ATOM 0 H ILE A 903 12.908 -13.739 0.181 1.00 62.21 H new ATOM 0 HA ILE A 903 10.131 -14.567 -0.435 1.00 51.23 H new ATOM 0 HB ILE A 903 10.985 -15.550 -2.343 1.00 61.24 H new ATOM 0 HG12 ILE A 903 13.566 -15.562 -0.869 1.00 71.30 H new ATOM 0 HG13 ILE A 903 12.847 -16.784 -1.900 1.00 71.30 H new ATOM 0 HG21 ILE A 903 12.174 -13.725 -3.481 1.00 64.22 H new ATOM 0 HG22 ILE A 903 10.820 -13.128 -2.493 1.00 64.22 H new ATOM 0 HG23 ILE A 903 12.492 -12.956 -1.908 1.00 64.22 H new ATOM 0 HD11 ILE A 903 14.846 -15.796 -2.974 1.00 31.13 H new ATOM 0 HD12 ILE A 903 13.384 -15.419 -3.915 1.00 31.13 H new ATOM 0 HD13 ILE A 903 14.113 -14.178 -2.868 1.00 31.13 H new ATOM 192 N THR A 904 10.253 -16.932 0.326 1.00 63.21 N ATOM 193 CA THR A 904 10.203 -18.196 1.042 1.00 44.32 C ATOM 194 C THR A 904 9.589 -19.284 0.160 1.00 61.52 C ATOM 195 O THR A 904 8.910 -18.984 -0.821 1.00 21.31 O ATOM 196 CB THR A 904 9.440 -17.969 2.348 1.00 33.10 C ATOM 197 OG1 THR A 904 9.677 -16.598 2.656 1.00 61.23 O ATOM 198 CG2 THR A 904 10.056 -18.727 3.526 1.00 72.34 C ATOM 0 H THR A 904 9.451 -16.752 -0.277 1.00 63.21 H new ATOM 0 HA THR A 904 11.203 -18.550 1.291 1.00 44.32 H new ATOM 0 HB THR A 904 8.403 -18.278 2.220 1.00 33.10 H new ATOM 0 HG1 THR A 904 9.216 -16.365 3.489 1.00 61.23 H new ATOM 0 HG21 THR A 904 9.476 -18.531 4.428 1.00 72.34 H new ATOM 0 HG22 THR A 904 10.048 -19.796 3.315 1.00 72.34 H new ATOM 0 HG23 THR A 904 11.083 -18.394 3.676 1.00 72.34 H new ATOM 206 N PHE A 905 9.850 -20.526 0.540 1.00 33.54 N ATOM 207 CA PHE A 905 9.331 -21.662 -0.204 1.00 11.34 C ATOM 208 C PHE A 905 8.099 -22.252 0.485 1.00 31.13 C ATOM 209 O PHE A 905 8.042 -22.320 1.712 1.00 23.41 O ATOM 210 CB PHE A 905 10.437 -22.718 -0.237 1.00 2.02 C ATOM 211 CG PHE A 905 11.741 -22.233 -0.874 1.00 24.34 C ATOM 212 CD1 PHE A 905 11.794 -21.012 -1.471 1.00 20.45 C ATOM 213 CD2 PHE A 905 12.848 -23.023 -0.843 1.00 31.43 C ATOM 214 CE1 PHE A 905 13.004 -20.563 -2.061 1.00 43.35 C ATOM 215 CE2 PHE A 905 14.058 -22.574 -1.434 1.00 2.32 C ATOM 216 CZ PHE A 905 14.111 -21.353 -2.031 1.00 12.23 C ATOM 0 H PHE A 905 10.414 -20.771 1.354 1.00 33.54 H new ATOM 0 HA PHE A 905 9.038 -21.348 -1.206 1.00 11.34 H new ATOM 0 HB2 PHE A 905 10.642 -23.046 0.782 1.00 2.02 H new ATOM 0 HB3 PHE A 905 10.078 -23.588 -0.786 1.00 2.02 H new ATOM 0 HD1 PHE A 905 10.915 -20.384 -1.496 1.00 20.45 H new ATOM 0 HD2 PHE A 905 12.806 -23.992 -0.369 1.00 31.43 H new ATOM 0 HE1 PHE A 905 13.046 -19.593 -2.534 1.00 43.35 H new ATOM 0 HE2 PHE A 905 14.936 -23.202 -1.410 1.00 2.32 H new ATOM 0 HZ PHE A 905 15.031 -21.011 -2.481 1.00 12.23 H new ATOM 226 N LEU A 906 7.143 -22.664 -0.334 1.00 54.32 N ATOM 227 CA LEU A 906 5.915 -23.246 0.181 1.00 61.11 C ATOM 228 C LEU A 906 5.561 -24.487 -0.640 1.00 73.34 C ATOM 229 O LEU A 906 6.210 -24.823 -1.631 1.00 13.24 O ATOM 230 CB LEU A 906 4.801 -22.198 0.223 1.00 43.11 C ATOM 231 CG LEU A 906 5.249 -20.753 0.451 1.00 54.41 C ATOM 232 CD1 LEU A 906 4.175 -19.767 -0.014 1.00 42.41 C ATOM 233 CD2 LEU A 906 5.642 -20.524 1.912 1.00 63.43 C ATOM 0 H LEU A 906 7.194 -22.606 -1.351 1.00 54.32 H new ATOM 0 HA LEU A 906 6.052 -23.573 1.212 1.00 61.11 H new ATOM 0 HB2 LEU A 906 4.251 -22.243 -0.717 1.00 43.11 H new ATOM 0 HB3 LEU A 906 4.103 -22.470 1.014 1.00 43.11 H new ATOM 0 HG LEU A 906 6.138 -20.572 -0.154 1.00 54.41 H new ATOM 0 HD11 LEU A 906 4.518 -18.747 0.159 1.00 42.41 H new ATOM 0 HD12 LEU A 906 3.985 -19.911 -1.078 1.00 42.41 H new ATOM 0 HD13 LEU A 906 3.255 -19.940 0.545 1.00 42.41 H new ATOM 0 HD21 LEU A 906 5.956 -19.489 2.046 1.00 63.43 H new ATOM 0 HD22 LEU A 906 4.787 -20.730 2.555 1.00 63.43 H new ATOM 0 HD23 LEU A 906 6.463 -21.190 2.176 1.00 63.43 H new ATOM 245 N CYS A 907 4.506 -25.168 -0.203 1.00 72.11 N ATOM 246 CA CYS A 907 4.041 -26.375 -0.876 1.00 42.33 C ATOM 247 C CYS A 907 3.005 -26.038 -1.945 1.00 45.30 C ATOM 248 O CYS A 907 1.976 -25.448 -1.621 1.00 2.53 O ATOM 249 CB CYS A 907 3.444 -27.352 0.138 1.00 60.14 C ATOM 250 SG CYS A 907 2.848 -28.910 -0.595 1.00 30.54 S ATOM 0 H CYS A 907 3.957 -24.904 0.615 1.00 72.11 H new ATOM 0 HA CYS A 907 4.898 -26.843 -1.361 1.00 42.33 H new ATOM 0 HB2 CYS A 907 4.197 -27.582 0.892 1.00 60.14 H new ATOM 0 HB3 CYS A 907 2.616 -26.865 0.653 1.00 60.14 H new ATOM 0 HG CYS A 907 3.435 -29.915 -0.015 1.00 30.54 H new ATOM 255 N LYS A 908 3.297 -26.415 -3.181 1.00 55.44 N ATOM 256 CA LYS A 908 2.384 -26.146 -4.280 1.00 43.21 C ATOM 257 C LYS A 908 0.989 -26.656 -3.915 1.00 71.10 C ATOM 258 O LYS A 908 0.038 -25.879 -3.847 1.00 51.25 O ATOM 259 CB LYS A 908 2.931 -26.729 -5.585 1.00 35.02 C ATOM 260 CG LYS A 908 1.857 -26.733 -6.675 1.00 62.03 C ATOM 261 CD LYS A 908 2.482 -26.550 -8.060 1.00 12.10 C ATOM 262 CE LYS A 908 2.624 -27.893 -8.779 1.00 5.11 C ATOM 263 NZ LYS A 908 3.057 -27.688 -10.179 1.00 42.43 N ATOM 0 H LYS A 908 4.152 -26.904 -3.446 1.00 55.44 H new ATOM 0 HA LYS A 908 2.296 -25.073 -4.449 1.00 43.21 H new ATOM 0 HB2 LYS A 908 3.789 -26.145 -5.917 1.00 35.02 H new ATOM 0 HB3 LYS A 908 3.284 -27.746 -5.414 1.00 35.02 H new ATOM 0 HG2 LYS A 908 1.304 -27.672 -6.643 1.00 62.03 H new ATOM 0 HG3 LYS A 908 1.140 -25.934 -6.487 1.00 62.03 H new ATOM 0 HD2 LYS A 908 1.864 -25.878 -8.656 1.00 12.10 H new ATOM 0 HD3 LYS A 908 3.461 -26.081 -7.962 1.00 12.10 H new ATOM 0 HE2 LYS A 908 3.348 -28.517 -8.256 1.00 5.11 H new ATOM 0 HE3 LYS A 908 1.673 -28.425 -8.760 1.00 5.11 H new ATOM 0 HZ1 LYS A 908 2.667 -28.444 -10.777 1.00 42.43 H new ATOM 0 HZ2 LYS A 908 2.713 -26.767 -10.517 1.00 42.43 H new ATOM 0 HZ3 LYS A 908 4.096 -27.709 -10.228 1.00 42.43 H new ATOM 276 N ASN A 909 0.910 -27.959 -3.689 1.00 65.23 N ATOM 277 CA ASN A 909 -0.353 -28.582 -3.333 1.00 22.42 C ATOM 278 C ASN A 909 -1.053 -27.734 -2.269 1.00 25.42 C ATOM 279 O ASN A 909 -2.180 -27.285 -2.470 1.00 44.14 O ATOM 280 CB ASN A 909 -0.133 -29.981 -2.753 1.00 61.13 C ATOM 281 CG ASN A 909 -0.194 -31.045 -3.851 1.00 21.21 C ATOM 282 OD1 ASN A 909 0.068 -30.789 -5.015 1.00 33.42 O ATOM 283 ND2 ASN A 909 -0.553 -32.250 -3.417 1.00 0.01 N ATOM 0 H ASN A 909 1.701 -28.601 -3.746 1.00 65.23 H new ATOM 0 HA ASN A 909 -0.958 -28.657 -4.236 1.00 22.42 H new ATOM 0 HB2 ASN A 909 0.835 -30.024 -2.254 1.00 61.13 H new ATOM 0 HB3 ASN A 909 -0.891 -30.189 -1.998 1.00 61.13 H new ATOM 0 HD21 ASN A 909 -0.623 -33.028 -4.073 1.00 0.01 H new ATOM 0 HD22 ASN A 909 -0.759 -32.396 -2.429 1.00 0.01 H new ATOM 290 N CYS A 910 -0.355 -27.541 -1.159 1.00 31.30 N ATOM 291 CA CYS A 910 -0.895 -26.755 -0.063 1.00 33.22 C ATOM 292 C CYS A 910 -0.292 -25.351 -0.135 1.00 65.42 C ATOM 293 O CYS A 910 -0.713 -24.532 -0.949 1.00 54.44 O ATOM 294 CB CYS A 910 -0.636 -27.419 1.291 1.00 24.10 C ATOM 295 SG CYS A 910 -1.431 -29.053 1.510 1.00 44.23 S ATOM 0 H CYS A 910 0.580 -27.915 -0.995 1.00 31.30 H new ATOM 0 HA CYS A 910 -1.979 -26.689 -0.160 1.00 33.22 H new ATOM 0 HB2 CYS A 910 0.440 -27.534 1.424 1.00 24.10 H new ATOM 0 HB3 CYS A 910 -0.985 -26.752 2.079 1.00 24.10 H new ATOM 300 N SER A 911 0.687 -25.117 0.727 1.00 34.33 N ATOM 301 CA SER A 911 1.353 -23.827 0.771 1.00 13.43 C ATOM 302 C SER A 911 1.969 -23.603 2.154 1.00 53.42 C ATOM 303 O SER A 911 1.877 -22.509 2.708 1.00 11.44 O ATOM 304 CB SER A 911 0.381 -22.694 0.433 1.00 5.11 C ATOM 305 OG SER A 911 0.850 -21.432 0.900 1.00 42.41 O ATOM 0 H SER A 911 1.035 -25.800 1.400 1.00 34.33 H new ATOM 0 HA SER A 911 2.146 -23.825 0.023 1.00 13.43 H new ATOM 0 HB2 SER A 911 0.236 -22.650 -0.646 1.00 5.11 H new ATOM 0 HB3 SER A 911 -0.592 -22.906 0.877 1.00 5.11 H new ATOM 0 HG SER A 911 1.031 -21.486 1.862 1.00 42.41 H new ATOM 311 N VAL A 912 2.583 -24.657 2.670 1.00 1.34 N ATOM 312 CA VAL A 912 3.214 -24.589 3.977 1.00 2.15 C ATOM 313 C VAL A 912 4.690 -24.222 3.808 1.00 12.51 C ATOM 314 O VAL A 912 5.386 -24.802 2.977 1.00 24.43 O ATOM 315 CB VAL A 912 3.008 -25.907 4.727 1.00 45.11 C ATOM 316 CG1 VAL A 912 1.630 -26.499 4.427 1.00 51.31 C ATOM 317 CG2 VAL A 912 4.118 -26.906 4.394 1.00 45.11 C ATOM 0 H VAL A 912 2.657 -25.563 2.207 1.00 1.34 H new ATOM 0 HA VAL A 912 2.753 -23.810 4.583 1.00 2.15 H new ATOM 0 HB VAL A 912 3.056 -25.696 5.795 1.00 45.11 H new ATOM 0 HG11 VAL A 912 1.510 -27.435 4.972 1.00 51.31 H new ATOM 0 HG12 VAL A 912 0.857 -25.796 4.737 1.00 51.31 H new ATOM 0 HG13 VAL A 912 1.540 -26.688 3.357 1.00 51.31 H new ATOM 0 HG21 VAL A 912 3.948 -27.834 4.940 1.00 45.11 H new ATOM 0 HG22 VAL A 912 4.115 -27.109 3.323 1.00 45.11 H new ATOM 0 HG23 VAL A 912 5.082 -26.487 4.681 1.00 45.11 H new ATOM 327 N LEU A 913 5.123 -23.259 4.609 1.00 34.12 N ATOM 328 CA LEU A 913 6.503 -22.807 4.558 1.00 33.34 C ATOM 329 C LEU A 913 7.428 -23.965 4.940 1.00 50.41 C ATOM 330 O LEU A 913 7.504 -24.344 6.107 1.00 20.43 O ATOM 331 CB LEU A 913 6.690 -21.559 5.423 1.00 21.35 C ATOM 332 CG LEU A 913 8.117 -21.013 5.513 1.00 33.53 C ATOM 333 CD1 LEU A 913 8.846 -21.584 6.731 1.00 64.32 C ATOM 334 CD2 LEU A 913 8.884 -21.268 4.214 1.00 12.42 C ATOM 0 H LEU A 913 4.542 -22.779 5.297 1.00 34.12 H new ATOM 0 HA LEU A 913 6.769 -22.507 3.545 1.00 33.34 H new ATOM 0 HB2 LEU A 913 6.045 -20.771 5.034 1.00 21.35 H new ATOM 0 HB3 LEU A 913 6.344 -21.785 6.432 1.00 21.35 H new ATOM 0 HG LEU A 913 8.062 -19.933 5.648 1.00 33.53 H new ATOM 0 HD11 LEU A 913 9.858 -21.180 6.772 1.00 64.32 H new ATOM 0 HD12 LEU A 913 8.309 -21.309 7.639 1.00 64.32 H new ATOM 0 HD13 LEU A 913 8.892 -22.670 6.651 1.00 64.32 H new ATOM 0 HD21 LEU A 913 9.895 -20.870 4.304 1.00 12.42 H new ATOM 0 HD22 LEU A 913 8.931 -22.340 4.024 1.00 12.42 H new ATOM 0 HD23 LEU A 913 8.373 -20.775 3.387 1.00 12.42 H new ATOM 346 N ALA A 914 8.108 -24.493 3.933 1.00 2.21 N ATOM 347 CA ALA A 914 9.025 -25.599 4.148 1.00 23.13 C ATOM 348 C ALA A 914 10.395 -25.049 4.551 1.00 20.45 C ATOM 349 O ALA A 914 11.098 -25.655 5.359 1.00 32.20 O ATOM 350 CB ALA A 914 9.092 -26.461 2.886 1.00 55.44 C ATOM 0 H ALA A 914 8.042 -24.175 2.966 1.00 2.21 H new ATOM 0 HA ALA A 914 8.673 -26.236 4.959 1.00 23.13 H new ATOM 0 HB1 ALA A 914 9.780 -27.291 3.048 1.00 55.44 H new ATOM 0 HB2 ALA A 914 8.100 -26.852 2.659 1.00 55.44 H new ATOM 0 HB3 ALA A 914 9.444 -25.856 2.050 1.00 55.44 H new ATOM 356 N CYS A 915 10.733 -23.908 3.971 1.00 42.35 N ATOM 357 CA CYS A 915 12.006 -23.269 4.259 1.00 23.42 C ATOM 358 C CYS A 915 12.088 -21.974 3.450 1.00 44.41 C ATOM 359 O CYS A 915 11.252 -21.725 2.583 1.00 64.34 O ATOM 360 CB CYS A 915 13.185 -24.200 3.967 1.00 31.42 C ATOM 361 SG CYS A 915 13.805 -24.933 5.525 1.00 13.14 S ATOM 0 H CYS A 915 10.147 -23.408 3.302 1.00 42.35 H new ATOM 0 HA CYS A 915 12.066 -23.036 5.322 1.00 23.42 H new ATOM 0 HB2 CYS A 915 12.875 -24.989 3.282 1.00 31.42 H new ATOM 0 HB3 CYS A 915 13.983 -23.646 3.473 1.00 31.42 H new ATOM 0 HG CYS A 915 12.841 -25.572 6.118 1.00 13.14 H new ATOM 367 N SER A 916 13.104 -21.182 3.762 1.00 13.23 N ATOM 368 CA SER A 916 13.306 -19.918 3.075 1.00 52.31 C ATOM 369 C SER A 916 14.397 -20.068 2.013 1.00 24.03 C ATOM 370 O SER A 916 15.167 -21.027 2.040 1.00 32.34 O ATOM 371 CB SER A 916 13.674 -18.807 4.061 1.00 72.21 C ATOM 372 OG SER A 916 13.614 -17.517 3.459 1.00 64.14 O ATOM 0 H SER A 916 13.796 -21.392 4.482 1.00 13.23 H new ATOM 0 HA SER A 916 12.371 -19.640 2.589 1.00 52.31 H new ATOM 0 HB2 SER A 916 12.997 -18.841 4.914 1.00 72.21 H new ATOM 0 HB3 SER A 916 14.679 -18.981 4.445 1.00 72.21 H new ATOM 0 HG SER A 916 12.975 -17.532 2.716 1.00 64.14 H new ATOM 378 N GLY A 917 14.430 -19.106 1.103 1.00 12.44 N ATOM 379 CA GLY A 917 15.414 -19.119 0.035 1.00 43.22 C ATOM 380 C GLY A 917 16.818 -18.849 0.580 1.00 65.45 C ATOM 381 O GLY A 917 17.807 -19.318 0.017 1.00 31.10 O ATOM 0 H GLY A 917 13.790 -18.312 1.084 1.00 12.44 H new ATOM 0 HA2 GLY A 917 15.395 -20.085 -0.470 1.00 43.22 H new ATOM 0 HA3 GLY A 917 15.158 -18.365 -0.710 1.00 43.22 H new ATOM 385 N GLU A 918 16.862 -18.095 1.668 1.00 73.20 N ATOM 386 CA GLU A 918 18.128 -17.758 2.295 1.00 43.10 C ATOM 387 C GLU A 918 18.575 -18.885 3.229 1.00 42.44 C ATOM 388 O GLU A 918 19.752 -18.979 3.575 1.00 52.32 O ATOM 389 CB GLU A 918 18.031 -16.429 3.047 1.00 42.12 C ATOM 390 CG GLU A 918 17.136 -16.561 4.281 1.00 62.23 C ATOM 391 CD GLU A 918 17.305 -15.359 5.212 1.00 24.21 C ATOM 392 OE1 GLU A 918 18.220 -14.546 5.014 1.00 0.53 O ATOM 393 OE2 GLU A 918 16.444 -15.286 6.170 1.00 41.24 O ATOM 0 H GLU A 918 16.040 -17.708 2.132 1.00 73.20 H new ATOM 0 HA GLU A 918 18.878 -17.641 1.513 1.00 43.10 H new ATOM 0 HB2 GLU A 918 19.027 -16.104 3.349 1.00 42.12 H new ATOM 0 HB3 GLU A 918 17.632 -15.661 2.385 1.00 42.12 H new ATOM 0 HG2 GLU A 918 16.094 -16.642 3.972 1.00 62.23 H new ATOM 0 HG3 GLU A 918 17.382 -17.478 4.817 1.00 62.23 H new ATOM 401 N ASP A 919 17.612 -19.711 3.610 1.00 64.24 N ATOM 402 CA ASP A 919 17.892 -20.828 4.496 1.00 1.24 C ATOM 403 C ASP A 919 18.201 -22.072 3.661 1.00 3.20 C ATOM 404 O ASP A 919 18.063 -23.196 4.141 1.00 52.05 O ATOM 405 CB ASP A 919 16.686 -21.142 5.384 1.00 50.14 C ATOM 406 CG ASP A 919 16.868 -20.805 6.865 1.00 31.51 C ATOM 407 OD1 ASP A 919 17.455 -21.586 7.630 1.00 54.53 O ATOM 408 OD2 ASP A 919 16.371 -19.673 7.232 1.00 73.01 O ATOM 0 H ASP A 919 16.637 -19.629 3.321 1.00 64.24 H new ATOM 0 HA ASP A 919 18.741 -20.556 5.123 1.00 1.24 H new ATOM 0 HB2 ASP A 919 15.823 -20.594 5.006 1.00 50.14 H new ATOM 0 HB3 ASP A 919 16.454 -22.203 5.294 1.00 50.14 H new ATOM 414 N ILE A 920 18.614 -21.828 2.426 1.00 63.41 N ATOM 415 CA ILE A 920 18.944 -22.915 1.519 1.00 2.13 C ATOM 416 C ILE A 920 20.406 -22.785 1.085 1.00 35.10 C ATOM 417 O ILE A 920 20.976 -21.696 1.131 1.00 22.45 O ATOM 418 CB ILE A 920 17.957 -22.957 0.351 1.00 11.33 C ATOM 419 CG1 ILE A 920 16.528 -23.185 0.849 1.00 62.21 C ATOM 420 CG2 ILE A 920 18.377 -24.001 -0.685 1.00 20.54 C ATOM 421 CD1 ILE A 920 16.148 -24.665 0.764 1.00 2.25 C ATOM 0 H ILE A 920 18.728 -20.894 2.032 1.00 63.41 H new ATOM 0 HA ILE A 920 18.845 -23.876 2.024 1.00 2.13 H new ATOM 0 HB ILE A 920 17.974 -21.987 -0.146 1.00 11.33 H new ATOM 0 HG12 ILE A 920 16.439 -22.841 1.880 1.00 62.21 H new ATOM 0 HG13 ILE A 920 15.833 -22.592 0.254 1.00 62.21 H new ATOM 0 HG21 ILE A 920 17.658 -24.010 -1.504 1.00 20.54 H new ATOM 0 HG22 ILE A 920 19.365 -23.753 -1.072 1.00 20.54 H new ATOM 0 HG23 ILE A 920 18.407 -24.985 -0.218 1.00 20.54 H new ATOM 0 HD11 ILE A 920 15.128 -24.800 1.124 1.00 2.25 H new ATOM 0 HD12 ILE A 920 16.215 -24.999 -0.271 1.00 2.25 H new ATOM 0 HD13 ILE A 920 16.830 -25.252 1.379 1.00 2.25 H new ATOM 433 N HIS A 921 20.969 -23.911 0.673 1.00 43.13 N ATOM 434 CA HIS A 921 22.353 -23.937 0.230 1.00 2.35 C ATOM 435 C HIS A 921 22.413 -24.343 -1.244 1.00 4.45 C ATOM 436 O HIS A 921 21.486 -24.966 -1.758 1.00 23.11 O ATOM 437 CB HIS A 921 23.194 -24.844 1.130 1.00 22.33 C ATOM 438 CG HIS A 921 23.704 -24.168 2.380 1.00 3.32 C ATOM 439 ND1 HIS A 921 23.632 -24.753 3.632 1.00 10.03 N ATOM 440 CD2 HIS A 921 24.295 -22.951 2.557 1.00 21.23 C ATOM 441 CE1 HIS A 921 24.158 -23.917 4.516 1.00 74.13 C ATOM 442 NE2 HIS A 921 24.568 -22.801 3.848 1.00 55.24 N ATOM 0 H HIS A 921 20.492 -24.812 0.636 1.00 43.13 H new ATOM 0 HA HIS A 921 22.784 -22.939 0.313 1.00 2.35 H new ATOM 0 HB2 HIS A 921 22.597 -25.710 1.416 1.00 22.33 H new ATOM 0 HB3 HIS A 921 24.044 -25.218 0.559 1.00 22.33 H new ATOM 0 HD2 HIS A 921 24.505 -22.232 1.779 1.00 21.23 H new ATOM 0 HE1 HIS A 921 24.246 -24.089 5.578 1.00 74.13 H new ATOM 0 HE2 HIS A 921 25.011 -21.985 4.270 1.00 55.24 H new ATOM 450 N VAL A 922 23.514 -23.972 -1.882 1.00 31.15 N ATOM 451 CA VAL A 922 23.707 -24.290 -3.286 1.00 44.22 C ATOM 452 C VAL A 922 25.015 -25.067 -3.453 1.00 75.24 C ATOM 453 O VAL A 922 25.963 -24.864 -2.697 1.00 31.11 O ATOM 454 CB VAL A 922 23.662 -23.010 -4.123 1.00 51.22 C ATOM 455 CG1 VAL A 922 24.386 -23.201 -5.457 1.00 72.24 C ATOM 456 CG2 VAL A 922 22.219 -22.549 -4.343 1.00 25.41 C ATOM 0 H VAL A 922 24.281 -23.455 -1.452 1.00 31.15 H new ATOM 0 HA VAL A 922 22.901 -24.928 -3.648 1.00 44.22 H new ATOM 0 HB VAL A 922 24.182 -22.229 -3.569 1.00 51.22 H new ATOM 0 HG11 VAL A 922 24.339 -22.276 -6.032 1.00 72.24 H new ATOM 0 HG12 VAL A 922 25.428 -23.460 -5.271 1.00 72.24 H new ATOM 0 HG13 VAL A 922 23.907 -24.003 -6.019 1.00 72.24 H new ATOM 0 HG21 VAL A 922 22.215 -21.637 -4.941 1.00 25.41 H new ATOM 0 HG22 VAL A 922 21.664 -23.328 -4.866 1.00 25.41 H new ATOM 0 HG23 VAL A 922 21.749 -22.353 -3.379 1.00 25.41 H new ATOM 573 N VAL A 929 20.656 -28.140 -2.963 1.00 20.15 N ATOM 574 CA VAL A 929 20.302 -29.079 -1.911 1.00 54.25 C ATOM 575 C VAL A 929 19.825 -28.304 -0.681 1.00 64.11 C ATOM 576 O VAL A 929 20.366 -27.246 -0.362 1.00 33.23 O ATOM 577 CB VAL A 929 21.484 -30.003 -1.615 1.00 21.40 C ATOM 578 CG1 VAL A 929 21.686 -31.015 -2.745 1.00 50.31 C ATOM 579 CG2 VAL A 929 22.761 -29.198 -1.365 1.00 54.12 C ATOM 0 HA VAL A 929 19.479 -29.719 -2.231 1.00 54.25 H new ATOM 0 HB VAL A 929 21.255 -30.558 -0.705 1.00 21.40 H new ATOM 0 HG11 VAL A 929 22.533 -31.660 -2.509 1.00 50.31 H new ATOM 0 HG12 VAL A 929 20.787 -31.622 -2.855 1.00 50.31 H new ATOM 0 HG13 VAL A 929 21.882 -30.485 -3.677 1.00 50.31 H new ATOM 0 HG21 VAL A 929 23.586 -29.880 -1.157 1.00 54.12 H new ATOM 0 HG22 VAL A 929 22.995 -28.604 -2.248 1.00 54.12 H new ATOM 0 HG23 VAL A 929 22.613 -28.537 -0.511 1.00 54.12 H new ATOM 589 N ASN A 930 18.819 -28.861 -0.024 1.00 13.11 N ATOM 590 CA ASN A 930 18.264 -28.235 1.164 1.00 35.44 C ATOM 591 C ASN A 930 18.892 -28.866 2.408 1.00 24.15 C ATOM 592 O ASN A 930 18.442 -29.911 2.874 1.00 34.43 O ATOM 593 CB ASN A 930 16.750 -28.446 1.242 1.00 41.35 C ATOM 594 CG ASN A 930 16.210 -28.047 2.616 1.00 4.24 C ATOM 595 OD1 ASN A 930 16.580 -28.597 3.641 1.00 44.23 O ATOM 596 ND2 ASN A 930 15.317 -27.062 2.582 1.00 3.01 N ATOM 0 H ASN A 930 18.374 -29.739 -0.291 1.00 13.11 H new ATOM 0 HA ASN A 930 18.478 -27.167 1.113 1.00 35.44 H new ATOM 0 HB2 ASN A 930 16.257 -27.857 0.469 1.00 41.35 H new ATOM 0 HB3 ASN A 930 16.515 -29.492 1.045 1.00 41.35 H new ATOM 0 HD21 ASN A 930 14.898 -26.723 3.448 1.00 3.01 H new ATOM 0 HD22 ASN A 930 15.051 -26.645 1.690 1.00 3.01 H new ATOM 603 N MET A 931 19.924 -28.204 2.911 1.00 22.01 N ATOM 604 CA MET A 931 20.620 -28.687 4.092 1.00 14.31 C ATOM 605 C MET A 931 19.910 -28.234 5.370 1.00 74.43 C ATOM 606 O MET A 931 20.550 -27.752 6.302 1.00 10.34 O ATOM 607 CB MET A 931 22.055 -28.158 4.091 1.00 3.21 C ATOM 608 CG MET A 931 22.706 -28.339 2.718 1.00 35.41 C ATOM 609 SD MET A 931 23.160 -30.049 2.479 1.00 2.13 S ATOM 610 CE MET A 931 24.937 -29.892 2.425 1.00 25.34 C ATOM 0 H MET A 931 20.295 -27.337 2.522 1.00 22.01 H new ATOM 0 HA MET A 931 20.625 -29.777 4.068 1.00 14.31 H new ATOM 0 HB2 MET A 931 22.057 -27.102 4.362 1.00 3.21 H new ATOM 0 HB3 MET A 931 22.640 -28.682 4.847 1.00 3.21 H new ATOM 0 HG2 MET A 931 22.016 -28.024 1.935 1.00 35.41 H new ATOM 0 HG3 MET A 931 23.589 -27.705 2.639 1.00 35.41 H new ATOM 0 HE1 MET A 931 25.385 -30.875 2.280 1.00 25.34 H new ATOM 0 HE2 MET A 931 25.220 -29.239 1.599 1.00 25.34 H new ATOM 0 HE3 MET A 931 25.293 -29.466 3.363 1.00 25.34 H new ATOM 620 N THR A 932 18.596 -28.407 5.371 1.00 11.51 N ATOM 621 CA THR A 932 17.792 -28.022 6.519 1.00 70.02 C ATOM 622 C THR A 932 17.366 -29.260 7.310 1.00 75.10 C ATOM 623 O THR A 932 16.728 -30.160 6.766 1.00 52.05 O ATOM 624 CB THR A 932 16.613 -27.189 6.012 1.00 0.34 C ATOM 625 OG1 THR A 932 17.125 -26.529 4.858 1.00 0.50 O ATOM 626 CG2 THR A 932 16.251 -26.047 6.965 1.00 71.14 C ATOM 0 H THR A 932 18.068 -28.808 4.596 1.00 11.51 H new ATOM 0 HA THR A 932 18.364 -27.410 7.216 1.00 70.02 H new ATOM 0 HB THR A 932 15.746 -27.834 5.872 1.00 0.34 H new ATOM 0 HG1 THR A 932 16.567 -25.750 4.652 1.00 0.50 H new ATOM 0 HG21 THR A 932 15.409 -25.487 6.559 1.00 71.14 H new ATOM 0 HG22 THR A 932 15.979 -26.457 7.938 1.00 71.14 H new ATOM 0 HG23 THR A 932 17.107 -25.382 7.078 1.00 71.14 H new ATOM 634 N PRO A 933 17.745 -29.266 8.616 1.00 33.21 N ATOM 635 CA PRO A 933 17.408 -30.379 9.488 1.00 44.12 C ATOM 636 C PRO A 933 15.930 -30.340 9.881 1.00 23.21 C ATOM 637 O PRO A 933 15.254 -31.367 9.868 1.00 73.31 O ATOM 638 CB PRO A 933 18.344 -30.243 10.678 1.00 13.32 C ATOM 639 CG PRO A 933 18.844 -28.807 10.653 1.00 34.43 C ATOM 640 CD PRO A 933 18.501 -28.218 9.295 1.00 14.10 C ATOM 0 HA PRO A 933 17.538 -31.347 9.005 1.00 44.12 H new ATOM 0 HB2 PRO A 933 17.824 -30.459 11.611 1.00 13.32 H new ATOM 0 HB3 PRO A 933 19.173 -30.947 10.605 1.00 13.32 H new ATOM 0 HG2 PRO A 933 18.378 -28.227 11.449 1.00 34.43 H new ATOM 0 HG3 PRO A 933 19.920 -28.774 10.822 1.00 34.43 H new ATOM 0 HD2 PRO A 933 17.911 -27.307 9.396 1.00 14.10 H new ATOM 0 HD3 PRO A 933 19.401 -27.955 8.739 1.00 14.10 H new ATOM 648 N GLU A 934 15.473 -29.144 10.222 1.00 73.43 N ATOM 649 CA GLU A 934 14.087 -28.958 10.618 1.00 62.31 C ATOM 650 C GLU A 934 13.150 -29.383 9.486 1.00 53.23 C ATOM 651 O GLU A 934 12.021 -29.804 9.734 1.00 23.45 O ATOM 652 CB GLU A 934 13.825 -27.509 11.032 1.00 3.01 C ATOM 653 CG GLU A 934 14.108 -26.548 9.875 1.00 31.42 C ATOM 654 CD GLU A 934 14.204 -25.105 10.372 1.00 11.44 C ATOM 655 OE1 GLU A 934 15.134 -24.378 9.992 1.00 62.42 O ATOM 656 OE2 GLU A 934 13.267 -24.743 11.182 1.00 21.44 O ATOM 0 H GLU A 934 16.037 -28.294 10.232 1.00 73.43 H new ATOM 0 HA GLU A 934 13.889 -29.590 11.484 1.00 62.31 H new ATOM 0 HB2 GLU A 934 12.789 -27.401 11.354 1.00 3.01 H new ATOM 0 HB3 GLU A 934 14.453 -27.252 11.885 1.00 3.01 H new ATOM 0 HG2 GLU A 934 15.039 -26.830 9.383 1.00 31.42 H new ATOM 0 HG3 GLU A 934 13.317 -26.628 9.130 1.00 31.42 H new ATOM 664 N PHE A 935 13.652 -29.257 8.266 1.00 13.30 N ATOM 665 CA PHE A 935 12.873 -29.622 7.095 1.00 61.12 C ATOM 666 C PHE A 935 12.667 -31.137 7.024 1.00 44.43 C ATOM 667 O PHE A 935 11.772 -31.613 6.328 1.00 42.05 O ATOM 668 CB PHE A 935 13.670 -29.169 5.869 1.00 35.54 C ATOM 669 CG PHE A 935 13.071 -29.622 4.536 1.00 32.32 C ATOM 670 CD1 PHE A 935 11.989 -28.978 4.023 1.00 40.44 C ATOM 671 CD2 PHE A 935 13.620 -30.669 3.865 1.00 65.54 C ATOM 672 CE1 PHE A 935 11.433 -29.398 2.785 1.00 4.22 C ATOM 673 CE2 PHE A 935 13.065 -31.090 2.627 1.00 12.33 C ATOM 674 CZ PHE A 935 11.983 -30.445 2.114 1.00 61.03 C ATOM 0 H PHE A 935 14.588 -28.907 8.063 1.00 13.30 H new ATOM 0 HA PHE A 935 11.891 -29.151 7.139 1.00 61.12 H new ATOM 0 HB2 PHE A 935 13.738 -28.081 5.874 1.00 35.54 H new ATOM 0 HB3 PHE A 935 14.687 -29.552 5.948 1.00 35.54 H new ATOM 0 HD1 PHE A 935 11.552 -28.147 4.557 1.00 40.44 H new ATOM 0 HD2 PHE A 935 14.479 -31.181 4.273 1.00 65.54 H new ATOM 0 HE1 PHE A 935 10.574 -28.886 2.377 1.00 4.22 H new ATOM 0 HE2 PHE A 935 13.502 -31.921 2.094 1.00 12.33 H new ATOM 0 HZ PHE A 935 11.560 -30.765 1.173 1.00 61.03 H new ATOM 684 N LYS A 936 13.511 -31.851 7.754 1.00 62.14 N ATOM 685 CA LYS A 936 13.433 -33.302 7.782 1.00 1.21 C ATOM 686 C LYS A 936 12.123 -33.725 8.449 1.00 13.31 C ATOM 687 O LYS A 936 11.687 -34.866 8.302 1.00 41.40 O ATOM 688 CB LYS A 936 14.679 -33.892 8.445 1.00 22.50 C ATOM 689 CG LYS A 936 14.456 -34.100 9.945 1.00 44.25 C ATOM 690 CD LYS A 936 15.757 -34.504 10.641 1.00 2.24 C ATOM 691 CE LYS A 936 16.540 -33.271 11.098 1.00 65.33 C ATOM 692 NZ LYS A 936 17.636 -33.663 12.012 1.00 2.12 N ATOM 0 H LYS A 936 14.252 -31.452 8.330 1.00 62.14 H new ATOM 0 HA LYS A 936 13.419 -33.703 6.768 1.00 1.21 H new ATOM 0 HB2 LYS A 936 14.929 -34.843 7.976 1.00 22.50 H new ATOM 0 HB3 LYS A 936 15.528 -33.227 8.289 1.00 22.50 H new ATOM 0 HG2 LYS A 936 14.071 -33.182 10.390 1.00 44.25 H new ATOM 0 HG3 LYS A 936 13.701 -34.871 10.101 1.00 44.25 H new ATOM 0 HD2 LYS A 936 15.533 -35.136 11.500 1.00 2.24 H new ATOM 0 HD3 LYS A 936 16.369 -35.096 9.961 1.00 2.24 H new ATOM 0 HE2 LYS A 936 16.949 -32.751 10.232 1.00 65.33 H new ATOM 0 HE3 LYS A 936 15.870 -32.574 11.601 1.00 65.33 H new ATOM 0 HZ1 LYS A 936 18.157 -32.815 12.313 1.00 2.12 H new ATOM 0 HZ2 LYS A 936 17.238 -34.139 12.847 1.00 2.12 H new ATOM 0 HZ3 LYS A 936 18.284 -34.311 11.520 1.00 2.12 H new ATOM 705 N GLU A 937 11.531 -32.782 9.168 1.00 32.42 N ATOM 706 CA GLU A 937 10.279 -33.043 9.858 1.00 11.02 C ATOM 707 C GLU A 937 9.116 -32.379 9.118 1.00 44.42 C ATOM 708 O GLU A 937 7.979 -32.411 9.585 1.00 50.31 O ATOM 709 CB GLU A 937 10.345 -32.570 11.312 1.00 42.14 C ATOM 710 CG GLU A 937 11.762 -32.712 11.870 1.00 4.34 C ATOM 711 CD GLU A 937 11.732 -33.120 13.345 1.00 61.34 C ATOM 712 OE1 GLU A 937 10.824 -32.711 14.083 1.00 41.51 O ATOM 713 OE2 GLU A 937 12.696 -33.893 13.716 1.00 30.01 O ATOM 0 H GLU A 937 11.895 -31.837 9.288 1.00 32.42 H new ATOM 0 HA GLU A 937 10.110 -34.120 9.868 1.00 11.02 H new ATOM 0 HB2 GLU A 937 10.028 -31.529 11.374 1.00 42.14 H new ATOM 0 HB3 GLU A 937 9.651 -33.151 11.919 1.00 42.14 H new ATOM 0 HG2 GLU A 937 12.311 -33.457 11.294 1.00 4.34 H new ATOM 0 HG3 GLU A 937 12.296 -31.768 11.761 1.00 4.34 H new ATOM 721 N LEU A 938 9.442 -31.792 7.975 1.00 23.04 N ATOM 722 CA LEU A 938 8.439 -31.121 7.166 1.00 63.11 C ATOM 723 C LEU A 938 8.171 -31.947 5.906 1.00 32.13 C ATOM 724 O LEU A 938 7.209 -31.690 5.184 1.00 11.42 O ATOM 725 CB LEU A 938 8.861 -29.679 6.877 1.00 12.12 C ATOM 726 CG LEU A 938 9.413 -28.891 8.067 1.00 53.42 C ATOM 727 CD1 LEU A 938 9.991 -27.549 7.614 1.00 4.31 C ATOM 728 CD2 LEU A 938 8.348 -28.719 9.152 1.00 0.31 C ATOM 0 H LEU A 938 10.386 -31.767 7.591 1.00 23.04 H new ATOM 0 HA LEU A 938 7.496 -31.050 7.709 1.00 63.11 H new ATOM 0 HB2 LEU A 938 9.618 -29.693 6.093 1.00 12.12 H new ATOM 0 HB3 LEU A 938 8.000 -29.142 6.479 1.00 12.12 H new ATOM 0 HG LEU A 938 10.231 -29.463 8.506 1.00 53.42 H new ATOM 0 HD11 LEU A 938 10.377 -27.009 8.478 1.00 4.31 H new ATOM 0 HD12 LEU A 938 10.800 -27.722 6.904 1.00 4.31 H new ATOM 0 HD13 LEU A 938 9.209 -26.959 7.136 1.00 4.31 H new ATOM 0 HD21 LEU A 938 8.766 -28.156 9.986 1.00 0.31 H new ATOM 0 HD22 LEU A 938 7.494 -28.180 8.742 1.00 0.31 H new ATOM 0 HD23 LEU A 938 8.024 -29.699 9.502 1.00 0.31 H new ATOM 740 N TYR A 939 9.038 -32.923 5.681 1.00 21.03 N ATOM 741 CA TYR A 939 8.907 -33.788 4.521 1.00 33.45 C ATOM 742 C TYR A 939 8.911 -35.262 4.933 1.00 1.05 C ATOM 743 O TYR A 939 9.530 -35.630 5.931 1.00 44.54 O ATOM 744 CB TYR A 939 10.132 -33.512 3.648 1.00 51.21 C ATOM 745 CG TYR A 939 11.317 -34.438 3.928 1.00 44.43 C ATOM 746 CD1 TYR A 939 11.226 -35.783 3.636 1.00 33.55 C ATOM 747 CD2 TYR A 939 12.479 -33.927 4.471 1.00 14.23 C ATOM 748 CE1 TYR A 939 12.341 -36.655 3.900 1.00 45.22 C ATOM 749 CE2 TYR A 939 13.594 -34.798 4.735 1.00 64.13 C ATOM 750 CZ TYR A 939 13.471 -36.119 4.436 1.00 72.10 C ATOM 751 OH TYR A 939 14.525 -36.942 4.685 1.00 74.03 O ATOM 0 H TYR A 939 9.834 -33.134 6.283 1.00 21.03 H new ATOM 0 HA TYR A 939 7.970 -33.592 4.000 1.00 33.45 H new ATOM 0 HB2 TYR A 939 9.848 -33.609 2.600 1.00 51.21 H new ATOM 0 HB3 TYR A 939 10.447 -32.480 3.798 1.00 51.21 H new ATOM 0 HD1 TYR A 939 10.318 -36.182 3.209 1.00 33.55 H new ATOM 0 HD2 TYR A 939 12.551 -32.874 4.698 1.00 14.23 H new ATOM 0 HE1 TYR A 939 12.282 -37.710 3.678 1.00 45.22 H new ATOM 0 HE2 TYR A 939 14.508 -34.411 5.161 1.00 64.13 H new ATOM 0 HH TYR A 939 15.263 -36.422 5.066 1.00 74.03 H new ATOM 761 N ILE A 940 8.213 -36.066 4.145 1.00 40.10 N ATOM 762 CA ILE A 940 8.129 -37.491 4.415 1.00 33.13 C ATOM 763 C ILE A 940 8.560 -38.268 3.170 1.00 22.41 C ATOM 764 O ILE A 940 8.184 -37.916 2.053 1.00 24.40 O ATOM 765 CB ILE A 940 6.731 -37.860 4.917 1.00 52.44 C ATOM 766 CG1 ILE A 940 6.094 -36.692 5.673 1.00 42.10 C ATOM 767 CG2 ILE A 940 6.769 -39.136 5.760 1.00 45.23 C ATOM 768 CD1 ILE A 940 4.697 -37.060 6.175 1.00 75.54 C ATOM 0 H ILE A 940 7.700 -35.758 3.319 1.00 40.10 H new ATOM 0 HA ILE A 940 8.814 -37.768 5.217 1.00 33.13 H new ATOM 0 HB ILE A 940 6.101 -38.066 4.052 1.00 52.44 H new ATOM 0 HG12 ILE A 940 6.725 -36.413 6.516 1.00 42.10 H new ATOM 0 HG13 ILE A 940 6.032 -35.822 5.019 1.00 42.10 H new ATOM 0 HG21 ILE A 940 5.763 -39.375 6.104 1.00 45.23 H new ATOM 0 HG22 ILE A 940 7.152 -39.959 5.157 1.00 45.23 H new ATOM 0 HG23 ILE A 940 7.420 -38.984 6.621 1.00 45.23 H new ATOM 0 HD11 ILE A 940 4.267 -36.212 6.709 1.00 75.54 H new ATOM 0 HD12 ILE A 940 4.061 -37.315 5.327 1.00 75.54 H new ATOM 0 HD13 ILE A 940 4.766 -37.915 6.847 1.00 75.54 H new ATOM 780 N VAL A 941 9.343 -39.311 3.404 1.00 23.04 N ATOM 781 CA VAL A 941 9.830 -40.141 2.316 1.00 60.15 C ATOM 782 C VAL A 941 8.935 -41.375 2.181 1.00 52.41 C ATOM 783 O VAL A 941 8.559 -41.985 3.180 1.00 30.33 O ATOM 784 CB VAL A 941 11.302 -40.492 2.543 1.00 73.52 C ATOM 785 CG1 VAL A 941 11.639 -41.857 1.938 1.00 4.31 C ATOM 786 CG2 VAL A 941 12.218 -39.403 1.983 1.00 2.54 C ATOM 0 H VAL A 941 9.652 -39.600 4.332 1.00 23.04 H new ATOM 0 HA VAL A 941 9.781 -39.599 1.372 1.00 60.15 H new ATOM 0 HB VAL A 941 11.471 -40.551 3.618 1.00 73.52 H new ATOM 0 HG11 VAL A 941 12.691 -42.083 2.113 1.00 4.31 H new ATOM 0 HG12 VAL A 941 11.021 -42.624 2.404 1.00 4.31 H new ATOM 0 HG13 VAL A 941 11.446 -41.837 0.865 1.00 4.31 H new ATOM 0 HG21 VAL A 941 13.258 -39.677 2.158 1.00 2.54 H new ATOM 0 HG22 VAL A 941 12.045 -39.298 0.912 1.00 2.54 H new ATOM 0 HG23 VAL A 941 12.004 -38.457 2.480 1.00 2.54 H new ATOM 796 N ARG A 942 8.619 -41.704 0.937 1.00 22.31 N ATOM 797 CA ARG A 942 7.775 -42.854 0.659 1.00 42.11 C ATOM 798 C ARG A 942 8.573 -43.933 -0.076 1.00 24.05 C ATOM 799 O ARG A 942 9.367 -43.627 -0.964 1.00 52.40 O ATOM 800 CB ARG A 942 6.566 -42.457 -0.190 1.00 42.25 C ATOM 801 CG ARG A 942 5.342 -43.301 0.169 1.00 21.34 C ATOM 802 CD ARG A 942 4.497 -42.613 1.243 1.00 2.40 C ATOM 803 NE ARG A 942 3.225 -43.345 1.433 1.00 42.31 N ATOM 804 CZ ARG A 942 2.352 -43.098 2.432 1.00 14.31 C ATOM 805 NH1 ARG A 942 2.606 -42.133 3.342 1.00 70.31 N ATOM 806 NH2 ARG A 942 1.245 -43.813 2.506 1.00 31.42 N ATOM 0 H ARG A 942 8.932 -41.195 0.111 1.00 22.31 H new ATOM 0 HA ARG A 942 7.422 -43.245 1.613 1.00 42.11 H new ATOM 0 HB2 ARG A 942 6.341 -41.401 -0.038 1.00 42.25 H new ATOM 0 HB3 ARG A 942 6.802 -42.584 -1.247 1.00 42.25 H new ATOM 0 HG2 ARG A 942 4.737 -43.469 -0.722 1.00 21.34 H new ATOM 0 HG3 ARG A 942 5.663 -44.280 0.525 1.00 21.34 H new ATOM 0 HD2 ARG A 942 5.048 -42.576 2.183 1.00 2.40 H new ATOM 0 HD3 ARG A 942 4.293 -41.583 0.952 1.00 2.40 H new ATOM 0 HE ARG A 942 2.994 -44.082 0.767 1.00 42.31 H new ATOM 0 HH11 ARG A 942 3.463 -41.584 3.277 1.00 70.31 H new ATOM 0 HH12 ARG A 942 1.941 -41.953 4.094 1.00 70.31 H new ATOM 0 HH21 ARG A 942 1.060 -44.539 1.814 1.00 31.42 H new ATOM 0 HH22 ARG A 942 0.575 -43.639 3.255 1.00 31.42 H new ATOM 819 N GLU A 943 8.336 -45.174 0.323 1.00 75.01 N ATOM 820 CA GLU A 943 9.022 -46.300 -0.286 1.00 64.33 C ATOM 821 C GLU A 943 8.693 -46.379 -1.778 1.00 74.23 C ATOM 822 O GLU A 943 7.600 -46.800 -2.155 1.00 30.54 O ATOM 823 CB GLU A 943 8.667 -47.608 0.424 1.00 63.24 C ATOM 824 CG GLU A 943 9.588 -48.744 -0.027 1.00 73.24 C ATOM 825 CD GLU A 943 8.884 -50.098 0.087 1.00 21.12 C ATOM 826 OE1 GLU A 943 8.177 -50.510 -0.844 1.00 60.14 O ATOM 827 OE2 GLU A 943 9.094 -50.730 1.192 1.00 12.33 O ATOM 0 H GLU A 943 7.678 -45.424 1.061 1.00 75.01 H new ATOM 0 HA GLU A 943 10.096 -46.147 -0.179 1.00 64.33 H new ATOM 0 HB2 GLU A 943 8.750 -47.475 1.503 1.00 63.24 H new ATOM 0 HB3 GLU A 943 7.630 -47.870 0.214 1.00 63.24 H new ATOM 0 HG2 GLU A 943 9.899 -48.577 -1.058 1.00 73.24 H new ATOM 0 HG3 GLU A 943 10.492 -48.748 0.582 1.00 73.24 H new ATOM 835 N ASN A 944 9.657 -45.967 -2.588 1.00 24.35 N ATOM 836 CA ASN A 944 9.483 -45.986 -4.030 1.00 22.10 C ATOM 837 C ASN A 944 10.856 -46.012 -4.705 1.00 0.31 C ATOM 838 O ASN A 944 11.642 -45.077 -4.558 1.00 14.33 O ATOM 839 CB ASN A 944 8.743 -44.737 -4.512 1.00 11.23 C ATOM 840 CG ASN A 944 8.856 -44.583 -6.030 1.00 23.43 C ATOM 841 OD1 ASN A 944 7.975 -44.959 -6.785 1.00 52.42 O ATOM 842 ND2 ASN A 944 9.988 -44.012 -6.433 1.00 31.54 N ATOM 0 H ASN A 944 10.562 -45.618 -2.273 1.00 24.35 H new ATOM 0 HA ASN A 944 8.902 -46.871 -4.288 1.00 22.10 H new ATOM 0 HB2 ASN A 944 7.693 -44.800 -4.227 1.00 11.23 H new ATOM 0 HB3 ASN A 944 9.154 -43.855 -4.022 1.00 11.23 H new ATOM 0 HD21 ASN A 944 10.159 -43.866 -7.428 1.00 31.54 H new ATOM 0 HD22 ASN A 944 10.684 -43.720 -5.747 1.00 31.54 H new ATOM 849 N LYS A 945 11.103 -47.092 -5.431 1.00 21.35 N ATOM 850 CA LYS A 945 12.367 -47.252 -6.128 1.00 65.15 C ATOM 851 C LYS A 945 12.276 -46.582 -7.501 1.00 12.22 C ATOM 852 O LYS A 945 13.280 -46.445 -8.197 1.00 64.33 O ATOM 853 CB LYS A 945 12.762 -48.729 -6.191 1.00 3.04 C ATOM 854 CG LYS A 945 11.642 -49.571 -6.806 1.00 3.51 C ATOM 855 CD LYS A 945 12.164 -50.404 -7.978 1.00 73.12 C ATOM 856 CE LYS A 945 11.009 -51.045 -8.751 1.00 24.40 C ATOM 857 NZ LYS A 945 10.940 -52.497 -8.469 1.00 10.30 N ATOM 0 H LYS A 945 10.449 -47.865 -5.552 1.00 21.35 H new ATOM 0 HA LYS A 945 13.168 -46.754 -5.581 1.00 65.15 H new ATOM 0 HB2 LYS A 945 13.672 -48.841 -6.781 1.00 3.04 H new ATOM 0 HB3 LYS A 945 12.986 -49.092 -5.188 1.00 3.04 H new ATOM 0 HG2 LYS A 945 11.218 -50.229 -6.047 1.00 3.51 H new ATOM 0 HG3 LYS A 945 10.838 -48.919 -7.148 1.00 3.51 H new ATOM 0 HD2 LYS A 945 12.748 -49.772 -8.647 1.00 73.12 H new ATOM 0 HD3 LYS A 945 12.834 -51.180 -7.608 1.00 73.12 H new ATOM 0 HE2 LYS A 945 10.069 -50.569 -8.472 1.00 24.40 H new ATOM 0 HE3 LYS A 945 11.144 -50.882 -9.820 1.00 24.40 H new ATOM 0 HZ1 LYS A 945 10.151 -52.917 -9.001 1.00 10.30 H new ATOM 0 HZ2 LYS A 945 11.831 -52.949 -8.757 1.00 10.30 H new ATOM 0 HZ3 LYS A 945 10.789 -52.646 -7.451 1.00 10.30 H new ATOM 870 N ALA A 946 11.062 -46.181 -7.848 1.00 74.32 N ATOM 871 CA ALA A 946 10.826 -45.529 -9.125 1.00 14.52 C ATOM 872 C ALA A 946 11.634 -44.231 -9.186 1.00 51.13 C ATOM 873 O ALA A 946 11.808 -43.654 -10.259 1.00 14.24 O ATOM 874 CB ALA A 946 9.325 -45.290 -9.307 1.00 23.12 C ATOM 0 H ALA A 946 10.231 -46.295 -7.267 1.00 74.32 H new ATOM 0 HA ALA A 946 11.157 -46.163 -9.947 1.00 14.52 H new ATOM 0 HB1 ALA A 946 9.148 -44.801 -10.265 1.00 23.12 H new ATOM 0 HB2 ALA A 946 8.799 -46.245 -9.284 1.00 23.12 H new ATOM 0 HB3 ALA A 946 8.958 -44.654 -8.502 1.00 23.12 H new ATOM 880 N LEU A 947 12.106 -43.810 -8.022 1.00 45.13 N ATOM 881 CA LEU A 947 12.892 -42.591 -7.930 1.00 63.13 C ATOM 882 C LEU A 947 14.363 -42.953 -7.713 1.00 50.24 C ATOM 883 O LEU A 947 15.220 -42.593 -8.519 1.00 72.23 O ATOM 884 CB LEU A 947 12.321 -41.666 -6.854 1.00 44.40 C ATOM 885 CG LEU A 947 11.268 -40.660 -7.324 1.00 31.32 C ATOM 886 CD1 LEU A 947 11.704 -39.974 -8.620 1.00 24.04 C ATOM 887 CD2 LEU A 947 9.897 -41.326 -7.461 1.00 64.35 C ATOM 0 H LEU A 947 11.959 -44.291 -7.135 1.00 45.13 H new ATOM 0 HA LEU A 947 12.836 -42.030 -8.863 1.00 63.13 H new ATOM 0 HB2 LEU A 947 11.882 -42.282 -6.069 1.00 44.40 H new ATOM 0 HB3 LEU A 947 13.146 -41.115 -6.402 1.00 44.40 H new ATOM 0 HG LEU A 947 11.175 -39.883 -6.565 1.00 31.32 H new ATOM 0 HD11 LEU A 947 10.938 -39.264 -8.932 1.00 24.04 H new ATOM 0 HD12 LEU A 947 12.642 -39.445 -8.454 1.00 24.04 H new ATOM 0 HD13 LEU A 947 11.843 -40.723 -9.399 1.00 24.04 H new ATOM 0 HD21 LEU A 947 9.167 -40.590 -7.796 1.00 64.35 H new ATOM 0 HD22 LEU A 947 9.957 -42.135 -8.189 1.00 64.35 H new ATOM 0 HD23 LEU A 947 9.590 -41.728 -6.496 1.00 64.35 H new ATOM 899 N GLN A 948 14.610 -43.660 -6.621 1.00 4.14 N ATOM 900 CA GLN A 948 15.963 -44.074 -6.287 1.00 73.35 C ATOM 901 C GLN A 948 16.378 -45.270 -7.146 1.00 61.43 C ATOM 902 O GLN A 948 15.547 -46.109 -7.492 1.00 64.11 O ATOM 903 CB GLN A 948 16.085 -44.400 -4.798 1.00 30.23 C ATOM 904 CG GLN A 948 15.746 -45.868 -4.528 1.00 0.43 C ATOM 905 CD GLN A 948 17.013 -46.684 -4.267 1.00 25.00 C ATOM 906 OE1 GLN A 948 17.021 -47.644 -3.514 1.00 13.23 O ATOM 907 NE2 GLN A 948 18.082 -46.251 -4.930 1.00 50.10 N ATOM 0 H GLN A 948 13.897 -43.957 -5.955 1.00 4.14 H new ATOM 0 HA GLN A 948 16.639 -43.246 -6.500 1.00 73.35 H new ATOM 0 HB2 GLN A 948 17.099 -44.189 -4.458 1.00 30.23 H new ATOM 0 HB3 GLN A 948 15.416 -43.757 -4.225 1.00 30.23 H new ATOM 0 HG2 GLN A 948 15.080 -45.939 -3.668 1.00 0.43 H new ATOM 0 HG3 GLN A 948 15.210 -46.284 -5.381 1.00 0.43 H new ATOM 0 HE21 GLN A 948 18.007 -45.441 -5.545 1.00 50.10 H new ATOM 0 HE22 GLN A 948 18.977 -46.729 -4.823 1.00 50.10 H new ATOM 1013 N GLN A 955 23.134 -41.918 -4.705 1.00 74.04 N ATOM 1014 CA GLN A 955 22.181 -42.844 -4.116 1.00 4.10 C ATOM 1015 C GLN A 955 20.996 -42.080 -3.523 1.00 32.21 C ATOM 1016 O GLN A 955 21.182 -41.120 -2.777 1.00 31.01 O ATOM 1017 CB GLN A 955 22.853 -43.721 -3.058 1.00 20.42 C ATOM 1018 CG GLN A 955 21.811 -44.455 -2.211 1.00 55.25 C ATOM 1019 CD GLN A 955 21.058 -45.492 -3.047 1.00 33.31 C ATOM 1020 OE1 GLN A 955 21.483 -45.892 -4.118 1.00 41.44 O ATOM 1021 NE2 GLN A 955 19.918 -45.905 -2.498 1.00 65.15 N ATOM 0 HA GLN A 955 21.808 -43.501 -4.902 1.00 4.10 H new ATOM 0 HB2 GLN A 955 23.508 -44.445 -3.543 1.00 20.42 H new ATOM 0 HB3 GLN A 955 23.481 -43.104 -2.415 1.00 20.42 H new ATOM 0 HG2 GLN A 955 22.301 -44.946 -1.370 1.00 55.25 H new ATOM 0 HG3 GLN A 955 21.105 -43.737 -1.793 1.00 55.25 H new ATOM 0 HE21 GLN A 955 19.620 -45.529 -1.598 1.00 65.15 H new ATOM 0 HE22 GLN A 955 19.342 -46.597 -2.977 1.00 65.15 H new ATOM 1030 N ILE A 956 19.803 -42.535 -3.877 1.00 31.33 N ATOM 1031 CA ILE A 956 18.587 -41.907 -3.389 1.00 1.13 C ATOM 1032 C ILE A 956 17.866 -42.868 -2.441 1.00 4.20 C ATOM 1033 O ILE A 956 18.085 -44.077 -2.493 1.00 60.10 O ATOM 1034 CB ILE A 956 17.722 -41.433 -4.559 1.00 3.15 C ATOM 1035 CG1 ILE A 956 18.584 -41.103 -5.779 1.00 50.00 C ATOM 1036 CG2 ILE A 956 16.839 -40.254 -4.145 1.00 10.01 C ATOM 1037 CD1 ILE A 956 19.368 -39.807 -5.563 1.00 11.04 C ATOM 0 H ILE A 956 19.653 -43.331 -4.496 1.00 31.33 H new ATOM 0 HA ILE A 956 18.825 -41.011 -2.815 1.00 1.13 H new ATOM 0 HB ILE A 956 17.057 -42.248 -4.845 1.00 3.15 H new ATOM 0 HG12 ILE A 956 19.276 -41.923 -5.972 1.00 50.00 H new ATOM 0 HG13 ILE A 956 17.951 -41.006 -6.661 1.00 50.00 H new ATOM 0 HG21 ILE A 956 16.234 -39.936 -4.994 1.00 10.01 H new ATOM 0 HG22 ILE A 956 16.185 -40.559 -3.328 1.00 10.01 H new ATOM 0 HG23 ILE A 956 17.468 -39.426 -3.817 1.00 10.01 H new ATOM 0 HD11 ILE A 956 19.972 -39.596 -6.445 1.00 11.04 H new ATOM 0 HD12 ILE A 956 18.673 -38.985 -5.394 1.00 11.04 H new ATOM 0 HD13 ILE A 956 20.019 -39.916 -4.695 1.00 11.04 H new ATOM 1049 N ASN A 957 17.022 -42.293 -1.597 1.00 71.50 N ATOM 1050 CA ASN A 957 16.268 -43.084 -0.639 1.00 13.11 C ATOM 1051 C ASN A 957 14.835 -43.262 -1.146 1.00 43.32 C ATOM 1052 O ASN A 957 14.163 -44.228 -0.791 1.00 34.12 O ATOM 1053 CB ASN A 957 16.204 -42.387 0.722 1.00 44.15 C ATOM 1054 CG ASN A 957 17.346 -42.850 1.628 1.00 3.35 C ATOM 1055 OD1 ASN A 957 17.203 -42.981 2.833 1.00 11.40 O ATOM 1056 ND2 ASN A 957 18.485 -43.089 0.985 1.00 61.52 N ATOM 0 H ASN A 957 16.844 -41.290 -1.557 1.00 71.50 H new ATOM 0 HA ASN A 957 16.768 -44.046 -0.529 1.00 13.11 H new ATOM 0 HB2 ASN A 957 16.259 -41.307 0.585 1.00 44.15 H new ATOM 0 HB3 ASN A 957 15.247 -42.600 1.199 1.00 44.15 H new ATOM 0 HD21 ASN A 957 19.307 -43.402 1.502 1.00 61.52 H new ATOM 0 HD22 ASN A 957 18.537 -42.959 -0.025 1.00 61.52 H new ATOM 1063 N GLY A 958 14.411 -42.314 -1.969 1.00 41.02 N ATOM 1064 CA GLY A 958 13.071 -42.354 -2.529 1.00 12.21 C ATOM 1065 C GLY A 958 12.634 -40.967 -3.005 1.00 13.35 C ATOM 1066 O GLY A 958 13.414 -40.244 -3.623 1.00 20.14 O ATOM 0 H GLY A 958 14.972 -41.514 -2.261 1.00 41.02 H new ATOM 0 HA2 GLY A 958 13.043 -43.054 -3.364 1.00 12.21 H new ATOM 0 HA3 GLY A 958 12.371 -42.723 -1.780 1.00 12.21 H new ATOM 1070 N GLU A 959 11.388 -40.637 -2.698 1.00 53.42 N ATOM 1071 CA GLU A 959 10.838 -39.349 -3.087 1.00 34.04 C ATOM 1072 C GLU A 959 10.280 -38.619 -1.863 1.00 75.41 C ATOM 1073 O GLU A 959 9.527 -39.198 -1.080 1.00 45.04 O ATOM 1074 CB GLU A 959 9.764 -39.514 -4.164 1.00 35.14 C ATOM 1075 CG GLU A 959 9.675 -38.267 -5.046 1.00 2.04 C ATOM 1076 CD GLU A 959 8.409 -38.292 -5.905 1.00 3.54 C ATOM 1077 OE1 GLU A 959 8.494 -38.176 -7.136 1.00 54.53 O ATOM 1078 OE2 GLU A 959 7.308 -38.439 -5.249 1.00 2.41 O ATOM 0 H GLU A 959 10.744 -41.239 -2.185 1.00 53.42 H new ATOM 0 HA GLU A 959 11.641 -38.746 -3.511 1.00 34.04 H new ATOM 0 HB2 GLU A 959 9.992 -40.384 -4.780 1.00 35.14 H new ATOM 0 HB3 GLU A 959 8.798 -39.701 -3.694 1.00 35.14 H new ATOM 0 HG2 GLU A 959 9.677 -37.374 -4.421 1.00 2.04 H new ATOM 0 HG3 GLU A 959 10.554 -38.208 -5.688 1.00 2.04 H new ATOM 1086 N ILE A 960 10.669 -37.359 -1.736 1.00 64.54 N ATOM 1087 CA ILE A 960 10.217 -36.545 -0.621 1.00 44.34 C ATOM 1088 C ILE A 960 8.875 -35.903 -0.976 1.00 14.42 C ATOM 1089 O ILE A 960 8.720 -35.334 -2.056 1.00 20.43 O ATOM 1090 CB ILE A 960 11.296 -35.535 -0.224 1.00 30.02 C ATOM 1091 CG1 ILE A 960 11.851 -34.813 -1.453 1.00 53.42 C ATOM 1092 CG2 ILE A 960 12.401 -36.207 0.594 1.00 42.24 C ATOM 1093 CD1 ILE A 960 12.428 -33.447 -1.073 1.00 74.51 C ATOM 0 H ILE A 960 11.292 -36.882 -2.387 1.00 64.54 H new ATOM 0 HA ILE A 960 10.052 -37.164 0.261 1.00 44.34 H new ATOM 0 HB ILE A 960 10.838 -34.779 0.413 1.00 30.02 H new ATOM 0 HG12 ILE A 960 12.626 -35.422 -1.918 1.00 53.42 H new ATOM 0 HG13 ILE A 960 11.060 -34.685 -2.192 1.00 53.42 H new ATOM 0 HG21 ILE A 960 13.155 -35.468 0.863 1.00 42.24 H new ATOM 0 HG22 ILE A 960 11.973 -36.636 1.500 1.00 42.24 H new ATOM 0 HG23 ILE A 960 12.863 -36.997 0.002 1.00 42.24 H new ATOM 0 HD11 ILE A 960 12.816 -32.955 -1.965 1.00 74.51 H new ATOM 0 HD12 ILE A 960 11.645 -32.832 -0.631 1.00 74.51 H new ATOM 0 HD13 ILE A 960 13.235 -33.581 -0.353 1.00 74.51 H new ATOM 1105 N ILE A 961 7.938 -36.015 -0.046 1.00 14.42 N ATOM 1106 CA ILE A 961 6.613 -35.452 -0.247 1.00 20.15 C ATOM 1107 C ILE A 961 6.189 -34.694 1.013 1.00 24.02 C ATOM 1108 O ILE A 961 6.488 -35.120 2.128 1.00 50.41 O ATOM 1109 CB ILE A 961 5.626 -36.542 -0.669 1.00 63.42 C ATOM 1110 CG1 ILE A 961 5.666 -37.724 0.302 1.00 72.00 C ATOM 1111 CG2 ILE A 961 5.878 -36.979 -2.114 1.00 33.11 C ATOM 1112 CD1 ILE A 961 4.590 -38.755 -0.045 1.00 62.33 C ATOM 0 H ILE A 961 8.070 -36.487 0.849 1.00 14.42 H new ATOM 0 HA ILE A 961 6.626 -34.731 -1.065 1.00 20.15 H new ATOM 0 HB ILE A 961 4.619 -36.126 -0.628 1.00 63.42 H new ATOM 0 HG12 ILE A 961 6.649 -38.194 0.269 1.00 72.00 H new ATOM 0 HG13 ILE A 961 5.518 -37.367 1.321 1.00 72.00 H new ATOM 0 HG21 ILE A 961 5.163 -37.754 -2.389 1.00 33.11 H new ATOM 0 HG22 ILE A 961 5.759 -36.123 -2.779 1.00 33.11 H new ATOM 0 HG23 ILE A 961 6.891 -37.371 -2.204 1.00 33.11 H new ATOM 0 HD11 ILE A 961 4.640 -39.585 0.660 1.00 62.33 H new ATOM 0 HD12 ILE A 961 3.607 -38.288 0.013 1.00 62.33 H new ATOM 0 HD13 ILE A 961 4.756 -39.128 -1.056 1.00 62.33 H new ATOM 1124 N CYS A 962 5.500 -33.584 0.793 1.00 22.05 N ATOM 1125 CA CYS A 962 5.032 -32.763 1.897 1.00 5.31 C ATOM 1126 C CYS A 962 4.069 -33.598 2.742 1.00 15.44 C ATOM 1127 O CYS A 962 3.891 -34.789 2.493 1.00 22.03 O ATOM 1128 CB CYS A 962 4.384 -31.468 1.403 1.00 0.14 C ATOM 1129 SG CYS A 962 2.591 -31.590 1.060 1.00 34.04 S ATOM 0 H CYS A 962 5.255 -33.234 -0.133 1.00 22.05 H new ATOM 0 HA CYS A 962 5.879 -32.457 2.511 1.00 5.31 H new ATOM 0 HB2 CYS A 962 4.545 -30.690 2.149 1.00 0.14 H new ATOM 0 HB3 CYS A 962 4.893 -31.147 0.494 1.00 0.14 H new ATOM 0 HG CYS A 962 2.186 -30.501 0.476 1.00 34.04 H new ATOM 1134 N LYS A 963 3.471 -32.939 3.725 1.00 71.33 N ATOM 1135 CA LYS A 963 2.529 -33.606 4.608 1.00 5.11 C ATOM 1136 C LYS A 963 1.364 -34.156 3.783 1.00 2.11 C ATOM 1137 O LYS A 963 1.022 -35.332 3.893 1.00 62.34 O ATOM 1138 CB LYS A 963 2.096 -32.667 5.736 1.00 54.05 C ATOM 1139 CG LYS A 963 3.289 -31.883 6.286 1.00 72.11 C ATOM 1140 CD LYS A 963 4.497 -32.798 6.494 1.00 62.22 C ATOM 1141 CE LYS A 963 4.287 -33.718 7.698 1.00 25.11 C ATOM 1142 NZ LYS A 963 3.187 -34.672 7.436 1.00 33.21 N ATOM 0 H LYS A 963 3.621 -31.951 3.929 1.00 71.33 H new ATOM 0 HA LYS A 963 3.002 -34.457 5.097 1.00 5.11 H new ATOM 0 HB2 LYS A 963 1.340 -31.974 5.367 1.00 54.05 H new ATOM 0 HB3 LYS A 963 1.635 -33.244 6.538 1.00 54.05 H new ATOM 0 HG2 LYS A 963 3.551 -31.081 5.596 1.00 72.11 H new ATOM 0 HG3 LYS A 963 3.016 -31.414 7.232 1.00 72.11 H new ATOM 0 HD2 LYS A 963 4.662 -33.397 5.599 1.00 62.22 H new ATOM 0 HD3 LYS A 963 5.393 -32.195 6.644 1.00 62.22 H new ATOM 0 HE2 LYS A 963 5.206 -34.264 7.911 1.00 25.11 H new ATOM 0 HE3 LYS A 963 4.057 -33.123 8.582 1.00 25.11 H new ATOM 0 HZ1 LYS A 963 3.387 -35.573 7.916 1.00 33.21 H new ATOM 0 HZ2 LYS A 963 2.294 -34.279 7.796 1.00 33.21 H new ATOM 0 HZ3 LYS A 963 3.106 -34.835 6.412 1.00 33.21 H new ATOM 1155 N CYS A 964 0.787 -33.278 2.976 1.00 74.43 N ATOM 1156 CA CYS A 964 -0.333 -33.661 2.132 1.00 31.45 C ATOM 1157 C CYS A 964 0.098 -34.852 1.273 1.00 13.41 C ATOM 1158 O CYS A 964 -0.684 -35.775 1.049 1.00 44.34 O ATOM 1159 CB CYS A 964 -0.825 -32.490 1.280 1.00 75.32 C ATOM 1160 SG CYS A 964 -0.948 -30.894 2.166 1.00 34.02 S ATOM 0 H CYS A 964 1.074 -32.303 2.888 1.00 74.43 H new ATOM 0 HA CYS A 964 -1.179 -33.952 2.755 1.00 31.45 H new ATOM 0 HB2 CYS A 964 -0.151 -32.368 0.432 1.00 75.32 H new ATOM 0 HB3 CYS A 964 -1.805 -32.741 0.874 1.00 75.32 H new ATOM 1165 N GLY A 965 1.340 -34.792 0.816 1.00 53.42 N ATOM 1166 CA GLY A 965 1.884 -35.853 -0.014 1.00 32.10 C ATOM 1167 C GLY A 965 2.267 -35.325 -1.398 1.00 61.40 C ATOM 1168 O GLY A 965 2.090 -36.016 -2.401 1.00 11.35 O ATOM 0 H GLY A 965 1.985 -34.025 1.005 1.00 53.42 H new ATOM 0 HA2 GLY A 965 2.760 -36.285 0.470 1.00 32.10 H new ATOM 0 HA3 GLY A 965 1.150 -36.652 -0.116 1.00 32.10 H new ATOM 1172 N GLN A 966 2.785 -34.106 -1.409 1.00 25.15 N ATOM 1173 CA GLN A 966 3.195 -33.478 -2.653 1.00 4.21 C ATOM 1174 C GLN A 966 4.698 -33.665 -2.872 1.00 71.24 C ATOM 1175 O GLN A 966 5.508 -33.198 -2.074 1.00 5.11 O ATOM 1176 CB GLN A 966 2.820 -31.995 -2.668 1.00 52.31 C ATOM 1177 CG GLN A 966 3.491 -31.271 -3.837 1.00 73.14 C ATOM 1178 CD GLN A 966 2.946 -31.771 -5.177 1.00 31.42 C ATOM 1179 OE1 GLN A 966 2.043 -32.589 -5.243 1.00 13.14 O ATOM 1180 NE2 GLN A 966 3.544 -31.236 -6.238 1.00 34.43 N ATOM 0 H GLN A 966 2.930 -33.536 -0.576 1.00 25.15 H new ATOM 0 HA GLN A 966 2.665 -33.962 -3.473 1.00 4.21 H new ATOM 0 HB2 GLN A 966 1.738 -31.891 -2.744 1.00 52.31 H new ATOM 0 HB3 GLN A 966 3.120 -31.531 -1.728 1.00 52.31 H new ATOM 0 HG2 GLN A 966 3.323 -30.198 -3.750 1.00 73.14 H new ATOM 0 HG3 GLN A 966 4.569 -31.429 -3.797 1.00 73.14 H new ATOM 0 HE21 GLN A 966 4.294 -30.556 -6.112 1.00 34.43 H new ATOM 0 HE22 GLN A 966 3.253 -31.506 -7.178 1.00 34.43 H new ATOM 1189 N ALA A 967 5.024 -34.350 -3.959 1.00 0.31 N ATOM 1190 CA ALA A 967 6.415 -34.605 -4.293 1.00 51.44 C ATOM 1191 C ALA A 967 7.193 -33.288 -4.257 1.00 3.13 C ATOM 1192 O ALA A 967 7.156 -32.514 -5.212 1.00 0.21 O ATOM 1193 CB ALA A 967 6.494 -35.291 -5.659 1.00 2.05 C ATOM 0 H ALA A 967 4.349 -34.736 -4.619 1.00 0.31 H new ATOM 0 HA ALA A 967 6.868 -35.276 -3.564 1.00 51.44 H new ATOM 0 HB1 ALA A 967 7.537 -35.483 -5.910 1.00 2.05 H new ATOM 0 HB2 ALA A 967 5.950 -36.235 -5.624 1.00 2.05 H new ATOM 0 HB3 ALA A 967 6.051 -34.645 -6.417 1.00 2.05 H new ATOM 1199 N TRP A 968 7.880 -33.074 -3.144 1.00 63.51 N ATOM 1200 CA TRP A 968 8.666 -31.865 -2.970 1.00 44.24 C ATOM 1201 C TRP A 968 9.898 -31.967 -3.873 1.00 75.30 C ATOM 1202 O TRP A 968 10.400 -30.956 -4.360 1.00 44.02 O ATOM 1203 CB TRP A 968 9.021 -31.648 -1.498 1.00 70.20 C ATOM 1204 CG TRP A 968 7.996 -30.813 -0.727 1.00 62.34 C ATOM 1205 CD1 TRP A 968 6.967 -30.110 -1.220 1.00 21.24 C ATOM 1206 CD2 TRP A 968 7.943 -30.622 0.702 1.00 4.01 C ATOM 1207 NE1 TRP A 968 6.258 -29.482 -0.216 1.00 73.11 N ATOM 1208 CE2 TRP A 968 6.870 -29.803 0.990 1.00 63.44 C ATOM 1209 CE3 TRP A 968 8.775 -31.124 1.719 1.00 72.24 C ATOM 1210 CZ2 TRP A 968 6.530 -29.414 2.291 1.00 73.43 C ATOM 1211 CZ3 TRP A 968 8.421 -30.726 3.014 1.00 61.25 C ATOM 1212 CH2 TRP A 968 7.344 -29.903 3.320 1.00 41.45 C ATOM 0 H TRP A 968 7.908 -33.718 -2.354 1.00 63.51 H new ATOM 0 HA TRP A 968 8.091 -30.987 -3.263 1.00 44.24 H new ATOM 0 HB2 TRP A 968 9.123 -32.619 -1.013 1.00 70.20 H new ATOM 0 HB3 TRP A 968 9.993 -31.158 -1.438 1.00 70.20 H new ATOM 0 HD1 TRP A 968 6.723 -30.043 -2.270 1.00 21.24 H new ATOM 0 HE1 TRP A 968 5.436 -28.891 -0.337 1.00 73.11 H new ATOM 0 HE3 TRP A 968 9.620 -31.766 1.517 1.00 72.24 H new ATOM 0 HZ2 TRP A 968 5.685 -28.771 2.490 1.00 73.43 H new ATOM 0 HZ3 TRP A 968 9.028 -31.084 3.833 1.00 61.25 H new ATOM 0 HH2 TRP A 968 7.136 -29.642 4.347 1.00 41.45 H new ATOM 1223 N GLY A 969 10.347 -33.198 -4.069 1.00 4.03 N ATOM 1224 CA GLY A 969 11.510 -33.446 -4.904 1.00 42.21 C ATOM 1225 C GLY A 969 12.021 -34.876 -4.722 1.00 63.42 C ATOM 1226 O GLY A 969 11.276 -35.835 -4.917 1.00 32.21 O ATOM 0 H GLY A 969 9.926 -34.034 -3.664 1.00 4.03 H new ATOM 0 HA2 GLY A 969 11.253 -33.278 -5.950 1.00 42.21 H new ATOM 0 HA3 GLY A 969 12.300 -32.739 -4.652 1.00 42.21 H new ATOM 1230 N THR A 970 13.289 -34.975 -4.351 1.00 2.02 N ATOM 1231 CA THR A 970 13.909 -36.272 -4.140 1.00 73.44 C ATOM 1232 C THR A 970 14.993 -36.178 -3.065 1.00 12.40 C ATOM 1233 O THR A 970 15.624 -35.134 -2.905 1.00 61.11 O ATOM 1234 CB THR A 970 14.432 -36.771 -5.489 1.00 5.51 C ATOM 1235 OG1 THR A 970 14.777 -35.578 -6.189 1.00 74.44 O ATOM 1236 CG2 THR A 970 13.334 -37.403 -6.346 1.00 42.33 C ATOM 0 H THR A 970 13.904 -34.177 -4.191 1.00 2.02 H new ATOM 0 HA THR A 970 13.188 -36.998 -3.766 1.00 73.44 H new ATOM 0 HB THR A 970 15.226 -37.499 -5.324 1.00 5.51 H new ATOM 0 HG1 THR A 970 15.127 -35.808 -7.075 1.00 74.44 H new ATOM 0 HG21 THR A 970 13.759 -37.740 -7.292 1.00 42.33 H new ATOM 0 HG22 THR A 970 12.905 -38.254 -5.818 1.00 42.33 H new ATOM 0 HG23 THR A 970 12.555 -36.666 -6.541 1.00 42.33 H new ATOM 1244 N MET A 971 15.175 -37.281 -2.355 1.00 64.43 N ATOM 1245 CA MET A 971 16.172 -37.336 -1.299 1.00 62.05 C ATOM 1246 C MET A 971 17.470 -37.971 -1.803 1.00 42.41 C ATOM 1247 O MET A 971 17.620 -39.191 -1.776 1.00 73.22 O ATOM 1248 CB MET A 971 15.628 -38.151 -0.125 1.00 14.13 C ATOM 1249 CG MET A 971 16.744 -38.507 0.859 1.00 33.35 C ATOM 1250 SD MET A 971 17.669 -37.043 1.290 1.00 52.32 S ATOM 1251 CE MET A 971 16.364 -36.046 1.989 1.00 55.35 C ATOM 0 H MET A 971 14.649 -38.144 -2.490 1.00 64.43 H new ATOM 0 HA MET A 971 16.389 -36.318 -0.976 1.00 62.05 H new ATOM 0 HB2 MET A 971 14.853 -37.582 0.389 1.00 14.13 H new ATOM 0 HB3 MET A 971 15.161 -39.063 -0.496 1.00 14.13 H new ATOM 0 HG2 MET A 971 16.319 -38.956 1.757 1.00 33.35 H new ATOM 0 HG3 MET A 971 17.408 -39.249 0.415 1.00 33.35 H new ATOM 0 HE1 MET A 971 16.796 -35.178 2.486 1.00 55.35 H new ATOM 0 HE2 MET A 971 15.695 -35.714 1.195 1.00 55.35 H new ATOM 0 HE3 MET A 971 15.803 -36.637 2.713 1.00 55.35 H new ATOM 1261 N MET A 972 18.376 -37.113 -2.251 1.00 33.34 N ATOM 1262 CA MET A 972 19.656 -37.575 -2.760 1.00 1.25 C ATOM 1263 C MET A 972 20.636 -37.843 -1.616 1.00 24.02 C ATOM 1264 O MET A 972 20.591 -37.174 -0.585 1.00 11.23 O ATOM 1265 CB MET A 972 20.243 -36.519 -3.698 1.00 42.12 C ATOM 1266 CG MET A 972 19.749 -36.724 -5.132 1.00 12.14 C ATOM 1267 SD MET A 972 19.970 -35.224 -6.074 1.00 33.11 S ATOM 1268 CE MET A 972 21.669 -34.853 -5.671 1.00 54.45 C ATOM 0 H MET A 972 18.249 -36.101 -2.272 1.00 33.34 H new ATOM 0 HA MET A 972 19.496 -38.507 -3.302 1.00 1.25 H new ATOM 0 HB2 MET A 972 19.963 -35.524 -3.352 1.00 42.12 H new ATOM 0 HB3 MET A 972 21.332 -36.570 -3.674 1.00 42.12 H new ATOM 0 HG2 MET A 972 20.297 -37.542 -5.601 1.00 12.14 H new ATOM 0 HG3 MET A 972 18.697 -37.008 -5.126 1.00 12.14 H new ATOM 0 HE1 MET A 972 22.087 -34.192 -6.430 1.00 54.45 H new ATOM 0 HE2 MET A 972 21.714 -34.362 -4.699 1.00 54.45 H new ATOM 0 HE3 MET A 972 22.245 -35.778 -5.638 1.00 54.45 H new ATOM 1278 N VAL A 973 21.500 -38.823 -1.837 1.00 32.44 N ATOM 1279 CA VAL A 973 22.489 -39.188 -0.837 1.00 64.42 C ATOM 1280 C VAL A 973 23.887 -39.099 -1.453 1.00 41.33 C ATOM 1281 O VAL A 973 24.068 -39.386 -2.636 1.00 32.35 O ATOM 1282 CB VAL A 973 22.174 -40.574 -0.270 1.00 10.11 C ATOM 1283 CG1 VAL A 973 22.946 -40.824 1.027 1.00 12.22 C ATOM 1284 CG2 VAL A 973 20.669 -40.749 -0.055 1.00 43.31 C ATOM 0 H VAL A 973 21.536 -39.375 -2.694 1.00 32.44 H new ATOM 0 HA VAL A 973 22.457 -38.493 0.002 1.00 64.42 H new ATOM 0 HB VAL A 973 22.497 -41.316 -1.000 1.00 10.11 H new ATOM 0 HG11 VAL A 973 22.704 -41.816 1.409 1.00 12.22 H new ATOM 0 HG12 VAL A 973 24.016 -40.762 0.831 1.00 12.22 H new ATOM 0 HG13 VAL A 973 22.668 -40.073 1.766 1.00 12.22 H new ATOM 0 HG21 VAL A 973 20.472 -41.742 0.348 1.00 43.31 H new ATOM 0 HG22 VAL A 973 20.312 -39.995 0.646 1.00 43.31 H new ATOM 0 HG23 VAL A 973 20.150 -40.635 -1.007 1.00 43.31 H new ATOM 1294 N HIS A 974 24.840 -38.699 -0.624 1.00 52.52 N ATOM 1295 CA HIS A 974 26.216 -38.567 -1.073 1.00 33.44 C ATOM 1296 C HIS A 974 27.153 -39.204 -0.045 1.00 24.21 C ATOM 1297 O HIS A 974 27.460 -38.598 0.980 1.00 2.05 O ATOM 1298 CB HIS A 974 26.556 -37.104 -1.359 1.00 44.42 C ATOM 1299 CG HIS A 974 28.038 -36.810 -1.379 1.00 33.34 C ATOM 1300 ND1 HIS A 974 28.836 -36.909 -0.253 1.00 23.33 N ATOM 1301 CD2 HIS A 974 28.856 -36.421 -2.398 1.00 71.12 C ATOM 1302 CE1 HIS A 974 30.077 -36.591 -0.591 1.00 1.23 C ATOM 1303 NE2 HIS A 974 30.087 -36.288 -1.921 1.00 21.04 N ATOM 0 H HIS A 974 24.687 -38.462 0.356 1.00 52.52 H new ATOM 0 HA HIS A 974 26.349 -39.100 -2.014 1.00 33.44 H new ATOM 0 HB2 HIS A 974 26.127 -36.823 -2.321 1.00 44.42 H new ATOM 0 HB3 HIS A 974 26.082 -36.477 -0.604 1.00 44.42 H new ATOM 0 HD1 HIS A 974 28.522 -37.181 0.679 1.00 23.33 H new ATOM 0 HD2 HIS A 974 28.553 -36.250 -3.420 1.00 71.12 H new ATOM 0 HE1 HIS A 974 30.931 -36.575 0.070 1.00 1.23 H new ATOM 1311 N LYS A 975 27.582 -40.419 -0.356 1.00 4.45 N ATOM 1312 CA LYS A 975 28.479 -41.144 0.528 1.00 31.42 C ATOM 1313 C LYS A 975 27.792 -41.361 1.878 1.00 23.21 C ATOM 1314 O LYS A 975 28.457 -41.595 2.886 1.00 21.52 O ATOM 1315 CB LYS A 975 29.826 -40.427 0.632 1.00 42.14 C ATOM 1316 CG LYS A 975 30.306 -39.960 -0.744 1.00 71.12 C ATOM 1317 CD LYS A 975 31.834 -39.958 -0.821 1.00 20.34 C ATOM 1318 CE LYS A 975 32.312 -39.621 -2.234 1.00 51.52 C ATOM 1319 NZ LYS A 975 31.611 -40.459 -3.232 1.00 64.24 N ATOM 0 H LYS A 975 27.325 -40.919 -1.207 1.00 4.45 H new ATOM 0 HA LYS A 975 28.701 -42.130 0.120 1.00 31.42 H new ATOM 0 HB2 LYS A 975 29.735 -39.570 1.300 1.00 42.14 H new ATOM 0 HB3 LYS A 975 30.566 -41.097 1.071 1.00 42.14 H new ATOM 0 HG2 LYS A 975 29.900 -40.614 -1.516 1.00 71.12 H new ATOM 0 HG3 LYS A 975 29.927 -38.958 -0.944 1.00 71.12 H new ATOM 0 HD2 LYS A 975 32.236 -39.232 -0.115 1.00 20.34 H new ATOM 0 HD3 LYS A 975 32.218 -40.935 -0.527 1.00 20.34 H new ATOM 0 HE2 LYS A 975 32.131 -38.567 -2.444 1.00 51.52 H new ATOM 0 HE3 LYS A 975 33.388 -39.780 -2.308 1.00 51.52 H new ATOM 0 HZ1 LYS A 975 32.219 -40.587 -4.066 1.00 64.24 H new ATOM 0 HZ2 LYS A 975 31.394 -41.387 -2.815 1.00 64.24 H new ATOM 0 HZ3 LYS A 975 30.726 -39.992 -3.517 1.00 64.24 H new ATOM 1332 N GLY A 976 26.470 -41.275 1.854 1.00 24.32 N ATOM 1333 CA GLY A 976 25.686 -41.459 3.064 1.00 64.23 C ATOM 1334 C GLY A 976 25.149 -40.122 3.577 1.00 11.14 C ATOM 1335 O GLY A 976 24.566 -40.057 4.658 1.00 33.24 O ATOM 0 H GLY A 976 25.922 -41.080 1.016 1.00 24.32 H new ATOM 0 HA2 GLY A 976 24.855 -42.136 2.864 1.00 64.23 H new ATOM 0 HA3 GLY A 976 26.301 -41.927 3.833 1.00 64.23 H new ATOM 1339 N LEU A 977 25.365 -39.088 2.778 1.00 54.40 N ATOM 1340 CA LEU A 977 24.909 -37.756 3.138 1.00 1.42 C ATOM 1341 C LEU A 977 23.414 -37.633 2.835 1.00 24.12 C ATOM 1342 O LEU A 977 22.847 -38.474 2.140 1.00 64.44 O ATOM 1343 CB LEU A 977 25.766 -36.692 2.449 1.00 55.35 C ATOM 1344 CG LEU A 977 25.726 -35.293 3.068 1.00 31.43 C ATOM 1345 CD1 LEU A 977 25.831 -35.366 4.593 1.00 72.32 C ATOM 1346 CD2 LEU A 977 26.805 -34.394 2.462 1.00 71.02 C ATOM 0 H LEU A 977 25.850 -39.145 1.882 1.00 54.40 H new ATOM 0 HA LEU A 977 25.032 -37.588 4.208 1.00 1.42 H new ATOM 0 HB2 LEU A 977 26.800 -37.035 2.443 1.00 55.35 H new ATOM 0 HB3 LEU A 977 25.449 -36.616 1.409 1.00 55.35 H new ATOM 0 HG LEU A 977 24.762 -34.842 2.832 1.00 31.43 H new ATOM 0 HD11 LEU A 977 25.800 -34.359 5.008 1.00 72.32 H new ATOM 0 HD12 LEU A 977 24.997 -35.947 4.988 1.00 72.32 H new ATOM 0 HD13 LEU A 977 26.770 -35.844 4.871 1.00 72.32 H new ATOM 0 HD21 LEU A 977 26.754 -33.406 2.919 1.00 71.02 H new ATOM 0 HD22 LEU A 977 27.787 -34.829 2.646 1.00 71.02 H new ATOM 0 HD23 LEU A 977 26.643 -34.305 1.388 1.00 71.02 H new ATOM 1358 N ASP A 978 22.819 -36.579 3.372 1.00 12.44 N ATOM 1359 CA ASP A 978 21.401 -36.335 3.168 1.00 31.22 C ATOM 1360 C ASP A 978 21.211 -34.956 2.535 1.00 53.43 C ATOM 1361 O ASP A 978 21.268 -33.939 3.224 1.00 1.43 O ATOM 1362 CB ASP A 978 20.642 -36.354 4.497 1.00 70.15 C ATOM 1363 CG ASP A 978 20.510 -37.733 5.146 1.00 34.01 C ATOM 1364 OD1 ASP A 978 19.738 -37.919 6.099 1.00 53.14 O ATOM 1365 OD2 ASP A 978 21.251 -38.653 4.628 1.00 32.02 O ATOM 0 H ASP A 978 23.293 -35.884 3.948 1.00 12.44 H new ATOM 0 HA ASP A 978 21.014 -37.121 2.520 1.00 31.22 H new ATOM 0 HB2 ASP A 978 21.146 -35.687 5.196 1.00 70.15 H new ATOM 0 HB3 ASP A 978 19.643 -35.949 4.334 1.00 70.15 H new ATOM 1371 N LEU A 979 20.988 -34.965 1.229 1.00 62.14 N ATOM 1372 CA LEU A 979 20.789 -33.727 0.494 1.00 22.13 C ATOM 1373 C LEU A 979 19.456 -33.791 -0.253 1.00 72.32 C ATOM 1374 O LEU A 979 19.380 -34.345 -1.349 1.00 3.01 O ATOM 1375 CB LEU A 979 21.989 -33.443 -0.412 1.00 0.24 C ATOM 1376 CG LEU A 979 23.333 -34.001 0.061 1.00 41.24 C ATOM 1377 CD1 LEU A 979 23.563 -35.412 -0.484 1.00 35.02 C ATOM 1378 CD2 LEU A 979 24.478 -33.053 -0.302 1.00 62.24 C ATOM 0 H LEU A 979 20.941 -35.810 0.660 1.00 62.14 H new ATOM 0 HA LEU A 979 20.730 -32.882 1.180 1.00 22.13 H new ATOM 0 HB2 LEU A 979 21.777 -33.850 -1.401 1.00 0.24 H new ATOM 0 HB3 LEU A 979 22.086 -32.363 -0.526 1.00 0.24 H new ATOM 0 HG LEU A 979 23.309 -34.076 1.148 1.00 41.24 H new ATOM 0 HD11 LEU A 979 24.525 -35.785 -0.133 1.00 35.02 H new ATOM 0 HD12 LEU A 979 22.768 -36.071 -0.134 1.00 35.02 H new ATOM 0 HD13 LEU A 979 23.560 -35.386 -1.574 1.00 35.02 H new ATOM 0 HD21 LEU A 979 25.422 -33.473 0.045 1.00 62.24 H new ATOM 0 HD22 LEU A 979 24.514 -32.924 -1.384 1.00 62.24 H new ATOM 0 HD23 LEU A 979 24.314 -32.086 0.173 1.00 62.24 H new ATOM 1390 N PRO A 980 18.410 -33.202 0.386 1.00 51.23 N ATOM 1391 CA PRO A 980 17.083 -33.187 -0.207 1.00 3.31 C ATOM 1392 C PRO A 980 17.004 -32.171 -1.348 1.00 11.50 C ATOM 1393 O PRO A 980 17.159 -30.970 -1.127 1.00 71.42 O ATOM 1394 CB PRO A 980 16.143 -32.864 0.943 1.00 54.15 C ATOM 1395 CG PRO A 980 17.010 -32.255 2.032 1.00 13.42 C ATOM 1396 CD PRO A 980 18.462 -32.536 1.684 1.00 22.52 C ATOM 0 HA PRO A 980 16.816 -34.139 -0.667 1.00 3.31 H new ATOM 0 HB2 PRO A 980 15.365 -32.168 0.628 1.00 54.15 H new ATOM 0 HB3 PRO A 980 15.641 -33.763 1.301 1.00 54.15 H new ATOM 0 HG2 PRO A 980 16.835 -31.181 2.103 1.00 13.42 H new ATOM 0 HG3 PRO A 980 16.760 -32.683 3.003 1.00 13.42 H new ATOM 0 HD2 PRO A 980 19.042 -31.615 1.633 1.00 22.52 H new ATOM 0 HD3 PRO A 980 18.934 -33.169 2.435 1.00 22.52 H new ATOM 1404 N CYS A 981 16.762 -32.689 -2.543 1.00 44.53 N ATOM 1405 CA CYS A 981 16.660 -31.841 -3.719 1.00 64.44 C ATOM 1406 C CYS A 981 15.179 -31.577 -3.994 1.00 33.01 C ATOM 1407 O CYS A 981 14.468 -32.454 -4.483 1.00 22.25 O ATOM 1408 CB CYS A 981 17.363 -32.464 -4.928 1.00 34.23 C ATOM 1409 SG CYS A 981 19.105 -31.909 -4.994 1.00 0.22 S ATOM 0 H CYS A 981 16.634 -33.685 -2.723 1.00 44.53 H new ATOM 0 HA CYS A 981 17.168 -30.895 -3.533 1.00 64.44 H new ATOM 0 HB2 CYS A 981 17.321 -33.551 -4.863 1.00 34.23 H new ATOM 0 HB3 CYS A 981 16.847 -32.180 -5.845 1.00 34.23 H new ATOM 0 HG CYS A 981 19.855 -32.883 -5.418 1.00 0.22 H new ATOM 1415 N LEU A 982 14.756 -30.364 -3.668 1.00 24.32 N ATOM 1416 CA LEU A 982 13.372 -29.973 -3.873 1.00 61.52 C ATOM 1417 C LEU A 982 13.199 -29.458 -5.303 1.00 70.24 C ATOM 1418 O LEU A 982 14.181 -29.208 -6.000 1.00 63.31 O ATOM 1419 CB LEU A 982 12.933 -28.973 -2.802 1.00 21.32 C ATOM 1420 CG LEU A 982 12.897 -29.501 -1.366 1.00 44.00 C ATOM 1421 CD1 LEU A 982 14.132 -30.353 -1.064 1.00 52.02 C ATOM 1422 CD2 LEU A 982 12.733 -28.356 -0.365 1.00 12.30 C ATOM 0 H LEU A 982 15.348 -29.639 -3.263 1.00 24.32 H new ATOM 0 HA LEU A 982 12.713 -30.834 -3.761 1.00 61.52 H new ATOM 0 HB2 LEU A 982 13.605 -28.116 -2.836 1.00 21.32 H new ATOM 0 HB3 LEU A 982 11.938 -28.609 -3.059 1.00 21.32 H new ATOM 0 HG LEU A 982 12.026 -30.148 -1.262 1.00 44.00 H new ATOM 0 HD11 LEU A 982 14.082 -30.716 -0.037 1.00 52.02 H new ATOM 0 HD12 LEU A 982 14.165 -31.201 -1.747 1.00 52.02 H new ATOM 0 HD13 LEU A 982 15.031 -29.749 -1.192 1.00 52.02 H new ATOM 0 HD21 LEU A 982 12.710 -28.759 0.648 1.00 12.30 H new ATOM 0 HD22 LEU A 982 13.570 -27.665 -0.462 1.00 12.30 H new ATOM 0 HD23 LEU A 982 11.801 -27.827 -0.566 1.00 12.30 H new ATOM 1434 N LYS A 983 11.943 -29.315 -5.699 1.00 15.55 N ATOM 1435 CA LYS A 983 11.628 -28.834 -7.033 1.00 41.51 C ATOM 1436 C LYS A 983 10.643 -27.667 -6.931 1.00 45.12 C ATOM 1437 O LYS A 983 9.560 -27.812 -6.367 1.00 3.44 O ATOM 1438 CB LYS A 983 11.132 -29.982 -7.913 1.00 75.24 C ATOM 1439 CG LYS A 983 11.973 -31.242 -7.698 1.00 4.41 C ATOM 1440 CD LYS A 983 11.474 -32.392 -8.574 1.00 55.24 C ATOM 1441 CE LYS A 983 12.627 -33.307 -8.988 1.00 65.12 C ATOM 1442 NZ LYS A 983 12.305 -34.010 -10.250 1.00 52.43 N ATOM 0 H LYS A 983 11.131 -29.524 -5.119 1.00 15.55 H new ATOM 0 HA LYS A 983 12.525 -28.453 -7.522 1.00 41.51 H new ATOM 0 HB2 LYS A 983 10.088 -30.195 -7.685 1.00 75.24 H new ATOM 0 HB3 LYS A 983 11.175 -29.686 -8.961 1.00 75.24 H new ATOM 0 HG2 LYS A 983 13.017 -31.030 -7.930 1.00 4.41 H new ATOM 0 HG3 LYS A 983 11.933 -31.536 -6.649 1.00 4.41 H new ATOM 0 HD2 LYS A 983 10.725 -32.968 -8.031 1.00 55.24 H new ATOM 0 HD3 LYS A 983 10.986 -31.992 -9.463 1.00 55.24 H new ATOM 0 HE2 LYS A 983 13.537 -32.720 -9.114 1.00 65.12 H new ATOM 0 HE3 LYS A 983 12.823 -34.034 -8.200 1.00 65.12 H new ATOM 0 HZ1 LYS A 983 13.099 -34.627 -10.516 1.00 52.43 H new ATOM 0 HZ2 LYS A 983 11.449 -34.585 -10.118 1.00 52.43 H new ATOM 0 HZ3 LYS A 983 12.141 -33.313 -11.004 1.00 52.43 H new ATOM 1455 N ILE A 984 11.055 -26.537 -7.486 1.00 42.45 N ATOM 1456 CA ILE A 984 10.223 -25.346 -7.465 1.00 51.32 C ATOM 1457 C ILE A 984 8.906 -25.636 -8.188 1.00 31.23 C ATOM 1458 O ILE A 984 7.928 -24.910 -8.019 1.00 13.05 O ATOM 1459 CB ILE A 984 10.986 -24.148 -8.035 1.00 61.54 C ATOM 1460 CG1 ILE A 984 11.715 -23.385 -6.928 1.00 0.02 C ATOM 1461 CG2 ILE A 984 10.057 -23.240 -8.842 1.00 54.51 C ATOM 1462 CD1 ILE A 984 12.325 -22.089 -7.465 1.00 42.13 C ATOM 0 H ILE A 984 11.954 -26.421 -7.953 1.00 42.45 H new ATOM 0 HA ILE A 984 9.972 -25.076 -6.439 1.00 51.32 H new ATOM 0 HB ILE A 984 11.746 -24.522 -8.721 1.00 61.54 H new ATOM 0 HG12 ILE A 984 11.020 -23.156 -6.120 1.00 0.02 H new ATOM 0 HG13 ILE A 984 12.500 -24.012 -6.505 1.00 0.02 H new ATOM 0 HG21 ILE A 984 10.624 -22.397 -9.236 1.00 54.51 H new ATOM 0 HG22 ILE A 984 9.625 -23.804 -9.668 1.00 54.51 H new ATOM 0 HG23 ILE A 984 9.259 -22.871 -8.198 1.00 54.51 H new ATOM 0 HD11 ILE A 984 12.837 -21.566 -6.657 1.00 42.13 H new ATOM 0 HD12 ILE A 984 13.038 -22.323 -8.256 1.00 42.13 H new ATOM 0 HD13 ILE A 984 11.535 -21.453 -7.865 1.00 42.13 H new ATOM 1474 N ARG A 985 8.923 -26.700 -8.978 1.00 4.43 N ATOM 1475 CA ARG A 985 7.743 -27.095 -9.727 1.00 33.14 C ATOM 1476 C ARG A 985 6.692 -27.689 -8.786 1.00 61.33 C ATOM 1477 O ARG A 985 5.544 -27.889 -9.180 1.00 12.24 O ATOM 1478 CB ARG A 985 8.093 -28.123 -10.804 1.00 73.50 C ATOM 1479 CG ARG A 985 9.017 -29.208 -10.247 1.00 62.01 C ATOM 1480 CD ARG A 985 8.709 -30.568 -10.878 1.00 4.33 C ATOM 1481 NE ARG A 985 7.257 -30.842 -10.806 1.00 52.40 N ATOM 1482 CZ ARG A 985 6.605 -31.690 -11.629 1.00 61.13 C ATOM 1483 NH1 ARG A 985 7.273 -32.356 -12.595 1.00 51.24 N ATOM 1484 NH2 ARG A 985 5.305 -31.859 -11.475 1.00 70.15 N ATOM 0 H ARG A 985 9.736 -27.301 -9.115 1.00 4.43 H new ATOM 0 HA ARG A 985 7.342 -26.204 -10.209 1.00 33.14 H new ATOM 0 HB2 ARG A 985 7.180 -28.579 -11.187 1.00 73.50 H new ATOM 0 HB3 ARG A 985 8.577 -27.625 -11.644 1.00 73.50 H new ATOM 0 HG2 ARG A 985 10.056 -28.940 -10.440 1.00 62.01 H new ATOM 0 HG3 ARG A 985 8.900 -29.270 -9.165 1.00 62.01 H new ATOM 0 HD2 ARG A 985 9.038 -30.579 -11.917 1.00 4.33 H new ATOM 0 HD3 ARG A 985 9.262 -31.352 -10.360 1.00 4.33 H new ATOM 0 HE ARG A 985 6.715 -30.360 -10.089 1.00 52.40 H new ATOM 0 HH11 ARG A 985 8.278 -32.220 -12.707 1.00 51.24 H new ATOM 0 HH12 ARG A 985 6.773 -32.995 -13.213 1.00 51.24 H new ATOM 0 HH21 ARG A 985 4.808 -31.352 -10.742 1.00 70.15 H new ATOM 0 HH22 ARG A 985 4.797 -32.496 -12.089 1.00 70.15 H new ATOM 1497 N ASN A 986 7.123 -27.955 -7.562 1.00 32.40 N ATOM 1498 CA ASN A 986 6.234 -28.523 -6.563 1.00 14.34 C ATOM 1499 C ASN A 986 6.109 -27.551 -5.387 1.00 72.41 C ATOM 1500 O ASN A 986 5.315 -27.775 -4.474 1.00 51.54 O ATOM 1501 CB ASN A 986 6.782 -29.846 -6.026 1.00 35.51 C ATOM 1502 CG ASN A 986 6.998 -30.850 -7.160 1.00 22.30 C ATOM 1503 OD1 ASN A 986 6.124 -31.108 -7.971 1.00 41.13 O ATOM 1504 ND2 ASN A 986 8.209 -31.401 -7.171 1.00 73.01 N ATOM 0 H ASN A 986 8.076 -27.788 -7.239 1.00 32.40 H new ATOM 0 HA ASN A 986 5.266 -28.698 -7.033 1.00 14.34 H new ATOM 0 HB2 ASN A 986 7.724 -29.670 -5.507 1.00 35.51 H new ATOM 0 HB3 ASN A 986 6.088 -30.261 -5.295 1.00 35.51 H new ATOM 0 HD21 ASN A 986 8.452 -32.084 -7.888 1.00 73.01 H new ATOM 0 HD22 ASN A 986 8.894 -31.140 -6.462 1.00 73.01 H new ATOM 1511 N PHE A 987 6.905 -26.494 -5.447 1.00 71.14 N ATOM 1512 CA PHE A 987 6.893 -25.488 -4.399 1.00 45.22 C ATOM 1513 C PHE A 987 6.394 -24.144 -4.934 1.00 74.42 C ATOM 1514 O PHE A 987 6.029 -24.035 -6.104 1.00 0.22 O ATOM 1515 CB PHE A 987 8.337 -25.327 -3.918 1.00 51.43 C ATOM 1516 CG PHE A 987 8.752 -26.336 -2.846 1.00 61.33 C ATOM 1517 CD1 PHE A 987 9.179 -27.576 -3.209 1.00 14.15 C ATOM 1518 CD2 PHE A 987 8.694 -25.994 -1.531 1.00 65.33 C ATOM 1519 CE1 PHE A 987 9.564 -28.513 -2.214 1.00 12.04 C ATOM 1520 CE2 PHE A 987 9.080 -26.931 -0.536 1.00 73.54 C ATOM 1521 CZ PHE A 987 9.506 -28.171 -0.899 1.00 22.14 C ATOM 0 H PHE A 987 7.563 -26.312 -6.205 1.00 71.14 H new ATOM 0 HA PHE A 987 6.227 -25.798 -3.594 1.00 45.22 H new ATOM 0 HB2 PHE A 987 9.007 -25.424 -4.773 1.00 51.43 H new ATOM 0 HB3 PHE A 987 8.468 -24.319 -3.524 1.00 51.43 H new ATOM 0 HD1 PHE A 987 9.225 -27.847 -4.253 1.00 14.15 H new ATOM 0 HD2 PHE A 987 8.354 -25.010 -1.243 1.00 65.33 H new ATOM 0 HE1 PHE A 987 9.903 -29.497 -2.501 1.00 12.04 H new ATOM 0 HE2 PHE A 987 9.035 -26.659 0.508 1.00 73.54 H new ATOM 0 HZ PHE A 987 9.798 -28.884 -0.142 1.00 22.14 H new ATOM 1531 N VAL A 988 6.393 -23.156 -4.052 1.00 54.21 N ATOM 1532 CA VAL A 988 5.944 -21.824 -4.421 1.00 35.00 C ATOM 1533 C VAL A 988 6.851 -20.784 -3.761 1.00 52.43 C ATOM 1534 O VAL A 988 7.491 -21.065 -2.750 1.00 22.44 O ATOM 1535 CB VAL A 988 4.468 -21.649 -4.055 1.00 23.04 C ATOM 1536 CG1 VAL A 988 3.894 -20.379 -4.686 1.00 34.43 C ATOM 1537 CG2 VAL A 988 3.653 -22.879 -4.458 1.00 65.54 C ATOM 0 H VAL A 988 6.696 -23.251 -3.083 1.00 54.21 H new ATOM 0 HA VAL A 988 6.017 -21.681 -5.499 1.00 35.00 H new ATOM 0 HB VAL A 988 4.401 -21.544 -2.972 1.00 23.04 H new ATOM 0 HG11 VAL A 988 2.844 -20.278 -4.410 1.00 34.43 H new ATOM 0 HG12 VAL A 988 4.448 -19.512 -4.327 1.00 34.43 H new ATOM 0 HG13 VAL A 988 3.980 -20.441 -5.771 1.00 34.43 H new ATOM 0 HG21 VAL A 988 2.608 -22.728 -4.187 1.00 65.54 H new ATOM 0 HG22 VAL A 988 3.730 -23.030 -5.535 1.00 65.54 H new ATOM 0 HG23 VAL A 988 4.039 -23.757 -3.940 1.00 65.54 H new ATOM 1547 N VAL A 989 6.877 -19.603 -4.361 1.00 52.42 N ATOM 1548 CA VAL A 989 7.695 -18.519 -3.845 1.00 0.44 C ATOM 1549 C VAL A 989 6.800 -17.322 -3.516 1.00 21.04 C ATOM 1550 O VAL A 989 6.132 -16.782 -4.396 1.00 12.45 O ATOM 1551 CB VAL A 989 8.804 -18.179 -4.842 1.00 64.11 C ATOM 1552 CG1 VAL A 989 9.926 -17.388 -4.166 1.00 51.44 C ATOM 1553 CG2 VAL A 989 9.350 -19.444 -5.507 1.00 72.50 C ATOM 0 H VAL A 989 6.344 -19.373 -5.200 1.00 52.42 H new ATOM 0 HA VAL A 989 8.188 -18.820 -2.921 1.00 0.44 H new ATOM 0 HB VAL A 989 8.373 -17.550 -5.621 1.00 64.11 H new ATOM 0 HG11 VAL A 989 10.701 -17.159 -4.897 1.00 51.44 H new ATOM 0 HG12 VAL A 989 9.524 -16.459 -3.761 1.00 51.44 H new ATOM 0 HG13 VAL A 989 10.353 -17.981 -3.357 1.00 51.44 H new ATOM 0 HG21 VAL A 989 10.137 -19.174 -6.211 1.00 72.50 H new ATOM 0 HG22 VAL A 989 9.757 -20.109 -4.745 1.00 72.50 H new ATOM 0 HG23 VAL A 989 8.545 -19.952 -6.039 1.00 72.50 H new ATOM 1563 N VAL A 990 6.816 -16.943 -2.246 1.00 61.21 N ATOM 1564 CA VAL A 990 6.014 -15.820 -1.790 1.00 23.50 C ATOM 1565 C VAL A 990 6.939 -14.703 -1.303 1.00 23.42 C ATOM 1566 O VAL A 990 7.776 -14.923 -0.428 1.00 40.52 O ATOM 1567 CB VAL A 990 5.024 -16.285 -0.721 1.00 35.23 C ATOM 1568 CG1 VAL A 990 4.614 -15.125 0.189 1.00 64.01 C ATOM 1569 CG2 VAL A 990 3.797 -16.941 -1.358 1.00 20.31 C ATOM 0 H VAL A 990 7.372 -17.394 -1.519 1.00 61.21 H new ATOM 0 HA VAL A 990 5.420 -15.416 -2.610 1.00 23.50 H new ATOM 0 HB VAL A 990 5.523 -17.034 -0.106 1.00 35.23 H new ATOM 0 HG11 VAL A 990 3.910 -15.483 0.940 1.00 64.01 H new ATOM 0 HG12 VAL A 990 5.497 -14.721 0.683 1.00 64.01 H new ATOM 0 HG13 VAL A 990 4.142 -14.344 -0.407 1.00 64.01 H new ATOM 0 HG21 VAL A 990 3.109 -17.263 -0.576 1.00 20.31 H new ATOM 0 HG22 VAL A 990 3.297 -16.223 -2.008 1.00 20.31 H new ATOM 0 HG23 VAL A 990 4.110 -17.805 -1.944 1.00 20.31 H new ATOM 1579 N PHE A 991 6.757 -13.530 -1.890 1.00 45.22 N ATOM 1580 CA PHE A 991 7.565 -12.378 -1.527 1.00 3.11 C ATOM 1581 C PHE A 991 6.983 -11.663 -0.306 1.00 51.31 C ATOM 1582 O PHE A 991 5.772 -11.465 -0.217 1.00 41.54 O ATOM 1583 CB PHE A 991 7.544 -11.422 -2.721 1.00 70.14 C ATOM 1584 CG PHE A 991 8.429 -11.865 -3.888 1.00 42.43 C ATOM 1585 CD1 PHE A 991 9.762 -11.596 -3.870 1.00 63.14 C ATOM 1586 CD2 PHE A 991 7.883 -12.527 -4.943 1.00 51.53 C ATOM 1587 CE1 PHE A 991 10.584 -12.007 -4.953 1.00 51.13 C ATOM 1588 CE2 PHE A 991 8.704 -12.937 -6.026 1.00 65.32 C ATOM 1589 CZ PHE A 991 10.038 -12.669 -6.008 1.00 54.24 C ATOM 0 H PHE A 991 6.062 -13.352 -2.615 1.00 45.22 H new ATOM 0 HA PHE A 991 8.577 -12.697 -1.280 1.00 3.11 H new ATOM 0 HB2 PHE A 991 6.518 -11.321 -3.074 1.00 70.14 H new ATOM 0 HB3 PHE A 991 7.865 -10.435 -2.389 1.00 70.14 H new ATOM 0 HD1 PHE A 991 10.196 -11.070 -3.032 1.00 63.14 H new ATOM 0 HD2 PHE A 991 6.824 -12.741 -4.957 1.00 51.53 H new ATOM 0 HE1 PHE A 991 11.643 -11.794 -4.939 1.00 51.13 H new ATOM 0 HE2 PHE A 991 8.270 -13.462 -6.864 1.00 65.32 H new ATOM 0 HZ PHE A 991 10.663 -12.982 -6.831 1.00 54.24 H new ATOM 1599 N LYS A 992 7.872 -11.295 0.604 1.00 2.15 N ATOM 1600 CA LYS A 992 7.462 -10.606 1.816 1.00 34.02 C ATOM 1601 C LYS A 992 7.377 -9.104 1.540 1.00 53.43 C ATOM 1602 O LYS A 992 6.424 -8.445 1.955 1.00 62.35 O ATOM 1603 CB LYS A 992 8.390 -10.966 2.978 1.00 72.11 C ATOM 1604 CG LYS A 992 7.823 -10.465 4.308 1.00 42.00 C ATOM 1605 CD LYS A 992 8.921 -10.366 5.369 1.00 20.31 C ATOM 1606 CE LYS A 992 9.875 -11.559 5.283 1.00 21.25 C ATOM 1607 NZ LYS A 992 10.545 -11.782 6.584 1.00 11.44 N ATOM 0 H LYS A 992 8.875 -11.461 0.527 1.00 2.15 H new ATOM 0 HA LYS A 992 6.467 -10.931 2.120 1.00 34.02 H new ATOM 0 HB2 LYS A 992 8.524 -12.047 3.020 1.00 72.11 H new ATOM 0 HB3 LYS A 992 9.375 -10.529 2.811 1.00 72.11 H new ATOM 0 HG2 LYS A 992 7.361 -9.488 4.166 1.00 42.00 H new ATOM 0 HG3 LYS A 992 7.040 -11.141 4.652 1.00 42.00 H new ATOM 0 HD2 LYS A 992 9.479 -9.439 5.235 1.00 20.31 H new ATOM 0 HD3 LYS A 992 8.471 -10.326 6.361 1.00 20.31 H new ATOM 0 HE2 LYS A 992 9.323 -12.453 4.993 1.00 21.25 H new ATOM 0 HE3 LYS A 992 10.621 -11.380 4.509 1.00 21.25 H new ATOM 0 HZ1 LYS A 992 11.189 -12.595 6.508 1.00 11.44 H new ATOM 0 HZ2 LYS A 992 11.088 -10.934 6.845 1.00 11.44 H new ATOM 0 HZ3 LYS A 992 9.830 -11.974 7.314 1.00 11.44 H new ATOM 1673 N LYS A 997 2.279 -13.693 -4.507 1.00 64.44 N ATOM 1674 CA LYS A 997 2.642 -15.100 -4.551 1.00 14.14 C ATOM 1675 C LYS A 997 3.065 -15.469 -5.974 1.00 30.53 C ATOM 1676 O LYS A 997 2.248 -15.450 -6.893 1.00 20.00 O ATOM 1677 CB LYS A 997 1.503 -15.963 -4.004 1.00 21.42 C ATOM 1678 CG LYS A 997 1.445 -17.313 -4.722 1.00 60.12 C ATOM 1679 CD LYS A 997 0.259 -18.145 -4.230 1.00 60.35 C ATOM 1680 CE LYS A 997 0.139 -18.082 -2.707 1.00 2.15 C ATOM 1681 NZ LYS A 997 -0.785 -19.128 -2.215 1.00 71.44 N ATOM 0 HA LYS A 997 3.498 -15.294 -3.904 1.00 14.14 H new ATOM 0 HB2 LYS A 997 1.643 -16.121 -2.935 1.00 21.42 H new ATOM 0 HB3 LYS A 997 0.554 -15.440 -4.127 1.00 21.42 H new ATOM 0 HG2 LYS A 997 1.361 -17.154 -5.797 1.00 60.12 H new ATOM 0 HG3 LYS A 997 2.373 -17.860 -4.552 1.00 60.12 H new ATOM 0 HD2 LYS A 997 -0.661 -17.779 -4.686 1.00 60.35 H new ATOM 0 HD3 LYS A 997 0.381 -19.181 -4.546 1.00 60.35 H new ATOM 0 HE2 LYS A 997 1.121 -18.214 -2.253 1.00 2.15 H new ATOM 0 HE3 LYS A 997 -0.222 -17.099 -2.405 1.00 2.15 H new ATOM 0 HZ1 LYS A 997 -0.854 -19.070 -1.179 1.00 71.44 H new ATOM 0 HZ2 LYS A 997 -1.726 -18.985 -2.634 1.00 71.44 H new ATOM 0 HZ3 LYS A 997 -0.425 -20.065 -2.486 1.00 71.44 H new ATOM 1694 N LYS A 998 4.341 -15.798 -6.111 1.00 3.43 N ATOM 1695 CA LYS A 998 4.883 -16.171 -7.406 1.00 60.13 C ATOM 1696 C LYS A 998 5.103 -17.685 -7.445 1.00 40.31 C ATOM 1697 O LYS A 998 5.568 -18.273 -6.470 1.00 73.20 O ATOM 1698 CB LYS A 998 6.142 -15.359 -7.715 1.00 1.50 C ATOM 1699 CG LYS A 998 5.815 -14.157 -8.604 1.00 11.33 C ATOM 1700 CD LYS A 998 4.698 -13.310 -7.991 1.00 10.43 C ATOM 1701 CE LYS A 998 4.145 -12.311 -9.010 1.00 32.42 C ATOM 1702 NZ LYS A 998 3.012 -12.905 -9.754 1.00 72.14 N ATOM 0 H LYS A 998 5.015 -15.814 -5.346 1.00 3.43 H new ATOM 0 HA LYS A 998 4.174 -15.930 -8.199 1.00 60.13 H new ATOM 0 HB2 LYS A 998 6.595 -15.015 -6.785 1.00 1.50 H new ATOM 0 HB3 LYS A 998 6.876 -15.994 -8.211 1.00 1.50 H new ATOM 0 HG2 LYS A 998 6.708 -13.546 -8.738 1.00 11.33 H new ATOM 0 HG3 LYS A 998 5.513 -14.503 -9.593 1.00 11.33 H new ATOM 0 HD2 LYS A 998 3.896 -13.959 -7.640 1.00 10.43 H new ATOM 0 HD3 LYS A 998 5.078 -12.775 -7.121 1.00 10.43 H new ATOM 0 HE2 LYS A 998 3.818 -11.405 -8.500 1.00 32.42 H new ATOM 0 HE3 LYS A 998 4.932 -12.019 -9.706 1.00 32.42 H new ATOM 0 HZ1 LYS A 998 2.648 -12.215 -10.441 1.00 72.14 H new ATOM 0 HZ2 LYS A 998 3.335 -13.757 -10.256 1.00 72.14 H new ATOM 0 HZ3 LYS A 998 2.256 -13.162 -9.088 1.00 72.14 H new ATOM 1715 N GLN A 999 4.759 -18.272 -8.582 1.00 11.41 N ATOM 1716 CA GLN A 999 4.913 -19.705 -8.761 1.00 30.34 C ATOM 1717 C GLN A 999 5.868 -19.996 -9.920 1.00 60.21 C ATOM 1718 O GLN A 999 5.551 -19.716 -11.075 1.00 43.31 O ATOM 1719 CB GLN A 999 3.558 -20.379 -8.985 1.00 14.33 C ATOM 1720 CG GLN A 999 3.558 -21.808 -8.438 1.00 1.44 C ATOM 1721 CD GLN A 999 2.138 -22.264 -8.094 1.00 45.34 C ATOM 1722 OE1 GLN A 999 1.153 -21.701 -8.542 1.00 73.20 O ATOM 1723 NE2 GLN A 999 2.090 -23.312 -7.277 1.00 53.03 N ATOM 0 H GLN A 999 4.374 -17.781 -9.389 1.00 11.41 H new ATOM 0 HA GLN A 999 5.342 -20.121 -7.849 1.00 30.34 H new ATOM 0 HB2 GLN A 999 2.775 -19.799 -8.497 1.00 14.33 H new ATOM 0 HB3 GLN A 999 3.327 -20.394 -10.050 1.00 14.33 H new ATOM 0 HG2 GLN A 999 3.992 -22.483 -9.175 1.00 1.44 H new ATOM 0 HG3 GLN A 999 4.186 -21.861 -7.549 1.00 1.44 H new ATOM 0 HE21 GLN A 999 2.954 -23.735 -6.939 1.00 53.03 H new ATOM 0 HE22 GLN A 999 1.189 -23.693 -6.988 1.00 53.03 H new ATOM 1732 N TYR A1000 7.018 -20.555 -9.572 1.00 12.32 N ATOM 1733 CA TYR A1000 8.021 -20.887 -10.569 1.00 41.41 C ATOM 1734 C TYR A1000 8.066 -22.395 -10.821 1.00 20.12 C ATOM 1735 O TYR A1000 7.204 -23.133 -10.346 1.00 25.34 O ATOM 1736 CB TYR A1000 9.362 -20.439 -9.984 1.00 31.14 C ATOM 1737 CG TYR A1000 9.487 -18.925 -9.802 1.00 64.23 C ATOM 1738 CD1 TYR A1000 9.962 -18.143 -10.836 1.00 23.44 C ATOM 1739 CD2 TYR A1000 9.126 -18.341 -8.605 1.00 74.11 C ATOM 1740 CE1 TYR A1000 10.080 -16.718 -10.665 1.00 25.41 C ATOM 1741 CE2 TYR A1000 9.244 -16.916 -8.434 1.00 72.24 C ATOM 1742 CZ TYR A1000 9.715 -16.175 -9.473 1.00 24.23 C ATOM 1743 OH TYR A1000 9.827 -14.829 -9.311 1.00 60.45 O ATOM 0 H TYR A1000 7.277 -20.786 -8.613 1.00 12.32 H new ATOM 0 HA TYR A1000 7.795 -20.400 -11.517 1.00 41.41 H new ATOM 0 HB2 TYR A1000 9.506 -20.924 -9.018 1.00 31.14 H new ATOM 0 HB3 TYR A1000 10.165 -20.784 -10.636 1.00 31.14 H new ATOM 0 HD1 TYR A1000 10.245 -18.600 -11.773 1.00 23.44 H new ATOM 0 HD2 TYR A1000 8.755 -18.953 -7.796 1.00 74.11 H new ATOM 0 HE1 TYR A1000 10.450 -16.095 -11.466 1.00 25.41 H new ATOM 0 HE2 TYR A1000 8.965 -16.446 -7.502 1.00 72.24 H new ATOM 0 HH TYR A1000 9.529 -14.582 -8.411 1.00 60.45 H new ATOM 1753 N LYS A1001 9.079 -22.808 -11.568 1.00 24.23 N ATOM 1754 CA LYS A1001 9.248 -24.215 -11.888 1.00 60.42 C ATOM 1755 C LYS A1001 10.682 -24.640 -11.563 1.00 55.10 C ATOM 1756 O LYS A1001 10.900 -25.688 -10.957 1.00 41.30 O ATOM 1757 CB LYS A1001 8.840 -24.487 -13.337 1.00 71.45 C ATOM 1758 CG LYS A1001 9.899 -23.969 -14.312 1.00 44.10 C ATOM 1759 CD LYS A1001 9.516 -24.286 -15.759 1.00 33.22 C ATOM 1760 CE LYS A1001 10.754 -24.332 -16.657 1.00 35.12 C ATOM 1761 NZ LYS A1001 10.397 -23.981 -18.049 1.00 52.55 N ATOM 0 H LYS A1001 9.791 -22.193 -11.961 1.00 24.23 H new ATOM 0 HA LYS A1001 8.587 -24.827 -11.274 1.00 60.42 H new ATOM 0 HB2 LYS A1001 8.698 -25.558 -13.484 1.00 71.45 H new ATOM 0 HB3 LYS A1001 7.883 -24.008 -13.545 1.00 71.45 H new ATOM 0 HG2 LYS A1001 10.014 -22.892 -14.190 1.00 44.10 H new ATOM 0 HG3 LYS A1001 10.863 -24.421 -14.080 1.00 44.10 H new ATOM 0 HD2 LYS A1001 8.997 -25.244 -15.800 1.00 33.22 H new ATOM 0 HD3 LYS A1001 8.822 -23.531 -16.129 1.00 33.22 H new ATOM 0 HE2 LYS A1001 11.508 -23.639 -16.283 1.00 35.12 H new ATOM 0 HE3 LYS A1001 11.195 -25.329 -16.628 1.00 35.12 H new ATOM 0 HZ1 LYS A1001 11.248 -24.017 -18.645 1.00 52.55 H new ATOM 0 HZ2 LYS A1001 9.694 -24.658 -18.408 1.00 52.55 H new ATOM 0 HZ3 LYS A1001 9.998 -23.021 -18.073 1.00 52.55 H new ATOM 1774 N LYS A1002 11.621 -23.804 -11.980 1.00 62.22 N ATOM 1775 CA LYS A1002 13.028 -24.080 -11.741 1.00 13.21 C ATOM 1776 C LYS A1002 13.613 -22.984 -10.847 1.00 73.24 C ATOM 1777 O LYS A1002 13.158 -21.842 -10.881 1.00 53.11 O ATOM 1778 CB LYS A1002 13.772 -24.256 -13.066 1.00 2.40 C ATOM 1779 CG LYS A1002 13.482 -25.626 -13.680 1.00 73.45 C ATOM 1780 CD LYS A1002 13.819 -26.750 -12.698 1.00 75.13 C ATOM 1781 CE LYS A1002 14.164 -28.042 -13.441 1.00 62.21 C ATOM 1782 NZ LYS A1002 15.387 -27.861 -14.255 1.00 51.21 N ATOM 0 H LYS A1002 11.436 -22.935 -12.482 1.00 62.22 H new ATOM 0 HA LYS A1002 13.147 -25.024 -11.208 1.00 13.21 H new ATOM 0 HB2 LYS A1002 13.474 -23.471 -13.761 1.00 2.40 H new ATOM 0 HB3 LYS A1002 14.844 -24.146 -12.902 1.00 2.40 H new ATOM 0 HG2 LYS A1002 12.431 -25.687 -13.961 1.00 73.45 H new ATOM 0 HG3 LYS A1002 14.064 -25.750 -14.593 1.00 73.45 H new ATOM 0 HD2 LYS A1002 14.660 -26.451 -12.072 1.00 75.13 H new ATOM 0 HD3 LYS A1002 12.972 -26.923 -12.034 1.00 75.13 H new ATOM 0 HE2 LYS A1002 14.312 -28.851 -12.726 1.00 62.21 H new ATOM 0 HE3 LYS A1002 13.332 -28.332 -14.083 1.00 62.21 H new ATOM 0 HZ1 LYS A1002 15.872 -28.775 -14.360 1.00 51.21 H new ATOM 0 HZ2 LYS A1002 15.128 -27.496 -15.194 1.00 51.21 H new ATOM 0 HZ3 LYS A1002 16.021 -27.185 -13.783 1.00 51.21 H new ATOM 1795 N TRP A1003 14.613 -23.371 -10.069 1.00 52.02 N ATOM 1796 CA TRP A1003 15.265 -22.436 -9.168 1.00 52.12 C ATOM 1797 C TRP A1003 15.959 -21.368 -10.016 1.00 53.12 C ATOM 1798 O TRP A1003 15.988 -20.196 -9.643 1.00 74.22 O ATOM 1799 CB TRP A1003 16.222 -23.163 -8.222 1.00 62.11 C ATOM 1800 CG TRP A1003 15.604 -24.375 -7.522 1.00 63.33 C ATOM 1801 CD1 TRP A1003 15.653 -25.660 -7.900 1.00 43.14 C ATOM 1802 CD2 TRP A1003 14.838 -24.364 -6.300 1.00 14.24 C ATOM 1803 NE1 TRP A1003 14.977 -26.474 -7.015 1.00 20.04 N ATOM 1804 CE2 TRP A1003 14.465 -25.661 -6.010 1.00 44.32 C ATOM 1805 CE3 TRP A1003 14.471 -23.293 -5.466 1.00 11.14 C ATOM 1806 CZ2 TRP A1003 13.708 -26.008 -4.885 1.00 55.14 C ATOM 1807 CZ3 TRP A1003 13.714 -23.657 -4.346 1.00 14.54 C ATOM 1808 CH2 TRP A1003 13.331 -24.957 -4.040 1.00 74.33 C ATOM 0 H TRP A1003 14.988 -24.319 -10.044 1.00 52.02 H new ATOM 0 HA TRP A1003 14.534 -21.948 -8.524 1.00 52.12 H new ATOM 0 HB2 TRP A1003 17.096 -23.489 -8.786 1.00 62.11 H new ATOM 0 HB3 TRP A1003 16.574 -22.460 -7.467 1.00 62.11 H new ATOM 0 HD1 TRP A1003 16.158 -26.014 -8.786 1.00 43.14 H new ATOM 0 HE1 TRP A1003 14.872 -27.486 -7.085 1.00 20.04 H new ATOM 0 HE3 TRP A1003 14.751 -22.271 -5.673 1.00 11.14 H new ATOM 0 HZ2 TRP A1003 13.430 -27.031 -4.680 1.00 55.14 H new ATOM 0 HZ3 TRP A1003 13.406 -22.871 -3.672 1.00 14.54 H new ATOM 0 HH2 TRP A1003 12.745 -25.156 -3.155 1.00 74.33 H new ATOM 1819 N VAL A1004 16.501 -21.811 -11.141 1.00 75.01 N ATOM 1820 CA VAL A1004 17.192 -20.908 -12.045 1.00 43.11 C ATOM 1821 C VAL A1004 16.310 -19.687 -12.313 1.00 70.15 C ATOM 1822 O VAL A1004 16.815 -18.598 -12.582 1.00 25.41 O ATOM 1823 CB VAL A1004 17.591 -21.650 -13.322 1.00 51.14 C ATOM 1824 CG1 VAL A1004 16.505 -22.643 -13.741 1.00 40.12 C ATOM 1825 CG2 VAL A1004 17.901 -20.667 -14.453 1.00 70.02 C ATOM 0 H VAL A1004 16.475 -22.784 -11.447 1.00 75.01 H new ATOM 0 HA VAL A1004 18.116 -20.548 -11.593 1.00 43.11 H new ATOM 0 HB VAL A1004 18.499 -22.215 -13.111 1.00 51.14 H new ATOM 0 HG11 VAL A1004 16.814 -23.157 -14.651 1.00 40.12 H new ATOM 0 HG12 VAL A1004 16.353 -23.373 -12.946 1.00 40.12 H new ATOM 0 HG13 VAL A1004 15.574 -22.107 -13.925 1.00 40.12 H new ATOM 0 HG21 VAL A1004 18.182 -21.220 -15.349 1.00 70.02 H new ATOM 0 HG22 VAL A1004 17.018 -20.062 -14.662 1.00 70.02 H new ATOM 0 HG23 VAL A1004 18.724 -20.017 -14.155 1.00 70.02 H new ATOM 1835 N GLU A1005 15.006 -19.910 -12.232 1.00 4.54 N ATOM 1836 CA GLU A1005 14.049 -18.841 -12.462 1.00 70.23 C ATOM 1837 C GLU A1005 14.165 -17.779 -11.368 1.00 1.35 C ATOM 1838 O GLU A1005 14.037 -16.586 -11.639 1.00 45.12 O ATOM 1839 CB GLU A1005 12.623 -19.391 -12.544 1.00 45.41 C ATOM 1840 CG GLU A1005 12.533 -20.530 -13.561 1.00 35.42 C ATOM 1841 CD GLU A1005 12.285 -19.989 -14.970 1.00 71.23 C ATOM 1842 OE1 GLU A1005 12.948 -20.421 -15.925 1.00 52.43 O ATOM 1843 OE2 GLU A1005 11.365 -19.089 -15.055 1.00 11.12 O ATOM 0 H GLU A1005 14.590 -20.815 -12.010 1.00 4.54 H new ATOM 0 HA GLU A1005 14.279 -18.374 -13.419 1.00 70.23 H new ATOM 0 HB2 GLU A1005 12.310 -19.749 -11.563 1.00 45.41 H new ATOM 0 HB3 GLU A1005 11.937 -18.592 -12.825 1.00 45.41 H new ATOM 0 HG2 GLU A1005 13.457 -21.108 -13.547 1.00 35.42 H new ATOM 0 HG3 GLU A1005 11.728 -21.209 -13.281 1.00 35.42 H new ATOM 1851 N LEU A1006 14.406 -18.250 -10.153 1.00 70.20 N ATOM 1852 CA LEU A1006 14.541 -17.355 -9.016 1.00 72.50 C ATOM 1853 C LEU A1006 15.535 -16.245 -9.362 1.00 12.24 C ATOM 1854 O LEU A1006 16.733 -16.495 -9.482 1.00 1.44 O ATOM 1855 CB LEU A1006 14.910 -18.142 -7.757 1.00 4.45 C ATOM 1856 CG LEU A1006 14.319 -17.622 -6.444 1.00 64.32 C ATOM 1857 CD1 LEU A1006 12.825 -17.333 -6.593 1.00 14.32 C ATOM 1858 CD2 LEU A1006 14.604 -18.590 -5.294 1.00 21.02 C ATOM 0 H LEU A1006 14.511 -19.240 -9.931 1.00 70.20 H new ATOM 0 HA LEU A1006 13.589 -16.872 -8.795 1.00 72.50 H new ATOM 0 HB2 LEU A1006 14.591 -19.176 -7.892 1.00 4.45 H new ATOM 0 HB3 LEU A1006 15.996 -18.153 -7.665 1.00 4.45 H new ATOM 0 HG LEU A1006 14.807 -16.678 -6.199 1.00 64.32 H new ATOM 0 HD11 LEU A1006 12.429 -16.965 -5.646 1.00 14.32 H new ATOM 0 HD12 LEU A1006 12.676 -16.579 -7.366 1.00 14.32 H new ATOM 0 HD13 LEU A1006 12.303 -18.248 -6.873 1.00 14.32 H new ATOM 0 HD21 LEU A1006 14.174 -18.197 -4.373 1.00 21.02 H new ATOM 0 HD22 LEU A1006 14.160 -19.560 -5.517 1.00 21.02 H new ATOM 0 HD23 LEU A1006 15.681 -18.703 -5.172 1.00 21.02 H new ATOM 1870 N PRO A1007 14.986 -15.010 -9.516 1.00 21.03 N ATOM 1871 CA PRO A1007 15.811 -13.860 -9.845 1.00 61.30 C ATOM 1872 C PRO A1007 16.610 -13.391 -8.627 1.00 73.40 C ATOM 1873 O PRO A1007 17.367 -12.425 -8.711 1.00 34.52 O ATOM 1874 CB PRO A1007 14.838 -12.811 -10.357 1.00 33.21 C ATOM 1875 CG PRO A1007 13.466 -13.239 -9.862 1.00 14.22 C ATOM 1876 CD PRO A1007 13.571 -14.677 -9.381 1.00 40.10 C ATOM 0 HA PRO A1007 16.565 -14.086 -10.599 1.00 61.30 H new ATOM 0 HB2 PRO A1007 15.097 -11.821 -9.982 1.00 33.21 H new ATOM 0 HB3 PRO A1007 14.861 -12.755 -11.445 1.00 33.21 H new ATOM 0 HG2 PRO A1007 13.133 -12.589 -9.053 1.00 14.22 H new ATOM 0 HG3 PRO A1007 12.729 -13.157 -10.661 1.00 14.22 H new ATOM 0 HD2 PRO A1007 13.238 -14.774 -8.348 1.00 40.10 H new ATOM 0 HD3 PRO A1007 12.949 -15.342 -9.980 1.00 40.10 H new ATOM 1884 N ILE A1008 16.414 -14.098 -7.523 1.00 54.43 N ATOM 1885 CA ILE A1008 17.106 -13.766 -6.290 1.00 1.03 C ATOM 1886 C ILE A1008 18.398 -14.581 -6.200 1.00 33.30 C ATOM 1887 O ILE A1008 18.395 -15.785 -6.455 1.00 3.35 O ATOM 1888 CB ILE A1008 16.178 -13.950 -5.088 1.00 34.52 C ATOM 1889 CG1 ILE A1008 15.288 -12.721 -4.888 1.00 64.41 C ATOM 1890 CG2 ILE A1008 16.974 -14.293 -3.827 1.00 42.40 C ATOM 1891 CD1 ILE A1008 14.835 -12.149 -6.232 1.00 53.33 C ATOM 0 H ILE A1008 15.786 -14.899 -7.457 1.00 54.43 H new ATOM 0 HA ILE A1008 17.391 -12.714 -6.285 1.00 1.03 H new ATOM 0 HB ILE A1008 15.519 -14.794 -5.292 1.00 34.52 H new ATOM 0 HG12 ILE A1008 14.417 -12.991 -4.291 1.00 64.41 H new ATOM 0 HG13 ILE A1008 15.833 -11.960 -4.330 1.00 64.41 H new ATOM 0 HG21 ILE A1008 16.290 -14.418 -2.988 1.00 42.40 H new ATOM 0 HG22 ILE A1008 17.527 -15.219 -3.986 1.00 42.40 H new ATOM 0 HG23 ILE A1008 17.673 -13.486 -3.608 1.00 42.40 H new ATOM 0 HD11 ILE A1008 14.204 -11.277 -6.062 1.00 53.33 H new ATOM 0 HD12 ILE A1008 15.708 -11.857 -6.816 1.00 53.33 H new ATOM 0 HD13 ILE A1008 14.270 -12.905 -6.777 1.00 53.33 H new ATOM 1903 N THR A1009 19.470 -13.893 -5.837 1.00 62.12 N ATOM 1904 CA THR A1009 20.766 -14.538 -5.711 1.00 31.43 C ATOM 1905 C THR A1009 20.780 -15.474 -4.500 1.00 10.40 C ATOM 1906 O THR A1009 20.073 -15.238 -3.521 1.00 63.41 O ATOM 1907 CB THR A1009 21.834 -13.445 -5.646 1.00 62.04 C ATOM 1908 OG1 THR A1009 23.010 -14.079 -6.141 1.00 25.52 O ATOM 1909 CG2 THR A1009 22.194 -13.061 -4.210 1.00 32.45 C ATOM 0 H THR A1009 19.468 -12.895 -5.626 1.00 62.12 H new ATOM 0 HA THR A1009 20.979 -15.170 -6.573 1.00 31.43 H new ATOM 0 HB THR A1009 21.482 -12.562 -6.179 1.00 62.04 H new ATOM 0 HG1 THR A1009 23.753 -13.440 -6.135 1.00 25.52 H new ATOM 0 HG21 THR A1009 22.956 -12.282 -4.222 1.00 32.45 H new ATOM 0 HG22 THR A1009 21.305 -12.692 -3.698 1.00 32.45 H new ATOM 0 HG23 THR A1009 22.578 -13.936 -3.685 1.00 32.45 H new ATOM 1917 N PHE A1010 21.592 -16.515 -4.606 1.00 44.22 N ATOM 1918 CA PHE A1010 21.708 -17.487 -3.532 1.00 51.42 C ATOM 1919 C PHE A1010 23.168 -17.672 -3.115 1.00 2.21 C ATOM 1920 O PHE A1010 24.079 -17.252 -3.827 1.00 60.10 O ATOM 1921 CB PHE A1010 21.172 -18.814 -4.071 1.00 35.41 C ATOM 1922 CG PHE A1010 19.663 -18.995 -3.891 1.00 31.25 C ATOM 1923 CD1 PHE A1010 18.802 -18.072 -4.397 1.00 61.20 C ATOM 1924 CD2 PHE A1010 19.183 -20.079 -3.224 1.00 11.03 C ATOM 1925 CE1 PHE A1010 17.402 -18.240 -4.230 1.00 31.03 C ATOM 1926 CE2 PHE A1010 17.783 -20.247 -3.056 1.00 51.23 C ATOM 1927 CZ PHE A1010 16.922 -19.324 -3.563 1.00 11.12 C ATOM 0 H PHE A1010 22.176 -16.707 -5.420 1.00 44.22 H new ATOM 0 HA PHE A1010 21.150 -17.146 -2.660 1.00 51.42 H new ATOM 0 HB2 PHE A1010 21.412 -18.887 -5.132 1.00 35.41 H new ATOM 0 HB3 PHE A1010 21.688 -19.633 -3.570 1.00 35.41 H new ATOM 0 HD1 PHE A1010 19.183 -17.211 -4.926 1.00 61.20 H new ATOM 0 HD2 PHE A1010 19.867 -20.812 -2.822 1.00 11.03 H new ATOM 0 HE1 PHE A1010 16.718 -17.507 -4.632 1.00 31.03 H new ATOM 0 HE2 PHE A1010 17.402 -21.107 -2.526 1.00 51.23 H new ATOM 0 HZ PHE A1010 15.857 -19.452 -3.436 1.00 11.12 H new ATOM 1937 N PRO A1011 23.350 -18.317 -1.932 1.00 25.41 N ATOM 1938 CA PRO A1011 24.684 -18.563 -1.411 1.00 65.32 C ATOM 1939 C PRO A1011 25.371 -19.697 -2.175 1.00 60.24 C ATOM 1940 O PRO A1011 24.916 -20.092 -3.248 1.00 4.00 O ATOM 1941 CB PRO A1011 24.480 -18.878 0.062 1.00 61.13 C ATOM 1942 CG PRO A1011 23.014 -19.253 0.208 1.00 24.13 C ATOM 1943 CD PRO A1011 22.295 -18.828 -1.062 1.00 24.43 C ATOM 0 HA PRO A1011 25.347 -17.707 -1.533 1.00 65.32 H new ATOM 0 HB2 PRO A1011 25.126 -19.696 0.380 1.00 61.13 H new ATOM 0 HB3 PRO A1011 24.727 -18.017 0.683 1.00 61.13 H new ATOM 0 HG2 PRO A1011 22.908 -20.326 0.365 1.00 24.13 H new ATOM 0 HG3 PRO A1011 22.578 -18.759 1.077 1.00 24.13 H new ATOM 0 HD2 PRO A1011 21.774 -19.668 -1.522 1.00 24.43 H new ATOM 0 HD3 PRO A1011 21.546 -18.063 -0.856 1.00 24.43 H new