USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=19 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 167:sc= -0.309 (180deg=-0.353) USER MOD Set 1.2: A 981 CYS SG : rot 160:sc= 0.321 USER MOD Set 2.1: A 939 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 971 MET CE :methyl 159:sc= -2.61 (180deg=-4.28!) USER MOD Set 3.1: A 948 GLN : amide:sc= -3.7 K(o=-7,f=-3.3) USER MOD Set 3.2: A 955 GLN : amide:sc= -3.3 X(o=-7,f=-6.8!) USER MOD Set 4.1: A 915 CYS SG : rot -130:sc= -0.882 USER MOD Set 4.2: A 930 ASN : amide:sc= -4.92! C(o=-7.9!,f=-21!) USER MOD Set 4.3: A 932 THR OG1 : rot 58:sc= -2.09! USER MOD Set 5.1: A 907 CYS SG : rot 121:sc= 0.701 USER MOD Set 5.2: A 962 CYS SG : rot -172:sc= 1.17! USER MOD Single : A 898 ASN : amide:sc= -1.19 K(o=-1.2,f=-0.42) USER MOD Single : A 899 ASN : amide:sc= -0.432 K(o=-0.43,f=-1.8!) USER MOD Single : A 901 SER OG : rot 83:sc= 1.17 USER MOD Single : A 904 THR OG1 : rot 180:sc= -0.826 USER MOD Single : A 908 LYS NZ :NH3+ 151:sc= -0.563 (180deg=-1.84!) USER MOD Single : A 909 ASN : amide:sc= -2.76! C(o=-2.8!,f=-3.4!) USER MOD Single : A 911 SER OG : rot 69:sc= 1.09 USER MOD Single : A 916 SER OG : rot -170:sc= -0.404 USER MOD Single : A 921 HIS : no HD1:sc= -0.0161 X(o=-0.016,f=-0.018) 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= -14.5! C(o=-15!,f=-9.8!) USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 957 ASN : amide:sc= -2.09 K(o=-2.1,f=-0.23) USER MOD Single : A 963 LYS NZ :NH3+ 160:sc=-0.00311 (180deg=-0.154) USER MOD Single : A 966 GLN : amide:sc= -0.681 K(o=-0.68,f=-3.4!) USER MOD Single : A 970 THR OG1 : rot 180:sc= 0 USER MOD Single : A 974 HIS : no HD1:sc= -2.29! C(o=-2.3!,f=-4.7!) USER MOD Single : A 975 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 986 ASN : amide:sc= -4.65! C(o=-4.7!,f=-3.3!) 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= -0.877 X(o=-0.88,f=-0.89) USER MOD Single : A1000 TYR OH : rot 180:sc= 0 USER MOD Single : A1001 LYS NZ :NH3+ 150:sc= 0.138 (180deg=-2.63!) USER MOD Single : A1002 LYS NZ :NH3+ -126:sc= -0.122 (180deg=-0.808) USER MOD Single : A1009 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 101 N ASN A 898 16.650 -9.076 -4.161 1.00 12.34 N ATOM 102 CA ASN A 898 17.645 -10.050 -4.575 1.00 40.24 C ATOM 103 C ASN A 898 18.279 -10.685 -3.336 1.00 15.32 C ATOM 104 O ASN A 898 19.498 -10.663 -3.177 1.00 41.43 O ATOM 105 CB ASN A 898 18.759 -9.387 -5.389 1.00 34.32 C ATOM 106 CG ASN A 898 18.443 -9.427 -6.885 1.00 55.12 C ATOM 107 OD1 ASN A 898 18.157 -8.420 -7.513 1.00 31.34 O ATOM 108 ND2 ASN A 898 18.509 -10.643 -7.420 1.00 43.32 N ATOM 0 HA ASN A 898 17.147 -10.800 -5.189 1.00 40.24 H new ATOM 0 HB2 ASN A 898 18.883 -8.353 -5.067 1.00 34.32 H new ATOM 0 HB3 ASN A 898 19.704 -9.895 -5.200 1.00 34.32 H new ATOM 0 HD21 ASN A 898 18.314 -10.775 -8.413 1.00 43.32 H new ATOM 0 HD22 ASN A 898 18.754 -11.444 -6.838 1.00 43.32 H new ATOM 115 N ASN A 899 17.421 -11.236 -2.489 1.00 5.52 N ATOM 116 CA ASN A 899 17.882 -11.875 -1.268 1.00 61.43 C ATOM 117 C ASN A 899 16.994 -13.084 -0.965 1.00 64.10 C ATOM 118 O ASN A 899 15.769 -12.975 -0.966 1.00 3.14 O ATOM 119 CB ASN A 899 17.798 -10.917 -0.079 1.00 24.14 C ATOM 120 CG ASN A 899 18.938 -11.170 0.911 1.00 73.43 C ATOM 121 OD1 ASN A 899 20.051 -11.506 0.542 1.00 4.43 O ATOM 122 ND2 ASN A 899 18.598 -10.992 2.184 1.00 31.21 N ATOM 0 H ASN A 899 16.410 -11.253 -2.624 1.00 5.52 H new ATOM 0 HA ASN A 899 18.919 -12.176 -1.415 1.00 61.43 H new ATOM 0 HB2 ASN A 899 17.841 -9.887 -0.433 1.00 24.14 H new ATOM 0 HB3 ASN A 899 16.840 -11.041 0.425 1.00 24.14 H new ATOM 0 HD21 ASN A 899 19.288 -11.137 2.921 1.00 31.21 H new ATOM 0 HD22 ASN A 899 17.647 -10.710 2.423 1.00 31.21 H new ATOM 129 N PRO A 900 17.665 -14.239 -0.706 1.00 54.05 N ATOM 130 CA PRO A 900 16.950 -15.467 -0.402 1.00 50.12 C ATOM 131 C PRO A 900 16.386 -15.435 1.020 1.00 70.33 C ATOM 132 O PRO A 900 15.754 -16.393 1.462 1.00 33.20 O ATOM 133 CB PRO A 900 17.967 -16.577 -0.613 1.00 40.43 C ATOM 134 CG PRO A 900 19.330 -15.905 -0.575 1.00 23.30 C ATOM 135 CD PRO A 900 19.115 -14.406 -0.697 1.00 10.30 C ATOM 0 HA PRO A 900 16.079 -15.616 -1.041 1.00 50.12 H new ATOM 0 HB2 PRO A 900 17.884 -17.336 0.165 1.00 40.43 H new ATOM 0 HB3 PRO A 900 17.805 -17.079 -1.567 1.00 40.43 H new ATOM 0 HG2 PRO A 900 19.846 -16.142 0.355 1.00 23.30 H new ATOM 0 HG3 PRO A 900 19.957 -16.268 -1.389 1.00 23.30 H new ATOM 0 HD2 PRO A 900 19.570 -13.872 0.137 1.00 10.30 H new ATOM 0 HD3 PRO A 900 19.564 -14.015 -1.610 1.00 10.30 H new ATOM 143 N SER A 901 16.635 -14.324 1.696 1.00 0.32 N ATOM 144 CA SER A 901 16.160 -14.154 3.059 1.00 71.51 C ATOM 145 C SER A 901 14.730 -13.609 3.051 1.00 44.13 C ATOM 146 O SER A 901 13.972 -13.832 3.993 1.00 54.14 O ATOM 147 CB SER A 901 17.079 -13.223 3.851 1.00 41.30 C ATOM 148 OG SER A 901 17.072 -13.523 5.244 1.00 14.10 O ATOM 0 H SER A 901 17.160 -13.532 1.326 1.00 0.32 H new ATOM 0 HA SER A 901 16.168 -15.128 3.548 1.00 71.51 H new ATOM 0 HB2 SER A 901 18.096 -13.306 3.468 1.00 41.30 H new ATOM 0 HB3 SER A 901 16.765 -12.190 3.701 1.00 41.30 H new ATOM 0 HG SER A 901 17.694 -14.259 5.423 1.00 14.10 H new ATOM 154 N LEU A 902 14.406 -12.904 1.977 1.00 64.25 N ATOM 155 CA LEU A 902 13.081 -12.325 1.833 1.00 5.02 C ATOM 156 C LEU A 902 12.144 -13.356 1.202 1.00 22.50 C ATOM 157 O LEU A 902 10.937 -13.327 1.434 1.00 34.10 O ATOM 158 CB LEU A 902 13.154 -11.006 1.061 1.00 60.21 C ATOM 159 CG LEU A 902 14.394 -10.147 1.315 1.00 24.24 C ATOM 160 CD1 LEU A 902 14.797 -9.379 0.055 1.00 0.33 C ATOM 161 CD2 LEU A 902 14.181 -9.216 2.511 1.00 72.43 C ATOM 0 H LEU A 902 15.038 -12.721 1.198 1.00 64.25 H new ATOM 0 HA LEU A 902 12.667 -12.074 2.809 1.00 5.02 H new ATOM 0 HB2 LEU A 902 13.103 -11.229 -0.005 1.00 60.21 H new ATOM 0 HB3 LEU A 902 12.271 -10.415 1.306 1.00 60.21 H new ATOM 0 HG LEU A 902 15.222 -10.809 1.566 1.00 24.24 H new ATOM 0 HD11 LEU A 902 15.681 -8.776 0.263 1.00 0.33 H new ATOM 0 HD12 LEU A 902 15.019 -10.084 -0.746 1.00 0.33 H new ATOM 0 HD13 LEU A 902 13.978 -8.728 -0.252 1.00 0.33 H new ATOM 0 HD21 LEU A 902 15.077 -8.617 2.670 1.00 72.43 H new ATOM 0 HD22 LEU A 902 13.335 -8.558 2.314 1.00 72.43 H new ATOM 0 HD23 LEU A 902 13.979 -9.810 3.403 1.00 72.43 H new ATOM 173 N ILE A 903 12.736 -14.244 0.416 1.00 21.14 N ATOM 174 CA ILE A 903 11.969 -15.283 -0.250 1.00 1.11 C ATOM 175 C ILE A 903 12.023 -16.565 0.584 1.00 52.42 C ATOM 176 O ILE A 903 12.947 -16.758 1.373 1.00 74.15 O ATOM 177 CB ILE A 903 12.452 -15.465 -1.690 1.00 63.41 C ATOM 178 CG1 ILE A 903 13.729 -16.308 -1.738 1.00 12.54 C ATOM 179 CG2 ILE A 903 12.631 -14.113 -2.384 1.00 24.42 C ATOM 180 CD1 ILE A 903 14.622 -15.883 -2.905 1.00 25.32 C ATOM 0 H ILE A 903 13.738 -14.265 0.226 1.00 21.14 H new ATOM 0 HA ILE A 903 10.920 -14.995 -0.324 1.00 1.11 H new ATOM 0 HB ILE A 903 11.685 -16.010 -2.241 1.00 63.41 H new ATOM 0 HG12 ILE A 903 14.275 -16.202 -0.800 1.00 12.54 H new ATOM 0 HG13 ILE A 903 13.470 -17.362 -1.839 1.00 12.54 H new ATOM 0 HG21 ILE A 903 12.975 -14.271 -3.406 1.00 24.42 H new ATOM 0 HG22 ILE A 903 11.679 -13.583 -2.400 1.00 24.42 H new ATOM 0 HG23 ILE A 903 13.367 -13.520 -1.841 1.00 24.42 H new ATOM 0 HD11 ILE A 903 15.522 -16.497 -2.917 1.00 25.32 H new ATOM 0 HD12 ILE A 903 14.082 -16.013 -3.843 1.00 25.32 H new ATOM 0 HD13 ILE A 903 14.899 -14.835 -2.788 1.00 25.32 H new ATOM 192 N THR A 904 11.021 -17.407 0.381 1.00 75.02 N ATOM 193 CA THR A 904 10.942 -18.665 1.104 1.00 11.10 C ATOM 194 C THR A 904 10.267 -19.734 0.243 1.00 52.14 C ATOM 195 O THR A 904 9.593 -19.414 -0.735 1.00 53.12 O ATOM 196 CB THR A 904 10.219 -18.405 2.427 1.00 22.12 C ATOM 197 OG1 THR A 904 10.502 -17.038 2.715 1.00 61.41 O ATOM 198 CG2 THR A 904 10.845 -19.169 3.596 1.00 32.00 C ATOM 0 H THR A 904 10.257 -17.243 -0.274 1.00 75.02 H new ATOM 0 HA THR A 904 11.935 -19.054 1.330 1.00 11.10 H new ATOM 0 HB THR A 904 9.171 -18.686 2.329 1.00 22.12 H new ATOM 0 HG1 THR A 904 10.069 -16.785 3.557 1.00 61.41 H new ATOM 0 HG21 THR A 904 10.294 -18.949 4.511 1.00 32.00 H new ATOM 0 HG22 THR A 904 10.803 -20.240 3.395 1.00 32.00 H new ATOM 0 HG23 THR A 904 11.884 -18.863 3.716 1.00 32.00 H new ATOM 206 N PHE A 905 10.472 -20.982 0.637 1.00 75.10 N ATOM 207 CA PHE A 905 9.891 -22.100 -0.087 1.00 21.42 C ATOM 208 C PHE A 905 8.620 -22.599 0.603 1.00 75.23 C ATOM 209 O PHE A 905 8.565 -22.680 1.829 1.00 51.11 O ATOM 210 CB PHE A 905 10.931 -23.222 -0.086 1.00 23.35 C ATOM 211 CG PHE A 905 12.284 -22.817 -0.674 1.00 62.12 C ATOM 212 CD1 PHE A 905 12.425 -21.612 -1.288 1.00 2.31 C ATOM 213 CD2 PHE A 905 13.346 -23.662 -0.584 1.00 32.43 C ATOM 214 CE1 PHE A 905 13.681 -21.236 -1.834 1.00 52.42 C ATOM 215 CE2 PHE A 905 14.601 -23.286 -1.130 1.00 24.41 C ATOM 216 CZ PHE A 905 14.742 -22.081 -1.744 1.00 4.04 C ATOM 0 H PHE A 905 11.032 -21.244 1.448 1.00 75.10 H new ATOM 0 HA PHE A 905 9.626 -21.791 -1.098 1.00 21.42 H new ATOM 0 HB2 PHE A 905 11.079 -23.565 0.938 1.00 23.35 H new ATOM 0 HB3 PHE A 905 10.539 -24.067 -0.652 1.00 23.35 H new ATOM 0 HD1 PHE A 905 11.582 -20.941 -1.360 1.00 2.31 H new ATOM 0 HD2 PHE A 905 13.234 -24.619 -0.097 1.00 32.43 H new ATOM 0 HE1 PHE A 905 13.793 -20.278 -2.321 1.00 52.42 H new ATOM 0 HE2 PHE A 905 15.444 -23.957 -1.058 1.00 24.41 H new ATOM 0 HZ PHE A 905 15.697 -21.795 -2.160 1.00 4.04 H new ATOM 226 N LEU A 906 7.628 -22.921 -0.215 1.00 43.24 N ATOM 227 CA LEU A 906 6.361 -23.410 0.300 1.00 12.54 C ATOM 228 C LEU A 906 5.927 -24.637 -0.504 1.00 1.14 C ATOM 229 O LEU A 906 6.540 -25.014 -1.502 1.00 54.22 O ATOM 230 CB LEU A 906 5.321 -22.287 0.318 1.00 21.22 C ATOM 231 CG LEU A 906 5.867 -20.870 0.502 1.00 3.24 C ATOM 232 CD1 LEU A 906 4.824 -19.824 0.103 1.00 21.25 C ATOM 233 CD2 LEU A 906 6.373 -20.659 1.931 1.00 44.43 C ATOM 0 H LEU A 906 7.677 -22.852 -1.232 1.00 43.24 H new ATOM 0 HA LEU A 906 6.469 -23.730 1.336 1.00 12.54 H new ATOM 0 HB2 LEU A 906 4.762 -22.321 -0.617 1.00 21.22 H new ATOM 0 HB3 LEU A 906 4.612 -22.489 1.121 1.00 21.22 H new ATOM 0 HG LEU A 906 6.720 -20.744 -0.164 1.00 3.24 H new ATOM 0 HD11 LEU A 906 5.238 -18.825 0.243 1.00 21.25 H new ATOM 0 HD12 LEU A 906 4.554 -19.961 -0.944 1.00 21.25 H new ATOM 0 HD13 LEU A 906 3.936 -19.940 0.725 1.00 21.25 H new ATOM 0 HD21 LEU A 906 6.756 -19.644 2.035 1.00 44.43 H new ATOM 0 HD22 LEU A 906 5.554 -20.812 2.633 1.00 44.43 H new ATOM 0 HD23 LEU A 906 7.170 -21.371 2.143 1.00 44.43 H new ATOM 245 N CYS A 907 4.846 -25.258 -0.042 1.00 1.22 N ATOM 246 CA CYS A 907 4.307 -26.444 -0.696 1.00 52.41 C ATOM 247 C CYS A 907 3.241 -26.064 -1.720 1.00 1.40 C ATOM 248 O CYS A 907 2.191 -25.551 -1.334 1.00 64.32 O ATOM 249 CB CYS A 907 3.715 -27.400 0.341 1.00 12.41 C ATOM 250 SG CYS A 907 3.054 -28.944 -0.364 1.00 24.51 S ATOM 0 H CYS A 907 4.326 -24.959 0.783 1.00 1.22 H new ATOM 0 HA CYS A 907 5.124 -26.944 -1.216 1.00 52.41 H new ATOM 0 HB2 CYS A 907 4.484 -27.647 1.073 1.00 12.41 H new ATOM 0 HB3 CYS A 907 2.917 -26.888 0.878 1.00 12.41 H new ATOM 0 HG CYS A 907 3.673 -29.960 0.160 1.00 24.51 H new ATOM 255 N LYS A 908 3.530 -26.319 -2.988 1.00 1.35 N ATOM 256 CA LYS A 908 2.590 -25.998 -4.049 1.00 24.34 C ATOM 257 C LYS A 908 1.195 -26.487 -3.653 1.00 45.12 C ATOM 258 O LYS A 908 0.257 -25.696 -3.572 1.00 31.15 O ATOM 259 CB LYS A 908 3.081 -26.557 -5.386 1.00 5.42 C ATOM 260 CG LYS A 908 1.956 -26.565 -6.423 1.00 24.44 C ATOM 261 CD LYS A 908 2.513 -26.395 -7.837 1.00 43.25 C ATOM 262 CE LYS A 908 2.672 -27.749 -8.531 1.00 74.23 C ATOM 263 NZ LYS A 908 1.426 -28.540 -8.415 1.00 53.21 N ATOM 0 H LYS A 908 4.402 -26.744 -3.304 1.00 1.35 H new ATOM 0 HA LYS A 908 2.523 -24.919 -4.186 1.00 24.34 H new ATOM 0 HB2 LYS A 908 3.913 -25.956 -5.752 1.00 5.42 H new ATOM 0 HB3 LYS A 908 3.457 -27.570 -5.245 1.00 5.42 H new ATOM 0 HG2 LYS A 908 1.402 -27.501 -6.357 1.00 24.44 H new ATOM 0 HG3 LYS A 908 1.252 -25.762 -6.207 1.00 24.44 H new ATOM 0 HD2 LYS A 908 1.846 -25.760 -8.420 1.00 43.25 H new ATOM 0 HD3 LYS A 908 3.478 -25.889 -7.793 1.00 43.25 H new ATOM 0 HE2 LYS A 908 2.918 -27.599 -9.582 1.00 74.23 H new ATOM 0 HE3 LYS A 908 3.501 -28.298 -8.085 1.00 74.23 H new ATOM 0 HZ1 LYS A 908 1.340 -29.175 -9.234 1.00 53.21 H new ATOM 0 HZ2 LYS A 908 1.453 -29.104 -7.541 1.00 53.21 H new ATOM 0 HZ3 LYS A 908 0.608 -27.898 -8.388 1.00 53.21 H new ATOM 276 N ASN A 909 1.104 -27.788 -3.418 1.00 55.43 N ATOM 277 CA ASN A 909 -0.161 -28.391 -3.033 1.00 71.05 C ATOM 278 C ASN A 909 -0.808 -27.550 -1.931 1.00 51.13 C ATOM 279 O ASN A 909 -1.927 -27.066 -2.091 1.00 55.22 O ATOM 280 CB ASN A 909 0.047 -29.805 -2.488 1.00 72.33 C ATOM 281 CG ASN A 909 -0.060 -30.845 -3.606 1.00 5.12 C ATOM 282 OD1 ASN A 909 0.136 -30.559 -4.776 1.00 11.13 O ATOM 283 ND2 ASN A 909 -0.379 -32.064 -3.182 1.00 34.12 N ATOM 0 H ASN A 909 1.885 -28.441 -3.487 1.00 55.43 H new ATOM 0 HA ASN A 909 -0.797 -28.435 -3.917 1.00 71.05 H new ATOM 0 HB2 ASN A 909 1.026 -29.875 -2.013 1.00 72.33 H new ATOM 0 HB3 ASN A 909 -0.696 -30.015 -1.719 1.00 72.33 H new ATOM 0 HD21 ASN A 909 -0.473 -32.828 -3.851 1.00 34.12 H new ATOM 0 HD22 ASN A 909 -0.530 -32.235 -2.188 1.00 34.12 H new ATOM 290 N CYS A 910 -0.076 -27.402 -0.837 1.00 43.32 N ATOM 291 CA CYS A 910 -0.564 -26.627 0.291 1.00 32.42 C ATOM 292 C CYS A 910 0.061 -25.233 0.223 1.00 13.51 C ATOM 293 O CYS A 910 -0.369 -24.394 -0.567 1.00 50.15 O ATOM 294 CB CYS A 910 -0.269 -27.321 1.623 1.00 52.41 C ATOM 295 SG CYS A 910 -1.078 -28.948 1.836 1.00 23.33 S ATOM 0 H CYS A 910 0.852 -27.806 -0.708 1.00 43.32 H new ATOM 0 HA CYS A 910 -1.649 -26.540 0.234 1.00 32.42 H new ATOM 0 HB2 CYS A 910 0.809 -27.452 1.718 1.00 52.41 H new ATOM 0 HB3 CYS A 910 -0.583 -26.666 2.435 1.00 52.41 H new ATOM 300 N SER A 911 1.065 -25.027 1.062 1.00 20.35 N ATOM 301 CA SER A 911 1.753 -23.748 1.108 1.00 63.45 C ATOM 302 C SER A 911 2.430 -23.566 2.468 1.00 52.23 C ATOM 303 O SER A 911 2.384 -22.482 3.047 1.00 3.22 O ATOM 304 CB SER A 911 0.788 -22.593 0.836 1.00 74.43 C ATOM 305 OG SER A 911 0.768 -22.227 -0.541 1.00 51.32 O ATOM 0 H SER A 911 1.419 -25.725 1.716 1.00 20.35 H new ATOM 0 HA SER A 911 2.514 -23.741 0.327 1.00 63.45 H new ATOM 0 HB2 SER A 911 -0.216 -22.878 1.150 1.00 74.43 H new ATOM 0 HB3 SER A 911 1.077 -21.730 1.436 1.00 74.43 H new ATOM 0 HG SER A 911 0.352 -22.944 -1.064 1.00 51.32 H new ATOM 311 N VAL A 912 3.042 -24.643 2.938 1.00 53.14 N ATOM 312 CA VAL A 912 3.727 -24.615 4.219 1.00 72.32 C ATOM 313 C VAL A 912 5.214 -24.337 3.991 1.00 30.31 C ATOM 314 O VAL A 912 5.831 -24.927 3.105 1.00 31.14 O ATOM 315 CB VAL A 912 3.472 -25.920 4.977 1.00 54.41 C ATOM 316 CG1 VAL A 912 2.043 -26.416 4.748 1.00 72.44 C ATOM 317 CG2 VAL A 912 4.493 -26.989 4.587 1.00 65.32 C ATOM 0 H VAL A 912 3.078 -25.540 2.455 1.00 53.14 H new ATOM 0 HA VAL A 912 3.338 -23.811 4.843 1.00 72.32 H new ATOM 0 HB VAL A 912 3.590 -25.718 6.042 1.00 54.41 H new ATOM 0 HG11 VAL A 912 1.888 -27.345 5.297 1.00 72.44 H new ATOM 0 HG12 VAL A 912 1.336 -25.664 5.099 1.00 72.44 H new ATOM 0 HG13 VAL A 912 1.886 -26.593 3.684 1.00 72.44 H new ATOM 0 HG21 VAL A 912 4.289 -27.906 5.140 1.00 65.32 H new ATOM 0 HG22 VAL A 912 4.422 -27.187 3.517 1.00 65.32 H new ATOM 0 HG23 VAL A 912 5.497 -26.637 4.825 1.00 65.32 H new ATOM 327 N LEU A 913 5.747 -23.439 4.806 1.00 12.20 N ATOM 328 CA LEU A 913 7.150 -23.075 4.705 1.00 61.53 C ATOM 329 C LEU A 913 8.013 -24.286 5.067 1.00 42.24 C ATOM 330 O LEU A 913 8.087 -24.674 6.231 1.00 34.34 O ATOM 331 CB LEU A 913 7.445 -21.835 5.550 1.00 12.13 C ATOM 332 CG LEU A 913 8.905 -21.380 5.587 1.00 1.32 C ATOM 333 CD1 LEU A 913 9.640 -21.991 6.781 1.00 30.55 C ATOM 334 CD2 LEU A 913 9.608 -21.686 4.263 1.00 4.24 C ATOM 0 H LEU A 913 5.232 -22.952 5.540 1.00 12.20 H new ATOM 0 HA LEU A 913 7.399 -22.799 3.680 1.00 61.53 H new ATOM 0 HB2 LEU A 913 6.838 -21.011 5.175 1.00 12.13 H new ATOM 0 HB3 LEU A 913 7.120 -22.031 6.572 1.00 12.13 H new ATOM 0 HG LEU A 913 8.922 -20.298 5.718 1.00 1.32 H new ATOM 0 HD11 LEU A 913 10.676 -21.651 6.783 1.00 30.55 H new ATOM 0 HD12 LEU A 913 9.154 -21.680 7.706 1.00 30.55 H new ATOM 0 HD13 LEU A 913 9.615 -23.078 6.706 1.00 30.55 H new ATOM 0 HD21 LEU A 913 10.644 -21.353 4.316 1.00 4.24 H new ATOM 0 HD22 LEU A 913 9.581 -22.760 4.076 1.00 4.24 H new ATOM 0 HD23 LEU A 913 9.100 -21.164 3.452 1.00 4.24 H new ATOM 346 N ALA A 914 8.645 -24.848 4.047 1.00 41.12 N ATOM 347 CA ALA A 914 9.500 -26.006 4.243 1.00 63.21 C ATOM 348 C ALA A 914 10.916 -25.537 4.585 1.00 61.33 C ATOM 349 O ALA A 914 11.611 -26.175 5.374 1.00 44.01 O ATOM 350 CB ALA A 914 9.464 -26.886 2.992 1.00 54.25 C ATOM 0 H ALA A 914 8.582 -24.523 3.082 1.00 41.12 H new ATOM 0 HA ALA A 914 9.142 -26.610 5.077 1.00 63.21 H new ATOM 0 HB1 ALA A 914 10.106 -27.755 3.140 1.00 54.25 H new ATOM 0 HB2 ALA A 914 8.442 -27.217 2.809 1.00 54.25 H new ATOM 0 HB3 ALA A 914 9.819 -26.314 2.135 1.00 54.25 H new ATOM 356 N CYS A 915 11.301 -24.426 3.974 1.00 72.54 N ATOM 357 CA CYS A 915 12.621 -23.865 4.203 1.00 1.23 C ATOM 358 C CYS A 915 12.726 -22.551 3.426 1.00 63.54 C ATOM 359 O CYS A 915 11.931 -22.295 2.523 1.00 0.00 O ATOM 360 CB CYS A 915 13.729 -24.847 3.817 1.00 33.11 C ATOM 361 SG CYS A 915 13.262 -25.749 2.295 1.00 62.22 S ATOM 0 H CYS A 915 10.721 -23.899 3.320 1.00 72.54 H new ATOM 0 HA CYS A 915 12.755 -23.669 5.267 1.00 1.23 H new ATOM 0 HB2 CYS A 915 14.664 -24.310 3.659 1.00 33.11 H new ATOM 0 HB3 CYS A 915 13.901 -25.553 4.630 1.00 33.11 H new ATOM 0 HG CYS A 915 13.424 -27.026 2.480 1.00 62.22 H new ATOM 367 N SER A 916 13.715 -21.754 3.804 1.00 35.21 N ATOM 368 CA SER A 916 13.934 -20.474 3.153 1.00 0.34 C ATOM 369 C SER A 916 15.213 -20.525 2.315 1.00 20.12 C ATOM 370 O SER A 916 16.080 -21.366 2.550 1.00 53.15 O ATOM 371 CB SER A 916 14.017 -19.342 4.179 1.00 11.33 C ATOM 372 OG SER A 916 15.270 -19.326 4.857 1.00 23.32 O ATOM 0 H SER A 916 14.373 -21.970 4.553 1.00 35.21 H new ATOM 0 HA SER A 916 13.086 -20.274 2.498 1.00 0.34 H new ATOM 0 HB2 SER A 916 13.864 -18.386 3.677 1.00 11.33 H new ATOM 0 HB3 SER A 916 13.213 -19.452 4.906 1.00 11.33 H new ATOM 0 HG SER A 916 15.228 -18.697 5.607 1.00 23.32 H new ATOM 378 N GLY A 917 15.290 -19.615 1.356 1.00 44.15 N ATOM 379 CA GLY A 917 16.449 -19.546 0.481 1.00 11.12 C ATOM 380 C GLY A 917 17.743 -19.448 1.292 1.00 13.30 C ATOM 381 O GLY A 917 18.654 -20.254 1.114 1.00 70.33 O ATOM 0 H GLY A 917 14.569 -18.919 1.165 1.00 44.15 H new ATOM 0 HA2 GLY A 917 16.481 -20.430 -0.156 1.00 11.12 H new ATOM 0 HA3 GLY A 917 16.362 -18.681 -0.177 1.00 11.12 H new ATOM 385 N GLU A 918 17.782 -18.452 2.166 1.00 72.34 N ATOM 386 CA GLU A 918 18.949 -18.238 3.004 1.00 32.24 C ATOM 387 C GLU A 918 19.317 -19.528 3.741 1.00 13.42 C ATOM 388 O GLU A 918 20.483 -19.754 4.059 1.00 3.20 O ATOM 389 CB GLU A 918 18.713 -17.092 3.990 1.00 52.12 C ATOM 390 CG GLU A 918 17.566 -17.420 4.948 1.00 1.21 C ATOM 391 CD GLU A 918 17.707 -16.643 6.258 1.00 3.54 C ATOM 392 OE1 GLU A 918 18.431 -15.637 6.308 1.00 64.21 O ATOM 393 OE2 GLU A 918 17.031 -17.117 7.249 1.00 14.52 O ATOM 0 H GLU A 918 17.024 -17.785 2.311 1.00 72.34 H new ATOM 0 HA GLU A 918 19.785 -17.957 2.364 1.00 32.24 H new ATOM 0 HB2 GLU A 918 19.624 -16.903 4.559 1.00 52.12 H new ATOM 0 HB3 GLU A 918 18.484 -16.178 3.442 1.00 52.12 H new ATOM 0 HG2 GLU A 918 16.613 -17.177 4.477 1.00 1.21 H new ATOM 0 HG3 GLU A 918 17.555 -18.490 5.155 1.00 1.21 H new ATOM 401 N ASP A 919 18.300 -20.339 3.991 1.00 31.25 N ATOM 402 CA ASP A 919 18.502 -21.600 4.685 1.00 72.00 C ATOM 403 C ASP A 919 18.710 -22.715 3.658 1.00 40.54 C ATOM 404 O ASP A 919 18.380 -23.871 3.915 1.00 14.04 O ATOM 405 CB ASP A 919 17.282 -21.962 5.535 1.00 64.50 C ATOM 406 CG ASP A 919 17.598 -22.702 6.836 1.00 22.35 C ATOM 407 OD1 ASP A 919 16.717 -23.327 7.446 1.00 64.33 O ATOM 408 OD2 ASP A 919 18.825 -22.618 7.228 1.00 74.04 O ATOM 0 H ASP A 919 17.334 -20.148 3.726 1.00 31.25 H new ATOM 0 HA ASP A 919 19.373 -21.494 5.331 1.00 72.00 H new ATOM 0 HB2 ASP A 919 16.742 -21.047 5.777 1.00 64.50 H new ATOM 0 HB3 ASP A 919 16.611 -22.579 4.937 1.00 64.50 H new ATOM 414 N ILE A 920 19.257 -22.327 2.515 1.00 71.44 N ATOM 415 CA ILE A 920 19.513 -23.279 1.447 1.00 22.43 C ATOM 416 C ILE A 920 20.932 -23.072 0.914 1.00 3.15 C ATOM 417 O ILE A 920 21.454 -21.958 0.945 1.00 22.44 O ATOM 418 CB ILE A 920 18.431 -23.181 0.370 1.00 43.40 C ATOM 419 CG1 ILE A 920 17.053 -23.513 0.945 1.00 11.41 C ATOM 420 CG2 ILE A 920 18.776 -24.058 -0.835 1.00 50.23 C ATOM 421 CD1 ILE A 920 16.726 -24.996 0.764 1.00 71.24 C ATOM 0 H ILE A 920 19.530 -21.367 2.305 1.00 71.44 H new ATOM 0 HA ILE A 920 19.460 -24.299 1.826 1.00 22.43 H new ATOM 0 HB ILE A 920 18.392 -22.150 0.017 1.00 43.40 H new ATOM 0 HG12 ILE A 920 17.026 -23.258 2.004 1.00 11.41 H new ATOM 0 HG13 ILE A 920 16.293 -22.907 0.452 1.00 11.41 H new ATOM 0 HG21 ILE A 920 17.991 -23.970 -1.586 1.00 50.23 H new ATOM 0 HG22 ILE A 920 19.725 -23.733 -1.262 1.00 50.23 H new ATOM 0 HG23 ILE A 920 18.859 -25.097 -0.517 1.00 50.23 H new ATOM 0 HD11 ILE A 920 15.741 -25.205 1.181 1.00 71.24 H new ATOM 0 HD12 ILE A 920 16.730 -25.242 -0.298 1.00 71.24 H new ATOM 0 HD13 ILE A 920 17.474 -25.599 1.279 1.00 71.24 H new ATOM 433 N HIS A 921 21.517 -24.161 0.438 1.00 35.52 N ATOM 434 CA HIS A 921 22.865 -24.113 -0.101 1.00 1.14 C ATOM 435 C HIS A 921 22.853 -24.582 -1.557 1.00 22.12 C ATOM 436 O HIS A 921 21.934 -25.281 -1.980 1.00 55.43 O ATOM 437 CB HIS A 921 23.829 -24.918 0.774 1.00 53.22 C ATOM 438 CG HIS A 921 24.269 -24.198 2.026 1.00 11.21 C ATOM 439 ND1 HIS A 921 24.080 -24.717 3.295 1.00 13.21 N ATOM 440 CD2 HIS A 921 24.891 -22.995 2.191 1.00 64.43 C ATOM 441 CE1 HIS A 921 24.569 -23.857 4.176 1.00 41.20 C ATOM 442 NE2 HIS A 921 25.071 -22.790 3.490 1.00 63.34 N ATOM 0 H HIS A 921 21.081 -25.083 0.414 1.00 35.52 H new ATOM 0 HA HIS A 921 23.228 -23.085 -0.090 1.00 1.14 H new ATOM 0 HB2 HIS A 921 23.351 -25.856 1.056 1.00 53.22 H new ATOM 0 HB3 HIS A 921 24.710 -25.174 0.186 1.00 53.22 H new ATOM 0 HD2 HIS A 921 25.187 -22.323 1.399 1.00 64.43 H new ATOM 0 HE1 HIS A 921 24.570 -23.979 5.249 1.00 41.20 H new ATOM 0 HE2 HIS A 921 25.512 -21.970 3.907 1.00 63.34 H new ATOM 450 N VAL A 922 23.885 -24.179 -2.283 1.00 64.21 N ATOM 451 CA VAL A 922 24.005 -24.550 -3.683 1.00 44.51 C ATOM 452 C VAL A 922 25.328 -25.287 -3.899 1.00 61.44 C ATOM 453 O VAL A 922 26.228 -25.215 -3.063 1.00 54.45 O ATOM 454 CB VAL A 922 23.862 -23.309 -4.567 1.00 15.22 C ATOM 455 CG1 VAL A 922 24.175 -23.637 -6.028 1.00 4.02 C ATOM 456 CG2 VAL A 922 22.466 -22.697 -4.430 1.00 10.14 C ATOM 0 H VAL A 922 24.646 -23.599 -1.928 1.00 64.21 H new ATOM 0 HA VAL A 922 23.203 -25.231 -3.968 1.00 44.51 H new ATOM 0 HB VAL A 922 24.588 -22.570 -4.227 1.00 15.22 H new ATOM 0 HG11 VAL A 922 24.066 -22.738 -6.634 1.00 4.02 H new ATOM 0 HG12 VAL A 922 25.198 -24.006 -6.107 1.00 4.02 H new ATOM 0 HG13 VAL A 922 23.485 -24.401 -6.385 1.00 4.02 H new ATOM 0 HG21 VAL A 922 22.390 -21.817 -5.068 1.00 10.14 H new ATOM 0 HG22 VAL A 922 21.717 -23.429 -4.731 1.00 10.14 H new ATOM 0 HG23 VAL A 922 22.295 -22.409 -3.393 1.00 10.14 H new ATOM 573 N VAL A 929 20.908 -28.511 -3.267 1.00 43.33 N ATOM 574 CA VAL A 929 20.794 -29.462 -2.175 1.00 64.42 C ATOM 575 C VAL A 929 20.395 -28.721 -0.898 1.00 33.11 C ATOM 576 O VAL A 929 20.976 -27.689 -0.567 1.00 40.45 O ATOM 577 CB VAL A 929 22.099 -30.248 -2.027 1.00 42.33 C ATOM 578 CG1 VAL A 929 22.215 -31.326 -3.106 1.00 62.41 C ATOM 579 CG2 VAL A 929 23.309 -29.311 -2.056 1.00 32.33 C ATOM 0 HA VAL A 929 20.012 -30.192 -2.385 1.00 64.42 H new ATOM 0 HB VAL A 929 22.083 -30.745 -1.057 1.00 42.33 H new ATOM 0 HG11 VAL A 929 23.151 -31.870 -2.978 1.00 62.41 H new ATOM 0 HG12 VAL A 929 21.378 -32.019 -3.019 1.00 62.41 H new ATOM 0 HG13 VAL A 929 22.199 -30.859 -4.091 1.00 62.41 H new ATOM 0 HG21 VAL A 929 24.224 -29.894 -1.949 1.00 32.33 H new ATOM 0 HG22 VAL A 929 23.330 -28.773 -3.004 1.00 32.33 H new ATOM 0 HG23 VAL A 929 23.236 -28.597 -1.236 1.00 32.33 H new ATOM 589 N ASN A 930 19.405 -29.277 -0.214 1.00 41.24 N ATOM 590 CA ASN A 930 18.921 -28.681 1.019 1.00 30.24 C ATOM 591 C ASN A 930 19.556 -29.400 2.211 1.00 22.03 C ATOM 592 O ASN A 930 19.068 -30.442 2.644 1.00 35.44 O ATOM 593 CB ASN A 930 17.402 -28.819 1.139 1.00 70.53 C ATOM 594 CG ASN A 930 16.927 -28.458 2.548 1.00 44.14 C ATOM 595 OD1 ASN A 930 17.347 -29.033 3.539 1.00 41.44 O ATOM 596 ND2 ASN A 930 16.031 -27.476 2.581 1.00 3.31 N ATOM 0 H ASN A 930 18.925 -30.134 -0.491 1.00 41.24 H new ATOM 0 HA ASN A 930 19.187 -27.624 1.010 1.00 30.24 H new ATOM 0 HB2 ASN A 930 16.916 -28.170 0.410 1.00 70.53 H new ATOM 0 HB3 ASN A 930 17.107 -29.841 0.903 1.00 70.53 H new ATOM 0 HD21 ASN A 930 15.652 -27.161 3.474 1.00 3.31 H new ATOM 0 HD22 ASN A 930 15.723 -27.038 1.713 1.00 3.31 H new ATOM 603 N MET A 931 20.636 -28.814 2.708 1.00 60.53 N ATOM 604 CA MET A 931 21.343 -29.386 3.841 1.00 22.11 C ATOM 605 C MET A 931 20.683 -28.981 5.160 1.00 1.45 C ATOM 606 O MET A 931 21.362 -28.555 6.093 1.00 3.14 O ATOM 607 CB MET A 931 22.797 -28.909 3.829 1.00 12.24 C ATOM 608 CG MET A 931 23.429 -29.111 2.451 1.00 42.11 C ATOM 609 SD MET A 931 23.822 -30.835 2.206 1.00 2.24 S ATOM 610 CE MET A 931 25.578 -30.801 2.526 1.00 41.34 C ATOM 0 H MET A 931 21.038 -27.949 2.347 1.00 60.53 H new ATOM 0 HA MET A 931 21.307 -30.472 3.757 1.00 22.11 H new ATOM 0 HB2 MET A 931 22.840 -27.854 4.102 1.00 12.24 H new ATOM 0 HB3 MET A 931 23.369 -29.455 4.579 1.00 12.24 H new ATOM 0 HG2 MET A 931 22.744 -28.772 1.674 1.00 42.11 H new ATOM 0 HG3 MET A 931 24.333 -28.508 2.364 1.00 42.11 H new ATOM 0 HE1 MET A 931 25.987 -31.805 2.416 1.00 41.34 H new ATOM 0 HE2 MET A 931 26.064 -30.131 1.817 1.00 41.34 H new ATOM 0 HE3 MET A 931 25.756 -30.446 3.541 1.00 41.34 H new ATOM 620 N THR A 932 19.367 -29.127 5.196 1.00 32.13 N ATOM 621 CA THR A 932 18.607 -28.781 6.386 1.00 64.51 C ATOM 622 C THR A 932 18.110 -30.047 7.087 1.00 14.21 C ATOM 623 O THR A 932 17.397 -30.852 6.490 1.00 22.40 O ATOM 624 CB THR A 932 17.480 -27.835 5.969 1.00 44.53 C ATOM 625 OG1 THR A 932 18.011 -27.138 4.845 1.00 54.25 O ATOM 626 CG2 THR A 932 17.226 -26.735 7.002 1.00 23.44 C ATOM 0 H THR A 932 18.807 -29.480 4.420 1.00 32.13 H new ATOM 0 HA THR A 932 19.229 -28.265 7.117 1.00 64.51 H new ATOM 0 HB THR A 932 16.565 -28.407 5.815 1.00 44.53 H new ATOM 0 HG1 THR A 932 18.269 -27.782 4.153 1.00 54.25 H new ATOM 0 HG21 THR A 932 16.417 -26.092 6.657 1.00 23.44 H new ATOM 0 HG22 THR A 932 16.949 -27.187 7.954 1.00 23.44 H new ATOM 0 HG23 THR A 932 18.131 -26.142 7.132 1.00 23.44 H new ATOM 634 N PRO A 933 18.515 -30.186 8.378 1.00 51.22 N ATOM 635 CA PRO A 933 18.118 -31.339 9.167 1.00 72.52 C ATOM 636 C PRO A 933 16.655 -31.229 9.602 1.00 70.23 C ATOM 637 O PRO A 933 15.911 -32.207 9.543 1.00 53.34 O ATOM 638 CB PRO A 933 19.085 -31.367 10.339 1.00 44.44 C ATOM 639 CG PRO A 933 19.687 -29.973 10.415 1.00 50.32 C ATOM 640 CD PRO A 933 19.359 -29.252 9.118 1.00 52.15 C ATOM 0 HA PRO A 933 18.169 -32.271 8.604 1.00 72.52 H new ATOM 0 HB2 PRO A 933 18.569 -31.621 11.265 1.00 44.44 H new ATOM 0 HB3 PRO A 933 19.859 -32.119 10.189 1.00 44.44 H new ATOM 0 HG2 PRO A 933 19.282 -29.428 11.268 1.00 50.32 H new ATOM 0 HG3 PRO A 933 20.766 -30.031 10.557 1.00 50.32 H new ATOM 0 HD2 PRO A 933 18.839 -28.313 9.307 1.00 52.15 H new ATOM 0 HD3 PRO A 933 20.263 -29.009 8.561 1.00 52.15 H new ATOM 648 N GLU A 934 16.287 -30.030 10.029 1.00 73.34 N ATOM 649 CA GLU A 934 14.926 -29.779 10.473 1.00 22.40 C ATOM 650 C GLU A 934 13.931 -30.157 9.374 1.00 13.12 C ATOM 651 O GLU A 934 12.821 -30.601 9.663 1.00 32.42 O ATOM 652 CB GLU A 934 14.748 -28.320 10.897 1.00 70.15 C ATOM 653 CG GLU A 934 14.731 -27.394 9.679 1.00 54.03 C ATOM 654 CD GLU A 934 15.082 -25.959 10.076 1.00 3.13 C ATOM 655 OE1 GLU A 934 14.336 -25.024 9.749 1.00 32.43 O ATOM 656 OE2 GLU A 934 16.175 -25.832 10.750 1.00 30.12 O ATOM 0 H GLU A 934 16.907 -29.222 10.077 1.00 73.34 H new ATOM 0 HA GLU A 934 14.728 -30.403 11.345 1.00 22.40 H new ATOM 0 HB2 GLU A 934 13.818 -28.210 11.455 1.00 70.15 H new ATOM 0 HB3 GLU A 934 15.558 -28.031 11.567 1.00 70.15 H new ATOM 0 HG2 GLU A 934 15.442 -27.753 8.935 1.00 54.03 H new ATOM 0 HG3 GLU A 934 13.745 -27.416 9.215 1.00 54.03 H new ATOM 664 N PHE A 935 14.364 -29.966 8.137 1.00 54.03 N ATOM 665 CA PHE A 935 13.524 -30.281 6.993 1.00 2.12 C ATOM 666 C PHE A 935 13.130 -31.759 6.993 1.00 61.31 C ATOM 667 O PHE A 935 12.127 -32.138 6.390 1.00 13.24 O ATOM 668 CB PHE A 935 14.348 -29.985 5.739 1.00 41.35 C ATOM 669 CG PHE A 935 13.617 -30.287 4.429 1.00 44.24 C ATOM 670 CD1 PHE A 935 12.451 -29.651 4.138 1.00 11.24 C ATOM 671 CD2 PHE A 935 14.135 -31.191 3.554 1.00 35.34 C ATOM 672 CE1 PHE A 935 11.773 -29.931 2.923 1.00 72.04 C ATOM 673 CE2 PHE A 935 13.456 -31.472 2.339 1.00 44.42 C ATOM 674 CZ PHE A 935 12.290 -30.836 2.048 1.00 11.45 C ATOM 0 H PHE A 935 15.285 -29.597 7.901 1.00 54.03 H new ATOM 0 HA PHE A 935 12.609 -29.689 7.028 1.00 2.12 H new ATOM 0 HB2 PHE A 935 14.639 -28.935 5.747 1.00 41.35 H new ATOM 0 HB3 PHE A 935 15.267 -30.570 5.774 1.00 41.35 H new ATOM 0 HD1 PHE A 935 12.041 -28.932 4.832 1.00 11.24 H new ATOM 0 HD2 PHE A 935 15.062 -31.695 3.784 1.00 35.34 H new ATOM 0 HE1 PHE A 935 10.847 -29.426 2.693 1.00 72.04 H new ATOM 0 HE2 PHE A 935 13.866 -32.191 1.646 1.00 44.42 H new ATOM 0 HZ PHE A 935 11.775 -31.049 1.123 1.00 11.45 H new ATOM 684 N LYS A 936 13.940 -32.555 7.675 1.00 4.12 N ATOM 685 CA LYS A 936 13.689 -33.983 7.761 1.00 31.53 C ATOM 686 C LYS A 936 12.375 -34.222 8.509 1.00 43.53 C ATOM 687 O LYS A 936 11.814 -35.315 8.452 1.00 3.34 O ATOM 688 CB LYS A 936 14.889 -34.702 8.382 1.00 74.21 C ATOM 689 CG LYS A 936 14.728 -34.828 9.898 1.00 2.33 C ATOM 690 CD LYS A 936 15.911 -35.577 10.515 1.00 62.24 C ATOM 691 CE LYS A 936 17.196 -34.754 10.411 1.00 43.54 C ATOM 692 NZ LYS A 936 18.296 -35.414 11.148 1.00 3.14 N ATOM 0 H LYS A 936 14.771 -32.238 8.174 1.00 4.12 H new ATOM 0 HA LYS A 936 13.572 -34.409 6.765 1.00 31.53 H new ATOM 0 HB2 LYS A 936 14.992 -35.693 7.940 1.00 74.21 H new ATOM 0 HB3 LYS A 936 15.803 -34.154 8.154 1.00 74.21 H new ATOM 0 HG2 LYS A 936 14.649 -33.836 10.343 1.00 2.33 H new ATOM 0 HG3 LYS A 936 13.801 -35.354 10.126 1.00 2.33 H new ATOM 0 HD2 LYS A 936 15.700 -35.798 11.561 1.00 62.24 H new ATOM 0 HD3 LYS A 936 16.045 -36.533 10.008 1.00 62.24 H new ATOM 0 HE2 LYS A 936 17.473 -34.633 9.364 1.00 43.54 H new ATOM 0 HE3 LYS A 936 17.029 -33.755 10.814 1.00 43.54 H new ATOM 0 HZ1 LYS A 936 19.161 -34.842 11.067 1.00 3.14 H new ATOM 0 HZ2 LYS A 936 18.035 -35.507 12.150 1.00 3.14 H new ATOM 0 HZ3 LYS A 936 18.466 -36.358 10.745 1.00 3.14 H new ATOM 705 N GLU A 937 11.923 -33.180 9.192 1.00 70.25 N ATOM 706 CA GLU A 937 10.686 -33.262 9.949 1.00 32.23 C ATOM 707 C GLU A 937 9.567 -32.514 9.222 1.00 41.23 C ATOM 708 O GLU A 937 8.456 -32.397 9.737 1.00 63.31 O ATOM 709 CB GLU A 937 10.875 -32.721 11.368 1.00 71.41 C ATOM 710 CG GLU A 937 12.121 -33.322 12.022 1.00 35.33 C ATOM 711 CD GLU A 937 11.742 -34.425 13.013 1.00 74.44 C ATOM 712 OE1 GLU A 937 11.685 -34.177 14.226 1.00 3.41 O ATOM 713 OE2 GLU A 937 11.500 -35.576 12.481 1.00 15.41 O ATOM 0 H GLU A 937 12.391 -32.275 9.237 1.00 70.25 H new ATOM 0 HA GLU A 937 10.402 -34.311 10.030 1.00 32.23 H new ATOM 0 HB2 GLU A 937 10.963 -31.635 11.338 1.00 71.41 H new ATOM 0 HB3 GLU A 937 9.996 -32.953 11.970 1.00 71.41 H new ATOM 0 HG2 GLU A 937 12.779 -33.729 11.254 1.00 35.33 H new ATOM 0 HG3 GLU A 937 12.678 -32.540 12.538 1.00 35.33 H new ATOM 721 N LEU A 938 9.899 -32.026 8.035 1.00 21.05 N ATOM 722 CA LEU A 938 8.936 -31.292 7.232 1.00 63.10 C ATOM 723 C LEU A 938 8.578 -32.117 5.994 1.00 51.51 C ATOM 724 O LEU A 938 7.517 -31.924 5.401 1.00 5.11 O ATOM 725 CB LEU A 938 9.465 -29.893 6.908 1.00 74.34 C ATOM 726 CG LEU A 938 10.175 -29.163 8.049 1.00 21.32 C ATOM 727 CD1 LEU A 938 10.819 -27.867 7.554 1.00 14.53 C ATOM 728 CD2 LEU A 938 9.222 -28.919 9.221 1.00 21.31 C ATOM 0 H LEU A 938 10.821 -32.125 7.611 1.00 21.05 H new ATOM 0 HA LEU A 938 8.013 -31.137 7.790 1.00 63.10 H new ATOM 0 HB2 LEU A 938 10.156 -29.973 6.069 1.00 74.34 H new ATOM 0 HB3 LEU A 938 8.629 -29.278 6.575 1.00 74.34 H new ATOM 0 HG LEU A 938 10.979 -29.802 8.415 1.00 21.32 H new ATOM 0 HD11 LEU A 938 11.317 -27.368 8.385 1.00 14.53 H new ATOM 0 HD12 LEU A 938 11.550 -28.097 6.778 1.00 14.53 H new ATOM 0 HD13 LEU A 938 10.050 -27.212 7.145 1.00 14.53 H new ATOM 0 HD21 LEU A 938 9.752 -28.399 10.019 1.00 21.31 H new ATOM 0 HD22 LEU A 938 8.382 -28.310 8.886 1.00 21.31 H new ATOM 0 HD23 LEU A 938 8.852 -29.874 9.594 1.00 21.31 H new ATOM 740 N TYR A 939 9.482 -33.018 5.640 1.00 5.42 N ATOM 741 CA TYR A 939 9.275 -33.872 4.483 1.00 20.14 C ATOM 742 C TYR A 939 9.276 -35.349 4.885 1.00 45.50 C ATOM 743 O TYR A 939 9.916 -35.728 5.865 1.00 71.43 O ATOM 744 CB TYR A 939 10.457 -33.609 3.548 1.00 74.33 C ATOM 745 CG TYR A 939 11.655 -34.531 3.784 1.00 13.23 C ATOM 746 CD1 TYR A 939 11.556 -35.878 3.501 1.00 50.35 C ATOM 747 CD2 TYR A 939 12.834 -34.015 4.282 1.00 64.03 C ATOM 748 CE1 TYR A 939 12.684 -36.745 3.723 1.00 33.13 C ATOM 749 CE2 TYR A 939 13.962 -34.882 4.504 1.00 21.44 C ATOM 750 CZ TYR A 939 13.831 -36.205 4.214 1.00 1.43 C ATOM 751 OH TYR A 939 14.896 -37.024 4.425 1.00 41.33 O ATOM 0 H TYR A 939 10.360 -33.175 6.134 1.00 5.42 H new ATOM 0 HA TYR A 939 8.315 -33.657 4.014 1.00 20.14 H new ATOM 0 HB2 TYR A 939 10.123 -33.721 2.517 1.00 74.33 H new ATOM 0 HB3 TYR A 939 10.779 -32.574 3.668 1.00 74.33 H new ATOM 0 HD1 TYR A 939 10.633 -36.282 3.113 1.00 50.35 H new ATOM 0 HD2 TYR A 939 12.911 -32.961 4.505 1.00 64.03 H new ATOM 0 HE1 TYR A 939 12.620 -37.801 3.504 1.00 33.13 H new ATOM 0 HE2 TYR A 939 14.891 -34.491 4.892 1.00 21.44 H new ATOM 0 HH TYR A 939 15.646 -36.501 4.776 1.00 41.33 H new ATOM 761 N ILE A 940 8.553 -36.141 4.108 1.00 43.04 N ATOM 762 CA ILE A 940 8.463 -37.567 4.370 1.00 61.31 C ATOM 763 C ILE A 940 8.841 -38.339 3.104 1.00 73.10 C ATOM 764 O ILE A 940 8.427 -37.975 2.004 1.00 24.02 O ATOM 765 CB ILE A 940 7.080 -37.925 4.919 1.00 44.33 C ATOM 766 CG1 ILE A 940 6.485 -36.757 5.708 1.00 1.01 C ATOM 767 CG2 ILE A 940 7.135 -39.209 5.749 1.00 41.13 C ATOM 768 CD1 ILE A 940 5.103 -37.115 6.258 1.00 51.21 C ATOM 0 H ILE A 940 8.024 -35.822 3.296 1.00 43.04 H new ATOM 0 HA ILE A 940 9.173 -37.857 5.145 1.00 61.31 H new ATOM 0 HB ILE A 940 6.416 -38.116 4.076 1.00 44.33 H new ATOM 0 HG12 ILE A 940 7.150 -36.492 6.530 1.00 1.01 H new ATOM 0 HG13 ILE A 940 6.409 -35.880 5.065 1.00 1.01 H new ATOM 0 HG21 ILE A 940 6.139 -39.441 6.127 1.00 41.13 H new ATOM 0 HG22 ILE A 940 7.487 -40.031 5.125 1.00 41.13 H new ATOM 0 HG23 ILE A 940 7.818 -39.072 6.587 1.00 41.13 H new ATOM 0 HD11 ILE A 940 4.702 -36.268 6.815 1.00 51.21 H new ATOM 0 HD12 ILE A 940 4.434 -37.356 5.432 1.00 51.21 H new ATOM 0 HD13 ILE A 940 5.187 -37.977 6.920 1.00 51.21 H new ATOM 780 N VAL A 941 9.622 -39.391 3.302 1.00 53.05 N ATOM 781 CA VAL A 941 10.060 -40.217 2.189 1.00 34.45 C ATOM 782 C VAL A 941 9.120 -41.417 2.050 1.00 24.14 C ATOM 783 O VAL A 941 8.779 -42.061 3.041 1.00 15.54 O ATOM 784 CB VAL A 941 11.522 -40.622 2.383 1.00 63.52 C ATOM 785 CG1 VAL A 941 11.809 -41.973 1.724 1.00 34.53 C ATOM 786 CG2 VAL A 941 12.465 -39.542 1.850 1.00 5.12 C ATOM 0 H VAL A 941 9.963 -39.690 4.216 1.00 53.05 H new ATOM 0 HA VAL A 941 10.013 -39.657 1.255 1.00 34.45 H new ATOM 0 HB VAL A 941 11.701 -40.726 3.453 1.00 63.52 H new ATOM 0 HG11 VAL A 941 12.855 -42.237 1.877 1.00 34.53 H new ATOM 0 HG12 VAL A 941 11.173 -42.738 2.170 1.00 34.53 H new ATOM 0 HG13 VAL A 941 11.604 -41.908 0.656 1.00 34.53 H new ATOM 0 HG21 VAL A 941 13.498 -39.855 2.000 1.00 5.12 H new ATOM 0 HG22 VAL A 941 12.282 -39.392 0.786 1.00 5.12 H new ATOM 0 HG23 VAL A 941 12.287 -38.608 2.384 1.00 5.12 H new ATOM 796 N ARG A 942 8.730 -41.682 0.812 1.00 12.24 N ATOM 797 CA ARG A 942 7.837 -42.793 0.531 1.00 53.12 C ATOM 798 C ARG A 942 8.567 -43.870 -0.275 1.00 13.34 C ATOM 799 O ARG A 942 9.061 -43.603 -1.369 1.00 22.12 O ATOM 800 CB ARG A 942 6.607 -42.327 -0.251 1.00 41.32 C ATOM 801 CG ARG A 942 5.452 -41.990 0.694 1.00 52.23 C ATOM 802 CD ARG A 942 5.915 -41.060 1.817 1.00 43.23 C ATOM 803 NE ARG A 942 4.776 -40.727 2.701 1.00 50.55 N ATOM 804 CZ ARG A 942 4.180 -41.608 3.532 1.00 52.44 C ATOM 805 NH1 ARG A 942 4.611 -42.885 3.599 1.00 32.23 N ATOM 806 NH2 ARG A 942 3.169 -41.201 4.277 1.00 71.31 N ATOM 0 H ARG A 942 9.016 -41.147 -0.008 1.00 12.24 H new ATOM 0 HA ARG A 942 7.512 -43.206 1.486 1.00 53.12 H new ATOM 0 HB2 ARG A 942 6.861 -41.451 -0.847 1.00 41.32 H new ATOM 0 HB3 ARG A 942 6.297 -43.107 -0.947 1.00 41.32 H new ATOM 0 HG2 ARG A 942 4.646 -41.516 0.134 1.00 52.23 H new ATOM 0 HG3 ARG A 942 5.047 -42.908 1.121 1.00 52.23 H new ATOM 0 HD2 ARG A 942 6.706 -41.539 2.394 1.00 43.23 H new ATOM 0 HD3 ARG A 942 6.337 -40.148 1.394 1.00 43.23 H new ATOM 0 HE ARG A 942 4.419 -39.772 2.681 1.00 50.55 H new ATOM 0 HH11 ARG A 942 5.393 -43.191 3.019 1.00 32.23 H new ATOM 0 HH12 ARG A 942 4.155 -43.545 4.230 1.00 32.23 H new ATOM 0 HH21 ARG A 942 2.850 -40.234 4.219 1.00 71.31 H new ATOM 0 HH22 ARG A 942 2.707 -41.854 4.910 1.00 71.31 H new ATOM 819 N GLU A 943 8.611 -45.064 0.298 1.00 0.41 N ATOM 820 CA GLU A 943 9.272 -46.182 -0.353 1.00 3.21 C ATOM 821 C GLU A 943 8.853 -46.264 -1.822 1.00 31.40 C ATOM 822 O GLU A 943 7.743 -46.694 -2.131 1.00 34.41 O ATOM 823 CB GLU A 943 8.976 -47.494 0.376 1.00 4.23 C ATOM 824 CG GLU A 943 10.005 -48.567 0.013 1.00 12.14 C ATOM 825 CD GLU A 943 9.589 -49.933 0.564 1.00 44.24 C ATOM 826 OE1 GLU A 943 10.317 -50.521 1.378 1.00 41.43 O ATOM 827 OE2 GLU A 943 8.465 -50.382 0.117 1.00 5.41 O ATOM 0 H GLU A 943 8.200 -45.281 1.206 1.00 0.41 H new ATOM 0 HA GLU A 943 10.349 -46.017 -0.311 1.00 3.21 H new ATOM 0 HB2 GLU A 943 8.985 -47.326 1.453 1.00 4.23 H new ATOM 0 HB3 GLU A 943 7.976 -47.841 0.116 1.00 4.23 H new ATOM 0 HG2 GLU A 943 10.110 -48.624 -1.070 1.00 12.14 H new ATOM 0 HG3 GLU A 943 10.981 -48.291 0.413 1.00 12.14 H new ATOM 835 N ASN A 944 9.763 -45.846 -2.689 1.00 3.44 N ATOM 836 CA ASN A 944 9.502 -45.867 -4.118 1.00 13.22 C ATOM 837 C ASN A 944 10.830 -45.928 -4.874 1.00 42.42 C ATOM 838 O ASN A 944 11.633 -44.998 -4.802 1.00 31.30 O ATOM 839 CB ASN A 944 8.763 -44.603 -4.561 1.00 54.22 C ATOM 840 CG ASN A 944 8.770 -44.470 -6.085 1.00 51.44 C ATOM 841 OD1 ASN A 944 7.819 -44.811 -6.769 1.00 15.22 O ATOM 842 ND2 ASN A 944 9.893 -43.956 -6.578 1.00 42.31 N ATOM 0 H ASN A 944 10.683 -45.490 -2.429 1.00 3.44 H new ATOM 0 HA ASN A 944 8.886 -46.740 -4.336 1.00 13.22 H new ATOM 0 HB2 ASN A 944 7.735 -44.633 -4.200 1.00 54.22 H new ATOM 0 HB3 ASN A 944 9.233 -43.727 -4.114 1.00 54.22 H new ATOM 0 HD21 ASN A 944 9.996 -43.827 -7.585 1.00 42.31 H new ATOM 0 HD22 ASN A 944 10.652 -43.691 -5.950 1.00 42.31 H new ATOM 849 N LYS A 945 11.021 -47.031 -5.583 1.00 2.24 N ATOM 850 CA LYS A 945 12.239 -47.225 -6.352 1.00 33.04 C ATOM 851 C LYS A 945 12.070 -46.593 -7.734 1.00 54.45 C ATOM 852 O LYS A 945 13.025 -46.512 -8.505 1.00 51.30 O ATOM 853 CB LYS A 945 12.614 -48.708 -6.395 1.00 42.42 C ATOM 854 CG LYS A 945 11.469 -49.547 -6.965 1.00 13.20 C ATOM 855 CD LYS A 945 11.983 -50.884 -7.502 1.00 1.00 C ATOM 856 CE LYS A 945 11.057 -51.430 -8.591 1.00 23.12 C ATOM 857 NZ LYS A 945 11.710 -52.543 -9.316 1.00 30.45 N ATOM 0 H LYS A 945 10.353 -47.800 -5.641 1.00 2.24 H new ATOM 0 HA LYS A 945 13.078 -46.721 -5.872 1.00 33.04 H new ATOM 0 HB2 LYS A 945 13.507 -48.843 -7.005 1.00 42.42 H new ATOM 0 HB3 LYS A 945 12.858 -49.054 -5.391 1.00 42.42 H new ATOM 0 HG2 LYS A 945 10.723 -49.725 -6.190 1.00 13.20 H new ATOM 0 HG3 LYS A 945 10.973 -48.996 -7.764 1.00 13.20 H new ATOM 0 HD2 LYS A 945 12.988 -50.756 -7.905 1.00 1.00 H new ATOM 0 HD3 LYS A 945 12.055 -51.604 -6.687 1.00 1.00 H new ATOM 0 HE2 LYS A 945 10.125 -51.776 -8.144 1.00 23.12 H new ATOM 0 HE3 LYS A 945 10.799 -50.634 -9.290 1.00 23.12 H new ATOM 0 HZ1 LYS A 945 11.068 -52.902 -10.051 1.00 30.45 H new ATOM 0 HZ2 LYS A 945 12.587 -52.202 -9.758 1.00 30.45 H new ATOM 0 HZ3 LYS A 945 11.934 -53.308 -8.648 1.00 30.45 H new ATOM 870 N ALA A 946 10.847 -46.160 -8.007 1.00 21.42 N ATOM 871 CA ALA A 946 10.541 -45.538 -9.283 1.00 54.43 C ATOM 872 C ALA A 946 11.356 -44.251 -9.427 1.00 70.01 C ATOM 873 O ALA A 946 11.465 -43.700 -10.521 1.00 51.13 O ATOM 874 CB ALA A 946 9.034 -45.287 -9.381 1.00 24.33 C ATOM 0 H ALA A 946 10.057 -46.228 -7.365 1.00 21.42 H new ATOM 0 HA ALA A 946 10.816 -46.197 -10.106 1.00 54.43 H new ATOM 0 HB1 ALA A 946 8.804 -44.820 -10.339 1.00 24.33 H new ATOM 0 HB2 ALA A 946 8.501 -46.235 -9.302 1.00 24.33 H new ATOM 0 HB3 ALA A 946 8.722 -44.627 -8.572 1.00 24.33 H new ATOM 880 N LEU A 947 11.908 -43.810 -8.306 1.00 51.24 N ATOM 881 CA LEU A 947 12.710 -42.598 -8.294 1.00 22.33 C ATOM 882 C LEU A 947 14.191 -42.973 -8.201 1.00 34.21 C ATOM 883 O LEU A 947 14.980 -42.619 -9.075 1.00 3.10 O ATOM 884 CB LEU A 947 12.243 -41.658 -7.181 1.00 11.01 C ATOM 885 CG LEU A 947 11.175 -40.634 -7.572 1.00 62.20 C ATOM 886 CD1 LEU A 947 11.520 -39.964 -8.903 1.00 40.04 C ATOM 887 CD2 LEU A 947 9.785 -41.273 -7.595 1.00 63.31 C ATOM 0 H LEU A 947 11.816 -44.270 -7.400 1.00 51.24 H new ATOM 0 HA LEU A 947 12.578 -42.044 -9.224 1.00 22.33 H new ATOM 0 HB2 LEU A 947 11.856 -42.262 -6.361 1.00 11.01 H new ATOM 0 HB3 LEU A 947 13.111 -41.120 -6.799 1.00 11.01 H new ATOM 0 HG LEU A 947 11.157 -39.852 -6.813 1.00 62.20 H new ATOM 0 HD11 LEU A 947 10.745 -39.241 -9.158 1.00 40.04 H new ATOM 0 HD12 LEU A 947 12.479 -39.453 -8.815 1.00 40.04 H new ATOM 0 HD13 LEU A 947 11.582 -40.720 -9.686 1.00 40.04 H new ATOM 0 HD21 LEU A 947 9.045 -40.524 -7.876 1.00 63.31 H new ATOM 0 HD22 LEU A 947 9.771 -42.087 -8.320 1.00 63.31 H new ATOM 0 HD23 LEU A 947 9.548 -41.664 -6.606 1.00 63.31 H new ATOM 899 N GLN A 948 14.522 -43.685 -7.134 1.00 2.12 N ATOM 900 CA GLN A 948 15.894 -44.112 -6.915 1.00 51.35 C ATOM 901 C GLN A 948 16.231 -45.298 -7.821 1.00 44.32 C ATOM 902 O GLN A 948 15.371 -46.128 -8.109 1.00 31.44 O ATOM 903 CB GLN A 948 16.132 -44.460 -5.445 1.00 4.42 C ATOM 904 CG GLN A 948 15.812 -45.930 -5.170 1.00 73.33 C ATOM 905 CD GLN A 948 17.094 -46.754 -5.029 1.00 55.21 C ATOM 906 OE1 GLN A 948 17.159 -47.727 -4.296 1.00 61.25 O ATOM 907 NE2 GLN A 948 18.106 -46.311 -5.770 1.00 14.44 N ATOM 0 H GLN A 948 13.864 -43.977 -6.411 1.00 2.12 H new ATOM 0 HA GLN A 948 16.557 -43.285 -7.170 1.00 51.35 H new ATOM 0 HB2 GLN A 948 17.170 -44.255 -5.183 1.00 4.42 H new ATOM 0 HB3 GLN A 948 15.512 -43.825 -4.812 1.00 4.42 H new ATOM 0 HG2 GLN A 948 15.220 -46.013 -4.258 1.00 73.33 H new ATOM 0 HG3 GLN A 948 15.205 -46.332 -5.981 1.00 73.33 H new ATOM 0 HE21 GLN A 948 17.983 -45.490 -6.362 1.00 14.44 H new ATOM 0 HE22 GLN A 948 19.005 -46.793 -5.746 1.00 14.44 H new ATOM 1013 N GLN A 955 23.204 -41.941 -5.772 1.00 74.10 N ATOM 1014 CA GLN A 955 22.235 -42.874 -5.222 1.00 22.33 C ATOM 1015 C GLN A 955 21.097 -42.116 -4.536 1.00 3.41 C ATOM 1016 O GLN A 955 21.336 -41.139 -3.827 1.00 22.32 O ATOM 1017 CB GLN A 955 22.904 -43.851 -4.253 1.00 65.42 C ATOM 1018 CG GLN A 955 21.868 -44.529 -3.355 1.00 21.43 C ATOM 1019 CD GLN A 955 20.905 -45.386 -4.179 1.00 32.12 C ATOM 1020 OE1 GLN A 955 20.925 -45.390 -5.399 1.00 21.23 O ATOM 1021 NE2 GLN A 955 20.062 -46.109 -3.447 1.00 24.35 N ATOM 0 HA GLN A 955 21.815 -43.456 -6.042 1.00 22.33 H new ATOM 0 HB2 GLN A 955 23.454 -44.606 -4.815 1.00 65.42 H new ATOM 0 HB3 GLN A 955 23.630 -43.319 -3.639 1.00 65.42 H new ATOM 0 HG2 GLN A 955 22.373 -45.151 -2.617 1.00 21.43 H new ATOM 0 HG3 GLN A 955 21.308 -43.773 -2.805 1.00 21.43 H new ATOM 0 HE21 GLN A 955 20.099 -46.059 -2.429 1.00 24.35 H new ATOM 0 HE22 GLN A 955 19.379 -46.713 -3.904 1.00 24.35 H new ATOM 1030 N ILE A 956 19.884 -42.593 -4.771 1.00 61.22 N ATOM 1031 CA ILE A 956 18.709 -41.972 -4.185 1.00 75.10 C ATOM 1032 C ILE A 956 18.061 -42.946 -3.198 1.00 43.40 C ATOM 1033 O ILE A 956 18.267 -44.155 -3.288 1.00 40.02 O ATOM 1034 CB ILE A 956 17.758 -41.484 -5.280 1.00 41.11 C ATOM 1035 CG1 ILE A 956 18.527 -41.126 -6.554 1.00 33.31 C ATOM 1036 CG2 ILE A 956 16.900 -40.319 -4.782 1.00 42.12 C ATOM 1037 CD1 ILE A 956 19.294 -39.814 -6.381 1.00 52.21 C ATOM 0 H ILE A 956 19.689 -43.403 -5.360 1.00 61.22 H new ATOM 0 HA ILE A 956 18.990 -41.084 -3.620 1.00 75.10 H new ATOM 0 HB ILE A 956 17.079 -42.299 -5.531 1.00 41.11 H new ATOM 0 HG12 ILE A 956 19.223 -41.928 -6.801 1.00 33.31 H new ATOM 0 HG13 ILE A 956 17.833 -41.038 -7.390 1.00 33.31 H new ATOM 0 HG21 ILE A 956 16.233 -39.991 -5.580 1.00 42.12 H new ATOM 0 HG22 ILE A 956 16.309 -40.643 -3.925 1.00 42.12 H new ATOM 0 HG23 ILE A 956 17.546 -39.492 -4.486 1.00 42.12 H new ATOM 0 HD11 ILE A 956 19.832 -39.583 -7.301 1.00 52.21 H new ATOM 0 HD12 ILE A 956 18.593 -39.009 -6.158 1.00 52.21 H new ATOM 0 HD13 ILE A 956 20.005 -39.913 -5.560 1.00 52.21 H new ATOM 1049 N ASN A 957 17.292 -42.382 -2.278 1.00 40.24 N ATOM 1050 CA ASN A 957 16.613 -43.185 -1.276 1.00 3.05 C ATOM 1051 C ASN A 957 15.141 -43.337 -1.662 1.00 33.35 C ATOM 1052 O ASN A 957 14.491 -44.307 -1.275 1.00 30.54 O ATOM 1053 CB ASN A 957 16.675 -42.517 0.099 1.00 10.33 C ATOM 1054 CG ASN A 957 17.895 -42.996 0.888 1.00 63.22 C ATOM 1055 OD1 ASN A 957 17.849 -43.200 2.090 1.00 62.11 O ATOM 1056 ND2 ASN A 957 18.987 -43.164 0.146 1.00 35.34 N ATOM 0 H ASN A 957 17.124 -41.378 -2.206 1.00 40.24 H new ATOM 0 HA ASN A 957 17.108 -44.155 -1.229 1.00 3.05 H new ATOM 0 HB2 ASN A 957 16.717 -41.434 -0.021 1.00 10.33 H new ATOM 0 HB3 ASN A 957 15.766 -42.741 0.657 1.00 10.33 H new ATOM 0 HD21 ASN A 957 19.854 -43.482 0.579 1.00 35.34 H new ATOM 0 HD22 ASN A 957 18.957 -42.975 -0.856 1.00 35.34 H new ATOM 1063 N GLY A 958 14.657 -42.364 -2.420 1.00 30.34 N ATOM 1064 CA GLY A 958 13.273 -42.378 -2.862 1.00 60.12 C ATOM 1065 C GLY A 958 12.824 -40.983 -3.302 1.00 62.11 C ATOM 1066 O GLY A 958 13.590 -40.248 -3.924 1.00 12.14 O ATOM 0 H GLY A 958 15.199 -41.561 -2.739 1.00 30.34 H new ATOM 0 HA2 GLY A 958 13.159 -43.079 -3.689 1.00 60.12 H new ATOM 0 HA3 GLY A 958 12.633 -42.732 -2.054 1.00 60.12 H new ATOM 1070 N GLU A 959 11.585 -40.661 -2.962 1.00 51.43 N ATOM 1071 CA GLU A 959 11.025 -39.367 -3.314 1.00 51.24 C ATOM 1072 C GLU A 959 10.482 -38.666 -2.067 1.00 75.43 C ATOM 1073 O GLU A 959 9.707 -39.251 -1.311 1.00 5.44 O ATOM 1074 CB GLU A 959 9.936 -39.512 -4.380 1.00 24.14 C ATOM 1075 CG GLU A 959 9.779 -38.219 -5.182 1.00 73.13 C ATOM 1076 CD GLU A 959 8.395 -38.141 -5.831 1.00 31.55 C ATOM 1077 OE1 GLU A 959 8.197 -37.366 -6.777 1.00 55.15 O ATOM 1078 OE2 GLU A 959 7.508 -38.925 -5.317 1.00 53.23 O ATOM 0 H GLU A 959 10.953 -41.274 -2.447 1.00 51.43 H new ATOM 0 HA GLU A 959 11.820 -38.752 -3.735 1.00 51.24 H new ATOM 0 HB2 GLU A 959 10.187 -40.333 -5.052 1.00 24.14 H new ATOM 0 HB3 GLU A 959 8.989 -39.767 -3.905 1.00 24.14 H new ATOM 0 HG2 GLU A 959 9.926 -37.360 -4.527 1.00 73.13 H new ATOM 0 HG3 GLU A 959 10.549 -38.169 -5.952 1.00 73.13 H new ATOM 1086 N ILE A 960 10.909 -37.425 -1.892 1.00 15.43 N ATOM 1087 CA ILE A 960 10.475 -36.638 -0.749 1.00 75.43 C ATOM 1088 C ILE A 960 9.134 -35.975 -1.072 1.00 43.31 C ATOM 1089 O ILE A 960 8.959 -35.415 -2.153 1.00 43.32 O ATOM 1090 CB ILE A 960 11.566 -35.650 -0.333 1.00 71.13 C ATOM 1091 CG1 ILE A 960 12.095 -34.876 -1.543 1.00 31.43 C ATOM 1092 CG2 ILE A 960 12.687 -36.360 0.428 1.00 21.12 C ATOM 1093 CD1 ILE A 960 12.812 -33.598 -1.105 1.00 0.23 C ATOM 0 H ILE A 960 11.551 -36.944 -2.522 1.00 15.43 H new ATOM 0 HA ILE A 960 10.313 -37.280 0.117 1.00 75.43 H new ATOM 0 HB ILE A 960 11.126 -34.921 0.348 1.00 71.13 H new ATOM 0 HG12 ILE A 960 12.780 -35.505 -2.111 1.00 31.43 H new ATOM 0 HG13 ILE A 960 11.269 -34.624 -2.208 1.00 31.43 H new ATOM 0 HG21 ILE A 960 13.450 -35.635 0.712 1.00 21.12 H new ATOM 0 HG22 ILE A 960 12.279 -36.828 1.324 1.00 21.12 H new ATOM 0 HG23 ILE A 960 13.132 -37.124 -0.209 1.00 21.12 H new ATOM 0 HD11 ILE A 960 13.178 -33.067 -1.984 1.00 0.23 H new ATOM 0 HD12 ILE A 960 12.117 -32.960 -0.559 1.00 0.23 H new ATOM 0 HD13 ILE A 960 13.652 -33.855 -0.460 1.00 0.23 H new ATOM 1105 N ILE A 961 8.223 -36.059 -0.115 1.00 34.34 N ATOM 1106 CA ILE A 961 6.903 -35.474 -0.283 1.00 44.24 C ATOM 1107 C ILE A 961 6.503 -34.750 1.004 1.00 41.13 C ATOM 1108 O ILE A 961 6.849 -35.188 2.100 1.00 50.12 O ATOM 1109 CB ILE A 961 5.898 -36.538 -0.729 1.00 1.32 C ATOM 1110 CG1 ILE A 961 5.896 -37.727 0.234 1.00 55.11 C ATOM 1111 CG2 ILE A 961 6.161 -36.970 -2.173 1.00 13.31 C ATOM 1112 CD1 ILE A 961 4.849 -38.764 -0.179 1.00 22.22 C ATOM 0 H ILE A 961 8.372 -36.524 0.781 1.00 34.34 H new ATOM 0 HA ILE A 961 6.915 -34.728 -1.078 1.00 44.24 H new ATOM 0 HB ILE A 961 4.901 -36.099 -0.701 1.00 1.32 H new ATOM 0 HG12 ILE A 961 6.883 -38.188 0.250 1.00 55.11 H new ATOM 0 HG13 ILE A 961 5.690 -37.380 1.246 1.00 55.11 H new ATOM 0 HG21 ILE A 961 5.433 -37.727 -2.465 1.00 13.31 H new ATOM 0 HG22 ILE A 961 6.072 -36.107 -2.833 1.00 13.31 H new ATOM 0 HG23 ILE A 961 7.166 -37.384 -2.251 1.00 13.31 H new ATOM 0 HD11 ILE A 961 4.868 -39.599 0.521 1.00 22.22 H new ATOM 0 HD12 ILE A 961 3.860 -38.306 -0.171 1.00 22.22 H new ATOM 0 HD13 ILE A 961 5.072 -39.127 -1.182 1.00 22.22 H new ATOM 1124 N CYS A 962 5.780 -33.654 0.828 1.00 75.12 N ATOM 1125 CA CYS A 962 5.328 -32.865 1.962 1.00 64.24 C ATOM 1126 C CYS A 962 4.384 -33.728 2.802 1.00 45.32 C ATOM 1127 O CYS A 962 4.195 -34.908 2.514 1.00 62.42 O ATOM 1128 CB CYS A 962 4.664 -31.561 1.515 1.00 63.10 C ATOM 1129 SG CYS A 962 2.864 -31.681 1.212 1.00 34.43 S ATOM 0 H CYS A 962 5.496 -33.293 -0.083 1.00 75.12 H new ATOM 0 HA CYS A 962 6.185 -32.570 2.568 1.00 64.24 H new ATOM 0 HB2 CYS A 962 4.840 -30.801 2.276 1.00 63.10 H new ATOM 0 HB3 CYS A 962 5.150 -31.217 0.602 1.00 63.10 H new ATOM 0 HG CYS A 962 2.440 -30.576 0.675 1.00 34.43 H new ATOM 1134 N LYS A 963 3.817 -33.104 3.824 1.00 61.30 N ATOM 1135 CA LYS A 963 2.897 -33.800 4.708 1.00 64.21 C ATOM 1136 C LYS A 963 1.694 -34.291 3.901 1.00 62.54 C ATOM 1137 O LYS A 963 1.335 -35.466 3.968 1.00 52.13 O ATOM 1138 CB LYS A 963 2.520 -32.912 5.895 1.00 22.13 C ATOM 1139 CG LYS A 963 3.757 -32.233 6.487 1.00 61.01 C ATOM 1140 CD LYS A 963 4.899 -33.235 6.667 1.00 21.15 C ATOM 1141 CE LYS A 963 5.672 -32.959 7.959 1.00 74.01 C ATOM 1142 NZ LYS A 963 4.863 -33.342 9.138 1.00 5.22 N ATOM 0 H LYS A 963 3.977 -32.125 4.060 1.00 61.30 H new ATOM 0 HA LYS A 963 3.374 -34.681 5.137 1.00 64.21 H new ATOM 0 HB2 LYS A 963 1.804 -32.155 5.575 1.00 22.13 H new ATOM 0 HB3 LYS A 963 2.029 -33.512 6.661 1.00 22.13 H new ATOM 0 HG2 LYS A 963 4.079 -31.422 5.833 1.00 61.01 H new ATOM 0 HG3 LYS A 963 3.506 -31.786 7.449 1.00 61.01 H new ATOM 0 HD2 LYS A 963 4.498 -34.249 6.688 1.00 21.15 H new ATOM 0 HD3 LYS A 963 5.576 -33.177 5.815 1.00 21.15 H new ATOM 0 HE2 LYS A 963 6.608 -33.517 7.956 1.00 74.01 H new ATOM 0 HE3 LYS A 963 5.931 -31.902 8.016 1.00 74.01 H new ATOM 0 HZ1 LYS A 963 5.487 -33.475 9.959 1.00 5.22 H new ATOM 0 HZ2 LYS A 963 4.174 -32.591 9.345 1.00 5.22 H new ATOM 0 HZ3 LYS A 963 4.359 -34.230 8.940 1.00 5.22 H new ATOM 1155 N CYS A 964 1.105 -33.368 3.156 1.00 53.31 N ATOM 1156 CA CYS A 964 -0.051 -33.692 2.337 1.00 64.14 C ATOM 1157 C CYS A 964 0.320 -34.865 1.426 1.00 10.43 C ATOM 1158 O CYS A 964 -0.510 -35.732 1.156 1.00 43.50 O ATOM 1159 CB CYS A 964 -0.536 -32.481 1.538 1.00 43.42 C ATOM 1160 SG CYS A 964 -0.634 -30.922 2.492 1.00 42.14 S ATOM 0 H CYS A 964 1.407 -32.395 3.102 1.00 53.31 H new ATOM 0 HA CYS A 964 -0.885 -33.979 2.978 1.00 64.14 H new ATOM 0 HB2 CYS A 964 0.133 -32.331 0.691 1.00 43.42 H new ATOM 0 HB3 CYS A 964 -1.522 -32.704 1.130 1.00 43.42 H new ATOM 1165 N GLY A 965 1.567 -34.854 0.979 1.00 51.43 N ATOM 1166 CA GLY A 965 2.057 -35.906 0.104 1.00 5.54 C ATOM 1167 C GLY A 965 2.390 -35.354 -1.284 1.00 23.25 C ATOM 1168 O GLY A 965 2.158 -36.020 -2.292 1.00 2.53 O ATOM 0 H GLY A 965 2.253 -34.134 1.206 1.00 51.43 H new ATOM 0 HA2 GLY A 965 2.945 -36.363 0.540 1.00 5.54 H new ATOM 0 HA3 GLY A 965 1.306 -36.691 0.017 1.00 5.54 H new ATOM 1172 N GLN A 966 2.929 -34.144 -1.291 1.00 10.32 N ATOM 1173 CA GLN A 966 3.296 -33.495 -2.538 1.00 61.43 C ATOM 1174 C GLN A 966 4.792 -33.670 -2.807 1.00 62.00 C ATOM 1175 O GLN A 966 5.623 -33.275 -1.991 1.00 3.21 O ATOM 1176 CB GLN A 966 2.911 -32.015 -2.521 1.00 4.24 C ATOM 1177 CG GLN A 966 3.581 -31.261 -3.671 1.00 52.53 C ATOM 1178 CD GLN A 966 3.010 -31.700 -5.021 1.00 33.42 C ATOM 1179 OE1 GLN A 966 2.145 -32.556 -5.109 1.00 34.22 O ATOM 1180 NE2 GLN A 966 3.540 -31.069 -6.064 1.00 62.14 N ATOM 0 H GLN A 966 3.121 -33.596 -0.453 1.00 10.32 H new ATOM 0 HA GLN A 966 2.743 -33.970 -3.348 1.00 61.43 H new ATOM 0 HB2 GLN A 966 1.828 -31.916 -2.599 1.00 4.24 H new ATOM 0 HB3 GLN A 966 3.204 -31.570 -1.570 1.00 4.24 H new ATOM 0 HG2 GLN A 966 3.435 -30.189 -3.542 1.00 52.53 H new ATOM 0 HG3 GLN A 966 4.656 -31.441 -3.651 1.00 52.53 H new ATOM 0 HE21 GLN A 966 4.261 -30.362 -5.920 1.00 62.14 H new ATOM 0 HE22 GLN A 966 3.226 -31.292 -7.008 1.00 62.14 H new ATOM 1189 N ALA A 967 5.090 -34.262 -3.954 1.00 74.32 N ATOM 1190 CA ALA A 967 6.471 -34.494 -4.341 1.00 21.03 C ATOM 1191 C ALA A 967 7.249 -33.180 -4.248 1.00 23.02 C ATOM 1192 O ALA A 967 7.150 -32.332 -5.133 1.00 11.41 O ATOM 1193 CB ALA A 967 6.514 -35.099 -5.745 1.00 53.14 C ATOM 0 H ALA A 967 4.398 -34.588 -4.628 1.00 74.32 H new ATOM 0 HA ALA A 967 6.944 -35.206 -3.665 1.00 21.03 H new ATOM 0 HB1 ALA A 967 7.550 -35.273 -6.035 1.00 53.14 H new ATOM 0 HB2 ALA A 967 5.972 -36.045 -5.750 1.00 53.14 H new ATOM 0 HB3 ALA A 967 6.050 -34.411 -6.452 1.00 53.14 H new ATOM 1199 N TRP A 968 8.007 -33.053 -3.168 1.00 54.12 N ATOM 1200 CA TRP A 968 8.802 -31.857 -2.948 1.00 55.42 C ATOM 1201 C TRP A 968 10.023 -31.925 -3.867 1.00 52.23 C ATOM 1202 O TRP A 968 10.487 -30.901 -4.365 1.00 43.54 O ATOM 1203 CB TRP A 968 9.172 -31.709 -1.471 1.00 43.32 C ATOM 1204 CG TRP A 968 8.178 -30.875 -0.661 1.00 4.44 C ATOM 1205 CD1 TRP A 968 7.151 -30.144 -1.115 1.00 32.22 C ATOM 1206 CD2 TRP A 968 8.159 -30.714 0.774 1.00 63.04 C ATOM 1207 NE1 TRP A 968 6.474 -29.527 -0.083 1.00 34.13 N ATOM 1208 CE2 TRP A 968 7.106 -29.885 1.102 1.00 4.21 C ATOM 1209 CE3 TRP A 968 9.004 -31.252 1.761 1.00 52.04 C ATOM 1210 CZ2 TRP A 968 6.800 -29.519 2.418 1.00 23.24 C ATOM 1211 CZ3 TRP A 968 8.685 -30.877 3.071 1.00 14.12 C ATOM 1212 CH2 TRP A 968 7.628 -30.043 3.418 1.00 2.04 C ATOM 0 H TRP A 968 8.087 -33.759 -2.436 1.00 54.12 H new ATOM 0 HA TRP A 968 8.230 -30.963 -3.195 1.00 55.42 H new ATOM 0 HB2 TRP A 968 9.247 -32.701 -1.025 1.00 43.32 H new ATOM 0 HB3 TRP A 968 10.159 -31.251 -1.398 1.00 43.32 H new ATOM 0 HD1 TRP A 968 6.886 -30.050 -2.158 1.00 32.22 H new ATOM 0 HE1 TRP A 968 5.659 -28.920 -0.173 1.00 34.13 H new ATOM 0 HE3 TRP A 968 9.833 -31.903 1.527 1.00 52.04 H new ATOM 0 HZ2 TRP A 968 5.970 -28.868 2.649 1.00 23.24 H new ATOM 0 HZ3 TRP A 968 9.303 -31.262 3.868 1.00 14.12 H new ATOM 0 HH2 TRP A 968 7.446 -29.800 4.455 1.00 2.04 H new ATOM 1223 N GLY A 969 10.508 -33.142 -4.064 1.00 41.21 N ATOM 1224 CA GLY A 969 11.666 -33.357 -4.915 1.00 25.04 C ATOM 1225 C GLY A 969 12.140 -34.810 -4.839 1.00 73.11 C ATOM 1226 O GLY A 969 11.364 -35.733 -5.084 1.00 41.23 O ATOM 0 H GLY A 969 10.120 -33.989 -3.649 1.00 41.21 H new ATOM 0 HA2 GLY A 969 11.416 -33.106 -5.946 1.00 25.04 H new ATOM 0 HA3 GLY A 969 12.474 -32.691 -4.611 1.00 25.04 H new ATOM 1230 N THR A 970 13.410 -34.968 -4.499 1.00 24.22 N ATOM 1231 CA THR A 970 13.996 -36.293 -4.388 1.00 22.30 C ATOM 1232 C THR A 970 15.124 -36.293 -3.354 1.00 41.13 C ATOM 1233 O THR A 970 15.742 -35.259 -3.105 1.00 63.22 O ATOM 1234 CB THR A 970 14.450 -36.728 -5.783 1.00 5.51 C ATOM 1235 OG1 THR A 970 14.764 -35.504 -6.443 1.00 11.05 O ATOM 1236 CG2 THR A 970 13.309 -37.317 -6.614 1.00 14.24 C ATOM 0 H THR A 970 14.050 -34.200 -4.297 1.00 24.22 H new ATOM 0 HA THR A 970 13.267 -37.019 -4.027 1.00 22.30 H new ATOM 0 HB THR A 970 15.249 -37.464 -5.691 1.00 5.51 H new ATOM 0 HG1 THR A 970 15.069 -35.693 -7.355 1.00 11.05 H new ATOM 0 HG21 THR A 970 13.686 -37.609 -7.594 1.00 14.24 H new ATOM 0 HG22 THR A 970 12.903 -38.192 -6.106 1.00 14.24 H new ATOM 0 HG23 THR A 970 12.524 -36.571 -6.735 1.00 14.24 H new ATOM 1244 N MET A 971 15.358 -37.464 -2.780 1.00 52.14 N ATOM 1245 CA MET A 971 16.401 -37.612 -1.779 1.00 55.12 C ATOM 1246 C MET A 971 17.681 -38.175 -2.400 1.00 13.11 C ATOM 1247 O MET A 971 17.847 -39.390 -2.494 1.00 73.02 O ATOM 1248 CB MET A 971 15.915 -38.549 -0.671 1.00 44.32 C ATOM 1249 CG MET A 971 17.072 -38.967 0.239 1.00 42.12 C ATOM 1250 SD MET A 971 17.980 -37.526 0.773 1.00 64.02 S ATOM 1251 CE MET A 971 16.633 -36.505 1.345 1.00 50.43 C ATOM 0 H MET A 971 14.843 -38.319 -2.989 1.00 52.14 H new ATOM 0 HA MET A 971 16.623 -36.629 -1.364 1.00 55.12 H new ATOM 0 HB2 MET A 971 15.145 -38.052 -0.081 1.00 44.32 H new ATOM 0 HB3 MET A 971 15.457 -39.434 -1.113 1.00 44.32 H new ATOM 0 HG2 MET A 971 16.688 -39.506 1.105 1.00 42.12 H new ATOM 0 HG3 MET A 971 17.736 -39.649 -0.293 1.00 42.12 H new ATOM 0 HE1 MET A 971 17.014 -35.753 2.035 1.00 50.43 H new ATOM 0 HE2 MET A 971 16.164 -36.012 0.494 1.00 50.43 H new ATOM 0 HE3 MET A 971 15.897 -37.126 1.856 1.00 50.43 H new ATOM 1261 N MET A 972 18.553 -37.265 -2.807 1.00 51.51 N ATOM 1262 CA MET A 972 19.813 -37.655 -3.416 1.00 61.01 C ATOM 1263 C MET A 972 20.850 -38.012 -2.349 1.00 44.43 C ATOM 1264 O MET A 972 20.840 -37.449 -1.256 1.00 10.33 O ATOM 1265 CB MET A 972 20.341 -36.507 -4.278 1.00 41.32 C ATOM 1266 CG MET A 972 19.872 -36.649 -5.728 1.00 12.44 C ATOM 1267 SD MET A 972 19.859 -35.051 -6.524 1.00 73.32 S ATOM 1268 CE MET A 972 21.580 -34.608 -6.358 1.00 53.11 C ATOM 0 H MET A 972 18.412 -36.258 -2.727 1.00 51.51 H new ATOM 0 HA MET A 972 19.639 -38.535 -4.035 1.00 61.01 H new ATOM 0 HB2 MET A 972 19.997 -35.555 -3.873 1.00 41.32 H new ATOM 0 HB3 MET A 972 21.430 -36.493 -4.244 1.00 41.32 H new ATOM 0 HG2 MET A 972 20.532 -37.328 -6.268 1.00 12.44 H new ATOM 0 HG3 MET A 972 18.874 -37.086 -5.755 1.00 12.44 H new ATOM 0 HE1 MET A 972 21.799 -33.752 -6.997 1.00 53.11 H new ATOM 0 HE2 MET A 972 21.791 -34.349 -5.320 1.00 53.11 H new ATOM 0 HE3 MET A 972 22.203 -35.451 -6.655 1.00 53.11 H new ATOM 1278 N VAL A 973 21.721 -38.945 -2.705 1.00 3.51 N ATOM 1279 CA VAL A 973 22.763 -39.383 -1.792 1.00 1.22 C ATOM 1280 C VAL A 973 24.132 -39.123 -2.424 1.00 51.20 C ATOM 1281 O VAL A 973 24.269 -39.145 -3.646 1.00 43.52 O ATOM 1282 CB VAL A 973 22.547 -40.850 -1.417 1.00 31.33 C ATOM 1283 CG1 VAL A 973 23.419 -41.245 -0.223 1.00 62.45 C ATOM 1284 CG2 VAL A 973 21.070 -41.132 -1.133 1.00 51.14 C ATOM 0 H VAL A 973 21.726 -39.410 -3.613 1.00 3.51 H new ATOM 0 HA VAL A 973 22.721 -38.814 -0.863 1.00 1.22 H new ATOM 0 HB VAL A 973 22.847 -41.461 -2.269 1.00 31.33 H new ATOM 0 HG11 VAL A 973 23.246 -42.293 0.023 1.00 62.45 H new ATOM 0 HG12 VAL A 973 24.469 -41.100 -0.476 1.00 62.45 H new ATOM 0 HG13 VAL A 973 23.163 -40.624 0.635 1.00 62.45 H new ATOM 0 HG21 VAL A 973 20.944 -42.182 -0.869 1.00 51.14 H new ATOM 0 HG22 VAL A 973 20.733 -40.507 -0.306 1.00 51.14 H new ATOM 0 HG23 VAL A 973 20.479 -40.908 -2.021 1.00 51.14 H new ATOM 1294 N HIS A 974 25.110 -38.883 -1.563 1.00 51.10 N ATOM 1295 CA HIS A 974 26.463 -38.619 -2.022 1.00 1.00 C ATOM 1296 C HIS A 974 27.459 -39.386 -1.150 1.00 64.13 C ATOM 1297 O HIS A 974 27.820 -38.931 -0.066 1.00 43.21 O ATOM 1298 CB HIS A 974 26.741 -37.115 -2.057 1.00 42.10 C ATOM 1299 CG HIS A 974 28.161 -36.745 -1.702 1.00 4.43 C ATOM 1300 ND1 HIS A 974 29.244 -37.554 -1.999 1.00 31.12 N ATOM 1301 CD2 HIS A 974 28.665 -35.644 -1.073 1.00 13.12 C ATOM 1302 CE1 HIS A 974 30.344 -36.958 -1.563 1.00 31.12 C ATOM 1303 NE2 HIS A 974 29.983 -35.775 -0.989 1.00 11.32 N ATOM 0 H HIS A 974 24.992 -38.866 -0.550 1.00 51.10 H new ATOM 0 HA HIS A 974 26.580 -38.975 -3.046 1.00 1.00 H new ATOM 0 HB2 HIS A 974 26.517 -36.737 -3.055 1.00 42.10 H new ATOM 0 HB3 HIS A 974 26.062 -36.614 -1.367 1.00 42.10 H new ATOM 0 HD2 HIS A 974 28.089 -34.808 -0.706 1.00 13.12 H new ATOM 0 HE1 HIS A 974 31.350 -37.342 -1.647 1.00 31.12 H new ATOM 0 HE2 HIS A 974 30.621 -35.102 -0.565 1.00 11.32 H new ATOM 1311 N LYS A 975 27.876 -40.537 -1.657 1.00 33.41 N ATOM 1312 CA LYS A 975 28.823 -41.372 -0.938 1.00 62.21 C ATOM 1313 C LYS A 975 28.215 -41.788 0.403 1.00 42.11 C ATOM 1314 O LYS A 975 28.939 -42.114 1.342 1.00 2.44 O ATOM 1315 CB LYS A 975 30.172 -40.662 -0.808 1.00 40.20 C ATOM 1316 CG LYS A 975 30.922 -40.661 -2.142 1.00 23.25 C ATOM 1317 CD LYS A 975 32.436 -40.699 -1.919 1.00 74.23 C ATOM 1318 CE LYS A 975 33.188 -40.422 -3.222 1.00 42.31 C ATOM 1319 NZ LYS A 975 33.275 -41.650 -4.042 1.00 73.55 N ATOM 0 H LYS A 975 27.575 -40.911 -2.557 1.00 33.41 H new ATOM 0 HA LYS A 975 29.023 -42.287 -1.495 1.00 62.21 H new ATOM 0 HB2 LYS A 975 30.016 -39.636 -0.473 1.00 40.20 H new ATOM 0 HB3 LYS A 975 30.776 -41.157 -0.048 1.00 40.20 H new ATOM 0 HG2 LYS A 975 30.616 -41.522 -2.736 1.00 23.25 H new ATOM 0 HG3 LYS A 975 30.657 -39.771 -2.712 1.00 23.25 H new ATOM 0 HD2 LYS A 975 32.716 -39.959 -1.169 1.00 74.23 H new ATOM 0 HD3 LYS A 975 32.725 -41.674 -1.528 1.00 74.23 H new ATOM 0 HE2 LYS A 975 32.679 -39.639 -3.783 1.00 42.31 H new ATOM 0 HE3 LYS A 975 34.190 -40.055 -2.999 1.00 42.31 H new ATOM 0 HZ1 LYS A 975 33.788 -41.444 -4.923 1.00 73.55 H new ATOM 0 HZ2 LYS A 975 33.781 -42.387 -3.511 1.00 73.55 H new ATOM 0 HZ3 LYS A 975 32.317 -41.984 -4.270 1.00 73.55 H new ATOM 1332 N GLY A 976 26.891 -41.763 0.449 1.00 24.31 N ATOM 1333 CA GLY A 976 26.178 -42.134 1.660 1.00 52.45 C ATOM 1334 C GLY A 976 25.639 -40.895 2.379 1.00 73.42 C ATOM 1335 O GLY A 976 24.993 -41.010 3.420 1.00 42.54 O ATOM 0 H GLY A 976 26.294 -41.492 -0.332 1.00 24.31 H new ATOM 0 HA2 GLY A 976 25.354 -42.802 1.411 1.00 52.45 H new ATOM 0 HA3 GLY A 976 26.844 -42.684 2.325 1.00 52.45 H new ATOM 1339 N LEU A 977 25.923 -39.740 1.795 1.00 25.52 N ATOM 1340 CA LEU A 977 25.475 -38.482 2.367 1.00 23.34 C ATOM 1341 C LEU A 977 24.003 -38.263 2.016 1.00 55.14 C ATOM 1342 O LEU A 977 23.457 -38.952 1.155 1.00 32.34 O ATOM 1343 CB LEU A 977 26.390 -37.337 1.927 1.00 71.50 C ATOM 1344 CG LEU A 977 26.489 -36.151 2.887 1.00 12.45 C ATOM 1345 CD1 LEU A 977 26.668 -36.626 4.330 1.00 23.53 C ATOM 1346 CD2 LEU A 977 27.599 -35.189 2.459 1.00 62.34 C ATOM 0 H LEU A 977 26.458 -39.649 0.931 1.00 25.52 H new ATOM 0 HA LEU A 977 25.542 -38.512 3.454 1.00 23.34 H new ATOM 0 HB2 LEU A 977 27.392 -37.738 1.772 1.00 71.50 H new ATOM 0 HB3 LEU A 977 26.041 -36.970 0.962 1.00 71.50 H new ATOM 0 HG LEU A 977 25.550 -35.599 2.844 1.00 12.45 H new ATOM 0 HD11 LEU A 977 26.736 -35.762 4.992 1.00 23.53 H new ATOM 0 HD12 LEU A 977 25.815 -37.239 4.620 1.00 23.53 H new ATOM 0 HD13 LEU A 977 27.582 -37.215 4.408 1.00 23.53 H new ATOM 0 HD21 LEU A 977 27.647 -34.355 3.159 1.00 62.34 H new ATOM 0 HD22 LEU A 977 28.554 -35.714 2.454 1.00 62.34 H new ATOM 0 HD23 LEU A 977 27.387 -34.811 1.459 1.00 62.34 H new ATOM 1358 N ASP A 978 23.401 -37.300 2.699 1.00 61.22 N ATOM 1359 CA ASP A 978 22.002 -36.981 2.469 1.00 21.43 C ATOM 1360 C ASP A 978 21.893 -35.565 1.900 1.00 70.51 C ATOM 1361 O ASP A 978 22.283 -34.598 2.553 1.00 74.45 O ATOM 1362 CB ASP A 978 21.205 -37.029 3.774 1.00 1.23 C ATOM 1363 CG ASP A 978 20.704 -38.418 4.176 1.00 41.41 C ATOM 1364 OD1 ASP A 978 19.882 -39.027 3.476 1.00 52.11 O ATOM 1365 OD2 ASP A 978 21.200 -38.880 5.273 1.00 1.34 O ATOM 0 H ASP A 978 23.857 -36.730 3.412 1.00 61.22 H new ATOM 0 HA ASP A 978 21.598 -37.716 1.773 1.00 21.43 H new ATOM 0 HB2 ASP A 978 21.829 -36.638 4.578 1.00 1.23 H new ATOM 0 HB3 ASP A 978 20.347 -36.362 3.683 1.00 1.23 H new ATOM 1371 N LEU A 979 21.361 -35.488 0.689 1.00 62.42 N ATOM 1372 CA LEU A 979 21.196 -34.207 0.024 1.00 11.12 C ATOM 1373 C LEU A 979 19.846 -34.181 -0.695 1.00 51.22 C ATOM 1374 O LEU A 979 19.725 -34.676 -1.815 1.00 22.14 O ATOM 1375 CB LEU A 979 22.387 -33.921 -0.893 1.00 20.33 C ATOM 1376 CG LEU A 979 23.717 -34.555 -0.481 1.00 64.32 C ATOM 1377 CD1 LEU A 979 23.770 -36.030 -0.885 1.00 41.11 C ATOM 1378 CD2 LEU A 979 24.899 -33.764 -1.045 1.00 24.01 C ATOM 0 H LEU A 979 21.039 -36.292 0.151 1.00 62.42 H new ATOM 0 HA LEU A 979 21.185 -33.398 0.754 1.00 11.12 H new ATOM 0 HB2 LEU A 979 22.138 -34.265 -1.897 1.00 20.33 H new ATOM 0 HB3 LEU A 979 22.524 -32.841 -0.951 1.00 20.33 H new ATOM 0 HG LEU A 979 23.792 -34.516 0.606 1.00 64.32 H new ATOM 0 HD11 LEU A 979 24.726 -36.457 -0.581 1.00 41.11 H new ATOM 0 HD12 LEU A 979 22.959 -36.570 -0.396 1.00 41.11 H new ATOM 0 HD13 LEU A 979 23.663 -36.115 -1.966 1.00 41.11 H new ATOM 0 HD21 LEU A 979 25.832 -34.236 -0.737 1.00 24.01 H new ATOM 0 HD22 LEU A 979 24.841 -33.750 -2.133 1.00 24.01 H new ATOM 0 HD23 LEU A 979 24.867 -32.742 -0.666 1.00 24.01 H new ATOM 1390 N PRO A 980 18.838 -33.582 -0.005 1.00 63.50 N ATOM 1391 CA PRO A 980 17.502 -33.485 -0.566 1.00 74.30 C ATOM 1392 C PRO A 980 17.440 -32.411 -1.654 1.00 63.42 C ATOM 1393 O PRO A 980 17.773 -31.253 -1.408 1.00 21.22 O ATOM 1394 CB PRO A 980 16.599 -33.183 0.619 1.00 53.43 C ATOM 1395 CG PRO A 980 17.512 -32.663 1.717 1.00 63.01 C ATOM 1396 CD PRO A 980 18.945 -32.985 1.323 1.00 55.11 C ATOM 0 HA PRO A 980 17.188 -34.401 -1.066 1.00 74.30 H new ATOM 0 HB2 PRO A 980 15.844 -32.442 0.356 1.00 53.43 H new ATOM 0 HB3 PRO A 980 16.068 -34.078 0.944 1.00 53.43 H new ATOM 0 HG2 PRO A 980 17.383 -31.588 1.843 1.00 63.01 H new ATOM 0 HG3 PRO A 980 17.265 -33.128 2.671 1.00 63.01 H new ATOM 0 HD2 PRO A 980 19.562 -32.087 1.305 1.00 55.11 H new ATOM 0 HD3 PRO A 980 19.405 -33.674 2.031 1.00 55.11 H new ATOM 1404 N CYS A 981 17.012 -32.834 -2.835 1.00 24.34 N ATOM 1405 CA CYS A 981 16.903 -31.923 -3.961 1.00 61.34 C ATOM 1406 C CYS A 981 15.427 -31.571 -4.153 1.00 34.12 C ATOM 1407 O CYS A 981 14.651 -32.384 -4.653 1.00 13.01 O ATOM 1408 CB CYS A 981 17.517 -32.517 -5.231 1.00 24.14 C ATOM 1409 SG CYS A 981 19.282 -32.047 -5.351 1.00 31.23 S ATOM 0 H CYS A 981 16.737 -33.795 -3.036 1.00 24.34 H new ATOM 0 HA CYS A 981 17.468 -31.015 -3.753 1.00 61.34 H new ATOM 0 HB2 CYS A 981 17.421 -33.603 -5.218 1.00 24.14 H new ATOM 0 HB3 CYS A 981 16.977 -32.160 -6.108 1.00 24.14 H new ATOM 0 HG CYS A 981 19.896 -32.868 -6.151 1.00 31.23 H new ATOM 1415 N LEU A 982 15.083 -30.358 -3.745 1.00 33.42 N ATOM 1416 CA LEU A 982 13.713 -29.889 -3.865 1.00 50.41 C ATOM 1417 C LEU A 982 13.451 -29.459 -5.310 1.00 10.41 C ATOM 1418 O LEU A 982 14.387 -29.280 -6.088 1.00 1.45 O ATOM 1419 CB LEU A 982 13.430 -28.792 -2.836 1.00 63.12 C ATOM 1420 CG LEU A 982 13.615 -29.185 -1.369 1.00 73.41 C ATOM 1421 CD1 LEU A 982 13.519 -30.702 -1.192 1.00 14.12 C ATOM 1422 CD2 LEU A 982 14.925 -28.625 -0.812 1.00 12.02 C ATOM 0 H LEU A 982 15.729 -29.686 -3.331 1.00 33.42 H new ATOM 0 HA LEU A 982 13.013 -30.694 -3.639 1.00 50.41 H new ATOM 0 HB2 LEU A 982 14.081 -27.944 -3.049 1.00 63.12 H new ATOM 0 HB3 LEU A 982 12.405 -28.449 -2.973 1.00 63.12 H new ATOM 0 HG LEU A 982 12.804 -28.741 -0.792 1.00 73.41 H new ATOM 0 HD11 LEU A 982 13.654 -30.955 -0.140 1.00 14.12 H new ATOM 0 HD12 LEU A 982 12.540 -31.046 -1.525 1.00 14.12 H new ATOM 0 HD13 LEU A 982 14.295 -31.187 -1.784 1.00 14.12 H new ATOM 0 HD21 LEU A 982 15.032 -28.919 0.232 1.00 12.02 H new ATOM 0 HD22 LEU A 982 15.763 -29.019 -1.387 1.00 12.02 H new ATOM 0 HD23 LEU A 982 14.915 -27.537 -0.883 1.00 12.02 H new ATOM 1434 N LYS A 983 12.173 -29.305 -5.625 1.00 64.25 N ATOM 1435 CA LYS A 983 11.776 -28.899 -6.963 1.00 64.51 C ATOM 1436 C LYS A 983 10.785 -27.739 -6.866 1.00 14.40 C ATOM 1437 O LYS A 983 9.689 -27.897 -6.329 1.00 41.34 O ATOM 1438 CB LYS A 983 11.245 -30.098 -7.751 1.00 33.51 C ATOM 1439 CG LYS A 983 12.215 -31.279 -7.674 1.00 32.24 C ATOM 1440 CD LYS A 983 11.647 -32.504 -8.394 1.00 14.41 C ATOM 1441 CE LYS A 983 12.661 -33.649 -8.411 1.00 35.33 C ATOM 1442 NZ LYS A 983 12.302 -34.644 -9.446 1.00 55.01 N ATOM 0 H LYS A 983 11.399 -29.454 -4.977 1.00 64.25 H new ATOM 0 HA LYS A 983 12.638 -28.536 -7.523 1.00 64.51 H new ATOM 0 HB2 LYS A 983 10.273 -30.395 -7.357 1.00 33.51 H new ATOM 0 HB3 LYS A 983 11.094 -29.815 -8.793 1.00 33.51 H new ATOM 0 HG2 LYS A 983 13.169 -31.000 -8.121 1.00 32.24 H new ATOM 0 HG3 LYS A 983 12.412 -31.525 -6.631 1.00 32.24 H new ATOM 0 HD2 LYS A 983 10.733 -32.830 -7.898 1.00 14.41 H new ATOM 0 HD3 LYS A 983 11.377 -32.237 -9.416 1.00 14.41 H new ATOM 0 HE2 LYS A 983 13.659 -33.256 -8.606 1.00 35.33 H new ATOM 0 HE3 LYS A 983 12.693 -34.129 -7.433 1.00 35.33 H new ATOM 0 HZ1 LYS A 983 13.001 -35.414 -9.444 1.00 55.01 H new ATOM 0 HZ2 LYS A 983 11.359 -35.032 -9.243 1.00 55.01 H new ATOM 0 HZ3 LYS A 983 12.294 -34.186 -10.380 1.00 55.01 H new ATOM 1455 N ILE A 984 11.204 -26.598 -7.393 1.00 62.05 N ATOM 1456 CA ILE A 984 10.366 -25.411 -7.373 1.00 4.00 C ATOM 1457 C ILE A 984 9.050 -25.708 -8.094 1.00 63.43 C ATOM 1458 O ILE A 984 8.061 -25.003 -7.904 1.00 52.00 O ATOM 1459 CB ILE A 984 11.124 -24.211 -7.945 1.00 14.20 C ATOM 1460 CG1 ILE A 984 11.850 -23.443 -6.839 1.00 12.23 C ATOM 1461 CG2 ILE A 984 10.189 -23.307 -8.752 1.00 2.01 C ATOM 1462 CD1 ILE A 984 12.564 -22.213 -7.403 1.00 62.10 C ATOM 0 H ILE A 984 12.113 -26.470 -7.837 1.00 62.05 H new ATOM 0 HA ILE A 984 10.113 -25.140 -6.348 1.00 4.00 H new ATOM 0 HB ILE A 984 11.885 -24.583 -8.631 1.00 14.20 H new ATOM 0 HG12 ILE A 984 11.135 -23.135 -6.076 1.00 12.23 H new ATOM 0 HG13 ILE A 984 12.574 -24.097 -6.352 1.00 12.23 H new ATOM 0 HG21 ILE A 984 10.752 -22.462 -9.148 1.00 2.01 H new ATOM 0 HG22 ILE A 984 9.758 -23.874 -9.577 1.00 2.01 H new ATOM 0 HG23 ILE A 984 9.390 -22.941 -8.107 1.00 2.01 H new ATOM 0 HD11 ILE A 984 13.072 -21.685 -6.596 1.00 62.10 H new ATOM 0 HD12 ILE A 984 13.295 -22.527 -8.148 1.00 62.10 H new ATOM 0 HD13 ILE A 984 11.834 -21.550 -7.867 1.00 62.10 H new ATOM 1474 N ARG A 985 9.081 -26.754 -8.907 1.00 63.14 N ATOM 1475 CA ARG A 985 7.903 -27.154 -9.658 1.00 41.52 C ATOM 1476 C ARG A 985 6.870 -27.789 -8.726 1.00 14.43 C ATOM 1477 O ARG A 985 5.758 -28.105 -9.148 1.00 45.52 O ATOM 1478 CB ARG A 985 8.265 -28.150 -10.761 1.00 52.25 C ATOM 1479 CG ARG A 985 9.242 -29.209 -10.246 1.00 14.44 C ATOM 1480 CD ARG A 985 9.023 -30.548 -10.953 1.00 14.42 C ATOM 1481 NE ARG A 985 10.025 -30.722 -12.028 1.00 14.02 N ATOM 1482 CZ ARG A 985 10.440 -31.921 -12.488 1.00 24.23 C ATOM 1483 NH1 ARG A 985 9.943 -33.064 -11.969 1.00 11.12 N ATOM 1484 NH2 ARG A 985 11.341 -31.960 -13.452 1.00 52.31 N ATOM 0 H ARG A 985 9.904 -27.337 -9.062 1.00 63.14 H new ATOM 0 HA ARG A 985 7.482 -26.259 -10.116 1.00 41.52 H new ATOM 0 HB2 ARG A 985 7.361 -28.634 -11.130 1.00 52.25 H new ATOM 0 HB3 ARG A 985 8.709 -27.619 -11.603 1.00 52.25 H new ATOM 0 HG2 ARG A 985 10.266 -28.872 -10.406 1.00 14.44 H new ATOM 0 HG3 ARG A 985 9.113 -29.336 -9.171 1.00 14.44 H new ATOM 0 HD2 ARG A 985 9.102 -31.365 -10.235 1.00 14.42 H new ATOM 0 HD3 ARG A 985 8.017 -30.587 -11.372 1.00 14.42 H new ATOM 0 HE ARG A 985 10.427 -29.884 -12.447 1.00 14.02 H new ATOM 0 HH11 ARG A 985 9.248 -33.026 -11.223 1.00 11.12 H new ATOM 0 HH12 ARG A 985 10.262 -33.966 -12.323 1.00 11.12 H new ATOM 0 HH21 ARG A 985 11.713 -31.092 -13.838 1.00 52.31 H new ATOM 0 HH22 ARG A 985 11.665 -32.858 -13.811 1.00 52.31 H new ATOM 1497 N ASN A 986 7.273 -27.957 -7.475 1.00 14.22 N ATOM 1498 CA ASN A 986 6.395 -28.548 -6.479 1.00 62.51 C ATOM 1499 C ASN A 986 6.341 -27.640 -5.249 1.00 24.41 C ATOM 1500 O ASN A 986 5.699 -27.974 -4.254 1.00 52.35 O ATOM 1501 CB ASN A 986 6.912 -29.918 -6.034 1.00 2.24 C ATOM 1502 CG ASN A 986 7.131 -30.839 -7.236 1.00 13.05 C ATOM 1503 OD1 ASN A 986 6.317 -30.926 -8.140 1.00 55.21 O ATOM 1504 ND2 ASN A 986 8.272 -31.520 -7.195 1.00 3.13 N ATOM 0 H ASN A 986 8.196 -27.694 -7.128 1.00 14.22 H new ATOM 0 HA ASN A 986 5.407 -28.662 -6.925 1.00 62.51 H new ATOM 0 HB2 ASN A 986 7.848 -29.798 -5.488 1.00 2.24 H new ATOM 0 HB3 ASN A 986 6.199 -30.374 -5.347 1.00 2.24 H new ATOM 0 HD21 ASN A 986 8.510 -32.162 -7.951 1.00 3.13 H new ATOM 0 HD22 ASN A 986 8.910 -31.400 -6.408 1.00 3.13 H new ATOM 1511 N PHE A 987 7.025 -26.511 -5.357 1.00 11.53 N ATOM 1512 CA PHE A 987 7.063 -25.552 -4.265 1.00 41.14 C ATOM 1513 C PHE A 987 6.584 -24.175 -4.728 1.00 54.44 C ATOM 1514 O PHE A 987 6.158 -24.013 -5.871 1.00 72.40 O ATOM 1515 CB PHE A 987 8.521 -25.446 -3.814 1.00 0.01 C ATOM 1516 CG PHE A 987 8.934 -26.506 -2.791 1.00 63.31 C ATOM 1517 CD1 PHE A 987 9.277 -27.755 -3.207 1.00 34.21 C ATOM 1518 CD2 PHE A 987 8.959 -26.200 -1.466 1.00 43.14 C ATOM 1519 CE1 PHE A 987 9.660 -28.739 -2.258 1.00 20.13 C ATOM 1520 CE2 PHE A 987 9.343 -27.184 -0.517 1.00 52.11 C ATOM 1521 CZ PHE A 987 9.685 -28.433 -0.933 1.00 0.21 C ATOM 0 H PHE A 987 7.557 -26.238 -6.183 1.00 11.53 H new ATOM 0 HA PHE A 987 6.410 -25.882 -3.457 1.00 41.14 H new ATOM 0 HB2 PHE A 987 9.168 -25.527 -4.688 1.00 0.01 H new ATOM 0 HB3 PHE A 987 8.687 -24.458 -3.385 1.00 0.01 H new ATOM 0 HD1 PHE A 987 9.258 -27.998 -4.259 1.00 34.21 H new ATOM 0 HD2 PHE A 987 8.687 -25.208 -1.136 1.00 43.14 H new ATOM 0 HE1 PHE A 987 9.932 -29.731 -2.588 1.00 20.13 H new ATOM 0 HE2 PHE A 987 9.364 -26.941 0.535 1.00 52.11 H new ATOM 0 HZ PHE A 987 9.976 -29.182 -0.211 1.00 0.21 H new ATOM 1531 N VAL A 988 6.669 -23.217 -3.817 1.00 51.42 N ATOM 1532 CA VAL A 988 6.249 -21.858 -4.118 1.00 30.43 C ATOM 1533 C VAL A 988 7.236 -20.873 -3.488 1.00 35.12 C ATOM 1534 O VAL A 988 7.898 -21.196 -2.503 1.00 70.41 O ATOM 1535 CB VAL A 988 4.808 -21.641 -3.652 1.00 73.13 C ATOM 1536 CG1 VAL A 988 4.281 -20.282 -4.116 1.00 50.40 C ATOM 1537 CG2 VAL A 988 3.899 -22.774 -4.134 1.00 25.44 C ATOM 0 H VAL A 988 7.022 -23.354 -2.870 1.00 51.42 H new ATOM 0 HA VAL A 988 6.258 -21.684 -5.194 1.00 30.43 H new ATOM 0 HB VAL A 988 4.804 -21.648 -2.562 1.00 73.13 H new ATOM 0 HG11 VAL A 988 3.255 -20.153 -3.772 1.00 50.40 H new ATOM 0 HG12 VAL A 988 4.905 -19.489 -3.703 1.00 50.40 H new ATOM 0 HG13 VAL A 988 4.307 -20.234 -5.205 1.00 50.40 H new ATOM 0 HG21 VAL A 988 2.881 -22.595 -3.789 1.00 25.44 H new ATOM 0 HG22 VAL A 988 3.912 -22.812 -5.223 1.00 25.44 H new ATOM 0 HG23 VAL A 988 4.256 -23.723 -3.733 1.00 25.44 H new ATOM 1547 N VAL A 989 7.302 -19.691 -4.082 1.00 1.42 N ATOM 1548 CA VAL A 989 8.197 -18.656 -3.591 1.00 73.02 C ATOM 1549 C VAL A 989 7.380 -17.420 -3.211 1.00 15.25 C ATOM 1550 O VAL A 989 6.745 -16.803 -4.065 1.00 62.22 O ATOM 1551 CB VAL A 989 9.277 -18.361 -4.634 1.00 0.23 C ATOM 1552 CG1 VAL A 989 10.466 -17.635 -4.001 1.00 13.31 C ATOM 1553 CG2 VAL A 989 9.728 -19.644 -5.334 1.00 51.04 C ATOM 0 H VAL A 989 6.751 -19.426 -4.898 1.00 1.42 H new ATOM 0 HA VAL A 989 8.714 -18.993 -2.693 1.00 73.02 H new ATOM 0 HB VAL A 989 8.844 -17.703 -5.387 1.00 0.23 H new ATOM 0 HG11 VAL A 989 11.219 -17.437 -4.763 1.00 13.31 H new ATOM 0 HG12 VAL A 989 10.129 -16.692 -3.570 1.00 13.31 H new ATOM 0 HG13 VAL A 989 10.898 -18.258 -3.218 1.00 13.31 H new ATOM 0 HG21 VAL A 989 10.496 -19.406 -6.070 1.00 51.04 H new ATOM 0 HG22 VAL A 989 10.134 -20.337 -4.597 1.00 51.04 H new ATOM 0 HG23 VAL A 989 8.876 -20.104 -5.834 1.00 51.04 H new ATOM 1563 N VAL A 990 7.421 -17.094 -1.927 1.00 23.51 N ATOM 1564 CA VAL A 990 6.693 -15.943 -1.423 1.00 14.05 C ATOM 1565 C VAL A 990 7.688 -14.899 -0.911 1.00 34.54 C ATOM 1566 O VAL A 990 8.486 -15.183 -0.019 1.00 11.23 O ATOM 1567 CB VAL A 990 5.688 -16.385 -0.356 1.00 64.12 C ATOM 1568 CG1 VAL A 990 5.369 -15.239 0.605 1.00 10.50 C ATOM 1569 CG2 VAL A 990 4.413 -16.934 -0.999 1.00 12.14 C ATOM 0 H VAL A 990 7.948 -17.608 -1.221 1.00 23.51 H new ATOM 0 HA VAL A 990 6.115 -15.477 -2.222 1.00 14.05 H new ATOM 0 HB VAL A 990 6.144 -17.189 0.222 1.00 64.12 H new ATOM 0 HG11 VAL A 990 4.653 -15.580 1.353 1.00 10.50 H new ATOM 0 HG12 VAL A 990 6.284 -14.914 1.100 1.00 10.50 H new ATOM 0 HG13 VAL A 990 4.942 -14.405 0.048 1.00 10.50 H new ATOM 0 HG21 VAL A 990 3.716 -17.241 -0.220 1.00 12.14 H new ATOM 0 HG22 VAL A 990 3.953 -16.160 -1.613 1.00 12.14 H new ATOM 0 HG23 VAL A 990 4.661 -17.793 -1.623 1.00 12.14 H new ATOM 1579 N PHE A 991 7.607 -13.714 -1.497 1.00 62.21 N ATOM 1580 CA PHE A 991 8.491 -12.627 -1.111 1.00 53.14 C ATOM 1581 C PHE A 991 8.026 -11.980 0.195 1.00 50.32 C ATOM 1582 O PHE A 991 6.832 -11.758 0.391 1.00 2.43 O ATOM 1583 CB PHE A 991 8.434 -11.586 -2.231 1.00 52.21 C ATOM 1584 CG PHE A 991 9.209 -11.982 -3.489 1.00 60.23 C ATOM 1585 CD1 PHE A 991 8.610 -12.741 -4.446 1.00 24.31 C ATOM 1586 CD2 PHE A 991 10.497 -11.575 -3.651 1.00 74.40 C ATOM 1587 CE1 PHE A 991 9.330 -13.109 -5.613 1.00 72.25 C ATOM 1588 CE2 PHE A 991 11.216 -11.943 -4.819 1.00 21.43 C ATOM 1589 CZ PHE A 991 10.617 -12.702 -5.775 1.00 65.53 C ATOM 0 H PHE A 991 6.943 -13.482 -2.236 1.00 62.21 H new ATOM 0 HA PHE A 991 9.502 -13.005 -0.958 1.00 53.14 H new ATOM 0 HB2 PHE A 991 7.392 -11.412 -2.499 1.00 52.21 H new ATOM 0 HB3 PHE A 991 8.829 -10.642 -1.856 1.00 52.21 H new ATOM 0 HD1 PHE A 991 7.587 -13.063 -4.318 1.00 24.31 H new ATOM 0 HD2 PHE A 991 10.973 -10.972 -2.891 1.00 74.40 H new ATOM 0 HE1 PHE A 991 8.855 -13.713 -6.372 1.00 72.25 H new ATOM 0 HE2 PHE A 991 12.238 -11.620 -4.948 1.00 21.43 H new ATOM 0 HZ PHE A 991 11.164 -12.982 -6.663 1.00 65.53 H new ATOM 1599 N LYS A 992 8.994 -11.695 1.054 1.00 35.30 N ATOM 1600 CA LYS A 992 8.699 -11.078 2.336 1.00 75.01 C ATOM 1601 C LYS A 992 8.633 -9.559 2.163 1.00 72.33 C ATOM 1602 O LYS A 992 7.844 -8.889 2.827 1.00 41.32 O ATOM 1603 CB LYS A 992 9.705 -11.533 3.394 1.00 23.32 C ATOM 1604 CG LYS A 992 9.314 -11.018 4.781 1.00 72.52 C ATOM 1605 CD LYS A 992 10.508 -11.055 5.737 1.00 70.53 C ATOM 1606 CE LYS A 992 11.274 -12.373 5.606 1.00 62.30 C ATOM 1607 NZ LYS A 992 12.411 -12.408 6.553 1.00 32.03 N ATOM 0 H LYS A 992 9.983 -11.880 0.887 1.00 35.30 H new ATOM 0 HA LYS A 992 7.723 -11.401 2.698 1.00 75.01 H new ATOM 0 HB2 LYS A 992 9.756 -12.622 3.408 1.00 23.32 H new ATOM 0 HB3 LYS A 992 10.700 -11.170 3.135 1.00 23.32 H new ATOM 0 HG2 LYS A 992 8.939 -9.998 4.701 1.00 72.52 H new ATOM 0 HG3 LYS A 992 8.503 -11.625 5.183 1.00 72.52 H new ATOM 0 HD2 LYS A 992 11.175 -10.220 5.524 1.00 70.53 H new ATOM 0 HD3 LYS A 992 10.161 -10.932 6.763 1.00 70.53 H new ATOM 0 HE2 LYS A 992 10.604 -13.211 5.801 1.00 62.30 H new ATOM 0 HE3 LYS A 992 11.639 -12.488 4.586 1.00 62.30 H new ATOM 0 HZ1 LYS A 992 12.920 -13.309 6.451 1.00 32.03 H new ATOM 0 HZ2 LYS A 992 13.058 -11.620 6.348 1.00 32.03 H new ATOM 0 HZ3 LYS A 992 12.055 -12.320 7.526 1.00 32.03 H new ATOM 1673 N LYS A 997 3.144 -13.573 -4.047 1.00 14.03 N ATOM 1674 CA LYS A 997 3.349 -15.007 -4.159 1.00 22.03 C ATOM 1675 C LYS A 997 3.738 -15.351 -5.598 1.00 31.30 C ATOM 1676 O LYS A 997 2.907 -15.281 -6.503 1.00 25.13 O ATOM 1677 CB LYS A 997 2.119 -15.766 -3.656 1.00 3.53 C ATOM 1678 CG LYS A 997 1.984 -17.118 -4.358 1.00 61.10 C ATOM 1679 CD LYS A 997 0.708 -17.839 -3.918 1.00 61.05 C ATOM 1680 CE LYS A 997 0.548 -17.792 -2.398 1.00 22.24 C ATOM 1681 NZ LYS A 997 -0.644 -18.562 -1.978 1.00 20.31 N ATOM 0 HA LYS A 997 4.173 -15.325 -3.521 1.00 22.03 H new ATOM 0 HB2 LYS A 997 2.196 -15.917 -2.579 1.00 3.53 H new ATOM 0 HB3 LYS A 997 1.223 -15.170 -3.831 1.00 3.53 H new ATOM 0 HG2 LYS A 997 1.969 -16.971 -5.438 1.00 61.10 H new ATOM 0 HG3 LYS A 997 2.852 -17.737 -4.132 1.00 61.10 H new ATOM 0 HD2 LYS A 997 -0.157 -17.376 -4.393 1.00 61.05 H new ATOM 0 HD3 LYS A 997 0.738 -18.876 -4.252 1.00 61.05 H new ATOM 0 HE2 LYS A 997 1.439 -18.200 -1.920 1.00 22.24 H new ATOM 0 HE3 LYS A 997 0.455 -16.757 -2.068 1.00 22.24 H new ATOM 0 HZ1 LYS A 997 -0.738 -18.520 -0.943 1.00 20.31 H new ATOM 0 HZ2 LYS A 997 -1.493 -18.155 -2.420 1.00 20.31 H new ATOM 0 HZ3 LYS A 997 -0.540 -19.553 -2.276 1.00 20.31 H new ATOM 1694 N LYS A 998 5.001 -15.716 -5.765 1.00 14.10 N ATOM 1695 CA LYS A 998 5.509 -16.071 -7.079 1.00 25.22 C ATOM 1696 C LYS A 998 5.665 -17.591 -7.167 1.00 3.32 C ATOM 1697 O LYS A 998 6.266 -18.209 -6.289 1.00 11.50 O ATOM 1698 CB LYS A 998 6.798 -15.302 -7.380 1.00 75.44 C ATOM 1699 CG LYS A 998 6.498 -14.006 -8.136 1.00 61.11 C ATOM 1700 CD LYS A 998 5.455 -13.168 -7.395 1.00 2.55 C ATOM 1701 CE LYS A 998 5.066 -11.932 -8.208 1.00 41.32 C ATOM 1702 NZ LYS A 998 3.646 -11.585 -7.977 1.00 72.34 N ATOM 0 H LYS A 998 5.687 -15.773 -5.012 1.00 14.10 H new ATOM 0 HA LYS A 998 4.801 -15.777 -7.854 1.00 25.22 H new ATOM 0 HB2 LYS A 998 7.315 -15.073 -6.448 1.00 75.44 H new ATOM 0 HB3 LYS A 998 7.468 -15.926 -7.971 1.00 75.44 H new ATOM 0 HG2 LYS A 998 7.415 -13.429 -8.255 1.00 61.11 H new ATOM 0 HG3 LYS A 998 6.137 -14.240 -9.137 1.00 61.11 H new ATOM 0 HD2 LYS A 998 4.569 -13.773 -7.200 1.00 2.55 H new ATOM 0 HD3 LYS A 998 5.851 -12.861 -6.427 1.00 2.55 H new ATOM 0 HE2 LYS A 998 5.702 -11.092 -7.930 1.00 41.32 H new ATOM 0 HE3 LYS A 998 5.233 -12.120 -9.269 1.00 41.32 H new ATOM 0 HZ1 LYS A 998 3.399 -10.744 -8.536 1.00 72.34 H new ATOM 0 HZ2 LYS A 998 3.043 -12.382 -8.265 1.00 72.34 H new ATOM 0 HZ3 LYS A 998 3.497 -11.385 -6.967 1.00 72.34 H new ATOM 1715 N GLN A 999 5.114 -18.149 -8.234 1.00 72.21 N ATOM 1716 CA GLN A 999 5.184 -19.585 -8.448 1.00 50.32 C ATOM 1717 C GLN A 999 6.093 -19.900 -9.638 1.00 24.25 C ATOM 1718 O GLN A 999 5.741 -19.625 -10.783 1.00 74.23 O ATOM 1719 CB GLN A 999 3.788 -20.177 -8.653 1.00 24.42 C ATOM 1720 CG GLN A 999 3.748 -21.645 -8.223 1.00 71.45 C ATOM 1721 CD GLN A 999 2.342 -22.046 -7.772 1.00 72.03 C ATOM 1722 OE1 GLN A 999 1.356 -21.394 -8.075 1.00 33.35 O ATOM 1723 NE2 GLN A 999 2.305 -23.152 -7.034 1.00 50.23 N ATOM 0 H GLN A 999 4.617 -17.633 -8.960 1.00 72.21 H new ATOM 0 HA GLN A 999 5.611 -20.046 -7.557 1.00 50.32 H new ATOM 0 HB2 GLN A 999 3.059 -19.606 -8.079 1.00 24.42 H new ATOM 0 HB3 GLN A 999 3.504 -20.093 -9.702 1.00 24.42 H new ATOM 0 HG2 GLN A 999 4.063 -22.279 -9.052 1.00 71.45 H new ATOM 0 HG3 GLN A 999 4.455 -21.809 -7.410 1.00 71.45 H new ATOM 0 HE21 GLN A 999 3.169 -23.650 -6.817 1.00 50.23 H new ATOM 0 HE22 GLN A 999 1.413 -23.502 -6.685 1.00 50.23 H new ATOM 1732 N TYR A1000 7.246 -20.473 -9.324 1.00 63.14 N ATOM 1733 CA TYR A1000 8.209 -20.829 -10.353 1.00 51.10 C ATOM 1734 C TYR A1000 8.171 -22.331 -10.643 1.00 43.32 C ATOM 1735 O TYR A1000 7.300 -23.041 -10.144 1.00 62.42 O ATOM 1736 CB TYR A1000 9.583 -20.465 -9.788 1.00 44.13 C ATOM 1737 CG TYR A1000 9.801 -18.962 -9.600 1.00 33.30 C ATOM 1738 CD1 TYR A1000 10.278 -18.198 -10.645 1.00 43.32 C ATOM 1739 CD2 TYR A1000 9.519 -18.371 -8.385 1.00 64.21 C ATOM 1740 CE1 TYR A1000 10.483 -16.783 -10.468 1.00 72.40 C ATOM 1741 CE2 TYR A1000 9.724 -16.957 -8.208 1.00 11.21 C ATOM 1742 CZ TYR A1000 10.196 -16.233 -9.258 1.00 55.31 C ATOM 1743 OH TYR A1000 10.389 -14.897 -9.091 1.00 13.02 O ATOM 0 H TYR A1000 7.535 -20.699 -8.372 1.00 63.14 H new ATOM 0 HA TYR A1000 7.988 -20.306 -11.284 1.00 51.10 H new ATOM 0 HB2 TYR A1000 9.713 -20.963 -8.827 1.00 44.13 H new ATOM 0 HB3 TYR A1000 10.353 -20.853 -10.455 1.00 44.13 H new ATOM 0 HD1 TYR A1000 10.498 -18.661 -11.596 1.00 43.32 H new ATOM 0 HD2 TYR A1000 9.145 -18.969 -7.567 1.00 64.21 H new ATOM 0 HE1 TYR A1000 10.856 -16.173 -11.278 1.00 72.40 H new ATOM 0 HE2 TYR A1000 9.508 -16.482 -7.263 1.00 11.21 H new ATOM 0 HH TYR A1000 10.141 -14.642 -8.178 1.00 13.02 H new ATOM 1753 N LYS A1001 9.127 -22.769 -11.449 1.00 62.30 N ATOM 1754 CA LYS A1001 9.214 -24.174 -11.812 1.00 4.33 C ATOM 1755 C LYS A1001 10.620 -24.690 -11.500 1.00 65.10 C ATOM 1756 O LYS A1001 10.778 -25.773 -10.938 1.00 74.03 O ATOM 1757 CB LYS A1001 8.793 -24.378 -13.268 1.00 71.12 C ATOM 1758 CG LYS A1001 9.857 -23.840 -14.227 1.00 73.24 C ATOM 1759 CD LYS A1001 9.320 -23.772 -15.659 1.00 24.52 C ATOM 1760 CE LYS A1001 10.321 -23.080 -16.587 1.00 35.12 C ATOM 1761 NZ LYS A1001 10.127 -21.613 -16.555 1.00 63.10 N ATOM 0 H LYS A1001 9.848 -22.176 -11.861 1.00 62.30 H new ATOM 0 HA LYS A1001 8.518 -24.765 -11.218 1.00 4.33 H new ATOM 0 HB2 LYS A1001 8.630 -25.439 -13.458 1.00 71.12 H new ATOM 0 HB3 LYS A1001 7.845 -23.872 -13.450 1.00 71.12 H new ATOM 0 HG2 LYS A1001 10.173 -22.848 -13.906 1.00 73.24 H new ATOM 0 HG3 LYS A1001 10.738 -24.481 -14.195 1.00 73.24 H new ATOM 0 HD2 LYS A1001 9.117 -24.779 -16.023 1.00 24.52 H new ATOM 0 HD3 LYS A1001 8.373 -23.232 -15.671 1.00 24.52 H new ATOM 0 HE2 LYS A1001 11.338 -23.325 -16.282 1.00 35.12 H new ATOM 0 HE3 LYS A1001 10.196 -23.447 -17.606 1.00 35.12 H new ATOM 0 HZ1 LYS A1001 11.035 -21.139 -16.734 1.00 63.10 H new ATOM 0 HZ2 LYS A1001 9.442 -21.337 -17.288 1.00 63.10 H new ATOM 0 HZ3 LYS A1001 9.767 -21.331 -15.621 1.00 63.10 H new ATOM 1774 N LYS A1002 11.607 -23.891 -11.878 1.00 41.23 N ATOM 1775 CA LYS A1002 12.995 -24.253 -11.646 1.00 71.53 C ATOM 1776 C LYS A1002 13.654 -23.192 -10.763 1.00 30.21 C ATOM 1777 O LYS A1002 13.210 -22.046 -10.727 1.00 55.23 O ATOM 1778 CB LYS A1002 13.718 -24.483 -12.975 1.00 30.31 C ATOM 1779 CG LYS A1002 13.168 -25.718 -13.692 1.00 53.32 C ATOM 1780 CD LYS A1002 13.410 -25.629 -15.200 1.00 55.44 C ATOM 1781 CE LYS A1002 13.389 -27.017 -15.842 1.00 34.41 C ATOM 1782 NZ LYS A1002 14.507 -27.841 -15.331 1.00 61.22 N ATOM 0 H LYS A1002 11.473 -22.994 -12.344 1.00 41.23 H new ATOM 0 HA LYS A1002 13.057 -25.199 -11.108 1.00 71.53 H new ATOM 0 HB2 LYS A1002 13.602 -23.606 -13.612 1.00 30.31 H new ATOM 0 HB3 LYS A1002 14.786 -24.608 -12.795 1.00 30.31 H new ATOM 0 HG2 LYS A1002 13.644 -26.615 -13.296 1.00 53.32 H new ATOM 0 HG3 LYS A1002 12.100 -25.811 -13.496 1.00 53.32 H new ATOM 0 HD2 LYS A1002 12.646 -25.001 -15.658 1.00 55.44 H new ATOM 0 HD3 LYS A1002 14.371 -25.151 -15.390 1.00 55.44 H new ATOM 0 HE2 LYS A1002 12.440 -27.509 -15.629 1.00 34.41 H new ATOM 0 HE3 LYS A1002 13.463 -26.924 -16.925 1.00 34.41 H new ATOM 0 HZ1 LYS A1002 15.061 -28.208 -16.131 1.00 61.22 H new ATOM 0 HZ2 LYS A1002 15.119 -27.258 -14.724 1.00 61.22 H new ATOM 0 HZ3 LYS A1002 14.128 -28.636 -14.779 1.00 61.22 H new ATOM 1795 N TRP A1003 14.703 -23.612 -10.072 1.00 24.13 N ATOM 1796 CA TRP A1003 15.428 -22.712 -9.191 1.00 2.02 C ATOM 1797 C TRP A1003 16.204 -21.721 -10.061 1.00 73.34 C ATOM 1798 O TRP A1003 16.639 -20.676 -9.581 1.00 54.43 O ATOM 1799 CB TRP A1003 16.326 -23.492 -8.228 1.00 53.11 C ATOM 1800 CG TRP A1003 15.624 -24.659 -7.530 1.00 40.33 C ATOM 1801 CD1 TRP A1003 15.551 -25.936 -7.930 1.00 40.30 C ATOM 1802 CD2 TRP A1003 14.895 -24.604 -6.286 1.00 53.51 C ATOM 1803 NE1 TRP A1003 14.831 -26.704 -7.038 1.00 71.44 N ATOM 1804 CE2 TRP A1003 14.419 -25.868 -6.007 1.00 22.51 C ATOM 1805 CE3 TRP A1003 14.645 -23.520 -5.425 1.00 62.41 C ATOM 1806 CZ2 TRP A1003 13.665 -26.170 -4.867 1.00 11.54 C ATOM 1807 CZ3 TRP A1003 13.890 -23.838 -4.290 1.00 12.22 C ATOM 1808 CH2 TRP A1003 13.404 -25.106 -3.994 1.00 73.04 C ATOM 0 H TRP A1003 15.069 -24.564 -10.104 1.00 24.13 H new ATOM 0 HA TRP A1003 14.738 -22.154 -8.558 1.00 2.02 H new ATOM 0 HB2 TRP A1003 17.185 -23.875 -8.778 1.00 53.11 H new ATOM 0 HB3 TRP A1003 16.711 -22.808 -7.472 1.00 53.11 H new ATOM 0 HD1 TRP A1003 15.999 -26.316 -8.836 1.00 40.30 H new ATOM 0 HE1 TRP A1003 14.637 -27.702 -7.120 1.00 71.44 H new ATOM 0 HE3 TRP A1003 15.007 -22.522 -5.624 1.00 62.41 H new ATOM 0 HZ2 TRP A1003 13.304 -27.169 -4.671 1.00 11.54 H new ATOM 0 HZ3 TRP A1003 13.669 -23.041 -3.595 1.00 12.22 H new ATOM 0 HH2 TRP A1003 12.828 -25.270 -3.095 1.00 73.04 H new ATOM 1819 N VAL A1004 16.353 -22.085 -11.326 1.00 65.45 N ATOM 1820 CA VAL A1004 17.069 -21.242 -12.268 1.00 40.35 C ATOM 1821 C VAL A1004 16.269 -19.959 -12.507 1.00 64.32 C ATOM 1822 O VAL A1004 16.838 -18.924 -12.850 1.00 51.22 O ATOM 1823 CB VAL A1004 17.352 -22.018 -13.556 1.00 61.11 C ATOM 1824 CG1 VAL A1004 16.107 -22.773 -14.026 1.00 41.11 C ATOM 1825 CG2 VAL A1004 17.877 -21.089 -14.653 1.00 13.15 C ATOM 0 H VAL A1004 15.990 -22.953 -11.721 1.00 65.45 H new ATOM 0 HA VAL A1004 18.037 -20.951 -11.861 1.00 40.35 H new ATOM 0 HB VAL A1004 18.128 -22.753 -13.340 1.00 61.11 H new ATOM 0 HG11 VAL A1004 16.335 -23.316 -14.943 1.00 41.11 H new ATOM 0 HG12 VAL A1004 15.796 -23.478 -13.255 1.00 41.11 H new ATOM 0 HG13 VAL A1004 15.301 -22.064 -14.215 1.00 41.11 H new ATOM 0 HG21 VAL A1004 18.070 -21.666 -15.557 1.00 13.15 H new ATOM 0 HG22 VAL A1004 17.134 -20.320 -14.865 1.00 13.15 H new ATOM 0 HG23 VAL A1004 18.802 -20.618 -14.319 1.00 13.15 H new ATOM 1835 N GLU A1005 14.963 -20.070 -12.316 1.00 60.34 N ATOM 1836 CA GLU A1005 14.080 -18.932 -12.507 1.00 34.53 C ATOM 1837 C GLU A1005 14.280 -17.912 -11.385 1.00 13.52 C ATOM 1838 O GLU A1005 14.165 -16.708 -11.609 1.00 12.53 O ATOM 1839 CB GLU A1005 12.619 -19.380 -12.587 1.00 13.05 C ATOM 1840 CG GLU A1005 12.455 -20.547 -13.562 1.00 63.13 C ATOM 1841 CD GLU A1005 12.091 -20.045 -14.961 1.00 32.40 C ATOM 1842 OE1 GLU A1005 11.451 -18.991 -15.094 1.00 64.45 O ATOM 1843 OE2 GLU A1005 12.497 -20.792 -15.931 1.00 62.22 O ATOM 0 H GLU A1005 14.495 -20.930 -12.031 1.00 60.34 H new ATOM 0 HA GLU A1005 14.332 -18.455 -13.454 1.00 34.53 H new ATOM 0 HB2 GLU A1005 12.271 -19.677 -11.597 1.00 13.05 H new ATOM 0 HB3 GLU A1005 11.996 -18.545 -12.906 1.00 13.05 H new ATOM 0 HG2 GLU A1005 13.381 -21.121 -13.607 1.00 63.13 H new ATOM 0 HG3 GLU A1005 11.679 -21.222 -13.200 1.00 63.13 H new ATOM 1851 N LEU A1006 14.576 -18.430 -10.202 1.00 73.01 N ATOM 1852 CA LEU A1006 14.793 -17.579 -9.045 1.00 11.42 C ATOM 1853 C LEU A1006 15.827 -16.506 -9.393 1.00 62.30 C ATOM 1854 O LEU A1006 17.015 -16.801 -9.517 1.00 72.34 O ATOM 1855 CB LEU A1006 15.167 -18.420 -7.823 1.00 60.21 C ATOM 1856 CG LEU A1006 14.746 -17.855 -6.465 1.00 4.11 C ATOM 1857 CD1 LEU A1006 13.300 -17.358 -6.502 1.00 41.32 C ATOM 1858 CD2 LEU A1006 14.972 -18.879 -5.351 1.00 71.31 C ATOM 0 H LEU A1006 14.671 -19.429 -10.020 1.00 73.01 H new ATOM 0 HA LEU A1006 13.873 -17.060 -8.776 1.00 11.42 H new ATOM 0 HB2 LEU A1006 14.722 -19.408 -7.937 1.00 60.21 H new ATOM 0 HB3 LEU A1006 16.248 -18.556 -7.818 1.00 60.21 H new ATOM 0 HG LEU A1006 15.376 -16.994 -6.243 1.00 4.11 H new ATOM 0 HD11 LEU A1006 13.026 -16.962 -5.524 1.00 41.32 H new ATOM 0 HD12 LEU A1006 13.204 -16.573 -7.252 1.00 41.32 H new ATOM 0 HD13 LEU A1006 12.637 -18.185 -6.757 1.00 41.32 H new ATOM 0 HD21 LEU A1006 14.665 -18.452 -4.396 1.00 71.31 H new ATOM 0 HD22 LEU A1006 14.384 -19.774 -5.554 1.00 71.31 H new ATOM 0 HD23 LEU A1006 16.029 -19.142 -5.307 1.00 71.31 H new ATOM 1870 N PRO A1007 15.325 -15.251 -9.544 1.00 64.44 N ATOM 1871 CA PRO A1007 16.192 -14.134 -9.876 1.00 5.52 C ATOM 1872 C PRO A1007 17.012 -13.696 -8.660 1.00 64.42 C ATOM 1873 O PRO A1007 17.801 -12.757 -8.745 1.00 4.54 O ATOM 1874 CB PRO A1007 15.258 -13.048 -10.384 1.00 11.34 C ATOM 1875 CG PRO A1007 13.872 -13.423 -9.884 1.00 62.31 C ATOM 1876 CD PRO A1007 13.924 -14.865 -9.405 1.00 5.23 C ATOM 0 HA PRO A1007 16.934 -14.388 -10.633 1.00 5.52 H new ATOM 0 HB2 PRO A1007 15.557 -12.069 -10.009 1.00 11.34 H new ATOM 0 HB3 PRO A1007 15.279 -12.993 -11.472 1.00 11.34 H new ATOM 0 HG2 PRO A1007 13.567 -12.762 -9.073 1.00 62.31 H new ATOM 0 HG3 PRO A1007 13.136 -13.311 -10.680 1.00 62.31 H new ATOM 0 HD2 PRO A1007 13.590 -14.951 -8.371 1.00 5.23 H new ATOM 0 HD3 PRO A1007 13.276 -15.505 -10.004 1.00 5.23 H new ATOM 1884 N ILE A1008 16.798 -14.399 -7.558 1.00 34.21 N ATOM 1885 CA ILE A1008 17.507 -14.096 -6.327 1.00 10.34 C ATOM 1886 C ILE A1008 18.809 -14.898 -6.282 1.00 41.12 C ATOM 1887 O ILE A1008 18.804 -16.109 -6.497 1.00 52.00 O ATOM 1888 CB ILE A1008 16.601 -14.326 -5.115 1.00 70.25 C ATOM 1889 CG1 ILE A1008 15.709 -13.110 -4.858 1.00 41.14 C ATOM 1890 CG2 ILE A1008 17.422 -14.706 -3.881 1.00 74.43 C ATOM 1891 CD1 ILE A1008 15.216 -12.504 -6.174 1.00 2.41 C ATOM 0 H ILE A1008 16.143 -15.178 -7.492 1.00 34.21 H new ATOM 0 HA ILE A1008 17.780 -13.041 -6.296 1.00 10.34 H new ATOM 0 HB ILE A1008 15.943 -15.167 -5.335 1.00 70.25 H new ATOM 0 HG12 ILE A1008 14.856 -13.403 -4.246 1.00 41.14 H new ATOM 0 HG13 ILE A1008 16.264 -12.360 -4.293 1.00 41.14 H new ATOM 0 HG21 ILE A1008 16.754 -14.864 -3.034 1.00 74.43 H new ATOM 0 HG22 ILE A1008 17.977 -15.623 -4.081 1.00 74.43 H new ATOM 0 HG23 ILE A1008 18.121 -13.903 -3.647 1.00 74.43 H new ATOM 0 HD11 ILE A1008 14.584 -11.641 -5.963 1.00 2.41 H new ATOM 0 HD12 ILE A1008 16.071 -12.190 -6.773 1.00 2.41 H new ATOM 0 HD13 ILE A1008 14.641 -13.249 -6.725 1.00 2.41 H new ATOM 1903 N THR A1009 19.893 -14.190 -6.002 1.00 65.10 N ATOM 1904 CA THR A1009 21.200 -14.821 -5.927 1.00 22.23 C ATOM 1905 C THR A1009 21.266 -15.770 -4.728 1.00 72.14 C ATOM 1906 O THR A1009 20.658 -15.509 -3.691 1.00 73.45 O ATOM 1907 CB THR A1009 22.257 -13.716 -5.885 1.00 42.11 C ATOM 1908 OG1 THR A1009 23.411 -14.317 -6.467 1.00 10.22 O ATOM 1909 CG2 THR A1009 22.693 -13.376 -4.458 1.00 64.04 C ATOM 0 H THR A1009 19.893 -13.186 -5.824 1.00 65.10 H new ATOM 0 HA THR A1009 21.391 -15.440 -6.803 1.00 22.23 H new ATOM 0 HB THR A1009 21.865 -12.821 -6.367 1.00 42.11 H new ATOM 0 HG1 THR A1009 24.146 -13.668 -6.481 1.00 10.22 H new ATOM 0 HG21 THR A1009 23.444 -12.586 -4.485 1.00 64.04 H new ATOM 0 HG22 THR A1009 21.830 -13.037 -3.885 1.00 64.04 H new ATOM 0 HG23 THR A1009 23.116 -14.263 -3.986 1.00 64.04 H new ATOM 1917 N PHE A1010 22.009 -16.852 -4.911 1.00 2.52 N ATOM 1918 CA PHE A1010 22.162 -17.841 -3.858 1.00 3.25 C ATOM 1919 C PHE A1010 23.639 -18.065 -3.527 1.00 21.44 C ATOM 1920 O PHE A1010 24.516 -17.706 -4.311 1.00 22.54 O ATOM 1921 CB PHE A1010 21.565 -19.148 -4.382 1.00 32.13 C ATOM 1922 CG PHE A1010 20.079 -19.326 -4.061 1.00 25.34 C ATOM 1923 CD1 PHE A1010 19.192 -18.349 -4.385 1.00 54.40 C ATOM 1924 CD2 PHE A1010 19.647 -20.462 -3.451 1.00 21.53 C ATOM 1925 CE1 PHE A1010 17.813 -18.514 -4.087 1.00 41.01 C ATOM 1926 CE2 PHE A1010 18.269 -20.628 -3.153 1.00 13.22 C ATOM 1927 CZ PHE A1010 17.381 -19.650 -3.477 1.00 73.12 C ATOM 0 H PHE A1010 22.511 -17.065 -5.773 1.00 2.52 H new ATOM 0 HA PHE A1010 21.662 -17.500 -2.952 1.00 3.25 H new ATOM 0 HB2 PHE A1010 21.700 -19.190 -5.463 1.00 32.13 H new ATOM 0 HB3 PHE A1010 22.121 -19.985 -3.959 1.00 32.13 H new ATOM 0 HD1 PHE A1010 19.536 -17.447 -4.869 1.00 54.40 H new ATOM 0 HD2 PHE A1010 20.352 -21.238 -3.193 1.00 21.53 H new ATOM 0 HE1 PHE A1010 17.108 -17.738 -4.345 1.00 41.01 H new ATOM 0 HE2 PHE A1010 17.926 -21.531 -2.669 1.00 13.22 H new ATOM 0 HZ PHE A1010 16.333 -19.776 -3.250 1.00 73.12 H new ATOM 1937 N PRO A1011 23.875 -18.674 -2.333 1.00 54.32 N ATOM 1938 CA PRO A1011 25.230 -18.950 -1.889 1.00 20.41 C ATOM 1939 C PRO A1011 25.825 -20.136 -2.650 1.00 64.43 C ATOM 1940 O PRO A1011 25.287 -20.555 -3.674 1.00 42.43 O ATOM 1941 CB PRO A1011 25.110 -19.203 -0.395 1.00 24.31 C ATOM 1942 CG PRO A1011 23.645 -19.517 -0.141 1.00 71.34 C ATOM 1943 CD PRO A1011 22.861 -19.113 -1.379 1.00 13.41 C ATOM 0 HA PRO A1011 25.914 -18.125 -2.086 1.00 20.41 H new ATOM 0 HB2 PRO A1011 25.746 -20.033 -0.087 1.00 24.31 H new ATOM 0 HB3 PRO A1011 25.427 -18.330 0.176 1.00 24.31 H new ATOM 0 HG2 PRO A1011 23.512 -20.579 0.065 1.00 71.34 H new ATOM 0 HG3 PRO A1011 23.284 -18.975 0.733 1.00 71.34 H new ATOM 0 HD2 PRO A1011 22.283 -19.949 -1.772 1.00 13.41 H new ATOM 0 HD3 PRO A1011 22.154 -18.314 -1.157 1.00 13.41 H new