USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 808 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 972 MET CE :methyl 167:sc= -0.448 (180deg=-0.203) USER MOD Set 1.2: A 981 CYS SG : rot -150:sc= -2.3 USER MOD Set 2.1: A 939 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 971 MET CE :methyl 161:sc= -2.75! (180deg=-4.36!) USER MOD Set 3.1: A 948 GLN : amide:sc= -5.6! C(o=-8.1!,f=-6.4!) USER MOD Set 3.2: A 955 GLN : amide:sc= -2.5! K(o=-8.1!,f=-6.4) USER MOD Set 4.1: A 915 CYS SG : rot -118:sc= -2.93 USER MOD Set 4.2: A 930 ASN : amide:sc= -4.92! C(o=-9.1!,f=-17!) USER MOD Set 4.3: A 932 THR OG1 : rot 58:sc= -1.29! USER MOD Set 5.1: A 909 ASN : amide:sc= -2.79! C(o=-4.1!,f=-6.5!) USER MOD Set 5.2: A 966 GLN : amide:sc= -1.3 K(o=-4.1,f=-9.3!) USER MOD Set 6.1: A 907 CYS SG : rot 127:sc= 0.566 USER MOD Set 6.2: A 962 CYS SG : rot 170:sc= 0.967! USER MOD Single : A 898 ASN : amide:sc= -1.6! K(o=-1.6!,f=-0.76) USER MOD Single : A 899 ASN : amide:sc= -0.91 K(o=-0.91,f=-5.7!) USER MOD Single : A 901 SER OG : rot 85:sc= 0.524 USER MOD Single : A 904 THR OG1 : rot 180:sc= -0.587 USER MOD Single : A 908 LYS NZ :NH3+ -143:sc= 0.891 (180deg=0.0311) USER MOD Single : A 911 SER OG : rot -63:sc= 0.938 USER MOD Single : A 916 SER OG : rot 180:sc= -0.483 USER MOD Single : A 921 HIS : no HD1:sc=-0.00989 X(o=-0.0099,f=-0.38) USER MOD Single : A 931 MET CE :methyl 167:sc= -0.214 (180deg=-0.56) USER MOD Single : A 936 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 944 ASN : amide:sc= -15.2! C(o=-15!,f=-11!) USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 957 ASN : amide:sc= -1.57 K(o=-1.6,f=-0.2) USER MOD Single : A 963 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 970 THR OG1 : rot 180:sc= 0 USER MOD Single : A 974 HIS : no HE2:sc= -3.64! C(o=-3.6!,f=-7.9!) 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= -5.06! C(o=-5.1!,f=-3.7!) USER MOD Single : A 992 LYS NZ :NH3+ 164:sc= -0.19 (180deg=-0.622) 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= -0.698 X(o=-0.7,f=-0.79) USER MOD Single : A1000 TYR OH : rot 180:sc= 0 USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 LYS NZ :NH3+ -150:sc= -0.229 (180deg=-1.19) USER MOD Single : A1009 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 101 N ASN A 898 16.714 -9.055 -5.499 1.00 31.30 N ATOM 102 CA ASN A 898 17.641 -10.141 -5.769 1.00 2.10 C ATOM 103 C ASN A 898 18.170 -10.695 -4.445 1.00 31.54 C ATOM 104 O ASN A 898 19.379 -10.744 -4.227 1.00 25.23 O ATOM 105 CB ASN A 898 18.837 -9.653 -6.588 1.00 44.52 C ATOM 106 CG ASN A 898 18.569 -9.792 -8.088 1.00 14.01 C ATOM 107 OD1 ASN A 898 18.345 -8.825 -8.797 1.00 40.14 O ATOM 108 ND2 ASN A 898 18.603 -11.046 -8.529 1.00 75.13 N ATOM 0 HA ASN A 898 17.108 -10.908 -6.331 1.00 2.10 H new ATOM 0 HB2 ASN A 898 19.046 -8.611 -6.348 1.00 44.52 H new ATOM 0 HB3 ASN A 898 19.724 -10.226 -6.319 1.00 44.52 H new ATOM 0 HD21 ASN A 898 18.436 -11.244 -9.515 1.00 75.13 H new ATOM 0 HD22 ASN A 898 18.797 -11.809 -7.881 1.00 75.13 H new ATOM 115 N ASN A 899 17.237 -11.100 -3.595 1.00 3.43 N ATOM 116 CA ASN A 899 17.594 -11.649 -2.298 1.00 2.13 C ATOM 117 C ASN A 899 16.676 -12.830 -1.979 1.00 34.14 C ATOM 118 O ASN A 899 15.453 -12.702 -2.029 1.00 44.02 O ATOM 119 CB ASN A 899 17.424 -10.605 -1.192 1.00 32.41 C ATOM 120 CG ASN A 899 18.454 -10.812 -0.080 1.00 11.14 C ATOM 121 OD1 ASN A 899 18.559 -11.872 0.516 1.00 41.34 O ATOM 122 ND2 ASN A 899 19.206 -9.743 0.167 1.00 53.23 N ATOM 0 H ASN A 899 16.235 -11.059 -3.780 1.00 3.43 H new ATOM 0 HA ASN A 899 18.637 -11.963 -2.340 1.00 2.13 H new ATOM 0 HB2 ASN A 899 17.532 -9.605 -1.611 1.00 32.41 H new ATOM 0 HB3 ASN A 899 16.418 -10.670 -0.777 1.00 32.41 H new ATOM 0 HD21 ASN A 899 19.922 -9.780 0.892 1.00 53.23 H new ATOM 0 HD22 ASN A 899 19.066 -8.886 -0.369 1.00 53.23 H new ATOM 129 N PRO A 900 17.316 -13.984 -1.649 1.00 2.54 N ATOM 130 CA PRO A 900 16.570 -15.187 -1.321 1.00 41.44 C ATOM 131 C PRO A 900 15.955 -15.088 0.076 1.00 3.52 C ATOM 132 O PRO A 900 15.299 -16.020 0.537 1.00 22.22 O ATOM 133 CB PRO A 900 17.575 -16.320 -1.449 1.00 42.32 C ATOM 134 CG PRO A 900 18.947 -15.669 -1.388 1.00 4.34 C ATOM 135 CD PRO A 900 18.762 -14.172 -1.578 1.00 62.25 C ATOM 0 HA PRO A 900 15.720 -15.349 -1.984 1.00 41.44 H new ATOM 0 HB2 PRO A 900 17.451 -17.045 -0.645 1.00 42.32 H new ATOM 0 HB3 PRO A 900 17.439 -16.858 -2.387 1.00 42.32 H new ATOM 0 HG2 PRO A 900 19.425 -15.876 -0.431 1.00 4.34 H new ATOM 0 HG3 PRO A 900 19.597 -16.075 -2.163 1.00 4.34 H new ATOM 0 HD2 PRO A 900 19.194 -13.611 -0.749 1.00 62.25 H new ATOM 0 HD3 PRO A 900 19.252 -13.825 -2.488 1.00 62.25 H new ATOM 143 N SER A 901 16.189 -13.949 0.711 1.00 3.43 N ATOM 144 CA SER A 901 15.667 -13.715 2.047 1.00 75.31 C ATOM 145 C SER A 901 14.239 -13.171 1.962 1.00 20.24 C ATOM 146 O SER A 901 13.449 -13.344 2.889 1.00 1.13 O ATOM 147 CB SER A 901 16.558 -12.747 2.826 1.00 5.11 C ATOM 148 OG SER A 901 16.385 -12.877 4.235 1.00 54.45 O ATOM 0 H SER A 901 16.733 -13.178 0.325 1.00 3.43 H new ATOM 0 HA SER A 901 15.657 -14.665 2.581 1.00 75.31 H new ATOM 0 HB2 SER A 901 17.602 -12.930 2.571 1.00 5.11 H new ATOM 0 HB3 SER A 901 16.331 -11.724 2.526 1.00 5.11 H new ATOM 0 HG SER A 901 16.953 -13.602 4.569 1.00 54.45 H new ATOM 154 N LEU A 902 13.952 -12.525 0.842 1.00 13.32 N ATOM 155 CA LEU A 902 12.633 -11.954 0.624 1.00 22.15 C ATOM 156 C LEU A 902 11.715 -13.018 0.020 1.00 62.32 C ATOM 157 O LEU A 902 10.496 -12.951 0.172 1.00 45.34 O ATOM 158 CB LEU A 902 12.733 -10.679 -0.215 1.00 62.03 C ATOM 159 CG LEU A 902 13.961 -9.802 0.040 1.00 61.52 C ATOM 160 CD1 LEU A 902 14.402 -9.091 -1.241 1.00 25.23 C ATOM 161 CD2 LEU A 902 13.704 -8.818 1.183 1.00 63.32 C ATOM 0 H LEU A 902 14.610 -12.384 0.075 1.00 13.32 H new ATOM 0 HA LEU A 902 12.188 -11.650 1.571 1.00 22.15 H new ATOM 0 HB2 LEU A 902 12.724 -10.959 -1.268 1.00 62.03 H new ATOM 0 HB3 LEU A 902 11.840 -10.080 -0.037 1.00 62.03 H new ATOM 0 HG LEU A 902 14.783 -10.447 0.350 1.00 61.52 H new ATOM 0 HD11 LEU A 902 15.276 -8.474 -1.032 1.00 25.23 H new ATOM 0 HD12 LEU A 902 14.653 -9.832 -2.000 1.00 25.23 H new ATOM 0 HD13 LEU A 902 13.591 -8.460 -1.604 1.00 25.23 H new ATOM 0 HD21 LEU A 902 14.592 -8.207 1.344 1.00 63.32 H new ATOM 0 HD22 LEU A 902 12.862 -8.175 0.927 1.00 63.32 H new ATOM 0 HD23 LEU A 902 13.474 -9.371 2.094 1.00 63.32 H new ATOM 173 N ILE A 903 12.336 -13.976 -0.653 1.00 33.30 N ATOM 174 CA ILE A 903 11.590 -15.053 -1.281 1.00 73.32 C ATOM 175 C ILE A 903 11.644 -16.294 -0.388 1.00 34.13 C ATOM 176 O ILE A 903 12.584 -16.465 0.387 1.00 72.32 O ATOM 177 CB ILE A 903 12.097 -15.298 -2.704 1.00 12.51 C ATOM 178 CG1 ILE A 903 13.388 -16.119 -2.692 1.00 53.25 C ATOM 179 CG2 ILE A 903 12.263 -13.978 -3.461 1.00 24.24 C ATOM 180 CD1 ILE A 903 14.287 -15.742 -3.871 1.00 65.33 C ATOM 0 H ILE A 903 13.347 -14.029 -0.777 1.00 33.30 H new ATOM 0 HA ILE A 903 10.540 -14.779 -1.384 1.00 73.32 H new ATOM 0 HB ILE A 903 11.349 -15.884 -3.238 1.00 12.51 H new ATOM 0 HG12 ILE A 903 13.921 -15.952 -1.756 1.00 53.25 H new ATOM 0 HG13 ILE A 903 13.148 -17.181 -2.738 1.00 53.25 H new ATOM 0 HG21 ILE A 903 12.624 -14.180 -4.469 1.00 24.24 H new ATOM 0 HG22 ILE A 903 11.302 -13.466 -3.515 1.00 24.24 H new ATOM 0 HG23 ILE A 903 12.981 -13.346 -2.938 1.00 24.24 H new ATOM 0 HD11 ILE A 903 15.198 -16.340 -3.840 1.00 65.33 H new ATOM 0 HD12 ILE A 903 13.760 -15.933 -4.806 1.00 65.33 H new ATOM 0 HD13 ILE A 903 14.544 -14.685 -3.809 1.00 65.33 H new ATOM 192 N THR A 904 10.623 -17.128 -0.525 1.00 1.21 N ATOM 193 CA THR A 904 10.542 -18.348 0.260 1.00 4.33 C ATOM 194 C THR A 904 9.892 -19.466 -0.557 1.00 12.33 C ATOM 195 O THR A 904 9.185 -19.199 -1.528 1.00 24.42 O ATOM 196 CB THR A 904 9.794 -18.027 1.556 1.00 61.52 C ATOM 197 OG1 THR A 904 10.061 -16.646 1.778 1.00 10.53 O ATOM 198 CG2 THR A 904 10.405 -18.726 2.773 1.00 51.53 C ATOM 0 H THR A 904 9.845 -16.982 -1.168 1.00 1.21 H new ATOM 0 HA THR A 904 11.534 -18.716 0.523 1.00 4.33 H new ATOM 0 HB THR A 904 8.749 -18.322 1.455 1.00 61.52 H new ATOM 0 HG1 THR A 904 9.612 -16.354 2.599 1.00 10.53 H new ATOM 0 HG21 THR A 904 9.837 -18.465 3.666 1.00 51.53 H new ATOM 0 HG22 THR A 904 10.374 -19.806 2.626 1.00 51.53 H new ATOM 0 HG23 THR A 904 11.440 -18.406 2.895 1.00 51.53 H new ATOM 206 N PHE A 905 10.153 -20.694 -0.133 1.00 44.51 N ATOM 207 CA PHE A 905 9.602 -21.853 -0.813 1.00 61.24 C ATOM 208 C PHE A 905 8.384 -22.399 -0.066 1.00 74.33 C ATOM 209 O PHE A 905 8.389 -22.482 1.161 1.00 64.41 O ATOM 210 CB PHE A 905 10.696 -22.923 -0.832 1.00 11.24 C ATOM 211 CG PHE A 905 12.014 -22.455 -1.452 1.00 11.53 C ATOM 212 CD1 PHE A 905 12.074 -21.262 -2.102 1.00 15.51 C ATOM 213 CD2 PHE A 905 13.126 -23.231 -1.353 1.00 31.33 C ATOM 214 CE1 PHE A 905 13.297 -20.827 -2.677 1.00 52.14 C ATOM 215 CE2 PHE A 905 14.349 -22.797 -1.928 1.00 41.32 C ATOM 216 CZ PHE A 905 14.409 -21.604 -2.578 1.00 52.34 C ATOM 0 H PHE A 905 10.739 -20.911 0.673 1.00 44.51 H new ATOM 0 HA PHE A 905 9.285 -21.578 -1.819 1.00 61.24 H new ATOM 0 HB2 PHE A 905 10.884 -23.254 0.189 1.00 11.24 H new ATOM 0 HB3 PHE A 905 10.333 -23.789 -1.386 1.00 11.24 H new ATOM 0 HD1 PHE A 905 11.191 -20.645 -2.181 1.00 15.51 H new ATOM 0 HD2 PHE A 905 13.079 -24.178 -0.836 1.00 31.33 H new ATOM 0 HE1 PHE A 905 13.344 -19.879 -3.193 1.00 52.14 H new ATOM 0 HE2 PHE A 905 15.232 -23.414 -1.849 1.00 41.32 H new ATOM 0 HZ PHE A 905 15.339 -21.274 -3.016 1.00 52.34 H new ATOM 226 N LEU A 906 7.368 -22.757 -0.838 1.00 31.30 N ATOM 227 CA LEU A 906 6.145 -23.293 -0.265 1.00 30.14 C ATOM 228 C LEU A 906 5.734 -24.550 -1.034 1.00 22.21 C ATOM 229 O LEU A 906 6.358 -24.948 -2.017 1.00 44.31 O ATOM 230 CB LEU A 906 5.058 -22.217 -0.219 1.00 62.14 C ATOM 231 CG LEU A 906 5.545 -20.780 -0.022 1.00 31.12 C ATOM 232 CD1 LEU A 906 4.513 -19.776 -0.538 1.00 52.23 C ATOM 233 CD2 LEU A 906 5.913 -20.522 1.441 1.00 65.34 C ATOM 0 H LEU A 906 7.367 -22.686 -1.856 1.00 31.30 H new ATOM 0 HA LEU A 906 6.309 -23.592 0.770 1.00 30.14 H new ATOM 0 HB2 LEU A 906 4.490 -22.263 -1.148 1.00 62.14 H new ATOM 0 HB3 LEU A 906 4.368 -22.460 0.589 1.00 62.14 H new ATOM 0 HG LEU A 906 6.451 -20.642 -0.612 1.00 31.12 H new ATOM 0 HD11 LEU A 906 4.884 -18.762 -0.386 1.00 52.23 H new ATOM 0 HD12 LEU A 906 4.342 -19.944 -1.601 1.00 52.23 H new ATOM 0 HD13 LEU A 906 3.577 -19.905 0.005 1.00 52.23 H new ATOM 0 HD21 LEU A 906 6.256 -19.494 1.554 1.00 65.34 H new ATOM 0 HD22 LEU A 906 5.038 -20.684 2.070 1.00 65.34 H new ATOM 0 HD23 LEU A 906 6.708 -21.205 1.742 1.00 65.34 H new ATOM 245 N CYS A 907 4.659 -25.173 -0.560 1.00 4.20 N ATOM 246 CA CYS A 907 4.141 -26.385 -1.182 1.00 25.45 C ATOM 247 C CYS A 907 3.090 -26.051 -2.236 1.00 10.14 C ATOM 248 O CYS A 907 2.056 -25.480 -1.894 1.00 35.04 O ATOM 249 CB CYS A 907 3.540 -27.310 -0.122 1.00 24.43 C ATOM 250 SG CYS A 907 2.852 -28.859 -0.791 1.00 62.11 S ATOM 0 H CYS A 907 4.130 -24.858 0.253 1.00 4.20 H new ATOM 0 HA CYS A 907 4.971 -26.894 -1.672 1.00 25.45 H new ATOM 0 HB2 CYS A 907 4.309 -27.553 0.611 1.00 24.43 H new ATOM 0 HB3 CYS A 907 2.753 -26.774 0.408 1.00 24.43 H new ATOM 0 HG CYS A 907 3.371 -29.872 -0.162 1.00 62.11 H new ATOM 255 N LYS A 908 3.374 -26.408 -3.479 1.00 71.43 N ATOM 256 CA LYS A 908 2.447 -26.140 -4.565 1.00 54.14 C ATOM 257 C LYS A 908 1.049 -26.617 -4.166 1.00 53.04 C ATOM 258 O LYS A 908 0.106 -25.828 -4.131 1.00 40.43 O ATOM 259 CB LYS A 908 2.957 -26.755 -5.870 1.00 41.31 C ATOM 260 CG LYS A 908 1.841 -26.831 -6.914 1.00 31.22 C ATOM 261 CD LYS A 908 2.403 -26.687 -8.329 1.00 41.24 C ATOM 262 CE LYS A 908 2.571 -28.054 -8.995 1.00 33.21 C ATOM 263 NZ LYS A 908 3.010 -27.897 -10.399 1.00 50.45 N ATOM 0 H LYS A 908 4.233 -26.881 -3.759 1.00 71.43 H new ATOM 0 HA LYS A 908 2.378 -25.068 -4.751 1.00 54.14 H new ATOM 0 HB2 LYS A 908 3.783 -26.159 -6.258 1.00 41.31 H new ATOM 0 HB3 LYS A 908 3.348 -27.754 -5.677 1.00 41.31 H new ATOM 0 HG2 LYS A 908 1.317 -27.782 -6.822 1.00 31.22 H new ATOM 0 HG3 LYS A 908 1.110 -26.045 -6.728 1.00 31.22 H new ATOM 0 HD2 LYS A 908 1.736 -26.067 -8.928 1.00 41.24 H new ATOM 0 HD3 LYS A 908 3.365 -26.176 -8.292 1.00 41.24 H new ATOM 0 HE2 LYS A 908 3.301 -28.646 -8.444 1.00 33.21 H new ATOM 0 HE3 LYS A 908 1.628 -28.599 -8.962 1.00 33.21 H new ATOM 0 HZ1 LYS A 908 2.554 -28.623 -10.988 1.00 50.45 H new ATOM 0 HZ2 LYS A 908 2.742 -26.953 -10.743 1.00 50.45 H new ATOM 0 HZ3 LYS A 908 4.043 -28.005 -10.454 1.00 50.45 H new ATOM 276 N ASN A 909 0.959 -27.906 -3.876 1.00 31.44 N ATOM 277 CA ASN A 909 -0.308 -28.498 -3.480 1.00 70.15 C ATOM 278 C ASN A 909 -0.985 -27.598 -2.445 1.00 31.33 C ATOM 279 O ASN A 909 -2.083 -27.095 -2.677 1.00 73.33 O ATOM 280 CB ASN A 909 -0.099 -29.875 -2.846 1.00 51.44 C ATOM 281 CG ASN A 909 -0.175 -30.981 -3.900 1.00 71.13 C ATOM 282 OD1 ASN A 909 0.072 -30.772 -5.077 1.00 10.34 O ATOM 283 ND2 ASN A 909 -0.530 -32.167 -3.415 1.00 22.33 N ATOM 0 H ASN A 909 1.743 -28.558 -3.907 1.00 31.44 H new ATOM 0 HA ASN A 909 -0.925 -28.603 -4.373 1.00 70.15 H new ATOM 0 HB2 ASN A 909 0.871 -29.907 -2.349 1.00 51.44 H new ATOM 0 HB3 ASN A 909 -0.855 -30.045 -2.080 1.00 51.44 H new ATOM 0 HD21 ASN A 909 -0.609 -32.970 -4.039 1.00 22.33 H new ATOM 0 HD22 ASN A 909 -0.723 -32.274 -2.419 1.00 22.33 H new ATOM 290 N CYS A 910 -0.302 -27.423 -1.323 1.00 43.23 N ATOM 291 CA CYS A 910 -0.823 -26.592 -0.251 1.00 74.41 C ATOM 292 C CYS A 910 -0.221 -25.193 -0.391 1.00 24.15 C ATOM 293 O CYS A 910 -0.673 -24.397 -1.212 1.00 34.32 O ATOM 294 CB CYS A 910 -0.541 -27.201 1.124 1.00 13.00 C ATOM 295 SG CYS A 910 -1.366 -28.804 1.438 1.00 73.14 S ATOM 0 H CYS A 910 0.608 -27.843 -1.133 1.00 43.23 H new ATOM 0 HA CYS A 910 -1.908 -26.528 -0.331 1.00 74.41 H new ATOM 0 HB2 CYS A 910 0.535 -27.335 1.232 1.00 13.00 H new ATOM 0 HB3 CYS A 910 -0.853 -26.492 1.891 1.00 13.00 H new ATOM 300 N SER A 911 0.792 -24.936 0.424 1.00 12.25 N ATOM 301 CA SER A 911 1.461 -23.646 0.402 1.00 23.44 C ATOM 302 C SER A 911 2.099 -23.364 1.764 1.00 32.34 C ATOM 303 O SER A 911 2.028 -22.244 2.267 1.00 45.44 O ATOM 304 CB SER A 911 0.488 -22.527 0.030 1.00 54.41 C ATOM 305 OG SER A 911 0.945 -21.252 0.473 1.00 45.23 O ATOM 0 H SER A 911 1.165 -25.599 1.103 1.00 12.25 H new ATOM 0 HA SER A 911 2.242 -23.679 -0.358 1.00 23.44 H new ATOM 0 HB2 SER A 911 0.354 -22.508 -1.052 1.00 54.41 H new ATOM 0 HB3 SER A 911 -0.488 -22.735 0.469 1.00 54.41 H new ATOM 0 HG SER A 911 0.994 -21.244 1.452 1.00 45.23 H new ATOM 311 N VAL A 912 2.706 -24.400 2.323 1.00 24.45 N ATOM 312 CA VAL A 912 3.356 -24.278 3.618 1.00 72.24 C ATOM 313 C VAL A 912 4.840 -23.968 3.411 1.00 32.44 C ATOM 314 O VAL A 912 5.502 -24.604 2.593 1.00 43.34 O ATOM 315 CB VAL A 912 3.119 -25.544 4.444 1.00 55.02 C ATOM 316 CG1 VAL A 912 1.711 -26.096 4.209 1.00 62.11 C ATOM 317 CG2 VAL A 912 4.181 -26.603 4.142 1.00 53.04 C ATOM 0 H VAL A 912 2.762 -25.328 1.904 1.00 24.45 H new ATOM 0 HA VAL A 912 2.927 -23.452 4.185 1.00 72.24 H new ATOM 0 HB VAL A 912 3.203 -25.277 5.498 1.00 55.02 H new ATOM 0 HG11 VAL A 912 1.568 -26.996 4.808 1.00 62.11 H new ATOM 0 HG12 VAL A 912 0.974 -25.347 4.498 1.00 62.11 H new ATOM 0 HG13 VAL A 912 1.587 -26.339 3.154 1.00 62.11 H new ATOM 0 HG21 VAL A 912 3.989 -27.492 4.742 1.00 53.04 H new ATOM 0 HG22 VAL A 912 4.144 -26.864 3.084 1.00 53.04 H new ATOM 0 HG23 VAL A 912 5.168 -26.208 4.384 1.00 53.04 H new ATOM 327 N LEU A 913 5.318 -22.992 4.168 1.00 4.13 N ATOM 328 CA LEU A 913 6.712 -22.590 4.079 1.00 71.02 C ATOM 329 C LEU A 913 7.602 -23.744 4.544 1.00 71.41 C ATOM 330 O LEU A 913 7.672 -24.037 5.736 1.00 31.44 O ATOM 331 CB LEU A 913 6.944 -21.287 4.846 1.00 10.21 C ATOM 332 CG LEU A 913 8.391 -20.792 4.906 1.00 74.23 C ATOM 333 CD1 LEU A 913 9.094 -21.305 6.164 1.00 51.20 C ATOM 334 CD2 LEU A 913 9.151 -21.166 3.632 1.00 51.13 C ATOM 0 H LEU A 913 4.765 -22.467 4.846 1.00 4.13 H new ATOM 0 HA LEU A 913 6.981 -22.376 3.045 1.00 71.02 H new ATOM 0 HB2 LEU A 913 6.333 -20.507 4.391 1.00 10.21 H new ATOM 0 HB3 LEU A 913 6.584 -21.420 5.866 1.00 10.21 H new ATOM 0 HG LEU A 913 8.378 -19.704 4.966 1.00 74.23 H new ATOM 0 HD11 LEU A 913 10.121 -20.939 6.182 1.00 51.20 H new ATOM 0 HD12 LEU A 913 8.566 -20.947 7.048 1.00 51.20 H new ATOM 0 HD13 LEU A 913 9.098 -22.395 6.160 1.00 51.20 H new ATOM 0 HD21 LEU A 913 10.176 -20.803 3.700 1.00 51.13 H new ATOM 0 HD22 LEU A 913 9.157 -22.250 3.517 1.00 51.13 H new ATOM 0 HD23 LEU A 913 8.662 -20.712 2.770 1.00 51.13 H new ATOM 346 N ALA A 914 8.260 -24.368 3.578 1.00 72.41 N ATOM 347 CA ALA A 914 9.142 -25.484 3.873 1.00 25.24 C ATOM 348 C ALA A 914 10.536 -24.951 4.213 1.00 52.35 C ATOM 349 O ALA A 914 11.226 -25.506 5.066 1.00 42.31 O ATOM 350 CB ALA A 914 9.161 -26.449 2.686 1.00 33.23 C ATOM 0 H ALA A 914 8.200 -24.122 2.590 1.00 72.41 H new ATOM 0 HA ALA A 914 8.781 -26.039 4.738 1.00 25.24 H new ATOM 0 HB1 ALA A 914 9.823 -27.286 2.908 1.00 33.23 H new ATOM 0 HB2 ALA A 914 8.153 -26.822 2.504 1.00 33.23 H new ATOM 0 HB3 ALA A 914 9.521 -25.928 1.799 1.00 33.23 H new ATOM 356 N CYS A 915 10.908 -23.880 3.527 1.00 54.15 N ATOM 357 CA CYS A 915 12.206 -23.265 3.744 1.00 21.33 C ATOM 358 C CYS A 915 12.313 -22.035 2.842 1.00 54.44 C ATOM 359 O CYS A 915 11.542 -21.887 1.894 1.00 11.34 O ATOM 360 CB CYS A 915 13.348 -24.254 3.499 1.00 0.40 C ATOM 361 SG CYS A 915 12.952 -25.324 2.069 1.00 65.33 S ATOM 0 H CYS A 915 10.332 -23.422 2.820 1.00 54.15 H new ATOM 0 HA CYS A 915 12.296 -22.958 4.786 1.00 21.33 H new ATOM 0 HB2 CYS A 915 14.276 -23.713 3.313 1.00 0.40 H new ATOM 0 HB3 CYS A 915 13.508 -24.865 4.387 1.00 0.40 H new ATOM 0 HG CYS A 915 12.888 -26.563 2.458 1.00 65.33 H new ATOM 367 N SER A 916 13.274 -21.183 3.167 1.00 12.10 N ATOM 368 CA SER A 916 13.491 -19.970 2.397 1.00 10.33 C ATOM 369 C SER A 916 14.775 -20.095 1.575 1.00 42.30 C ATOM 370 O SER A 916 15.666 -20.868 1.923 1.00 44.15 O ATOM 371 CB SER A 916 13.562 -18.744 3.310 1.00 42.21 C ATOM 372 OG SER A 916 12.825 -18.932 4.515 1.00 41.21 O ATOM 0 H SER A 916 13.911 -21.309 3.953 1.00 12.10 H new ATOM 0 HA SER A 916 12.646 -19.838 1.721 1.00 10.33 H new ATOM 0 HB2 SER A 916 14.604 -18.532 3.551 1.00 42.21 H new ATOM 0 HB3 SER A 916 13.174 -17.874 2.780 1.00 42.21 H new ATOM 0 HG SER A 916 12.897 -18.128 5.071 1.00 41.21 H new ATOM 378 N GLY A 917 14.829 -19.322 0.500 1.00 20.00 N ATOM 379 CA GLY A 917 15.989 -19.336 -0.375 1.00 22.44 C ATOM 380 C GLY A 917 17.283 -19.188 0.428 1.00 2.14 C ATOM 381 O GLY A 917 18.234 -19.940 0.224 1.00 25.41 O ATOM 0 H GLY A 917 14.088 -18.682 0.215 1.00 20.00 H new ATOM 0 HA2 GLY A 917 16.012 -20.268 -0.940 1.00 22.44 H new ATOM 0 HA3 GLY A 917 15.912 -18.526 -1.100 1.00 22.44 H new ATOM 385 N GLU A 918 17.277 -18.212 1.325 1.00 70.42 N ATOM 386 CA GLU A 918 18.438 -17.956 2.159 1.00 4.44 C ATOM 387 C GLU A 918 18.757 -19.182 3.017 1.00 1.33 C ATOM 388 O GLU A 918 19.906 -19.391 3.404 1.00 33.42 O ATOM 389 CB GLU A 918 18.224 -16.717 3.032 1.00 73.04 C ATOM 390 CG GLU A 918 17.111 -16.953 4.054 1.00 14.15 C ATOM 391 CD GLU A 918 17.321 -16.093 5.302 1.00 2.31 C ATOM 392 OE1 GLU A 918 18.078 -15.111 5.258 1.00 75.01 O ATOM 393 OE2 GLU A 918 16.665 -16.475 6.345 1.00 51.30 O ATOM 0 H GLU A 918 16.486 -17.590 1.492 1.00 70.42 H new ATOM 0 HA GLU A 918 19.291 -17.760 1.509 1.00 4.44 H new ATOM 0 HB2 GLU A 918 19.151 -16.467 3.549 1.00 73.04 H new ATOM 0 HB3 GLU A 918 17.970 -15.864 2.403 1.00 73.04 H new ATOM 0 HG2 GLU A 918 16.145 -16.720 3.606 1.00 14.15 H new ATOM 0 HG3 GLU A 918 17.087 -18.006 4.334 1.00 14.15 H new ATOM 401 N ASP A 919 17.720 -19.960 3.289 1.00 13.35 N ATOM 402 CA ASP A 919 17.875 -21.159 4.094 1.00 32.45 C ATOM 403 C ASP A 919 18.111 -22.359 3.174 1.00 13.33 C ATOM 404 O ASP A 919 17.758 -23.487 3.516 1.00 5.40 O ATOM 405 CB ASP A 919 16.616 -21.436 4.919 1.00 71.24 C ATOM 406 CG ASP A 919 16.862 -22.120 6.265 1.00 73.52 C ATOM 407 OD1 ASP A 919 16.042 -22.023 7.190 1.00 50.30 O ATOM 408 OD2 ASP A 919 17.964 -22.786 6.345 1.00 71.02 O ATOM 0 H ASP A 919 16.769 -19.783 2.966 1.00 13.35 H new ATOM 0 HA ASP A 919 18.720 -21.007 4.766 1.00 32.45 H new ATOM 0 HB2 ASP A 919 16.102 -20.492 5.097 1.00 71.24 H new ATOM 0 HB3 ASP A 919 15.943 -22.059 4.329 1.00 71.24 H new ATOM 414 N ILE A 920 18.705 -22.074 2.025 1.00 62.31 N ATOM 415 CA ILE A 920 18.992 -23.116 1.053 1.00 43.50 C ATOM 416 C ILE A 920 20.432 -22.962 0.558 1.00 53.24 C ATOM 417 O ILE A 920 21.007 -21.877 0.636 1.00 35.21 O ATOM 418 CB ILE A 920 17.951 -23.104 -0.068 1.00 44.43 C ATOM 419 CG1 ILE A 920 16.547 -23.356 0.485 1.00 41.45 C ATOM 420 CG2 ILE A 920 18.321 -24.099 -1.170 1.00 11.00 C ATOM 421 CD1 ILE A 920 16.177 -24.837 0.387 1.00 23.02 C ATOM 0 H ILE A 920 18.995 -21.137 1.745 1.00 62.31 H new ATOM 0 HA ILE A 920 18.917 -24.100 1.515 1.00 43.50 H new ATOM 0 HB ILE A 920 17.946 -22.112 -0.519 1.00 44.43 H new ATOM 0 HG12 ILE A 920 16.499 -23.033 1.525 1.00 41.45 H new ATOM 0 HG13 ILE A 920 15.822 -22.759 -0.068 1.00 41.45 H new ATOM 0 HG21 ILE A 920 17.565 -24.071 -1.955 1.00 11.00 H new ATOM 0 HG22 ILE A 920 19.291 -23.832 -1.591 1.00 11.00 H new ATOM 0 HG23 ILE A 920 18.372 -25.104 -0.751 1.00 11.00 H new ATOM 0 HD11 ILE A 920 15.174 -24.989 0.787 1.00 23.02 H new ATOM 0 HD12 ILE A 920 16.203 -25.150 -0.657 1.00 23.02 H new ATOM 0 HD13 ILE A 920 16.890 -25.429 0.961 1.00 23.02 H new ATOM 433 N HIS A 921 20.973 -24.063 0.058 1.00 34.42 N ATOM 434 CA HIS A 921 22.334 -24.065 -0.450 1.00 11.30 C ATOM 435 C HIS A 921 22.331 -24.470 -1.925 1.00 75.03 C ATOM 436 O HIS A 921 21.314 -24.928 -2.445 1.00 21.53 O ATOM 437 CB HIS A 921 23.233 -24.957 0.408 1.00 41.10 C ATOM 438 CG HIS A 921 23.688 -24.313 1.696 1.00 41.01 C ATOM 439 ND1 HIS A 921 23.439 -24.866 2.940 1.00 72.43 N ATOM 440 CD2 HIS A 921 24.379 -23.158 1.920 1.00 62.54 C ATOM 441 CE1 HIS A 921 23.960 -24.072 3.863 1.00 11.10 C ATOM 442 NE2 HIS A 921 24.542 -23.014 3.229 1.00 52.31 N ATOM 0 H HIS A 921 20.493 -24.961 -0.006 1.00 34.42 H new ATOM 0 HA HIS A 921 22.751 -23.060 -0.386 1.00 11.30 H new ATOM 0 HB2 HIS A 921 22.697 -25.877 0.643 1.00 41.10 H new ATOM 0 HB3 HIS A 921 24.110 -25.239 -0.175 1.00 41.10 H new ATOM 0 HD2 HIS A 921 24.733 -22.477 1.161 1.00 62.54 H new ATOM 0 HE1 HIS A 921 23.929 -24.234 4.930 1.00 11.10 H new ATOM 0 HE2 HIS A 921 25.023 -22.239 3.686 1.00 52.31 H new ATOM 450 N VAL A 922 23.480 -24.286 -2.559 1.00 35.31 N ATOM 451 CA VAL A 922 23.622 -24.627 -3.964 1.00 61.02 C ATOM 452 C VAL A 922 24.883 -25.472 -4.154 1.00 45.23 C ATOM 453 O VAL A 922 25.745 -25.514 -3.277 1.00 34.10 O ATOM 454 CB VAL A 922 23.621 -23.355 -4.814 1.00 1.41 C ATOM 455 CG1 VAL A 922 24.171 -23.630 -6.215 1.00 22.34 C ATOM 456 CG2 VAL A 922 22.220 -22.744 -4.885 1.00 70.23 C ATOM 0 H VAL A 922 24.321 -23.905 -2.125 1.00 35.31 H new ATOM 0 HA VAL A 922 22.775 -25.226 -4.299 1.00 61.02 H new ATOM 0 HB VAL A 922 24.278 -22.631 -4.333 1.00 1.41 H new ATOM 0 HG11 VAL A 922 24.159 -22.709 -6.798 1.00 22.34 H new ATOM 0 HG12 VAL A 922 25.194 -23.998 -6.138 1.00 22.34 H new ATOM 0 HG13 VAL A 922 23.552 -24.380 -6.708 1.00 22.34 H new ATOM 0 HG21 VAL A 922 22.247 -21.841 -5.495 1.00 70.23 H new ATOM 0 HG22 VAL A 922 21.532 -23.462 -5.331 1.00 70.23 H new ATOM 0 HG23 VAL A 922 21.881 -22.493 -3.880 1.00 70.23 H new ATOM 573 N VAL A 929 20.446 -28.688 -3.331 1.00 11.33 N ATOM 574 CA VAL A 929 20.343 -29.536 -2.156 1.00 20.53 C ATOM 575 C VAL A 929 19.883 -28.696 -0.963 1.00 51.42 C ATOM 576 O VAL A 929 20.465 -27.651 -0.674 1.00 21.41 O ATOM 577 CB VAL A 929 21.674 -30.249 -1.907 1.00 31.12 C ATOM 578 CG1 VAL A 929 21.843 -31.441 -2.851 1.00 52.34 C ATOM 579 CG2 VAL A 929 22.849 -29.277 -2.035 1.00 35.14 C ATOM 0 HA VAL A 929 19.596 -30.314 -2.312 1.00 20.53 H new ATOM 0 HB VAL A 929 21.664 -30.630 -0.886 1.00 31.12 H new ATOM 0 HG11 VAL A 929 22.797 -31.930 -2.653 1.00 52.34 H new ATOM 0 HG12 VAL A 929 21.031 -32.151 -2.690 1.00 52.34 H new ATOM 0 HG13 VAL A 929 21.821 -31.093 -3.884 1.00 52.34 H new ATOM 0 HG21 VAL A 929 23.783 -29.809 -1.853 1.00 35.14 H new ATOM 0 HG22 VAL A 929 22.862 -28.853 -3.039 1.00 35.14 H new ATOM 0 HG23 VAL A 929 22.740 -28.476 -1.304 1.00 35.14 H new ATOM 589 N ASN A 930 18.842 -29.182 -0.303 1.00 62.23 N ATOM 590 CA ASN A 930 18.297 -28.488 0.851 1.00 23.53 C ATOM 591 C ASN A 930 18.895 -29.084 2.128 1.00 74.43 C ATOM 592 O ASN A 930 18.405 -30.092 2.635 1.00 74.22 O ATOM 593 CB ASN A 930 16.777 -28.647 0.922 1.00 2.21 C ATOM 594 CG ASN A 930 16.235 -28.138 2.259 1.00 34.01 C ATOM 595 OD1 ASN A 930 16.634 -28.573 3.327 1.00 43.23 O ATOM 596 ND2 ASN A 930 15.304 -27.195 2.142 1.00 60.23 N ATOM 0 H ASN A 930 18.362 -30.048 -0.546 1.00 62.23 H new ATOM 0 HA ASN A 930 18.545 -27.431 0.757 1.00 23.53 H new ATOM 0 HB2 ASN A 930 16.312 -28.097 0.104 1.00 2.21 H new ATOM 0 HB3 ASN A 930 16.511 -29.696 0.793 1.00 2.21 H new ATOM 0 HD21 ASN A 930 14.879 -26.791 2.977 1.00 60.23 H new ATOM 0 HD22 ASN A 930 15.015 -26.875 1.217 1.00 60.23 H new ATOM 603 N MET A 931 19.944 -28.436 2.610 1.00 24.12 N ATOM 604 CA MET A 931 20.614 -28.889 3.818 1.00 72.33 C ATOM 605 C MET A 931 19.936 -28.321 5.066 1.00 20.44 C ATOM 606 O MET A 931 20.606 -27.807 5.961 1.00 74.11 O ATOM 607 CB MET A 931 22.078 -28.448 3.786 1.00 3.20 C ATOM 608 CG MET A 931 22.727 -28.797 2.445 1.00 3.31 C ATOM 609 SD MET A 931 23.004 -30.557 2.341 1.00 43.04 S ATOM 610 CE MET A 931 24.631 -30.572 1.605 1.00 55.20 C ATOM 0 H MET A 931 20.347 -27.600 2.186 1.00 24.12 H new ATOM 0 HA MET A 931 20.554 -29.977 3.858 1.00 72.33 H new ATOM 0 HB2 MET A 931 22.141 -27.373 3.956 1.00 3.20 H new ATOM 0 HB3 MET A 931 22.625 -28.932 4.595 1.00 3.20 H new ATOM 0 HG2 MET A 931 22.086 -28.472 1.626 1.00 3.31 H new ATOM 0 HG3 MET A 931 23.672 -28.265 2.340 1.00 3.31 H new ATOM 0 HE1 MET A 931 25.055 -31.574 1.679 1.00 55.20 H new ATOM 0 HE2 MET A 931 24.558 -30.285 0.556 1.00 55.20 H new ATOM 0 HE3 MET A 931 25.274 -29.866 2.130 1.00 55.20 H new ATOM 620 N THR A 932 18.616 -28.434 5.087 1.00 1.21 N ATOM 621 CA THR A 932 17.840 -27.938 6.211 1.00 24.03 C ATOM 622 C THR A 932 17.364 -29.100 7.085 1.00 63.53 C ATOM 623 O THR A 932 16.726 -30.030 6.593 1.00 23.23 O ATOM 624 CB THR A 932 16.697 -27.086 5.657 1.00 33.04 C ATOM 625 OG1 THR A 932 17.233 -26.517 4.466 1.00 2.34 O ATOM 626 CG2 THR A 932 16.386 -25.876 6.542 1.00 62.54 C ATOM 0 H THR A 932 18.064 -28.862 4.343 1.00 1.21 H new ATOM 0 HA THR A 932 18.446 -27.309 6.863 1.00 24.03 H new ATOM 0 HB THR A 932 15.803 -27.701 5.556 1.00 33.04 H new ATOM 0 HG1 THR A 932 17.528 -27.233 3.865 1.00 2.34 H new ATOM 0 HG21 THR A 932 15.567 -25.305 6.103 1.00 62.54 H new ATOM 0 HG22 THR A 932 16.099 -26.217 7.537 1.00 62.54 H new ATOM 0 HG23 THR A 932 17.270 -25.243 6.617 1.00 62.54 H new ATOM 634 N PRO A 933 17.702 -29.007 8.399 1.00 75.50 N ATOM 635 CA PRO A 933 17.316 -30.040 9.346 1.00 75.05 C ATOM 636 C PRO A 933 15.827 -29.944 9.685 1.00 13.10 C ATOM 637 O PRO A 933 15.125 -30.954 9.709 1.00 24.15 O ATOM 638 CB PRO A 933 18.215 -29.824 10.552 1.00 70.24 C ATOM 639 CG PRO A 933 18.744 -28.405 10.428 1.00 1.53 C ATOM 640 CD PRO A 933 18.456 -27.921 9.016 1.00 4.14 C ATOM 0 HA PRO A 933 17.443 -31.046 8.946 1.00 75.05 H new ATOM 0 HB2 PRO A 933 17.660 -29.954 11.481 1.00 70.24 H new ATOM 0 HB3 PRO A 933 19.032 -30.546 10.565 1.00 70.24 H new ATOM 0 HG2 PRO A 933 18.265 -27.754 11.160 1.00 1.53 H new ATOM 0 HG3 PRO A 933 19.815 -28.378 10.630 1.00 1.53 H new ATOM 0 HD2 PRO A 933 17.881 -26.995 9.024 1.00 4.14 H new ATOM 0 HD3 PRO A 933 19.378 -27.719 8.471 1.00 4.14 H new ATOM 648 N GLU A 934 15.388 -28.720 9.938 1.00 1.44 N ATOM 649 CA GLU A 934 13.995 -28.478 10.275 1.00 24.32 C ATOM 650 C GLU A 934 13.084 -28.971 9.149 1.00 30.04 C ATOM 651 O GLU A 934 11.982 -29.453 9.405 1.00 75.14 O ATOM 652 CB GLU A 934 13.751 -26.997 10.570 1.00 42.03 C ATOM 653 CG GLU A 934 14.797 -26.452 11.545 1.00 71.13 C ATOM 654 CD GLU A 934 14.154 -26.065 12.878 1.00 40.30 C ATOM 655 OE1 GLU A 934 13.510 -25.009 12.972 1.00 22.23 O ATOM 656 OE2 GLU A 934 14.341 -26.905 13.838 1.00 24.43 O ATOM 0 H GLU A 934 15.973 -27.884 9.916 1.00 1.44 H new ATOM 0 HA GLU A 934 13.757 -29.038 11.180 1.00 24.32 H new ATOM 0 HB2 GLU A 934 13.783 -26.428 9.641 1.00 42.03 H new ATOM 0 HB3 GLU A 934 12.754 -26.866 10.990 1.00 42.03 H new ATOM 0 HG2 GLU A 934 15.569 -27.203 11.714 1.00 71.13 H new ATOM 0 HG3 GLU A 934 15.289 -25.583 11.108 1.00 71.13 H new ATOM 664 N PHE A 935 13.578 -28.833 7.928 1.00 41.11 N ATOM 665 CA PHE A 935 12.822 -29.258 6.762 1.00 11.02 C ATOM 666 C PHE A 935 12.539 -30.761 6.810 1.00 1.12 C ATOM 667 O PHE A 935 11.645 -31.250 6.121 1.00 22.35 O ATOM 668 CB PHE A 935 13.683 -28.952 5.535 1.00 54.01 C ATOM 669 CG PHE A 935 13.100 -29.476 4.220 1.00 5.14 C ATOM 670 CD1 PHE A 935 11.982 -28.906 3.697 1.00 33.23 C ATOM 671 CD2 PHE A 935 13.702 -30.511 3.575 1.00 33.22 C ATOM 672 CE1 PHE A 935 11.441 -29.392 2.477 1.00 25.55 C ATOM 673 CE2 PHE A 935 13.161 -30.997 2.355 1.00 24.44 C ATOM 674 CZ PHE A 935 12.043 -30.428 1.832 1.00 14.22 C ATOM 0 H PHE A 935 14.493 -28.433 7.720 1.00 41.11 H new ATOM 0 HA PHE A 935 11.866 -28.736 6.728 1.00 11.02 H new ATOM 0 HB2 PHE A 935 13.816 -27.873 5.457 1.00 54.01 H new ATOM 0 HB3 PHE A 935 14.672 -29.386 5.681 1.00 54.01 H new ATOM 0 HD1 PHE A 935 11.505 -28.083 4.209 1.00 33.23 H new ATOM 0 HD2 PHE A 935 14.591 -30.963 3.990 1.00 33.22 H new ATOM 0 HE1 PHE A 935 10.553 -28.940 2.062 1.00 25.55 H new ATOM 0 HE2 PHE A 935 13.638 -31.819 1.843 1.00 24.44 H new ATOM 0 HZ PHE A 935 11.632 -30.798 0.904 1.00 14.22 H new ATOM 684 N LYS A 936 13.318 -31.451 7.630 1.00 33.23 N ATOM 685 CA LYS A 936 13.162 -32.888 7.777 1.00 22.52 C ATOM 686 C LYS A 936 11.826 -33.185 8.461 1.00 23.24 C ATOM 687 O LYS A 936 11.343 -34.316 8.423 1.00 11.34 O ATOM 688 CB LYS A 936 14.370 -33.487 8.501 1.00 41.10 C ATOM 689 CG LYS A 936 14.125 -33.559 10.010 1.00 41.34 C ATOM 690 CD LYS A 936 15.388 -34.005 10.749 1.00 33.54 C ATOM 691 CE LYS A 936 16.213 -32.800 11.203 1.00 11.31 C ATOM 692 NZ LYS A 936 17.173 -33.196 12.258 1.00 52.24 N ATOM 0 H LYS A 936 14.059 -31.042 8.199 1.00 33.23 H new ATOM 0 HA LYS A 936 13.134 -33.370 6.800 1.00 22.52 H new ATOM 0 HB2 LYS A 936 14.572 -34.486 8.114 1.00 41.10 H new ATOM 0 HB3 LYS A 936 15.255 -32.883 8.301 1.00 41.10 H new ATOM 0 HG2 LYS A 936 13.810 -32.583 10.378 1.00 41.34 H new ATOM 0 HG3 LYS A 936 13.313 -34.256 10.217 1.00 41.34 H new ATOM 0 HD2 LYS A 936 15.113 -34.609 11.614 1.00 33.54 H new ATOM 0 HD3 LYS A 936 15.990 -34.638 10.097 1.00 33.54 H new ATOM 0 HE2 LYS A 936 16.751 -32.379 10.353 1.00 11.31 H new ATOM 0 HE3 LYS A 936 15.551 -32.020 11.580 1.00 11.31 H new ATOM 0 HZ1 LYS A 936 17.725 -32.366 12.555 1.00 52.24 H new ATOM 0 HZ2 LYS A 936 16.654 -33.576 13.075 1.00 52.24 H new ATOM 0 HZ3 LYS A 936 17.816 -33.924 11.887 1.00 52.24 H new ATOM 705 N GLU A 937 11.267 -32.150 9.071 1.00 24.22 N ATOM 706 CA GLU A 937 9.997 -32.286 9.763 1.00 52.21 C ATOM 707 C GLU A 937 8.862 -31.724 8.904 1.00 42.11 C ATOM 708 O GLU A 937 7.703 -31.735 9.316 1.00 61.25 O ATOM 709 CB GLU A 937 10.041 -31.600 11.130 1.00 73.21 C ATOM 710 CG GLU A 937 11.450 -31.652 11.724 1.00 13.31 C ATOM 711 CD GLU A 937 11.761 -33.044 12.277 1.00 61.02 C ATOM 712 OE1 GLU A 937 11.056 -34.011 11.954 1.00 74.32 O ATOM 713 OE2 GLU A 937 12.778 -33.102 13.068 1.00 2.42 O ATOM 0 H GLU A 937 11.671 -31.214 9.100 1.00 24.22 H new ATOM 0 HA GLU A 937 9.809 -33.346 9.931 1.00 52.21 H new ATOM 0 HB2 GLU A 937 9.722 -30.562 11.031 1.00 73.21 H new ATOM 0 HB3 GLU A 937 9.339 -32.086 11.807 1.00 73.21 H new ATOM 0 HG2 GLU A 937 12.181 -31.389 10.959 1.00 13.31 H new ATOM 0 HG3 GLU A 937 11.541 -30.912 12.519 1.00 13.31 H new ATOM 721 N LEU A 938 9.236 -31.246 7.726 1.00 14.42 N ATOM 722 CA LEU A 938 8.264 -30.680 6.806 1.00 72.33 C ATOM 723 C LEU A 938 8.052 -31.646 5.638 1.00 42.22 C ATOM 724 O LEU A 938 6.996 -31.642 5.008 1.00 34.12 O ATOM 725 CB LEU A 938 8.689 -29.276 6.373 1.00 3.21 C ATOM 726 CG LEU A 938 9.317 -28.401 7.460 1.00 41.42 C ATOM 727 CD1 LEU A 938 9.987 -27.167 6.851 1.00 31.04 C ATOM 728 CD2 LEU A 938 8.286 -28.026 8.526 1.00 54.43 C ATOM 0 H LEU A 938 10.198 -31.239 7.388 1.00 14.42 H new ATOM 0 HA LEU A 938 7.300 -30.557 7.299 1.00 72.33 H new ATOM 0 HB2 LEU A 938 9.401 -29.370 5.553 1.00 3.21 H new ATOM 0 HB3 LEU A 938 7.815 -28.759 5.978 1.00 3.21 H new ATOM 0 HG LEU A 938 10.097 -28.979 7.956 1.00 41.42 H new ATOM 0 HD11 LEU A 938 10.425 -26.562 7.645 1.00 31.04 H new ATOM 0 HD12 LEU A 938 10.769 -27.481 6.160 1.00 31.04 H new ATOM 0 HD13 LEU A 938 9.244 -26.577 6.314 1.00 31.04 H new ATOM 0 HD21 LEU A 938 8.759 -27.404 9.286 1.00 54.43 H new ATOM 0 HD22 LEU A 938 7.468 -27.474 8.063 1.00 54.43 H new ATOM 0 HD23 LEU A 938 7.896 -28.932 8.989 1.00 54.43 H new ATOM 740 N TYR A 939 9.074 -32.450 5.384 1.00 43.21 N ATOM 741 CA TYR A 939 9.014 -33.419 4.303 1.00 54.22 C ATOM 742 C TYR A 939 9.048 -34.849 4.846 1.00 51.14 C ATOM 743 O TYR A 939 9.649 -35.107 5.887 1.00 11.14 O ATOM 744 CB TYR A 939 10.262 -33.179 3.451 1.00 32.12 C ATOM 745 CG TYR A 939 11.458 -34.050 3.841 1.00 12.24 C ATOM 746 CD1 TYR A 939 11.405 -35.417 3.658 1.00 2.35 C ATOM 747 CD2 TYR A 939 12.590 -33.468 4.376 1.00 35.32 C ATOM 748 CE1 TYR A 939 12.531 -36.236 4.026 1.00 72.23 C ATOM 749 CE2 TYR A 939 13.715 -34.288 4.743 1.00 2.35 C ATOM 750 CZ TYR A 939 13.630 -35.631 4.550 1.00 23.32 C ATOM 751 OH TYR A 939 14.693 -36.405 4.897 1.00 24.20 O ATOM 0 H TYR A 939 9.949 -32.450 5.909 1.00 43.21 H new ATOM 0 HA TYR A 939 8.091 -33.303 3.734 1.00 54.22 H new ATOM 0 HB2 TYR A 939 10.017 -33.364 2.405 1.00 32.12 H new ATOM 0 HB3 TYR A 939 10.548 -32.130 3.531 1.00 32.12 H new ATOM 0 HD1 TYR A 939 10.520 -35.872 3.239 1.00 2.35 H new ATOM 0 HD2 TYR A 939 12.631 -32.398 4.519 1.00 35.32 H new ATOM 0 HE1 TYR A 939 12.503 -37.307 3.889 1.00 72.23 H new ATOM 0 HE2 TYR A 939 14.607 -33.846 5.162 1.00 2.35 H new ATOM 0 HH TYR A 939 15.407 -35.838 5.257 1.00 24.20 H new ATOM 761 N ILE A 940 8.396 -35.741 4.115 1.00 55.10 N ATOM 762 CA ILE A 940 8.344 -37.138 4.510 1.00 32.31 C ATOM 763 C ILE A 940 8.717 -38.016 3.314 1.00 74.22 C ATOM 764 O ILE A 940 8.273 -37.767 2.194 1.00 42.51 O ATOM 765 CB ILE A 940 6.980 -37.473 5.118 1.00 61.25 C ATOM 766 CG1 ILE A 940 6.369 -36.249 5.801 1.00 13.51 C ATOM 767 CG2 ILE A 940 7.082 -38.669 6.067 1.00 55.30 C ATOM 768 CD1 ILE A 940 4.969 -36.561 6.336 1.00 45.52 C ATOM 0 H ILE A 940 7.899 -35.523 3.251 1.00 55.10 H new ATOM 0 HA ILE A 940 9.074 -37.340 5.294 1.00 32.31 H new ATOM 0 HB ILE A 940 6.307 -37.760 4.310 1.00 61.25 H new ATOM 0 HG12 ILE A 940 7.012 -35.927 6.620 1.00 13.51 H new ATOM 0 HG13 ILE A 940 6.316 -35.422 5.093 1.00 13.51 H new ATOM 0 HG21 ILE A 940 6.099 -38.886 6.485 1.00 55.30 H new ATOM 0 HG22 ILE A 940 7.443 -39.539 5.519 1.00 55.30 H new ATOM 0 HG23 ILE A 940 7.776 -38.435 6.874 1.00 55.30 H new ATOM 0 HD11 ILE A 940 4.557 -35.674 6.817 1.00 45.52 H new ATOM 0 HD12 ILE A 940 4.322 -36.860 5.511 1.00 45.52 H new ATOM 0 HD13 ILE A 940 5.029 -37.372 7.062 1.00 45.52 H new ATOM 780 N VAL A 941 9.528 -39.026 3.592 1.00 73.33 N ATOM 781 CA VAL A 941 9.965 -39.943 2.552 1.00 1.43 C ATOM 782 C VAL A 941 9.111 -41.211 2.604 1.00 11.10 C ATOM 783 O VAL A 941 8.870 -41.758 3.679 1.00 0.00 O ATOM 784 CB VAL A 941 11.462 -40.224 2.698 1.00 0.34 C ATOM 785 CG1 VAL A 941 11.808 -41.627 2.196 1.00 11.14 C ATOM 786 CG2 VAL A 941 12.292 -39.162 1.974 1.00 4.04 C ATOM 0 H VAL A 941 9.894 -39.230 4.522 1.00 73.33 H new ATOM 0 HA VAL A 941 9.826 -39.498 1.567 1.00 1.43 H new ATOM 0 HB VAL A 941 11.710 -40.177 3.758 1.00 0.34 H new ATOM 0 HG11 VAL A 941 12.878 -41.801 2.311 1.00 11.14 H new ATOM 0 HG12 VAL A 941 11.256 -42.367 2.775 1.00 11.14 H new ATOM 0 HG13 VAL A 941 11.537 -41.714 1.144 1.00 11.14 H new ATOM 0 HG21 VAL A 941 13.352 -39.385 2.093 1.00 4.04 H new ATOM 0 HG22 VAL A 941 12.038 -39.162 0.914 1.00 4.04 H new ATOM 0 HG23 VAL A 941 12.078 -38.181 2.398 1.00 4.04 H new ATOM 796 N ARG A 942 8.676 -41.642 1.429 1.00 43.42 N ATOM 797 CA ARG A 942 7.854 -42.835 1.327 1.00 61.34 C ATOM 798 C ARG A 942 8.600 -43.929 0.560 1.00 32.51 C ATOM 799 O ARG A 942 9.151 -43.677 -0.510 1.00 73.13 O ATOM 800 CB ARG A 942 6.533 -42.535 0.616 1.00 12.33 C ATOM 801 CG ARG A 942 5.390 -42.391 1.623 1.00 55.31 C ATOM 802 CD ARG A 942 5.413 -41.012 2.285 1.00 14.34 C ATOM 803 NE ARG A 942 4.896 -41.106 3.669 1.00 24.31 N ATOM 804 CZ ARG A 942 4.363 -40.070 4.350 1.00 21.05 C ATOM 805 NH1 ARG A 942 4.271 -38.850 3.780 1.00 4.24 N ATOM 806 NH2 ARG A 942 3.933 -40.268 5.583 1.00 52.24 N ATOM 0 H ARG A 942 8.878 -41.186 0.539 1.00 43.42 H new ATOM 0 HA ARG A 942 7.639 -43.177 2.339 1.00 61.34 H new ATOM 0 HB2 ARG A 942 6.629 -41.618 0.035 1.00 12.33 H new ATOM 0 HB3 ARG A 942 6.304 -43.336 -0.087 1.00 12.33 H new ATOM 0 HG2 ARG A 942 4.435 -42.540 1.119 1.00 55.31 H new ATOM 0 HG3 ARG A 942 5.472 -43.166 2.385 1.00 55.31 H new ATOM 0 HD2 ARG A 942 6.430 -40.621 2.294 1.00 14.34 H new ATOM 0 HD3 ARG A 942 4.807 -40.313 1.709 1.00 14.34 H new ATOM 0 HE ARG A 942 4.946 -42.011 4.137 1.00 24.31 H new ATOM 0 HH11 ARG A 942 4.606 -38.706 2.827 1.00 4.24 H new ATOM 0 HH12 ARG A 942 3.867 -38.072 4.302 1.00 4.24 H new ATOM 0 HH21 ARG A 942 4.007 -41.193 6.006 1.00 52.24 H new ATOM 0 HH22 ARG A 942 3.527 -39.496 6.112 1.00 52.24 H new ATOM 819 N GLU A 943 8.593 -45.122 1.138 1.00 4.31 N ATOM 820 CA GLU A 943 9.262 -46.255 0.523 1.00 65.33 C ATOM 821 C GLU A 943 8.774 -46.443 -0.915 1.00 63.31 C ATOM 822 O GLU A 943 7.665 -46.925 -1.140 1.00 22.42 O ATOM 823 CB GLU A 943 9.051 -47.529 1.344 1.00 4.42 C ATOM 824 CG GLU A 943 9.926 -48.670 0.821 1.00 11.11 C ATOM 825 CD GLU A 943 9.673 -49.958 1.607 1.00 62.45 C ATOM 826 OE1 GLU A 943 8.671 -50.646 1.363 1.00 35.23 O ATOM 827 OE2 GLU A 943 10.564 -50.238 2.497 1.00 50.22 O ATOM 0 H GLU A 943 8.134 -45.328 2.026 1.00 4.31 H new ATOM 0 HA GLU A 943 10.332 -46.050 0.499 1.00 65.33 H new ATOM 0 HB2 GLU A 943 9.287 -47.335 2.390 1.00 4.42 H new ATOM 0 HB3 GLU A 943 8.002 -47.822 1.303 1.00 4.42 H new ATOM 0 HG2 GLU A 943 9.718 -48.838 -0.236 1.00 11.11 H new ATOM 0 HG3 GLU A 943 10.977 -48.392 0.899 1.00 11.11 H new ATOM 835 N ASN A 944 9.627 -46.053 -1.851 1.00 55.34 N ATOM 836 CA ASN A 944 9.296 -46.172 -3.261 1.00 72.22 C ATOM 837 C ASN A 944 10.585 -46.311 -4.073 1.00 62.50 C ATOM 838 O ASN A 944 11.504 -45.507 -3.928 1.00 3.00 O ATOM 839 CB ASN A 944 8.555 -44.930 -3.760 1.00 71.23 C ATOM 840 CG ASN A 944 8.479 -44.914 -5.288 1.00 42.13 C ATOM 841 OD1 ASN A 944 7.533 -45.390 -5.894 1.00 23.20 O ATOM 842 ND2 ASN A 944 9.526 -44.341 -5.876 1.00 13.33 N ATOM 0 H ASN A 944 10.546 -45.654 -1.661 1.00 55.34 H new ATOM 0 HA ASN A 944 8.657 -47.047 -3.384 1.00 72.22 H new ATOM 0 HB2 ASN A 944 7.549 -44.910 -3.342 1.00 71.23 H new ATOM 0 HB3 ASN A 944 9.064 -44.033 -3.408 1.00 71.23 H new ATOM 0 HD21 ASN A 944 9.570 -44.281 -6.893 1.00 13.33 H new ATOM 0 HD22 ASN A 944 10.285 -43.962 -5.309 1.00 13.33 H new ATOM 849 N LYS A 945 10.612 -47.338 -4.910 1.00 31.43 N ATOM 850 CA LYS A 945 11.773 -47.593 -5.745 1.00 24.53 C ATOM 851 C LYS A 945 11.541 -46.990 -7.132 1.00 25.25 C ATOM 852 O LYS A 945 12.448 -46.968 -7.962 1.00 62.34 O ATOM 853 CB LYS A 945 12.097 -49.089 -5.771 1.00 14.33 C ATOM 854 CG LYS A 945 11.017 -49.870 -6.522 1.00 73.10 C ATOM 855 CD LYS A 945 10.889 -51.293 -5.974 1.00 75.04 C ATOM 856 CE LYS A 945 12.127 -52.125 -6.313 1.00 43.52 C ATOM 857 NZ LYS A 945 12.173 -53.348 -5.482 1.00 25.12 N ATOM 0 H LYS A 945 9.848 -48.003 -5.028 1.00 31.43 H new ATOM 0 HA LYS A 945 12.655 -47.107 -5.329 1.00 24.53 H new ATOM 0 HB2 LYS A 945 13.064 -49.247 -6.249 1.00 14.33 H new ATOM 0 HB3 LYS A 945 12.180 -49.465 -4.751 1.00 14.33 H new ATOM 0 HG2 LYS A 945 10.061 -49.354 -6.432 1.00 73.10 H new ATOM 0 HG3 LYS A 945 11.261 -49.906 -7.584 1.00 73.10 H new ATOM 0 HD2 LYS A 945 10.754 -51.259 -4.893 1.00 75.04 H new ATOM 0 HD3 LYS A 945 10.001 -51.769 -6.391 1.00 75.04 H new ATOM 0 HE2 LYS A 945 12.112 -52.396 -7.369 1.00 43.52 H new ATOM 0 HE3 LYS A 945 13.027 -51.532 -6.148 1.00 43.52 H new ATOM 0 HZ1 LYS A 945 13.020 -53.901 -5.725 1.00 25.12 H new ATOM 0 HZ2 LYS A 945 12.209 -53.084 -4.477 1.00 25.12 H new ATOM 0 HZ3 LYS A 945 11.323 -53.920 -5.659 1.00 25.12 H new ATOM 870 N ALA A 946 10.322 -46.515 -7.339 1.00 21.42 N ATOM 871 CA ALA A 946 9.960 -45.913 -8.611 1.00 35.53 C ATOM 872 C ALA A 946 10.793 -44.649 -8.828 1.00 1.05 C ATOM 873 O ALA A 946 10.830 -44.107 -9.931 1.00 53.01 O ATOM 874 CB ALA A 946 8.456 -45.631 -8.632 1.00 31.41 C ATOM 0 H ALA A 946 9.572 -46.535 -6.648 1.00 21.42 H new ATOM 0 HA ALA A 946 10.176 -46.595 -9.434 1.00 35.53 H new ATOM 0 HB1 ALA A 946 8.184 -45.179 -9.586 1.00 31.41 H new ATOM 0 HB2 ALA A 946 7.909 -46.565 -8.503 1.00 31.41 H new ATOM 0 HB3 ALA A 946 8.203 -44.948 -7.822 1.00 31.41 H new ATOM 880 N LEU A 947 11.442 -44.216 -7.757 1.00 1.32 N ATOM 881 CA LEU A 947 12.273 -43.025 -7.816 1.00 71.02 C ATOM 882 C LEU A 947 13.742 -43.438 -7.918 1.00 25.54 C ATOM 883 O LEU A 947 14.345 -43.347 -8.986 1.00 55.43 O ATOM 884 CB LEU A 947 11.974 -42.103 -6.632 1.00 73.42 C ATOM 885 CG LEU A 947 10.894 -41.044 -6.863 1.00 21.01 C ATOM 886 CD1 LEU A 947 11.097 -40.337 -8.204 1.00 64.25 C ATOM 887 CD2 LEU A 947 9.495 -41.651 -6.741 1.00 61.43 C ATOM 0 H LEU A 947 11.409 -44.668 -6.843 1.00 1.32 H new ATOM 0 HA LEU A 947 12.042 -42.444 -8.709 1.00 71.02 H new ATOM 0 HB2 LEU A 947 11.675 -42.719 -5.784 1.00 73.42 H new ATOM 0 HB3 LEU A 947 12.897 -41.597 -6.349 1.00 73.42 H new ATOM 0 HG LEU A 947 10.986 -40.288 -6.083 1.00 21.01 H new ATOM 0 HD11 LEU A 947 10.316 -39.589 -8.343 1.00 64.25 H new ATOM 0 HD12 LEU A 947 12.072 -39.850 -8.214 1.00 64.25 H new ATOM 0 HD13 LEU A 947 11.048 -41.067 -9.012 1.00 64.25 H new ATOM 0 HD21 LEU A 947 8.746 -40.877 -6.910 1.00 61.43 H new ATOM 0 HD22 LEU A 947 9.375 -42.440 -7.483 1.00 61.43 H new ATOM 0 HD23 LEU A 947 9.366 -42.069 -5.743 1.00 61.43 H new ATOM 899 N GLN A 948 14.278 -43.885 -6.791 1.00 14.02 N ATOM 900 CA GLN A 948 15.665 -44.313 -6.739 1.00 43.24 C ATOM 901 C GLN A 948 15.947 -45.333 -7.844 1.00 25.20 C ATOM 902 O GLN A 948 15.064 -46.098 -8.228 1.00 52.20 O ATOM 903 CB GLN A 948 16.012 -44.884 -5.363 1.00 62.43 C ATOM 904 CG GLN A 948 15.548 -46.337 -5.240 1.00 13.00 C ATOM 905 CD GLN A 948 16.432 -47.268 -6.073 1.00 15.22 C ATOM 906 OE1 GLN A 948 15.961 -48.084 -6.848 1.00 32.24 O ATOM 907 NE2 GLN A 948 17.735 -47.100 -5.871 1.00 3.13 N ATOM 0 H GLN A 948 13.776 -43.960 -5.906 1.00 14.02 H new ATOM 0 HA GLN A 948 16.300 -43.443 -6.904 1.00 43.24 H new ATOM 0 HB2 GLN A 948 17.089 -44.827 -5.203 1.00 62.43 H new ATOM 0 HB3 GLN A 948 15.542 -44.281 -4.586 1.00 62.43 H new ATOM 0 HG2 GLN A 948 15.575 -46.644 -4.194 1.00 13.00 H new ATOM 0 HG3 GLN A 948 14.513 -46.421 -5.570 1.00 13.00 H new ATOM 0 HE21 GLN A 948 18.062 -46.398 -5.207 1.00 3.13 H new ATOM 0 HE22 GLN A 948 18.408 -47.673 -6.380 1.00 3.13 H new ATOM 1013 N GLN A 955 22.966 -41.554 -4.884 1.00 44.23 N ATOM 1014 CA GLN A 955 22.158 -42.618 -4.314 1.00 70.23 C ATOM 1015 C GLN A 955 20.869 -42.046 -3.721 1.00 30.11 C ATOM 1016 O GLN A 955 20.913 -41.146 -2.883 1.00 71.53 O ATOM 1017 CB GLN A 955 22.946 -43.401 -3.262 1.00 75.30 C ATOM 1018 CG GLN A 955 22.205 -44.678 -2.860 1.00 75.25 C ATOM 1019 CD GLN A 955 21.625 -45.385 -4.088 1.00 2.13 C ATOM 1020 OE1 GLN A 955 22.325 -46.025 -4.856 1.00 11.44 O ATOM 1021 NE2 GLN A 955 20.311 -45.234 -4.229 1.00 23.44 N ATOM 0 HA GLN A 955 21.891 -43.312 -5.111 1.00 70.23 H new ATOM 0 HB2 GLN A 955 23.930 -43.656 -3.655 1.00 75.30 H new ATOM 0 HB3 GLN A 955 23.106 -42.777 -2.383 1.00 75.30 H new ATOM 0 HG2 GLN A 955 22.887 -45.349 -2.338 1.00 75.25 H new ATOM 0 HG3 GLN A 955 21.403 -44.433 -2.164 1.00 75.25 H new ATOM 0 HE21 GLN A 955 19.785 -44.685 -3.549 1.00 23.44 H new ATOM 0 HE22 GLN A 955 19.829 -45.667 -5.017 1.00 23.44 H new ATOM 1030 N ILE A 956 19.752 -42.592 -4.178 1.00 54.45 N ATOM 1031 CA ILE A 956 18.452 -42.147 -3.703 1.00 45.34 C ATOM 1032 C ILE A 956 17.899 -43.171 -2.711 1.00 22.03 C ATOM 1033 O ILE A 956 18.249 -44.349 -2.768 1.00 44.34 O ATOM 1034 CB ILE A 956 17.518 -41.866 -4.882 1.00 43.11 C ATOM 1035 CG1 ILE A 956 18.309 -41.419 -6.114 1.00 14.34 C ATOM 1036 CG2 ILE A 956 16.438 -40.854 -4.496 1.00 75.01 C ATOM 1037 CD1 ILE A 956 18.645 -39.928 -6.038 1.00 22.14 C ATOM 0 H ILE A 956 19.720 -43.339 -4.872 1.00 54.45 H new ATOM 0 HA ILE A 956 18.545 -41.202 -3.168 1.00 45.34 H new ATOM 0 HB ILE A 956 17.010 -42.794 -5.145 1.00 43.11 H new ATOM 0 HG12 ILE A 956 19.229 -41.999 -6.191 1.00 14.34 H new ATOM 0 HG13 ILE A 956 17.730 -41.619 -7.015 1.00 14.34 H new ATOM 0 HG21 ILE A 956 15.788 -40.672 -5.352 1.00 75.01 H new ATOM 0 HG22 ILE A 956 15.848 -41.249 -3.669 1.00 75.01 H new ATOM 0 HG23 ILE A 956 16.908 -39.919 -4.192 1.00 75.01 H new ATOM 0 HD11 ILE A 956 19.207 -39.636 -6.925 1.00 22.14 H new ATOM 0 HD12 ILE A 956 17.723 -39.349 -5.986 1.00 22.14 H new ATOM 0 HD13 ILE A 956 19.245 -39.735 -5.149 1.00 22.14 H new ATOM 1049 N ASN A 957 17.044 -42.685 -1.823 1.00 20.10 N ATOM 1050 CA ASN A 957 16.439 -43.544 -0.819 1.00 12.30 C ATOM 1051 C ASN A 957 14.934 -43.643 -1.079 1.00 64.32 C ATOM 1052 O ASN A 957 14.266 -44.527 -0.546 1.00 32.23 O ATOM 1053 CB ASN A 957 16.639 -42.973 0.586 1.00 32.34 C ATOM 1054 CG ASN A 957 17.909 -43.533 1.230 1.00 60.12 C ATOM 1055 OD1 ASN A 957 17.906 -44.024 2.347 1.00 74.54 O ATOM 1056 ND2 ASN A 957 18.993 -43.432 0.465 1.00 15.33 N ATOM 0 H ASN A 957 16.756 -41.708 -1.778 1.00 20.10 H new ATOM 0 HA ASN A 957 16.914 -44.523 -0.882 1.00 12.30 H new ATOM 0 HB2 ASN A 957 16.702 -41.886 0.535 1.00 32.34 H new ATOM 0 HB3 ASN A 957 15.776 -43.214 1.207 1.00 32.34 H new ATOM 0 HD21 ASN A 957 19.891 -43.777 0.805 1.00 15.33 H new ATOM 0 HD22 ASN A 957 18.926 -43.010 -0.461 1.00 15.33 H new ATOM 1063 N GLY A 958 14.446 -42.724 -1.899 1.00 71.41 N ATOM 1064 CA GLY A 958 13.033 -42.698 -2.237 1.00 11.44 C ATOM 1065 C GLY A 958 12.621 -41.322 -2.765 1.00 43.02 C ATOM 1066 O GLY A 958 13.370 -40.689 -3.508 1.00 1.01 O ATOM 0 H GLY A 958 15.004 -41.992 -2.339 1.00 71.41 H new ATOM 0 HA2 GLY A 958 12.821 -43.458 -2.989 1.00 11.44 H new ATOM 0 HA3 GLY A 958 12.440 -42.946 -1.357 1.00 11.44 H new ATOM 1070 N GLU A 959 11.432 -40.900 -2.361 1.00 41.15 N ATOM 1071 CA GLU A 959 10.912 -39.611 -2.785 1.00 40.11 C ATOM 1072 C GLU A 959 10.437 -38.806 -1.574 1.00 35.22 C ATOM 1073 O GLU A 959 9.950 -39.376 -0.598 1.00 51.41 O ATOM 1074 CB GLU A 959 9.785 -39.783 -3.806 1.00 2.13 C ATOM 1075 CG GLU A 959 9.683 -38.561 -4.721 1.00 12.14 C ATOM 1076 CD GLU A 959 8.451 -38.654 -5.623 1.00 50.44 C ATOM 1077 OE1 GLU A 959 8.517 -38.276 -6.803 1.00 12.04 O ATOM 1078 OE2 GLU A 959 7.397 -39.140 -5.060 1.00 3.12 O ATOM 0 H GLU A 959 10.814 -41.428 -1.745 1.00 41.15 H new ATOM 0 HA GLU A 959 11.716 -39.059 -3.271 1.00 40.11 H new ATOM 0 HB2 GLU A 959 9.965 -40.676 -4.405 1.00 2.13 H new ATOM 0 HB3 GLU A 959 8.839 -39.933 -3.287 1.00 2.13 H new ATOM 0 HG2 GLU A 959 9.630 -37.654 -4.118 1.00 12.14 H new ATOM 0 HG3 GLU A 959 10.582 -38.484 -5.333 1.00 12.14 H new ATOM 1086 N ILE A 960 10.594 -37.495 -1.676 1.00 0.30 N ATOM 1087 CA ILE A 960 10.187 -36.606 -0.601 1.00 32.01 C ATOM 1088 C ILE A 960 8.859 -35.942 -0.969 1.00 75.13 C ATOM 1089 O ILE A 960 8.689 -35.466 -2.090 1.00 54.54 O ATOM 1090 CB ILE A 960 11.303 -35.611 -0.277 1.00 12.32 C ATOM 1091 CG1 ILE A 960 11.894 -35.014 -1.556 1.00 33.02 C ATOM 1092 CG2 ILE A 960 12.375 -36.257 0.603 1.00 10.41 C ATOM 1093 CD1 ILE A 960 12.780 -33.808 -1.239 1.00 41.33 C ATOM 0 H ILE A 960 10.998 -37.026 -2.487 1.00 0.30 H new ATOM 0 HA ILE A 960 10.018 -37.170 0.316 1.00 32.01 H new ATOM 0 HB ILE A 960 10.872 -34.788 0.293 1.00 12.32 H new ATOM 0 HG12 ILE A 960 12.478 -35.771 -2.079 1.00 33.02 H new ATOM 0 HG13 ILE A 960 11.089 -34.712 -2.227 1.00 33.02 H new ATOM 0 HG21 ILE A 960 13.156 -35.528 0.819 1.00 10.41 H new ATOM 0 HG22 ILE A 960 11.925 -36.593 1.537 1.00 10.41 H new ATOM 0 HG23 ILE A 960 12.808 -37.110 0.081 1.00 10.41 H new ATOM 0 HD11 ILE A 960 13.188 -33.402 -2.165 1.00 41.33 H new ATOM 0 HD12 ILE A 960 12.187 -33.043 -0.738 1.00 41.33 H new ATOM 0 HD13 ILE A 960 13.597 -34.118 -0.588 1.00 41.33 H new ATOM 1105 N ILE A 961 7.951 -35.932 -0.004 1.00 71.32 N ATOM 1106 CA ILE A 961 6.643 -35.335 -0.213 1.00 11.31 C ATOM 1107 C ILE A 961 6.247 -34.537 1.031 1.00 31.23 C ATOM 1108 O ILE A 961 6.585 -34.918 2.151 1.00 73.51 O ATOM 1109 CB ILE A 961 5.622 -36.404 -0.609 1.00 5.22 C ATOM 1110 CG1 ILE A 961 5.590 -37.538 0.418 1.00 42.21 C ATOM 1111 CG2 ILE A 961 5.890 -36.919 -2.024 1.00 72.53 C ATOM 1112 CD1 ILE A 961 4.525 -38.575 0.056 1.00 65.13 C ATOM 0 H ILE A 961 8.096 -36.328 0.925 1.00 71.32 H new ATOM 0 HA ILE A 961 6.674 -34.633 -1.046 1.00 11.31 H new ATOM 0 HB ILE A 961 4.632 -35.947 -0.615 1.00 5.22 H new ATOM 0 HG12 ILE A 961 6.568 -38.017 0.467 1.00 42.21 H new ATOM 0 HG13 ILE A 961 5.385 -37.131 1.408 1.00 42.21 H new ATOM 0 HG21 ILE A 961 5.151 -37.678 -2.281 1.00 72.53 H new ATOM 0 HG22 ILE A 961 5.823 -36.092 -2.731 1.00 72.53 H new ATOM 0 HG23 ILE A 961 6.888 -37.355 -2.070 1.00 72.53 H new ATOM 0 HD11 ILE A 961 4.523 -39.370 0.802 1.00 65.13 H new ATOM 0 HD12 ILE A 961 3.545 -38.097 0.032 1.00 65.13 H new ATOM 0 HD13 ILE A 961 4.747 -38.997 -0.924 1.00 65.13 H new ATOM 1124 N CYS A 962 5.536 -33.445 0.793 1.00 2.33 N ATOM 1125 CA CYS A 962 5.091 -32.590 1.881 1.00 74.13 C ATOM 1126 C CYS A 962 4.119 -33.389 2.752 1.00 5.13 C ATOM 1127 O CYS A 962 3.926 -34.584 2.537 1.00 22.41 O ATOM 1128 CB CYS A 962 4.460 -31.297 1.361 1.00 13.54 C ATOM 1129 SG CYS A 962 2.658 -31.391 1.053 1.00 24.11 S ATOM 0 H CYS A 962 5.257 -33.132 -0.137 1.00 2.33 H new ATOM 0 HA CYS A 962 5.948 -32.284 2.481 1.00 74.13 H new ATOM 0 HB2 CYS A 962 4.650 -30.501 2.081 1.00 13.54 H new ATOM 0 HB3 CYS A 962 4.958 -31.013 0.434 1.00 13.54 H new ATOM 0 HG CYS A 962 2.195 -30.199 0.821 1.00 24.11 H new ATOM 1134 N LYS A 963 3.534 -32.696 3.718 1.00 1.00 N ATOM 1135 CA LYS A 963 2.588 -33.326 4.623 1.00 12.21 C ATOM 1136 C LYS A 963 1.398 -33.857 3.821 1.00 12.43 C ATOM 1137 O LYS A 963 1.025 -35.021 3.954 1.00 31.24 O ATOM 1138 CB LYS A 963 2.193 -32.360 5.743 1.00 65.53 C ATOM 1139 CG LYS A 963 3.429 -31.695 6.353 1.00 14.11 C ATOM 1140 CD LYS A 963 4.530 -32.723 6.619 1.00 2.22 C ATOM 1141 CE LYS A 963 5.339 -32.350 7.863 1.00 44.41 C ATOM 1142 NZ LYS A 963 4.677 -32.859 9.084 1.00 13.34 N ATOM 0 H LYS A 963 3.697 -31.705 3.894 1.00 1.00 H new ATOM 0 HA LYS A 963 3.047 -34.182 5.118 1.00 12.21 H new ATOM 0 HB2 LYS A 963 1.521 -31.597 5.350 1.00 65.53 H new ATOM 0 HB3 LYS A 963 1.646 -32.898 6.517 1.00 65.53 H new ATOM 0 HG2 LYS A 963 3.802 -30.924 5.679 1.00 14.11 H new ATOM 0 HG3 LYS A 963 3.157 -31.199 7.285 1.00 14.11 H new ATOM 0 HD2 LYS A 963 4.087 -33.710 6.751 1.00 2.22 H new ATOM 0 HD3 LYS A 963 5.192 -32.784 5.755 1.00 2.22 H new ATOM 0 HE2 LYS A 963 6.344 -32.764 7.788 1.00 44.41 H new ATOM 0 HE3 LYS A 963 5.444 -31.267 7.924 1.00 44.41 H new ATOM 0 HZ1 LYS A 963 5.239 -32.597 9.919 1.00 13.34 H new ATOM 0 HZ2 LYS A 963 3.727 -32.444 9.162 1.00 13.34 H new ATOM 0 HZ3 LYS A 963 4.599 -33.895 9.030 1.00 13.34 H new ATOM 1155 N CYS A 964 0.835 -32.977 3.006 1.00 15.24 N ATOM 1156 CA CYS A 964 -0.306 -33.342 2.183 1.00 24.30 C ATOM 1157 C CYS A 964 0.083 -34.555 1.335 1.00 2.11 C ATOM 1158 O CYS A 964 -0.746 -35.424 1.071 1.00 13.02 O ATOM 1159 CB CYS A 964 -0.779 -32.171 1.320 1.00 10.33 C ATOM 1160 SG CYS A 964 -0.933 -30.577 2.207 1.00 24.53 S ATOM 0 H CYS A 964 1.148 -32.012 2.898 1.00 15.24 H new ATOM 0 HA CYS A 964 -1.150 -33.601 2.822 1.00 24.30 H new ATOM 0 HB2 CYS A 964 -0.082 -32.044 0.491 1.00 10.33 H new ATOM 0 HB3 CYS A 964 -1.747 -32.425 0.887 1.00 10.33 H new ATOM 1165 N GLY A 965 1.345 -34.575 0.932 1.00 41.22 N ATOM 1166 CA GLY A 965 1.854 -35.667 0.119 1.00 11.41 C ATOM 1167 C GLY A 965 2.203 -35.185 -1.291 1.00 14.54 C ATOM 1168 O GLY A 965 1.954 -35.886 -2.270 1.00 24.53 O ATOM 0 H GLY A 965 2.030 -33.853 1.153 1.00 41.22 H new ATOM 0 HA2 GLY A 965 2.739 -36.094 0.591 1.00 11.41 H new ATOM 0 HA3 GLY A 965 1.109 -36.460 0.062 1.00 11.41 H new ATOM 1172 N GLN A 966 2.773 -33.990 -1.349 1.00 13.12 N ATOM 1173 CA GLN A 966 3.158 -33.406 -2.622 1.00 40.23 C ATOM 1174 C GLN A 966 4.647 -33.640 -2.885 1.00 1.13 C ATOM 1175 O GLN A 966 5.494 -33.201 -2.109 1.00 3.33 O ATOM 1176 CB GLN A 966 2.822 -31.914 -2.665 1.00 54.04 C ATOM 1177 CG GLN A 966 3.470 -31.240 -3.877 1.00 20.44 C ATOM 1178 CD GLN A 966 2.875 -31.771 -5.183 1.00 24.14 C ATOM 1179 OE1 GLN A 966 1.972 -32.591 -5.196 1.00 13.34 O ATOM 1180 NE2 GLN A 966 3.431 -31.260 -6.277 1.00 42.53 N ATOM 0 H GLN A 966 2.977 -33.411 -0.535 1.00 13.12 H new ATOM 0 HA GLN A 966 2.588 -33.896 -3.411 1.00 40.23 H new ATOM 0 HB2 GLN A 966 1.741 -31.782 -2.706 1.00 54.04 H new ATOM 0 HB3 GLN A 966 3.167 -31.433 -1.750 1.00 54.04 H new ATOM 0 HG2 GLN A 966 3.324 -30.161 -3.819 1.00 20.44 H new ATOM 0 HG3 GLN A 966 4.545 -31.417 -3.865 1.00 20.44 H new ATOM 0 HE21 GLN A 966 4.184 -30.577 -6.195 1.00 42.53 H new ATOM 0 HE22 GLN A 966 3.105 -31.551 -7.199 1.00 42.53 H new ATOM 1189 N ALA A 967 4.921 -34.331 -3.981 1.00 75.33 N ATOM 1190 CA ALA A 967 6.293 -34.629 -4.356 1.00 14.12 C ATOM 1191 C ALA A 967 7.109 -33.335 -4.355 1.00 40.10 C ATOM 1192 O ALA A 967 7.109 -32.596 -5.339 1.00 21.25 O ATOM 1193 CB ALA A 967 6.310 -35.329 -5.716 1.00 43.32 C ATOM 0 H ALA A 967 4.216 -34.694 -4.622 1.00 75.33 H new ATOM 0 HA ALA A 967 6.750 -35.307 -3.635 1.00 14.12 H new ATOM 0 HB1 ALA A 967 7.339 -35.553 -5.997 1.00 43.32 H new ATOM 0 HB2 ALA A 967 5.741 -36.257 -5.655 1.00 43.32 H new ATOM 0 HB3 ALA A 967 5.862 -34.677 -6.466 1.00 43.32 H new ATOM 1199 N TRP A 968 7.785 -33.100 -3.240 1.00 61.21 N ATOM 1200 CA TRP A 968 8.604 -31.908 -3.098 1.00 60.23 C ATOM 1201 C TRP A 968 9.833 -32.070 -3.995 1.00 4.24 C ATOM 1202 O TRP A 968 10.370 -31.086 -4.501 1.00 44.12 O ATOM 1203 CB TRP A 968 8.962 -31.660 -1.632 1.00 30.23 C ATOM 1204 CG TRP A 968 7.964 -30.769 -0.890 1.00 1.23 C ATOM 1205 CD1 TRP A 968 6.932 -30.084 -1.400 1.00 14.21 C ATOM 1206 CD2 TRP A 968 7.946 -30.492 0.527 1.00 61.13 C ATOM 1207 NE1 TRP A 968 6.252 -29.389 -0.420 1.00 42.42 N ATOM 1208 CE2 TRP A 968 6.889 -29.645 0.789 1.00 73.04 C ATOM 1209 CE3 TRP A 968 8.795 -30.943 1.553 1.00 42.14 C ATOM 1210 CZ2 TRP A 968 6.582 -29.175 2.071 1.00 23.33 C ATOM 1211 CZ3 TRP A 968 8.476 -30.464 2.829 1.00 74.41 C ATOM 1212 CH2 TRP A 968 7.415 -29.611 3.109 1.00 33.11 C ATOM 0 H TRP A 968 7.782 -33.715 -2.426 1.00 61.21 H new ATOM 0 HA TRP A 968 8.055 -31.022 -3.417 1.00 60.23 H new ATOM 0 HB2 TRP A 968 9.030 -32.619 -1.118 1.00 30.23 H new ATOM 0 HB3 TRP A 968 9.950 -31.201 -1.582 1.00 30.23 H new ATOM 0 HD1 TRP A 968 6.665 -30.076 -2.447 1.00 14.21 H new ATOM 0 HE1 TRP A 968 5.433 -28.797 -0.558 1.00 42.42 H new ATOM 0 HE3 TRP A 968 9.627 -31.607 1.371 1.00 42.14 H new ATOM 0 HZ2 TRP A 968 5.748 -28.512 2.250 1.00 23.33 H new ATOM 0 HZ3 TRP A 968 9.098 -30.779 3.654 1.00 74.41 H new ATOM 0 HH2 TRP A 968 7.234 -29.286 4.123 1.00 33.11 H new ATOM 1223 N GLY A 969 10.243 -33.318 -4.163 1.00 63.41 N ATOM 1224 CA GLY A 969 11.399 -33.622 -4.990 1.00 3.45 C ATOM 1225 C GLY A 969 11.866 -35.062 -4.772 1.00 61.31 C ATOM 1226 O GLY A 969 11.098 -36.003 -4.965 1.00 71.41 O ATOM 0 H GLY A 969 9.795 -34.131 -3.740 1.00 63.41 H new ATOM 0 HA2 GLY A 969 11.149 -33.472 -6.040 1.00 3.45 H new ATOM 0 HA3 GLY A 969 12.210 -32.933 -4.754 1.00 3.45 H new ATOM 1230 N THR A 970 13.123 -35.189 -4.373 1.00 62.53 N ATOM 1231 CA THR A 970 13.701 -36.500 -4.128 1.00 5.35 C ATOM 1232 C THR A 970 14.779 -36.412 -3.045 1.00 34.55 C ATOM 1233 O THR A 970 15.388 -35.361 -2.854 1.00 24.44 O ATOM 1234 CB THR A 970 14.221 -37.044 -5.459 1.00 65.33 C ATOM 1235 OG1 THR A 970 14.594 -35.879 -6.189 1.00 51.44 O ATOM 1236 CG2 THR A 970 13.115 -37.676 -6.306 1.00 34.32 C ATOM 0 H THR A 970 13.757 -34.406 -4.213 1.00 62.53 H new ATOM 0 HA THR A 970 12.955 -37.196 -3.746 1.00 5.35 H new ATOM 0 HB THR A 970 14.999 -37.783 -5.269 1.00 65.33 H new ATOM 0 HG1 THR A 970 14.944 -36.141 -7.066 1.00 51.44 H new ATOM 0 HG21 THR A 970 13.538 -38.046 -7.240 1.00 34.32 H new ATOM 0 HG22 THR A 970 12.665 -38.504 -5.758 1.00 34.32 H new ATOM 0 HG23 THR A 970 12.352 -36.929 -6.524 1.00 34.32 H new ATOM 1244 N MET A 971 14.980 -37.531 -2.364 1.00 30.22 N ATOM 1245 CA MET A 971 15.973 -37.594 -1.305 1.00 30.51 C ATOM 1246 C MET A 971 17.286 -38.189 -1.819 1.00 51.52 C ATOM 1247 O MET A 971 17.477 -39.403 -1.786 1.00 73.23 O ATOM 1248 CB MET A 971 15.440 -38.452 -0.156 1.00 31.24 C ATOM 1249 CG MET A 971 16.545 -38.759 0.858 1.00 54.13 C ATOM 1250 SD MET A 971 17.396 -37.256 1.307 1.00 52.44 S ATOM 1251 CE MET A 971 16.005 -36.243 1.783 1.00 4.32 C ATOM 0 H MET A 971 14.472 -38.401 -2.525 1.00 30.22 H new ATOM 0 HA MET A 971 16.167 -36.580 -0.954 1.00 30.51 H new ATOM 0 HB2 MET A 971 14.620 -37.933 0.340 1.00 31.24 H new ATOM 0 HB3 MET A 971 15.035 -39.384 -0.551 1.00 31.24 H new ATOM 0 HG2 MET A 971 16.116 -39.223 1.746 1.00 54.13 H new ATOM 0 HG3 MET A 971 17.251 -39.473 0.434 1.00 54.13 H new ATOM 0 HE1 MET A 971 16.353 -35.413 2.397 1.00 4.32 H new ATOM 0 HE2 MET A 971 15.516 -35.854 0.890 1.00 4.32 H new ATOM 0 HE3 MET A 971 15.296 -36.843 2.353 1.00 4.32 H new ATOM 1261 N MET A 972 18.157 -37.304 -2.282 1.00 61.33 N ATOM 1262 CA MET A 972 19.447 -37.726 -2.803 1.00 15.02 C ATOM 1263 C MET A 972 20.453 -37.936 -1.670 1.00 2.42 C ATOM 1264 O MET A 972 20.311 -37.358 -0.593 1.00 75.32 O ATOM 1265 CB MET A 972 19.979 -36.666 -3.769 1.00 54.21 C ATOM 1266 CG MET A 972 19.521 -36.950 -5.201 1.00 61.22 C ATOM 1267 SD MET A 972 19.351 -35.419 -6.103 1.00 72.31 S ATOM 1268 CE MET A 972 21.040 -34.844 -6.058 1.00 52.43 C ATOM 0 H MET A 972 17.995 -36.297 -2.307 1.00 61.33 H new ATOM 0 HA MET A 972 19.315 -38.673 -3.326 1.00 15.02 H new ATOM 0 HB2 MET A 972 19.631 -35.680 -3.461 1.00 54.21 H new ATOM 0 HB3 MET A 972 21.068 -36.646 -3.729 1.00 54.21 H new ATOM 0 HG2 MET A 972 20.242 -37.598 -5.700 1.00 61.22 H new ATOM 0 HG3 MET A 972 18.570 -37.482 -5.189 1.00 61.22 H new ATOM 0 HE1 MET A 972 21.164 -34.023 -6.765 1.00 52.43 H new ATOM 0 HE2 MET A 972 21.279 -34.497 -5.053 1.00 52.43 H new ATOM 0 HE3 MET A 972 21.710 -35.660 -6.329 1.00 52.43 H new ATOM 1278 N VAL A 973 21.449 -38.763 -1.951 1.00 74.44 N ATOM 1279 CA VAL A 973 22.479 -39.057 -0.969 1.00 53.53 C ATOM 1280 C VAL A 973 23.852 -38.745 -1.568 1.00 53.33 C ATOM 1281 O VAL A 973 24.052 -38.881 -2.774 1.00 64.41 O ATOM 1282 CB VAL A 973 22.350 -40.504 -0.492 1.00 33.43 C ATOM 1283 CG1 VAL A 973 23.241 -40.762 0.724 1.00 5.04 C ATOM 1284 CG2 VAL A 973 20.892 -40.853 -0.186 1.00 74.04 C ATOM 0 H VAL A 973 21.565 -39.239 -2.846 1.00 74.44 H new ATOM 0 HA VAL A 973 22.358 -38.427 -0.088 1.00 53.53 H new ATOM 0 HB VAL A 973 22.688 -41.154 -1.299 1.00 33.43 H new ATOM 0 HG11 VAL A 973 23.130 -41.798 1.043 1.00 5.04 H new ATOM 0 HG12 VAL A 973 24.281 -40.573 0.459 1.00 5.04 H new ATOM 0 HG13 VAL A 973 22.947 -40.099 1.538 1.00 5.04 H new ATOM 0 HG21 VAL A 973 20.829 -41.888 0.151 1.00 74.04 H new ATOM 0 HG22 VAL A 973 20.516 -40.193 0.596 1.00 74.04 H new ATOM 0 HG23 VAL A 973 20.291 -40.727 -1.087 1.00 74.04 H new ATOM 1294 N HIS A 974 24.761 -38.331 -0.698 1.00 63.51 N ATOM 1295 CA HIS A 974 26.110 -37.999 -1.126 1.00 34.10 C ATOM 1296 C HIS A 974 27.119 -38.555 -0.119 1.00 41.43 C ATOM 1297 O HIS A 974 27.288 -38.001 0.966 1.00 44.53 O ATOM 1298 CB HIS A 974 26.255 -36.491 -1.341 1.00 61.41 C ATOM 1299 CG HIS A 974 27.686 -36.022 -1.448 1.00 43.42 C ATOM 1300 ND1 HIS A 974 28.621 -36.233 -0.450 1.00 44.00 N ATOM 1301 CD2 HIS A 974 28.332 -35.351 -2.445 1.00 11.41 C ATOM 1302 CE1 HIS A 974 29.774 -35.708 -0.839 1.00 10.23 C ATOM 1303 NE2 HIS A 974 29.592 -35.161 -2.075 1.00 64.00 N ATOM 0 H HIS A 974 24.590 -38.218 0.301 1.00 63.51 H new ATOM 0 HA HIS A 974 26.316 -38.466 -2.089 1.00 34.10 H new ATOM 0 HB2 HIS A 974 25.722 -36.211 -2.250 1.00 61.41 H new ATOM 0 HB3 HIS A 974 25.773 -35.968 -0.515 1.00 61.41 H new ATOM 0 HD1 HIS A 974 28.452 -36.711 0.435 1.00 44.00 H new ATOM 0 HD2 HIS A 974 27.892 -35.029 -3.377 1.00 11.41 H new ATOM 0 HE1 HIS A 974 30.696 -35.713 -0.276 1.00 10.23 H new ATOM 1311 N LYS A 975 27.763 -39.643 -0.515 1.00 43.40 N ATOM 1312 CA LYS A 975 28.752 -40.279 0.339 1.00 75.40 C ATOM 1313 C LYS A 975 28.076 -40.754 1.627 1.00 1.23 C ATOM 1314 O LYS A 975 28.741 -40.958 2.642 1.00 72.32 O ATOM 1315 CB LYS A 975 29.938 -39.343 0.576 1.00 62.05 C ATOM 1316 CG LYS A 975 30.448 -38.760 -0.744 1.00 12.51 C ATOM 1317 CD LYS A 975 31.521 -39.658 -1.362 1.00 40.44 C ATOM 1318 CE LYS A 975 31.457 -39.616 -2.890 1.00 42.44 C ATOM 1319 NZ LYS A 975 30.388 -40.510 -3.389 1.00 43.53 N ATOM 0 H LYS A 975 27.619 -40.100 -1.415 1.00 43.40 H new ATOM 0 HA LYS A 975 29.166 -41.161 -0.149 1.00 75.40 H new ATOM 0 HB2 LYS A 975 29.640 -38.535 1.244 1.00 62.05 H new ATOM 0 HB3 LYS A 975 30.742 -39.887 1.072 1.00 62.05 H new ATOM 0 HG2 LYS A 975 29.617 -38.647 -1.441 1.00 12.51 H new ATOM 0 HG3 LYS A 975 30.857 -37.764 -0.572 1.00 12.51 H new ATOM 0 HD2 LYS A 975 32.507 -39.336 -1.027 1.00 40.44 H new ATOM 0 HD3 LYS A 975 31.386 -40.683 -1.017 1.00 40.44 H new ATOM 0 HE2 LYS A 975 31.271 -38.595 -3.224 1.00 42.44 H new ATOM 0 HE3 LYS A 975 32.417 -39.918 -3.309 1.00 42.44 H new ATOM 0 HZ1 LYS A 975 30.358 -40.469 -4.428 1.00 43.53 H new ATOM 0 HZ2 LYS A 975 30.582 -41.486 -3.086 1.00 43.53 H new ATOM 0 HZ3 LYS A 975 29.472 -40.204 -3.004 1.00 43.53 H new ATOM 1332 N GLY A 976 26.764 -40.915 1.545 1.00 73.03 N ATOM 1333 CA GLY A 976 25.991 -41.362 2.691 1.00 11.54 C ATOM 1334 C GLY A 976 25.279 -40.186 3.364 1.00 24.05 C ATOM 1335 O GLY A 976 24.538 -40.374 4.328 1.00 52.23 O ATOM 0 H GLY A 976 26.216 -40.744 0.702 1.00 73.03 H new ATOM 0 HA2 GLY A 976 25.257 -42.102 2.373 1.00 11.54 H new ATOM 0 HA3 GLY A 976 26.648 -41.853 3.409 1.00 11.54 H new ATOM 1339 N LEU A 977 25.530 -39.000 2.831 1.00 42.34 N ATOM 1340 CA LEU A 977 24.923 -37.794 3.368 1.00 52.25 C ATOM 1341 C LEU A 977 23.484 -37.683 2.860 1.00 34.40 C ATOM 1342 O LEU A 977 23.090 -38.396 1.938 1.00 64.11 O ATOM 1343 CB LEU A 977 25.784 -36.571 3.045 1.00 0.03 C ATOM 1344 CG LEU A 977 25.668 -35.394 4.016 1.00 31.23 C ATOM 1345 CD1 LEU A 977 27.003 -34.659 4.149 1.00 22.42 C ATOM 1346 CD2 LEU A 977 24.534 -34.453 3.604 1.00 23.12 C ATOM 0 H LEU A 977 26.146 -38.848 2.032 1.00 42.34 H new ATOM 0 HA LEU A 977 24.875 -37.844 4.456 1.00 52.25 H new ATOM 0 HB2 LEU A 977 26.827 -36.885 3.009 1.00 0.03 H new ATOM 0 HB3 LEU A 977 25.522 -36.220 2.047 1.00 0.03 H new ATOM 0 HG LEU A 977 25.418 -35.788 5.001 1.00 31.23 H new ATOM 0 HD11 LEU A 977 26.893 -33.827 4.845 1.00 22.42 H new ATOM 0 HD12 LEU A 977 27.761 -35.347 4.523 1.00 22.42 H new ATOM 0 HD13 LEU A 977 27.308 -34.279 3.174 1.00 22.42 H new ATOM 0 HD21 LEU A 977 24.473 -33.625 4.311 1.00 23.12 H new ATOM 0 HD22 LEU A 977 24.729 -34.064 2.605 1.00 23.12 H new ATOM 0 HD23 LEU A 977 23.591 -34.999 3.603 1.00 23.12 H new ATOM 1358 N ASP A 978 22.737 -36.784 3.484 1.00 21.45 N ATOM 1359 CA ASP A 978 21.350 -36.572 3.108 1.00 40.53 C ATOM 1360 C ASP A 978 21.214 -35.207 2.429 1.00 1.24 C ATOM 1361 O ASP A 978 21.436 -34.173 3.057 1.00 11.33 O ATOM 1362 CB ASP A 978 20.438 -36.582 4.336 1.00 51.01 C ATOM 1363 CG ASP A 978 20.682 -35.447 5.332 1.00 11.23 C ATOM 1364 OD1 ASP A 978 21.806 -35.255 5.820 1.00 71.53 O ATOM 1365 OD2 ASP A 978 19.644 -34.732 5.609 1.00 44.33 O ATOM 0 H ASP A 978 23.067 -36.194 4.248 1.00 21.45 H new ATOM 0 HA ASP A 978 21.056 -37.377 2.435 1.00 40.53 H new ATOM 0 HB2 ASP A 978 19.402 -36.534 4.001 1.00 51.01 H new ATOM 0 HB3 ASP A 978 20.562 -37.533 4.854 1.00 51.01 H new ATOM 1371 N LEU A 979 20.850 -35.248 1.156 1.00 21.21 N ATOM 1372 CA LEU A 979 20.682 -34.028 0.386 1.00 51.32 C ATOM 1373 C LEU A 979 19.353 -34.086 -0.370 1.00 11.10 C ATOM 1374 O LEU A 979 19.274 -34.669 -1.450 1.00 51.11 O ATOM 1375 CB LEU A 979 21.894 -33.793 -0.518 1.00 72.53 C ATOM 1376 CG LEU A 979 23.235 -34.307 0.011 1.00 55.12 C ATOM 1377 CD1 LEU A 979 23.377 -35.812 -0.226 1.00 3.43 C ATOM 1378 CD2 LEU A 979 24.400 -33.519 -0.591 1.00 54.24 C ATOM 0 H LEU A 979 20.667 -36.108 0.638 1.00 21.21 H new ATOM 0 HA LEU A 979 20.635 -33.163 1.048 1.00 51.32 H new ATOM 0 HB2 LEU A 979 21.701 -34.265 -1.481 1.00 72.53 H new ATOM 0 HB3 LEU A 979 21.984 -32.722 -0.700 1.00 72.53 H new ATOM 0 HG LEU A 979 23.261 -34.147 1.089 1.00 55.12 H new ATOM 0 HD11 LEU A 979 24.338 -36.152 0.159 1.00 3.43 H new ATOM 0 HD12 LEU A 979 22.573 -36.339 0.289 1.00 3.43 H new ATOM 0 HD13 LEU A 979 23.321 -36.019 -1.295 1.00 3.43 H new ATOM 0 HD21 LEU A 979 25.341 -33.904 -0.199 1.00 54.24 H new ATOM 0 HD22 LEU A 979 24.389 -33.625 -1.676 1.00 54.24 H new ATOM 0 HD23 LEU A 979 24.301 -32.466 -0.328 1.00 54.24 H new ATOM 1390 N PRO A 980 18.315 -33.457 0.244 1.00 73.23 N ATOM 1391 CA PRO A 980 16.993 -33.432 -0.359 1.00 41.14 C ATOM 1392 C PRO A 980 16.943 -32.447 -1.529 1.00 71.24 C ATOM 1393 O PRO A 980 17.129 -31.246 -1.343 1.00 5.24 O ATOM 1394 CB PRO A 980 16.051 -33.057 0.773 1.00 31.50 C ATOM 1395 CG PRO A 980 16.923 -32.435 1.852 1.00 75.32 C ATOM 1396 CD PRO A 980 18.371 -32.756 1.523 1.00 23.53 C ATOM 0 HA PRO A 980 16.711 -34.391 -0.793 1.00 41.14 H new ATOM 0 HB2 PRO A 980 15.291 -32.354 0.432 1.00 31.50 H new ATOM 0 HB3 PRO A 980 15.527 -33.934 1.152 1.00 31.50 H new ATOM 0 HG2 PRO A 980 16.771 -31.356 1.891 1.00 75.32 H new ATOM 0 HG3 PRO A 980 16.658 -32.830 2.832 1.00 75.32 H new ATOM 0 HD2 PRO A 980 18.971 -31.849 1.451 1.00 23.53 H new ATOM 0 HD3 PRO A 980 18.824 -33.377 2.295 1.00 23.53 H new ATOM 1404 N CYS A 981 16.690 -32.993 -2.710 1.00 11.21 N ATOM 1405 CA CYS A 981 16.613 -32.177 -3.910 1.00 73.31 C ATOM 1406 C CYS A 981 15.139 -31.883 -4.197 1.00 70.42 C ATOM 1407 O CYS A 981 14.414 -32.748 -4.685 1.00 75.54 O ATOM 1408 CB CYS A 981 17.302 -32.852 -5.098 1.00 20.13 C ATOM 1409 SG CYS A 981 19.061 -32.353 -5.166 1.00 64.22 S ATOM 0 H CYS A 981 16.536 -33.990 -2.861 1.00 11.21 H new ATOM 0 HA CYS A 981 17.145 -31.239 -3.750 1.00 73.31 H new ATOM 0 HB2 CYS A 981 17.226 -33.935 -5.006 1.00 20.13 H new ATOM 0 HB3 CYS A 981 16.801 -32.575 -6.025 1.00 20.13 H new ATOM 0 HG CYS A 981 19.468 -32.364 -6.401 1.00 64.22 H new ATOM 1415 N LEU A 982 14.740 -30.660 -3.882 1.00 2.11 N ATOM 1416 CA LEU A 982 13.366 -30.241 -4.100 1.00 30.21 C ATOM 1417 C LEU A 982 13.203 -29.774 -5.548 1.00 23.41 C ATOM 1418 O LEU A 982 14.189 -29.605 -6.264 1.00 1.23 O ATOM 1419 CB LEU A 982 12.955 -29.191 -3.065 1.00 62.45 C ATOM 1420 CG LEU A 982 12.899 -29.668 -1.612 1.00 43.55 C ATOM 1421 CD1 LEU A 982 14.078 -30.588 -1.291 1.00 45.14 C ATOM 1422 CD2 LEU A 982 12.819 -28.481 -0.649 1.00 64.35 C ATOM 0 H LEU A 982 15.345 -29.945 -3.477 1.00 2.11 H new ATOM 0 HA LEU A 982 12.685 -31.080 -3.957 1.00 30.21 H new ATOM 0 HB2 LEU A 982 13.654 -28.356 -3.126 1.00 62.45 H new ATOM 0 HB3 LEU A 982 11.973 -28.805 -3.338 1.00 62.45 H new ATOM 0 HG LEU A 982 11.989 -30.253 -1.479 1.00 43.55 H new ATOM 0 HD11 LEU A 982 14.014 -30.913 -0.252 1.00 45.14 H new ATOM 0 HD12 LEU A 982 14.049 -31.459 -1.946 1.00 45.14 H new ATOM 0 HD13 LEU A 982 15.013 -30.049 -1.446 1.00 45.14 H new ATOM 0 HD21 LEU A 982 12.780 -28.847 0.377 1.00 64.35 H new ATOM 0 HD22 LEU A 982 13.698 -27.849 -0.776 1.00 64.35 H new ATOM 0 HD23 LEU A 982 11.921 -27.900 -0.861 1.00 64.35 H new ATOM 1434 N LYS A 983 11.952 -29.580 -5.936 1.00 55.11 N ATOM 1435 CA LYS A 983 11.647 -29.136 -7.286 1.00 10.02 C ATOM 1436 C LYS A 983 10.665 -27.965 -7.223 1.00 53.43 C ATOM 1437 O LYS A 983 9.572 -28.095 -6.673 1.00 41.34 O ATOM 1438 CB LYS A 983 11.153 -30.308 -8.137 1.00 3.24 C ATOM 1439 CG LYS A 983 11.979 -31.568 -7.866 1.00 54.44 C ATOM 1440 CD LYS A 983 11.444 -32.756 -8.668 1.00 51.23 C ATOM 1441 CE LYS A 983 12.574 -33.717 -9.043 1.00 74.21 C ATOM 1442 NZ LYS A 983 12.180 -34.553 -10.199 1.00 63.51 N ATOM 0 H LYS A 983 11.137 -29.722 -5.339 1.00 55.11 H new ATOM 0 HA LYS A 983 12.548 -28.771 -7.780 1.00 10.02 H new ATOM 0 HB2 LYS A 983 10.103 -30.503 -7.919 1.00 3.24 H new ATOM 0 HB3 LYS A 983 11.216 -30.047 -9.193 1.00 3.24 H new ATOM 0 HG2 LYS A 983 13.021 -31.387 -8.128 1.00 54.44 H new ATOM 0 HG3 LYS A 983 11.954 -31.802 -6.802 1.00 54.44 H new ATOM 0 HD2 LYS A 983 10.691 -33.285 -8.083 1.00 51.23 H new ATOM 0 HD3 LYS A 983 10.952 -32.397 -9.572 1.00 51.23 H new ATOM 0 HE2 LYS A 983 13.474 -33.152 -9.285 1.00 74.21 H new ATOM 0 HE3 LYS A 983 12.816 -34.353 -8.192 1.00 74.21 H new ATOM 0 HZ1 LYS A 983 12.958 -35.200 -10.441 1.00 63.51 H new ATOM 0 HZ2 LYS A 983 11.333 -35.106 -9.955 1.00 63.51 H new ATOM 0 HZ3 LYS A 983 11.972 -33.942 -11.014 1.00 63.51 H new ATOM 1455 N ILE A 984 11.089 -26.847 -7.794 1.00 70.05 N ATOM 1456 CA ILE A 984 10.260 -25.653 -7.811 1.00 24.54 C ATOM 1457 C ILE A 984 8.938 -25.966 -8.513 1.00 54.31 C ATOM 1458 O ILE A 984 7.946 -25.264 -8.319 1.00 5.43 O ATOM 1459 CB ILE A 984 11.023 -24.480 -8.429 1.00 21.01 C ATOM 1460 CG1 ILE A 984 11.783 -23.695 -7.358 1.00 2.11 C ATOM 1461 CG2 ILE A 984 10.086 -23.583 -9.240 1.00 34.21 C ATOM 1462 CD1 ILE A 984 12.403 -22.426 -7.945 1.00 43.54 C ATOM 0 H ILE A 984 11.996 -26.743 -8.249 1.00 70.05 H new ATOM 0 HA ILE A 984 10.016 -25.344 -6.795 1.00 24.54 H new ATOM 0 HB ILE A 984 11.764 -24.881 -9.121 1.00 21.01 H new ATOM 0 HG12 ILE A 984 11.105 -23.431 -6.546 1.00 2.11 H new ATOM 0 HG13 ILE A 984 12.565 -24.321 -6.929 1.00 2.11 H new ATOM 0 HG21 ILE A 984 10.654 -22.757 -9.668 1.00 34.21 H new ATOM 0 HG22 ILE A 984 9.630 -24.164 -10.041 1.00 34.21 H new ATOM 0 HG23 ILE A 984 9.306 -23.188 -8.589 1.00 34.21 H new ATOM 0 HD11 ILE A 984 12.937 -21.887 -7.163 1.00 43.54 H new ATOM 0 HD12 ILE A 984 13.098 -22.695 -8.740 1.00 43.54 H new ATOM 0 HD13 ILE A 984 11.616 -21.791 -8.351 1.00 43.54 H new ATOM 1474 N ARG A 985 8.965 -27.020 -9.315 1.00 52.24 N ATOM 1475 CA ARG A 985 7.780 -27.434 -10.048 1.00 1.41 C ATOM 1476 C ARG A 985 6.745 -28.029 -9.091 1.00 2.31 C ATOM 1477 O ARG A 985 5.623 -28.331 -9.494 1.00 41.32 O ATOM 1478 CB ARG A 985 8.129 -28.469 -11.119 1.00 54.22 C ATOM 1479 CG ARG A 985 9.104 -29.514 -10.575 1.00 23.13 C ATOM 1480 CD ARG A 985 8.869 -30.877 -11.229 1.00 43.02 C ATOM 1481 NE ARG A 985 9.454 -30.893 -12.589 1.00 23.24 N ATOM 1482 CZ ARG A 985 10.779 -30.958 -12.842 1.00 33.41 C ATOM 1483 NH1 ARG A 985 11.668 -31.014 -11.828 1.00 23.21 N ATOM 1484 NH2 ARG A 985 11.191 -30.967 -14.096 1.00 11.22 N ATOM 0 H ARG A 985 9.789 -27.600 -9.474 1.00 52.24 H new ATOM 0 HA ARG A 985 7.365 -26.551 -10.534 1.00 1.41 H new ATOM 0 HB2 ARG A 985 7.220 -28.960 -11.465 1.00 54.22 H new ATOM 0 HB3 ARG A 985 8.570 -27.970 -11.982 1.00 54.22 H new ATOM 0 HG2 ARG A 985 10.129 -29.191 -10.758 1.00 23.13 H new ATOM 0 HG3 ARG A 985 8.985 -29.600 -9.495 1.00 23.13 H new ATOM 0 HD2 ARG A 985 9.318 -31.663 -10.622 1.00 43.02 H new ATOM 0 HD3 ARG A 985 7.800 -31.085 -11.281 1.00 43.02 H new ATOM 0 HE ARG A 985 8.817 -30.852 -13.384 1.00 23.24 H new ATOM 0 HH11 ARG A 985 11.341 -31.007 -10.862 1.00 23.21 H new ATOM 0 HH12 ARG A 985 12.667 -31.063 -12.028 1.00 23.21 H new ATOM 0 HH21 ARG A 985 10.512 -30.925 -14.856 1.00 11.22 H new ATOM 0 HH22 ARG A 985 12.188 -31.016 -14.305 1.00 11.22 H new ATOM 1497 N ASN A 986 7.159 -28.179 -7.841 1.00 64.45 N ATOM 1498 CA ASN A 986 6.282 -28.733 -6.824 1.00 2.11 C ATOM 1499 C ASN A 986 6.175 -27.748 -5.658 1.00 42.21 C ATOM 1500 O ASN A 986 5.458 -28.000 -4.691 1.00 71.33 O ATOM 1501 CB ASN A 986 6.834 -30.052 -6.279 1.00 41.22 C ATOM 1502 CG ASN A 986 7.045 -31.065 -7.406 1.00 44.12 C ATOM 1503 OD1 ASN A 986 6.196 -31.272 -8.257 1.00 41.23 O ATOM 1504 ND2 ASN A 986 8.222 -31.683 -7.364 1.00 43.23 N ATOM 0 H ASN A 986 8.090 -27.926 -7.510 1.00 64.45 H new ATOM 0 HA ASN A 986 5.308 -28.911 -7.279 1.00 2.11 H new ATOM 0 HB2 ASN A 986 7.779 -29.871 -5.766 1.00 41.22 H new ATOM 0 HB3 ASN A 986 6.144 -30.462 -5.541 1.00 41.22 H new ATOM 0 HD21 ASN A 986 8.459 -32.378 -8.072 1.00 43.23 H new ATOM 0 HD22 ASN A 986 8.888 -31.462 -6.623 1.00 43.23 H new ATOM 1511 N PHE A 987 6.899 -26.646 -5.788 1.00 43.10 N ATOM 1512 CA PHE A 987 6.895 -25.622 -4.757 1.00 52.33 C ATOM 1513 C PHE A 987 6.427 -24.278 -5.321 1.00 72.52 C ATOM 1514 O PHE A 987 6.048 -24.189 -6.488 1.00 45.01 O ATOM 1515 CB PHE A 987 8.335 -25.479 -4.262 1.00 63.30 C ATOM 1516 CG PHE A 987 8.735 -26.512 -3.206 1.00 63.25 C ATOM 1517 CD1 PHE A 987 9.037 -27.785 -3.580 1.00 41.52 C ATOM 1518 CD2 PHE A 987 8.789 -26.158 -1.894 1.00 41.15 C ATOM 1519 CE1 PHE A 987 9.408 -28.743 -2.601 1.00 24.15 C ATOM 1520 CE2 PHE A 987 9.160 -27.116 -0.915 1.00 23.51 C ATOM 1521 CZ PHE A 987 9.462 -28.389 -1.289 1.00 2.25 C ATOM 0 H PHE A 987 7.492 -26.440 -6.592 1.00 43.10 H new ATOM 0 HA PHE A 987 6.215 -25.906 -3.954 1.00 52.33 H new ATOM 0 HB2 PHE A 987 9.011 -25.564 -5.113 1.00 63.30 H new ATOM 0 HB3 PHE A 987 8.468 -24.480 -3.847 1.00 63.30 H new ATOM 0 HD1 PHE A 987 8.994 -28.066 -4.622 1.00 41.52 H new ATOM 0 HD2 PHE A 987 8.549 -25.148 -1.597 1.00 41.15 H new ATOM 0 HE1 PHE A 987 9.648 -29.753 -2.898 1.00 24.15 H new ATOM 0 HE2 PHE A 987 9.203 -26.835 0.127 1.00 23.51 H new ATOM 0 HZ PHE A 987 9.745 -29.118 -0.544 1.00 2.25 H new ATOM 1531 N VAL A 988 6.468 -23.267 -4.466 1.00 32.41 N ATOM 1532 CA VAL A 988 6.053 -21.933 -4.864 1.00 74.11 C ATOM 1533 C VAL A 988 7.044 -20.908 -4.309 1.00 33.33 C ATOM 1534 O VAL A 988 7.765 -21.192 -3.354 1.00 1.44 O ATOM 1535 CB VAL A 988 4.613 -21.677 -4.414 1.00 52.04 C ATOM 1536 CG1 VAL A 988 4.072 -20.381 -5.020 1.00 55.43 C ATOM 1537 CG2 VAL A 988 3.711 -22.863 -4.761 1.00 72.15 C ATOM 0 H VAL A 988 6.782 -23.345 -3.499 1.00 32.41 H new ATOM 0 HA VAL A 988 6.062 -21.838 -5.950 1.00 74.11 H new ATOM 0 HB VAL A 988 4.616 -21.564 -3.330 1.00 52.04 H new ATOM 0 HG11 VAL A 988 3.047 -20.223 -4.684 1.00 55.43 H new ATOM 0 HG12 VAL A 988 4.692 -19.543 -4.701 1.00 55.43 H new ATOM 0 HG13 VAL A 988 4.091 -20.452 -6.108 1.00 55.43 H new ATOM 0 HG21 VAL A 988 2.693 -22.655 -4.430 1.00 72.15 H new ATOM 0 HG22 VAL A 988 3.717 -23.021 -5.839 1.00 72.15 H new ATOM 0 HG23 VAL A 988 4.079 -23.759 -4.261 1.00 72.15 H new ATOM 1547 N VAL A 989 7.047 -19.739 -4.931 1.00 1.53 N ATOM 1548 CA VAL A 989 7.938 -18.670 -4.511 1.00 33.05 C ATOM 1549 C VAL A 989 7.119 -17.406 -4.239 1.00 72.45 C ATOM 1550 O VAL A 989 6.526 -16.838 -5.155 1.00 70.23 O ATOM 1551 CB VAL A 989 9.033 -18.459 -5.558 1.00 20.41 C ATOM 1552 CG1 VAL A 989 10.222 -17.703 -4.963 1.00 24.22 C ATOM 1553 CG2 VAL A 989 9.478 -19.793 -6.162 1.00 14.01 C ATOM 0 H VAL A 989 6.447 -19.508 -5.723 1.00 1.53 H new ATOM 0 HA VAL A 989 8.442 -18.937 -3.582 1.00 33.05 H new ATOM 0 HB VAL A 989 8.617 -17.850 -6.360 1.00 20.41 H new ATOM 0 HG11 VAL A 989 10.986 -17.566 -5.728 1.00 24.22 H new ATOM 0 HG12 VAL A 989 9.891 -16.729 -4.603 1.00 24.22 H new ATOM 0 HG13 VAL A 989 10.638 -18.274 -4.133 1.00 24.22 H new ATOM 0 HG21 VAL A 989 10.257 -19.615 -6.903 1.00 14.01 H new ATOM 0 HG22 VAL A 989 9.868 -20.437 -5.374 1.00 14.01 H new ATOM 0 HG23 VAL A 989 8.627 -20.278 -6.640 1.00 14.01 H new ATOM 1563 N VAL A 990 7.112 -17.003 -2.977 1.00 63.44 N ATOM 1564 CA VAL A 990 6.376 -15.817 -2.574 1.00 71.42 C ATOM 1565 C VAL A 990 7.362 -14.744 -2.108 1.00 72.13 C ATOM 1566 O VAL A 990 8.161 -14.981 -1.204 1.00 12.14 O ATOM 1567 CB VAL A 990 5.341 -16.181 -1.508 1.00 74.41 C ATOM 1568 CG1 VAL A 990 4.993 -14.967 -0.645 1.00 34.33 C ATOM 1569 CG2 VAL A 990 4.085 -16.780 -2.145 1.00 53.52 C ATOM 0 H VAL A 990 7.605 -17.477 -2.220 1.00 63.44 H new ATOM 0 HA VAL A 990 5.823 -15.405 -3.418 1.00 71.42 H new ATOM 0 HB VAL A 990 5.781 -16.938 -0.859 1.00 74.41 H new ATOM 0 HG11 VAL A 990 4.255 -15.253 0.105 1.00 34.33 H new ATOM 0 HG12 VAL A 990 5.893 -14.604 -0.149 1.00 34.33 H new ATOM 0 HG13 VAL A 990 4.583 -14.178 -1.275 1.00 34.33 H new ATOM 0 HG21 VAL A 990 3.365 -17.030 -1.365 1.00 53.52 H new ATOM 0 HG22 VAL A 990 3.643 -16.055 -2.828 1.00 53.52 H new ATOM 0 HG23 VAL A 990 4.351 -17.682 -2.696 1.00 53.52 H new ATOM 1579 N PHE A 991 7.273 -13.587 -2.747 1.00 40.05 N ATOM 1580 CA PHE A 991 8.147 -12.477 -2.410 1.00 3.41 C ATOM 1581 C PHE A 991 7.642 -11.738 -1.169 1.00 31.44 C ATOM 1582 O PHE A 991 6.440 -11.525 -1.015 1.00 62.12 O ATOM 1583 CB PHE A 991 8.131 -11.517 -3.601 1.00 45.32 C ATOM 1584 CG PHE A 991 8.962 -11.993 -4.795 1.00 1.42 C ATOM 1585 CD1 PHE A 991 10.276 -11.653 -4.888 1.00 13.12 C ATOM 1586 CD2 PHE A 991 8.387 -12.755 -5.763 1.00 33.33 C ATOM 1587 CE1 PHE A 991 11.046 -12.095 -5.996 1.00 4.54 C ATOM 1588 CE2 PHE A 991 9.157 -13.197 -6.871 1.00 5.15 C ATOM 1589 CZ PHE A 991 10.471 -12.857 -6.964 1.00 21.24 C ATOM 0 H PHE A 991 6.609 -13.394 -3.497 1.00 40.05 H new ATOM 0 HA PHE A 991 9.150 -12.846 -2.198 1.00 3.41 H new ATOM 0 HB2 PHE A 991 7.100 -11.372 -3.924 1.00 45.32 H new ATOM 0 HB3 PHE A 991 8.503 -10.545 -3.276 1.00 45.32 H new ATOM 0 HD1 PHE A 991 10.733 -11.047 -4.120 1.00 13.12 H new ATOM 0 HD2 PHE A 991 7.344 -13.024 -5.689 1.00 33.33 H new ATOM 0 HE1 PHE A 991 12.089 -11.826 -6.070 1.00 4.54 H new ATOM 0 HE2 PHE A 991 8.700 -13.803 -7.639 1.00 5.15 H new ATOM 0 HZ PHE A 991 11.057 -13.192 -7.807 1.00 21.24 H new ATOM 1599 N LYS A 992 8.585 -11.369 -0.314 1.00 53.23 N ATOM 1600 CA LYS A 992 8.250 -10.659 0.909 1.00 70.14 C ATOM 1601 C LYS A 992 8.171 -9.159 0.617 1.00 31.14 C ATOM 1602 O LYS A 992 7.333 -8.457 1.181 1.00 31.00 O ATOM 1603 CB LYS A 992 9.235 -11.018 2.023 1.00 31.01 C ATOM 1604 CG LYS A 992 8.927 -10.234 3.301 1.00 73.54 C ATOM 1605 CD LYS A 992 9.597 -10.880 4.515 1.00 31.20 C ATOM 1606 CE LYS A 992 11.087 -11.114 4.259 1.00 60.21 C ATOM 1607 NZ LYS A 992 11.771 -9.833 3.974 1.00 62.25 N ATOM 0 H LYS A 992 9.581 -11.548 -0.444 1.00 53.23 H new ATOM 0 HA LYS A 992 7.269 -10.966 1.272 1.00 70.14 H new ATOM 0 HB2 LYS A 992 9.185 -12.088 2.227 1.00 31.01 H new ATOM 0 HB3 LYS A 992 10.253 -10.803 1.697 1.00 31.01 H new ATOM 0 HG2 LYS A 992 9.274 -9.206 3.194 1.00 73.54 H new ATOM 0 HG3 LYS A 992 7.849 -10.192 3.455 1.00 73.54 H new ATOM 0 HD2 LYS A 992 9.471 -10.240 5.388 1.00 31.20 H new ATOM 0 HD3 LYS A 992 9.110 -11.828 4.742 1.00 31.20 H new ATOM 0 HE2 LYS A 992 11.541 -11.590 5.128 1.00 60.21 H new ATOM 0 HE3 LYS A 992 11.215 -11.796 3.419 1.00 60.21 H new ATOM 0 HZ1 LYS A 992 12.799 -9.959 4.070 1.00 62.25 H new ATOM 0 HZ2 LYS A 992 11.549 -9.529 3.005 1.00 62.25 H new ATOM 0 HZ3 LYS A 992 11.447 -9.109 4.647 1.00 62.25 H new ATOM 1673 N LYS A 997 2.850 -13.673 -5.313 1.00 50.10 N ATOM 1674 CA LYS A 997 3.142 -15.096 -5.322 1.00 25.10 C ATOM 1675 C LYS A 997 3.482 -15.534 -6.748 1.00 42.42 C ATOM 1676 O LYS A 997 2.620 -15.526 -7.626 1.00 22.25 O ATOM 1677 CB LYS A 997 1.990 -15.884 -4.695 1.00 43.11 C ATOM 1678 CG LYS A 997 1.876 -17.277 -5.318 1.00 10.15 C ATOM 1679 CD LYS A 997 0.674 -18.034 -4.750 1.00 33.11 C ATOM 1680 CE LYS A 997 0.800 -18.207 -3.235 1.00 2.00 C ATOM 1681 NZ LYS A 997 -0.261 -19.104 -2.725 1.00 63.44 N ATOM 0 HA LYS A 997 4.016 -15.309 -4.706 1.00 25.10 H new ATOM 0 HB2 LYS A 997 2.149 -15.974 -3.620 1.00 43.11 H new ATOM 0 HB3 LYS A 997 1.055 -15.341 -4.835 1.00 43.11 H new ATOM 0 HG2 LYS A 997 1.777 -17.189 -6.400 1.00 10.15 H new ATOM 0 HG3 LYS A 997 2.789 -17.841 -5.127 1.00 10.15 H new ATOM 0 HD2 LYS A 997 -0.244 -17.494 -4.983 1.00 33.11 H new ATOM 0 HD3 LYS A 997 0.598 -19.012 -5.226 1.00 33.11 H new ATOM 0 HE2 LYS A 997 1.780 -18.617 -2.990 1.00 2.00 H new ATOM 0 HE3 LYS A 997 0.730 -17.236 -2.745 1.00 2.00 H new ATOM 0 HZ1 LYS A 997 -0.160 -19.210 -1.695 1.00 63.44 H new ATOM 0 HZ2 LYS A 997 -1.193 -18.697 -2.942 1.00 63.44 H new ATOM 0 HZ3 LYS A 997 -0.176 -20.036 -3.179 1.00 63.44 H new ATOM 1694 N LYS A 998 4.740 -15.904 -6.935 1.00 64.24 N ATOM 1695 CA LYS A 998 5.205 -16.344 -8.240 1.00 72.01 C ATOM 1696 C LYS A 998 5.408 -17.860 -8.220 1.00 31.41 C ATOM 1697 O LYS A 998 6.056 -18.391 -7.319 1.00 73.52 O ATOM 1698 CB LYS A 998 6.452 -15.562 -8.657 1.00 1.05 C ATOM 1699 CG LYS A 998 6.073 -14.287 -9.413 1.00 31.12 C ATOM 1700 CD LYS A 998 5.125 -13.419 -8.583 1.00 4.42 C ATOM 1701 CE LYS A 998 4.831 -12.096 -9.293 1.00 12.31 C ATOM 1702 NZ LYS A 998 5.837 -11.075 -8.925 1.00 11.43 N ATOM 0 H LYS A 998 5.452 -15.908 -6.205 1.00 64.24 H new ATOM 0 HA LYS A 998 4.455 -16.132 -9.002 1.00 72.01 H new ATOM 0 HB2 LYS A 998 7.037 -15.305 -7.774 1.00 1.05 H new ATOM 0 HB3 LYS A 998 7.084 -16.188 -9.287 1.00 1.05 H new ATOM 0 HG2 LYS A 998 6.973 -13.721 -9.653 1.00 31.12 H new ATOM 0 HG3 LYS A 998 5.598 -14.548 -10.359 1.00 31.12 H new ATOM 0 HD2 LYS A 998 4.193 -13.957 -8.408 1.00 4.42 H new ATOM 0 HD3 LYS A 998 5.568 -13.222 -7.607 1.00 4.42 H new ATOM 0 HE2 LYS A 998 4.836 -12.247 -10.372 1.00 12.31 H new ATOM 0 HE3 LYS A 998 3.834 -11.746 -9.024 1.00 12.31 H new ATOM 0 HZ1 LYS A 998 5.622 -10.184 -9.416 1.00 11.43 H new ATOM 0 HZ2 LYS A 998 5.813 -10.919 -7.897 1.00 11.43 H new ATOM 0 HZ3 LYS A 998 6.783 -11.404 -9.203 1.00 11.43 H new ATOM 1715 N GLN A 999 4.842 -18.515 -9.224 1.00 2.54 N ATOM 1716 CA GLN A 999 4.953 -19.959 -9.332 1.00 61.33 C ATOM 1717 C GLN A 999 5.910 -20.334 -10.466 1.00 74.41 C ATOM 1718 O GLN A 999 5.597 -20.133 -11.639 1.00 23.04 O ATOM 1719 CB GLN A 999 3.579 -20.601 -9.539 1.00 45.52 C ATOM 1720 CG GLN A 999 3.539 -22.013 -8.951 1.00 45.45 C ATOM 1721 CD GLN A 999 2.117 -22.395 -8.539 1.00 15.31 C ATOM 1722 OE1 GLN A 999 1.139 -21.804 -8.967 1.00 53.11 O ATOM 1723 NE2 GLN A 999 2.056 -23.413 -7.686 1.00 34.04 N ATOM 0 H GLN A 999 4.305 -18.071 -9.969 1.00 2.54 H new ATOM 0 HA GLN A 999 5.360 -20.344 -8.397 1.00 61.33 H new ATOM 0 HB2 GLN A 999 2.812 -19.986 -9.069 1.00 45.52 H new ATOM 0 HB3 GLN A 999 3.349 -20.640 -10.604 1.00 45.52 H new ATOM 0 HG2 GLN A 999 3.913 -22.727 -9.685 1.00 45.45 H new ATOM 0 HG3 GLN A 999 4.200 -22.069 -8.086 1.00 45.45 H new ATOM 0 HE21 GLN A 999 2.914 -23.863 -7.367 1.00 34.04 H new ATOM 0 HE22 GLN A 999 1.151 -23.744 -7.350 1.00 34.04 H new ATOM 1732 N TYR A1000 7.056 -20.873 -10.077 1.00 34.14 N ATOM 1733 CA TYR A1000 8.060 -21.278 -11.046 1.00 33.23 C ATOM 1734 C TYR A1000 8.054 -22.796 -11.240 1.00 13.23 C ATOM 1735 O TYR A1000 7.179 -23.488 -10.722 1.00 31.05 O ATOM 1736 CB TYR A1000 9.408 -20.856 -10.458 1.00 33.55 C ATOM 1737 CG TYR A1000 9.600 -19.341 -10.365 1.00 73.53 C ATOM 1738 CD1 TYR A1000 10.161 -18.651 -11.421 1.00 35.31 C ATOM 1739 CD2 TYR A1000 9.212 -18.665 -9.227 1.00 2.24 C ATOM 1740 CE1 TYR A1000 10.341 -17.225 -11.334 1.00 63.41 C ATOM 1741 CE2 TYR A1000 9.393 -17.239 -9.140 1.00 11.22 C ATOM 1742 CZ TYR A1000 9.949 -16.589 -10.198 1.00 35.52 C ATOM 1743 OH TYR A1000 10.119 -15.243 -10.116 1.00 2.31 O ATOM 0 H TYR A1000 7.312 -21.039 -9.104 1.00 34.14 H new ATOM 0 HA TYR A1000 7.865 -20.819 -12.015 1.00 33.23 H new ATOM 0 HB2 TYR A1000 9.509 -21.286 -9.462 1.00 33.55 H new ATOM 0 HB3 TYR A1000 10.207 -21.276 -11.069 1.00 33.55 H new ATOM 0 HD1 TYR A1000 10.465 -19.181 -12.312 1.00 35.31 H new ATOM 0 HD2 TYR A1000 8.773 -19.205 -8.401 1.00 2.24 H new ATOM 0 HE1 TYR A1000 10.778 -16.673 -12.153 1.00 63.41 H new ATOM 0 HE2 TYR A1000 9.094 -16.698 -8.255 1.00 11.22 H new ATOM 0 HH TYR A1000 9.793 -14.924 -9.249 1.00 2.31 H new ATOM 1753 N LYS A1001 9.040 -23.269 -11.987 1.00 40.44 N ATOM 1754 CA LYS A1001 9.159 -24.692 -12.256 1.00 44.43 C ATOM 1755 C LYS A1001 10.557 -25.167 -11.852 1.00 55.04 C ATOM 1756 O LYS A1001 10.697 -26.172 -11.157 1.00 3.42 O ATOM 1757 CB LYS A1001 8.805 -24.993 -13.714 1.00 34.13 C ATOM 1758 CG LYS A1001 9.855 -24.415 -14.665 1.00 15.34 C ATOM 1759 CD LYS A1001 9.388 -24.508 -16.119 1.00 21.22 C ATOM 1760 CE LYS A1001 10.410 -23.874 -17.064 1.00 51.52 C ATOM 1761 NZ LYS A1001 10.064 -24.166 -18.473 1.00 60.12 N ATOM 0 H LYS A1001 9.764 -22.692 -12.415 1.00 40.44 H new ATOM 0 HA LYS A1001 8.444 -25.255 -11.656 1.00 44.43 H new ATOM 0 HB2 LYS A1001 8.732 -26.071 -13.859 1.00 34.13 H new ATOM 0 HB3 LYS A1001 7.827 -24.573 -13.948 1.00 34.13 H new ATOM 0 HG2 LYS A1001 10.050 -23.374 -14.408 1.00 15.34 H new ATOM 0 HG3 LYS A1001 10.795 -24.954 -14.546 1.00 15.34 H new ATOM 0 HD2 LYS A1001 9.236 -25.553 -16.390 1.00 21.22 H new ATOM 0 HD3 LYS A1001 8.426 -24.007 -16.229 1.00 21.22 H new ATOM 0 HE2 LYS A1001 10.440 -22.796 -16.907 1.00 51.52 H new ATOM 0 HE3 LYS A1001 11.406 -24.256 -16.841 1.00 51.52 H new ATOM 0 HZ1 LYS A1001 10.768 -23.728 -19.101 1.00 60.12 H new ATOM 0 HZ2 LYS A1001 10.058 -25.195 -18.623 1.00 60.12 H new ATOM 0 HZ3 LYS A1001 9.122 -23.780 -18.686 1.00 60.12 H new ATOM 1774 N LYS A1002 11.554 -24.423 -12.306 1.00 42.51 N ATOM 1775 CA LYS A1002 12.935 -24.755 -12.001 1.00 22.32 C ATOM 1776 C LYS A1002 13.573 -23.603 -11.222 1.00 52.01 C ATOM 1777 O LYS A1002 13.107 -22.467 -11.295 1.00 33.01 O ATOM 1778 CB LYS A1002 13.692 -25.127 -13.278 1.00 34.53 C ATOM 1779 CG LYS A1002 13.268 -26.508 -13.784 1.00 15.24 C ATOM 1780 CD LYS A1002 13.529 -26.646 -15.285 1.00 10.32 C ATOM 1781 CE LYS A1002 13.800 -28.103 -15.663 1.00 35.45 C ATOM 1782 NZ LYS A1002 14.993 -28.611 -14.949 1.00 41.44 N ATOM 0 H LYS A1002 11.433 -23.591 -12.883 1.00 42.51 H new ATOM 0 HA LYS A1002 12.982 -25.637 -11.362 1.00 22.32 H new ATOM 0 HB2 LYS A1002 13.502 -24.379 -14.048 1.00 34.53 H new ATOM 0 HB3 LYS A1002 14.765 -25.120 -13.084 1.00 34.53 H new ATOM 0 HG2 LYS A1002 13.815 -27.281 -13.244 1.00 15.24 H new ATOM 0 HG3 LYS A1002 12.209 -26.665 -13.580 1.00 15.24 H new ATOM 0 HD2 LYS A1002 12.669 -26.276 -15.843 1.00 10.32 H new ATOM 0 HD3 LYS A1002 14.382 -26.029 -15.568 1.00 10.32 H new ATOM 0 HE2 LYS A1002 12.933 -28.716 -15.417 1.00 35.45 H new ATOM 0 HE3 LYS A1002 13.952 -28.183 -16.739 1.00 35.45 H new ATOM 0 HZ1 LYS A1002 15.462 -29.336 -15.529 1.00 41.44 H new ATOM 0 HZ2 LYS A1002 15.653 -27.827 -14.774 1.00 41.44 H new ATOM 0 HZ3 LYS A1002 14.703 -29.028 -14.042 1.00 41.44 H new ATOM 1795 N TRP A1003 14.629 -23.936 -10.495 1.00 0.54 N ATOM 1796 CA TRP A1003 15.335 -22.943 -9.703 1.00 44.51 C ATOM 1797 C TRP A1003 16.058 -21.998 -10.665 1.00 50.44 C ATOM 1798 O TRP A1003 16.335 -20.849 -10.322 1.00 63.44 O ATOM 1799 CB TRP A1003 16.278 -23.610 -8.700 1.00 63.33 C ATOM 1800 CG TRP A1003 15.655 -24.788 -7.949 1.00 72.41 C ATOM 1801 CD1 TRP A1003 15.684 -26.087 -8.280 1.00 43.41 C ATOM 1802 CD2 TRP A1003 14.903 -24.723 -6.719 1.00 10.31 C ATOM 1803 NE1 TRP A1003 15.009 -26.859 -7.357 1.00 63.31 N ATOM 1804 CE2 TRP A1003 14.519 -26.003 -6.378 1.00 22.54 C ATOM 1805 CE3 TRP A1003 14.559 -23.617 -5.921 1.00 32.51 C ATOM 1806 CZ2 TRP A1003 13.771 -26.300 -5.232 1.00 51.11 C ATOM 1807 CZ3 TRP A1003 13.811 -23.931 -4.780 1.00 13.54 C ATOM 1808 CH2 TRP A1003 13.416 -25.215 -4.422 1.00 44.50 C ATOM 0 H TRP A1003 15.013 -24.879 -10.438 1.00 0.54 H new ATOM 0 HA TRP A1003 14.636 -22.361 -9.102 1.00 44.51 H new ATOM 0 HB2 TRP A1003 17.166 -23.958 -9.228 1.00 63.33 H new ATOM 0 HB3 TRP A1003 16.608 -22.865 -7.976 1.00 63.33 H new ATOM 0 HD1 TRP A1003 16.174 -26.480 -9.159 1.00 43.41 H new ATOM 0 HE1 TRP A1003 14.891 -27.872 -7.388 1.00 63.31 H new ATOM 0 HE3 TRP A1003 14.849 -22.606 -6.169 1.00 32.51 H new ATOM 0 HZ2 TRP A1003 13.484 -27.312 -4.986 1.00 51.11 H new ATOM 0 HZ3 TRP A1003 13.520 -23.118 -4.132 1.00 13.54 H new ATOM 0 HH2 TRP A1003 12.838 -25.374 -3.524 1.00 44.50 H new ATOM 1819 N VAL A1004 16.342 -22.516 -11.851 1.00 43.01 N ATOM 1820 CA VAL A1004 17.027 -21.733 -12.865 1.00 43.15 C ATOM 1821 C VAL A1004 16.181 -20.507 -13.215 1.00 1.02 C ATOM 1822 O VAL A1004 16.698 -19.519 -13.734 1.00 2.24 O ATOM 1823 CB VAL A1004 17.340 -22.609 -14.080 1.00 63.11 C ATOM 1824 CG1 VAL A1004 16.132 -23.466 -14.464 1.00 3.10 C ATOM 1825 CG2 VAL A1004 17.808 -21.759 -15.263 1.00 60.12 C ATOM 0 H VAL A1004 16.110 -23.469 -12.132 1.00 43.01 H new ATOM 0 HA VAL A1004 17.983 -21.371 -12.486 1.00 43.15 H new ATOM 0 HB VAL A1004 18.154 -23.281 -13.808 1.00 63.11 H new ATOM 0 HG11 VAL A1004 16.381 -24.079 -15.330 1.00 3.10 H new ATOM 0 HG12 VAL A1004 15.863 -24.112 -13.628 1.00 3.10 H new ATOM 0 HG13 VAL A1004 15.290 -22.819 -14.708 1.00 3.10 H new ATOM 0 HG21 VAL A1004 18.024 -22.406 -16.113 1.00 60.12 H new ATOM 0 HG22 VAL A1004 17.025 -21.051 -15.535 1.00 60.12 H new ATOM 0 HG23 VAL A1004 18.709 -21.213 -14.985 1.00 60.12 H new ATOM 1835 N GLU A1005 14.894 -20.611 -12.916 1.00 65.24 N ATOM 1836 CA GLU A1005 13.972 -19.523 -13.192 1.00 73.35 C ATOM 1837 C GLU A1005 14.098 -18.436 -12.124 1.00 0.15 C ATOM 1838 O GLU A1005 13.805 -17.270 -12.382 1.00 1.51 O ATOM 1839 CB GLU A1005 12.533 -20.035 -13.286 1.00 70.14 C ATOM 1840 CG GLU A1005 12.454 -21.292 -14.156 1.00 13.33 C ATOM 1841 CD GLU A1005 12.371 -20.928 -15.640 1.00 1.45 C ATOM 1842 OE1 GLU A1005 11.759 -19.909 -15.995 1.00 24.12 O ATOM 1843 OE2 GLU A1005 12.972 -21.745 -16.436 1.00 21.31 O ATOM 0 H GLU A1005 14.469 -21.432 -12.485 1.00 65.24 H new ATOM 0 HA GLU A1005 14.232 -19.088 -14.157 1.00 73.35 H new ATOM 0 HB2 GLU A1005 12.156 -20.255 -12.287 1.00 70.14 H new ATOM 0 HB3 GLU A1005 11.893 -19.258 -13.704 1.00 70.14 H new ATOM 0 HG2 GLU A1005 13.330 -21.916 -13.980 1.00 13.33 H new ATOM 0 HG3 GLU A1005 11.581 -21.880 -13.873 1.00 13.33 H new ATOM 1851 N LEU A1006 14.535 -18.857 -10.946 1.00 14.25 N ATOM 1852 CA LEU A1006 14.703 -17.933 -9.836 1.00 63.34 C ATOM 1853 C LEU A1006 15.717 -16.856 -10.225 1.00 42.44 C ATOM 1854 O LEU A1006 16.906 -17.139 -10.369 1.00 15.03 O ATOM 1855 CB LEU A1006 15.071 -18.691 -8.559 1.00 70.43 C ATOM 1856 CG LEU A1006 14.575 -18.077 -7.249 1.00 30.45 C ATOM 1857 CD1 LEU A1006 13.112 -17.646 -7.364 1.00 52.13 C ATOM 1858 CD2 LEU A1006 14.799 -19.034 -6.076 1.00 5.24 C ATOM 0 H LEU A1006 14.778 -19.825 -10.736 1.00 14.25 H new ATOM 0 HA LEU A1006 13.764 -17.424 -9.618 1.00 63.34 H new ATOM 0 HB2 LEU A1006 14.676 -19.704 -8.635 1.00 70.43 H new ATOM 0 HB3 LEU A1006 16.157 -18.775 -8.510 1.00 70.43 H new ATOM 0 HG LEU A1006 15.160 -17.179 -7.050 1.00 30.45 H new ATOM 0 HD11 LEU A1006 12.785 -17.213 -6.419 1.00 52.13 H new ATOM 0 HD12 LEU A1006 13.012 -16.904 -8.157 1.00 52.13 H new ATOM 0 HD13 LEU A1006 12.495 -18.513 -7.599 1.00 52.13 H new ATOM 0 HD21 LEU A1006 14.438 -18.573 -5.157 1.00 5.24 H new ATOM 0 HD22 LEU A1006 14.256 -19.962 -6.255 1.00 5.24 H new ATOM 0 HD23 LEU A1006 15.863 -19.249 -5.980 1.00 5.24 H new ATOM 1870 N PRO A1007 15.197 -15.610 -10.390 1.00 3.34 N ATOM 1871 CA PRO A1007 16.044 -14.488 -10.759 1.00 71.22 C ATOM 1872 C PRO A1007 16.883 -14.019 -9.569 1.00 11.10 C ATOM 1873 O PRO A1007 17.675 -13.086 -9.693 1.00 23.22 O ATOM 1874 CB PRO A1007 15.086 -13.423 -11.268 1.00 21.14 C ATOM 1875 CG PRO A1007 13.716 -13.806 -10.733 1.00 15.51 C ATOM 1876 CD PRO A1007 13.795 -15.237 -10.228 1.00 71.03 C ATOM 0 HA PRO A1007 16.775 -14.747 -11.525 1.00 71.22 H new ATOM 0 HB2 PRO A1007 15.380 -12.434 -10.917 1.00 21.14 H new ATOM 0 HB3 PRO A1007 15.084 -13.388 -12.357 1.00 21.14 H new ATOM 0 HG2 PRO A1007 13.419 -13.133 -9.928 1.00 15.51 H new ATOM 0 HG3 PRO A1007 12.963 -13.719 -11.516 1.00 15.51 H new ATOM 0 HD2 PRO A1007 13.485 -15.307 -9.185 1.00 71.03 H new ATOM 0 HD3 PRO A1007 13.141 -15.896 -10.800 1.00 71.03 H new ATOM 1884 N ILE A1008 16.680 -14.687 -8.443 1.00 3.11 N ATOM 1885 CA ILE A1008 17.408 -14.350 -7.231 1.00 64.04 C ATOM 1886 C ILE A1008 18.658 -15.228 -7.132 1.00 13.42 C ATOM 1887 O ILE A1008 18.578 -16.446 -7.281 1.00 3.04 O ATOM 1888 CB ILE A1008 16.491 -14.445 -6.011 1.00 32.52 C ATOM 1889 CG1 ILE A1008 15.665 -13.168 -5.844 1.00 70.25 C ATOM 1890 CG2 ILE A1008 17.289 -14.780 -4.749 1.00 65.04 C ATOM 1891 CD1 ILE A1008 15.210 -12.629 -7.202 1.00 41.31 C ATOM 0 H ILE A1008 16.022 -15.460 -8.344 1.00 3.11 H new ATOM 0 HA ILE A1008 17.747 -13.315 -7.265 1.00 64.04 H new ATOM 0 HB ILE A1008 15.790 -15.263 -6.175 1.00 32.52 H new ATOM 0 HG12 ILE A1008 14.795 -13.372 -5.220 1.00 70.25 H new ATOM 0 HG13 ILE A1008 16.257 -12.412 -5.328 1.00 70.25 H new ATOM 0 HG21 ILE A1008 16.613 -14.842 -3.896 1.00 65.04 H new ATOM 0 HG22 ILE A1008 17.794 -15.737 -4.881 1.00 65.04 H new ATOM 0 HG23 ILE A1008 18.029 -14.001 -4.569 1.00 65.04 H new ATOM 0 HD11 ILE A1008 14.625 -11.721 -7.056 1.00 41.31 H new ATOM 0 HD12 ILE A1008 16.083 -12.403 -7.815 1.00 41.31 H new ATOM 0 HD13 ILE A1008 14.598 -13.378 -7.704 1.00 41.31 H new ATOM 1903 N THR A1009 19.782 -14.574 -6.881 1.00 5.04 N ATOM 1904 CA THR A1009 21.047 -15.279 -6.759 1.00 70.53 C ATOM 1905 C THR A1009 21.041 -16.175 -5.519 1.00 21.01 C ATOM 1906 O THR A1009 20.263 -15.953 -4.592 1.00 72.45 O ATOM 1907 CB THR A1009 22.170 -14.240 -6.753 1.00 34.10 C ATOM 1908 OG1 THR A1009 23.310 -14.958 -7.217 1.00 11.22 O ATOM 1909 CG2 THR A1009 22.555 -13.803 -5.338 1.00 53.43 C ATOM 0 H THR A1009 19.844 -13.563 -6.759 1.00 5.04 H new ATOM 0 HA THR A1009 21.209 -15.948 -7.604 1.00 70.53 H new ATOM 0 HB THR A1009 21.862 -13.369 -7.331 1.00 34.10 H new ATOM 0 HG1 THR A1009 24.085 -14.359 -7.246 1.00 11.22 H new ATOM 0 HG21 THR A1009 23.356 -13.065 -5.390 1.00 53.43 H new ATOM 0 HG22 THR A1009 21.688 -13.363 -4.845 1.00 53.43 H new ATOM 0 HG23 THR A1009 22.896 -14.669 -4.770 1.00 53.43 H new ATOM 1917 N PHE A1010 21.918 -17.168 -5.541 1.00 40.10 N ATOM 1918 CA PHE A1010 22.024 -18.098 -4.430 1.00 33.03 C ATOM 1919 C PHE A1010 23.477 -18.246 -3.974 1.00 40.54 C ATOM 1920 O PHE A1010 24.397 -17.836 -4.681 1.00 1.04 O ATOM 1921 CB PHE A1010 21.519 -19.453 -4.930 1.00 54.55 C ATOM 1922 CG PHE A1010 20.006 -19.642 -4.794 1.00 44.34 C ATOM 1923 CD1 PHE A1010 19.155 -18.794 -5.432 1.00 30.12 C ATOM 1924 CD2 PHE A1010 19.514 -20.658 -4.036 1.00 53.42 C ATOM 1925 CE1 PHE A1010 17.752 -18.970 -5.306 1.00 15.24 C ATOM 1926 CE2 PHE A1010 18.110 -20.833 -3.910 1.00 63.30 C ATOM 1927 CZ PHE A1010 17.259 -19.986 -4.547 1.00 52.34 C ATOM 0 H PHE A1010 22.562 -17.349 -6.311 1.00 40.10 H new ATOM 0 HA PHE A1010 21.441 -17.733 -3.584 1.00 33.03 H new ATOM 0 HB2 PHE A1010 21.797 -19.569 -5.978 1.00 54.55 H new ATOM 0 HB3 PHE A1010 22.025 -20.244 -4.377 1.00 54.55 H new ATOM 0 HD1 PHE A1010 19.546 -17.987 -6.034 1.00 30.12 H new ATOM 0 HD2 PHE A1010 20.190 -21.331 -3.530 1.00 53.42 H new ATOM 0 HE1 PHE A1010 17.076 -18.297 -5.813 1.00 15.24 H new ATOM 0 HE2 PHE A1010 17.719 -21.639 -3.308 1.00 63.30 H new ATOM 0 HZ PHE A1010 16.192 -20.119 -4.451 1.00 52.34 H new ATOM 1937 N PRO A1011 23.643 -18.847 -2.766 1.00 74.31 N ATOM 1938 CA PRO A1011 24.968 -19.054 -2.208 1.00 62.03 C ATOM 1939 C PRO A1011 25.689 -20.202 -2.918 1.00 33.33 C ATOM 1940 O PRO A1011 25.297 -20.604 -4.012 1.00 74.02 O ATOM 1941 CB PRO A1011 24.736 -19.322 -0.730 1.00 53.53 C ATOM 1942 CG PRO A1011 23.273 -19.715 -0.603 1.00 11.52 C ATOM 1943 CD PRO A1011 22.576 -19.345 -1.902 1.00 61.11 C ATOM 0 HA PRO A1011 25.621 -18.192 -2.345 1.00 62.03 H new ATOM 0 HB2 PRO A1011 25.387 -20.119 -0.371 1.00 53.53 H new ATOM 0 HB3 PRO A1011 24.956 -18.437 -0.133 1.00 53.53 H new ATOM 0 HG2 PRO A1011 23.180 -20.784 -0.411 1.00 11.52 H new ATOM 0 HG3 PRO A1011 22.811 -19.199 0.239 1.00 11.52 H new ATOM 0 HD2 PRO A1011 22.079 -20.208 -2.344 1.00 61.11 H new ATOM 0 HD3 PRO A1011 21.811 -18.585 -1.739 1.00 61.11 H new