USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1035 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: A1011 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A1012 SER OG : rot -95:sc= -0.0175! USER MOD Single : A 922 ASN : amide:sc= -2.33 K(o=-2.3,f=-3.6!) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 928 ASN : amide:sc= -1.19 K(o=-1.2,f=-3.4!) USER MOD Single : A 930 THR OG1 : rot -118:sc= -0.754 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl 179:sc= -2.48 (180deg=-2.56) USER MOD Single : A 940 SER OG : rot -63:sc= 0.207 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 944 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 951 TYR OH : rot 38:sc= 1.33 USER MOD Single : A 954 MET CE :methyl -152:sc= -2.87! (180deg=-5.25!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 THR OG1 : rot -20:sc= -1.8 USER MOD Single : A 972 SER OG : rot 180:sc= 0 USER MOD Single : A 979 SER OG : rot 120:sc= -0.981 USER MOD Single : A 980 THR OG1 : rot 7:sc= -4.05! USER MOD Single : A 981 HIS : no HD1:sc= -7.32! C(o=-7.3!,f=-10!) USER MOD Single : A 986 MET CE :methyl 139:sc= -0.523 (180deg=-2.08!) USER MOD Single : A 988 GLN : amide:sc= -2.76! C(o=-2.8!,f=-4.8!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -0.633 X(o=-0.63,f=-1.1) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 MET CE :methyl 152:sc= -1.41 (180deg=-4.08!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -7.03! C(o=-7!,f=-15!) USER MOD Single : A1007 GLN : amide:sc= -0.0104 X(o=-0.01,f=-0.013) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl -131:sc= -5.01! (180deg=-11.2!) USER MOD Single : A1014 GLN : amide:sc= -5.46! C(o=-5.5!,f=-9.5!) USER MOD Single : A1015 GLN : amide:sc=-0.00944 X(o=-0.0094,f=-0.12) USER MOD Single : A1017 TYR OH : rot 117:sc= -0.698! USER MOD Single : A1018 LYS NZ :NH3+ 151:sc= -1.8 (180deg=-3.67!) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= -0.147 K(o=-0.15,f=-0.97) USER MOD Single : A1021 MET CE :methyl -122:sc= -0.679 (180deg=-1.6) USER MOD Single : A1023 THR OG1 : rot 94:sc= 0.273 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.08) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.164 K(o=-0.16,f=-2.3!) USER MOD Single : A1041 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl 167:sc= 0 (180deg=-0.219) USER MOD ----------------------------------------------------------------- ATOM 107 N ASN A 922 4.638 -9.651 -6.941 1.00 0.00 N ATOM 108 CA ASN A 922 4.634 -9.538 -5.492 1.00 0.00 C ATOM 109 C ASN A 922 5.589 -8.420 -5.069 1.00 0.00 C ATOM 110 O ASN A 922 5.317 -7.695 -4.114 1.00 0.00 O ATOM 111 CB ASN A 922 5.107 -10.837 -4.837 1.00 0.00 C ATOM 112 CG ASN A 922 5.008 -10.751 -3.313 1.00 0.00 C ATOM 113 OD1 ASN A 922 4.993 -9.681 -2.726 1.00 0.00 O ATOM 114 ND2 ASN A 922 4.941 -11.933 -2.707 1.00 0.00 N ATOM 0 HA ASN A 922 3.614 -9.324 -5.173 1.00 0.00 H new ATOM 0 HB2 ASN A 922 4.504 -11.671 -5.198 1.00 0.00 H new ATOM 0 HB3 ASN A 922 6.138 -11.040 -5.127 1.00 0.00 H new ATOM 0 HD21 ASN A 922 4.872 -11.982 -1.690 1.00 0.00 H new ATOM 0 HD22 ASN A 922 4.958 -12.791 -3.259 1.00 0.00 H new ATOM 121 N ASP A 923 6.688 -8.317 -5.801 1.00 0.00 N ATOM 122 CA ASP A 923 7.685 -7.300 -5.514 1.00 0.00 C ATOM 123 C ASP A 923 7.176 -5.941 -5.999 1.00 0.00 C ATOM 124 O ASP A 923 7.410 -4.920 -5.354 1.00 0.00 O ATOM 125 CB ASP A 923 9.000 -7.597 -6.238 1.00 0.00 C ATOM 126 CG ASP A 923 10.242 -7.607 -5.344 1.00 0.00 C ATOM 127 OD1 ASP A 923 10.400 -6.629 -4.581 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.006 -8.592 -5.444 1.00 0.00 O ATOM 0 H ASP A 923 6.910 -8.921 -6.592 1.00 0.00 H new ATOM 0 HA ASP A 923 7.859 -7.294 -4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 923 8.916 -8.567 -6.729 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.141 -6.854 -7.023 1.00 0.00 H new ATOM 133 N LYS A 924 6.489 -5.972 -7.132 1.00 0.00 N ATOM 134 CA LYS A 924 5.945 -4.756 -7.711 1.00 0.00 C ATOM 135 C LYS A 924 5.090 -4.037 -6.666 1.00 0.00 C ATOM 136 O LYS A 924 5.382 -2.901 -6.294 1.00 0.00 O ATOM 137 CB LYS A 924 5.196 -5.069 -9.008 1.00 0.00 C ATOM 138 CG LYS A 924 5.292 -3.901 -9.992 1.00 0.00 C ATOM 139 CD LYS A 924 6.660 -3.871 -10.676 1.00 0.00 C ATOM 140 CE LYS A 924 6.726 -2.756 -11.722 1.00 0.00 C ATOM 141 NZ LYS A 924 8.096 -2.640 -12.270 1.00 0.00 N ATOM 0 H LYS A 924 6.297 -6.821 -7.664 1.00 0.00 H new ATOM 0 HA LYS A 924 6.748 -4.074 -7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 924 5.611 -5.968 -9.464 1.00 0.00 H new ATOM 0 HB3 LYS A 924 4.149 -5.278 -8.787 1.00 0.00 H new ATOM 0 HG2 LYS A 924 4.508 -3.989 -10.744 1.00 0.00 H new ATOM 0 HG3 LYS A 924 5.125 -2.962 -9.465 1.00 0.00 H new ATOM 0 HD2 LYS A 924 7.440 -3.721 -9.930 1.00 0.00 H new ATOM 0 HD3 LYS A 924 6.854 -4.832 -11.151 1.00 0.00 H new ATOM 0 HE2 LYS A 924 6.022 -2.963 -12.528 1.00 0.00 H new ATOM 0 HE3 LYS A 924 6.426 -1.809 -11.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 8.123 -1.879 -12.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 8.760 -2.421 -11.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 8.368 -3.539 -12.717 1.00 0.00 H new ATOM 155 N VAL A 925 4.051 -4.728 -6.221 1.00 0.00 N ATOM 156 CA VAL A 925 3.151 -4.169 -5.225 1.00 0.00 C ATOM 157 C VAL A 925 3.971 -3.601 -4.065 1.00 0.00 C ATOM 158 O VAL A 925 3.918 -2.403 -3.791 1.00 0.00 O ATOM 159 CB VAL A 925 2.140 -5.228 -4.781 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.253 -4.699 -3.652 1.00 0.00 C ATOM 161 CG2 VAL A 925 1.296 -5.710 -5.962 1.00 0.00 C ATOM 0 H VAL A 925 3.812 -5.670 -6.531 1.00 0.00 H new ATOM 0 HA VAL A 925 2.575 -3.347 -5.649 1.00 0.00 H new ATOM 0 HB VAL A 925 2.697 -6.083 -4.397 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.543 -5.471 -3.355 1.00 0.00 H new ATOM 0 HG12 VAL A 925 1.874 -4.429 -2.798 1.00 0.00 H new ATOM 0 HG13 VAL A 925 0.709 -3.820 -3.998 1.00 0.00 H new ATOM 0 HG21 VAL A 925 0.586 -6.462 -5.619 1.00 0.00 H new ATOM 0 HG22 VAL A 925 0.753 -4.867 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 925 1.947 -6.145 -6.721 1.00 0.00 H new ATOM 171 N TYR A 926 4.710 -4.488 -3.415 1.00 0.00 N ATOM 172 CA TYR A 926 5.540 -4.090 -2.290 1.00 0.00 C ATOM 173 C TYR A 926 6.448 -2.918 -2.667 1.00 0.00 C ATOM 174 O TYR A 926 6.782 -2.089 -1.821 1.00 0.00 O ATOM 175 CB TYR A 926 6.408 -5.305 -1.956 1.00 0.00 C ATOM 176 CG TYR A 926 5.744 -6.300 -1.002 1.00 0.00 C ATOM 177 CD1 TYR A 926 4.486 -6.792 -1.284 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.403 -6.705 0.141 1.00 0.00 C ATOM 179 CE1 TYR A 926 3.861 -7.728 -0.386 1.00 0.00 C ATOM 180 CE2 TYR A 926 5.779 -7.642 1.038 1.00 0.00 C ATOM 181 CZ TYR A 926 4.538 -8.107 0.731 1.00 0.00 C ATOM 182 OH TYR A 926 3.948 -8.992 1.579 1.00 0.00 O ATOM 0 H TYR A 926 4.751 -5.481 -3.646 1.00 0.00 H new ATOM 0 HA TYR A 926 4.922 -3.774 -1.450 1.00 0.00 H new ATOM 0 HB2 TYR A 926 6.665 -5.821 -2.881 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.342 -4.961 -1.513 1.00 0.00 H new ATOM 0 HD1 TYR A 926 3.970 -6.475 -2.178 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.387 -6.319 0.362 1.00 0.00 H new ATOM 0 HE1 TYR A 926 2.877 -8.120 -0.595 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.285 -7.969 1.935 1.00 0.00 H new ATOM 0 HH TYR A 926 4.548 -9.172 2.333 1.00 0.00 H new ATOM 192 N GLU A 927 6.822 -2.885 -3.938 1.00 0.00 N ATOM 193 CA GLU A 927 7.685 -1.828 -4.437 1.00 0.00 C ATOM 194 C GLU A 927 6.887 -0.536 -4.625 1.00 0.00 C ATOM 195 O GLU A 927 7.319 0.533 -4.194 1.00 0.00 O ATOM 196 CB GLU A 927 8.366 -2.246 -5.741 1.00 0.00 C ATOM 197 CG GLU A 927 9.515 -3.220 -5.472 1.00 0.00 C ATOM 198 CD GLU A 927 10.839 -2.473 -5.302 1.00 0.00 C ATOM 199 OE1 GLU A 927 10.825 -1.451 -4.582 1.00 0.00 O ATOM 200 OE2 GLU A 927 11.835 -2.941 -5.894 1.00 0.00 O ATOM 0 H GLU A 927 6.543 -3.573 -4.637 1.00 0.00 H new ATOM 0 HA GLU A 927 8.467 -1.645 -3.700 1.00 0.00 H new ATOM 0 HB2 GLU A 927 7.637 -2.713 -6.403 1.00 0.00 H new ATOM 0 HB3 GLU A 927 8.746 -1.364 -6.256 1.00 0.00 H new ATOM 0 HG2 GLU A 927 9.302 -3.799 -4.574 1.00 0.00 H new ATOM 0 HG3 GLU A 927 9.596 -3.928 -6.296 1.00 0.00 H new ATOM 207 N ASN A 928 5.737 -0.676 -5.268 1.00 0.00 N ATOM 208 CA ASN A 928 4.875 0.467 -5.517 1.00 0.00 C ATOM 209 C ASN A 928 4.485 1.107 -4.184 1.00 0.00 C ATOM 210 O ASN A 928 4.752 2.286 -3.956 1.00 0.00 O ATOM 211 CB ASN A 928 3.591 0.042 -6.232 1.00 0.00 C ATOM 212 CG ASN A 928 3.193 1.063 -7.299 1.00 0.00 C ATOM 213 OD1 ASN A 928 2.183 1.740 -7.202 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.042 1.137 -8.320 1.00 0.00 N ATOM 0 H ASN A 928 5.382 -1.564 -5.624 1.00 0.00 H new ATOM 0 HA ASN A 928 5.421 1.171 -6.145 1.00 0.00 H new ATOM 0 HB2 ASN A 928 3.734 -0.935 -6.694 1.00 0.00 H new ATOM 0 HB3 ASN A 928 2.785 -0.064 -5.506 1.00 0.00 H new ATOM 0 HD21 ASN A 928 3.866 1.790 -9.084 1.00 0.00 H new ATOM 0 HD22 ASN A 928 4.870 0.541 -8.339 1.00 0.00 H new ATOM 221 N VAL A 929 3.860 0.302 -3.338 1.00 0.00 N ATOM 222 CA VAL A 929 3.431 0.776 -2.033 1.00 0.00 C ATOM 223 C VAL A 929 4.534 1.641 -1.421 1.00 0.00 C ATOM 224 O VAL A 929 4.288 2.780 -1.026 1.00 0.00 O ATOM 225 CB VAL A 929 3.041 -0.410 -1.148 1.00 0.00 C ATOM 226 CG1 VAL A 929 3.167 -0.053 0.335 1.00 0.00 C ATOM 227 CG2 VAL A 929 1.629 -0.899 -1.476 1.00 0.00 C ATOM 0 H VAL A 929 3.640 -0.675 -3.530 1.00 0.00 H new ATOM 0 HA VAL A 929 2.543 1.401 -2.127 1.00 0.00 H new ATOM 0 HB VAL A 929 3.734 -1.225 -1.357 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.884 -0.913 0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 929 4.198 0.224 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 929 2.509 0.785 0.565 1.00 0.00 H new ATOM 0 HG21 VAL A 929 1.377 -1.742 -0.833 1.00 0.00 H new ATOM 0 HG22 VAL A 929 0.916 -0.091 -1.310 1.00 0.00 H new ATOM 0 HG23 VAL A 929 1.586 -1.213 -2.519 1.00 0.00 H new ATOM 237 N THR A 930 5.727 1.068 -1.360 1.00 0.00 N ATOM 238 CA THR A 930 6.869 1.773 -0.803 1.00 0.00 C ATOM 239 C THR A 930 7.163 3.036 -1.613 1.00 0.00 C ATOM 240 O THR A 930 7.203 4.136 -1.063 1.00 0.00 O ATOM 241 CB THR A 930 8.046 0.797 -0.749 1.00 0.00 C ATOM 242 OG1 THR A 930 7.903 0.014 -1.931 1.00 0.00 O ATOM 243 CG2 THR A 930 7.915 -0.217 0.388 1.00 0.00 C ATOM 0 H THR A 930 5.928 0.123 -1.687 1.00 0.00 H new ATOM 0 HA THR A 930 6.666 2.116 0.211 1.00 0.00 H new ATOM 0 HB THR A 930 8.975 1.356 -0.631 1.00 0.00 H new ATOM 0 HG1 THR A 930 7.758 -0.924 -1.687 1.00 0.00 H new ATOM 0 HG21 THR A 930 8.776 -0.885 0.381 1.00 0.00 H new ATOM 0 HG22 THR A 930 7.872 0.309 1.342 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.003 -0.799 0.253 1.00 0.00 H new ATOM 251 N GLY A 931 7.360 2.838 -2.908 1.00 0.00 N ATOM 252 CA GLY A 931 7.650 3.948 -3.800 1.00 0.00 C ATOM 253 C GLY A 931 6.567 5.025 -3.704 1.00 0.00 C ATOM 254 O GLY A 931 6.824 6.195 -3.983 1.00 0.00 O ATOM 0 H GLY A 931 7.324 1.925 -3.361 1.00 0.00 H new ATOM 0 HA2 GLY A 931 8.619 4.378 -3.548 1.00 0.00 H new ATOM 0 HA3 GLY A 931 7.719 3.587 -4.826 1.00 0.00 H new ATOM 258 N LEU A 932 5.379 4.591 -3.309 1.00 0.00 N ATOM 259 CA LEU A 932 4.257 5.503 -3.172 1.00 0.00 C ATOM 260 C LEU A 932 4.351 6.223 -1.825 1.00 0.00 C ATOM 261 O LEU A 932 4.496 7.444 -1.779 1.00 0.00 O ATOM 262 CB LEU A 932 2.935 4.762 -3.382 1.00 0.00 C ATOM 263 CG LEU A 932 1.887 4.934 -2.280 1.00 0.00 C ATOM 264 CD1 LEU A 932 1.608 6.414 -2.016 1.00 0.00 C ATOM 265 CD2 LEU A 932 0.610 4.160 -2.613 1.00 0.00 C ATOM 0 H LEU A 932 5.169 3.619 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 932 4.293 6.269 -3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.500 5.095 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.150 3.699 -3.488 1.00 0.00 H new ATOM 0 HG LEU A 932 2.288 4.513 -1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.860 6.508 -1.229 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.528 6.908 -1.703 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.237 6.882 -2.927 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -0.118 4.299 -1.814 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.195 4.529 -3.551 1.00 0.00 H new ATOM 0 HD23 LEU A 932 0.843 3.100 -2.712 1.00 0.00 H new ATOM 277 N VAL A 933 4.264 5.437 -0.763 1.00 0.00 N ATOM 278 CA VAL A 933 4.338 5.984 0.581 1.00 0.00 C ATOM 279 C VAL A 933 5.658 6.739 0.748 1.00 0.00 C ATOM 280 O VAL A 933 5.731 7.710 1.499 1.00 0.00 O ATOM 281 CB VAL A 933 4.153 4.868 1.611 1.00 0.00 C ATOM 282 CG1 VAL A 933 2.691 4.422 1.681 1.00 0.00 C ATOM 283 CG2 VAL A 933 5.073 3.683 1.308 1.00 0.00 C ATOM 0 H VAL A 933 4.143 4.425 -0.806 1.00 0.00 H new ATOM 0 HA VAL A 933 3.532 6.698 0.747 1.00 0.00 H new ATOM 0 HB VAL A 933 4.429 5.266 2.588 1.00 0.00 H new ATOM 0 HG11 VAL A 933 2.588 3.628 2.421 1.00 0.00 H new ATOM 0 HG12 VAL A 933 2.066 5.268 1.967 1.00 0.00 H new ATOM 0 HG13 VAL A 933 2.376 4.052 0.705 1.00 0.00 H new ATOM 0 HG21 VAL A 933 4.921 2.904 2.055 1.00 0.00 H new ATOM 0 HG22 VAL A 933 4.842 3.287 0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 933 6.112 4.013 1.334 1.00 0.00 H new ATOM 293 N LYS A 934 6.669 6.263 0.036 1.00 0.00 N ATOM 294 CA LYS A 934 7.983 6.881 0.096 1.00 0.00 C ATOM 295 C LYS A 934 7.892 8.314 -0.432 1.00 0.00 C ATOM 296 O LYS A 934 8.419 9.241 0.183 1.00 0.00 O ATOM 297 CB LYS A 934 9.014 6.020 -0.636 1.00 0.00 C ATOM 298 CG LYS A 934 9.377 4.782 0.186 1.00 0.00 C ATOM 299 CD LYS A 934 10.798 4.893 0.744 1.00 0.00 C ATOM 300 CE LYS A 934 11.749 3.940 0.017 1.00 0.00 C ATOM 301 NZ LYS A 934 13.036 4.612 -0.271 1.00 0.00 N ATOM 0 H LYS A 934 6.605 5.457 -0.585 1.00 0.00 H new ATOM 0 HA LYS A 934 8.329 6.942 1.128 1.00 0.00 H new ATOM 0 HB2 LYS A 934 8.617 5.715 -1.604 1.00 0.00 H new ATOM 0 HB3 LYS A 934 9.911 6.608 -0.831 1.00 0.00 H new ATOM 0 HG2 LYS A 934 8.668 4.665 1.006 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.295 3.891 -0.436 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.154 5.918 0.640 1.00 0.00 H new ATOM 0 HD3 LYS A 934 10.793 4.664 1.810 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.923 3.054 0.628 1.00 0.00 H new ATOM 0 HE3 LYS A 934 11.293 3.601 -0.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 13.670 3.951 -0.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 12.867 5.444 -0.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.477 4.914 0.621 1.00 0.00 H new ATOM 315 N ALA A 935 7.220 8.452 -1.565 1.00 0.00 N ATOM 316 CA ALA A 935 7.053 9.757 -2.183 1.00 0.00 C ATOM 317 C ALA A 935 6.059 10.582 -1.362 1.00 0.00 C ATOM 318 O ALA A 935 6.300 11.756 -1.088 1.00 0.00 O ATOM 319 CB ALA A 935 6.606 9.581 -3.635 1.00 0.00 C ATOM 0 H ALA A 935 6.784 7.681 -2.072 1.00 0.00 H new ATOM 0 HA ALA A 935 7.999 10.299 -2.197 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.481 10.560 -4.098 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.360 9.014 -4.182 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.658 9.043 -3.661 1.00 0.00 H new ATOM 325 N VAL A 936 4.964 9.934 -0.993 1.00 0.00 N ATOM 326 CA VAL A 936 3.933 10.592 -0.209 1.00 0.00 C ATOM 327 C VAL A 936 4.592 11.474 0.854 1.00 0.00 C ATOM 328 O VAL A 936 4.248 12.646 0.993 1.00 0.00 O ATOM 329 CB VAL A 936 2.981 9.551 0.383 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.276 10.098 1.626 1.00 0.00 C ATOM 331 CG2 VAL A 936 1.966 9.081 -0.660 1.00 0.00 C ATOM 0 H VAL A 936 4.768 8.960 -1.223 1.00 0.00 H new ATOM 0 HA VAL A 936 3.328 11.242 -0.841 1.00 0.00 H new ATOM 0 HB VAL A 936 3.574 8.688 0.686 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.605 9.339 2.028 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.019 10.361 2.379 1.00 0.00 H new ATOM 0 HG13 VAL A 936 1.701 10.985 1.358 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.301 8.341 -0.213 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.381 9.932 -1.007 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.492 8.634 -1.504 1.00 0.00 H new ATOM 341 N ILE A 937 5.527 10.875 1.577 1.00 0.00 N ATOM 342 CA ILE A 937 6.237 11.591 2.623 1.00 0.00 C ATOM 343 C ILE A 937 7.233 12.561 1.985 1.00 0.00 C ATOM 344 O ILE A 937 7.119 13.774 2.156 1.00 0.00 O ATOM 345 CB ILE A 937 6.878 10.608 3.604 1.00 0.00 C ATOM 346 CG1 ILE A 937 5.812 9.782 4.329 1.00 0.00 C ATOM 347 CG2 ILE A 937 7.803 11.335 4.583 1.00 0.00 C ATOM 348 CD1 ILE A 937 6.420 8.518 4.940 1.00 0.00 C ATOM 0 H ILE A 937 5.809 9.902 1.459 1.00 0.00 H new ATOM 0 HA ILE A 937 5.543 12.189 3.214 1.00 0.00 H new ATOM 0 HB ILE A 937 7.494 9.911 3.035 1.00 0.00 H new ATOM 0 HG12 ILE A 937 5.351 10.384 5.112 1.00 0.00 H new ATOM 0 HG13 ILE A 937 5.021 9.509 3.630 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.246 10.613 5.269 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.594 11.841 4.029 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.229 12.069 5.149 1.00 0.00 H new ATOM 0 HD11 ILE A 937 5.642 7.949 5.449 1.00 0.00 H new ATOM 0 HD12 ILE A 937 6.859 7.907 4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 937 7.193 8.796 5.656 1.00 0.00 H new ATOM 360 N GLU A 938 8.187 11.991 1.264 1.00 0.00 N ATOM 361 CA GLU A 938 9.203 12.790 0.600 1.00 0.00 C ATOM 362 C GLU A 938 8.609 14.121 0.133 1.00 0.00 C ATOM 363 O GLU A 938 9.208 15.176 0.334 1.00 0.00 O ATOM 364 CB GLU A 938 9.824 12.026 -0.570 1.00 0.00 C ATOM 365 CG GLU A 938 11.351 12.103 -0.526 1.00 0.00 C ATOM 366 CD GLU A 938 11.951 10.795 -0.005 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.508 10.361 1.080 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.839 10.260 -0.703 1.00 0.00 O ATOM 0 H GLU A 938 8.278 10.985 1.125 1.00 0.00 H new ATOM 0 HA GLU A 938 9.998 13.000 1.316 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.508 10.983 -0.537 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.462 12.439 -1.512 1.00 0.00 H new ATOM 0 HG2 GLU A 938 11.737 12.312 -1.524 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.659 12.929 0.115 1.00 0.00 H new ATOM 375 N MET A 939 7.439 14.027 -0.481 1.00 0.00 N ATOM 376 CA MET A 939 6.758 15.210 -0.979 1.00 0.00 C ATOM 377 C MET A 939 6.793 16.338 0.054 1.00 0.00 C ATOM 378 O MET A 939 7.464 17.349 -0.148 1.00 0.00 O ATOM 379 CB MET A 939 5.304 14.863 -1.307 1.00 0.00 C ATOM 380 CG MET A 939 4.450 16.127 -1.416 1.00 0.00 C ATOM 381 SD MET A 939 3.370 16.014 -2.833 1.00 0.00 S ATOM 382 CE MET A 939 2.643 14.410 -2.542 1.00 0.00 C ATOM 0 H MET A 939 6.945 13.150 -0.645 1.00 0.00 H new ATOM 0 HA MET A 939 7.271 15.550 -1.879 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.261 14.309 -2.245 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.898 14.211 -0.533 1.00 0.00 H new ATOM 0 HG2 MET A 939 3.860 16.257 -0.508 1.00 0.00 H new ATOM 0 HG3 MET A 939 5.092 17.003 -1.507 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.924 14.188 -3.331 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.425 13.651 -2.539 1.00 0.00 H new ATOM 0 HE3 MET A 939 2.135 14.410 -1.578 1.00 0.00 H new ATOM 392 N SER A 940 6.061 16.127 1.139 1.00 0.00 N ATOM 393 CA SER A 940 6.000 17.113 2.204 1.00 0.00 C ATOM 394 C SER A 940 7.393 17.691 2.462 1.00 0.00 C ATOM 395 O SER A 940 7.533 18.881 2.741 1.00 0.00 O ATOM 396 CB SER A 940 5.432 16.504 3.487 1.00 0.00 C ATOM 397 OG SER A 940 6.438 15.857 4.262 1.00 0.00 O ATOM 0 H SER A 940 5.505 15.287 1.303 1.00 0.00 H new ATOM 0 HA SER A 940 5.333 17.916 1.889 1.00 0.00 H new ATOM 0 HB2 SER A 940 4.963 17.287 4.083 1.00 0.00 H new ATOM 0 HB3 SER A 940 4.652 15.786 3.233 1.00 0.00 H new ATOM 0 HG SER A 940 6.815 15.111 3.751 1.00 0.00 H new ATOM 403 N SER A 941 8.388 16.822 2.360 1.00 0.00 N ATOM 404 CA SER A 941 9.765 17.232 2.579 1.00 0.00 C ATOM 405 C SER A 941 10.159 18.307 1.564 1.00 0.00 C ATOM 406 O SER A 941 10.791 19.300 1.920 1.00 0.00 O ATOM 407 CB SER A 941 10.716 16.038 2.484 1.00 0.00 C ATOM 408 OG SER A 941 11.896 16.233 3.258 1.00 0.00 O ATOM 0 H SER A 941 8.268 15.836 2.129 1.00 0.00 H new ATOM 0 HA SER A 941 9.843 17.645 3.585 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.204 15.138 2.825 1.00 0.00 H new ATOM 0 HB3 SER A 941 10.989 15.874 1.442 1.00 0.00 H new ATOM 0 HG SER A 941 12.477 15.448 3.173 1.00 0.00 H new ATOM 414 N LYS A 942 9.768 18.072 0.320 1.00 0.00 N ATOM 415 CA LYS A 942 10.073 19.007 -0.749 1.00 0.00 C ATOM 416 C LYS A 942 8.775 19.642 -1.251 1.00 0.00 C ATOM 417 O LYS A 942 8.668 20.003 -2.422 1.00 0.00 O ATOM 418 CB LYS A 942 10.886 18.319 -1.848 1.00 0.00 C ATOM 419 CG LYS A 942 10.006 17.378 -2.673 1.00 0.00 C ATOM 420 CD LYS A 942 10.285 17.536 -4.169 1.00 0.00 C ATOM 421 CE LYS A 942 9.031 17.998 -4.915 1.00 0.00 C ATOM 422 NZ LYS A 942 9.362 19.088 -5.859 1.00 0.00 N ATOM 0 H LYS A 942 9.243 17.248 0.029 1.00 0.00 H new ATOM 0 HA LYS A 942 10.702 19.816 -0.379 1.00 0.00 H new ATOM 0 HB2 LYS A 942 11.332 19.070 -2.500 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.706 17.757 -1.401 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.189 16.346 -2.372 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.955 17.587 -2.471 1.00 0.00 H new ATOM 0 HD2 LYS A 942 11.088 18.258 -4.319 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.629 16.587 -4.581 1.00 0.00 H new ATOM 0 HE2 LYS A 942 8.594 17.160 -5.457 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.282 18.342 -4.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 8.500 19.390 -6.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 9.759 19.893 -5.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 10.060 18.748 -6.551 1.00 0.00 H new ATOM 436 N ILE A 943 7.820 19.760 -0.340 1.00 0.00 N ATOM 437 CA ILE A 943 6.533 20.345 -0.675 1.00 0.00 C ATOM 438 C ILE A 943 6.546 21.833 -0.319 1.00 0.00 C ATOM 439 O ILE A 943 6.187 22.674 -1.141 1.00 0.00 O ATOM 440 CB ILE A 943 5.399 19.563 -0.009 1.00 0.00 C ATOM 441 CG1 ILE A 943 4.167 19.506 -0.914 1.00 0.00 C ATOM 442 CG2 ILE A 943 5.071 20.140 1.370 1.00 0.00 C ATOM 443 CD1 ILE A 943 3.214 20.665 -0.617 1.00 0.00 C ATOM 0 H ILE A 943 7.912 19.460 0.631 1.00 0.00 H new ATOM 0 HA ILE A 943 6.350 20.275 -1.747 1.00 0.00 H new ATOM 0 HB ILE A 943 5.735 18.537 0.143 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.477 19.544 -1.958 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.649 18.558 -0.769 1.00 0.00 H new ATOM 0 HG21 ILE A 943 4.262 19.566 1.822 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.954 20.085 2.007 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.763 21.180 1.265 1.00 0.00 H new ATOM 0 HD11 ILE A 943 2.347 20.601 -1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.887 20.610 0.421 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.728 21.611 -0.786 1.00 0.00 H new ATOM 455 N GLN A 944 6.964 22.112 0.907 1.00 0.00 N ATOM 456 CA GLN A 944 7.028 23.484 1.381 1.00 0.00 C ATOM 457 C GLN A 944 7.629 24.390 0.305 1.00 0.00 C ATOM 458 O GLN A 944 7.031 25.400 -0.065 1.00 0.00 O ATOM 459 CB GLN A 944 7.826 23.576 2.684 1.00 0.00 C ATOM 460 CG GLN A 944 6.959 24.122 3.820 1.00 0.00 C ATOM 461 CD GLN A 944 7.821 24.781 4.899 1.00 0.00 C ATOM 462 OE1 GLN A 944 8.009 25.986 4.930 1.00 0.00 O ATOM 463 NE2 GLN A 944 8.331 23.925 5.781 1.00 0.00 N ATOM 0 H GLN A 944 7.262 21.412 1.586 1.00 0.00 H new ATOM 0 HA GLN A 944 6.014 23.824 1.589 1.00 0.00 H new ATOM 0 HB2 GLN A 944 8.205 22.590 2.953 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.692 24.222 2.540 1.00 0.00 H new ATOM 0 HG2 GLN A 944 6.248 24.847 3.424 1.00 0.00 H new ATOM 0 HG3 GLN A 944 6.376 23.312 4.259 1.00 0.00 H new ATOM 0 HE21 GLN A 944 8.134 22.928 5.697 1.00 0.00 H new ATOM 0 HE22 GLN A 944 8.919 24.266 6.541 1.00 0.00 H new ATOM 472 N PRO A 945 8.834 23.987 -0.180 1.00 0.00 N ATOM 473 CA PRO A 945 9.521 24.751 -1.206 1.00 0.00 C ATOM 474 C PRO A 945 8.865 24.548 -2.573 1.00 0.00 C ATOM 475 O PRO A 945 8.545 25.516 -3.262 1.00 0.00 O ATOM 476 CB PRO A 945 10.961 24.265 -1.161 1.00 0.00 C ATOM 477 CG PRO A 945 10.927 22.928 -0.439 1.00 0.00 C ATOM 478 CD PRO A 945 9.571 22.797 0.235 1.00 0.00 C ATOM 0 HA PRO A 945 9.471 25.826 -1.033 1.00 0.00 H new ATOM 0 HB2 PRO A 945 11.368 24.156 -2.166 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.597 24.977 -0.635 1.00 0.00 H new ATOM 0 HG2 PRO A 945 11.084 22.110 -1.142 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.727 22.872 0.299 1.00 0.00 H new ATOM 0 HD2 PRO A 945 9.060 21.886 -0.077 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.671 22.751 1.319 1.00 0.00 H new ATOM 486 N ALA A 946 8.683 23.284 -2.925 1.00 0.00 N ATOM 487 CA ALA A 946 8.070 22.941 -4.197 1.00 0.00 C ATOM 488 C ALA A 946 7.028 24.001 -4.558 1.00 0.00 C ATOM 489 O ALA A 946 6.151 24.313 -3.754 1.00 0.00 O ATOM 490 CB ALA A 946 7.469 21.537 -4.113 1.00 0.00 C ATOM 0 H ALA A 946 8.950 22.484 -2.351 1.00 0.00 H new ATOM 0 HA ALA A 946 8.816 22.928 -4.991 1.00 0.00 H new ATOM 0 HB1 ALA A 946 7.009 21.280 -5.067 1.00 0.00 H new ATOM 0 HB2 ALA A 946 8.255 20.818 -3.884 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.713 21.511 -3.328 1.00 0.00 H new ATOM 496 N PRO A 947 7.161 24.540 -5.800 1.00 0.00 N ATOM 497 CA PRO A 947 6.241 25.558 -6.276 1.00 0.00 C ATOM 498 C PRO A 947 4.890 24.945 -6.650 1.00 0.00 C ATOM 499 O PRO A 947 4.715 23.729 -6.581 1.00 0.00 O ATOM 500 CB PRO A 947 6.947 26.204 -7.458 1.00 0.00 C ATOM 501 CG PRO A 947 8.024 25.221 -7.887 1.00 0.00 C ATOM 502 CD PRO A 947 8.187 24.194 -6.779 1.00 0.00 C ATOM 0 HA PRO A 947 6.005 26.301 -5.514 1.00 0.00 H new ATOM 0 HB2 PRO A 947 6.248 26.398 -8.272 1.00 0.00 H new ATOM 0 HB3 PRO A 947 7.383 27.163 -7.177 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.745 24.733 -8.821 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.965 25.741 -8.067 1.00 0.00 H new ATOM 0 HD2 PRO A 947 8.050 23.180 -7.155 1.00 0.00 H new ATOM 0 HD3 PRO A 947 9.184 24.239 -6.341 1.00 0.00 H new ATOM 510 N PRO A 948 3.944 25.837 -7.047 1.00 0.00 N ATOM 511 CA PRO A 948 2.613 25.397 -7.431 1.00 0.00 C ATOM 512 C PRO A 948 2.630 24.745 -8.816 1.00 0.00 C ATOM 513 O PRO A 948 1.687 24.051 -9.190 1.00 0.00 O ATOM 514 CB PRO A 948 1.753 26.648 -7.374 1.00 0.00 C ATOM 515 CG PRO A 948 2.719 27.821 -7.413 1.00 0.00 C ATOM 516 CD PRO A 948 4.114 27.284 -7.141 1.00 0.00 C ATOM 0 HA PRO A 948 2.217 24.628 -6.768 1.00 0.00 H new ATOM 0 HB2 PRO A 948 1.061 26.684 -8.215 1.00 0.00 H new ATOM 0 HB3 PRO A 948 1.152 26.667 -6.465 1.00 0.00 H new ATOM 0 HG2 PRO A 948 2.682 28.314 -8.385 1.00 0.00 H new ATOM 0 HG3 PRO A 948 2.445 28.567 -6.667 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.804 27.550 -7.942 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.523 27.695 -6.218 1.00 0.00 H new ATOM 524 N GLU A 949 3.713 24.993 -9.538 1.00 0.00 N ATOM 525 CA GLU A 949 3.865 24.440 -10.873 1.00 0.00 C ATOM 526 C GLU A 949 4.492 23.046 -10.801 1.00 0.00 C ATOM 527 O GLU A 949 4.347 22.248 -11.726 1.00 0.00 O ATOM 528 CB GLU A 949 4.694 25.370 -11.761 1.00 0.00 C ATOM 529 CG GLU A 949 3.895 25.813 -12.988 1.00 0.00 C ATOM 530 CD GLU A 949 4.819 26.370 -14.072 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.625 25.571 -14.597 1.00 0.00 O ATOM 532 OE2 GLU A 949 4.700 27.582 -14.352 1.00 0.00 O ATOM 0 H GLU A 949 4.494 25.569 -9.224 1.00 0.00 H new ATOM 0 HA GLU A 949 2.876 24.350 -11.323 1.00 0.00 H new ATOM 0 HB2 GLU A 949 5.003 26.245 -11.189 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.603 24.860 -12.079 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.332 24.968 -13.384 1.00 0.00 H new ATOM 0 HG3 GLU A 949 3.169 26.573 -12.699 1.00 0.00 H new ATOM 539 N GLU A 950 5.177 22.796 -9.695 1.00 0.00 N ATOM 540 CA GLU A 950 5.827 21.513 -9.491 1.00 0.00 C ATOM 541 C GLU A 950 5.028 20.665 -8.499 1.00 0.00 C ATOM 542 O GLU A 950 5.372 19.512 -8.245 1.00 0.00 O ATOM 543 CB GLU A 950 7.270 21.699 -9.015 1.00 0.00 C ATOM 544 CG GLU A 950 8.243 20.919 -9.901 1.00 0.00 C ATOM 545 CD GLU A 950 8.781 21.799 -11.031 1.00 0.00 C ATOM 546 OE1 GLU A 950 7.944 22.453 -11.689 1.00 0.00 O ATOM 547 OE2 GLU A 950 10.018 21.798 -11.212 1.00 0.00 O ATOM 0 H GLU A 950 5.296 23.461 -8.930 1.00 0.00 H new ATOM 0 HA GLU A 950 5.858 20.988 -10.446 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.528 22.758 -9.029 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.363 21.362 -7.982 1.00 0.00 H new ATOM 0 HG2 GLU A 950 9.072 20.548 -9.298 1.00 0.00 H new ATOM 0 HG3 GLU A 950 7.740 20.048 -10.321 1.00 0.00 H new ATOM 554 N TYR A 951 3.977 21.269 -7.966 1.00 0.00 N ATOM 555 CA TYR A 951 3.126 20.584 -7.008 1.00 0.00 C ATOM 556 C TYR A 951 1.946 19.908 -7.708 1.00 0.00 C ATOM 557 O TYR A 951 1.592 18.776 -7.382 1.00 0.00 O ATOM 558 CB TYR A 951 2.593 21.666 -6.067 1.00 0.00 C ATOM 559 CG TYR A 951 1.822 21.120 -4.864 1.00 0.00 C ATOM 560 CD1 TYR A 951 2.277 19.997 -4.204 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.671 21.751 -4.438 1.00 0.00 C ATOM 562 CE1 TYR A 951 1.551 19.483 -3.071 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.055 21.237 -3.305 1.00 0.00 C ATOM 564 CZ TYR A 951 0.421 20.129 -2.678 1.00 0.00 C ATOM 565 OH TYR A 951 -0.265 19.643 -1.608 1.00 0.00 O ATOM 0 H TYR A 951 3.695 22.226 -8.179 1.00 0.00 H new ATOM 0 HA TYR A 951 3.686 19.811 -6.482 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.430 22.265 -5.708 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.941 22.334 -6.630 1.00 0.00 H new ATOM 0 HD1 TYR A 951 3.178 19.503 -4.537 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.315 22.630 -4.954 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.896 18.605 -2.546 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -0.957 21.721 -2.961 1.00 0.00 H new ATOM 0 HH TYR A 951 0.368 19.322 -0.932 1.00 0.00 H new ATOM 575 N VAL A 952 1.369 20.630 -8.657 1.00 0.00 N ATOM 576 CA VAL A 952 0.236 20.114 -9.407 1.00 0.00 C ATOM 577 C VAL A 952 0.566 18.710 -9.918 1.00 0.00 C ATOM 578 O VAL A 952 -0.243 17.792 -9.786 1.00 0.00 O ATOM 579 CB VAL A 952 -0.137 21.086 -10.527 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.596 20.332 -11.777 1.00 0.00 C ATOM 581 CG2 VAL A 952 -1.205 22.077 -10.061 1.00 0.00 C ATOM 0 H VAL A 952 1.665 21.569 -8.924 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.641 20.029 -8.765 1.00 0.00 H new ATOM 0 HB VAL A 952 0.756 21.655 -10.788 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.855 21.047 -12.558 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.209 19.686 -12.128 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.469 19.725 -11.536 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.452 22.756 -10.877 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -2.100 21.532 -9.759 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -0.826 22.649 -9.214 1.00 0.00 H new ATOM 591 N PRO A 953 1.785 18.584 -10.506 1.00 0.00 N ATOM 592 CA PRO A 953 2.231 17.307 -11.038 1.00 0.00 C ATOM 593 C PRO A 953 2.638 16.356 -9.911 1.00 0.00 C ATOM 594 O PRO A 953 2.174 15.218 -9.857 1.00 0.00 O ATOM 595 CB PRO A 953 3.382 17.650 -11.970 1.00 0.00 C ATOM 596 CG PRO A 953 3.839 19.044 -11.573 1.00 0.00 C ATOM 597 CD PRO A 953 2.768 19.649 -10.680 1.00 0.00 C ATOM 0 HA PRO A 953 1.445 16.777 -11.576 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.194 16.930 -11.870 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.062 17.626 -13.012 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.793 18.998 -11.047 1.00 0.00 H new ATOM 0 HG3 PRO A 953 3.992 19.662 -12.458 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.183 19.965 -9.723 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.320 20.530 -11.140 1.00 0.00 H new ATOM 605 N MET A 954 3.501 16.857 -9.039 1.00 0.00 N ATOM 606 CA MET A 954 3.975 16.065 -7.917 1.00 0.00 C ATOM 607 C MET A 954 2.881 15.125 -7.408 1.00 0.00 C ATOM 608 O MET A 954 2.932 13.919 -7.648 1.00 0.00 O ATOM 609 CB MET A 954 4.415 16.996 -6.785 1.00 0.00 C ATOM 610 CG MET A 954 5.894 16.792 -6.450 1.00 0.00 C ATOM 611 SD MET A 954 6.138 16.879 -4.684 1.00 0.00 S ATOM 612 CE MET A 954 5.320 18.426 -4.334 1.00 0.00 C ATOM 0 H MET A 954 3.884 17.801 -9.087 1.00 0.00 H new ATOM 0 HA MET A 954 4.819 15.462 -8.253 1.00 0.00 H new ATOM 0 HB2 MET A 954 4.244 18.033 -7.075 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.809 16.809 -5.899 1.00 0.00 H new ATOM 0 HG2 MET A 954 6.230 15.825 -6.825 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.496 17.553 -6.946 1.00 0.00 H new ATOM 0 HE1 MET A 954 5.768 18.883 -3.452 1.00 0.00 H new ATOM 0 HE2 MET A 954 5.431 19.097 -5.186 1.00 0.00 H new ATOM 0 HE3 MET A 954 4.261 18.244 -4.150 1.00 0.00 H new ATOM 622 N VAL A 955 1.916 15.711 -6.714 1.00 0.00 N ATOM 623 CA VAL A 955 0.812 14.940 -6.169 1.00 0.00 C ATOM 624 C VAL A 955 0.190 14.092 -7.280 1.00 0.00 C ATOM 625 O VAL A 955 0.029 12.883 -7.127 1.00 0.00 O ATOM 626 CB VAL A 955 -0.196 15.874 -5.495 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.613 15.305 -5.581 1.00 0.00 C ATOM 628 CG2 VAL A 955 0.198 16.148 -4.042 1.00 0.00 C ATOM 0 H VAL A 955 1.876 16.711 -6.517 1.00 0.00 H new ATOM 0 HA VAL A 955 1.168 14.256 -5.398 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.184 16.823 -6.030 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.309 15.988 -5.095 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -1.894 15.185 -6.627 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.647 14.336 -5.082 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -0.534 16.814 -3.586 1.00 0.00 H new ATOM 0 HG22 VAL A 955 0.228 15.209 -3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 955 1.182 16.617 -4.014 1.00 0.00 H new ATOM 638 N LYS A 956 -0.143 14.761 -8.375 1.00 0.00 N ATOM 639 CA LYS A 956 -0.744 14.084 -9.511 1.00 0.00 C ATOM 640 C LYS A 956 -0.031 12.750 -9.740 1.00 0.00 C ATOM 641 O LYS A 956 -0.668 11.750 -10.067 1.00 0.00 O ATOM 642 CB LYS A 956 -0.748 14.998 -10.739 1.00 0.00 C ATOM 643 CG LYS A 956 -2.056 15.786 -10.831 1.00 0.00 C ATOM 644 CD LYS A 956 -3.112 15.006 -11.617 1.00 0.00 C ATOM 645 CE LYS A 956 -3.995 14.182 -10.679 1.00 0.00 C ATOM 646 NZ LYS A 956 -5.418 14.551 -10.850 1.00 0.00 N ATOM 0 H LYS A 956 -0.008 15.764 -8.499 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.790 13.856 -9.308 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.094 15.688 -10.686 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.614 14.401 -11.641 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.427 15.999 -9.829 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.873 16.746 -11.314 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.730 15.698 -12.189 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -2.623 14.347 -12.335 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.861 13.120 -10.884 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -3.692 14.348 -9.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -6.004 13.982 -10.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -5.544 15.560 -10.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.708 14.370 -11.832 1.00 0.00 H new ATOM 660 N GLU A 957 1.282 12.778 -9.560 1.00 0.00 N ATOM 661 CA GLU A 957 2.088 11.584 -9.742 1.00 0.00 C ATOM 662 C GLU A 957 1.643 10.489 -8.771 1.00 0.00 C ATOM 663 O GLU A 957 1.328 9.375 -9.187 1.00 0.00 O ATOM 664 CB GLU A 957 3.576 11.896 -9.573 1.00 0.00 C ATOM 665 CG GLU A 957 4.404 11.239 -10.679 1.00 0.00 C ATOM 666 CD GLU A 957 4.704 9.777 -10.345 1.00 0.00 C ATOM 667 OE1 GLU A 957 5.746 9.546 -9.693 1.00 0.00 O ATOM 668 OE2 GLU A 957 3.886 8.923 -10.749 1.00 0.00 O ATOM 0 H GLU A 957 1.807 13.610 -9.290 1.00 0.00 H new ATOM 0 HA GLU A 957 1.940 11.221 -10.759 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.729 12.975 -9.592 1.00 0.00 H new ATOM 0 HB3 GLU A 957 3.917 11.542 -8.600 1.00 0.00 H new ATOM 0 HG2 GLU A 957 3.865 11.296 -11.625 1.00 0.00 H new ATOM 0 HG3 GLU A 957 5.338 11.785 -10.811 1.00 0.00 H new ATOM 675 N VAL A 958 1.632 10.844 -7.494 1.00 0.00 N ATOM 676 CA VAL A 958 1.230 9.906 -6.460 1.00 0.00 C ATOM 677 C VAL A 958 0.036 9.088 -6.955 1.00 0.00 C ATOM 678 O VAL A 958 -0.025 7.878 -6.740 1.00 0.00 O ATOM 679 CB VAL A 958 0.943 10.654 -5.157 1.00 0.00 C ATOM 680 CG1 VAL A 958 0.100 9.800 -4.208 1.00 0.00 C ATOM 681 CG2 VAL A 958 2.242 11.101 -4.484 1.00 0.00 C ATOM 0 H VAL A 958 1.895 11.768 -7.152 1.00 0.00 H new ATOM 0 HA VAL A 958 2.037 9.206 -6.246 1.00 0.00 H new ATOM 0 HB VAL A 958 0.369 11.547 -5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.089 10.356 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.849 9.554 -4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 958 0.636 8.881 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 958 2.010 11.630 -3.560 1.00 0.00 H new ATOM 0 HG22 VAL A 958 2.854 10.228 -4.258 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.789 11.764 -5.154 1.00 0.00 H new ATOM 691 N GLY A 959 -0.885 9.781 -7.610 1.00 0.00 N ATOM 692 CA GLY A 959 -2.074 9.134 -8.137 1.00 0.00 C ATOM 693 C GLY A 959 -1.705 8.054 -9.156 1.00 0.00 C ATOM 694 O GLY A 959 -2.222 6.939 -9.099 1.00 0.00 O ATOM 0 H GLY A 959 -0.831 10.784 -7.787 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.643 8.689 -7.320 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.719 9.877 -8.607 1.00 0.00 H new ATOM 698 N LEU A 960 -0.813 8.422 -10.064 1.00 0.00 N ATOM 699 CA LEU A 960 -0.368 7.498 -11.094 1.00 0.00 C ATOM 700 C LEU A 960 0.159 6.222 -10.435 1.00 0.00 C ATOM 701 O LEU A 960 -0.172 5.117 -10.861 1.00 0.00 O ATOM 702 CB LEU A 960 0.644 8.175 -12.020 1.00 0.00 C ATOM 703 CG LEU A 960 0.365 8.057 -13.520 1.00 0.00 C ATOM 704 CD1 LEU A 960 1.241 9.023 -14.319 1.00 0.00 C ATOM 705 CD2 LEU A 960 0.525 6.611 -13.995 1.00 0.00 C ATOM 0 H LEU A 960 -0.386 9.347 -10.108 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.203 7.207 -11.731 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.692 9.233 -11.762 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.629 7.753 -11.820 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.672 8.342 -13.698 1.00 0.00 H new ATOM 0 HD11 LEU A 960 1.022 8.918 -15.382 1.00 0.00 H new ATOM 0 HD12 LEU A 960 1.034 10.046 -14.005 1.00 0.00 H new ATOM 0 HD13 LEU A 960 2.292 8.794 -14.140 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.321 6.555 -15.064 1.00 0.00 H new ATOM 0 HD22 LEU A 960 1.544 6.275 -13.802 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -0.176 5.972 -13.458 1.00 0.00 H new ATOM 717 N ALA A 961 0.970 6.417 -9.406 1.00 0.00 N ATOM 718 CA ALA A 961 1.546 5.295 -8.684 1.00 0.00 C ATOM 719 C ALA A 961 0.428 4.349 -8.243 1.00 0.00 C ATOM 720 O ALA A 961 0.524 3.138 -8.432 1.00 0.00 O ATOM 721 CB ALA A 961 2.369 5.816 -7.503 1.00 0.00 C ATOM 0 H ALA A 961 1.242 7.335 -9.055 1.00 0.00 H new ATOM 0 HA ALA A 961 2.220 4.730 -9.328 1.00 0.00 H new ATOM 0 HB1 ALA A 961 2.801 4.975 -6.961 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.168 6.459 -7.872 1.00 0.00 H new ATOM 0 HB3 ALA A 961 1.725 6.386 -6.834 1.00 0.00 H new ATOM 727 N LEU A 962 -0.608 4.939 -7.664 1.00 0.00 N ATOM 728 CA LEU A 962 -1.744 4.163 -7.194 1.00 0.00 C ATOM 729 C LEU A 962 -2.306 3.337 -8.353 1.00 0.00 C ATOM 730 O LEU A 962 -2.441 2.120 -8.244 1.00 0.00 O ATOM 731 CB LEU A 962 -2.778 5.075 -6.531 1.00 0.00 C ATOM 732 CG LEU A 962 -2.840 5.020 -5.003 1.00 0.00 C ATOM 733 CD1 LEU A 962 -2.080 6.193 -4.381 1.00 0.00 C ATOM 734 CD2 LEU A 962 -4.288 4.951 -4.515 1.00 0.00 C ATOM 0 H LEU A 962 -0.685 5.944 -7.510 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.432 3.459 -6.422 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.571 6.103 -6.830 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -3.762 4.821 -6.924 1.00 0.00 H new ATOM 0 HG LEU A 962 -2.346 4.106 -4.674 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -2.140 6.130 -3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -1.035 6.154 -4.690 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -2.523 7.131 -4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -4.303 4.913 -3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -4.829 5.834 -4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -4.765 4.057 -4.916 1.00 0.00 H new ATOM 746 N ARG A 963 -2.618 4.033 -9.437 1.00 0.00 N ATOM 747 CA ARG A 963 -3.162 3.379 -10.615 1.00 0.00 C ATOM 748 C ARG A 963 -2.438 2.056 -10.870 1.00 0.00 C ATOM 749 O ARG A 963 -3.074 1.011 -11.001 1.00 0.00 O ATOM 750 CB ARG A 963 -3.029 4.271 -11.851 1.00 0.00 C ATOM 751 CG ARG A 963 -4.196 4.049 -12.815 1.00 0.00 C ATOM 752 CD ARG A 963 -5.154 5.242 -12.801 1.00 0.00 C ATOM 753 NE ARG A 963 -5.298 5.792 -14.167 1.00 0.00 N ATOM 754 CZ ARG A 963 -6.026 5.217 -15.135 1.00 0.00 C ATOM 755 NH1 ARG A 963 -6.679 4.073 -14.893 1.00 0.00 N ATOM 756 NH2 ARG A 963 -6.100 5.787 -16.346 1.00 0.00 N ATOM 0 H ARG A 963 -2.504 5.043 -9.524 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.219 3.189 -10.430 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.998 5.317 -11.547 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -2.088 4.058 -12.358 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -3.814 3.897 -13.825 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -4.734 3.143 -12.537 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -6.127 4.933 -12.420 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -4.778 6.013 -12.128 1.00 0.00 H new ATOM 0 HE ARG A 963 -4.813 6.662 -14.386 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -6.623 3.639 -13.972 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -7.233 3.636 -15.630 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -5.602 6.658 -16.531 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -6.654 5.350 -17.083 1.00 0.00 H new ATOM 770 N THR A 964 -1.117 2.143 -10.931 1.00 0.00 N ATOM 771 CA THR A 964 -0.300 0.965 -11.168 1.00 0.00 C ATOM 772 C THR A 964 -0.430 -0.017 -10.002 1.00 0.00 C ATOM 773 O THR A 964 -0.380 -1.230 -10.199 1.00 0.00 O ATOM 774 CB THR A 964 1.137 1.429 -11.414 1.00 0.00 C ATOM 775 OG1 THR A 964 1.138 1.849 -12.776 1.00 0.00 O ATOM 776 CG2 THR A 964 2.139 0.273 -11.381 1.00 0.00 C ATOM 0 H THR A 964 -0.593 3.011 -10.820 1.00 0.00 H new ATOM 0 HA THR A 964 -0.637 0.420 -12.050 1.00 0.00 H new ATOM 0 HB THR A 964 1.412 2.170 -10.664 1.00 0.00 H new ATOM 0 HG1 THR A 964 2.032 2.167 -13.019 1.00 0.00 H new ATOM 0 HG21 THR A 964 3.143 0.657 -11.561 1.00 0.00 H new ATOM 0 HG22 THR A 964 2.105 -0.210 -10.405 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.884 -0.452 -12.154 1.00 0.00 H new ATOM 784 N LEU A 965 -0.594 0.544 -8.813 1.00 0.00 N ATOM 785 CA LEU A 965 -0.732 -0.268 -7.615 1.00 0.00 C ATOM 786 C LEU A 965 -1.916 -1.221 -7.784 1.00 0.00 C ATOM 787 O LEU A 965 -1.806 -2.412 -7.494 1.00 0.00 O ATOM 788 CB LEU A 965 -0.830 0.621 -6.374 1.00 0.00 C ATOM 789 CG LEU A 965 -0.227 0.049 -5.090 1.00 0.00 C ATOM 790 CD1 LEU A 965 0.541 1.124 -4.318 1.00 0.00 C ATOM 791 CD2 LEU A 965 -1.302 -0.617 -4.229 1.00 0.00 C ATOM 0 H LEU A 965 -0.634 1.551 -8.653 1.00 0.00 H new ATOM 0 HA LEU A 965 0.155 -0.884 -7.468 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -0.339 1.570 -6.591 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.882 0.841 -6.191 1.00 0.00 H new ATOM 0 HG LEU A 965 0.491 -0.724 -5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 965 0.959 0.691 -3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 965 1.348 1.512 -4.940 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -0.136 1.936 -4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.847 -1.015 -3.322 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -2.061 0.118 -3.961 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.765 -1.429 -4.789 1.00 0.00 H new ATOM 803 N LEU A 966 -3.022 -0.663 -8.252 1.00 0.00 N ATOM 804 CA LEU A 966 -4.226 -1.449 -8.463 1.00 0.00 C ATOM 805 C LEU A 966 -3.900 -2.643 -9.362 1.00 0.00 C ATOM 806 O LEU A 966 -4.199 -3.785 -9.016 1.00 0.00 O ATOM 807 CB LEU A 966 -5.355 -0.566 -8.999 1.00 0.00 C ATOM 808 CG LEU A 966 -5.980 0.407 -7.997 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.076 1.621 -7.776 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.389 0.813 -8.432 1.00 0.00 C ATOM 0 H LEU A 966 -3.110 0.325 -8.491 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.588 -1.852 -7.517 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.971 0.009 -9.842 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -6.142 -1.213 -9.387 1.00 0.00 H new ATOM 0 HG LEU A 966 -6.074 -0.103 -7.039 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.543 2.297 -7.060 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.112 1.291 -7.388 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -4.928 2.141 -8.722 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -7.810 1.505 -7.702 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.343 1.298 -9.407 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -8.019 -0.074 -8.497 1.00 0.00 H new ATOM 822 N ALA A 967 -3.290 -2.339 -10.498 1.00 0.00 N ATOM 823 CA ALA A 967 -2.920 -3.373 -11.449 1.00 0.00 C ATOM 824 C ALA A 967 -2.000 -4.385 -10.763 1.00 0.00 C ATOM 825 O ALA A 967 -2.285 -5.581 -10.753 1.00 0.00 O ATOM 826 CB ALA A 967 -2.268 -2.730 -12.675 1.00 0.00 C ATOM 0 H ALA A 967 -3.043 -1.391 -10.781 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.803 -3.911 -11.794 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.990 -3.506 -13.388 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -2.972 -2.042 -13.143 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.376 -2.183 -12.368 1.00 0.00 H new ATOM 832 N THR A 968 -0.915 -3.867 -10.206 1.00 0.00 N ATOM 833 CA THR A 968 0.048 -4.711 -9.519 1.00 0.00 C ATOM 834 C THR A 968 -0.646 -5.546 -8.441 1.00 0.00 C ATOM 835 O THR A 968 -0.279 -6.697 -8.210 1.00 0.00 O ATOM 836 CB THR A 968 1.157 -3.811 -8.969 1.00 0.00 C ATOM 837 OG1 THR A 968 0.487 -2.958 -8.047 1.00 0.00 O ATOM 838 CG2 THR A 968 1.713 -2.855 -10.026 1.00 0.00 C ATOM 0 H THR A 968 -0.682 -2.874 -10.216 1.00 0.00 H new ATOM 0 HA THR A 968 0.500 -5.430 -10.202 1.00 0.00 H new ATOM 0 HB THR A 968 1.965 -4.429 -8.578 1.00 0.00 H new ATOM 0 HG1 THR A 968 -0.472 -2.948 -8.248 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.496 -2.240 -9.584 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.127 -3.430 -10.854 1.00 0.00 H new ATOM 0 HG23 THR A 968 0.912 -2.214 -10.394 1.00 0.00 H new ATOM 846 N VAL A 969 -1.639 -4.934 -7.812 1.00 0.00 N ATOM 847 CA VAL A 969 -2.388 -5.606 -6.764 1.00 0.00 C ATOM 848 C VAL A 969 -3.111 -6.817 -7.358 1.00 0.00 C ATOM 849 O VAL A 969 -3.111 -7.896 -6.766 1.00 0.00 O ATOM 850 CB VAL A 969 -3.337 -4.618 -6.083 1.00 0.00 C ATOM 851 CG1 VAL A 969 -4.341 -5.349 -5.190 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.558 -3.569 -5.287 1.00 0.00 C ATOM 0 H VAL A 969 -1.942 -3.980 -8.008 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.715 -5.975 -5.990 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.896 -4.100 -6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -5.004 -4.624 -4.718 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.930 -6.039 -5.794 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.806 -5.906 -4.421 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -3.256 -2.879 -4.813 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.960 -4.063 -4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.902 -3.016 -5.959 1.00 0.00 H new ATOM 862 N ASP A 970 -3.710 -6.598 -8.519 1.00 0.00 N ATOM 863 CA ASP A 970 -4.435 -7.658 -9.199 1.00 0.00 C ATOM 864 C ASP A 970 -3.555 -8.908 -9.270 1.00 0.00 C ATOM 865 O ASP A 970 -4.039 -10.023 -9.087 1.00 0.00 O ATOM 866 CB ASP A 970 -4.794 -7.250 -10.629 1.00 0.00 C ATOM 867 CG ASP A 970 -5.676 -8.247 -11.384 1.00 0.00 C ATOM 868 OD1 ASP A 970 -5.095 -9.160 -12.009 1.00 0.00 O ATOM 869 OD2 ASP A 970 -6.912 -8.073 -11.318 1.00 0.00 O ATOM 0 H ASP A 970 -3.708 -5.702 -9.006 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.350 -7.853 -8.640 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -5.304 -6.287 -10.599 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.872 -7.105 -11.192 1.00 0.00 H new ATOM 874 N GLU A 971 -2.277 -8.678 -9.537 1.00 0.00 N ATOM 875 CA GLU A 971 -1.325 -9.772 -9.634 1.00 0.00 C ATOM 876 C GLU A 971 -0.928 -10.256 -8.238 1.00 0.00 C ATOM 877 O GLU A 971 -0.480 -11.390 -8.075 1.00 0.00 O ATOM 878 CB GLU A 971 -0.094 -9.356 -10.441 1.00 0.00 C ATOM 879 CG GLU A 971 -0.475 -9.005 -11.881 1.00 0.00 C ATOM 880 CD GLU A 971 0.753 -9.029 -12.794 1.00 0.00 C ATOM 881 OE1 GLU A 971 1.431 -7.981 -12.861 1.00 0.00 O ATOM 882 OE2 GLU A 971 0.986 -10.094 -13.405 1.00 0.00 O ATOM 0 H GLU A 971 -1.879 -7.751 -9.689 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.802 -10.598 -10.161 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.382 -8.498 -9.968 1.00 0.00 H new ATOM 0 HB3 GLU A 971 0.636 -10.166 -10.441 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.219 -9.713 -12.247 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.934 -8.017 -11.909 1.00 0.00 H new ATOM 889 N SER A 972 -1.107 -9.372 -7.267 1.00 0.00 N ATOM 890 CA SER A 972 -0.773 -9.696 -5.891 1.00 0.00 C ATOM 891 C SER A 972 -1.949 -10.407 -5.220 1.00 0.00 C ATOM 892 O SER A 972 -1.763 -11.149 -4.256 1.00 0.00 O ATOM 893 CB SER A 972 -0.396 -8.438 -5.105 1.00 0.00 C ATOM 894 OG SER A 972 0.026 -8.743 -3.779 1.00 0.00 O ATOM 0 H SER A 972 -1.479 -8.432 -7.406 1.00 0.00 H new ATOM 0 HA SER A 972 0.090 -10.361 -5.897 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.402 -7.910 -5.627 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.252 -7.764 -5.067 1.00 0.00 H new ATOM 0 HG SER A 972 0.259 -7.914 -3.311 1.00 0.00 H new ATOM 900 N LEU A 973 -3.135 -10.156 -5.756 1.00 0.00 N ATOM 901 CA LEU A 973 -4.342 -10.763 -5.221 1.00 0.00 C ATOM 902 C LEU A 973 -4.108 -12.262 -5.021 1.00 0.00 C ATOM 903 O LEU A 973 -4.340 -12.791 -3.935 1.00 0.00 O ATOM 904 CB LEU A 973 -5.543 -10.442 -6.112 1.00 0.00 C ATOM 905 CG LEU A 973 -6.745 -9.804 -5.413 1.00 0.00 C ATOM 906 CD1 LEU A 973 -8.058 -10.268 -6.045 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.709 -10.070 -3.906 1.00 0.00 C ATOM 0 H LEU A 973 -3.285 -9.540 -6.555 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.578 -10.343 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -5.212 -9.773 -6.906 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.873 -11.365 -6.589 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.685 -8.724 -5.551 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.896 -9.799 -5.529 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -8.075 -9.984 -7.097 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.140 -11.352 -5.960 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.575 -9.605 -3.434 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.730 -11.145 -3.726 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.796 -9.649 -3.484 1.00 0.00 H new ATOM 919 N PRO A 974 -3.639 -12.922 -6.114 1.00 0.00 N ATOM 920 CA PRO A 974 -3.371 -14.349 -6.069 1.00 0.00 C ATOM 921 C PRO A 974 -2.082 -14.641 -5.298 1.00 0.00 C ATOM 922 O PRO A 974 -1.960 -15.685 -4.659 1.00 0.00 O ATOM 923 CB PRO A 974 -3.303 -14.783 -7.524 1.00 0.00 C ATOM 924 CG PRO A 974 -3.073 -13.513 -8.327 1.00 0.00 C ATOM 925 CD PRO A 974 -3.353 -12.328 -7.417 1.00 0.00 C ATOM 0 HA PRO A 974 -4.143 -14.905 -5.537 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.494 -15.497 -7.681 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -4.226 -15.276 -7.828 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -2.049 -13.476 -8.697 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.728 -13.488 -9.198 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.496 -11.656 -7.367 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.197 -11.741 -7.779 1.00 0.00 H new ATOM 933 N VAL A 975 -1.154 -13.700 -5.382 1.00 0.00 N ATOM 934 CA VAL A 975 0.121 -13.843 -4.700 1.00 0.00 C ATOM 935 C VAL A 975 -0.124 -14.291 -3.258 1.00 0.00 C ATOM 936 O VAL A 975 0.720 -14.954 -2.658 1.00 0.00 O ATOM 937 CB VAL A 975 0.914 -12.538 -4.794 1.00 0.00 C ATOM 938 CG1 VAL A 975 1.984 -12.467 -3.702 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.535 -12.372 -6.182 1.00 0.00 C ATOM 0 H VAL A 975 -1.259 -12.835 -5.912 1.00 0.00 H new ATOM 0 HA VAL A 975 0.727 -14.611 -5.180 1.00 0.00 H new ATOM 0 HB VAL A 975 0.220 -11.712 -4.637 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.533 -11.530 -3.791 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.508 -12.517 -2.723 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.674 -13.304 -3.813 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.093 -11.436 -6.221 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.209 -13.205 -6.381 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.746 -12.356 -6.934 1.00 0.00 H new ATOM 949 N LEU A 976 -1.285 -13.911 -2.743 1.00 0.00 N ATOM 950 CA LEU A 976 -1.652 -14.266 -1.383 1.00 0.00 C ATOM 951 C LEU A 976 -2.740 -15.341 -1.417 1.00 0.00 C ATOM 952 O LEU A 976 -3.546 -15.385 -2.346 1.00 0.00 O ATOM 953 CB LEU A 976 -2.046 -13.017 -0.592 1.00 0.00 C ATOM 954 CG LEU A 976 -0.988 -11.915 -0.508 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.366 -12.485 -0.079 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.893 -11.144 -1.826 1.00 0.00 C ATOM 0 H LEU A 976 -1.983 -13.361 -3.243 1.00 0.00 H new ATOM 0 HA LEU A 976 -0.798 -14.693 -0.857 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.946 -12.596 -1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.307 -13.321 0.422 1.00 0.00 H new ATOM 0 HG LEU A 976 -1.296 -11.205 0.259 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.100 -11.680 -0.027 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.270 -12.952 0.901 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.694 -13.229 -0.805 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.134 -10.367 -1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.621 -11.829 -2.629 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.857 -10.686 -2.050 1.00 0.00 H new ATOM 968 N PRO A 977 -2.729 -16.203 -0.366 1.00 0.00 N ATOM 969 CA PRO A 977 -3.705 -17.275 -0.266 1.00 0.00 C ATOM 970 C PRO A 977 -5.074 -16.733 0.148 1.00 0.00 C ATOM 971 O PRO A 977 -5.547 -17.008 1.250 1.00 0.00 O ATOM 972 CB PRO A 977 -3.120 -18.248 0.745 1.00 0.00 C ATOM 973 CG PRO A 977 -2.070 -17.465 1.517 1.00 0.00 C ATOM 974 CD PRO A 977 -1.790 -16.181 0.752 1.00 0.00 C ATOM 0 HA PRO A 977 -3.883 -17.772 -1.220 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -3.893 -18.629 1.413 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -2.676 -19.110 0.246 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -2.424 -17.240 2.523 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -1.158 -18.052 1.624 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -1.944 -15.304 1.381 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -0.758 -16.146 0.402 1.00 0.00 H new ATOM 982 N ALA A 978 -5.673 -15.972 -0.756 1.00 0.00 N ATOM 983 CA ALA A 978 -6.978 -15.389 -0.498 1.00 0.00 C ATOM 984 C ALA A 978 -7.074 -14.997 0.978 1.00 0.00 C ATOM 985 O ALA A 978 -6.065 -14.688 1.609 1.00 0.00 O ATOM 986 CB ALA A 978 -8.070 -16.378 -0.911 1.00 0.00 C ATOM 0 H ALA A 978 -5.278 -15.746 -1.669 1.00 0.00 H new ATOM 0 HA ALA A 978 -7.118 -14.484 -1.089 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.049 -15.940 -0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -7.976 -16.601 -1.974 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -7.964 -17.298 -0.336 1.00 0.00 H new ATOM 992 N SER A 979 -8.298 -15.023 1.485 1.00 0.00 N ATOM 993 CA SER A 979 -8.539 -14.675 2.875 1.00 0.00 C ATOM 994 C SER A 979 -8.370 -13.167 3.074 1.00 0.00 C ATOM 995 O SER A 979 -9.290 -12.490 3.530 1.00 0.00 O ATOM 996 CB SER A 979 -7.598 -15.441 3.807 1.00 0.00 C ATOM 997 OG SER A 979 -8.300 -16.368 4.631 1.00 0.00 O ATOM 0 H SER A 979 -9.133 -15.280 0.958 1.00 0.00 H new ATOM 0 HA SER A 979 -9.562 -14.956 3.125 1.00 0.00 H new ATOM 0 HB2 SER A 979 -6.855 -15.974 3.214 1.00 0.00 H new ATOM 0 HB3 SER A 979 -7.057 -14.734 4.436 1.00 0.00 H new ATOM 0 HG SER A 979 -7.972 -17.275 4.456 1.00 0.00 H new ATOM 1003 N THR A 980 -7.187 -12.685 2.721 1.00 0.00 N ATOM 1004 CA THR A 980 -6.886 -11.270 2.855 1.00 0.00 C ATOM 1005 C THR A 980 -7.565 -10.472 1.740 1.00 0.00 C ATOM 1006 O THR A 980 -7.524 -9.243 1.737 1.00 0.00 O ATOM 1007 CB THR A 980 -5.364 -11.110 2.875 1.00 0.00 C ATOM 1008 OG1 THR A 980 -5.159 -9.712 2.691 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.692 -11.749 1.658 1.00 0.00 C ATOM 0 H THR A 980 -6.426 -13.249 2.343 1.00 0.00 H new ATOM 0 HA THR A 980 -7.282 -10.868 3.788 1.00 0.00 H new ATOM 0 HB THR A 980 -4.964 -11.556 3.786 1.00 0.00 H new ATOM 0 HG1 THR A 980 -6.023 -9.249 2.709 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.613 -11.607 1.722 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.917 -12.815 1.636 1.00 0.00 H new ATOM 0 HG23 THR A 980 -5.067 -11.281 0.748 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.176 -11.205 0.819 1.00 0.00 N ATOM 1018 CA HIS A 981 -8.863 -10.581 -0.298 1.00 0.00 C ATOM 1019 C HIS A 981 -9.805 -9.493 0.221 1.00 0.00 C ATOM 1020 O HIS A 981 -9.603 -8.310 -0.050 1.00 0.00 O ATOM 1021 CB HIS A 981 -9.582 -11.631 -1.148 1.00 0.00 C ATOM 1022 CG HIS A 981 -8.675 -12.377 -2.098 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -9.156 -13.177 -3.120 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -7.315 -12.435 -2.172 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -8.122 -13.690 -3.772 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -6.982 -13.229 -3.182 1.00 0.00 N ATOM 0 H HIS A 981 -8.209 -12.224 0.825 1.00 0.00 H new ATOM 0 HA HIS A 981 -8.137 -10.101 -0.954 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -10.068 -12.348 -0.487 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -10.369 -11.142 -1.722 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -6.625 -11.921 -1.519 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -8.173 -14.356 -4.621 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -6.030 -13.457 -3.470 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.815 -9.932 0.958 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.789 -9.010 1.518 1.00 0.00 C ATOM 1036 C ARG A 982 -11.106 -7.707 1.937 1.00 0.00 C ATOM 1037 O ARG A 982 -11.334 -6.660 1.333 1.00 0.00 O ATOM 1038 CB ARG A 982 -12.493 -9.622 2.730 1.00 0.00 C ATOM 1039 CG ARG A 982 -14.011 -9.468 2.618 1.00 0.00 C ATOM 1040 CD ARG A 982 -14.710 -10.822 2.749 1.00 0.00 C ATOM 1041 NE ARG A 982 -14.825 -11.197 4.176 1.00 0.00 N ATOM 1042 CZ ARG A 982 -15.660 -10.608 5.043 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -16.459 -9.613 4.633 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -15.697 -11.014 6.319 1.00 0.00 N ATOM 0 H ARG A 982 -10.980 -10.914 1.180 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.532 -8.803 0.747 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.236 -10.678 2.809 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -12.141 -9.139 3.642 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -14.370 -8.793 3.395 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -14.265 -9.015 1.660 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -15.700 -10.774 2.296 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -14.149 -11.584 2.208 1.00 0.00 H new ATOM 0 HE ARG A 982 -14.231 -11.951 4.521 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -16.431 -9.304 3.661 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -17.095 -9.165 5.293 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -15.089 -11.772 6.631 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -16.333 -10.565 6.979 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.281 -7.813 2.969 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.564 -6.656 3.476 1.00 0.00 C ATOM 1060 C GLU A 983 -8.757 -5.999 2.355 1.00 0.00 C ATOM 1061 O GLU A 983 -8.690 -4.773 2.270 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.660 -7.042 4.649 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.465 -7.163 5.945 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.549 -7.086 7.168 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -8.125 -5.955 7.489 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -8.294 -8.160 7.755 1.00 0.00 O ATOM 0 H GLU A 983 -10.094 -8.683 3.468 1.00 0.00 H new ATOM 0 HA GLU A 983 -10.293 -5.934 3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -8.165 -7.989 4.435 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.877 -6.293 4.771 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -10.208 -6.367 5.992 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.009 -8.107 5.953 1.00 0.00 H new ATOM 1073 N ILE A 984 -8.164 -6.842 1.523 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.364 -6.358 0.411 1.00 0.00 C ATOM 1075 C ILE A 984 -8.229 -5.470 -0.485 1.00 0.00 C ATOM 1076 O ILE A 984 -7.804 -4.388 -0.888 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.712 -7.528 -0.329 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.393 -7.931 0.336 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.530 -7.206 -1.813 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.896 -9.273 -0.203 1.00 0.00 C ATOM 0 H ILE A 984 -8.222 -7.858 1.597 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.541 -5.741 0.773 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.381 -8.387 -0.266 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.641 -7.162 0.157 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.531 -7.997 1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -6.065 -8.054 -2.315 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.502 -7.006 -2.264 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.893 -6.328 -1.919 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.958 -9.536 0.285 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.639 -10.044 -0.001 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.736 -9.196 -1.278 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.426 -5.959 -0.771 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.355 -5.223 -1.612 1.00 0.00 C ATOM 1094 C GLU A 985 -10.705 -3.880 -0.967 1.00 0.00 C ATOM 1095 O GLU A 985 -10.755 -2.856 -1.646 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.616 -6.045 -1.887 1.00 0.00 C ATOM 1097 CG GLU A 985 -12.044 -5.919 -3.350 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.422 -5.264 -3.463 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -14.417 -6.011 -3.348 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -13.450 -4.030 -3.663 1.00 0.00 O ATOM 0 H GLU A 985 -9.775 -6.857 -0.435 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.872 -5.029 -2.570 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.431 -7.092 -1.647 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.424 -5.707 -1.238 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -11.310 -5.328 -3.898 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -12.067 -6.906 -3.812 1.00 0.00 H new ATOM 1107 N MET A 986 -10.938 -3.929 0.336 1.00 0.00 N ATOM 1108 CA MET A 986 -11.282 -2.729 1.080 1.00 0.00 C ATOM 1109 C MET A 986 -10.048 -1.854 1.310 1.00 0.00 C ATOM 1110 O MET A 986 -10.167 -0.645 1.501 1.00 0.00 O ATOM 1111 CB MET A 986 -11.888 -3.121 2.429 1.00 0.00 C ATOM 1112 CG MET A 986 -13.401 -3.321 2.313 1.00 0.00 C ATOM 1113 SD MET A 986 -13.873 -4.863 3.078 1.00 0.00 S ATOM 1114 CE MET A 986 -14.196 -5.845 1.624 1.00 0.00 C ATOM 0 H MET A 986 -10.895 -4.781 0.896 1.00 0.00 H new ATOM 0 HA MET A 986 -12.006 -2.158 0.498 1.00 0.00 H new ATOM 0 HB2 MET A 986 -11.423 -4.039 2.788 1.00 0.00 H new ATOM 0 HB3 MET A 986 -11.675 -2.347 3.166 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.923 -2.493 2.792 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.697 -3.320 1.264 1.00 0.00 H new ATOM 0 HE1 MET A 986 -13.802 -6.851 1.769 1.00 0.00 H new ATOM 0 HE2 MET A 986 -15.271 -5.898 1.452 1.00 0.00 H new ATOM 0 HE3 MET A 986 -13.713 -5.387 0.761 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.891 -2.499 1.284 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.636 -1.795 1.487 1.00 0.00 C ATOM 1126 C ALA A 987 -7.315 -0.965 0.243 1.00 0.00 C ATOM 1127 O ALA A 987 -6.666 0.075 0.336 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.533 -2.802 1.817 1.00 0.00 C ATOM 0 H ALA A 987 -8.796 -3.502 1.125 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.713 -1.109 2.330 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.592 -2.274 1.969 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.796 -3.345 2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.425 -3.506 0.992 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.785 -1.456 -0.895 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.556 -0.773 -2.156 1.00 0.00 C ATOM 1136 C GLN A 988 -8.432 0.478 -2.249 1.00 0.00 C ATOM 1137 O GLN A 988 -7.962 1.541 -2.653 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.809 -1.708 -3.340 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.543 -2.485 -3.706 1.00 0.00 C ATOM 1140 CD GLN A 988 -5.974 -2.008 -5.044 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -6.513 -2.271 -6.106 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -4.858 -1.293 -4.933 1.00 0.00 N ATOM 0 H GLN A 988 -8.323 -2.319 -0.969 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.511 -0.465 -2.195 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.609 -2.406 -3.092 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -8.146 -1.129 -4.200 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -5.795 -2.358 -2.923 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -6.769 -3.550 -3.762 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -4.459 -1.109 -4.012 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -4.401 -0.928 -5.769 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.689 0.311 -1.868 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.635 1.414 -1.903 1.00 0.00 C ATOM 1153 C LYS A 989 -10.217 2.471 -0.880 1.00 0.00 C ATOM 1154 O LYS A 989 -10.448 3.662 -1.083 1.00 0.00 O ATOM 1155 CB LYS A 989 -12.063 0.901 -1.708 1.00 0.00 C ATOM 1156 CG LYS A 989 -13.062 2.060 -1.671 1.00 0.00 C ATOM 1157 CD LYS A 989 -13.804 2.101 -0.334 1.00 0.00 C ATOM 1158 CE LYS A 989 -15.305 1.880 -0.534 1.00 0.00 C ATOM 1159 NZ LYS A 989 -16.059 2.334 0.657 1.00 0.00 N ATOM 0 H LYS A 989 -10.075 -0.572 -1.533 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.624 1.894 -2.881 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.322 0.219 -2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -12.125 0.333 -0.780 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.537 3.002 -1.829 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -13.778 1.954 -2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -13.405 1.335 0.331 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -13.636 3.063 0.150 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -15.644 2.424 -1.416 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -15.502 0.823 -0.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -17.076 2.177 0.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -15.747 1.797 1.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -15.885 3.347 0.813 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.607 1.998 0.197 1.00 0.00 N ATOM 1174 CA LEU A 990 -9.154 2.888 1.253 1.00 0.00 C ATOM 1175 C LEU A 990 -8.024 3.771 0.719 1.00 0.00 C ATOM 1176 O LEU A 990 -8.156 4.992 0.669 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.775 2.090 2.501 1.00 0.00 C ATOM 1178 CG LEU A 990 -9.408 2.556 3.814 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -9.352 1.452 4.872 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.762 3.853 4.304 1.00 0.00 C ATOM 0 H LEU A 990 -9.416 1.010 0.361 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.960 3.554 1.563 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -9.049 1.048 2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.691 2.121 2.612 1.00 0.00 H new ATOM 0 HG LEU A 990 -10.460 2.771 3.629 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -9.808 1.809 5.795 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -9.895 0.577 4.514 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -8.313 1.182 5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -9.230 4.162 5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.697 3.689 4.468 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.898 4.633 3.555 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.937 3.117 0.335 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.784 3.826 -0.192 1.00 0.00 C ATOM 1194 C LEU A 991 -6.259 4.922 -1.149 1.00 0.00 C ATOM 1195 O LEU A 991 -5.825 6.069 -1.050 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.794 2.846 -0.823 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.502 3.456 -1.370 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.722 4.171 -0.264 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.652 2.398 -2.077 1.00 0.00 C ATOM 0 H LEU A 991 -6.831 2.103 0.379 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.239 4.319 0.613 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.531 2.096 -0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.298 2.324 -1.636 1.00 0.00 H new ATOM 0 HG LEU A 991 -3.768 4.206 -2.115 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -1.808 4.596 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.335 4.969 0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.467 3.458 0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -1.740 2.858 -2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.394 1.608 -1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.216 1.973 -2.907 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.144 4.530 -2.054 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.682 5.464 -3.028 1.00 0.00 C ATOM 1213 C ASN A 992 -8.432 6.580 -2.298 1.00 0.00 C ATOM 1214 O ASN A 992 -8.054 7.747 -2.386 1.00 0.00 O ATOM 1215 CB ASN A 992 -8.668 4.771 -3.971 1.00 0.00 C ATOM 1216 CG ASN A 992 -8.337 5.077 -5.433 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.935 5.932 -6.065 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -7.353 4.334 -5.932 1.00 0.00 N ATOM 0 H ASN A 992 -7.502 3.578 -2.133 1.00 0.00 H new ATOM 0 HA ASN A 992 -6.849 5.863 -3.607 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.639 3.694 -3.806 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -9.683 5.100 -3.748 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -7.057 4.463 -6.899 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -6.895 3.635 -5.347 1.00 0.00 H new ATOM 1225 N SER A 993 -9.481 6.182 -1.593 1.00 0.00 N ATOM 1226 CA SER A 993 -10.287 7.134 -0.848 1.00 0.00 C ATOM 1227 C SER A 993 -9.381 8.120 -0.108 1.00 0.00 C ATOM 1228 O SER A 993 -9.522 9.333 -0.262 1.00 0.00 O ATOM 1229 CB SER A 993 -11.211 6.419 0.139 1.00 0.00 C ATOM 1230 OG SER A 993 -12.568 6.430 -0.295 1.00 0.00 O ATOM 0 H SER A 993 -9.791 5.213 -1.522 1.00 0.00 H new ATOM 0 HA SER A 993 -10.910 7.683 -1.555 1.00 0.00 H new ATOM 0 HB2 SER A 993 -10.879 5.388 0.265 1.00 0.00 H new ATOM 0 HB3 SER A 993 -11.139 6.898 1.115 1.00 0.00 H new ATOM 0 HG SER A 993 -13.125 5.962 0.362 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.472 7.564 0.678 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.543 8.380 1.442 1.00 0.00 C ATOM 1238 C ASP A 994 -6.659 9.175 0.480 1.00 0.00 C ATOM 1239 O ASP A 994 -6.212 10.274 0.806 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.633 7.510 2.312 1.00 0.00 C ATOM 1241 CG ASP A 994 -6.900 7.598 3.816 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -7.631 8.532 4.209 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -6.367 6.728 4.538 1.00 0.00 O ATOM 0 H ASP A 994 -8.358 6.558 0.803 1.00 0.00 H new ATOM 0 HA ASP A 994 -8.124 9.045 2.081 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -6.741 6.471 1.999 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.597 7.793 2.125 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.433 8.589 -0.687 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.610 9.229 -1.699 1.00 0.00 C ATOM 1250 C LEU A 995 -6.341 10.459 -2.242 1.00 0.00 C ATOM 1251 O LEU A 995 -5.823 11.573 -2.175 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.211 8.223 -2.780 1.00 0.00 C ATOM 1253 CG LEU A 995 -5.111 8.774 -4.204 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -3.922 9.727 -4.342 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -5.058 7.639 -5.229 1.00 0.00 C ATOM 0 H LEU A 995 -6.806 7.678 -0.954 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.675 9.581 -1.263 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -4.247 7.792 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -5.936 7.409 -2.777 1.00 0.00 H new ATOM 0 HG LEU A 995 -6.012 9.352 -4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -3.874 10.104 -5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -4.043 10.562 -3.652 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -3.000 9.195 -4.108 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -4.987 8.058 -6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -4.187 7.014 -5.035 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -5.962 7.036 -5.151 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.532 10.215 -2.767 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.340 11.289 -3.321 1.00 0.00 C ATOM 1269 C ALA A 996 -8.320 12.482 -2.364 1.00 0.00 C ATOM 1270 O ALA A 996 -8.127 13.620 -2.789 1.00 0.00 O ATOM 1271 CB ALA A 996 -9.757 10.777 -3.586 1.00 0.00 C ATOM 0 H ALA A 996 -7.958 9.290 -2.821 1.00 0.00 H new ATOM 0 HA ALA A 996 -7.931 11.625 -4.274 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -10.363 11.582 -4.001 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -9.718 9.949 -4.294 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.201 10.434 -2.651 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.522 12.181 -1.089 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.530 13.215 -0.068 1.00 0.00 C ATOM 1279 C GLU A 997 -7.222 14.008 -0.106 1.00 0.00 C ATOM 1280 O GLU A 997 -7.218 15.216 0.123 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.768 12.614 1.318 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.323 13.664 2.283 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.724 13.280 2.764 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -11.628 13.237 1.901 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -10.860 13.040 3.983 1.00 0.00 O ATOM 0 H GLU A 997 -8.681 11.236 -0.740 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.352 13.899 -0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.466 11.780 1.242 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -7.833 12.213 1.710 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.656 13.765 3.139 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -9.358 14.635 1.789 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.144 13.295 -0.396 1.00 0.00 N ATOM 1293 CA LEU A 998 -4.832 13.917 -0.466 1.00 0.00 C ATOM 1294 C LEU A 998 -4.745 14.772 -1.732 1.00 0.00 C ATOM 1295 O LEU A 998 -4.222 15.885 -1.699 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.732 12.860 -0.361 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.315 13.388 -0.123 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -1.454 12.343 0.589 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.679 13.859 -1.432 1.00 0.00 C ATOM 0 H LEU A 998 -6.152 12.293 -0.585 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.681 14.585 0.382 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -3.986 12.179 0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.730 12.273 -1.280 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.379 14.255 0.534 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.452 12.743 0.746 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -1.902 12.097 1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -1.394 11.443 -0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.673 14.229 -1.235 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.628 13.025 -2.132 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.282 14.658 -1.863 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.266 14.220 -2.818 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.254 14.918 -4.092 1.00 0.00 C ATOM 1313 C ILE A 999 -5.925 16.283 -3.927 1.00 0.00 C ATOM 1314 O ILE A 999 -5.397 17.297 -4.382 1.00 0.00 O ATOM 1315 CB ILE A 999 -5.885 14.051 -5.184 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.136 12.725 -5.332 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -5.969 14.813 -6.508 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -3.940 12.873 -6.274 1.00 0.00 C ATOM 0 H ILE A 999 -5.699 13.297 -2.842 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.230 15.103 -4.415 1.00 0.00 H new ATOM 0 HB ILE A 999 -6.906 13.812 -4.884 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -4.794 12.386 -4.354 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -5.813 11.962 -5.715 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.421 14.175 -7.267 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -6.579 15.707 -6.375 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -4.967 15.101 -6.826 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.425 11.916 -6.362 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.288 13.189 -7.257 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.253 13.619 -5.875 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.078 16.266 -3.275 1.00 0.00 N ATOM 1331 CA ASN A1000 -7.826 17.490 -3.044 1.00 0.00 C ATOM 1332 C ASN A1000 -6.965 18.463 -2.236 1.00 0.00 C ATOM 1333 O ASN A1000 -6.756 19.603 -2.649 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.102 17.214 -2.247 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.053 18.411 -2.302 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -10.135 19.127 -3.286 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -10.764 18.588 -1.192 1.00 0.00 N ATOM 0 H ASN A1000 -7.513 15.423 -2.899 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.091 17.911 -4.014 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.600 16.331 -2.646 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -8.847 16.995 -1.210 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -11.427 19.361 -1.129 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -10.646 17.951 -0.404 1.00 0.00 H new ATOM 1344 N LYS A1001 -6.490 17.979 -1.098 1.00 0.00 N ATOM 1345 CA LYS A1001 -5.657 18.792 -0.229 1.00 0.00 C ATOM 1346 C LYS A1001 -4.694 19.621 -1.081 1.00 0.00 C ATOM 1347 O LYS A1001 -4.360 20.750 -0.726 1.00 0.00 O ATOM 1348 CB LYS A1001 -4.958 17.918 0.815 1.00 0.00 C ATOM 1349 CG LYS A1001 -5.879 17.642 2.005 1.00 0.00 C ATOM 1350 CD LYS A1001 -6.072 18.902 2.852 1.00 0.00 C ATOM 1351 CE LYS A1001 -7.516 19.015 3.344 1.00 0.00 C ATOM 1352 NZ LYS A1001 -7.633 20.079 4.367 1.00 0.00 N ATOM 0 H LYS A1001 -6.666 17.034 -0.758 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.269 19.495 0.336 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -4.653 16.975 0.360 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -4.050 18.413 1.160 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -6.846 17.288 1.647 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -5.457 16.847 2.620 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -5.394 18.879 3.705 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -5.814 19.783 2.264 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -8.176 19.235 2.505 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -7.839 18.062 3.763 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -8.619 20.143 4.690 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -7.018 19.853 5.175 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -7.344 20.989 3.956 1.00 0.00 H new ATOM 1366 N MET A1002 -4.275 19.028 -2.189 1.00 0.00 N ATOM 1367 CA MET A1002 -3.357 19.698 -3.095 1.00 0.00 C ATOM 1368 C MET A1002 -4.098 20.694 -3.989 1.00 0.00 C ATOM 1369 O MET A1002 -3.743 21.870 -4.041 1.00 0.00 O ATOM 1370 CB MET A1002 -2.649 18.658 -3.965 1.00 0.00 C ATOM 1371 CG MET A1002 -1.643 19.324 -4.907 1.00 0.00 C ATOM 1372 SD MET A1002 -1.860 18.706 -6.567 1.00 0.00 S ATOM 1373 CE MET A1002 -3.278 19.666 -7.072 1.00 0.00 C ATOM 0 H MET A1002 -4.554 18.091 -2.480 1.00 0.00 H new ATOM 0 HA MET A1002 -2.626 20.247 -2.502 1.00 0.00 H new ATOM 0 HB2 MET A1002 -2.135 17.936 -3.330 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.385 18.103 -4.547 1.00 0.00 H new ATOM 0 HG2 MET A1002 -1.779 20.405 -4.892 1.00 0.00 H new ATOM 0 HG3 MET A1002 -0.627 19.126 -4.566 1.00 0.00 H new ATOM 0 HE1 MET A1002 -3.259 19.802 -8.153 1.00 0.00 H new ATOM 0 HE2 MET A1002 -4.191 19.143 -6.788 1.00 0.00 H new ATOM 0 HE3 MET A1002 -3.251 20.640 -6.584 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.114 20.185 -4.671 1.00 0.00 N ATOM 1384 CA LYS A1003 -5.908 21.015 -5.561 1.00 0.00 C ATOM 1385 C LYS A1003 -6.270 22.319 -4.847 1.00 0.00 C ATOM 1386 O LYS A1003 -6.520 23.336 -5.492 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.121 20.239 -6.077 1.00 0.00 C ATOM 1388 CG LYS A1003 -6.978 19.926 -7.568 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.344 19.894 -8.255 1.00 0.00 C ATOM 1390 CE LYS A1003 -8.862 21.311 -8.512 1.00 0.00 C ATOM 1391 NZ LYS A1003 -9.280 21.463 -9.923 1.00 0.00 N ATOM 0 H LYS A1003 -5.405 19.209 -4.625 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.332 21.285 -6.446 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.229 19.311 -5.516 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.028 20.821 -5.909 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.346 20.677 -8.042 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.480 18.965 -7.695 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.268 19.354 -9.199 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -9.055 19.350 -7.633 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.704 21.522 -7.853 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -8.084 22.037 -8.277 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -9.629 22.430 -10.080 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -8.468 21.282 -10.547 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -10.038 20.783 -10.136 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.287 22.247 -3.524 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.615 23.409 -2.715 1.00 0.00 C ATOM 1407 C LEU A1004 -5.346 24.228 -2.470 1.00 0.00 C ATOM 1408 O LEU A1004 -5.309 25.424 -2.758 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.330 22.984 -1.431 1.00 0.00 C ATOM 1410 CG LEU A1004 -8.497 22.010 -1.605 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -8.866 21.353 -0.274 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -9.697 22.703 -2.254 1.00 0.00 C ATOM 0 H LEU A1004 -6.079 21.402 -2.992 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.316 24.055 -3.243 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -6.598 22.528 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -7.701 23.879 -0.932 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.180 21.215 -2.280 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -9.698 20.666 -0.426 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -8.007 20.803 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -9.156 22.121 0.443 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.513 21.989 -2.366 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -10.024 23.531 -1.624 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.411 23.084 -3.234 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.337 23.552 -1.940 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.069 24.203 -1.653 1.00 0.00 C ATOM 1426 C ALA A1005 -2.666 25.074 -2.844 1.00 0.00 C ATOM 1427 O ALA A1005 -2.168 26.184 -2.666 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.016 23.144 -1.321 1.00 0.00 C ATOM 0 H ALA A1005 -4.371 22.561 -1.702 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.160 24.856 -0.785 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.065 23.631 -1.106 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.336 22.573 -0.450 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -1.895 22.472 -2.171 1.00 0.00 H new ATOM 1434 N GLN A1006 -2.897 24.537 -4.033 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.564 25.251 -5.254 1.00 0.00 C ATOM 1436 C GLN A1006 -3.062 26.696 -5.176 1.00 0.00 C ATOM 1437 O GLN A1006 -2.358 27.622 -5.576 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.138 24.539 -6.480 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.924 25.370 -7.747 1.00 0.00 C ATOM 1440 CD GLN A1006 -1.447 25.727 -7.926 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -0.900 26.575 -7.241 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -0.835 25.035 -8.883 1.00 0.00 N ATOM 0 H GLN A1006 -3.311 23.616 -4.177 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.479 25.266 -5.359 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -2.663 23.565 -6.595 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -4.203 24.359 -6.335 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -3.275 24.812 -8.615 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -3.518 26.282 -7.693 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -1.353 24.339 -9.419 1.00 0.00 H new ATOM 0 HE22 GLN A1006 0.152 25.200 -9.080 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.273 26.844 -4.660 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.874 28.160 -4.524 1.00 0.00 C ATOM 1453 C GLN A1007 -4.706 28.675 -3.094 1.00 0.00 C ATOM 1454 O GLN A1007 -4.717 29.883 -2.860 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.350 28.133 -4.928 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.818 29.516 -5.384 1.00 0.00 C ATOM 1457 CD GLN A1007 -8.346 29.594 -5.418 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -9.027 28.716 -5.921 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.845 30.691 -4.856 1.00 0.00 N ATOM 0 H GLN A1007 -4.855 26.074 -4.331 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.359 28.845 -5.198 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.498 27.412 -5.732 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.956 27.800 -4.085 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -6.426 30.277 -4.709 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -6.417 29.731 -6.374 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -8.218 31.388 -4.453 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.854 30.836 -4.828 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.556 27.734 -2.173 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.386 28.078 -0.772 1.00 0.00 C ATOM 1470 C TYR A1008 -2.905 28.217 -0.417 1.00 0.00 C ATOM 1471 O TYR A1008 -2.507 27.955 0.718 1.00 0.00 O ATOM 1472 CB TYR A1008 -4.982 26.915 0.023 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.467 27.083 0.352 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -6.856 27.907 1.388 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.418 26.409 -0.387 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.253 28.064 1.698 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.816 26.567 -0.078 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.164 27.386 0.950 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.484 27.535 1.242 1.00 0.00 O ATOM 0 H TYR A1008 -4.549 26.733 -2.370 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.870 29.029 -0.549 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.848 25.994 -0.544 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.425 26.801 0.953 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.112 28.434 1.967 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.114 25.763 -1.197 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -8.570 28.706 2.506 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.570 26.047 -0.650 1.00 0.00 H new ATOM 0 HH TYR A1008 -11.019 26.992 0.625 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.127 28.628 -1.408 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.698 28.804 -1.214 1.00 0.00 C ATOM 1491 C VAL A1009 -0.330 30.267 -1.468 1.00 0.00 C ATOM 1492 O VAL A1009 0.308 30.905 -0.631 1.00 0.00 O ATOM 1493 CB VAL A1009 0.075 27.830 -2.106 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.215 28.093 -3.585 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.577 27.900 -1.821 1.00 0.00 C ATOM 0 H VAL A1009 -2.460 28.844 -2.348 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.421 28.572 -0.186 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.264 26.821 -1.872 1.00 0.00 H new ATOM 0 HG11 VAL A1009 0.347 27.387 -4.197 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.281 27.969 -3.774 1.00 0.00 H new ATOM 0 HG13 VAL A1009 0.083 29.110 -3.839 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.103 27.198 -2.468 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.937 28.911 -2.013 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.762 27.641 -0.779 1.00 0.00 H new ATOM 1505 N MET A1010 -0.749 30.758 -2.625 1.00 0.00 N ATOM 1506 CA MET A1010 -0.471 32.134 -3.000 1.00 0.00 C ATOM 1507 C MET A1010 -0.948 33.103 -1.916 1.00 0.00 C ATOM 1508 O MET A1010 -0.263 34.076 -1.603 1.00 0.00 O ATOM 1509 CB MET A1010 -1.175 32.456 -4.319 1.00 0.00 C ATOM 1510 CG MET A1010 -2.599 31.897 -4.332 1.00 0.00 C ATOM 1511 SD MET A1010 -3.774 33.224 -4.544 1.00 0.00 S ATOM 1512 CE MET A1010 -4.616 33.147 -2.972 1.00 0.00 C ATOM 0 H MET A1010 -1.279 30.227 -3.316 1.00 0.00 H new ATOM 0 HA MET A1010 0.607 32.249 -3.116 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.203 33.536 -4.466 1.00 0.00 H new ATOM 0 HB3 MET A1010 -0.608 32.036 -5.150 1.00 0.00 H new ATOM 0 HG2 MET A1010 -2.707 31.172 -5.139 1.00 0.00 H new ATOM 0 HG3 MET A1010 -2.799 31.368 -3.400 1.00 0.00 H new ATOM 0 HE1 MET A1010 -5.694 33.145 -3.136 1.00 0.00 H new ATOM 0 HE2 MET A1010 -4.327 32.236 -2.449 1.00 0.00 H new ATOM 0 HE3 MET A1010 -4.343 34.014 -2.370 1.00 0.00 H new ATOM 1522 N THR A1011 -2.120 32.805 -1.374 1.00 0.00 N ATOM 1523 CA THR A1011 -2.696 33.638 -0.333 1.00 0.00 C ATOM 1524 C THR A1011 -1.676 33.882 0.781 1.00 0.00 C ATOM 1525 O THR A1011 -1.250 35.015 1.000 1.00 0.00 O ATOM 1526 CB THR A1011 -3.979 32.963 0.156 1.00 0.00 C ATOM 1527 OG1 THR A1011 -4.196 33.523 1.449 1.00 0.00 O ATOM 1528 CG2 THR A1011 -3.790 31.469 0.425 1.00 0.00 C ATOM 0 H THR A1011 -2.686 31.998 -1.637 1.00 0.00 H new ATOM 0 HA THR A1011 -2.955 34.625 -0.715 1.00 0.00 H new ATOM 0 HB THR A1011 -4.766 33.102 -0.585 1.00 0.00 H new ATOM 0 HG1 THR A1011 -5.010 33.141 1.839 1.00 0.00 H new ATOM 0 HG21 THR A1011 -4.731 31.039 0.770 1.00 0.00 H new ATOM 0 HG22 THR A1011 -3.478 30.971 -0.493 1.00 0.00 H new ATOM 0 HG23 THR A1011 -3.026 31.331 1.190 1.00 0.00 H new ATOM 1536 N SER A1012 -1.313 32.800 1.455 1.00 0.00 N ATOM 1537 CA SER A1012 -0.351 32.883 2.541 1.00 0.00 C ATOM 1538 C SER A1012 -0.525 31.692 3.485 1.00 0.00 C ATOM 1539 O SER A1012 0.416 31.298 4.173 1.00 0.00 O ATOM 1540 CB SER A1012 -0.499 34.197 3.310 1.00 0.00 C ATOM 1541 OG SER A1012 -1.852 34.642 3.350 1.00 0.00 O ATOM 0 H SER A1012 -1.668 31.862 1.270 1.00 0.00 H new ATOM 0 HA SER A1012 0.651 32.856 2.113 1.00 0.00 H new ATOM 0 HB2 SER A1012 -0.130 34.065 4.327 1.00 0.00 H new ATOM 0 HB3 SER A1012 0.121 34.962 2.843 1.00 0.00 H new ATOM 0 HG SER A1012 -2.008 35.280 2.623 1.00 0.00 H new ATOM 1547 N LEU A1013 -1.735 31.152 3.489 1.00 0.00 N ATOM 1548 CA LEU A1013 -2.044 30.014 4.338 1.00 0.00 C ATOM 1549 C LEU A1013 -1.419 28.752 3.740 1.00 0.00 C ATOM 1550 O LEU A1013 -2.118 27.776 3.474 1.00 0.00 O ATOM 1551 CB LEU A1013 -3.554 29.907 4.561 1.00 0.00 C ATOM 1552 CG LEU A1013 -4.322 31.230 4.603 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -5.794 30.998 4.947 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -3.657 32.219 5.562 1.00 0.00 C ATOM 0 H LEU A1013 -2.513 31.482 2.918 1.00 0.00 H new ATOM 0 HA LEU A1013 -1.608 30.147 5.328 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -3.976 29.290 3.767 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -3.726 29.380 5.500 1.00 0.00 H new ATOM 0 HG LEU A1013 -4.291 31.676 3.609 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -6.317 31.954 4.970 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -6.247 30.355 4.193 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -5.868 30.520 5.924 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -4.222 33.151 5.573 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -3.637 31.795 6.566 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -2.638 32.417 5.231 1.00 0.00 H new ATOM 1566 N GLN A1014 -0.110 28.813 3.547 1.00 0.00 N ATOM 1567 CA GLN A1014 0.617 27.687 2.985 1.00 0.00 C ATOM 1568 C GLN A1014 1.023 26.712 4.093 1.00 0.00 C ATOM 1569 O GLN A1014 0.415 25.654 4.246 1.00 0.00 O ATOM 1570 CB GLN A1014 1.839 28.162 2.197 1.00 0.00 C ATOM 1571 CG GLN A1014 2.779 26.995 1.888 1.00 0.00 C ATOM 1572 CD GLN A1014 2.028 25.856 1.195 1.00 0.00 C ATOM 1573 OE1 GLN A1014 1.156 25.218 1.761 1.00 0.00 O ATOM 1574 NE2 GLN A1014 2.415 25.637 -0.059 1.00 0.00 N ATOM 0 H GLN A1014 0.466 29.625 3.770 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.041 27.164 2.291 1.00 0.00 H new ATOM 0 HB2 GLN A1014 1.517 28.630 1.267 1.00 0.00 H new ATOM 0 HB3 GLN A1014 2.372 28.922 2.769 1.00 0.00 H new ATOM 0 HG2 GLN A1014 3.594 27.339 1.251 1.00 0.00 H new ATOM 0 HG3 GLN A1014 3.228 26.630 2.812 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.152 26.208 -0.473 1.00 0.00 H new ATOM 0 HE22 GLN A1014 1.975 24.898 -0.607 1.00 0.00 H new ATOM 1583 N GLN A1015 2.048 27.104 4.835 1.00 0.00 N ATOM 1584 CA GLN A1015 2.542 26.277 5.923 1.00 0.00 C ATOM 1585 C GLN A1015 1.375 25.636 6.676 1.00 0.00 C ATOM 1586 O GLN A1015 1.513 24.548 7.232 1.00 0.00 O ATOM 1587 CB GLN A1015 3.425 27.091 6.872 1.00 0.00 C ATOM 1588 CG GLN A1015 2.896 28.518 7.025 1.00 0.00 C ATOM 1589 CD GLN A1015 3.215 29.075 8.414 1.00 0.00 C ATOM 1590 OE1 GLN A1015 2.879 28.497 9.435 1.00 0.00 O ATOM 1591 NE2 GLN A1015 3.879 30.227 8.396 1.00 0.00 N ATOM 0 H GLN A1015 2.550 27.982 4.705 1.00 0.00 H new ATOM 0 HA GLN A1015 3.155 25.482 5.499 1.00 0.00 H new ATOM 0 HB2 GLN A1015 3.460 26.606 7.847 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.446 27.117 6.492 1.00 0.00 H new ATOM 0 HG2 GLN A1015 3.339 29.158 6.262 1.00 0.00 H new ATOM 0 HG3 GLN A1015 1.818 28.529 6.863 1.00 0.00 H new ATOM 0 HE21 GLN A1015 4.130 30.657 7.506 1.00 0.00 H new ATOM 0 HE22 GLN A1015 4.138 30.680 9.272 1.00 0.00 H new ATOM 1600 N GLU A1016 0.251 26.338 6.668 1.00 0.00 N ATOM 1601 CA GLU A1016 -0.940 25.851 7.343 1.00 0.00 C ATOM 1602 C GLU A1016 -1.545 24.677 6.570 1.00 0.00 C ATOM 1603 O GLU A1016 -1.612 23.560 7.082 1.00 0.00 O ATOM 1604 CB GLU A1016 -1.964 26.972 7.526 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.256 26.439 8.148 1.00 0.00 C ATOM 1606 CD GLU A1016 -3.612 27.212 9.421 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -2.814 27.124 10.379 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -4.673 27.872 9.405 1.00 0.00 O ATOM 0 H GLU A1016 0.140 27.240 6.205 1.00 0.00 H new ATOM 0 HA GLU A1016 -0.654 25.500 8.334 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -1.545 27.752 8.162 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -2.183 27.430 6.562 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -4.071 26.521 7.429 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.142 25.380 8.381 1.00 0.00 H new ATOM 1615 N TYR A1017 -1.971 24.969 5.350 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.568 23.952 4.502 1.00 0.00 C ATOM 1617 C TYR A1017 -1.536 22.895 4.104 1.00 0.00 C ATOM 1618 O TYR A1017 -1.896 21.822 3.623 1.00 0.00 O ATOM 1619 CB TYR A1017 -3.047 24.680 3.244 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.520 25.094 3.288 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.929 26.097 4.142 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -5.438 24.464 2.472 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.315 26.487 4.183 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.824 24.854 2.513 1.00 0.00 C ATOM 1625 CZ TYR A1017 -7.194 25.846 3.366 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.502 26.214 3.405 1.00 0.00 O ATOM 0 H TYR A1017 -1.914 25.896 4.928 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.378 23.443 5.025 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.434 25.569 3.096 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.887 24.035 2.380 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.210 26.590 4.780 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -5.117 23.679 1.803 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.649 27.270 4.847 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -7.553 24.369 1.880 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.767 26.573 2.532 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.274 23.236 4.319 1.00 0.00 N ATOM 1637 CA LYS A1018 0.812 22.330 3.988 1.00 0.00 C ATOM 1638 C LYS A1018 0.829 21.173 4.989 1.00 0.00 C ATOM 1639 O LYS A1018 0.976 20.015 4.603 1.00 0.00 O ATOM 1640 CB LYS A1018 2.137 23.090 3.904 1.00 0.00 C ATOM 1641 CG LYS A1018 3.170 22.305 3.094 1.00 0.00 C ATOM 1642 CD LYS A1018 4.270 21.748 4.000 1.00 0.00 C ATOM 1643 CE LYS A1018 3.951 20.316 4.433 1.00 0.00 C ATOM 1644 NZ LYS A1018 5.198 19.545 4.637 1.00 0.00 N ATOM 0 H LYS A1018 0.020 24.127 4.718 1.00 0.00 H new ATOM 0 HA LYS A1018 0.657 21.895 3.001 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.973 24.064 3.443 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.520 23.273 4.908 1.00 0.00 H new ATOM 0 HG2 LYS A1018 2.679 21.487 2.567 1.00 0.00 H new ATOM 0 HG3 LYS A1018 3.611 22.952 2.336 1.00 0.00 H new ATOM 0 HD2 LYS A1018 5.224 21.769 3.474 1.00 0.00 H new ATOM 0 HD3 LYS A1018 4.377 22.382 4.880 1.00 0.00 H new ATOM 0 HE2 LYS A1018 3.370 20.330 5.355 1.00 0.00 H new ATOM 0 HE3 LYS A1018 3.336 19.830 3.676 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 5.038 18.810 5.355 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 5.480 19.098 3.741 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 5.953 20.184 4.958 1.00 0.00 H new ATOM 1658 N LYS A1019 0.676 21.528 6.257 1.00 0.00 N ATOM 1659 CA LYS A1019 0.672 20.534 7.317 1.00 0.00 C ATOM 1660 C LYS A1019 -0.554 19.632 7.158 1.00 0.00 C ATOM 1661 O LYS A1019 -0.497 18.442 7.468 1.00 0.00 O ATOM 1662 CB LYS A1019 0.764 21.211 8.686 1.00 0.00 C ATOM 1663 CG LYS A1019 2.059 22.016 8.813 1.00 0.00 C ATOM 1664 CD LYS A1019 3.256 21.096 9.062 1.00 0.00 C ATOM 1665 CE LYS A1019 4.496 21.597 8.320 1.00 0.00 C ATOM 1666 NZ LYS A1019 5.646 21.702 9.245 1.00 0.00 N ATOM 0 H LYS A1019 0.554 22.490 6.574 1.00 0.00 H new ATOM 0 HA LYS A1019 1.551 19.894 7.244 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -0.093 21.869 8.829 1.00 0.00 H new ATOM 0 HB3 LYS A1019 0.721 20.457 9.472 1.00 0.00 H new ATOM 0 HG2 LYS A1019 2.223 22.593 7.903 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.968 22.730 9.632 1.00 0.00 H new ATOM 0 HD2 LYS A1019 3.463 21.044 10.131 1.00 0.00 H new ATOM 0 HD3 LYS A1019 3.016 20.084 8.735 1.00 0.00 H new ATOM 0 HE2 LYS A1019 4.739 20.916 7.504 1.00 0.00 H new ATOM 0 HE3 LYS A1019 4.291 22.570 7.873 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 6.480 22.043 8.725 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 5.417 22.369 10.009 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 5.851 20.767 9.652 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.633 20.231 6.677 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.870 19.497 6.474 1.00 0.00 C ATOM 1682 C GLN A1020 -2.618 18.265 5.603 1.00 0.00 C ATOM 1683 O GLN A1020 -2.824 17.135 6.044 1.00 0.00 O ATOM 1684 CB GLN A1020 -3.945 20.394 5.859 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.282 21.563 6.787 1.00 0.00 C ATOM 1686 CD GLN A1020 -5.020 21.076 8.036 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -5.745 20.096 8.017 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -4.795 21.815 9.119 1.00 0.00 N ATOM 0 H GLN A1020 -1.676 21.218 6.422 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.236 19.163 7.445 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.599 20.776 4.899 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.844 19.809 5.664 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.366 22.076 7.079 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -4.898 22.288 6.255 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -4.176 22.624 9.065 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -5.242 21.573 10.003 1.00 0.00 H new ATOM 1697 N MET A1021 -2.177 18.524 4.381 1.00 0.00 N ATOM 1698 CA MET A1021 -1.896 17.450 3.443 1.00 0.00 C ATOM 1699 C MET A1021 -0.876 16.468 4.024 1.00 0.00 C ATOM 1700 O MET A1021 -0.834 15.305 3.628 1.00 0.00 O ATOM 1701 CB MET A1021 -1.353 18.039 2.140 1.00 0.00 C ATOM 1702 CG MET A1021 0.000 18.717 2.366 1.00 0.00 C ATOM 1703 SD MET A1021 1.065 18.441 0.960 1.00 0.00 S ATOM 1704 CE MET A1021 1.374 16.692 1.144 1.00 0.00 C ATOM 0 H MET A1021 -2.007 19.462 4.018 1.00 0.00 H new ATOM 0 HA MET A1021 -2.823 16.910 3.249 1.00 0.00 H new ATOM 0 HB2 MET A1021 -1.248 17.249 1.396 1.00 0.00 H new ATOM 0 HB3 MET A1021 -2.064 18.762 1.740 1.00 0.00 H new ATOM 0 HG2 MET A1021 -0.142 19.787 2.521 1.00 0.00 H new ATOM 0 HG3 MET A1021 0.467 18.323 3.269 1.00 0.00 H new ATOM 0 HE1 MET A1021 2.447 16.519 1.230 1.00 0.00 H new ATOM 0 HE2 MET A1021 0.875 16.327 2.042 1.00 0.00 H new ATOM 0 HE3 MET A1021 0.989 16.161 0.273 1.00 0.00 H new ATOM 1714 N LEU A1022 -0.078 16.974 4.953 1.00 0.00 N ATOM 1715 CA LEU A1022 0.939 16.157 5.593 1.00 0.00 C ATOM 1716 C LEU A1022 0.264 15.148 6.524 1.00 0.00 C ATOM 1717 O LEU A1022 0.515 13.947 6.430 1.00 0.00 O ATOM 1718 CB LEU A1022 1.976 17.040 6.290 1.00 0.00 C ATOM 1719 CG LEU A1022 3.179 16.312 6.893 1.00 0.00 C ATOM 1720 CD1 LEU A1022 2.764 15.483 8.110 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.893 15.464 5.838 1.00 0.00 C ATOM 0 H LEU A1022 -0.115 17.940 5.278 1.00 0.00 H new ATOM 0 HA LEU A1022 1.492 15.584 4.849 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.343 17.773 5.571 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.477 17.595 7.084 1.00 0.00 H new ATOM 0 HG LEU A1022 3.892 17.060 7.240 1.00 0.00 H new ATOM 0 HD11 LEU A1022 3.637 14.976 8.520 1.00 0.00 H new ATOM 0 HD12 LEU A1022 2.336 16.139 8.868 1.00 0.00 H new ATOM 0 HD13 LEU A1022 2.022 14.743 7.810 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.744 14.957 6.293 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.201 14.723 5.438 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.243 16.107 5.030 1.00 0.00 H new ATOM 1733 N THR A1023 -0.578 15.672 7.402 1.00 0.00 N ATOM 1734 CA THR A1023 -1.290 14.832 8.350 1.00 0.00 C ATOM 1735 C THR A1023 -1.816 13.573 7.657 1.00 0.00 C ATOM 1736 O THR A1023 -1.691 12.470 8.187 1.00 0.00 O ATOM 1737 CB THR A1023 -2.392 15.676 8.994 1.00 0.00 C ATOM 1738 OG1 THR A1023 -1.791 16.955 9.172 1.00 0.00 O ATOM 1739 CG2 THR A1023 -2.723 15.219 10.417 1.00 0.00 C ATOM 0 H THR A1023 -0.783 16.668 7.477 1.00 0.00 H new ATOM 0 HA THR A1023 -0.628 14.478 9.140 1.00 0.00 H new ATOM 0 HB THR A1023 -3.291 15.630 8.379 1.00 0.00 H new ATOM 0 HG1 THR A1023 -2.004 17.526 8.405 1.00 0.00 H new ATOM 0 HG21 THR A1023 -3.511 15.851 10.828 1.00 0.00 H new ATOM 0 HG22 THR A1023 -3.062 14.183 10.397 1.00 0.00 H new ATOM 0 HG23 THR A1023 -1.833 15.297 11.041 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.392 13.780 6.482 1.00 0.00 N ATOM 1748 CA ALA A1024 -2.937 12.675 5.711 1.00 0.00 C ATOM 1749 C ALA A1024 -1.818 11.683 5.390 1.00 0.00 C ATOM 1750 O ALA A1024 -1.942 10.491 5.668 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.615 13.217 4.451 1.00 0.00 C ATOM 0 H ALA A1024 -2.493 14.696 6.045 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.695 12.143 6.286 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -4.024 12.388 3.873 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.421 13.894 4.734 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -2.884 13.755 3.847 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.751 12.211 4.809 1.00 0.00 N ATOM 1758 CA ALA A1025 0.389 11.386 4.448 1.00 0.00 C ATOM 1759 C ALA A1025 0.723 10.446 5.608 1.00 0.00 C ATOM 1760 O ALA A1025 1.226 9.345 5.395 1.00 0.00 O ATOM 1761 CB ALA A1025 1.569 12.283 4.066 1.00 0.00 C ATOM 0 H ALA A1025 -0.652 13.200 4.579 1.00 0.00 H new ATOM 0 HA ALA A1025 0.155 10.768 3.581 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.424 11.664 3.795 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.291 12.908 3.218 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.833 12.917 4.913 1.00 0.00 H new ATOM 1767 N HIS A1026 0.428 10.917 6.811 1.00 0.00 N ATOM 1768 CA HIS A1026 0.690 10.132 8.006 1.00 0.00 C ATOM 1769 C HIS A1026 -0.183 8.876 7.998 1.00 0.00 C ATOM 1770 O HIS A1026 0.331 7.759 8.013 1.00 0.00 O ATOM 1771 CB HIS A1026 0.497 10.980 9.265 1.00 0.00 C ATOM 1772 CG HIS A1026 1.451 10.640 10.386 1.00 0.00 C ATOM 1773 ND1 HIS A1026 2.816 10.847 10.298 1.00 0.00 N ATOM 1774 CD2 HIS A1026 1.221 10.107 11.621 1.00 0.00 C ATOM 1775 CE1 HIS A1026 3.374 10.452 11.433 1.00 0.00 C ATOM 1776 NE2 HIS A1026 2.384 9.993 12.251 1.00 0.00 N ATOM 0 H HIS A1026 0.010 11.831 6.984 1.00 0.00 H new ATOM 0 HA HIS A1026 1.731 9.808 8.011 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.618 12.032 9.005 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.526 10.856 9.621 1.00 0.00 H new ATOM 0 HD2 HIS A1026 0.257 9.826 12.018 1.00 0.00 H new ATOM 0 HE1 HIS A1026 4.427 10.487 11.669 1.00 0.00 H new ATOM 0 HE2 HIS A1026 2.516 9.623 13.192 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.488 9.102 7.973 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.438 8.002 7.962 1.00 0.00 C ATOM 1786 C ALA A1027 -2.371 7.290 6.610 1.00 0.00 C ATOM 1787 O ALA A1027 -2.534 6.073 6.537 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.838 8.533 8.273 1.00 0.00 C ATOM 0 H ALA A1027 -1.910 10.030 7.960 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.189 7.272 8.732 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.550 7.708 8.265 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -3.839 9.003 9.256 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.124 9.267 7.520 1.00 0.00 H new ATOM 1794 N LEU A1028 -2.132 8.079 5.573 1.00 0.00 N ATOM 1795 CA LEU A1028 -2.041 7.539 4.227 1.00 0.00 C ATOM 1796 C LEU A1028 -0.921 6.498 4.173 1.00 0.00 C ATOM 1797 O LEU A1028 -1.175 5.319 3.932 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.882 8.668 3.206 1.00 0.00 C ATOM 1799 CG LEU A1028 -3.168 9.151 2.534 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -3.488 8.311 1.295 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -4.332 9.173 3.527 1.00 0.00 C ATOM 0 H LEU A1028 -1.999 9.088 5.638 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.965 7.026 3.959 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -1.414 9.518 3.704 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -1.193 8.335 2.430 1.00 0.00 H new ATOM 0 HG LEU A1028 -3.013 10.176 2.198 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -4.407 8.675 0.836 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -2.669 8.391 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -3.616 7.268 1.585 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -5.234 9.520 3.023 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -4.498 8.168 3.916 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -4.095 9.846 4.351 1.00 0.00 H new ATOM 1813 N ALA A1029 0.295 6.973 4.403 1.00 0.00 N ATOM 1814 CA ALA A1029 1.455 6.098 4.384 1.00 0.00 C ATOM 1815 C ALA A1029 1.108 4.782 5.083 1.00 0.00 C ATOM 1816 O ALA A1029 1.472 3.708 4.607 1.00 0.00 O ATOM 1817 CB ALA A1029 2.642 6.810 5.036 1.00 0.00 C ATOM 0 H ALA A1029 0.502 7.952 4.603 1.00 0.00 H new ATOM 0 HA ALA A1029 1.740 5.861 3.359 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.512 6.154 5.022 1.00 0.00 H new ATOM 0 HB2 ALA A1029 2.867 7.723 4.484 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.394 7.061 6.067 1.00 0.00 H new ATOM 1823 N VAL A1030 0.408 4.910 6.201 1.00 0.00 N ATOM 1824 CA VAL A1030 0.008 3.744 6.970 1.00 0.00 C ATOM 1825 C VAL A1030 -1.058 2.967 6.194 1.00 0.00 C ATOM 1826 O VAL A1030 -1.000 1.741 6.111 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.460 4.171 8.363 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -1.296 3.072 9.021 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.729 4.559 9.245 1.00 0.00 C ATOM 0 H VAL A1030 0.108 5.803 6.592 1.00 0.00 H new ATOM 0 HA VAL A1030 0.856 3.075 7.117 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.094 5.050 8.249 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -1.616 3.401 10.010 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.172 2.864 8.407 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -0.697 2.167 9.116 1.00 0.00 H new ATOM 0 HG21 VAL A1030 0.369 4.858 10.229 1.00 0.00 H new ATOM 0 HG22 VAL A1030 1.400 3.706 9.348 1.00 0.00 H new ATOM 0 HG23 VAL A1030 1.266 5.389 8.787 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.006 3.713 5.645 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.083 3.110 4.879 1.00 0.00 C ATOM 1841 C ASP A1031 -2.500 2.071 3.919 1.00 0.00 C ATOM 1842 O ASP A1031 -2.900 0.908 3.941 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.822 4.160 4.047 1.00 0.00 C ATOM 1844 CG ASP A1031 -5.100 3.664 3.368 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -5.113 2.476 2.982 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -6.035 4.485 3.250 1.00 0.00 O ATOM 0 H ASP A1031 -2.050 4.730 5.716 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.779 2.650 5.580 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -4.074 5.001 4.692 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -3.145 4.538 3.281 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.565 2.528 3.100 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.923 1.652 2.134 1.00 0.00 C ATOM 1853 C ALA A1032 -0.315 0.453 2.864 1.00 0.00 C ATOM 1854 O ALA A1032 -0.341 -0.667 2.355 1.00 0.00 O ATOM 1855 CB ALA A1032 0.121 2.443 1.342 1.00 0.00 C ATOM 0 H ALA A1032 -1.236 3.493 3.085 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.652 1.268 1.420 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.603 1.786 0.618 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.366 3.266 0.818 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.871 2.841 2.025 1.00 0.00 H new ATOM 1861 N LYS A1033 0.218 0.728 4.045 1.00 0.00 N ATOM 1862 CA LYS A1033 0.831 -0.314 4.851 1.00 0.00 C ATOM 1863 C LYS A1033 -0.247 -1.297 5.312 1.00 0.00 C ATOM 1864 O LYS A1033 -0.048 -2.510 5.264 1.00 0.00 O ATOM 1865 CB LYS A1033 1.636 0.299 5.998 1.00 0.00 C ATOM 1866 CG LYS A1033 2.893 -0.524 6.288 1.00 0.00 C ATOM 1867 CD LYS A1033 4.132 0.372 6.350 1.00 0.00 C ATOM 1868 CE LYS A1033 5.230 -0.270 7.201 1.00 0.00 C ATOM 1869 NZ LYS A1033 6.471 0.534 7.139 1.00 0.00 N ATOM 0 H LYS A1033 0.238 1.658 4.463 1.00 0.00 H new ATOM 0 HA LYS A1033 1.548 -0.882 4.258 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.917 1.321 5.744 1.00 0.00 H new ATOM 0 HB3 LYS A1033 1.017 0.352 6.894 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.775 -1.054 7.233 1.00 0.00 H new ATOM 0 HG3 LYS A1033 3.024 -1.279 5.513 1.00 0.00 H new ATOM 0 HD2 LYS A1033 4.506 0.552 5.342 1.00 0.00 H new ATOM 0 HD3 LYS A1033 3.863 1.342 6.768 1.00 0.00 H new ATOM 0 HE2 LYS A1033 4.895 -0.353 8.235 1.00 0.00 H new ATOM 0 HE3 LYS A1033 5.427 -1.282 6.847 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 7.206 0.084 7.722 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 6.798 0.592 6.154 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 6.282 1.492 7.498 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.365 -0.737 5.749 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.475 -1.549 6.218 1.00 0.00 C ATOM 1885 C ASN A1034 -2.856 -2.560 5.135 1.00 0.00 C ATOM 1886 O ASN A1034 -3.156 -3.714 5.436 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.703 -0.686 6.512 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.554 -1.303 7.623 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -4.185 -2.281 8.253 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.711 -0.680 7.828 1.00 0.00 N ATOM 0 H ASN A1034 -1.526 0.269 5.788 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.161 -2.053 7.132 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.387 0.315 6.805 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.302 -0.579 5.607 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.350 -1.016 8.548 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.959 0.134 7.265 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.831 -2.090 3.896 1.00 0.00 N ATOM 1898 CA LEU A1035 -3.170 -2.938 2.767 1.00 0.00 C ATOM 1899 C LEU A1035 -2.300 -4.196 2.800 1.00 0.00 C ATOM 1900 O LEU A1035 -2.810 -5.304 2.955 1.00 0.00 O ATOM 1901 CB LEU A1035 -3.068 -2.153 1.457 1.00 0.00 C ATOM 1902 CG LEU A1035 -2.998 -2.989 0.178 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -4.027 -4.122 0.206 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -3.151 -2.107 -1.063 1.00 0.00 C ATOM 0 H LEU A1035 -2.581 -1.132 3.650 1.00 0.00 H new ATOM 0 HA LEU A1035 -4.207 -3.266 2.835 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.929 -1.489 1.387 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -2.181 -1.521 1.503 1.00 0.00 H new ATOM 0 HG LEU A1035 -2.012 -3.451 0.126 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -3.956 -4.701 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -3.830 -4.771 1.059 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -5.029 -3.702 0.294 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -3.098 -2.726 -1.958 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -4.114 -1.598 -1.031 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -2.350 -1.368 -1.085 1.00 0.00 H new ATOM 1916 N LEU A1036 -1.001 -3.982 2.651 1.00 0.00 N ATOM 1917 CA LEU A1036 -0.055 -5.084 2.662 1.00 0.00 C ATOM 1918 C LEU A1036 -0.117 -5.791 4.017 1.00 0.00 C ATOM 1919 O LEU A1036 -0.044 -7.017 4.086 1.00 0.00 O ATOM 1920 CB LEU A1036 1.345 -4.593 2.288 1.00 0.00 C ATOM 1921 CG LEU A1036 2.105 -5.443 1.268 1.00 0.00 C ATOM 1922 CD1 LEU A1036 1.987 -4.850 -0.137 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.563 -5.632 1.689 1.00 0.00 C ATOM 0 H LEU A1036 -0.582 -3.061 2.522 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.322 -5.822 1.905 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.260 -3.580 1.895 1.00 0.00 H new ATOM 0 HB3 LEU A1036 1.942 -4.533 3.198 1.00 0.00 H new ATOM 0 HG LEU A1036 1.647 -6.432 1.240 1.00 0.00 H new ATOM 0 HD11 LEU A1036 2.536 -5.474 -0.842 1.00 0.00 H new ATOM 0 HD12 LEU A1036 0.937 -4.811 -0.428 1.00 0.00 H new ATOM 0 HD13 LEU A1036 2.403 -3.843 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.080 -6.240 0.947 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.049 -4.659 1.764 1.00 0.00 H new ATOM 0 HD23 LEU A1036 3.600 -6.132 2.657 1.00 0.00 H new ATOM 1935 N ASP A1037 -0.251 -4.987 5.062 1.00 0.00 N ATOM 1936 CA ASP A1037 -0.323 -5.520 6.412 1.00 0.00 C ATOM 1937 C ASP A1037 -1.198 -6.775 6.413 1.00 0.00 C ATOM 1938 O ASP A1037 -0.809 -7.806 6.961 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.950 -4.506 7.371 1.00 0.00 C ATOM 1940 CG ASP A1037 -0.747 -4.810 8.857 1.00 0.00 C ATOM 1941 OD1 ASP A1037 -1.576 -5.572 9.399 1.00 0.00 O ATOM 1942 OD2 ASP A1037 0.234 -4.273 9.417 1.00 0.00 O ATOM 0 H ASP A1037 -0.312 -3.971 5.001 1.00 0.00 H new ATOM 0 HA ASP A1037 0.691 -5.748 6.740 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.535 -3.521 7.157 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -2.020 -4.451 7.170 1.00 0.00 H new ATOM 1947 N VAL A1038 -2.362 -6.648 5.794 1.00 0.00 N ATOM 1948 CA VAL A1038 -3.294 -7.760 5.717 1.00 0.00 C ATOM 1949 C VAL A1038 -2.674 -8.883 4.883 1.00 0.00 C ATOM 1950 O VAL A1038 -2.824 -10.059 5.211 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.638 -7.278 5.165 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -5.671 -8.407 5.176 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -5.146 -6.063 5.944 1.00 0.00 C ATOM 0 H VAL A1038 -2.681 -5.792 5.341 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.491 -8.163 6.710 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.486 -6.973 4.130 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -6.617 -8.039 4.779 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -5.315 -9.232 4.559 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -5.818 -8.756 6.198 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -6.102 -5.740 5.532 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -5.275 -6.331 6.993 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.423 -5.251 5.863 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.990 -8.481 3.822 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.347 -9.439 2.940 1.00 0.00 C ATOM 1965 C ILE A1039 -0.332 -10.260 3.738 1.00 0.00 C ATOM 1966 O ILE A1039 -0.342 -11.489 3.683 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.744 -8.729 1.726 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.806 -8.479 0.653 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.455 -9.504 1.176 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.201 -7.777 -0.564 1.00 0.00 C ATOM 0 H ILE A1039 -1.867 -7.505 3.554 1.00 0.00 H new ATOM 0 HA ILE A1039 -2.080 -10.139 2.540 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.377 -7.755 2.049 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -2.249 -9.427 0.347 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.610 -7.870 1.067 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.864 -8.977 0.314 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.220 -9.586 1.948 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.136 -10.501 0.874 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.977 -7.611 -1.311 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.780 -6.819 -0.259 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.414 -8.400 -0.990 1.00 0.00 H new ATOM 1982 N ASP A1040 0.518 -9.548 4.462 1.00 0.00 N ATOM 1983 CA ASP A1040 1.537 -10.196 5.271 1.00 0.00 C ATOM 1984 C ASP A1040 0.905 -11.350 6.052 1.00 0.00 C ATOM 1985 O ASP A1040 1.477 -12.435 6.134 1.00 0.00 O ATOM 1986 CB ASP A1040 2.143 -9.218 6.280 1.00 0.00 C ATOM 1987 CG ASP A1040 3.558 -9.565 6.747 1.00 0.00 C ATOM 1988 OD1 ASP A1040 3.842 -10.778 6.844 1.00 0.00 O ATOM 1989 OD2 ASP A1040 4.324 -8.609 6.996 1.00 0.00 O ATOM 0 H ASP A1040 0.523 -8.529 4.506 1.00 0.00 H new ATOM 0 HA ASP A1040 2.319 -10.556 4.603 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.157 -8.223 5.835 1.00 0.00 H new ATOM 0 HB3 ASP A1040 1.491 -9.168 7.152 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.266 -11.075 6.607 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.982 -12.076 7.379 1.00 0.00 C ATOM 1996 C GLN A1041 -1.337 -13.274 6.495 1.00 0.00 C ATOM 1997 O GLN A1041 -1.363 -14.410 6.964 1.00 0.00 O ATOM 1998 CB GLN A1041 -2.235 -11.480 8.023 1.00 0.00 C ATOM 1999 CG GLN A1041 -3.072 -12.565 8.703 1.00 0.00 C ATOM 2000 CD GLN A1041 -3.946 -11.971 9.809 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -3.563 -11.894 10.965 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -5.139 -11.557 9.392 1.00 0.00 N ATOM 0 H GLN A1041 -0.737 -10.173 6.537 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.331 -12.421 8.182 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -1.948 -10.725 8.755 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.834 -10.976 7.264 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -3.702 -13.060 7.964 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -2.415 -13.326 9.123 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -5.397 -11.651 8.410 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -5.796 -11.146 10.055 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.603 -12.978 5.231 1.00 0.00 N ATOM 2012 CA ALA A1042 -1.955 -14.015 4.277 1.00 0.00 C ATOM 2013 C ALA A1042 -0.683 -14.727 3.811 1.00 0.00 C ATOM 2014 O ALA A1042 -0.719 -15.907 3.466 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.736 -13.398 3.115 1.00 0.00 C ATOM 0 H ALA A1042 -1.582 -12.034 4.846 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.599 -14.761 4.743 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.000 -14.177 2.400 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.645 -12.931 3.495 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -2.121 -12.646 2.622 1.00 0.00 H new ATOM 2021 N ARG A1043 0.411 -13.980 3.818 1.00 0.00 N ATOM 2022 CA ARG A1043 1.692 -14.525 3.400 1.00 0.00 C ATOM 2023 C ARG A1043 1.996 -15.813 4.169 1.00 0.00 C ATOM 2024 O ARG A1043 1.974 -16.901 3.597 1.00 0.00 O ATOM 2025 CB ARG A1043 2.821 -13.520 3.635 1.00 0.00 C ATOM 2026 CG ARG A1043 4.071 -13.905 2.842 1.00 0.00 C ATOM 2027 CD ARG A1043 5.212 -12.919 3.103 1.00 0.00 C ATOM 2028 NE ARG A1043 6.506 -13.531 2.729 1.00 0.00 N ATOM 2029 CZ ARG A1043 7.606 -12.831 2.417 1.00 0.00 C ATOM 2030 NH1 ARG A1043 7.574 -11.492 2.433 1.00 0.00 N ATOM 2031 NH2 ARG A1043 8.736 -13.471 2.089 1.00 0.00 N ATOM 0 H ARG A1043 0.437 -13.002 4.106 1.00 0.00 H new ATOM 0 HA ARG A1043 1.629 -14.740 2.333 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.492 -12.523 3.341 1.00 0.00 H new ATOM 0 HB3 ARG A1043 3.059 -13.477 4.698 1.00 0.00 H new ATOM 0 HG2 ARG A1043 4.385 -14.912 3.118 1.00 0.00 H new ATOM 0 HG3 ARG A1043 3.839 -13.924 1.777 1.00 0.00 H new ATOM 0 HD2 ARG A1043 5.053 -12.006 2.529 1.00 0.00 H new ATOM 0 HD3 ARG A1043 5.225 -12.636 4.155 1.00 0.00 H new ATOM 0 HE ARG A1043 6.565 -14.549 2.707 1.00 0.00 H new ATOM 0 HH11 ARG A1043 6.713 -11.005 2.683 1.00 0.00 H new ATOM 0 HH12 ARG A1043 8.411 -10.959 2.196 1.00 0.00 H new ATOM 0 HH21 ARG A1043 8.759 -14.491 2.077 1.00 0.00 H new ATOM 0 HH22 ARG A1043 9.573 -12.939 1.852 1.00 0.00 H new ATOM 2045 N LEU A1044 2.275 -15.645 5.454 1.00 0.00 N ATOM 2046 CA LEU A1044 2.583 -16.781 6.306 1.00 0.00 C ATOM 2047 C LEU A1044 1.420 -17.774 6.267 1.00 0.00 C ATOM 2048 O LEU A1044 1.616 -18.973 6.462 1.00 0.00 O ATOM 2049 CB LEU A1044 2.942 -16.309 7.717 1.00 0.00 C ATOM 2050 CG LEU A1044 1.779 -15.795 8.568 1.00 0.00 C ATOM 2051 CD1 LEU A1044 1.121 -14.576 7.919 1.00 0.00 C ATOM 2052 CD2 LEU A1044 0.770 -16.910 8.848 1.00 0.00 C ATOM 0 H LEU A1044 2.294 -14.740 5.925 1.00 0.00 H new ATOM 0 HA LEU A1044 3.463 -17.307 5.936 1.00 0.00 H new ATOM 0 HB2 LEU A1044 3.416 -17.136 8.246 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.685 -15.516 7.635 1.00 0.00 H new ATOM 0 HG LEU A1044 2.177 -15.472 9.530 1.00 0.00 H new ATOM 0 HD11 LEU A1044 0.298 -14.231 8.544 1.00 0.00 H new ATOM 0 HD12 LEU A1044 1.856 -13.778 7.814 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.740 -14.849 6.935 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -0.046 -16.518 9.455 1.00 0.00 H new ATOM 0 HD22 LEU A1044 0.373 -17.287 7.905 1.00 0.00 H new ATOM 0 HD23 LEU A1044 1.263 -17.721 9.384 1.00 0.00 H new ATOM 2064 N LYS A1045 0.235 -17.239 6.014 1.00 0.00 N ATOM 2065 CA LYS A1045 -0.959 -18.063 5.946 1.00 0.00 C ATOM 2066 C LYS A1045 -0.716 -19.228 4.985 1.00 0.00 C ATOM 2067 O LYS A1045 -1.393 -20.252 5.061 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.178 -17.212 5.586 1.00 0.00 C ATOM 2069 CG LYS A1045 -3.467 -17.849 6.110 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.450 -16.780 6.592 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.894 -17.269 6.472 1.00 0.00 C ATOM 2072 NZ LYS A1045 -6.556 -17.262 7.796 1.00 0.00 N ATOM 0 H LYS A1045 0.076 -16.244 5.854 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.179 -18.496 6.922 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.065 -16.213 6.007 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -2.239 -17.097 4.504 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -3.929 -18.444 5.322 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -3.234 -18.530 6.929 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -4.234 -16.524 7.629 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -4.320 -15.871 6.005 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.444 -16.631 5.781 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -5.910 -18.277 6.057 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -7.536 -17.597 7.696 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -6.040 -17.890 8.445 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -6.558 -16.295 8.178 1.00 0.00 H new ATOM 2086 N MET A1046 0.252 -19.032 4.101 1.00 0.00 N ATOM 2087 CA MET A1046 0.592 -20.054 3.126 1.00 0.00 C ATOM 2088 C MET A1046 1.451 -21.151 3.758 1.00 0.00 C ATOM 2089 O MET A1046 1.196 -22.337 3.557 1.00 0.00 O ATOM 2090 CB MET A1046 1.354 -19.415 1.963 1.00 0.00 C ATOM 2091 CG MET A1046 1.724 -20.462 0.910 1.00 0.00 C ATOM 2092 SD MET A1046 1.659 -19.737 -0.720 1.00 0.00 S ATOM 2093 CE MET A1046 2.912 -18.478 -0.550 1.00 0.00 C ATOM 0 H MET A1046 0.811 -18.181 4.040 1.00 0.00 H new ATOM 0 HA MET A1046 -0.331 -20.506 2.763 1.00 0.00 H new ATOM 0 HB2 MET A1046 0.743 -18.636 1.507 1.00 0.00 H new ATOM 0 HB3 MET A1046 2.258 -18.934 2.336 1.00 0.00 H new ATOM 0 HG2 MET A1046 2.724 -20.849 1.105 1.00 0.00 H new ATOM 0 HG3 MET A1046 1.038 -21.307 0.969 1.00 0.00 H new ATOM 0 HE1 MET A1046 3.167 -18.083 -1.533 1.00 0.00 H new ATOM 0 HE2 MET A1046 2.534 -17.671 0.079 1.00 0.00 H new ATOM 0 HE3 MET A1046 3.802 -18.910 -0.091 1.00 0.00 H new ATOM 2103 N ILE A1047 2.452 -20.715 4.509 1.00 0.00 N ATOM 2104 CA ILE A1047 3.350 -21.646 5.172 1.00 0.00 C ATOM 2105 C ILE A1047 2.628 -22.288 6.358 1.00 0.00 C ATOM 2106 O ILE A1047 2.607 -23.511 6.489 1.00 0.00 O ATOM 2107 CB ILE A1047 4.658 -20.949 5.553 1.00 0.00 C ATOM 2108 CG1 ILE A1047 5.410 -20.475 4.307 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.523 -21.850 6.436 1.00 0.00 C ATOM 2110 CD1 ILE A1047 5.394 -18.949 4.205 1.00 0.00 C ATOM 0 H ILE A1047 2.661 -19.730 4.673 1.00 0.00 H new ATOM 0 HA ILE A1047 3.630 -22.453 4.494 1.00 0.00 H new ATOM 0 HB ILE A1047 4.414 -20.063 6.139 1.00 0.00 H new ATOM 0 HG12 ILE A1047 6.440 -20.830 4.342 1.00 0.00 H new ATOM 0 HG13 ILE A1047 4.954 -20.907 3.416 1.00 0.00 H new ATOM 0 HG21 ILE A1047 6.446 -21.330 6.692 1.00 0.00 H new ATOM 0 HG22 ILE A1047 4.980 -22.095 7.348 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.760 -22.767 5.898 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.935 -18.638 3.311 1.00 0.00 H new ATOM 0 HD12 ILE A1047 4.363 -18.599 4.145 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.872 -18.520 5.086 1.00 0.00 H new