USER MOD reduce.3.24.130724 H: found=0, std=0, add=1013, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1011 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 Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -3.86! C(o=-3.9!,f=-11!) USER MOD Single : A 13 ASN : amide:sc= -2.61! C(o=-2.6!,f=-6.4!) USER MOD Single : A 15 ASN : amide:sc= -0.0303 X(o=-0.03,f=-0.34) USER MOD Single : A 16 ASN : amide:sc= -16.5! C(o=-16!,f=-25!) USER MOD Single : A 21 THR OG1 : rot 150:sc= -2.24! USER MOD Single : A 28 HIS : no HD1:sc= -0.409 X(o=-0.41,f=-0.55) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 61 THR OG1 : rot 16:sc= 0.239 USER MOD Single : A 63 GLN :FLIP amide:sc= -0.879 F(o=-3.3,f=-0.88) USER MOD Single : A 64 HIS : no HD1:sc= -0.257 X(o=-0.26,f=-0.05) USER MOD Single : A 66 SER OG : rot 86:sc= 1.22 USER MOD Single : A 70 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.046) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -4.22! C(o=-4.2!,f=-5!) USER MOD Single : A 81 THR OG1 : rot 65:sc= -0.869! USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -4.68! C(o=-4.7!,f=-7.9!) USER MOD Single : A 105 MET CE :methyl 168:sc= 0 (180deg=-0.0068) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0949 USER MOD Single : A 111 ASN : amide:sc= -0.229 K(o=-0.23,f=-3!) USER MOD Single : A 119 ASN : amide:sc= -6.3! C(o=-6.3!,f=-8.5!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.0854) USER MOD ----------------------------------------------------------------- ATOM 42 N LYS A 3 14.145 11.791 4.136 1.00 0.00 N ATOM 43 CA LYS A 3 13.201 11.260 3.115 1.00 0.00 C ATOM 44 C LYS A 3 13.128 9.739 3.237 1.00 0.00 C ATOM 45 O LYS A 3 14.104 9.083 3.543 1.00 0.00 O ATOM 46 CB LYS A 3 13.694 11.634 1.717 1.00 0.00 C ATOM 47 CG LYS A 3 12.781 10.996 0.669 1.00 0.00 C ATOM 48 CD LYS A 3 13.467 11.032 -0.698 1.00 0.00 C ATOM 49 CE LYS A 3 13.801 9.606 -1.137 1.00 0.00 C ATOM 50 NZ LYS A 3 14.852 9.643 -2.192 1.00 0.00 N ATOM 0 HA LYS A 3 12.212 11.689 3.277 1.00 0.00 H new ATOM 0 HB2 LYS A 3 13.700 12.718 1.599 1.00 0.00 H new ATOM 0 HB3 LYS A 3 14.720 11.293 1.578 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.555 9.967 0.947 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.832 11.530 0.625 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.815 11.507 -1.432 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.377 11.630 -0.645 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.148 9.024 -0.284 1.00 0.00 H new ATOM 0 HE3 LYS A 3 12.907 9.112 -1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.079 8.673 -2.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.505 10.184 -3.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.707 10.098 -1.814 1.00 0.00 H new ATOM 64 N LEU A 4 11.979 9.171 2.999 1.00 0.00 N ATOM 65 CA LEU A 4 11.849 7.692 3.099 1.00 0.00 C ATOM 66 C LEU A 4 10.945 7.182 1.979 1.00 0.00 C ATOM 67 O LEU A 4 10.394 7.946 1.212 1.00 0.00 O ATOM 68 CB LEU A 4 11.247 7.314 4.462 1.00 0.00 C ATOM 69 CG LEU A 4 9.720 7.457 4.440 1.00 0.00 C ATOM 70 CD1 LEU A 4 9.084 6.071 4.532 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.287 8.316 5.620 1.00 0.00 C ATOM 0 H LEU A 4 11.126 9.667 2.740 1.00 0.00 H new ATOM 0 HA LEU A 4 12.835 7.237 3.004 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.517 6.288 4.712 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.666 7.953 5.240 1.00 0.00 H new ATOM 0 HG LEU A 4 9.399 7.933 3.513 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.998 6.167 4.517 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.407 5.466 3.685 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.393 5.590 5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.202 8.424 5.613 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.599 7.840 6.550 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.750 9.300 5.543 1.00 0.00 H new ATOM 83 N GLN A 5 10.775 5.896 1.896 1.00 0.00 N ATOM 84 CA GLN A 5 9.892 5.330 0.848 1.00 0.00 C ATOM 85 C GLN A 5 9.122 4.161 1.439 1.00 0.00 C ATOM 86 O GLN A 5 9.335 3.768 2.568 1.00 0.00 O ATOM 87 CB GLN A 5 10.725 4.859 -0.338 1.00 0.00 C ATOM 88 CG GLN A 5 11.629 6.011 -0.782 1.00 0.00 C ATOM 89 CD GLN A 5 12.996 5.895 -0.107 1.00 0.00 C ATOM 90 OE1 GLN A 5 13.260 6.562 0.874 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.884 5.072 -0.594 1.00 0.00 N ATOM 0 H GLN A 5 11.212 5.210 2.512 1.00 0.00 H new ATOM 0 HA GLN A 5 9.196 6.093 0.500 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.324 3.992 -0.060 1.00 0.00 H new ATOM 0 HB3 GLN A 5 10.077 4.548 -1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.747 5.994 -1.865 1.00 0.00 H new ATOM 0 HG3 GLN A 5 11.168 6.965 -0.526 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.663 4.512 -1.417 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.799 4.989 -0.151 1.00 0.00 H new ATOM 100 N ILE A 6 8.214 3.610 0.702 1.00 0.00 N ATOM 101 CA ILE A 6 7.426 2.487 1.251 1.00 0.00 C ATOM 102 C ILE A 6 7.179 1.446 0.161 1.00 0.00 C ATOM 103 O ILE A 6 6.634 1.742 -0.884 1.00 0.00 O ATOM 104 CB ILE A 6 6.099 3.052 1.772 1.00 0.00 C ATOM 105 CG1 ILE A 6 6.326 3.624 3.189 1.00 0.00 C ATOM 106 CG2 ILE A 6 5.029 1.953 1.798 1.00 0.00 C ATOM 107 CD1 ILE A 6 5.265 3.105 4.179 1.00 0.00 C ATOM 0 H ILE A 6 7.983 3.886 -0.252 1.00 0.00 H new ATOM 0 HA ILE A 6 7.964 2.000 2.064 1.00 0.00 H new ATOM 0 HB ILE A 6 5.749 3.846 1.112 1.00 0.00 H new ATOM 0 HG12 ILE A 6 7.320 3.348 3.540 1.00 0.00 H new ATOM 0 HG13 ILE A 6 6.292 4.713 3.154 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.092 2.367 2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.880 1.566 0.790 1.00 0.00 H new ATOM 0 HG23 ILE A 6 5.354 1.144 2.453 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.452 3.526 5.167 1.00 0.00 H new ATOM 0 HD12 ILE A 6 4.273 3.404 3.839 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.318 2.018 4.232 1.00 0.00 H new ATOM 119 N ALA A 7 7.554 0.223 0.412 1.00 0.00 N ATOM 120 CA ALA A 7 7.314 -0.847 -0.591 1.00 0.00 C ATOM 121 C ALA A 7 5.917 -1.401 -0.349 1.00 0.00 C ATOM 122 O ALA A 7 5.741 -2.566 -0.053 1.00 0.00 O ATOM 123 CB ALA A 7 8.335 -1.970 -0.416 1.00 0.00 C ATOM 0 H ALA A 7 8.016 -0.080 1.269 1.00 0.00 H new ATOM 0 HA ALA A 7 7.408 -0.444 -1.599 1.00 0.00 H new ATOM 0 HB1 ALA A 7 8.150 -2.749 -1.156 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.341 -1.572 -0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 7 8.244 -2.392 0.585 1.00 0.00 H new ATOM 129 N VAL A 8 4.923 -0.569 -0.451 1.00 0.00 N ATOM 130 CA VAL A 8 3.540 -1.047 -0.201 1.00 0.00 C ATOM 131 C VAL A 8 3.025 -1.799 -1.423 1.00 0.00 C ATOM 132 O VAL A 8 3.121 -3.007 -1.500 1.00 0.00 O ATOM 133 CB VAL A 8 2.617 0.145 0.119 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.977 1.347 -0.758 1.00 0.00 C ATOM 135 CG2 VAL A 8 1.152 -0.251 -0.128 1.00 0.00 C ATOM 0 H VAL A 8 5.008 0.418 -0.696 1.00 0.00 H new ATOM 0 HA VAL A 8 3.546 -1.723 0.654 1.00 0.00 H new ATOM 0 HB VAL A 8 2.749 0.418 1.166 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.317 2.181 -0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 8 4.011 1.638 -0.570 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.860 1.079 -1.808 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.503 0.595 0.100 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.023 -0.536 -1.172 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.889 -1.092 0.513 1.00 0.00 H new ATOM 145 N GLY A 9 2.453 -1.117 -2.366 1.00 0.00 N ATOM 146 CA GLY A 9 1.914 -1.830 -3.536 1.00 0.00 C ATOM 147 C GLY A 9 0.624 -2.494 -3.099 1.00 0.00 C ATOM 148 O GLY A 9 0.613 -3.618 -2.639 1.00 0.00 O ATOM 0 H GLY A 9 2.338 -0.104 -2.374 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.732 -1.138 -4.358 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.626 -2.572 -3.896 1.00 0.00 H new ATOM 152 N ILE A 10 -0.464 -1.791 -3.215 1.00 0.00 N ATOM 153 CA ILE A 10 -1.760 -2.378 -2.783 1.00 0.00 C ATOM 154 C ILE A 10 -1.869 -3.755 -3.408 1.00 0.00 C ATOM 155 O ILE A 10 -1.015 -4.170 -4.165 1.00 0.00 O ATOM 156 CB ILE A 10 -2.957 -1.515 -3.211 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.508 -0.084 -3.509 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.984 -1.488 -2.073 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.730 0.767 -3.861 1.00 0.00 C ATOM 0 H ILE A 10 -0.513 -0.843 -3.587 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.783 -2.431 -1.695 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.397 -1.942 -4.112 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -1.995 0.336 -2.644 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.797 -0.078 -4.335 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.838 -0.878 -2.368 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.320 -2.503 -1.862 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.526 -1.064 -1.179 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.413 1.788 -4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.223 0.350 -4.739 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.425 0.770 -3.021 1.00 0.00 H new ATOM 171 N ILE A 11 -2.883 -4.485 -3.094 1.00 0.00 N ATOM 172 CA ILE A 11 -2.981 -5.840 -3.667 1.00 0.00 C ATOM 173 C ILE A 11 -4.438 -6.186 -3.966 1.00 0.00 C ATOM 174 O ILE A 11 -5.142 -6.717 -3.134 1.00 0.00 O ATOM 175 CB ILE A 11 -2.381 -6.823 -2.657 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.774 -6.396 -1.239 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.853 -6.801 -2.777 1.00 0.00 C ATOM 178 CD1 ILE A 11 -1.945 -7.182 -0.219 1.00 0.00 C ATOM 0 H ILE A 11 -3.643 -4.209 -2.472 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.433 -5.896 -4.608 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.755 -7.827 -2.859 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.608 -5.326 -1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.837 -6.576 -1.075 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.422 -7.499 -2.060 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.563 -7.092 -3.787 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.486 -5.796 -2.570 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.225 -6.878 0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.133 -8.249 -0.342 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.886 -6.980 -0.378 1.00 0.00 H new ATOM 190 N ARG A 12 -4.883 -5.915 -5.169 1.00 0.00 N ATOM 191 CA ARG A 12 -6.288 -6.249 -5.535 1.00 0.00 C ATOM 192 C ARG A 12 -6.322 -7.758 -5.749 1.00 0.00 C ATOM 193 O ARG A 12 -5.293 -8.399 -5.664 1.00 0.00 O ATOM 194 CB ARG A 12 -6.677 -5.522 -6.827 1.00 0.00 C ATOM 195 CG ARG A 12 -5.911 -4.204 -6.923 1.00 0.00 C ATOM 196 CD ARG A 12 -6.563 -3.290 -7.981 1.00 0.00 C ATOM 197 NE ARG A 12 -6.819 -4.098 -9.212 1.00 0.00 N ATOM 198 CZ ARG A 12 -7.585 -3.638 -10.166 1.00 0.00 C ATOM 199 NH1 ARG A 12 -8.628 -2.910 -9.880 1.00 0.00 N ATOM 200 NH2 ARG A 12 -7.306 -3.912 -11.411 1.00 0.00 N ATOM 0 H ARG A 12 -4.333 -5.478 -5.909 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.990 -5.943 -4.759 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.453 -6.148 -7.690 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.750 -5.332 -6.841 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.906 -3.706 -5.954 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.871 -4.397 -7.188 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.496 -2.875 -7.600 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.909 -2.448 -8.209 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.391 -5.019 -9.309 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.850 -2.697 -8.908 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.222 -2.554 -10.629 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -6.492 -4.484 -11.637 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -7.902 -3.555 -12.158 1.00 0.00 H new ATOM 214 N ASN A 13 -7.451 -8.374 -5.971 1.00 0.00 N ATOM 215 CA ASN A 13 -7.365 -9.851 -6.103 1.00 0.00 C ATOM 216 C ASN A 13 -8.571 -10.519 -6.800 1.00 0.00 C ATOM 217 O ASN A 13 -8.380 -11.358 -7.623 1.00 0.00 O ATOM 218 CB ASN A 13 -7.145 -10.407 -4.687 1.00 0.00 C ATOM 219 CG ASN A 13 -8.332 -11.260 -4.217 1.00 0.00 C ATOM 220 OD1 ASN A 13 -9.265 -10.754 -3.626 1.00 0.00 O ATOM 221 ND2 ASN A 13 -8.331 -12.543 -4.454 1.00 0.00 N ATOM 0 H ASN A 13 -8.374 -7.950 -6.062 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.536 -10.090 -6.769 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.236 -11.009 -4.670 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -6.993 -9.581 -3.992 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -9.113 -13.120 -4.143 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -7.548 -12.969 -4.950 1.00 0.00 H new ATOM 228 N GLU A 14 -9.793 -10.217 -6.493 1.00 0.00 N ATOM 229 CA GLU A 14 -10.888 -10.981 -7.183 1.00 0.00 C ATOM 230 C GLU A 14 -11.338 -10.244 -8.443 1.00 0.00 C ATOM 231 O GLU A 14 -11.769 -10.832 -9.414 1.00 0.00 O ATOM 232 CB GLU A 14 -12.066 -11.132 -6.216 1.00 0.00 C ATOM 233 CG GLU A 14 -12.869 -12.383 -6.578 1.00 0.00 C ATOM 234 CD GLU A 14 -12.385 -13.557 -5.723 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.904 -13.723 -4.631 1.00 0.00 O ATOM 236 OE2 GLU A 14 -11.502 -14.267 -6.175 1.00 0.00 O ATOM 0 H GLU A 14 -10.087 -9.506 -5.824 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.519 -11.964 -7.476 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.702 -11.205 -5.191 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.705 -10.250 -6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.932 -12.209 -6.410 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.748 -12.614 -7.636 1.00 0.00 H new ATOM 243 N ASN A 15 -11.194 -8.971 -8.432 1.00 0.00 N ATOM 244 CA ASN A 15 -11.545 -8.130 -9.607 1.00 0.00 C ATOM 245 C ASN A 15 -10.847 -6.816 -9.344 1.00 0.00 C ATOM 246 O ASN A 15 -10.174 -6.237 -10.174 1.00 0.00 O ATOM 247 CB ASN A 15 -13.060 -7.928 -9.682 1.00 0.00 C ATOM 248 CG ASN A 15 -13.436 -7.369 -11.054 1.00 0.00 C ATOM 249 OD1 ASN A 15 -13.088 -7.936 -12.071 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.138 -6.272 -11.126 1.00 0.00 N ATOM 0 H ASN A 15 -10.835 -8.447 -7.634 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.243 -8.581 -10.553 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.572 -8.875 -9.511 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.385 -7.244 -8.898 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.395 -5.890 -12.036 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.430 -5.796 -10.272 1.00 0.00 H new ATOM 257 N ASN A 16 -10.995 -6.398 -8.130 1.00 0.00 N ATOM 258 CA ASN A 16 -10.367 -5.178 -7.623 1.00 0.00 C ATOM 259 C ASN A 16 -10.373 -5.336 -6.110 1.00 0.00 C ATOM 260 O ASN A 16 -10.569 -4.386 -5.379 1.00 0.00 O ATOM 261 CB ASN A 16 -11.195 -3.955 -8.023 1.00 0.00 C ATOM 262 CG ASN A 16 -10.599 -2.684 -7.405 1.00 0.00 C ATOM 263 OD1 ASN A 16 -11.181 -1.623 -7.507 1.00 0.00 O ATOM 264 ND2 ASN A 16 -9.457 -2.737 -6.776 1.00 0.00 N ATOM 0 H ASN A 16 -11.560 -6.887 -7.436 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.363 -5.035 -8.022 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -11.219 -3.863 -9.109 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -12.226 -4.080 -7.691 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -9.057 -1.890 -6.373 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -8.964 -3.626 -6.688 1.00 0.00 H new ATOM 271 N GLU A 17 -10.193 -6.548 -5.619 1.00 0.00 N ATOM 272 CA GLU A 17 -10.237 -6.719 -4.144 1.00 0.00 C ATOM 273 C GLU A 17 -8.876 -6.410 -3.543 1.00 0.00 C ATOM 274 O GLU A 17 -8.009 -7.258 -3.460 1.00 0.00 O ATOM 275 CB GLU A 17 -10.655 -8.136 -3.782 1.00 0.00 C ATOM 276 CG GLU A 17 -11.972 -8.471 -4.484 1.00 0.00 C ATOM 277 CD GLU A 17 -12.768 -9.461 -3.629 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.146 -10.228 -2.913 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.985 -9.432 -3.703 1.00 0.00 O ATOM 0 H GLU A 17 -10.024 -7.393 -6.164 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.973 -6.025 -3.737 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.881 -8.843 -4.080 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.772 -8.228 -2.702 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.553 -7.563 -4.643 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.774 -8.899 -5.467 1.00 0.00 H new ATOM 286 N ILE A 18 -8.685 -5.197 -3.116 1.00 0.00 N ATOM 287 CA ILE A 18 -7.385 -4.818 -2.515 1.00 0.00 C ATOM 288 C ILE A 18 -7.368 -5.227 -1.050 1.00 0.00 C ATOM 289 O ILE A 18 -8.355 -5.117 -0.351 1.00 0.00 O ATOM 290 CB ILE A 18 -7.180 -3.305 -2.603 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.431 -2.586 -2.051 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.898 -2.904 -4.053 1.00 0.00 C ATOM 293 CD1 ILE A 18 -9.307 -2.024 -3.180 1.00 0.00 C ATOM 0 H ILE A 18 -9.378 -4.450 -3.158 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.588 -5.324 -3.059 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.321 -3.009 -2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.015 -3.282 -1.449 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.123 -1.775 -1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.753 -1.825 -4.110 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.998 -3.410 -4.402 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.742 -3.190 -4.680 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -10.177 -1.526 -2.752 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -8.730 -1.308 -3.766 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -9.636 -2.839 -3.825 1.00 0.00 H new ATOM 305 N PHE A 19 -6.244 -5.673 -0.575 1.00 0.00 N ATOM 306 CA PHE A 19 -6.129 -6.052 0.864 1.00 0.00 C ATOM 307 C PHE A 19 -5.883 -4.768 1.668 1.00 0.00 C ATOM 308 O PHE A 19 -4.994 -4.699 2.492 1.00 0.00 O ATOM 309 CB PHE A 19 -4.945 -7.008 1.029 1.00 0.00 C ATOM 310 CG PHE A 19 -4.822 -7.447 2.466 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.807 -8.257 3.042 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.711 -7.049 3.219 1.00 0.00 C ATOM 313 CE1 PHE A 19 -5.678 -8.673 4.371 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.584 -7.460 4.549 1.00 0.00 C ATOM 315 CZ PHE A 19 -4.567 -8.273 5.126 1.00 0.00 C ATOM 0 H PHE A 19 -5.392 -5.794 -1.122 1.00 0.00 H new ATOM 0 HA PHE A 19 -7.035 -6.545 1.216 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.079 -7.878 0.386 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.025 -6.516 0.712 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.665 -8.560 2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.952 -6.424 2.772 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.435 -9.303 4.816 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.728 -7.151 5.131 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.469 -8.592 6.153 1.00 0.00 H new ATOM 325 N ILE A 20 -6.643 -3.737 1.395 1.00 0.00 N ATOM 326 CA ILE A 20 -6.447 -2.438 2.084 1.00 0.00 C ATOM 327 C ILE A 20 -7.112 -2.411 3.445 1.00 0.00 C ATOM 328 O ILE A 20 -8.133 -3.023 3.679 1.00 0.00 O ATOM 329 CB ILE A 20 -7.075 -1.324 1.253 1.00 0.00 C ATOM 330 CG1 ILE A 20 -6.893 0.018 1.966 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.570 -1.600 1.100 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.406 0.322 2.142 1.00 0.00 C ATOM 0 H ILE A 20 -7.401 -3.747 0.712 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.373 -2.299 2.205 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.594 -1.287 0.275 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -7.369 0.812 1.390 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.384 -0.009 2.939 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.027 -0.808 0.507 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.714 -2.557 0.599 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.037 -1.632 2.084 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.288 1.279 2.650 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -4.942 -0.465 2.737 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.926 0.369 1.164 1.00 0.00 H new ATOM 344 N THR A 21 -6.563 -1.629 4.312 1.00 0.00 N ATOM 345 CA THR A 21 -7.160 -1.456 5.658 1.00 0.00 C ATOM 346 C THR A 21 -8.532 -0.810 5.455 1.00 0.00 C ATOM 347 O THR A 21 -8.657 0.397 5.398 1.00 0.00 O ATOM 348 CB THR A 21 -6.259 -0.532 6.469 1.00 0.00 C ATOM 349 OG1 THR A 21 -6.971 -0.017 7.586 1.00 0.00 O ATOM 350 CG2 THR A 21 -5.784 0.617 5.581 1.00 0.00 C ATOM 0 H THR A 21 -5.712 -1.091 4.147 1.00 0.00 H new ATOM 0 HA THR A 21 -7.261 -2.404 6.187 1.00 0.00 H new ATOM 0 HB THR A 21 -5.397 -1.093 6.830 1.00 0.00 H new ATOM 0 HG1 THR A 21 -6.347 0.151 8.322 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.139 1.280 6.158 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.227 0.216 4.734 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.646 1.176 5.217 1.00 0.00 H new ATOM 358 N ARG A 22 -9.556 -1.601 5.305 1.00 0.00 N ATOM 359 CA ARG A 22 -10.905 -1.028 5.063 1.00 0.00 C ATOM 360 C ARG A 22 -11.604 -0.779 6.393 1.00 0.00 C ATOM 361 O ARG A 22 -12.040 -1.706 7.043 1.00 0.00 O ATOM 362 CB ARG A 22 -11.721 -2.011 4.225 1.00 0.00 C ATOM 363 CG ARG A 22 -13.170 -1.529 4.142 1.00 0.00 C ATOM 364 CD ARG A 22 -13.226 -0.242 3.322 1.00 0.00 C ATOM 365 NE ARG A 22 -14.652 0.117 3.066 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.963 1.305 2.624 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.041 2.219 2.498 1.00 0.00 N ATOM 368 NH2 ARG A 22 -16.199 1.582 2.307 1.00 0.00 N ATOM 0 H ARG A 22 -9.516 -2.620 5.340 1.00 0.00 H new ATOM 0 HA ARG A 22 -10.812 -0.082 4.530 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.296 -2.093 3.225 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.682 -3.005 4.670 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -13.795 -2.295 3.682 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -13.565 -1.354 5.143 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.726 0.566 3.857 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.697 -0.375 2.378 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.387 -0.569 3.237 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.075 2.006 2.745 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.286 3.147 2.152 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.922 0.870 2.405 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.441 2.511 1.962 1.00 0.00 H new ATOM 382 N ARG A 23 -11.697 0.479 6.783 1.00 0.00 N ATOM 383 CA ARG A 23 -12.358 0.876 8.077 1.00 0.00 C ATOM 384 C ARG A 23 -12.804 -0.356 8.860 1.00 0.00 C ATOM 385 O ARG A 23 -13.967 -0.708 8.875 1.00 0.00 O ATOM 386 CB ARG A 23 -13.576 1.761 7.788 1.00 0.00 C ATOM 387 CG ARG A 23 -14.173 1.402 6.425 1.00 0.00 C ATOM 388 CD ARG A 23 -15.688 1.623 6.463 1.00 0.00 C ATOM 389 NE ARG A 23 -16.377 0.496 5.774 1.00 0.00 N ATOM 390 CZ ARG A 23 -17.645 0.274 5.991 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.551 0.924 5.311 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.008 -0.600 6.889 1.00 0.00 N ATOM 0 H ARG A 23 -11.333 1.265 6.244 1.00 0.00 H new ATOM 0 HA ARG A 23 -11.633 1.428 8.675 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.325 1.629 8.569 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -13.284 2.811 7.801 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.724 2.016 5.645 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -13.951 0.363 6.180 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.029 1.694 7.496 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -15.940 2.567 5.979 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.857 -0.103 5.132 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.269 1.607 4.608 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.541 0.748 5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -17.301 -1.109 7.420 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -18.998 -0.775 7.060 1.00 0.00 H new ATOM 406 N ALA A 24 -11.873 -1.027 9.484 1.00 0.00 N ATOM 407 CA ALA A 24 -12.212 -2.259 10.247 1.00 0.00 C ATOM 408 C ALA A 24 -13.541 -2.069 10.983 1.00 0.00 C ATOM 409 O ALA A 24 -14.456 -2.855 10.844 1.00 0.00 O ATOM 410 CB ALA A 24 -11.108 -2.548 11.265 1.00 0.00 C ATOM 0 H ALA A 24 -10.886 -0.771 9.497 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.301 -3.095 9.553 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.356 -3.450 11.824 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.161 -2.692 10.744 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -11.019 -1.708 11.953 1.00 0.00 H new ATOM 416 N ALA A 25 -13.660 -1.029 11.764 1.00 0.00 N ATOM 417 CA ALA A 25 -14.933 -0.796 12.503 1.00 0.00 C ATOM 418 C ALA A 25 -15.966 -0.195 11.550 1.00 0.00 C ATOM 419 O ALA A 25 -15.715 -0.029 10.373 1.00 0.00 O ATOM 420 CB ALA A 25 -14.687 0.171 13.662 1.00 0.00 C ATOM 0 H ALA A 25 -12.932 -0.332 11.922 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.303 -1.743 12.897 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.620 0.339 14.200 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.948 -0.255 14.341 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.317 1.119 13.272 1.00 0.00 H new ATOM 426 N ASP A 26 -17.129 0.129 12.046 1.00 0.00 N ATOM 427 CA ASP A 26 -18.173 0.715 11.164 1.00 0.00 C ATOM 428 C ASP A 26 -17.893 2.205 10.954 1.00 0.00 C ATOM 429 O ASP A 26 -18.527 3.056 11.548 1.00 0.00 O ATOM 430 CB ASP A 26 -19.548 0.535 11.812 1.00 0.00 C ATOM 431 CG ASP A 26 -19.560 1.206 13.186 1.00 0.00 C ATOM 432 OD1 ASP A 26 -18.508 1.652 13.615 1.00 0.00 O ATOM 433 OD2 ASP A 26 -20.620 1.261 13.787 1.00 0.00 O ATOM 0 H ASP A 26 -17.399 0.013 13.023 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.158 0.208 10.199 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -20.320 0.970 11.177 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -19.778 -0.526 11.912 1.00 0.00 H new ATOM 438 N ALA A 27 -16.948 2.529 10.111 1.00 0.00 N ATOM 439 CA ALA A 27 -16.629 3.964 9.861 1.00 0.00 C ATOM 440 C ALA A 27 -17.890 4.689 9.392 1.00 0.00 C ATOM 441 O ALA A 27 -18.072 5.866 9.637 1.00 0.00 O ATOM 442 CB ALA A 27 -15.556 4.073 8.774 1.00 0.00 C ATOM 0 H ALA A 27 -16.384 1.861 9.585 1.00 0.00 H new ATOM 0 HA ALA A 27 -16.262 4.416 10.782 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.326 5.123 8.594 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -14.654 3.554 9.100 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -15.923 3.619 7.853 1.00 0.00 H new ATOM 448 N HIS A 28 -18.757 3.997 8.708 1.00 0.00 N ATOM 449 CA HIS A 28 -20.000 4.644 8.208 1.00 0.00 C ATOM 450 C HIS A 28 -19.634 5.664 7.128 1.00 0.00 C ATOM 451 O HIS A 28 -20.465 6.423 6.669 1.00 0.00 O ATOM 452 CB HIS A 28 -20.713 5.353 9.361 1.00 0.00 C ATOM 453 CG HIS A 28 -22.197 5.322 9.121 1.00 0.00 C ATOM 454 ND1 HIS A 28 -22.850 4.184 8.676 1.00 0.00 N ATOM 455 CD2 HIS A 28 -23.167 6.283 9.252 1.00 0.00 C ATOM 456 CE1 HIS A 28 -24.156 4.486 8.555 1.00 0.00 C ATOM 457 NE2 HIS A 28 -24.404 5.753 8.894 1.00 0.00 N ATOM 0 H HIS A 28 -18.658 3.009 8.473 1.00 0.00 H new ATOM 0 HA HIS A 28 -20.663 3.887 7.790 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -20.475 4.865 10.306 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -20.367 6.384 9.439 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -22.997 7.297 9.583 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -24.911 3.788 8.224 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -25.305 6.230 8.891 1.00 0.00 H new ATOM 465 N MET A 29 -18.394 5.686 6.716 1.00 0.00 N ATOM 466 CA MET A 29 -17.972 6.651 5.664 1.00 0.00 C ATOM 467 C MET A 29 -17.433 5.874 4.458 1.00 0.00 C ATOM 468 O MET A 29 -18.199 5.349 3.674 1.00 0.00 O ATOM 469 CB MET A 29 -16.885 7.576 6.221 1.00 0.00 C ATOM 470 CG MET A 29 -17.533 8.817 6.840 1.00 0.00 C ATOM 471 SD MET A 29 -18.680 8.308 8.145 1.00 0.00 S ATOM 472 CE MET A 29 -20.065 9.359 7.645 1.00 0.00 C ATOM 0 H MET A 29 -17.655 5.075 7.065 1.00 0.00 H new ATOM 0 HA MET A 29 -18.824 7.255 5.354 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.295 7.049 6.971 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.201 7.870 5.425 1.00 0.00 H new ATOM 0 HG2 MET A 29 -16.767 9.475 7.250 1.00 0.00 H new ATOM 0 HG3 MET A 29 -18.063 9.384 6.075 1.00 0.00 H new ATOM 0 HE1 MET A 29 -20.902 9.206 8.326 1.00 0.00 H new ATOM 0 HE2 MET A 29 -19.758 10.404 7.677 1.00 0.00 H new ATOM 0 HE3 MET A 29 -20.370 9.101 6.631 1.00 0.00 H new ATOM 482 N ALA A 30 -16.129 5.783 4.316 1.00 0.00 N ATOM 483 CA ALA A 30 -15.532 5.028 3.166 1.00 0.00 C ATOM 484 C ALA A 30 -14.153 5.598 2.813 1.00 0.00 C ATOM 485 O ALA A 30 -13.414 5.017 2.043 1.00 0.00 O ATOM 486 CB ALA A 30 -16.437 5.127 1.938 1.00 0.00 C ATOM 0 H ALA A 30 -15.450 6.202 4.951 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.431 3.984 3.462 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.991 4.574 1.111 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.414 4.704 2.171 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.552 6.173 1.654 1.00 0.00 H new ATOM 492 N ASN A 31 -13.794 6.721 3.365 1.00 0.00 N ATOM 493 CA ASN A 31 -12.458 7.311 3.052 1.00 0.00 C ATOM 494 C ASN A 31 -11.372 6.578 3.847 1.00 0.00 C ATOM 495 O ASN A 31 -10.220 6.968 3.845 1.00 0.00 O ATOM 496 CB ASN A 31 -12.442 8.792 3.435 1.00 0.00 C ATOM 497 CG ASN A 31 -13.331 9.579 2.471 1.00 0.00 C ATOM 498 OD1 ASN A 31 -14.532 9.626 2.636 1.00 0.00 O ATOM 499 ND2 ASN A 31 -12.783 10.208 1.468 1.00 0.00 N ATOM 0 H ASN A 31 -14.364 7.258 4.019 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.267 7.208 1.984 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -12.797 8.918 4.458 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -11.422 9.176 3.402 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -13.364 10.740 0.821 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -11.773 10.167 1.331 1.00 0.00 H new ATOM 506 N LYS A 32 -11.734 5.532 4.537 1.00 0.00 N ATOM 507 CA LYS A 32 -10.734 4.776 5.341 1.00 0.00 C ATOM 508 C LYS A 32 -9.958 3.798 4.448 1.00 0.00 C ATOM 509 O LYS A 32 -9.785 2.644 4.786 1.00 0.00 O ATOM 510 CB LYS A 32 -11.466 3.998 6.435 1.00 0.00 C ATOM 511 CG LYS A 32 -10.679 4.077 7.743 1.00 0.00 C ATOM 512 CD LYS A 32 -9.231 3.642 7.506 1.00 0.00 C ATOM 513 CE LYS A 32 -8.633 3.112 8.812 1.00 0.00 C ATOM 514 NZ LYS A 32 -7.582 4.051 9.295 1.00 0.00 N ATOM 0 H LYS A 32 -12.685 5.167 4.578 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.027 5.476 5.786 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.466 4.407 6.577 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.586 2.957 6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.703 5.095 8.131 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.142 3.438 8.495 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.194 2.870 6.738 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.643 4.484 7.140 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.414 3.005 9.565 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.206 2.122 8.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.176 3.691 10.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.832 4.131 8.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.003 4.987 9.462 1.00 0.00 H new ATOM 528 N LEU A 33 -9.485 4.241 3.319 1.00 0.00 N ATOM 529 CA LEU A 33 -8.718 3.323 2.428 1.00 0.00 C ATOM 530 C LEU A 33 -7.291 3.853 2.271 1.00 0.00 C ATOM 531 O LEU A 33 -7.003 4.644 1.394 1.00 0.00 O ATOM 532 CB LEU A 33 -9.399 3.250 1.060 1.00 0.00 C ATOM 533 CG LEU A 33 -10.671 2.401 1.154 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.135 2.035 -0.255 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.386 1.115 1.935 1.00 0.00 C ATOM 0 H LEU A 33 -9.594 5.194 2.973 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.689 2.325 2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.646 4.253 0.713 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.717 2.819 0.327 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.445 2.971 1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.040 1.431 -0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.343 2.945 -0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.353 1.468 -0.760 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.296 0.518 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.611 0.544 1.425 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.048 1.367 2.940 1.00 0.00 H new ATOM 547 N GLU A 34 -6.395 3.426 3.120 1.00 0.00 N ATOM 548 CA GLU A 34 -4.988 3.908 3.029 1.00 0.00 C ATOM 549 C GLU A 34 -4.183 2.971 2.115 1.00 0.00 C ATOM 550 O GLU A 34 -4.580 2.701 1.000 1.00 0.00 O ATOM 551 CB GLU A 34 -4.382 3.935 4.433 1.00 0.00 C ATOM 552 CG GLU A 34 -3.155 4.849 4.443 1.00 0.00 C ATOM 553 CD GLU A 34 -2.278 4.513 5.651 1.00 0.00 C ATOM 554 OE1 GLU A 34 -1.769 3.406 5.698 1.00 0.00 O ATOM 555 OE2 GLU A 34 -2.134 5.368 6.509 1.00 0.00 O ATOM 0 H GLU A 34 -6.578 2.763 3.873 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.961 4.913 2.607 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.120 4.291 5.152 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.100 2.927 4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.587 4.723 3.521 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.466 5.893 4.485 1.00 0.00 H new ATOM 562 N PHE A 35 -3.060 2.470 2.569 1.00 0.00 N ATOM 563 CA PHE A 35 -2.258 1.553 1.707 1.00 0.00 C ATOM 564 C PHE A 35 -1.384 0.656 2.593 1.00 0.00 C ATOM 565 O PHE A 35 -0.674 1.144 3.450 1.00 0.00 O ATOM 566 CB PHE A 35 -1.357 2.374 0.781 1.00 0.00 C ATOM 567 CG PHE A 35 -2.045 3.671 0.430 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.864 4.802 1.238 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.864 3.744 -0.701 1.00 0.00 C ATOM 570 CE1 PHE A 35 -2.503 6.003 0.912 1.00 0.00 C ATOM 571 CE2 PHE A 35 -3.503 4.944 -1.027 1.00 0.00 C ATOM 572 CZ PHE A 35 -3.323 6.073 -0.221 1.00 0.00 C ATOM 0 H PHE A 35 -2.668 2.656 3.492 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.932 0.939 1.110 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.404 2.576 1.269 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.138 1.809 -0.125 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.232 4.746 2.112 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -3.003 2.872 -1.323 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.364 6.875 1.533 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -4.135 4.999 -1.901 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.817 7.000 -0.473 1.00 0.00 H new ATOM 582 N PRO A 36 -1.456 -0.634 2.357 1.00 0.00 N ATOM 583 CA PRO A 36 -0.669 -1.616 3.127 1.00 0.00 C ATOM 584 C PRO A 36 0.813 -1.478 2.766 1.00 0.00 C ATOM 585 O PRO A 36 1.262 -1.991 1.760 1.00 0.00 O ATOM 586 CB PRO A 36 -1.208 -2.977 2.667 1.00 0.00 C ATOM 587 CG PRO A 36 -2.069 -2.728 1.399 1.00 0.00 C ATOM 588 CD PRO A 36 -2.321 -1.217 1.315 1.00 0.00 C ATOM 0 HA PRO A 36 -0.754 -1.482 4.205 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.388 -3.660 2.447 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.806 -3.439 3.453 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.553 -3.083 0.507 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.011 -3.273 1.460 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.069 -0.828 0.328 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.370 -0.980 1.493 1.00 0.00 H new ATOM 596 N GLY A 37 1.577 -0.775 3.559 1.00 0.00 N ATOM 597 CA GLY A 37 3.016 -0.601 3.219 1.00 0.00 C ATOM 598 C GLY A 37 3.913 -1.384 4.172 1.00 0.00 C ATOM 599 O GLY A 37 3.457 -2.150 4.999 1.00 0.00 O ATOM 0 H GLY A 37 1.270 -0.319 4.418 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.192 -0.933 2.196 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.275 0.457 3.260 1.00 0.00 H new ATOM 603 N GLY A 38 5.196 -1.194 4.040 1.00 0.00 N ATOM 604 CA GLY A 38 6.163 -1.908 4.911 1.00 0.00 C ATOM 605 C GLY A 38 7.531 -1.225 4.836 1.00 0.00 C ATOM 606 O GLY A 38 8.536 -1.818 5.162 1.00 0.00 O ATOM 0 H GLY A 38 5.618 -0.566 3.356 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.805 -1.913 5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.248 -2.949 4.598 1.00 0.00 H new ATOM 610 N LYS A 39 7.573 0.019 4.417 1.00 0.00 N ATOM 611 CA LYS A 39 8.874 0.743 4.323 1.00 0.00 C ATOM 612 C LYS A 39 9.822 0.000 3.382 1.00 0.00 C ATOM 613 O LYS A 39 10.334 -1.050 3.718 1.00 0.00 O ATOM 614 CB LYS A 39 9.515 0.816 5.706 1.00 0.00 C ATOM 615 CG LYS A 39 10.910 1.430 5.581 1.00 0.00 C ATOM 616 CD LYS A 39 10.781 2.945 5.473 1.00 0.00 C ATOM 617 CE LYS A 39 11.747 3.468 4.408 1.00 0.00 C ATOM 618 NZ LYS A 39 13.141 3.406 4.930 1.00 0.00 N ATOM 0 H LYS A 39 6.757 0.562 4.136 1.00 0.00 H new ATOM 0 HA LYS A 39 8.691 1.747 3.939 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.899 1.417 6.375 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.581 -0.181 6.143 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.516 1.165 6.447 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.418 1.032 4.703 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.757 3.215 5.214 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.999 3.408 6.435 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.661 2.872 3.499 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.492 4.494 4.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.799 3.761 4.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.218 3.992 5.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.381 2.421 5.162 1.00 0.00 H new ATOM 632 N ILE A 40 10.085 0.531 2.216 1.00 0.00 N ATOM 633 CA ILE A 40 11.028 -0.172 1.301 1.00 0.00 C ATOM 634 C ILE A 40 12.452 0.162 1.699 1.00 0.00 C ATOM 635 O ILE A 40 12.816 1.306 1.872 1.00 0.00 O ATOM 636 CB ILE A 40 10.782 0.237 -0.145 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.005 -0.089 -1.016 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.476 1.739 -0.216 1.00 0.00 C ATOM 639 CD1 ILE A 40 11.819 0.548 -2.388 1.00 0.00 C ATOM 0 H ILE A 40 9.695 1.405 1.864 1.00 0.00 H new ATOM 0 HA ILE A 40 10.866 -1.247 1.383 1.00 0.00 H new ATOM 0 HB ILE A 40 9.928 -0.324 -0.524 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.913 0.287 -0.546 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.121 -1.168 -1.114 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.301 2.026 -1.253 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.587 1.958 0.376 1.00 0.00 H new ATOM 0 HG23 ILE A 40 11.322 2.302 0.178 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.682 0.322 -3.014 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.918 0.150 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.723 1.628 -2.278 1.00 0.00 H new ATOM 651 N GLU A 41 13.257 -0.835 1.832 1.00 0.00 N ATOM 652 CA GLU A 41 14.667 -0.590 2.205 1.00 0.00 C ATOM 653 C GLU A 41 15.463 -1.902 2.149 1.00 0.00 C ATOM 654 O GLU A 41 16.661 -1.901 1.944 1.00 0.00 O ATOM 655 CB GLU A 41 14.710 0.021 3.607 1.00 0.00 C ATOM 656 CG GLU A 41 14.466 -1.064 4.660 1.00 0.00 C ATOM 657 CD GLU A 41 14.222 -0.405 6.019 1.00 0.00 C ATOM 658 OE1 GLU A 41 14.827 0.623 6.275 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.431 -0.939 6.781 1.00 0.00 O ATOM 0 H GLU A 41 13.003 -1.814 1.699 1.00 0.00 H new ATOM 0 HA GLU A 41 15.123 0.106 1.501 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.678 0.493 3.777 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.954 0.802 3.696 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.607 -1.673 4.379 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.325 -1.732 4.716 1.00 0.00 H new ATOM 666 N MET A 42 14.810 -3.023 2.321 1.00 0.00 N ATOM 667 CA MET A 42 15.540 -4.324 2.267 1.00 0.00 C ATOM 668 C MET A 42 16.422 -4.357 1.016 1.00 0.00 C ATOM 669 O MET A 42 16.143 -3.702 0.029 1.00 0.00 O ATOM 670 CB MET A 42 14.535 -5.479 2.210 1.00 0.00 C ATOM 671 CG MET A 42 14.796 -6.448 3.367 1.00 0.00 C ATOM 672 SD MET A 42 13.929 -5.865 4.847 1.00 0.00 S ATOM 673 CE MET A 42 13.367 -7.483 5.432 1.00 0.00 C ATOM 0 H MET A 42 13.808 -3.093 2.496 1.00 0.00 H new ATOM 0 HA MET A 42 16.159 -4.429 3.158 1.00 0.00 H new ATOM 0 HB2 MET A 42 13.518 -5.092 2.270 1.00 0.00 H new ATOM 0 HB3 MET A 42 14.622 -6.003 1.258 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.454 -7.449 3.102 1.00 0.00 H new ATOM 0 HG3 MET A 42 15.866 -6.518 3.563 1.00 0.00 H new ATOM 0 HE1 MET A 42 12.799 -7.359 6.354 1.00 0.00 H new ATOM 0 HE2 MET A 42 12.734 -7.944 4.674 1.00 0.00 H new ATOM 0 HE3 MET A 42 14.230 -8.121 5.621 1.00 0.00 H new ATOM 683 N GLY A 43 17.487 -5.111 1.048 1.00 0.00 N ATOM 684 CA GLY A 43 18.383 -5.179 -0.139 1.00 0.00 C ATOM 685 C GLY A 43 18.661 -3.764 -0.645 1.00 0.00 C ATOM 686 O GLY A 43 19.237 -2.947 0.045 1.00 0.00 O ATOM 0 H GLY A 43 17.774 -5.681 1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.318 -5.673 0.125 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.919 -5.774 -0.926 1.00 0.00 H new ATOM 690 N GLU A 44 18.247 -3.470 -1.845 1.00 0.00 N ATOM 691 CA GLU A 44 18.473 -2.108 -2.405 1.00 0.00 C ATOM 692 C GLU A 44 17.702 -1.958 -3.719 1.00 0.00 C ATOM 693 O GLU A 44 18.042 -1.150 -4.562 1.00 0.00 O ATOM 694 CB GLU A 44 19.969 -1.896 -2.653 1.00 0.00 C ATOM 695 CG GLU A 44 20.410 -2.700 -3.878 1.00 0.00 C ATOM 696 CD GLU A 44 21.778 -3.330 -3.606 1.00 0.00 C ATOM 697 OE1 GLU A 44 21.822 -4.310 -2.881 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.757 -2.821 -4.126 1.00 0.00 O ATOM 0 H GLU A 44 17.760 -4.117 -2.465 1.00 0.00 H new ATOM 0 HA GLU A 44 18.118 -1.361 -1.695 1.00 0.00 H new ATOM 0 HB2 GLU A 44 20.175 -0.837 -2.808 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.540 -2.207 -1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.678 -3.476 -4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 44 20.463 -2.052 -4.753 1.00 0.00 H new ATOM 705 N THR A 45 16.666 -2.731 -3.899 1.00 0.00 N ATOM 706 CA THR A 45 15.869 -2.643 -5.149 1.00 0.00 C ATOM 707 C THR A 45 14.397 -2.786 -4.770 1.00 0.00 C ATOM 708 O THR A 45 14.072 -3.583 -3.930 1.00 0.00 O ATOM 709 CB THR A 45 16.293 -3.792 -6.073 1.00 0.00 C ATOM 710 OG1 THR A 45 17.664 -3.637 -6.413 1.00 0.00 O ATOM 711 CG2 THR A 45 15.451 -3.786 -7.349 1.00 0.00 C ATOM 0 H THR A 45 16.337 -3.424 -3.227 1.00 0.00 H new ATOM 0 HA THR A 45 16.028 -1.694 -5.662 1.00 0.00 H new ATOM 0 HB THR A 45 16.142 -4.739 -5.555 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.940 -4.370 -7.002 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.763 -4.607 -7.995 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.399 -3.907 -7.091 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.590 -2.840 -7.872 1.00 0.00 H new ATOM 719 N PRO A 46 13.542 -2.018 -5.386 1.00 0.00 N ATOM 720 CA PRO A 46 12.102 -2.089 -5.086 1.00 0.00 C ATOM 721 C PRO A 46 11.623 -3.542 -5.143 1.00 0.00 C ATOM 722 O PRO A 46 10.601 -3.886 -4.587 1.00 0.00 O ATOM 723 CB PRO A 46 11.437 -1.226 -6.161 1.00 0.00 C ATOM 724 CG PRO A 46 12.569 -0.513 -6.953 1.00 0.00 C ATOM 725 CD PRO A 46 13.917 -1.035 -6.417 1.00 0.00 C ATOM 0 HA PRO A 46 11.858 -1.732 -4.086 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.832 -1.841 -6.827 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.768 -0.495 -5.707 1.00 0.00 H new ATOM 0 HG2 PRO A 46 12.477 -0.717 -8.020 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.501 0.568 -6.828 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.509 -1.495 -7.209 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.518 -0.228 -5.998 1.00 0.00 H new ATOM 733 N GLU A 47 12.366 -4.405 -5.785 1.00 0.00 N ATOM 734 CA GLU A 47 11.962 -5.834 -5.842 1.00 0.00 C ATOM 735 C GLU A 47 12.355 -6.503 -4.525 1.00 0.00 C ATOM 736 O GLU A 47 11.578 -6.572 -3.612 1.00 0.00 O ATOM 737 CB GLU A 47 12.674 -6.537 -6.998 1.00 0.00 C ATOM 738 CG GLU A 47 11.656 -6.892 -8.081 1.00 0.00 C ATOM 739 CD GLU A 47 12.317 -7.785 -9.131 1.00 0.00 C ATOM 740 OE1 GLU A 47 13.504 -7.616 -9.362 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.626 -8.623 -9.688 1.00 0.00 O ATOM 0 H GLU A 47 13.234 -4.179 -6.271 1.00 0.00 H new ATOM 0 HA GLU A 47 10.885 -5.903 -5.998 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.449 -5.890 -7.410 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.170 -7.439 -6.640 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.802 -7.405 -7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.275 -5.984 -8.548 1.00 0.00 H new ATOM 748 N GLN A 48 13.556 -6.989 -4.413 1.00 0.00 N ATOM 749 CA GLN A 48 13.969 -7.647 -3.136 1.00 0.00 C ATOM 750 C GLN A 48 13.485 -6.831 -1.948 1.00 0.00 C ATOM 751 O GLN A 48 13.231 -7.353 -0.891 1.00 0.00 O ATOM 752 CB GLN A 48 15.487 -7.746 -3.061 1.00 0.00 C ATOM 753 CG GLN A 48 15.946 -8.904 -3.942 1.00 0.00 C ATOM 754 CD GLN A 48 17.312 -9.402 -3.468 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.315 -9.166 -4.111 1.00 0.00 O ATOM 756 NE2 GLN A 48 17.391 -10.089 -2.362 1.00 0.00 N ATOM 0 H GLN A 48 14.269 -6.962 -5.142 1.00 0.00 H new ATOM 0 HA GLN A 48 13.529 -8.644 -3.110 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.943 -6.814 -3.394 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.805 -7.906 -2.031 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.219 -9.715 -3.902 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.006 -8.581 -4.981 1.00 0.00 H new ATOM 0 HE21 GLN A 48 16.548 -10.286 -1.823 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.296 -10.429 -2.036 1.00 0.00 H new ATOM 765 N ALA A 49 13.369 -5.556 -2.114 1.00 0.00 N ATOM 766 CA ALA A 49 12.915 -4.697 -0.992 1.00 0.00 C ATOM 767 C ALA A 49 11.425 -4.924 -0.735 1.00 0.00 C ATOM 768 O ALA A 49 11.038 -5.333 0.330 1.00 0.00 O ATOM 769 CB ALA A 49 13.154 -3.229 -1.342 1.00 0.00 C ATOM 0 H ALA A 49 13.570 -5.063 -2.984 1.00 0.00 H new ATOM 0 HA ALA A 49 13.478 -4.954 -0.094 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.820 -2.599 -0.517 1.00 0.00 H new ATOM 0 HB2 ALA A 49 14.217 -3.065 -1.516 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.595 -2.974 -2.242 1.00 0.00 H new ATOM 775 N VAL A 50 10.586 -4.656 -1.697 1.00 0.00 N ATOM 776 CA VAL A 50 9.117 -4.849 -1.485 1.00 0.00 C ATOM 777 C VAL A 50 8.799 -6.335 -1.317 1.00 0.00 C ATOM 778 O VAL A 50 8.068 -6.733 -0.438 1.00 0.00 O ATOM 779 CB VAL A 50 8.358 -4.280 -2.691 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.409 -5.264 -3.863 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.901 -4.036 -2.305 1.00 0.00 C ATOM 0 H VAL A 50 10.850 -4.312 -2.620 1.00 0.00 H new ATOM 0 HA VAL A 50 8.808 -4.326 -0.580 1.00 0.00 H new ATOM 0 HB VAL A 50 8.826 -3.343 -2.991 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.867 -4.847 -4.712 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.447 -5.439 -4.146 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.950 -6.207 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.361 -3.632 -3.161 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.443 -4.977 -1.998 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.857 -3.325 -1.480 1.00 0.00 H new ATOM 791 N VAL A 51 9.349 -7.141 -2.163 1.00 0.00 N ATOM 792 CA VAL A 51 9.120 -8.609 -2.105 1.00 0.00 C ATOM 793 C VAL A 51 9.601 -9.154 -0.752 1.00 0.00 C ATOM 794 O VAL A 51 8.910 -9.905 -0.094 1.00 0.00 O ATOM 795 CB VAL A 51 9.903 -9.254 -3.255 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.357 -9.449 -2.843 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.293 -10.606 -3.613 1.00 0.00 C ATOM 0 H VAL A 51 9.967 -6.840 -2.917 1.00 0.00 H new ATOM 0 HA VAL A 51 8.059 -8.839 -2.205 1.00 0.00 H new ATOM 0 HB VAL A 51 9.855 -8.598 -4.124 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.909 -9.908 -3.663 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.800 -8.482 -2.603 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.403 -10.097 -1.968 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.857 -11.055 -4.431 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.329 -11.263 -2.744 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.256 -10.468 -3.920 1.00 0.00 H new ATOM 807 N ARG A 52 10.779 -8.773 -0.326 1.00 0.00 N ATOM 808 CA ARG A 52 11.288 -9.258 0.986 1.00 0.00 C ATOM 809 C ARG A 52 10.526 -8.517 2.079 1.00 0.00 C ATOM 810 O ARG A 52 10.388 -8.985 3.191 1.00 0.00 O ATOM 811 CB ARG A 52 12.795 -8.999 1.096 1.00 0.00 C ATOM 812 CG ARG A 52 13.521 -9.796 0.011 1.00 0.00 C ATOM 813 CD ARG A 52 14.224 -10.995 0.651 1.00 0.00 C ATOM 814 NE ARG A 52 15.128 -10.522 1.736 1.00 0.00 N ATOM 815 CZ ARG A 52 15.584 -11.364 2.622 1.00 0.00 C ATOM 816 NH1 ARG A 52 16.666 -12.050 2.376 1.00 0.00 N ATOM 817 NH2 ARG A 52 14.959 -11.519 3.757 1.00 0.00 N ATOM 0 H ARG A 52 11.407 -8.148 -0.831 1.00 0.00 H new ATOM 0 HA ARG A 52 11.133 -10.332 1.088 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.003 -7.935 0.983 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.156 -9.291 2.082 1.00 0.00 H new ATOM 0 HG2 ARG A 52 12.811 -10.136 -0.743 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.248 -9.162 -0.497 1.00 0.00 H new ATOM 0 HD2 ARG A 52 13.487 -11.689 1.055 1.00 0.00 H new ATOM 0 HD3 ARG A 52 14.795 -11.539 -0.101 1.00 0.00 H new ATOM 0 HE ARG A 52 15.391 -9.538 1.786 1.00 0.00 H new ATOM 0 HH11 ARG A 52 17.157 -11.928 1.490 1.00 0.00 H new ATOM 0 HH12 ARG A 52 17.021 -12.708 3.070 1.00 0.00 H new ATOM 0 HH21 ARG A 52 14.114 -10.982 3.951 1.00 0.00 H new ATOM 0 HH22 ARG A 52 15.315 -12.177 4.450 1.00 0.00 H new ATOM 831 N GLU A 53 9.972 -7.386 1.738 1.00 0.00 N ATOM 832 CA GLU A 53 9.142 -6.626 2.710 1.00 0.00 C ATOM 833 C GLU A 53 7.784 -7.319 2.753 1.00 0.00 C ATOM 834 O GLU A 53 6.998 -7.162 3.664 1.00 0.00 O ATOM 835 CB GLU A 53 8.938 -5.197 2.211 1.00 0.00 C ATOM 836 CG GLU A 53 10.190 -4.368 2.469 1.00 0.00 C ATOM 837 CD GLU A 53 10.128 -3.782 3.877 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.111 -3.965 4.523 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.100 -3.169 4.288 1.00 0.00 O ATOM 0 H GLU A 53 10.061 -6.953 0.819 1.00 0.00 H new ATOM 0 HA GLU A 53 9.621 -6.595 3.689 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.711 -5.205 1.145 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.084 -4.746 2.716 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.079 -4.989 2.360 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.268 -3.568 1.733 1.00 0.00 H new ATOM 846 N LEU A 54 7.524 -8.075 1.723 1.00 0.00 N ATOM 847 CA LEU A 54 6.246 -8.813 1.584 1.00 0.00 C ATOM 848 C LEU A 54 6.280 -10.087 2.424 1.00 0.00 C ATOM 849 O LEU A 54 5.318 -10.451 3.070 1.00 0.00 O ATOM 850 CB LEU A 54 6.082 -9.174 0.099 1.00 0.00 C ATOM 851 CG LEU A 54 5.075 -8.240 -0.576 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.689 -8.471 0.011 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.492 -6.785 -0.340 1.00 0.00 C ATOM 0 H LEU A 54 8.171 -8.213 0.947 1.00 0.00 H new ATOM 0 HA LEU A 54 5.413 -8.201 1.929 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.045 -9.104 -0.406 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.747 -10.207 0.005 1.00 0.00 H new ATOM 0 HG LEU A 54 5.053 -8.445 -1.646 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.974 -7.805 -0.471 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.391 -9.506 -0.157 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.709 -8.268 1.082 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.775 -6.119 -0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.515 -6.582 0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.483 -6.617 -0.762 1.00 0.00 H new ATOM 865 N GLN A 55 7.381 -10.771 2.401 1.00 0.00 N ATOM 866 CA GLN A 55 7.498 -12.037 3.182 1.00 0.00 C ATOM 867 C GLN A 55 7.779 -11.708 4.644 1.00 0.00 C ATOM 868 O GLN A 55 7.225 -12.307 5.546 1.00 0.00 O ATOM 869 CB GLN A 55 8.646 -12.902 2.634 1.00 0.00 C ATOM 870 CG GLN A 55 9.039 -12.453 1.220 1.00 0.00 C ATOM 871 CD GLN A 55 10.095 -13.406 0.657 1.00 0.00 C ATOM 872 OE1 GLN A 55 10.953 -13.964 1.469 1.00 0.00 O flip ATOM 873 NE2 GLN A 55 10.139 -13.649 -0.532 1.00 0.00 N flip ATOM 0 H GLN A 55 8.214 -10.511 1.873 1.00 0.00 H new ATOM 0 HA GLN A 55 6.562 -12.588 3.095 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.509 -12.831 3.296 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.343 -13.949 2.617 1.00 0.00 H new ATOM 0 HG2 GLN A 55 8.162 -12.442 0.573 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.429 -11.435 1.245 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.469 -13.214 -1.167 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.845 -14.288 -0.896 1.00 0.00 H new ATOM 882 N GLU A 56 8.646 -10.768 4.883 1.00 0.00 N ATOM 883 CA GLU A 56 8.981 -10.405 6.284 1.00 0.00 C ATOM 884 C GLU A 56 7.717 -9.987 7.032 1.00 0.00 C ATOM 885 O GLU A 56 7.659 -10.048 8.244 1.00 0.00 O ATOM 886 CB GLU A 56 9.993 -9.253 6.286 1.00 0.00 C ATOM 887 CG GLU A 56 9.452 -8.067 5.489 1.00 0.00 C ATOM 888 CD GLU A 56 8.617 -7.159 6.400 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.357 -7.557 7.522 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.253 -6.076 5.959 1.00 0.00 O ATOM 0 H GLU A 56 9.138 -10.234 4.167 1.00 0.00 H new ATOM 0 HA GLU A 56 9.417 -11.270 6.785 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.202 -8.946 7.311 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.936 -9.589 5.855 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.278 -7.502 5.057 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.842 -8.424 4.660 1.00 0.00 H new ATOM 897 N GLU A 57 6.705 -9.558 6.333 1.00 0.00 N ATOM 898 CA GLU A 57 5.458 -9.135 7.024 1.00 0.00 C ATOM 899 C GLU A 57 4.614 -10.354 7.397 1.00 0.00 C ATOM 900 O GLU A 57 4.761 -10.928 8.459 1.00 0.00 O ATOM 901 CB GLU A 57 4.659 -8.198 6.113 1.00 0.00 C ATOM 902 CG GLU A 57 5.094 -6.764 6.405 1.00 0.00 C ATOM 903 CD GLU A 57 5.103 -5.928 5.125 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.541 -6.378 4.140 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.680 -4.848 5.155 1.00 0.00 O ATOM 0 H GLU A 57 6.688 -9.482 5.316 1.00 0.00 H new ATOM 0 HA GLU A 57 5.722 -8.607 7.940 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.836 -8.443 5.066 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.590 -8.315 6.291 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.418 -6.315 7.133 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.088 -6.765 6.851 1.00 0.00 H new ATOM 912 N VAL A 58 3.716 -10.735 6.538 1.00 0.00 N ATOM 913 CA VAL A 58 2.828 -11.891 6.826 1.00 0.00 C ATOM 914 C VAL A 58 3.554 -13.215 6.554 1.00 0.00 C ATOM 915 O VAL A 58 4.030 -13.855 7.472 1.00 0.00 O ATOM 916 CB VAL A 58 1.604 -11.742 5.942 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.555 -12.786 6.304 1.00 0.00 C ATOM 918 CG2 VAL A 58 1.034 -10.341 6.168 1.00 0.00 C ATOM 0 H VAL A 58 3.557 -10.288 5.635 1.00 0.00 H new ATOM 0 HA VAL A 58 2.537 -11.906 7.876 1.00 0.00 H new ATOM 0 HB VAL A 58 1.879 -11.885 4.897 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.316 -12.665 5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.972 -13.784 6.166 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.258 -12.657 7.345 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.151 -10.203 5.545 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.760 -10.224 7.217 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.785 -9.596 5.904 1.00 0.00 H new ATOM 928 N GLY A 59 3.670 -13.639 5.319 1.00 0.00 N ATOM 929 CA GLY A 59 4.400 -14.921 5.068 1.00 0.00 C ATOM 930 C GLY A 59 3.720 -15.795 3.996 1.00 0.00 C ATOM 931 O GLY A 59 3.761 -17.006 4.073 1.00 0.00 O ATOM 0 H GLY A 59 3.301 -13.167 4.493 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.420 -14.698 4.755 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.468 -15.483 5.999 1.00 0.00 H new ATOM 935 N ILE A 60 3.136 -15.219 2.979 1.00 0.00 N ATOM 936 CA ILE A 60 2.518 -16.071 1.911 1.00 0.00 C ATOM 937 C ILE A 60 3.594 -16.308 0.843 1.00 0.00 C ATOM 938 O ILE A 60 4.761 -16.410 1.164 1.00 0.00 O ATOM 939 CB ILE A 60 1.304 -15.360 1.301 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.734 -13.984 0.815 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.216 -15.211 2.364 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.495 -13.874 -0.691 1.00 0.00 C ATOM 0 H ILE A 60 3.058 -14.212 2.839 1.00 0.00 H new ATOM 0 HA ILE A 60 2.171 -17.018 2.323 1.00 0.00 H new ATOM 0 HB ILE A 60 0.913 -15.941 0.466 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.173 -13.210 1.340 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.788 -13.821 1.039 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.648 -14.706 1.932 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.081 -16.197 2.721 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.600 -14.624 3.198 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.804 -12.888 -1.037 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.075 -14.638 -1.208 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.435 -14.018 -0.903 1.00 0.00 H new ATOM 954 N THR A 61 3.248 -16.384 -0.415 1.00 0.00 N ATOM 955 CA THR A 61 4.319 -16.596 -1.436 1.00 0.00 C ATOM 956 C THR A 61 4.029 -15.765 -2.704 1.00 0.00 C ATOM 957 O THR A 61 4.693 -14.771 -2.929 1.00 0.00 O ATOM 958 CB THR A 61 4.463 -18.094 -1.752 1.00 0.00 C ATOM 959 OG1 THR A 61 5.281 -18.700 -0.760 1.00 0.00 O ATOM 960 CG2 THR A 61 5.117 -18.281 -3.126 1.00 0.00 C ATOM 0 H THR A 61 2.296 -16.311 -0.775 1.00 0.00 H new ATOM 0 HA THR A 61 5.271 -16.251 -1.032 1.00 0.00 H new ATOM 0 HB THR A 61 3.476 -18.557 -1.760 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.352 -18.104 0.014 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.215 -19.345 -3.341 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.498 -17.812 -3.891 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.104 -17.819 -3.125 1.00 0.00 H new ATOM 968 N PRO A 62 3.060 -16.167 -3.501 1.00 0.00 N ATOM 969 CA PRO A 62 2.726 -15.424 -4.726 1.00 0.00 C ATOM 970 C PRO A 62 2.203 -14.028 -4.388 1.00 0.00 C ATOM 971 O PRO A 62 2.230 -13.593 -3.255 1.00 0.00 O ATOM 972 CB PRO A 62 1.616 -16.235 -5.396 1.00 0.00 C ATOM 973 CG PRO A 62 1.186 -17.333 -4.401 1.00 0.00 C ATOM 974 CD PRO A 62 2.230 -17.361 -3.269 1.00 0.00 C ATOM 0 HA PRO A 62 3.600 -15.297 -5.366 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.772 -15.594 -5.650 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.971 -16.677 -6.327 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.193 -17.123 -4.003 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.132 -18.302 -4.898 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.754 -17.329 -2.289 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.827 -18.272 -3.303 1.00 0.00 H new ATOM 982 N GLN A 63 1.717 -13.350 -5.388 1.00 0.00 N ATOM 983 CA GLN A 63 1.164 -11.979 -5.222 1.00 0.00 C ATOM 984 C GLN A 63 1.405 -11.229 -6.526 1.00 0.00 C ATOM 985 O GLN A 63 0.724 -10.282 -6.839 1.00 0.00 O ATOM 986 CB GLN A 63 1.851 -11.230 -4.076 1.00 0.00 C ATOM 987 CG GLN A 63 3.364 -11.420 -4.162 1.00 0.00 C ATOM 988 CD GLN A 63 4.081 -10.080 -3.943 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.485 -9.116 -3.292 1.00 0.00 O flip ATOM 990 NE2 GLN A 63 5.204 -9.910 -4.373 1.00 0.00 N flip ATOM 0 H GLN A 63 1.679 -13.702 -6.345 1.00 0.00 H new ATOM 0 HA GLN A 63 0.102 -12.044 -4.984 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.606 -10.169 -4.125 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.484 -11.598 -3.118 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.690 -12.142 -3.413 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.632 -11.829 -5.136 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.674 -10.659 -4.882 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.677 -9.019 -4.225 1.00 0.00 H new ATOM 999 N HIS A 64 2.374 -11.658 -7.294 1.00 0.00 N ATOM 1000 CA HIS A 64 2.661 -10.973 -8.584 1.00 0.00 C ATOM 1001 C HIS A 64 2.623 -9.464 -8.359 1.00 0.00 C ATOM 1002 O HIS A 64 1.643 -8.805 -8.638 1.00 0.00 O ATOM 1003 CB HIS A 64 1.603 -11.376 -9.610 1.00 0.00 C ATOM 1004 CG HIS A 64 2.102 -11.080 -10.999 1.00 0.00 C ATOM 1005 ND1 HIS A 64 1.248 -11.011 -12.089 1.00 0.00 N ATOM 1006 CD2 HIS A 64 3.360 -10.834 -11.492 1.00 0.00 C ATOM 1007 CE1 HIS A 64 1.996 -10.732 -13.173 1.00 0.00 C ATOM 1008 NE2 HIS A 64 3.290 -10.615 -12.866 1.00 0.00 N ATOM 0 H HIS A 64 2.977 -12.453 -7.081 1.00 0.00 H new ATOM 0 HA HIS A 64 3.645 -11.259 -8.954 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.376 -12.438 -9.514 1.00 0.00 H new ATOM 0 HB3 HIS A 64 0.676 -10.833 -9.423 1.00 0.00 H new ATOM 0 HD2 HIS A 64 4.266 -10.813 -10.904 1.00 0.00 H new ATOM 0 HE1 HIS A 64 1.598 -10.617 -14.170 1.00 0.00 H new ATOM 0 HE2 HIS A 64 4.061 -10.409 -13.501 1.00 0.00 H new ATOM 1016 N PHE A 65 3.683 -8.920 -7.834 1.00 0.00 N ATOM 1017 CA PHE A 65 3.720 -7.459 -7.559 1.00 0.00 C ATOM 1018 C PHE A 65 3.933 -6.678 -8.857 1.00 0.00 C ATOM 1019 O PHE A 65 4.634 -7.107 -9.750 1.00 0.00 O ATOM 1020 CB PHE A 65 4.864 -7.172 -6.589 1.00 0.00 C ATOM 1021 CG PHE A 65 6.183 -7.443 -7.269 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.762 -8.716 -7.205 1.00 0.00 C ATOM 1023 CD2 PHE A 65 6.830 -6.414 -7.961 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.987 -8.960 -7.838 1.00 0.00 C ATOM 1025 CE2 PHE A 65 8.055 -6.656 -8.593 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.634 -7.930 -8.531 1.00 0.00 C ATOM 0 H PHE A 65 4.531 -9.428 -7.582 1.00 0.00 H new ATOM 0 HA PHE A 65 2.772 -7.147 -7.122 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.821 -6.135 -6.257 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.766 -7.796 -5.701 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.264 -9.510 -6.668 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.384 -5.432 -8.008 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.433 -9.943 -7.792 1.00 0.00 H new ATOM 0 HE2 PHE A 65 8.553 -5.861 -9.128 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.580 -8.118 -9.018 1.00 0.00 H new ATOM 1036 N SER A 66 3.329 -5.525 -8.954 1.00 0.00 N ATOM 1037 CA SER A 66 3.478 -4.687 -10.177 1.00 0.00 C ATOM 1038 C SER A 66 3.563 -3.223 -9.748 1.00 0.00 C ATOM 1039 O SER A 66 2.907 -2.814 -8.822 1.00 0.00 O ATOM 1040 CB SER A 66 2.263 -4.883 -11.081 1.00 0.00 C ATOM 1041 OG SER A 66 1.558 -6.049 -10.674 1.00 0.00 O ATOM 0 H SER A 66 2.733 -5.124 -8.230 1.00 0.00 H new ATOM 0 HA SER A 66 4.377 -4.973 -10.722 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.610 -4.012 -11.026 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.580 -4.979 -12.120 1.00 0.00 H new ATOM 0 HG SER A 66 0.931 -5.819 -9.957 1.00 0.00 H new ATOM 1047 N LEU A 67 4.369 -2.431 -10.396 1.00 0.00 N ATOM 1048 CA LEU A 67 4.483 -1.000 -9.982 1.00 0.00 C ATOM 1049 C LEU A 67 3.174 -0.257 -10.258 1.00 0.00 C ATOM 1050 O LEU A 67 2.481 0.142 -9.354 1.00 0.00 O ATOM 1051 CB LEU A 67 5.608 -0.317 -10.767 1.00 0.00 C ATOM 1052 CG LEU A 67 6.273 0.787 -9.924 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.773 1.887 -10.855 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.273 1.401 -8.934 1.00 0.00 C ATOM 0 H LEU A 67 4.950 -2.706 -11.188 1.00 0.00 H new ATOM 0 HA LEU A 67 4.701 -0.971 -8.914 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.354 -1.056 -11.059 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.208 0.112 -11.685 1.00 0.00 H new ATOM 0 HG LEU A 67 7.098 0.346 -9.364 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.246 2.674 -10.267 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.498 1.470 -11.554 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.933 2.304 -11.410 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.768 2.178 -8.351 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.438 1.836 -9.483 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.902 0.626 -8.264 1.00 0.00 H new ATOM 1066 N PHE A 68 2.865 -0.049 -11.506 1.00 0.00 N ATOM 1067 CA PHE A 68 1.627 0.690 -11.900 1.00 0.00 C ATOM 1068 C PHE A 68 1.929 2.192 -11.854 1.00 0.00 C ATOM 1069 O PHE A 68 1.696 2.912 -12.806 1.00 0.00 O ATOM 1070 CB PHE A 68 0.447 0.308 -10.973 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.202 1.539 -10.373 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.145 2.265 -11.114 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.143 1.956 -9.083 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.742 3.405 -10.561 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.453 3.097 -8.531 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.395 3.821 -9.271 1.00 0.00 C ATOM 0 H PHE A 68 3.432 -0.368 -12.292 1.00 0.00 H new ATOM 0 HA PHE A 68 1.328 0.419 -12.913 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.294 -0.258 -11.538 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.804 -0.343 -10.175 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.411 1.945 -12.111 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.870 1.397 -8.512 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.470 3.963 -11.131 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.186 3.418 -7.535 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.854 4.701 -8.846 1.00 0.00 H new ATOM 1086 N GLU A 69 2.459 2.665 -10.761 1.00 0.00 N ATOM 1087 CA GLU A 69 2.792 4.109 -10.651 1.00 0.00 C ATOM 1088 C GLU A 69 3.162 4.410 -9.205 1.00 0.00 C ATOM 1089 O GLU A 69 3.119 3.545 -8.358 1.00 0.00 O ATOM 1090 CB GLU A 69 1.588 4.956 -11.073 1.00 0.00 C ATOM 1091 CG GLU A 69 1.908 5.679 -12.383 1.00 0.00 C ATOM 1092 CD GLU A 69 0.970 6.873 -12.557 1.00 0.00 C ATOM 1093 OE1 GLU A 69 -0.131 6.669 -13.042 1.00 0.00 O ATOM 1094 OE2 GLU A 69 1.368 7.972 -12.206 1.00 0.00 O ATOM 0 H GLU A 69 2.677 2.108 -9.935 1.00 0.00 H new ATOM 0 HA GLU A 69 3.629 4.350 -11.306 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.710 4.322 -11.200 1.00 0.00 H new ATOM 0 HB3 GLU A 69 1.348 5.680 -10.294 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.944 6.016 -12.379 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.799 4.994 -13.223 1.00 0.00 H new ATOM 1101 N LYS A 70 3.540 5.618 -8.913 1.00 0.00 N ATOM 1102 CA LYS A 70 3.917 5.948 -7.513 1.00 0.00 C ATOM 1103 C LYS A 70 3.867 7.461 -7.310 1.00 0.00 C ATOM 1104 O LYS A 70 3.676 8.215 -8.243 1.00 0.00 O ATOM 1105 CB LYS A 70 5.329 5.430 -7.241 1.00 0.00 C ATOM 1106 CG LYS A 70 6.291 5.978 -8.293 1.00 0.00 C ATOM 1107 CD LYS A 70 7.726 5.616 -7.904 1.00 0.00 C ATOM 1108 CE LYS A 70 8.062 6.252 -6.553 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.229 7.164 -6.710 1.00 0.00 N ATOM 0 H LYS A 70 3.605 6.389 -9.578 1.00 0.00 H new ATOM 0 HA LYS A 70 3.218 5.477 -6.822 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.652 5.734 -6.245 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.337 4.340 -7.260 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.052 5.563 -9.272 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.185 7.060 -8.371 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.837 4.533 -7.846 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.421 5.967 -8.667 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.202 6.806 -6.176 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.288 5.477 -5.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.332 7.746 -5.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.092 6.602 -6.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.078 7.782 -7.533 1.00 0.00 H new ATOM 1123 N LEU A 71 4.038 7.916 -6.098 1.00 0.00 N ATOM 1124 CA LEU A 71 3.999 9.382 -5.851 1.00 0.00 C ATOM 1125 C LEU A 71 5.052 9.781 -4.822 1.00 0.00 C ATOM 1126 O LEU A 71 5.753 8.957 -4.268 1.00 0.00 O ATOM 1127 CB LEU A 71 2.615 9.791 -5.323 1.00 0.00 C ATOM 1128 CG LEU A 71 2.116 8.792 -4.264 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.194 8.556 -3.198 1.00 0.00 C ATOM 1130 CD2 LEU A 71 0.861 9.360 -3.586 1.00 0.00 C ATOM 0 H LEU A 71 4.202 7.338 -5.274 1.00 0.00 H new ATOM 0 HA LEU A 71 4.203 9.889 -6.794 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.667 10.790 -4.891 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.905 9.837 -6.149 1.00 0.00 H new ATOM 0 HG LEU A 71 1.887 7.846 -4.754 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.824 7.847 -2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.090 8.153 -3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.434 9.500 -2.709 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.503 8.656 -2.835 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.104 10.309 -3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.084 9.519 -4.334 1.00 0.00 H new ATOM 1142 N GLU A 72 5.134 11.047 -4.548 1.00 0.00 N ATOM 1143 CA GLU A 72 6.097 11.548 -3.536 1.00 0.00 C ATOM 1144 C GLU A 72 5.510 12.820 -2.935 1.00 0.00 C ATOM 1145 O GLU A 72 5.670 13.902 -3.464 1.00 0.00 O ATOM 1146 CB GLU A 72 7.446 11.853 -4.190 1.00 0.00 C ATOM 1147 CG GLU A 72 8.568 11.515 -3.204 1.00 0.00 C ATOM 1148 CD GLU A 72 9.917 11.908 -3.806 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.097 13.080 -4.092 1.00 0.00 O ATOM 1150 OE2 GLU A 72 10.748 11.030 -3.969 1.00 0.00 O ATOM 0 H GLU A 72 4.565 11.769 -4.990 1.00 0.00 H new ATOM 0 HA GLU A 72 6.261 10.796 -2.764 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.561 11.271 -5.104 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.498 12.904 -4.473 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.411 12.043 -2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.557 10.449 -2.977 1.00 0.00 H new ATOM 1157 N TYR A 73 4.816 12.695 -1.839 1.00 0.00 N ATOM 1158 CA TYR A 73 4.199 13.890 -1.208 1.00 0.00 C ATOM 1159 C TYR A 73 5.273 14.629 -0.428 1.00 0.00 C ATOM 1160 O TYR A 73 6.004 14.044 0.348 1.00 0.00 O ATOM 1161 CB TYR A 73 3.076 13.451 -0.267 1.00 0.00 C ATOM 1162 CG TYR A 73 1.890 14.369 -0.436 1.00 0.00 C ATOM 1163 CD1 TYR A 73 1.127 14.316 -1.607 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.552 15.271 0.580 1.00 0.00 C ATOM 1165 CE1 TYR A 73 0.027 15.167 -1.765 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.452 16.122 0.422 1.00 0.00 C ATOM 1167 CZ TYR A 73 -0.311 16.070 -0.750 1.00 0.00 C ATOM 1168 OH TYR A 73 -1.396 16.910 -0.905 1.00 0.00 O ATOM 0 H TYR A 73 4.650 11.814 -1.353 1.00 0.00 H new ATOM 0 HA TYR A 73 3.779 14.545 -1.971 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.787 12.423 -0.483 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.423 13.474 0.766 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.387 13.618 -2.389 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.140 15.310 1.485 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.561 15.127 -2.670 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.192 16.819 1.205 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.491 17.472 -0.108 1.00 0.00 H new ATOM 1178 N GLU A 74 5.396 15.903 -0.635 1.00 0.00 N ATOM 1179 CA GLU A 74 6.448 16.651 0.090 1.00 0.00 C ATOM 1180 C GLU A 74 5.837 17.411 1.268 1.00 0.00 C ATOM 1181 O GLU A 74 5.182 18.419 1.100 1.00 0.00 O ATOM 1182 CB GLU A 74 7.122 17.640 -0.863 1.00 0.00 C ATOM 1183 CG GLU A 74 8.626 17.669 -0.590 1.00 0.00 C ATOM 1184 CD GLU A 74 9.270 18.792 -1.405 1.00 0.00 C ATOM 1185 OE1 GLU A 74 8.574 19.382 -2.216 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.446 19.043 -1.207 1.00 0.00 O ATOM 0 H GLU A 74 4.819 16.455 -1.269 1.00 0.00 H new ATOM 0 HA GLU A 74 7.188 15.946 0.468 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.935 17.350 -1.897 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.698 18.635 -0.730 1.00 0.00 H new ATOM 0 HG2 GLU A 74 8.811 17.824 0.473 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.073 16.711 -0.854 1.00 0.00 H new ATOM 1193 N PHE A 75 6.061 16.940 2.463 1.00 0.00 N ATOM 1194 CA PHE A 75 5.512 17.638 3.658 1.00 0.00 C ATOM 1195 C PHE A 75 6.437 18.811 4.005 1.00 0.00 C ATOM 1196 O PHE A 75 7.510 18.928 3.448 1.00 0.00 O ATOM 1197 CB PHE A 75 5.466 16.655 4.834 1.00 0.00 C ATOM 1198 CG PHE A 75 4.049 16.166 5.054 1.00 0.00 C ATOM 1199 CD1 PHE A 75 2.965 17.042 4.912 1.00 0.00 C ATOM 1200 CD2 PHE A 75 3.824 14.828 5.403 1.00 0.00 C ATOM 1201 CE1 PHE A 75 1.660 16.580 5.120 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.518 14.368 5.611 1.00 0.00 C ATOM 1203 CZ PHE A 75 1.436 15.244 5.468 1.00 0.00 C ATOM 0 H PHE A 75 6.602 16.099 2.664 1.00 0.00 H new ATOM 0 HA PHE A 75 4.506 18.006 3.455 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.124 15.809 4.636 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.835 17.140 5.737 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.136 18.074 4.642 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.658 14.151 5.512 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.825 17.256 5.012 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.346 13.337 5.882 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.429 14.889 5.626 1.00 0.00 H new ATOM 1213 N PRO A 76 6.005 19.639 4.920 1.00 0.00 N ATOM 1214 CA PRO A 76 6.798 20.800 5.358 1.00 0.00 C ATOM 1215 C PRO A 76 8.238 20.373 5.640 1.00 0.00 C ATOM 1216 O PRO A 76 9.170 21.136 5.483 1.00 0.00 O ATOM 1217 CB PRO A 76 6.098 21.278 6.637 1.00 0.00 C ATOM 1218 CG PRO A 76 4.757 20.506 6.748 1.00 0.00 C ATOM 1219 CD PRO A 76 4.709 19.487 5.600 1.00 0.00 C ATOM 0 HA PRO A 76 6.853 21.588 4.607 1.00 0.00 H new ATOM 0 HB2 PRO A 76 6.723 21.089 7.510 1.00 0.00 H new ATOM 0 HB3 PRO A 76 5.920 22.353 6.599 1.00 0.00 H new ATOM 0 HG2 PRO A 76 4.685 20.001 7.711 1.00 0.00 H new ATOM 0 HG3 PRO A 76 3.913 21.193 6.685 1.00 0.00 H new ATOM 0 HD2 PRO A 76 4.574 18.472 5.975 1.00 0.00 H new ATOM 0 HD3 PRO A 76 3.879 19.690 4.923 1.00 0.00 H new ATOM 1227 N ASP A 77 8.420 19.150 6.042 1.00 0.00 N ATOM 1228 CA ASP A 77 9.789 18.643 6.327 1.00 0.00 C ATOM 1229 C ASP A 77 9.734 17.120 6.344 1.00 0.00 C ATOM 1230 O ASP A 77 10.496 16.464 7.024 1.00 0.00 O ATOM 1231 CB ASP A 77 10.259 19.159 7.690 1.00 0.00 C ATOM 1232 CG ASP A 77 11.347 20.215 7.488 1.00 0.00 C ATOM 1233 OD1 ASP A 77 12.347 19.897 6.867 1.00 0.00 O ATOM 1234 OD2 ASP A 77 11.160 21.325 7.960 1.00 0.00 O ATOM 0 H ASP A 77 7.672 18.472 6.187 1.00 0.00 H new ATOM 0 HA ASP A 77 10.487 18.988 5.564 1.00 0.00 H new ATOM 0 HB2 ASP A 77 9.419 19.587 8.238 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.644 18.334 8.290 1.00 0.00 H new ATOM 1239 N ARG A 78 8.816 16.560 5.606 1.00 0.00 N ATOM 1240 CA ARG A 78 8.677 15.082 5.577 1.00 0.00 C ATOM 1241 C ARG A 78 8.524 14.599 4.130 1.00 0.00 C ATOM 1242 O ARG A 78 7.429 14.502 3.613 1.00 0.00 O ATOM 1243 CB ARG A 78 7.432 14.689 6.375 1.00 0.00 C ATOM 1244 CG ARG A 78 7.821 13.728 7.498 1.00 0.00 C ATOM 1245 CD ARG A 78 8.765 14.434 8.475 1.00 0.00 C ATOM 1246 NE ARG A 78 8.090 14.589 9.797 1.00 0.00 N ATOM 1247 CZ ARG A 78 6.816 14.868 9.855 1.00 0.00 C ATOM 1248 NH1 ARG A 78 6.341 15.884 9.190 1.00 0.00 N ATOM 1249 NH2 ARG A 78 6.018 14.132 10.580 1.00 0.00 N ATOM 0 H ARG A 78 8.154 17.068 5.019 1.00 0.00 H new ATOM 0 HA ARG A 78 9.565 14.623 6.013 1.00 0.00 H new ATOM 0 HB2 ARG A 78 6.960 15.579 6.792 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.701 14.218 5.718 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.929 13.385 8.022 1.00 0.00 H new ATOM 0 HG3 ARG A 78 8.306 12.845 7.083 1.00 0.00 H new ATOM 0 HD2 ARG A 78 9.684 13.859 8.589 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.047 15.411 8.082 1.00 0.00 H new ATOM 0 HE ARG A 78 8.626 14.477 10.658 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.965 16.460 8.625 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.346 16.103 9.235 1.00 0.00 H new ATOM 0 HH21 ARG A 78 6.390 13.338 11.102 1.00 0.00 H new ATOM 0 HH22 ARG A 78 5.023 14.351 10.625 1.00 0.00 H new ATOM 1263 N HIS A 79 9.609 14.283 3.476 1.00 0.00 N ATOM 1264 CA HIS A 79 9.514 13.791 2.070 1.00 0.00 C ATOM 1265 C HIS A 79 9.285 12.279 2.099 1.00 0.00 C ATOM 1266 O HIS A 79 10.153 11.520 2.479 1.00 0.00 O ATOM 1267 CB HIS A 79 10.817 14.103 1.330 1.00 0.00 C ATOM 1268 CG HIS A 79 10.511 14.494 -0.090 1.00 0.00 C ATOM 1269 ND1 HIS A 79 11.445 15.117 -0.904 1.00 0.00 N ATOM 1270 CD2 HIS A 79 9.378 14.358 -0.855 1.00 0.00 C ATOM 1271 CE1 HIS A 79 10.864 15.331 -2.098 1.00 0.00 C ATOM 1272 NE2 HIS A 79 9.604 14.887 -2.124 1.00 0.00 N ATOM 0 H HIS A 79 10.555 14.344 3.853 1.00 0.00 H new ATOM 0 HA HIS A 79 8.688 14.282 1.555 1.00 0.00 H new ATOM 0 HB2 HIS A 79 11.348 14.911 1.834 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.473 13.232 1.345 1.00 0.00 H new ATOM 0 HD2 HIS A 79 8.453 13.909 -0.523 1.00 0.00 H new ATOM 0 HE1 HIS A 79 11.356 15.804 -2.935 1.00 0.00 H new ATOM 0 HE2 HIS A 79 8.949 14.927 -2.905 1.00 0.00 H new ATOM 1280 N ILE A 80 8.113 11.834 1.727 1.00 0.00 N ATOM 1281 CA ILE A 80 7.831 10.369 1.766 1.00 0.00 C ATOM 1282 C ILE A 80 7.661 9.820 0.348 1.00 0.00 C ATOM 1283 O ILE A 80 7.228 10.507 -0.556 1.00 0.00 O ATOM 1284 CB ILE A 80 6.527 10.109 2.540 1.00 0.00 C ATOM 1285 CG1 ILE A 80 6.726 10.325 4.050 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.082 8.663 2.307 1.00 0.00 C ATOM 1287 CD1 ILE A 80 7.633 11.529 4.310 1.00 0.00 C ATOM 0 H ILE A 80 7.343 12.418 1.400 1.00 0.00 H new ATOM 0 HA ILE A 80 8.670 9.875 2.256 1.00 0.00 H new ATOM 0 HB ILE A 80 5.772 10.808 2.181 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.760 10.481 4.530 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.163 9.431 4.496 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.158 8.474 2.854 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.913 8.501 1.242 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.857 7.983 2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.760 11.663 5.384 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.605 11.358 3.848 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.181 12.424 3.883 1.00 0.00 H new ATOM 1299 N THR A 81 7.963 8.564 0.172 1.00 0.00 N ATOM 1300 CA THR A 81 7.788 7.916 -1.157 1.00 0.00 C ATOM 1301 C THR A 81 6.927 6.677 -0.947 1.00 0.00 C ATOM 1302 O THR A 81 7.111 5.946 0.006 1.00 0.00 O ATOM 1303 CB THR A 81 9.136 7.476 -1.726 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.119 8.481 -1.503 1.00 0.00 O ATOM 1305 CG2 THR A 81 8.997 7.224 -3.229 1.00 0.00 C ATOM 0 H THR A 81 8.328 7.952 0.902 1.00 0.00 H new ATOM 0 HA THR A 81 7.329 8.619 -1.852 1.00 0.00 H new ATOM 0 HB THR A 81 9.448 6.560 -1.225 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.276 8.577 -0.540 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.958 6.910 -3.636 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.258 6.441 -3.400 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.676 8.141 -3.723 1.00 0.00 H new ATOM 1313 N LEU A 82 5.983 6.424 -1.801 1.00 0.00 N ATOM 1314 CA LEU A 82 5.132 5.225 -1.589 1.00 0.00 C ATOM 1315 C LEU A 82 5.073 4.373 -2.853 1.00 0.00 C ATOM 1316 O LEU A 82 4.111 4.414 -3.594 1.00 0.00 O ATOM 1317 CB LEU A 82 3.723 5.669 -1.209 1.00 0.00 C ATOM 1318 CG LEU A 82 3.129 4.668 -0.220 1.00 0.00 C ATOM 1319 CD1 LEU A 82 2.814 5.375 1.094 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.845 4.078 -0.804 1.00 0.00 C ATOM 0 H LEU A 82 5.764 6.984 -2.625 1.00 0.00 H new ATOM 0 HA LEU A 82 5.564 4.626 -0.787 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.750 6.664 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.097 5.734 -2.099 1.00 0.00 H new ATOM 0 HG LEU A 82 3.846 3.868 -0.037 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.390 4.660 1.799 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.730 5.795 1.510 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.097 6.176 0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.420 3.363 -0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.128 4.878 -0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.071 3.572 -1.742 1.00 0.00 H new ATOM 1332 N TRP A 83 6.083 3.584 -3.105 1.00 0.00 N ATOM 1333 CA TRP A 83 6.044 2.721 -4.324 1.00 0.00 C ATOM 1334 C TRP A 83 4.719 1.949 -4.342 1.00 0.00 C ATOM 1335 O TRP A 83 4.504 1.051 -3.552 1.00 0.00 O ATOM 1336 CB TRP A 83 7.207 1.729 -4.292 1.00 0.00 C ATOM 1337 CG TRP A 83 8.490 2.464 -4.496 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.270 2.954 -3.507 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.152 2.801 -5.748 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.371 3.571 -4.072 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.343 3.503 -5.451 1.00 0.00 C ATOM 1342 CE3 TRP A 83 8.837 2.568 -7.099 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.194 3.957 -6.459 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 9.691 3.024 -8.116 1.00 0.00 C ATOM 1345 CH2 TRP A 83 10.867 3.718 -7.797 1.00 0.00 C ATOM 0 H TRP A 83 6.922 3.499 -2.531 1.00 0.00 H new ATOM 0 HA TRP A 83 6.127 3.342 -5.216 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.224 1.202 -3.338 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.079 0.976 -5.069 1.00 0.00 H new ATOM 0 HD1 TRP A 83 9.067 2.876 -2.449 1.00 0.00 H new ATOM 0 HE1 TRP A 83 11.113 4.021 -3.536 1.00 0.00 H new ATOM 0 HE3 TRP A 83 7.933 2.035 -7.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.099 4.489 -6.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 9.441 2.839 -9.150 1.00 0.00 H new ATOM 0 HH2 TRP A 83 11.519 4.067 -8.584 1.00 0.00 H new ATOM 1356 N PHE A 84 3.823 2.294 -5.233 1.00 0.00 N ATOM 1357 CA PHE A 84 2.510 1.580 -5.289 1.00 0.00 C ATOM 1358 C PHE A 84 2.656 0.285 -6.077 1.00 0.00 C ATOM 1359 O PHE A 84 2.122 0.153 -7.152 1.00 0.00 O ATOM 1360 CB PHE A 84 1.473 2.457 -5.993 1.00 0.00 C ATOM 1361 CG PHE A 84 0.778 3.325 -4.972 1.00 0.00 C ATOM 1362 CD1 PHE A 84 -0.325 2.824 -4.275 1.00 0.00 C ATOM 1363 CD2 PHE A 84 1.238 4.623 -4.719 1.00 0.00 C ATOM 1364 CE1 PHE A 84 -0.974 3.618 -3.325 1.00 0.00 C ATOM 1365 CE2 PHE A 84 0.588 5.420 -3.767 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.517 4.915 -3.070 1.00 0.00 C ATOM 0 H PHE A 84 3.943 3.037 -5.922 1.00 0.00 H new ATOM 0 HA PHE A 84 2.189 1.363 -4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.957 3.078 -6.747 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.746 1.834 -6.513 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.677 1.822 -4.471 1.00 0.00 H new ATOM 0 HD2 PHE A 84 2.092 5.009 -5.256 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -1.827 3.230 -2.789 1.00 0.00 H new ATOM 0 HE2 PHE A 84 0.939 6.422 -3.571 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.017 5.528 -2.335 1.00 0.00 H new ATOM 1376 N TRP A 85 3.351 -0.677 -5.552 1.00 0.00 N ATOM 1377 CA TRP A 85 3.507 -1.959 -6.289 1.00 0.00 C ATOM 1378 C TRP A 85 2.179 -2.730 -6.273 1.00 0.00 C ATOM 1379 O TRP A 85 1.970 -3.612 -5.466 1.00 0.00 O ATOM 1380 CB TRP A 85 4.599 -2.797 -5.619 1.00 0.00 C ATOM 1381 CG TRP A 85 5.925 -2.150 -5.853 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.637 -1.475 -4.921 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.707 -2.101 -7.080 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.805 -1.013 -5.501 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.892 -1.372 -6.830 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.503 -2.614 -8.374 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.842 -1.158 -7.828 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.458 -2.401 -9.382 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.625 -1.673 -9.109 1.00 0.00 C ATOM 0 H TRP A 85 3.818 -0.634 -4.646 1.00 0.00 H new ATOM 0 HA TRP A 85 3.788 -1.754 -7.322 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.405 -2.881 -4.550 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.598 -3.809 -6.024 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.342 -1.322 -3.893 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.515 -0.473 -5.006 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.607 -3.175 -8.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.740 -0.598 -7.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 7.293 -2.800 -10.372 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.355 -1.510 -9.888 1.00 0.00 H new ATOM 1400 N LEU A 86 1.271 -2.414 -7.160 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.023 -3.147 -7.170 1.00 0.00 C ATOM 1402 C LEU A 86 0.213 -4.598 -7.578 1.00 0.00 C ATOM 1403 O LEU A 86 0.751 -4.883 -8.629 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.986 -2.505 -8.166 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.806 -1.424 -7.467 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.446 -1.994 -6.195 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.886 -0.250 -7.116 1.00 0.00 C ATOM 0 H LEU A 86 1.370 -1.688 -7.869 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.455 -3.106 -6.170 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.429 -2.072 -8.997 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.648 -3.262 -8.586 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.600 -1.078 -8.129 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.030 -1.217 -5.702 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.099 -2.826 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.665 -2.345 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.463 0.528 -6.616 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.092 -0.595 -6.454 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.447 0.154 -8.028 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.206 -5.514 -6.757 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.028 -6.955 -7.091 1.00 0.00 C ATOM 1421 C VAL A 87 -1.416 -7.529 -7.415 1.00 0.00 C ATOM 1422 O VAL A 87 -2.402 -6.824 -7.345 1.00 0.00 O ATOM 1423 CB VAL A 87 0.640 -7.693 -5.906 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.380 -6.691 -5.008 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.405 -8.439 -5.067 1.00 0.00 C ATOM 0 H VAL A 87 -0.666 -5.329 -5.865 1.00 0.00 H new ATOM 0 HA VAL A 87 0.626 -7.084 -7.953 1.00 0.00 H new ATOM 0 HB VAL A 87 1.347 -8.414 -6.316 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.846 -7.222 -4.178 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.148 -6.180 -5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.672 -5.959 -4.619 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.089 -8.950 -4.240 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.130 -7.727 -4.672 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.918 -9.171 -5.691 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.525 -8.777 -7.794 1.00 0.00 N ATOM 1436 CA GLU A 88 -2.890 -9.284 -8.130 1.00 0.00 C ATOM 1437 C GLU A 88 -3.039 -10.807 -7.958 1.00 0.00 C ATOM 1438 O GLU A 88 -3.962 -11.387 -8.496 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.201 -8.918 -9.583 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.088 -7.402 -9.768 1.00 0.00 C ATOM 1441 CD GLU A 88 -3.604 -7.019 -11.156 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -3.462 -7.826 -12.061 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -4.134 -5.928 -11.291 1.00 0.00 O ATOM 0 H GLU A 88 -0.760 -9.445 -7.883 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.587 -8.818 -7.434 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.509 -9.429 -10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.205 -9.253 -9.846 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.664 -6.887 -8.999 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.051 -7.087 -9.654 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.190 -11.482 -7.225 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.406 -12.958 -7.087 1.00 0.00 C ATOM 1452 C ARG A 89 -1.664 -13.541 -5.876 1.00 0.00 C ATOM 1453 O ARG A 89 -0.826 -14.403 -6.009 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.977 -13.671 -8.378 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.457 -13.836 -8.429 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.099 -15.323 -8.336 1.00 0.00 C ATOM 1457 NE ARG A 89 -0.414 -15.992 -9.628 1.00 0.00 N ATOM 1458 CZ ARG A 89 0.083 -17.170 -9.894 1.00 0.00 C ATOM 1459 NH1 ARG A 89 0.703 -17.844 -8.963 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -0.039 -17.673 -11.091 1.00 0.00 N ATOM 0 H ARG A 89 -1.385 -11.096 -6.732 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.470 -13.124 -6.918 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.455 -14.649 -8.435 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.314 -13.100 -9.243 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.066 -13.415 -9.355 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.006 -13.288 -7.609 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.959 -15.439 -8.103 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.657 -15.792 -7.526 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.019 -15.530 -10.307 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.799 -17.450 -8.027 1.00 0.00 H new ATOM 0 HH12 ARG A 89 1.091 -18.764 -9.172 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -0.522 -17.146 -11.819 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.349 -18.593 -11.300 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.988 -13.115 -4.686 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.311 -13.701 -3.493 1.00 0.00 C ATOM 1476 C TRP A 90 -1.984 -15.036 -3.149 1.00 0.00 C ATOM 1477 O TRP A 90 -3.110 -15.283 -3.533 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.418 -12.747 -2.302 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.819 -12.754 -1.766 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.348 -13.746 -1.014 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.874 -11.753 -1.919 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.654 -13.423 -0.697 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.025 -12.208 -1.231 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.949 -10.512 -2.580 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.203 -11.462 -1.196 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.139 -9.758 -2.546 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.261 -10.234 -1.855 1.00 0.00 C ATOM 0 H TRP A 90 -2.683 -12.395 -4.488 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.256 -13.861 -3.716 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.719 -13.047 -1.521 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.141 -11.738 -2.607 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.833 -14.645 -0.710 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.269 -14.013 -0.136 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.090 -10.136 -3.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.065 -11.833 -0.662 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.186 -8.807 -3.056 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.170 -9.651 -1.833 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.311 -15.902 -2.440 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.939 -17.219 -2.096 1.00 0.00 C ATOM 1500 C GLU A 91 -2.664 -17.125 -0.747 1.00 0.00 C ATOM 1501 O GLU A 91 -2.223 -16.449 0.159 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.854 -18.317 -2.054 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.637 -18.848 -0.626 1.00 0.00 C ATOM 1504 CD GLU A 91 0.309 -20.049 -0.666 1.00 0.00 C ATOM 1505 OE1 GLU A 91 0.383 -20.686 -1.704 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.946 -20.311 0.342 1.00 0.00 O ATOM 0 H GLU A 91 -0.365 -15.761 -2.086 1.00 0.00 H new ATOM 0 HA GLU A 91 -2.672 -17.477 -2.860 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.143 -19.140 -2.708 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.084 -17.917 -2.440 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.219 -18.064 0.005 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.591 -19.138 -0.186 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.760 -17.825 -0.613 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.522 -17.818 0.672 1.00 0.00 C ATOM 1515 C GLY A 92 -4.670 -16.391 1.193 1.00 0.00 C ATOM 1516 O GLY A 92 -5.648 -15.722 0.926 1.00 0.00 O ATOM 0 H GLY A 92 -4.164 -18.407 -1.346 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.506 -18.261 0.521 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.007 -18.431 1.412 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.714 -15.923 1.944 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.801 -14.543 2.489 1.00 0.00 C ATOM 1522 C GLU A 93 -2.740 -13.659 1.825 1.00 0.00 C ATOM 1523 O GLU A 93 -1.792 -14.155 1.257 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.560 -14.582 3.999 1.00 0.00 C ATOM 1525 CG GLU A 93 -2.103 -14.956 4.274 1.00 0.00 C ATOM 1526 CD GLU A 93 -1.980 -15.525 5.688 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -2.145 -14.763 6.628 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -1.724 -16.711 5.808 1.00 0.00 O ATOM 0 H GLU A 93 -2.874 -16.439 2.204 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.790 -14.132 2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.786 -13.611 4.439 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.227 -15.307 4.466 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.761 -15.690 3.544 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.465 -14.079 4.167 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.938 -12.370 1.918 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.011 -11.382 1.340 1.00 0.00 C ATOM 1537 C PRO A 94 -0.750 -11.296 2.202 1.00 0.00 C ATOM 1538 O PRO A 94 -0.471 -12.174 2.994 1.00 0.00 O ATOM 1539 CB PRO A 94 -2.777 -10.056 1.404 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.052 -10.297 2.253 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.111 -11.794 2.590 1.00 0.00 C ATOM 0 HA PRO A 94 -1.701 -11.637 0.326 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.159 -9.277 1.852 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.041 -9.717 0.402 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.023 -9.700 3.165 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -4.942 -9.994 1.702 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.073 -11.960 3.667 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.036 -12.245 2.230 1.00 0.00 H new ATOM 1549 N TRP A 95 0.003 -10.235 2.077 1.00 0.00 N ATOM 1550 CA TRP A 95 1.227 -10.095 2.913 1.00 0.00 C ATOM 1551 C TRP A 95 1.964 -8.794 2.584 1.00 0.00 C ATOM 1552 O TRP A 95 3.173 -8.725 2.659 1.00 0.00 O ATOM 1553 CB TRP A 95 2.155 -11.293 2.693 1.00 0.00 C ATOM 1554 CG TRP A 95 2.681 -11.313 1.295 1.00 0.00 C ATOM 1555 CD1 TRP A 95 2.090 -10.753 0.215 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.902 -11.939 0.813 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.881 -10.989 -0.896 1.00 0.00 N ATOM 1558 CE2 TRP A 95 4.009 -11.719 -0.576 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.915 -12.671 1.451 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 5.091 -12.209 -1.311 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 6.002 -13.167 0.719 1.00 0.00 C ATOM 1562 CH2 TRP A 95 6.091 -12.936 -0.660 1.00 0.00 C ATOM 0 H TRP A 95 -0.177 -9.463 1.435 1.00 0.00 H new ATOM 0 HA TRP A 95 0.925 -10.065 3.960 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.986 -11.248 3.397 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.615 -12.218 2.895 1.00 0.00 H new ATOM 0 HD1 TRP A 95 1.156 -10.211 0.219 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.658 -10.663 -1.837 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.856 -12.853 2.514 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 5.154 -12.027 -2.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.775 -13.730 1.220 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.932 -13.319 -1.219 1.00 0.00 H new ATOM 1573 N GLY A 96 1.251 -7.757 2.235 1.00 0.00 N ATOM 1574 CA GLY A 96 1.929 -6.467 1.914 1.00 0.00 C ATOM 1575 C GLY A 96 1.491 -5.381 2.894 1.00 0.00 C ATOM 1576 O GLY A 96 1.835 -4.224 2.745 1.00 0.00 O ATOM 0 H GLY A 96 0.234 -7.746 2.158 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.010 -6.595 1.962 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.688 -6.165 0.895 1.00 0.00 H new ATOM 1580 N LYS A 97 0.735 -5.734 3.891 1.00 0.00 N ATOM 1581 CA LYS A 97 0.279 -4.709 4.870 1.00 0.00 C ATOM 1582 C LYS A 97 1.390 -4.413 5.873 1.00 0.00 C ATOM 1583 O LYS A 97 2.175 -5.271 6.225 1.00 0.00 O ATOM 1584 CB LYS A 97 -0.956 -5.219 5.607 1.00 0.00 C ATOM 1585 CG LYS A 97 -0.646 -6.578 6.228 1.00 0.00 C ATOM 1586 CD LYS A 97 -1.479 -6.749 7.494 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.847 -7.824 8.380 1.00 0.00 C ATOM 1588 NZ LYS A 97 -1.892 -8.424 9.256 1.00 0.00 N ATOM 0 H LYS A 97 0.413 -6.685 4.072 1.00 0.00 H new ATOM 0 HA LYS A 97 0.030 -3.792 4.336 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.250 -4.511 6.382 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -1.796 -5.304 4.918 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.870 -7.375 5.519 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.416 -6.651 6.464 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.536 -5.804 8.035 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.500 -7.030 7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.388 -8.596 7.762 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.054 -7.389 8.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.462 -9.155 9.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.310 -7.684 9.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -2.634 -8.853 8.667 1.00 0.00 H new ATOM 1602 N GLU A 98 1.454 -3.195 6.341 1.00 0.00 N ATOM 1603 CA GLU A 98 2.503 -2.819 7.330 1.00 0.00 C ATOM 1604 C GLU A 98 2.059 -3.237 8.737 1.00 0.00 C ATOM 1605 O GLU A 98 2.292 -2.531 9.700 1.00 0.00 O ATOM 1606 CB GLU A 98 2.691 -1.300 7.300 1.00 0.00 C ATOM 1607 CG GLU A 98 4.155 -0.909 7.604 1.00 0.00 C ATOM 1608 CD GLU A 98 4.896 -2.038 8.342 1.00 0.00 C ATOM 1609 OE1 GLU A 98 5.463 -2.892 7.672 1.00 0.00 O ATOM 1610 OE2 GLU A 98 4.885 -2.027 9.561 1.00 0.00 O ATOM 0 H GLU A 98 0.820 -2.440 6.078 1.00 0.00 H new ATOM 0 HA GLU A 98 3.438 -3.321 7.079 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.406 -0.915 6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.029 -0.835 8.031 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.673 -0.680 6.673 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.173 -0.003 8.210 1.00 0.00 H new ATOM 1617 N GLY A 99 1.406 -4.359 8.873 1.00 0.00 N ATOM 1618 CA GLY A 99 0.937 -4.786 10.216 1.00 0.00 C ATOM 1619 C GLY A 99 -0.468 -4.223 10.453 1.00 0.00 C ATOM 1620 O GLY A 99 -1.150 -4.591 11.389 1.00 0.00 O ATOM 0 H GLY A 99 1.178 -4.997 8.110 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.923 -5.874 10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.621 -4.428 10.986 1.00 0.00 H new ATOM 1624 N GLN A 100 -0.906 -3.336 9.596 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.266 -2.742 9.742 1.00 0.00 C ATOM 1626 C GLN A 100 -3.312 -3.856 9.563 1.00 0.00 C ATOM 1627 O GLN A 100 -2.955 -5.015 9.496 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.423 -1.645 8.678 1.00 0.00 C ATOM 1629 CG GLN A 100 -2.942 -2.236 7.363 1.00 0.00 C ATOM 1630 CD GLN A 100 -3.132 -1.111 6.346 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -3.278 0.038 6.716 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.137 -1.391 5.074 1.00 0.00 N ATOM 0 H GLN A 100 -0.374 -2.996 8.795 1.00 0.00 H new ATOM 0 HA GLN A 100 -2.407 -2.298 10.728 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.112 -0.880 9.036 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.464 -1.155 8.509 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.238 -2.974 6.979 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.886 -2.754 7.531 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -3.015 -2.355 4.763 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -3.263 -0.646 4.388 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.573 -3.493 9.501 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.643 -4.488 9.343 1.00 0.00 C ATOM 1643 C PRO A 101 -5.512 -5.159 7.979 1.00 0.00 C ATOM 1644 O PRO A 101 -5.410 -6.363 7.880 1.00 0.00 O ATOM 1645 CB PRO A 101 -6.949 -3.689 9.430 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.571 -2.207 9.668 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.039 -2.098 9.575 1.00 0.00 C ATOM 0 HA PRO A 101 -5.604 -5.273 10.098 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.526 -3.795 8.511 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.573 -4.061 10.243 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.046 -1.566 8.925 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -6.920 -1.875 10.646 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -4.734 -1.531 8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.624 -1.587 10.444 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.507 -4.381 6.929 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.377 -4.969 5.570 1.00 0.00 C ATOM 1657 C GLY A 102 -6.505 -5.973 5.353 1.00 0.00 C ATOM 1658 O GLY A 102 -6.591 -6.980 6.022 1.00 0.00 O ATOM 0 H GLY A 102 -5.587 -3.365 6.957 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.421 -4.184 4.815 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.410 -5.460 5.463 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.380 -5.710 4.431 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.498 -6.674 4.197 1.00 0.00 C ATOM 1664 C GLU A 103 -8.989 -6.576 2.754 1.00 0.00 C ATOM 1665 O GLU A 103 -9.215 -5.497 2.243 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.656 -6.365 5.154 1.00 0.00 C ATOM 1667 CG GLU A 103 -9.884 -4.851 5.226 1.00 0.00 C ATOM 1668 CD GLU A 103 -10.433 -4.487 6.605 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -11.460 -5.033 6.976 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -9.817 -3.669 7.269 1.00 0.00 O ATOM 0 H GLU A 103 -7.377 -4.883 3.833 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.133 -7.685 4.379 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.564 -6.862 4.813 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.433 -6.755 6.147 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.949 -4.322 5.043 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.583 -4.540 4.450 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.171 -7.698 2.093 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.666 -7.653 0.686 1.00 0.00 C ATOM 1679 C TRP A 104 -10.808 -6.647 0.627 1.00 0.00 C ATOM 1680 O TRP A 104 -11.658 -6.609 1.496 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.182 -9.029 0.243 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.285 -10.109 0.763 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.956 -9.980 0.978 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.628 -11.479 1.127 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.462 -11.182 1.454 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.454 -12.137 1.564 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.832 -12.207 1.124 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.474 -13.470 1.981 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.856 -13.548 1.543 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.679 -14.178 1.971 1.00 0.00 C ATOM 0 H TRP A 104 -8.999 -8.631 2.466 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.851 -7.366 0.021 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.197 -9.181 0.611 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.227 -9.076 -0.845 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.375 -9.086 0.806 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.484 -11.343 1.694 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.745 -11.731 0.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.564 -13.950 2.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.786 -14.096 1.535 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.703 -15.209 2.292 1.00 0.00 H new ATOM 1701 N MET A 105 -10.835 -5.823 -0.374 1.00 0.00 N ATOM 1702 CA MET A 105 -11.927 -4.819 -0.456 1.00 0.00 C ATOM 1703 C MET A 105 -12.548 -4.865 -1.844 1.00 0.00 C ATOM 1704 O MET A 105 -11.912 -4.545 -2.823 1.00 0.00 O ATOM 1705 CB MET A 105 -11.363 -3.422 -0.185 1.00 0.00 C ATOM 1706 CG MET A 105 -12.458 -2.540 0.414 1.00 0.00 C ATOM 1707 SD MET A 105 -13.651 -2.102 -0.874 1.00 0.00 S ATOM 1708 CE MET A 105 -15.144 -2.224 0.140 1.00 0.00 C ATOM 0 H MET A 105 -10.156 -5.798 -1.134 1.00 0.00 H new ATOM 0 HA MET A 105 -12.689 -5.045 0.290 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.517 -3.486 0.499 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.992 -2.982 -1.110 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.960 -3.066 1.226 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.020 -1.638 0.841 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.986 -1.788 -0.398 1.00 0.00 H new ATOM 0 HE2 MET A 105 -15.354 -3.272 0.354 1.00 0.00 H new ATOM 0 HE3 MET A 105 -14.993 -1.685 1.076 1.00 0.00 H new ATOM 1718 N SER A 106 -13.785 -5.270 -1.933 1.00 0.00 N ATOM 1719 CA SER A 106 -14.454 -5.345 -3.259 1.00 0.00 C ATOM 1720 C SER A 106 -14.960 -3.957 -3.655 1.00 0.00 C ATOM 1721 O SER A 106 -16.105 -3.779 -4.017 1.00 0.00 O ATOM 1722 CB SER A 106 -15.631 -6.317 -3.181 1.00 0.00 C ATOM 1723 OG SER A 106 -15.816 -6.728 -1.834 1.00 0.00 O ATOM 0 H SER A 106 -14.362 -5.553 -1.141 1.00 0.00 H new ATOM 0 HA SER A 106 -13.743 -5.697 -4.006 1.00 0.00 H new ATOM 0 HB2 SER A 106 -16.537 -5.839 -3.554 1.00 0.00 H new ATOM 0 HB3 SER A 106 -15.443 -7.184 -3.815 1.00 0.00 H new ATOM 0 HG SER A 106 -16.572 -7.350 -1.783 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.107 -2.973 -3.594 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.522 -1.597 -3.972 1.00 0.00 C ATOM 1731 C LEU A 107 -14.854 -1.585 -5.469 1.00 0.00 C ATOM 1732 O LEU A 107 -15.822 -0.990 -5.891 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.372 -0.629 -3.637 1.00 0.00 C ATOM 1734 CG LEU A 107 -13.223 0.447 -4.710 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -12.683 1.728 -4.068 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -12.244 -0.052 -5.776 1.00 0.00 C ATOM 0 H LEU A 107 -13.136 -3.065 -3.297 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.407 -1.280 -3.420 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.559 -0.159 -2.671 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.440 -1.186 -3.546 1.00 0.00 H new ATOM 0 HG LEU A 107 -14.189 0.657 -5.170 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -12.575 2.499 -4.830 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -13.377 2.071 -3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -11.712 1.527 -3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -12.129 0.708 -6.549 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.276 -0.251 -5.316 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -12.629 -0.968 -6.223 1.00 0.00 H new ATOM 1748 N VAL A 108 -14.052 -2.253 -6.259 1.00 0.00 N ATOM 1749 CA VAL A 108 -14.292 -2.325 -7.737 1.00 0.00 C ATOM 1750 C VAL A 108 -13.806 -1.050 -8.415 1.00 0.00 C ATOM 1751 O VAL A 108 -14.316 0.024 -8.166 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.779 -2.515 -8.033 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -15.969 -2.647 -9.539 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -16.280 -3.783 -7.337 1.00 0.00 C ATOM 0 H VAL A 108 -13.227 -2.760 -5.939 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.737 -3.179 -8.127 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.344 -1.658 -7.665 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -17.027 -2.783 -9.762 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.608 -1.744 -10.032 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.408 -3.508 -9.902 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.341 -3.919 -7.548 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.723 -4.645 -7.706 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -16.133 -3.690 -6.261 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.824 -1.164 -9.277 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.293 0.040 -9.980 1.00 0.00 C ATOM 1766 C GLY A 109 -12.251 1.199 -8.993 1.00 0.00 C ATOM 1767 O GLY A 109 -13.164 1.998 -8.916 1.00 0.00 O ATOM 0 H GLY A 109 -12.368 -2.043 -9.523 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.296 -0.160 -10.372 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.926 0.291 -10.831 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.209 1.272 -8.216 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.097 2.351 -7.202 1.00 0.00 C ATOM 1773 C LEU A 110 -11.635 3.673 -7.755 1.00 0.00 C ATOM 1774 O LEU A 110 -11.775 3.853 -8.949 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.640 2.512 -6.812 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.428 1.942 -5.416 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.818 0.545 -5.518 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -8.484 2.857 -4.648 1.00 0.00 C ATOM 0 H LEU A 110 -10.423 0.623 -8.241 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.690 2.081 -6.328 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.000 1.997 -7.529 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.360 3.565 -6.834 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.384 1.876 -4.896 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.667 0.140 -4.517 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.491 -0.106 -6.076 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.860 0.603 -6.034 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -8.325 2.458 -3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -7.529 2.916 -5.171 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -8.921 3.853 -4.577 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.961 4.589 -6.885 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.523 5.889 -7.342 1.00 0.00 C ATOM 1792 C ASN A 111 -11.890 7.056 -6.581 1.00 0.00 C ATOM 1793 O ASN A 111 -12.186 8.203 -6.848 1.00 0.00 O ATOM 1794 CB ASN A 111 -14.022 5.874 -7.054 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.770 6.645 -8.141 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -14.229 6.920 -9.193 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -16.006 7.010 -7.927 1.00 0.00 N ATOM 0 H ASN A 111 -11.862 4.492 -5.875 1.00 0.00 H new ATOM 0 HA ASN A 111 -12.319 6.018 -8.405 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.382 4.846 -7.012 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.218 6.321 -6.079 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -16.517 7.526 -8.643 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -16.460 6.779 -7.043 1.00 0.00 H new ATOM 1804 N ALA A 112 -11.058 6.782 -5.611 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.450 7.889 -4.815 1.00 0.00 C ATOM 1806 C ALA A 112 -11.510 8.448 -3.857 1.00 0.00 C ATOM 1807 O ALA A 112 -11.237 9.308 -3.044 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.968 9.004 -5.747 1.00 0.00 C ATOM 0 H ALA A 112 -10.774 5.842 -5.336 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.598 7.507 -4.252 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.526 9.806 -5.156 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.221 8.606 -6.434 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.813 9.394 -6.315 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.716 7.956 -3.949 1.00 0.00 N ATOM 1815 CA ASP A 113 -13.803 8.429 -3.058 1.00 0.00 C ATOM 1816 C ASP A 113 -13.665 7.724 -1.716 1.00 0.00 C ATOM 1817 O ASP A 113 -13.976 8.259 -0.670 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.139 8.054 -3.695 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.036 9.291 -3.781 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -15.503 10.387 -3.761 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -17.240 9.122 -3.868 1.00 0.00 O ATOM 0 H ASP A 113 -12.994 7.236 -4.616 1.00 0.00 H new ATOM 0 HA ASP A 113 -13.749 9.508 -2.915 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.975 7.642 -4.691 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.629 7.278 -3.106 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.201 6.511 -1.754 1.00 0.00 N ATOM 1827 CA ASP A 114 -13.028 5.720 -0.512 1.00 0.00 C ATOM 1828 C ASP A 114 -11.597 5.898 0.006 1.00 0.00 C ATOM 1829 O ASP A 114 -11.273 5.517 1.113 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.290 4.253 -0.850 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.800 4.001 -0.855 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.506 4.759 -1.500 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.225 3.055 -0.210 1.00 0.00 O ATOM 0 H ASP A 114 -12.930 6.026 -2.609 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.721 6.053 0.261 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.865 4.010 -1.824 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.803 3.606 -0.120 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.743 6.480 -0.792 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.331 6.693 -0.363 1.00 0.00 C ATOM 1840 C PHE A 115 -9.150 8.128 0.146 1.00 0.00 C ATOM 1841 O PHE A 115 -9.845 9.026 -0.285 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.408 6.498 -1.565 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.936 5.069 -1.643 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -8.861 4.027 -1.771 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -6.567 4.787 -1.599 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -8.413 2.702 -1.858 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.119 3.465 -1.686 1.00 0.00 C ATOM 1848 CZ PHE A 115 -7.043 2.420 -1.814 1.00 0.00 C ATOM 0 H PHE A 115 -10.964 6.819 -1.728 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.091 5.983 0.429 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.934 6.764 -2.482 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.551 7.166 -1.485 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -9.919 4.244 -1.803 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -5.854 5.592 -1.498 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -9.126 1.897 -1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -5.061 3.250 -1.655 1.00 0.00 H new ATOM 0 HZ PHE A 115 -6.699 1.398 -1.879 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.199 8.301 1.032 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.882 9.625 1.595 1.00 0.00 C ATOM 1860 C PRO A 116 -7.261 10.509 0.500 1.00 0.00 C ATOM 1861 O PRO A 116 -6.411 10.057 -0.239 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.849 9.342 2.694 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.487 7.836 2.624 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.377 7.192 1.549 1.00 0.00 C ATOM 0 HA PRO A 116 -8.760 10.143 1.980 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.960 9.956 2.551 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.255 9.593 3.674 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.433 7.707 2.376 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -6.648 7.358 3.590 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.779 6.740 0.758 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -7.998 6.401 1.970 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.704 11.739 0.425 1.00 0.00 N ATOM 1873 CA PRO A 117 -7.196 12.691 -0.583 1.00 0.00 C ATOM 1874 C PRO A 117 -5.687 12.901 -0.423 1.00 0.00 C ATOM 1875 O PRO A 117 -4.994 13.208 -1.373 1.00 0.00 O ATOM 1876 CB PRO A 117 -7.956 13.995 -0.310 1.00 0.00 C ATOM 1877 CG PRO A 117 -8.955 13.724 0.845 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.738 12.279 1.322 1.00 0.00 C ATOM 0 HA PRO A 117 -7.349 12.330 -1.600 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.264 14.792 -0.038 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.485 14.324 -1.204 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -8.793 14.425 1.663 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.981 13.864 0.504 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.414 12.250 2.362 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.659 11.699 1.259 1.00 0.00 H new ATOM 1886 N ALA A 118 -5.170 12.740 0.765 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.704 12.931 0.972 1.00 0.00 C ATOM 1888 C ALA A 118 -2.936 12.272 -0.171 1.00 0.00 C ATOM 1889 O ALA A 118 -2.087 12.876 -0.796 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.283 12.284 2.290 1.00 0.00 C ATOM 0 H ALA A 118 -5.697 12.485 1.600 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.483 13.998 0.999 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -2.212 12.425 2.439 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.828 12.747 3.113 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.508 11.218 2.260 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.231 11.034 -0.447 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.522 10.326 -1.546 1.00 0.00 C ATOM 1898 C ASN A 119 -3.261 10.570 -2.861 1.00 0.00 C ATOM 1899 O ASN A 119 -3.537 9.660 -3.615 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.479 8.830 -1.241 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.020 8.380 -1.152 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.599 7.500 -1.873 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.226 8.955 -0.294 1.00 0.00 N ATOM 0 H ASN A 119 -3.934 10.481 0.042 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.502 10.702 -1.631 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.995 8.622 -0.303 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.998 8.272 -2.020 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.750 8.665 -0.228 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.580 9.695 0.312 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.575 11.802 -3.131 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.291 12.157 -4.387 1.00 0.00 C ATOM 1912 C GLU A 120 -3.455 11.832 -5.640 1.00 0.00 C ATOM 1913 O GLU A 120 -3.997 11.366 -6.621 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.577 13.656 -4.366 1.00 0.00 C ATOM 1915 CG GLU A 120 -6.077 13.894 -4.191 1.00 0.00 C ATOM 1916 CD GLU A 120 -6.758 13.900 -5.561 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -6.073 13.663 -6.542 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -7.952 14.145 -5.605 1.00 0.00 O ATOM 0 H GLU A 120 -3.363 12.594 -2.524 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.209 11.572 -4.436 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.027 14.129 -3.553 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.232 14.114 -5.293 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.508 13.115 -3.562 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.248 14.844 -3.684 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.171 12.120 -5.603 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.286 11.893 -6.765 1.00 0.00 C ATOM 1927 C PRO A 121 -1.383 10.471 -7.325 1.00 0.00 C ATOM 1928 O PRO A 121 -1.345 10.275 -8.524 1.00 0.00 O ATOM 1929 CB PRO A 121 0.125 12.188 -6.242 1.00 0.00 C ATOM 1930 CG PRO A 121 -0.016 12.809 -4.831 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.489 12.687 -4.418 1.00 0.00 C ATOM 0 HA PRO A 121 -1.569 12.533 -7.601 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.716 11.273 -6.200 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.645 12.873 -6.911 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.626 12.291 -4.118 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.295 13.854 -4.839 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.603 12.039 -3.549 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.906 13.658 -4.149 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.494 9.477 -6.500 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.576 8.092 -7.044 1.00 0.00 C ATOM 1941 C VAL A 122 -3.031 7.617 -7.052 1.00 0.00 C ATOM 1942 O VAL A 122 -3.456 6.931 -7.959 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.725 7.166 -6.181 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.245 5.727 -6.275 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.725 7.209 -6.667 1.00 0.00 C ATOM 0 H VAL A 122 -1.532 9.556 -5.484 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.202 8.079 -8.068 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.781 7.499 -5.145 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.629 5.076 -5.654 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.277 5.690 -5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.199 5.390 -7.311 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.335 6.548 -6.051 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.770 6.882 -7.706 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.104 8.228 -6.591 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.795 7.959 -6.055 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.211 7.507 -6.046 1.00 0.00 C ATOM 1957 C ILE A 123 -5.892 8.091 -7.284 1.00 0.00 C ATOM 1958 O ILE A 123 -6.888 7.587 -7.753 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.904 7.970 -4.748 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -6.050 6.768 -3.806 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.298 8.539 -5.048 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -7.134 5.832 -4.343 1.00 0.00 C ATOM 0 H ILE A 123 -3.506 8.524 -5.257 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.275 6.419 -6.074 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.298 8.750 -4.286 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -5.102 6.237 -3.727 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.310 7.107 -2.803 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.768 8.859 -4.118 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.206 9.392 -5.721 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.911 7.770 -5.519 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.240 4.977 -3.675 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -8.082 6.368 -4.400 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.854 5.484 -5.337 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.341 9.146 -7.820 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.928 9.768 -9.038 1.00 0.00 C ATOM 1976 C ALA A 124 -5.865 8.753 -10.175 1.00 0.00 C ATOM 1977 O ALA A 124 -6.727 8.686 -11.029 1.00 0.00 O ATOM 1978 CB ALA A 124 -5.107 11.002 -9.414 1.00 0.00 C ATOM 0 H ALA A 124 -4.504 9.606 -7.463 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.962 10.062 -8.854 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.531 11.463 -10.306 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.127 11.717 -8.591 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -4.077 10.707 -9.613 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.832 7.971 -10.174 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.643 6.938 -11.224 1.00 0.00 C ATOM 1986 C LYS A 125 -5.507 5.709 -10.912 1.00 0.00 C ATOM 1987 O LYS A 125 -6.083 5.114 -11.800 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.169 6.557 -11.250 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.342 7.833 -11.397 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.870 8.659 -12.575 1.00 0.00 C ATOM 1991 CE LYS A 125 -1.711 9.419 -13.226 1.00 0.00 C ATOM 1992 NZ LYS A 125 -1.828 10.870 -12.909 1.00 0.00 N ATOM 0 H LYS A 125 -4.091 8.003 -9.473 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.945 7.325 -12.197 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.897 6.033 -10.334 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.968 5.877 -12.078 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.392 8.418 -10.479 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.294 7.582 -11.558 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.347 8.006 -13.306 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.630 9.360 -12.230 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -0.759 9.032 -12.863 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.725 9.269 -14.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.041 11.386 -13.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.730 11.234 -13.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.794 11.004 -11.878 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.624 5.331 -9.665 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.484 4.155 -9.340 1.00 0.00 C ATOM 2008 C LEU A 126 -7.888 4.472 -9.823 1.00 0.00 C ATOM 2009 O LEU A 126 -8.573 3.645 -10.381 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.526 3.930 -7.828 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.203 3.348 -7.309 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.032 3.702 -8.233 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -4.936 3.930 -5.925 1.00 0.00 C ATOM 0 H LEU A 126 -5.169 5.778 -8.869 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.087 3.259 -9.818 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.732 4.874 -7.324 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.344 3.253 -7.582 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.288 2.262 -7.273 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.112 3.274 -7.835 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.219 3.299 -9.228 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.931 4.786 -8.294 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.000 3.530 -5.536 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.866 5.016 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.752 3.661 -5.254 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.301 5.689 -9.621 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.650 6.126 -10.074 1.00 0.00 C ATOM 2027 C LYS A 127 -9.941 5.493 -11.427 1.00 0.00 C ATOM 2028 O LYS A 127 -11.050 5.104 -11.732 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.620 7.639 -10.251 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.000 8.290 -9.017 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.794 9.545 -8.646 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.957 10.431 -9.882 1.00 0.00 C ATOM 2033 NZ LYS A 127 -11.407 10.615 -10.174 1.00 0.00 N ATOM 0 H LYS A 127 -7.753 6.412 -9.154 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.410 5.833 -9.349 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.044 7.899 -11.139 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.631 8.017 -10.404 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.000 7.587 -8.184 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.960 8.550 -9.214 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.772 9.266 -8.254 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.279 10.094 -7.858 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.483 11.398 -9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.458 9.976 -10.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.526 10.928 -11.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.906 9.713 -10.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.802 11.332 -9.533 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.929 5.395 -12.234 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.086 4.798 -13.581 1.00 0.00 C ATOM 2049 C ARG A 128 -9.081 3.267 -13.461 1.00 0.00 C ATOM 2050 O ARG A 128 -9.970 2.603 -13.954 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.921 5.251 -14.473 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.357 6.590 -13.978 1.00 0.00 C ATOM 2053 CD ARG A 128 -7.010 7.475 -15.178 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.680 8.797 -15.026 1.00 0.00 N ATOM 2055 CZ ARG A 128 -7.309 9.806 -15.766 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -6.040 10.053 -15.945 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -8.207 10.568 -16.326 1.00 0.00 N ATOM 0 H ARG A 128 -7.984 5.709 -12.013 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.028 5.123 -14.022 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.136 4.495 -14.469 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.261 5.351 -15.504 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.087 7.091 -13.343 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.469 6.420 -13.370 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -5.930 7.608 -15.246 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -7.331 6.996 -16.103 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.429 8.914 -14.343 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -5.338 9.457 -15.506 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.751 10.842 -16.523 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -9.199 10.375 -16.186 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -7.918 11.357 -16.904 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.082 2.719 -12.801 1.00 0.00 N ATOM 2072 CA LEU A 129 -7.979 1.228 -12.625 1.00 0.00 C ATOM 2073 C LEU A 129 -8.676 0.499 -13.776 1.00 0.00 C ATOM 2074 O LEU A 129 -9.863 0.244 -13.658 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.622 0.809 -11.293 1.00 0.00 C ATOM 2076 CG LEU A 129 -7.676 -0.098 -10.500 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.318 0.585 -10.288 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -8.300 -0.393 -9.136 1.00 0.00 C ATOM 2079 OXT LEU A 129 -8.010 0.209 -14.757 1.00 0.00 O ATOM 0 H LEU A 129 -7.324 3.249 -12.371 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.923 0.957 -12.622 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.864 1.694 -10.705 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.560 0.287 -11.484 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.522 -1.020 -11.060 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.662 -0.077 -9.723 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -5.866 0.804 -11.255 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.460 1.514 -9.735 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.634 -1.038 -8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.453 0.541 -8.596 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.259 -0.893 -9.275 1.00 0.00 H new