USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 MET CE :methyl 143:sc= -2.91 (180deg=-8.03!) USER MOD Set 1.2: A 96 THR OG1 : rot -111:sc= -1.4! USER MOD Set 2.1: A 54 GLN : amide:sc= -7.12! C(o=-7.1!,f=-4.1!) USER MOD Set 2.2: A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 27 ASN : amide:sc= -1.41 K(o=-2.5,f=-12!) USER MOD Set 3.2: A 29 LYS NZ :NH3+ -142:sc= -1.13! (180deg=0) USER MOD Set 4.1: A 21 GLN : amide:sc= -0.115 X(o=-0.17,f=-0.41) USER MOD Set 4.2: A 25 TYR OH : rot 180:sc= -0.0595 USER MOD Set 5.1: A 19 THR OG1 : rot 84:sc= -4.51! USER MOD Set 5.2: A 32 GLN : amide:sc= -16.3! C(o=-21!,f=-18!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 42:sc= -0.762 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 139:sc= 0.567 (180deg=0.0177) USER MOD Single : A 31 MET CE :methyl 169:sc= 0 (180deg=-0.17) USER MOD Single : A 34 THR OG1 : rot -88:sc= 1.21 USER MOD Single : A 38 CYS SG : rot 67:sc= 0.101! USER MOD Single : A 45 SER OG : rot 86:sc= 0.497 USER MOD Single : A 49 SER OG : rot 180:sc= -0.521! USER MOD Single : A 50 SER OG : rot 180:sc= -0.25 USER MOD Single : A 53 LYS NZ :NH3+ 145:sc= -2.4! (180deg=-2.84!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 165:sc= -4.1! USER MOD Single : A 67 LYS NZ :NH3+ -162:sc= -5.3! (180deg=-7.15!) USER MOD Single : A 71 THR OG1 : rot -140:sc= -3.73! USER MOD Single : A 79 ASN : amide:sc= -8.25! C(o=-8.3!,f=-5.1!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -90:sc= -1.96! USER MOD Single : A 93 LYS NZ :NH3+ 139:sc= -1.44 (180deg=-5.05!) USER MOD Single : A 97 MET CE :methyl -173:sc= -0.843 (180deg=-0.951) USER MOD Single : A 98 LYS NZ :NH3+ -139:sc= 0.0328 (180deg=-1.09!) USER MOD Single : A 99 TYR OH : rot -150:sc= -2.17 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.518 K(o=-0.52,f=0) USER MOD Single : A 111 GLN : amide:sc=-0.00507 X(o=-0.0051,f=-0.23) USER MOD Single : A 122 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.019) USER MOD Single : A 123 SER OG : rot -67:sc= 0.0997 USER MOD Single : A 126 ASN : amide:sc= -1.78 K(o=-1.8,f=-0.052) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -125:sc=0.000781 USER MOD Single : A 141 SER OG : rot 99:sc= 0.773 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.553 3.377 -14.382 1.00 0.00 N ATOM 106 CA VAL A 7 113.849 4.611 -13.605 1.00 0.00 C ATOM 107 C VAL A 7 115.359 4.827 -13.513 1.00 0.00 C ATOM 108 O VAL A 7 115.842 5.931 -13.659 1.00 0.00 O ATOM 109 CB VAL A 7 113.282 4.462 -12.194 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.835 3.973 -12.271 1.00 0.00 C ATOM 111 CG2 VAL A 7 114.121 3.446 -11.419 1.00 0.00 C ATOM 0 HA VAL A 7 113.394 5.465 -14.107 1.00 0.00 H new ATOM 0 HB VAL A 7 113.311 5.426 -11.686 1.00 0.00 H new ATOM 0 HG11 VAL A 7 111.433 3.867 -11.264 1.00 0.00 H new ATOM 0 HG12 VAL A 7 111.236 4.694 -12.827 1.00 0.00 H new ATOM 0 HG13 VAL A 7 111.803 3.008 -12.777 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.720 3.336 -10.411 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.089 2.483 -11.929 1.00 0.00 H new ATOM 0 HG23 VAL A 7 115.153 3.793 -11.363 1.00 0.00 H new ATOM 121 N LYS A 8 116.107 3.791 -13.245 1.00 0.00 N ATOM 122 CA LYS A 8 117.583 3.958 -13.116 1.00 0.00 C ATOM 123 C LYS A 8 117.851 5.124 -12.162 1.00 0.00 C ATOM 124 O LYS A 8 118.976 5.534 -11.957 1.00 0.00 O ATOM 125 CB LYS A 8 118.198 4.227 -14.498 1.00 0.00 C ATOM 126 CG LYS A 8 118.666 5.683 -14.615 1.00 0.00 C ATOM 127 CD LYS A 8 118.949 6.008 -16.083 1.00 0.00 C ATOM 128 CE LYS A 8 117.677 6.542 -16.742 1.00 0.00 C ATOM 129 NZ LYS A 8 117.988 6.999 -18.126 1.00 0.00 N ATOM 0 H LYS A 8 115.762 2.841 -13.110 1.00 0.00 H new ATOM 0 HA LYS A 8 118.038 3.051 -12.718 1.00 0.00 H new ATOM 0 HB2 LYS A 8 119.041 3.556 -14.662 1.00 0.00 H new ATOM 0 HB3 LYS A 8 117.464 4.013 -15.275 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.903 6.355 -14.223 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.564 5.837 -14.017 1.00 0.00 H new ATOM 0 HD2 LYS A 8 119.747 6.747 -16.155 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.294 5.115 -16.604 1.00 0.00 H new ATOM 0 HE2 LYS A 8 116.914 5.764 -16.767 1.00 0.00 H new ATOM 0 HE3 LYS A 8 117.271 7.368 -16.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 117.123 7.362 -18.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 118.702 7.754 -18.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.356 6.200 -18.681 1.00 0.00 H new ATOM 143 N GLY A 9 116.811 5.654 -11.574 1.00 0.00 N ATOM 144 CA GLY A 9 116.978 6.789 -10.628 1.00 0.00 C ATOM 145 C GLY A 9 115.995 7.903 -10.992 1.00 0.00 C ATOM 146 O GLY A 9 116.364 8.895 -11.587 1.00 0.00 O ATOM 0 H GLY A 9 115.849 5.345 -11.711 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.802 6.454 -9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 9 118.001 7.164 -10.669 1.00 0.00 H new ATOM 150 N ALA A 10 114.746 7.742 -10.635 1.00 0.00 N ATOM 151 CA ALA A 10 113.724 8.782 -10.956 1.00 0.00 C ATOM 152 C ALA A 10 112.368 8.100 -11.121 1.00 0.00 C ATOM 153 O ALA A 10 112.020 7.645 -12.193 1.00 0.00 O ATOM 154 CB ALA A 10 114.091 9.493 -12.261 1.00 0.00 C ATOM 0 H ALA A 10 114.389 6.930 -10.132 1.00 0.00 H new ATOM 0 HA ALA A 10 113.685 9.515 -10.151 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.340 10.250 -12.487 1.00 0.00 H new ATOM 0 HB2 ALA A 10 115.065 9.970 -12.154 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.130 8.767 -13.073 1.00 0.00 H new ATOM 160 N LEU A 11 111.603 8.012 -10.069 1.00 0.00 N ATOM 161 CA LEU A 11 110.277 7.344 -10.173 1.00 0.00 C ATOM 162 C LEU A 11 109.163 8.330 -9.819 1.00 0.00 C ATOM 163 O LEU A 11 109.399 9.504 -9.614 1.00 0.00 O ATOM 164 CB LEU A 11 110.240 6.142 -9.223 1.00 0.00 C ATOM 165 CG LEU A 11 110.067 6.605 -7.771 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.424 5.451 -6.834 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.995 7.785 -7.470 1.00 0.00 C ATOM 0 H LEU A 11 111.838 8.373 -9.144 1.00 0.00 H new ATOM 0 HA LEU A 11 110.123 7.001 -11.196 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.420 5.479 -9.499 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.161 5.567 -9.320 1.00 0.00 H new ATOM 0 HG LEU A 11 109.033 6.916 -7.622 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.304 5.772 -5.799 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.765 4.605 -7.031 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.458 5.152 -7.003 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.859 8.100 -6.436 1.00 0.00 H new ATOM 0 HD22 LEU A 11 112.031 7.482 -7.624 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.757 8.614 -8.136 1.00 0.00 H new ATOM 179 N THR A 12 107.948 7.863 -9.754 1.00 0.00 N ATOM 180 CA THR A 12 106.818 8.775 -9.421 1.00 0.00 C ATOM 181 C THR A 12 107.227 9.714 -8.281 1.00 0.00 C ATOM 182 O THR A 12 108.240 9.524 -7.637 1.00 0.00 O ATOM 183 CB THR A 12 105.606 7.947 -8.988 1.00 0.00 C ATOM 184 OG1 THR A 12 105.313 6.981 -9.988 1.00 0.00 O ATOM 185 CG2 THR A 12 104.399 8.866 -8.795 1.00 0.00 C ATOM 0 H THR A 12 107.688 6.890 -9.917 1.00 0.00 H new ATOM 0 HA THR A 12 106.563 9.367 -10.300 1.00 0.00 H new ATOM 0 HB THR A 12 105.828 7.442 -8.048 1.00 0.00 H new ATOM 0 HG1 THR A 12 104.538 6.449 -9.712 1.00 0.00 H new ATOM 0 HG21 THR A 12 103.537 8.274 -8.487 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.624 9.606 -8.027 1.00 0.00 H new ATOM 0 HG23 THR A 12 104.174 9.373 -9.733 1.00 0.00 H new ATOM 193 N SER A 13 106.438 10.723 -8.026 1.00 0.00 N ATOM 194 CA SER A 13 106.763 11.681 -6.927 1.00 0.00 C ATOM 195 C SER A 13 106.875 10.923 -5.601 1.00 0.00 C ATOM 196 O SER A 13 106.942 11.512 -4.541 1.00 0.00 O ATOM 197 CB SER A 13 105.654 12.729 -6.821 1.00 0.00 C ATOM 198 OG SER A 13 106.146 13.862 -6.118 1.00 0.00 O ATOM 0 H SER A 13 105.577 10.927 -8.534 1.00 0.00 H new ATOM 0 HA SER A 13 107.711 12.173 -7.144 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.318 13.021 -7.816 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.791 12.311 -6.303 1.00 0.00 H new ATOM 0 HG SER A 13 107.056 14.065 -6.421 1.00 0.00 H new ATOM 204 N GLY A 14 106.881 9.621 -5.654 1.00 0.00 N ATOM 205 CA GLY A 14 106.970 8.817 -4.403 1.00 0.00 C ATOM 206 C GLY A 14 108.061 9.378 -3.488 1.00 0.00 C ATOM 207 O GLY A 14 107.982 9.276 -2.280 1.00 0.00 O ATOM 0 H GLY A 14 106.828 9.076 -6.514 1.00 0.00 H new ATOM 0 HA2 GLY A 14 106.011 8.829 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.189 7.777 -4.646 1.00 0.00 H new ATOM 211 N ARG A 15 109.086 9.954 -4.046 1.00 0.00 N ATOM 212 CA ARG A 15 110.183 10.499 -3.196 1.00 0.00 C ATOM 213 C ARG A 15 109.654 11.599 -2.267 1.00 0.00 C ATOM 214 O ARG A 15 109.711 11.481 -1.060 1.00 0.00 O ATOM 215 CB ARG A 15 111.284 11.080 -4.090 1.00 0.00 C ATOM 216 CG ARG A 15 110.679 11.529 -5.420 1.00 0.00 C ATOM 217 CD ARG A 15 111.544 12.629 -6.039 1.00 0.00 C ATOM 218 NE ARG A 15 111.592 12.450 -7.517 1.00 0.00 N ATOM 219 CZ ARG A 15 112.288 13.274 -8.252 1.00 0.00 C ATOM 220 NH1 ARG A 15 112.942 14.254 -7.692 1.00 0.00 N ATOM 221 NH2 ARG A 15 112.329 13.118 -9.547 1.00 0.00 N ATOM 0 H ARG A 15 109.214 10.072 -5.051 1.00 0.00 H new ATOM 0 HA ARG A 15 110.585 9.688 -2.588 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.763 11.924 -3.593 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.058 10.332 -4.265 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.609 10.682 -6.102 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.665 11.897 -5.263 1.00 0.00 H new ATOM 0 HD2 ARG A 15 111.135 13.609 -5.794 1.00 0.00 H new ATOM 0 HD3 ARG A 15 112.551 12.591 -5.624 1.00 0.00 H new ATOM 0 HE ARG A 15 111.081 11.683 -7.955 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.909 14.376 -6.680 1.00 0.00 H new ATOM 0 HH12 ARG A 15 113.486 14.898 -8.266 1.00 0.00 H new ATOM 0 HH21 ARG A 15 111.817 12.352 -9.985 1.00 0.00 H new ATOM 0 HH22 ARG A 15 112.873 13.762 -10.121 1.00 0.00 H new ATOM 235 N GLU A 16 109.157 12.673 -2.815 1.00 0.00 N ATOM 236 CA GLU A 16 108.649 13.782 -1.951 1.00 0.00 C ATOM 237 C GLU A 16 107.219 13.493 -1.493 1.00 0.00 C ATOM 238 O GLU A 16 106.908 13.552 -0.320 1.00 0.00 O ATOM 239 CB GLU A 16 108.661 15.095 -2.741 1.00 0.00 C ATOM 240 CG GLU A 16 108.474 14.805 -4.232 1.00 0.00 C ATOM 241 CD GLU A 16 108.348 16.125 -4.996 1.00 0.00 C ATOM 242 OE1 GLU A 16 107.488 16.913 -4.639 1.00 0.00 O ATOM 243 OE2 GLU A 16 109.114 16.324 -5.924 1.00 0.00 O ATOM 0 H GLU A 16 109.080 12.833 -3.819 1.00 0.00 H new ATOM 0 HA GLU A 16 109.296 13.864 -1.077 1.00 0.00 H new ATOM 0 HB2 GLU A 16 107.866 15.751 -2.386 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.603 15.619 -2.578 1.00 0.00 H new ATOM 0 HG2 GLU A 16 109.320 14.232 -4.611 1.00 0.00 H new ATOM 0 HG3 GLU A 16 107.583 14.197 -4.386 1.00 0.00 H new ATOM 250 N GLU A 17 106.344 13.212 -2.412 1.00 0.00 N ATOM 251 CA GLU A 17 104.925 12.953 -2.043 1.00 0.00 C ATOM 252 C GLU A 17 104.826 11.897 -0.937 1.00 0.00 C ATOM 253 O GLU A 17 104.163 12.098 0.059 1.00 0.00 O ATOM 254 CB GLU A 17 104.168 12.460 -3.278 1.00 0.00 C ATOM 255 CG GLU A 17 102.808 11.902 -2.855 1.00 0.00 C ATOM 256 CD GLU A 17 101.796 12.114 -3.982 1.00 0.00 C ATOM 257 OE1 GLU A 17 101.857 11.378 -4.953 1.00 0.00 O ATOM 258 OE2 GLU A 17 100.976 13.008 -3.856 1.00 0.00 O ATOM 0 H GLU A 17 106.550 13.150 -3.409 1.00 0.00 H new ATOM 0 HA GLU A 17 104.489 13.881 -1.674 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.033 13.278 -3.985 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.746 11.690 -3.788 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.895 10.840 -2.625 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.466 12.398 -1.947 1.00 0.00 H new ATOM 265 N LEU A 18 105.444 10.763 -1.109 1.00 0.00 N ATOM 266 CA LEU A 18 105.332 9.699 -0.069 1.00 0.00 C ATOM 267 C LEU A 18 106.237 9.981 1.138 1.00 0.00 C ATOM 268 O LEU A 18 105.884 9.663 2.257 1.00 0.00 O ATOM 269 CB LEU A 18 105.690 8.344 -0.684 1.00 0.00 C ATOM 270 CG LEU A 18 104.471 7.419 -0.618 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.079 7.192 0.845 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.297 8.063 -1.366 1.00 0.00 C ATOM 0 H LEU A 18 106.018 10.526 -1.918 1.00 0.00 H new ATOM 0 HA LEU A 18 104.303 9.686 0.289 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.006 8.474 -1.719 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.528 7.899 -0.148 1.00 0.00 H new ATOM 0 HG LEU A 18 104.717 6.464 -1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.211 6.534 0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.912 6.733 1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.834 8.148 1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.430 7.404 -1.319 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.052 9.019 -0.904 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.574 8.224 -2.408 1.00 0.00 H new ATOM 284 N THR A 19 107.396 10.557 0.951 1.00 0.00 N ATOM 285 CA THR A 19 108.266 10.810 2.136 1.00 0.00 C ATOM 286 C THR A 19 107.696 11.977 2.936 1.00 0.00 C ATOM 287 O THR A 19 107.437 11.860 4.115 1.00 0.00 O ATOM 288 CB THR A 19 109.691 11.137 1.684 1.00 0.00 C ATOM 289 OG1 THR A 19 110.109 10.174 0.729 1.00 0.00 O ATOM 290 CG2 THR A 19 110.640 11.107 2.891 1.00 0.00 C ATOM 0 H THR A 19 107.771 10.857 0.051 1.00 0.00 H new ATOM 0 HA THR A 19 108.294 9.917 2.760 1.00 0.00 H new ATOM 0 HB THR A 19 109.711 12.132 1.238 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.785 10.432 -0.159 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.653 11.340 2.563 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.317 11.844 3.626 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.624 10.115 3.342 1.00 0.00 H new ATOM 298 N ARG A 20 107.481 13.096 2.302 1.00 0.00 N ATOM 299 CA ARG A 20 106.910 14.263 3.026 1.00 0.00 C ATOM 300 C ARG A 20 105.640 13.828 3.758 1.00 0.00 C ATOM 301 O ARG A 20 105.343 14.291 4.841 1.00 0.00 O ATOM 302 CB ARG A 20 106.566 15.356 2.021 1.00 0.00 C ATOM 303 CG ARG A 20 107.857 15.950 1.469 1.00 0.00 C ATOM 304 CD ARG A 20 107.561 16.723 0.182 1.00 0.00 C ATOM 305 NE ARG A 20 106.971 18.048 0.523 1.00 0.00 N ATOM 306 CZ ARG A 20 106.244 18.683 -0.355 1.00 0.00 C ATOM 307 NH1 ARG A 20 106.032 18.157 -1.530 1.00 0.00 N ATOM 308 NH2 ARG A 20 105.729 19.845 -0.058 1.00 0.00 N ATOM 0 H ARG A 20 107.677 13.252 1.313 1.00 0.00 H new ATOM 0 HA ARG A 20 107.635 14.643 3.746 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.964 14.945 1.210 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.969 16.133 2.499 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.308 16.613 2.207 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.578 15.157 1.270 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.477 16.858 -0.393 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.872 16.157 -0.445 1.00 0.00 H new ATOM 0 HE ARG A 20 107.135 18.458 1.442 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.435 17.249 -1.762 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.464 18.654 -2.216 1.00 0.00 H new ATOM 0 HH21 ARG A 20 105.895 20.257 0.860 1.00 0.00 H new ATOM 0 HH22 ARG A 20 105.161 20.341 -0.744 1.00 0.00 H new ATOM 322 N GLN A 21 104.892 12.934 3.175 1.00 0.00 N ATOM 323 CA GLN A 21 103.646 12.457 3.833 1.00 0.00 C ATOM 324 C GLN A 21 104.003 11.437 4.915 1.00 0.00 C ATOM 325 O GLN A 21 103.224 11.167 5.806 1.00 0.00 O ATOM 326 CB GLN A 21 102.733 11.805 2.794 1.00 0.00 C ATOM 327 CG GLN A 21 102.378 12.831 1.718 1.00 0.00 C ATOM 328 CD GLN A 21 101.199 13.682 2.193 1.00 0.00 C ATOM 329 OE1 GLN A 21 101.355 14.536 3.043 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.016 13.484 1.678 1.00 0.00 N ATOM 0 H GLN A 21 105.091 12.512 2.268 1.00 0.00 H new ATOM 0 HA GLN A 21 103.128 13.302 4.286 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.231 10.946 2.344 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.826 11.434 3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.238 13.467 1.509 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.123 12.324 0.787 1.00 0.00 H new ATOM 0 HE21 GLN A 21 99.884 12.767 0.964 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.224 14.046 1.989 1.00 0.00 H new ATOM 339 N VAL A 22 105.173 10.862 4.840 1.00 0.00 N ATOM 340 CA VAL A 22 105.574 9.855 5.863 1.00 0.00 C ATOM 341 C VAL A 22 105.263 10.402 7.258 1.00 0.00 C ATOM 342 O VAL A 22 104.938 9.663 8.165 1.00 0.00 O ATOM 343 CB VAL A 22 107.073 9.560 5.735 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.886 10.718 6.317 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.413 8.275 6.494 1.00 0.00 C ATOM 0 H VAL A 22 105.867 11.046 4.116 1.00 0.00 H new ATOM 0 HA VAL A 22 105.018 8.930 5.707 1.00 0.00 H new ATOM 0 HB VAL A 22 107.319 9.439 4.680 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.950 10.500 6.222 1.00 0.00 H new ATOM 0 HG12 VAL A 22 107.654 11.634 5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.635 10.846 7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.479 8.069 6.401 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.158 8.396 7.547 1.00 0.00 H new ATOM 0 HG23 VAL A 22 106.845 7.444 6.076 1.00 0.00 H new ATOM 355 N GLY A 23 105.343 11.693 7.437 1.00 0.00 N ATOM 356 CA GLY A 23 105.031 12.272 8.773 1.00 0.00 C ATOM 357 C GLY A 23 103.584 11.929 9.128 1.00 0.00 C ATOM 358 O GLY A 23 103.155 12.072 10.256 1.00 0.00 O ATOM 0 H GLY A 23 105.609 12.368 6.720 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.710 11.873 9.526 1.00 0.00 H new ATOM 0 HA3 GLY A 23 105.171 13.353 8.759 1.00 0.00 H new ATOM 362 N ARG A 24 102.832 11.471 8.163 1.00 0.00 N ATOM 363 CA ARG A 24 101.412 11.106 8.421 1.00 0.00 C ATOM 364 C ARG A 24 101.269 9.584 8.368 1.00 0.00 C ATOM 365 O ARG A 24 100.602 8.984 9.187 1.00 0.00 O ATOM 366 CB ARG A 24 100.519 11.739 7.351 1.00 0.00 C ATOM 367 CG ARG A 24 100.760 13.250 7.312 1.00 0.00 C ATOM 368 CD ARG A 24 99.807 13.944 8.286 1.00 0.00 C ATOM 369 NE ARG A 24 100.157 13.560 9.682 1.00 0.00 N ATOM 370 CZ ARG A 24 101.094 14.205 10.321 1.00 0.00 C ATOM 371 NH1 ARG A 24 101.725 15.187 9.738 1.00 0.00 N ATOM 372 NH2 ARG A 24 101.401 13.867 11.544 1.00 0.00 N ATOM 0 H ARG A 24 103.144 11.334 7.202 1.00 0.00 H new ATOM 0 HA ARG A 24 101.112 11.470 9.404 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.735 11.301 6.377 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.471 11.533 7.569 1.00 0.00 H new ATOM 0 HG2 ARG A 24 101.794 13.471 7.578 1.00 0.00 H new ATOM 0 HG3 ARG A 24 100.603 13.628 6.302 1.00 0.00 H new ATOM 0 HD2 ARG A 24 99.873 15.026 8.168 1.00 0.00 H new ATOM 0 HD3 ARG A 24 98.777 13.662 8.067 1.00 0.00 H new ATOM 0 HE ARG A 24 99.664 12.793 10.139 1.00 0.00 H new ATOM 0 HH11 ARG A 24 101.486 15.451 8.782 1.00 0.00 H new ATOM 0 HH12 ARG A 24 102.457 15.691 10.238 1.00 0.00 H new ATOM 0 HH21 ARG A 24 100.908 13.099 12.000 1.00 0.00 H new ATOM 0 HH22 ARG A 24 102.133 14.371 12.044 1.00 0.00 H new ATOM 386 N TYR A 25 101.896 8.955 7.411 1.00 0.00 N ATOM 387 CA TYR A 25 101.803 7.472 7.307 1.00 0.00 C ATOM 388 C TYR A 25 102.963 6.838 8.075 1.00 0.00 C ATOM 389 O TYR A 25 102.858 5.739 8.581 1.00 0.00 O ATOM 390 CB TYR A 25 101.876 7.056 5.835 1.00 0.00 C ATOM 391 CG TYR A 25 101.159 8.076 4.980 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.098 8.820 5.512 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.557 8.277 3.652 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.436 9.763 4.719 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.893 9.220 2.859 1.00 0.00 C ATOM 396 CZ TYR A 25 99.833 9.963 3.392 1.00 0.00 C ATOM 397 OH TYR A 25 99.180 10.893 2.609 1.00 0.00 O ATOM 0 H TYR A 25 102.469 9.405 6.697 1.00 0.00 H new ATOM 0 HA TYR A 25 100.857 7.135 7.731 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.917 6.972 5.522 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.423 6.073 5.702 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.791 8.665 6.536 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.375 7.705 3.240 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.619 10.337 5.131 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.199 9.375 1.835 1.00 0.00 H new ATOM 0 HH TYR A 25 99.581 10.907 1.715 1.00 0.00 H new ATOM 407 N LYS A 26 104.069 7.525 8.169 1.00 0.00 N ATOM 408 CA LYS A 26 105.234 6.963 8.907 1.00 0.00 C ATOM 409 C LYS A 26 105.661 5.643 8.263 1.00 0.00 C ATOM 410 O LYS A 26 106.575 4.986 8.721 1.00 0.00 O ATOM 411 CB LYS A 26 104.844 6.716 10.367 1.00 0.00 C ATOM 412 CG LYS A 26 104.173 7.968 10.937 1.00 0.00 C ATOM 413 CD LYS A 26 103.492 7.623 12.263 1.00 0.00 C ATOM 414 CE LYS A 26 102.670 8.821 12.742 1.00 0.00 C ATOM 415 NZ LYS A 26 102.605 8.814 14.231 1.00 0.00 N ATOM 0 H LYS A 26 104.215 8.451 7.767 1.00 0.00 H new ATOM 0 HA LYS A 26 106.062 7.670 8.867 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.166 5.865 10.434 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.728 6.466 10.953 1.00 0.00 H new ATOM 0 HG2 LYS A 26 104.914 8.753 11.090 1.00 0.00 H new ATOM 0 HG3 LYS A 26 103.440 8.355 10.229 1.00 0.00 H new ATOM 0 HD2 LYS A 26 102.847 6.753 12.137 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.240 7.360 13.011 1.00 0.00 H new ATOM 0 HE2 LYS A 26 103.121 9.749 12.391 1.00 0.00 H new ATOM 0 HE3 LYS A 26 101.665 8.777 12.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 102.046 9.628 14.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 102.156 7.934 14.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 103.567 8.876 14.621 1.00 0.00 H new ATOM 429 N ASN A 27 105.009 5.247 7.203 1.00 0.00 N ATOM 430 CA ASN A 27 105.384 3.971 6.536 1.00 0.00 C ATOM 431 C ASN A 27 106.502 4.237 5.527 1.00 0.00 C ATOM 432 O ASN A 27 106.622 5.319 4.988 1.00 0.00 O ATOM 433 CB ASN A 27 104.166 3.396 5.811 1.00 0.00 C ATOM 434 CG ASN A 27 103.404 2.463 6.754 1.00 0.00 C ATOM 435 OD1 ASN A 27 103.996 1.805 7.586 1.00 0.00 O ATOM 436 ND2 ASN A 27 102.105 2.378 6.658 1.00 0.00 N ATOM 0 H ASN A 27 104.235 5.752 6.772 1.00 0.00 H new ATOM 0 HA ASN A 27 105.730 3.256 7.283 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.514 4.203 5.476 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.483 2.852 4.921 1.00 0.00 H new ATOM 0 HD21 ASN A 27 101.587 1.759 7.282 1.00 0.00 H new ATOM 0 HD22 ASN A 27 101.608 2.931 5.959 1.00 0.00 H new ATOM 443 N LYS A 28 107.323 3.258 5.270 1.00 0.00 N ATOM 444 CA LYS A 28 108.436 3.446 4.298 1.00 0.00 C ATOM 445 C LYS A 28 108.472 2.249 3.344 1.00 0.00 C ATOM 446 O LYS A 28 108.618 2.390 2.142 1.00 0.00 O ATOM 447 CB LYS A 28 109.758 3.531 5.058 1.00 0.00 C ATOM 448 CG LYS A 28 109.842 4.871 5.795 1.00 0.00 C ATOM 449 CD LYS A 28 109.311 4.705 7.220 1.00 0.00 C ATOM 450 CE LYS A 28 109.214 6.074 7.898 1.00 0.00 C ATOM 451 NZ LYS A 28 109.763 5.982 9.281 1.00 0.00 N ATOM 0 H LYS A 28 107.271 2.331 5.693 1.00 0.00 H new ATOM 0 HA LYS A 28 108.283 4.364 3.730 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.834 2.708 5.769 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.594 3.432 4.366 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.874 5.221 5.819 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.262 5.626 5.265 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.331 4.228 7.200 1.00 0.00 H new ATOM 0 HD3 LYS A 28 109.971 4.052 7.791 1.00 0.00 H new ATOM 0 HE2 LYS A 28 109.768 6.817 7.324 1.00 0.00 H new ATOM 0 HE3 LYS A 28 108.176 6.404 7.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 110.330 6.830 9.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 108.980 5.916 9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 110.363 5.137 9.361 1.00 0.00 H new ATOM 465 N LYS A 29 108.332 1.069 3.883 1.00 0.00 N ATOM 466 CA LYS A 29 108.347 -0.160 3.041 1.00 0.00 C ATOM 467 C LYS A 29 107.074 -0.216 2.196 1.00 0.00 C ATOM 468 O LYS A 29 106.881 -1.105 1.394 1.00 0.00 O ATOM 469 CB LYS A 29 108.395 -1.388 3.957 1.00 0.00 C ATOM 470 CG LYS A 29 107.656 -1.088 5.264 1.00 0.00 C ATOM 471 CD LYS A 29 106.236 -0.609 4.955 1.00 0.00 C ATOM 472 CE LYS A 29 105.356 -0.793 6.193 1.00 0.00 C ATOM 473 NZ LYS A 29 104.001 -0.232 5.927 1.00 0.00 N ATOM 0 H LYS A 29 108.207 0.903 4.881 1.00 0.00 H new ATOM 0 HA LYS A 29 109.218 -0.146 2.386 1.00 0.00 H new ATOM 0 HB2 LYS A 29 107.939 -2.243 3.458 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.430 -1.656 4.167 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.621 -1.982 5.887 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.192 -0.326 5.830 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.251 0.440 4.659 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.825 -1.171 4.117 1.00 0.00 H new ATOM 0 HE2 LYS A 29 105.280 -1.851 6.445 1.00 0.00 H new ATOM 0 HE3 LYS A 29 105.807 -0.293 7.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 103.644 0.234 6.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 104.058 0.462 5.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 103.354 -1.000 5.655 1.00 0.00 H new ATOM 487 N PHE A 30 106.194 0.717 2.391 1.00 0.00 N ATOM 488 CA PHE A 30 104.909 0.711 1.630 1.00 0.00 C ATOM 489 C PHE A 30 105.129 1.017 0.138 1.00 0.00 C ATOM 490 O PHE A 30 105.093 0.140 -0.703 1.00 0.00 O ATOM 491 CB PHE A 30 104.061 1.835 2.221 1.00 0.00 C ATOM 492 CG PHE A 30 104.899 3.110 2.322 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.229 3.153 1.841 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.343 4.259 2.894 1.00 0.00 C ATOM 495 CE1 PHE A 30 106.972 4.330 1.935 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.097 5.437 2.987 1.00 0.00 C ATOM 497 CZ PHE A 30 106.411 5.470 2.505 1.00 0.00 C ATOM 0 H PHE A 30 106.304 1.490 3.047 1.00 0.00 H new ATOM 0 HA PHE A 30 104.441 -0.270 1.706 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.186 2.011 1.596 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.696 1.549 3.207 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.670 2.272 1.400 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.329 4.238 3.265 1.00 0.00 H new ATOM 0 HE1 PHE A 30 107.986 4.357 1.564 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.663 6.321 3.431 1.00 0.00 H new ATOM 0 HZ PHE A 30 106.989 6.379 2.575 1.00 0.00 H new ATOM 507 N MET A 31 105.391 2.255 -0.179 1.00 0.00 N ATOM 508 CA MET A 31 105.654 2.651 -1.584 1.00 0.00 C ATOM 509 C MET A 31 107.099 2.324 -1.932 1.00 0.00 C ATOM 510 O MET A 31 107.398 1.763 -2.967 1.00 0.00 O ATOM 511 CB MET A 31 105.424 4.154 -1.735 1.00 0.00 C ATOM 512 CG MET A 31 106.072 4.646 -3.030 1.00 0.00 C ATOM 513 SD MET A 31 105.583 3.566 -4.397 1.00 0.00 S ATOM 514 CE MET A 31 106.480 4.436 -5.706 1.00 0.00 C ATOM 0 H MET A 31 105.434 3.021 0.493 1.00 0.00 H new ATOM 0 HA MET A 31 104.984 2.110 -2.252 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.355 4.369 -1.747 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.846 4.684 -0.881 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.766 5.672 -3.235 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.157 4.652 -2.927 1.00 0.00 H new ATOM 0 HE1 MET A 31 106.479 3.830 -6.612 1.00 0.00 H new ATOM 0 HE2 MET A 31 105.994 5.391 -5.907 1.00 0.00 H new ATOM 0 HE3 MET A 31 107.508 4.612 -5.388 1.00 0.00 H new ATOM 524 N GLN A 32 108.003 2.703 -1.067 1.00 0.00 N ATOM 525 CA GLN A 32 109.439 2.456 -1.329 1.00 0.00 C ATOM 526 C GLN A 32 109.752 0.966 -1.154 1.00 0.00 C ATOM 527 O GLN A 32 110.634 0.433 -1.796 1.00 0.00 O ATOM 528 CB GLN A 32 110.273 3.309 -0.372 1.00 0.00 C ATOM 529 CG GLN A 32 109.902 4.783 -0.556 1.00 0.00 C ATOM 530 CD GLN A 32 110.648 5.629 0.477 1.00 0.00 C ATOM 531 OE1 GLN A 32 111.630 5.192 1.043 1.00 0.00 O ATOM 532 NE2 GLN A 32 110.220 6.832 0.749 1.00 0.00 N ATOM 0 H GLN A 32 107.800 3.176 -0.186 1.00 0.00 H new ATOM 0 HA GLN A 32 109.685 2.733 -2.354 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.093 3.002 0.658 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.335 3.162 -0.567 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.158 5.111 -1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.826 4.915 -0.442 1.00 0.00 H new ATOM 0 HE21 GLN A 32 109.396 7.200 0.274 1.00 0.00 H new ATOM 0 HE22 GLN A 32 110.710 7.404 1.436 1.00 0.00 H new ATOM 541 N GLY A 33 109.036 0.278 -0.299 1.00 0.00 N ATOM 542 CA GLY A 33 109.312 -1.175 -0.122 1.00 0.00 C ATOM 543 C GLY A 33 108.874 -1.904 -1.388 1.00 0.00 C ATOM 544 O GLY A 33 109.626 -2.657 -1.974 1.00 0.00 O ATOM 0 H GLY A 33 108.283 0.656 0.276 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.373 -1.340 0.063 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.774 -1.561 0.744 1.00 0.00 H new ATOM 548 N THR A 34 107.668 -1.667 -1.833 1.00 0.00 N ATOM 549 CA THR A 34 107.200 -2.329 -3.080 1.00 0.00 C ATOM 550 C THR A 34 108.135 -1.913 -4.214 1.00 0.00 C ATOM 551 O THR A 34 108.250 -2.578 -5.224 1.00 0.00 O ATOM 552 CB THR A 34 105.772 -1.881 -3.398 1.00 0.00 C ATOM 553 OG1 THR A 34 105.697 -0.464 -3.335 1.00 0.00 O ATOM 554 CG2 THR A 34 104.805 -2.491 -2.381 1.00 0.00 C ATOM 0 H THR A 34 106.992 -1.047 -1.388 1.00 0.00 H new ATOM 0 HA THR A 34 107.207 -3.412 -2.960 1.00 0.00 H new ATOM 0 HB THR A 34 105.501 -2.215 -4.399 1.00 0.00 H new ATOM 0 HG1 THR A 34 105.498 -0.187 -2.416 1.00 0.00 H new ATOM 0 HG21 THR A 34 103.788 -2.171 -2.609 1.00 0.00 H new ATOM 0 HG22 THR A 34 104.863 -3.578 -2.431 1.00 0.00 H new ATOM 0 HG23 THR A 34 105.074 -2.159 -1.378 1.00 0.00 H new ATOM 562 N VAL A 35 108.812 -0.813 -4.037 1.00 0.00 N ATOM 563 CA VAL A 35 109.758 -0.329 -5.078 1.00 0.00 C ATOM 564 C VAL A 35 111.034 -1.178 -5.033 1.00 0.00 C ATOM 565 O VAL A 35 111.411 -1.801 -6.005 1.00 0.00 O ATOM 566 CB VAL A 35 110.094 1.137 -4.787 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.451 1.495 -5.383 1.00 0.00 C ATOM 568 CG2 VAL A 35 109.023 2.041 -5.398 1.00 0.00 C ATOM 0 H VAL A 35 108.749 -0.224 -3.207 1.00 0.00 H new ATOM 0 HA VAL A 35 109.310 -0.413 -6.068 1.00 0.00 H new ATOM 0 HB VAL A 35 110.127 1.281 -3.707 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.678 2.539 -5.169 1.00 0.00 H new ATOM 0 HG12 VAL A 35 112.220 0.859 -4.944 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.426 1.343 -6.462 1.00 0.00 H new ATOM 0 HG21 VAL A 35 109.264 3.083 -5.190 1.00 0.00 H new ATOM 0 HG22 VAL A 35 108.987 1.885 -6.476 1.00 0.00 H new ATOM 0 HG23 VAL A 35 108.053 1.800 -4.964 1.00 0.00 H new ATOM 578 N ALA A 36 111.700 -1.209 -3.910 1.00 0.00 N ATOM 579 CA ALA A 36 112.948 -2.018 -3.800 1.00 0.00 C ATOM 580 C ALA A 36 112.715 -3.401 -4.411 1.00 0.00 C ATOM 581 O ALA A 36 113.475 -3.858 -5.242 1.00 0.00 O ATOM 582 CB ALA A 36 113.327 -2.170 -2.324 1.00 0.00 C ATOM 0 H ALA A 36 111.433 -0.708 -3.063 1.00 0.00 H new ATOM 0 HA ALA A 36 113.755 -1.516 -4.334 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.239 -2.761 -2.242 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.492 -1.185 -1.887 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.520 -2.672 -1.791 1.00 0.00 H new ATOM 588 N VAL A 37 111.672 -4.073 -4.007 1.00 0.00 N ATOM 589 CA VAL A 37 111.399 -5.426 -4.569 1.00 0.00 C ATOM 590 C VAL A 37 111.338 -5.332 -6.093 1.00 0.00 C ATOM 591 O VAL A 37 111.847 -6.187 -6.796 1.00 0.00 O ATOM 592 CB VAL A 37 110.069 -5.955 -4.032 1.00 0.00 C ATOM 593 CG1 VAL A 37 108.979 -4.909 -4.247 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.696 -7.239 -4.776 1.00 0.00 C ATOM 0 H VAL A 37 110.999 -3.745 -3.314 1.00 0.00 H new ATOM 0 HA VAL A 37 112.196 -6.109 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 37 110.165 -6.164 -2.967 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.031 -5.287 -3.864 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.244 -3.993 -3.719 1.00 0.00 H new ATOM 0 HG13 VAL A 37 108.882 -4.699 -5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.748 -7.618 -4.395 1.00 0.00 H new ATOM 0 HG22 VAL A 37 109.600 -7.028 -5.841 1.00 0.00 H new ATOM 0 HG23 VAL A 37 110.474 -7.987 -4.623 1.00 0.00 H new ATOM 604 N CYS A 38 110.741 -4.293 -6.620 1.00 0.00 N ATOM 605 CA CYS A 38 110.687 -4.164 -8.099 1.00 0.00 C ATOM 606 C CYS A 38 112.110 -4.316 -8.626 1.00 0.00 C ATOM 607 O CYS A 38 112.343 -4.759 -9.732 1.00 0.00 O ATOM 608 CB CYS A 38 110.135 -2.790 -8.489 1.00 0.00 C ATOM 609 SG CYS A 38 108.480 -2.582 -7.789 1.00 0.00 S ATOM 0 H CYS A 38 110.296 -3.540 -6.095 1.00 0.00 H new ATOM 0 HA CYS A 38 110.034 -4.927 -8.523 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.797 -2.004 -8.125 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.096 -2.697 -9.574 1.00 0.00 H new ATOM 0 HG CYS A 38 108.561 -2.522 -6.493 1.00 0.00 H new ATOM 615 N ALA A 39 113.071 -3.949 -7.828 1.00 0.00 N ATOM 616 CA ALA A 39 114.481 -4.080 -8.259 1.00 0.00 C ATOM 617 C ALA A 39 114.940 -5.535 -8.093 1.00 0.00 C ATOM 618 O ALA A 39 115.496 -6.130 -8.992 1.00 0.00 O ATOM 619 CB ALA A 39 115.356 -3.167 -7.404 1.00 0.00 C ATOM 0 H ALA A 39 112.936 -3.563 -6.893 1.00 0.00 H new ATOM 0 HA ALA A 39 114.569 -3.794 -9.307 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.395 -3.261 -7.718 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.032 -2.134 -7.526 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.267 -3.454 -6.356 1.00 0.00 H new ATOM 625 N ARG A 40 114.735 -6.092 -6.929 1.00 0.00 N ATOM 626 CA ARG A 40 115.191 -7.489 -6.658 1.00 0.00 C ATOM 627 C ARG A 40 114.945 -8.400 -7.862 1.00 0.00 C ATOM 628 O ARG A 40 115.765 -9.234 -8.180 1.00 0.00 O ATOM 629 CB ARG A 40 114.440 -8.042 -5.448 1.00 0.00 C ATOM 630 CG ARG A 40 114.869 -9.491 -5.192 1.00 0.00 C ATOM 631 CD ARG A 40 113.844 -10.454 -5.797 1.00 0.00 C ATOM 632 NE ARG A 40 114.092 -11.829 -5.279 1.00 0.00 N ATOM 633 CZ ARG A 40 113.793 -12.868 -6.010 1.00 0.00 C ATOM 634 NH1 ARG A 40 113.274 -12.705 -7.197 1.00 0.00 N ATOM 635 NH2 ARG A 40 114.011 -14.071 -5.554 1.00 0.00 N ATOM 0 H ARG A 40 114.267 -5.635 -6.146 1.00 0.00 H new ATOM 0 HA ARG A 40 116.263 -7.464 -6.461 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.646 -7.431 -4.569 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.365 -7.996 -5.623 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.851 -9.671 -5.629 1.00 0.00 H new ATOM 0 HG3 ARG A 40 114.959 -9.669 -4.120 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.834 -10.134 -5.542 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.917 -10.444 -6.885 1.00 0.00 H new ATOM 0 HE ARG A 40 114.496 -11.958 -4.351 1.00 0.00 H new ATOM 0 HH11 ARG A 40 113.102 -11.765 -7.554 1.00 0.00 H new ATOM 0 HH12 ARG A 40 113.041 -13.518 -7.768 1.00 0.00 H new ATOM 0 HH21 ARG A 40 114.415 -14.199 -4.626 1.00 0.00 H new ATOM 0 HH22 ARG A 40 113.777 -14.883 -6.125 1.00 0.00 H new ATOM 649 N ILE A 41 113.832 -8.280 -8.526 1.00 0.00 N ATOM 650 CA ILE A 41 113.592 -9.181 -9.693 1.00 0.00 C ATOM 651 C ILE A 41 114.081 -8.535 -10.995 1.00 0.00 C ATOM 652 O ILE A 41 114.357 -9.218 -11.961 1.00 0.00 O ATOM 653 CB ILE A 41 112.104 -9.509 -9.807 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.275 -8.347 -9.265 1.00 0.00 C ATOM 655 CG2 ILE A 41 111.810 -10.763 -8.991 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.697 -7.059 -9.965 1.00 0.00 C ATOM 0 H ILE A 41 113.089 -7.612 -8.320 1.00 0.00 H new ATOM 0 HA ILE A 41 114.154 -10.101 -9.531 1.00 0.00 H new ATOM 0 HB ILE A 41 111.846 -9.675 -10.853 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.214 -8.534 -9.430 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.418 -8.254 -8.189 1.00 0.00 H new ATOM 0 HG21 ILE A 41 110.750 -11.006 -9.066 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.401 -11.594 -9.376 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.069 -10.587 -7.947 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.108 -6.226 -9.581 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.754 -6.872 -9.777 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.531 -7.157 -11.038 1.00 0.00 H new ATOM 668 N ALA A 42 114.185 -7.234 -11.045 1.00 0.00 N ATOM 669 CA ALA A 42 114.647 -6.583 -12.304 1.00 0.00 C ATOM 670 C ALA A 42 116.177 -6.480 -12.302 1.00 0.00 C ATOM 671 O ALA A 42 116.777 -5.994 -13.240 1.00 0.00 O ATOM 672 CB ALA A 42 114.021 -5.191 -12.416 1.00 0.00 C ATOM 0 H ALA A 42 113.972 -6.599 -10.276 1.00 0.00 H new ATOM 0 HA ALA A 42 114.338 -7.182 -13.161 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.358 -4.714 -13.336 1.00 0.00 H new ATOM 0 HB2 ALA A 42 112.935 -5.281 -12.430 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.324 -4.586 -11.561 1.00 0.00 H new ATOM 678 N VAL A 43 116.806 -6.922 -11.245 1.00 0.00 N ATOM 679 CA VAL A 43 118.300 -6.843 -11.162 1.00 0.00 C ATOM 680 C VAL A 43 118.932 -6.979 -12.552 1.00 0.00 C ATOM 681 O VAL A 43 119.837 -6.251 -12.900 1.00 0.00 O ATOM 682 CB VAL A 43 118.824 -7.944 -10.237 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.711 -8.415 -9.310 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.328 -9.125 -11.061 1.00 0.00 C ATOM 0 H VAL A 43 116.351 -7.336 -10.432 1.00 0.00 H new ATOM 0 HA VAL A 43 118.574 -5.869 -10.757 1.00 0.00 H new ATOM 0 HB VAL A 43 119.645 -7.541 -9.644 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.091 -9.199 -8.654 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.360 -7.577 -8.708 1.00 0.00 H new ATOM 0 HG13 VAL A 43 116.885 -8.807 -9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.699 -9.903 -10.393 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.512 -9.523 -11.664 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.134 -8.794 -11.716 1.00 0.00 H new ATOM 694 N ALA A 44 118.479 -7.905 -13.346 1.00 0.00 N ATOM 695 CA ALA A 44 119.081 -8.078 -14.697 1.00 0.00 C ATOM 696 C ALA A 44 120.392 -8.857 -14.559 1.00 0.00 C ATOM 697 O ALA A 44 120.664 -9.771 -15.311 1.00 0.00 O ATOM 698 CB ALA A 44 119.360 -6.706 -15.316 1.00 0.00 C ATOM 0 H ALA A 44 117.720 -8.548 -13.120 1.00 0.00 H new ATOM 0 HA ALA A 44 118.392 -8.625 -15.341 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.801 -6.836 -16.305 1.00 0.00 H new ATOM 0 HB2 ALA A 44 118.427 -6.150 -15.405 1.00 0.00 H new ATOM 0 HB3 ALA A 44 120.052 -6.154 -14.680 1.00 0.00 H new ATOM 704 N SER A 45 121.204 -8.508 -13.593 1.00 0.00 N ATOM 705 CA SER A 45 122.491 -9.238 -13.401 1.00 0.00 C ATOM 706 C SER A 45 122.218 -10.740 -13.458 1.00 0.00 C ATOM 707 O SER A 45 123.093 -11.532 -13.743 1.00 0.00 O ATOM 708 CB SER A 45 123.085 -8.879 -12.040 1.00 0.00 C ATOM 709 OG SER A 45 124.503 -8.926 -12.119 1.00 0.00 O ATOM 0 H SER A 45 121.031 -7.751 -12.931 1.00 0.00 H new ATOM 0 HA SER A 45 123.196 -8.958 -14.184 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.759 -7.883 -11.739 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.728 -9.574 -11.280 1.00 0.00 H new ATOM 0 HG SER A 45 124.841 -8.066 -12.446 1.00 0.00 H new ATOM 715 N ASP A 46 120.999 -11.125 -13.198 1.00 0.00 N ATOM 716 CA ASP A 46 120.625 -12.574 -13.242 1.00 0.00 C ATOM 717 C ASP A 46 120.927 -13.256 -11.900 1.00 0.00 C ATOM 718 O ASP A 46 120.539 -14.386 -11.676 1.00 0.00 O ATOM 719 CB ASP A 46 121.405 -13.281 -14.355 1.00 0.00 C ATOM 720 CG ASP A 46 121.551 -12.344 -15.557 1.00 0.00 C ATOM 721 OD1 ASP A 46 120.533 -11.932 -16.088 1.00 0.00 O ATOM 722 OD2 ASP A 46 122.678 -12.056 -15.924 1.00 0.00 O ATOM 0 H ASP A 46 120.236 -10.494 -12.954 1.00 0.00 H new ATOM 0 HA ASP A 46 119.555 -12.644 -13.440 1.00 0.00 H new ATOM 0 HB2 ASP A 46 122.389 -13.578 -13.991 1.00 0.00 H new ATOM 0 HB3 ASP A 46 120.887 -14.193 -14.653 1.00 0.00 H new ATOM 727 N GLY A 47 121.607 -12.593 -11.004 1.00 0.00 N ATOM 728 CA GLY A 47 121.912 -13.230 -9.687 1.00 0.00 C ATOM 729 C GLY A 47 120.705 -13.073 -8.758 1.00 0.00 C ATOM 730 O GLY A 47 120.482 -13.872 -7.872 1.00 0.00 O ATOM 0 H GLY A 47 121.963 -11.645 -11.124 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.144 -14.286 -9.826 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.792 -12.766 -9.241 1.00 0.00 H new ATOM 734 N VAL A 48 119.929 -12.044 -8.966 1.00 0.00 N ATOM 735 CA VAL A 48 118.721 -11.802 -8.120 1.00 0.00 C ATOM 736 C VAL A 48 119.040 -12.003 -6.636 1.00 0.00 C ATOM 737 O VAL A 48 120.113 -12.436 -6.266 1.00 0.00 O ATOM 738 CB VAL A 48 117.589 -12.746 -8.543 1.00 0.00 C ATOM 739 CG1 VAL A 48 117.323 -12.580 -10.040 1.00 0.00 C ATOM 740 CG2 VAL A 48 117.979 -14.200 -8.259 1.00 0.00 C ATOM 0 H VAL A 48 120.082 -11.349 -9.697 1.00 0.00 H new ATOM 0 HA VAL A 48 118.405 -10.769 -8.265 1.00 0.00 H new ATOM 0 HB VAL A 48 116.691 -12.499 -7.976 1.00 0.00 H new ATOM 0 HG11 VAL A 48 116.519 -13.250 -10.343 1.00 0.00 H new ATOM 0 HG12 VAL A 48 117.034 -11.549 -10.246 1.00 0.00 H new ATOM 0 HG13 VAL A 48 118.227 -12.822 -10.599 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.167 -14.861 -8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.880 -14.451 -8.818 1.00 0.00 H new ATOM 0 HG23 VAL A 48 118.167 -14.325 -7.193 1.00 0.00 H new ATOM 750 N SER A 49 118.103 -11.677 -5.784 1.00 0.00 N ATOM 751 CA SER A 49 118.327 -11.832 -4.319 1.00 0.00 C ATOM 752 C SER A 49 117.062 -12.395 -3.668 1.00 0.00 C ATOM 753 O SER A 49 116.526 -13.396 -4.100 1.00 0.00 O ATOM 754 CB SER A 49 118.646 -10.468 -3.707 1.00 0.00 C ATOM 755 OG SER A 49 117.438 -9.739 -3.531 1.00 0.00 O ATOM 0 H SER A 49 117.188 -11.308 -6.043 1.00 0.00 H new ATOM 0 HA SER A 49 119.160 -12.513 -4.148 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.151 -10.595 -2.749 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.327 -9.916 -4.355 1.00 0.00 H new ATOM 0 HG SER A 49 117.638 -8.864 -3.137 1.00 0.00 H new ATOM 761 N SER A 50 116.583 -11.757 -2.632 1.00 0.00 N ATOM 762 CA SER A 50 115.356 -12.247 -1.946 1.00 0.00 C ATOM 763 C SER A 50 115.382 -11.774 -0.494 1.00 0.00 C ATOM 764 O SER A 50 114.702 -10.840 -0.122 1.00 0.00 O ATOM 765 CB SER A 50 115.318 -13.776 -1.979 1.00 0.00 C ATOM 766 OG SER A 50 114.641 -14.253 -0.824 1.00 0.00 O ATOM 0 H SER A 50 116.993 -10.913 -2.231 1.00 0.00 H new ATOM 0 HA SER A 50 114.473 -11.857 -2.452 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.810 -14.119 -2.880 1.00 0.00 H new ATOM 0 HB3 SER A 50 116.331 -14.176 -2.012 1.00 0.00 H new ATOM 0 HG SER A 50 114.613 -15.232 -0.842 1.00 0.00 H new ATOM 772 N GLU A 51 116.166 -12.414 0.328 1.00 0.00 N ATOM 773 CA GLU A 51 116.245 -12.007 1.757 1.00 0.00 C ATOM 774 C GLU A 51 116.988 -10.673 1.880 1.00 0.00 C ATOM 775 O GLU A 51 116.752 -9.906 2.790 1.00 0.00 O ATOM 776 CB GLU A 51 116.993 -13.081 2.551 1.00 0.00 C ATOM 777 CG GLU A 51 118.016 -13.765 1.643 1.00 0.00 C ATOM 778 CD GLU A 51 119.052 -14.495 2.500 1.00 0.00 C ATOM 779 OE1 GLU A 51 118.809 -15.642 2.839 1.00 0.00 O ATOM 780 OE2 GLU A 51 120.070 -13.896 2.803 1.00 0.00 O ATOM 0 H GLU A 51 116.757 -13.204 0.070 1.00 0.00 H new ATOM 0 HA GLU A 51 115.236 -11.893 2.153 1.00 0.00 H new ATOM 0 HB2 GLU A 51 117.494 -12.632 3.408 1.00 0.00 H new ATOM 0 HB3 GLU A 51 116.289 -13.816 2.942 1.00 0.00 H new ATOM 0 HG2 GLU A 51 117.515 -14.470 0.980 1.00 0.00 H new ATOM 0 HG3 GLU A 51 118.508 -13.026 1.010 1.00 0.00 H new ATOM 787 N GLU A 52 117.894 -10.391 0.981 1.00 0.00 N ATOM 788 CA GLU A 52 118.648 -9.107 1.074 1.00 0.00 C ATOM 789 C GLU A 52 117.728 -7.936 0.723 1.00 0.00 C ATOM 790 O GLU A 52 117.609 -6.990 1.477 1.00 0.00 O ATOM 791 CB GLU A 52 119.825 -9.137 0.102 1.00 0.00 C ATOM 792 CG GLU A 52 121.094 -9.570 0.841 1.00 0.00 C ATOM 793 CD GLU A 52 120.985 -11.048 1.222 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.049 -11.391 1.925 1.00 0.00 O ATOM 795 OE2 GLU A 52 121.840 -11.811 0.804 1.00 0.00 O ATOM 0 H GLU A 52 118.143 -10.989 0.193 1.00 0.00 H new ATOM 0 HA GLU A 52 119.016 -8.981 2.092 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.616 -9.826 -0.716 1.00 0.00 H new ATOM 0 HB3 GLU A 52 119.969 -8.151 -0.341 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.968 -9.410 0.209 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.232 -8.962 1.735 1.00 0.00 H new ATOM 802 N LYS A 53 117.059 -7.985 -0.401 1.00 0.00 N ATOM 803 CA LYS A 53 116.145 -6.859 -0.744 1.00 0.00 C ATOM 804 C LYS A 53 115.146 -6.712 0.393 1.00 0.00 C ATOM 805 O LYS A 53 114.906 -5.632 0.894 1.00 0.00 O ATOM 806 CB LYS A 53 115.385 -7.150 -2.044 1.00 0.00 C ATOM 807 CG LYS A 53 114.233 -6.145 -2.196 1.00 0.00 C ATOM 808 CD LYS A 53 112.917 -6.742 -1.671 1.00 0.00 C ATOM 809 CE LYS A 53 112.603 -8.058 -2.388 1.00 0.00 C ATOM 810 NZ LYS A 53 113.005 -9.204 -1.524 1.00 0.00 N ATOM 0 H LYS A 53 117.105 -8.742 -1.083 1.00 0.00 H new ATOM 0 HA LYS A 53 116.725 -5.947 -0.884 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.060 -7.078 -2.897 1.00 0.00 H new ATOM 0 HB3 LYS A 53 114.995 -8.168 -2.031 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.467 -5.231 -1.650 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.120 -5.870 -3.245 1.00 0.00 H new ATOM 0 HD2 LYS A 53 112.992 -6.915 -0.597 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.103 -6.034 -1.824 1.00 0.00 H new ATOM 0 HE2 LYS A 53 111.538 -8.116 -2.615 1.00 0.00 H new ATOM 0 HE3 LYS A 53 113.134 -8.102 -3.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 112.335 -9.989 -1.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 113.961 -9.518 -1.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 113.000 -8.906 -0.528 1.00 0.00 H new ATOM 824 N GLN A 54 114.571 -7.805 0.807 1.00 0.00 N ATOM 825 CA GLN A 54 113.589 -7.762 1.920 1.00 0.00 C ATOM 826 C GLN A 54 114.224 -7.030 3.108 1.00 0.00 C ATOM 827 O GLN A 54 113.577 -6.269 3.805 1.00 0.00 O ATOM 828 CB GLN A 54 113.212 -9.204 2.295 1.00 0.00 C ATOM 829 CG GLN A 54 113.781 -9.577 3.667 1.00 0.00 C ATOM 830 CD GLN A 54 113.021 -8.826 4.762 1.00 0.00 C ATOM 831 OE1 GLN A 54 113.372 -8.902 5.923 1.00 0.00 O ATOM 832 NE2 GLN A 54 111.987 -8.098 4.440 1.00 0.00 N ATOM 0 H GLN A 54 114.742 -8.732 0.418 1.00 0.00 H new ATOM 0 HA GLN A 54 112.685 -7.229 1.627 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.127 -9.310 2.306 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.592 -9.892 1.540 1.00 0.00 H new ATOM 0 HG2 GLN A 54 113.698 -10.652 3.826 1.00 0.00 H new ATOM 0 HG3 GLN A 54 114.841 -9.329 3.711 1.00 0.00 H new ATOM 0 HE21 GLN A 54 111.692 -8.034 3.466 1.00 0.00 H new ATOM 0 HE22 GLN A 54 111.474 -7.593 5.163 1.00 0.00 H new ATOM 841 N LYS A 55 115.494 -7.242 3.331 1.00 0.00 N ATOM 842 CA LYS A 55 116.179 -6.552 4.458 1.00 0.00 C ATOM 843 C LYS A 55 116.146 -5.046 4.202 1.00 0.00 C ATOM 844 O LYS A 55 115.799 -4.265 5.066 1.00 0.00 O ATOM 845 CB LYS A 55 117.633 -7.031 4.545 1.00 0.00 C ATOM 846 CG LYS A 55 117.840 -7.820 5.840 1.00 0.00 C ATOM 847 CD LYS A 55 117.114 -9.163 5.743 1.00 0.00 C ATOM 848 CE LYS A 55 117.319 -9.950 7.038 1.00 0.00 C ATOM 849 NZ LYS A 55 116.251 -9.590 8.013 1.00 0.00 N ATOM 0 H LYS A 55 116.085 -7.864 2.780 1.00 0.00 H new ATOM 0 HA LYS A 55 115.674 -6.779 5.397 1.00 0.00 H new ATOM 0 HB2 LYS A 55 117.872 -7.656 3.685 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.310 -6.177 4.516 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.904 -7.982 6.013 1.00 0.00 H new ATOM 0 HG3 LYS A 55 117.462 -7.251 6.689 1.00 0.00 H new ATOM 0 HD2 LYS A 55 116.050 -9.001 5.568 1.00 0.00 H new ATOM 0 HD3 LYS A 55 117.494 -9.733 4.895 1.00 0.00 H new ATOM 0 HE2 LYS A 55 117.294 -11.020 6.833 1.00 0.00 H new ATOM 0 HE3 LYS A 55 118.300 -9.729 7.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 116.390 -10.125 8.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 116.296 -8.571 8.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 115.321 -9.822 7.610 1.00 0.00 H new ATOM 863 N MET A 56 116.501 -4.630 3.016 1.00 0.00 N ATOM 864 CA MET A 56 116.484 -3.176 2.704 1.00 0.00 C ATOM 865 C MET A 56 115.107 -2.601 3.050 1.00 0.00 C ATOM 866 O MET A 56 115.000 -1.558 3.661 1.00 0.00 O ATOM 867 CB MET A 56 116.766 -2.970 1.215 1.00 0.00 C ATOM 868 CG MET A 56 116.994 -1.482 0.935 1.00 0.00 C ATOM 869 SD MET A 56 118.366 -1.290 -0.229 1.00 0.00 S ATOM 870 CE MET A 56 118.553 0.503 -0.069 1.00 0.00 C ATOM 0 H MET A 56 116.801 -5.235 2.252 1.00 0.00 H new ATOM 0 HA MET A 56 117.249 -2.667 3.290 1.00 0.00 H new ATOM 0 HB2 MET A 56 117.643 -3.545 0.918 1.00 0.00 H new ATOM 0 HB3 MET A 56 115.929 -3.338 0.622 1.00 0.00 H new ATOM 0 HG2 MET A 56 116.089 -1.036 0.523 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.215 -0.956 1.864 1.00 0.00 H new ATOM 0 HE1 MET A 56 119.610 0.764 -0.117 1.00 0.00 H new ATOM 0 HE2 MET A 56 118.020 0.998 -0.880 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.142 0.828 0.887 1.00 0.00 H new ATOM 880 N ILE A 57 114.049 -3.271 2.677 1.00 0.00 N ATOM 881 CA ILE A 57 112.698 -2.739 3.011 1.00 0.00 C ATOM 882 C ILE A 57 112.669 -2.418 4.504 1.00 0.00 C ATOM 883 O ILE A 57 112.179 -1.388 4.919 1.00 0.00 O ATOM 884 CB ILE A 57 111.619 -3.774 2.677 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.117 -4.677 1.547 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.331 -3.064 2.233 1.00 0.00 C ATOM 887 CD1 ILE A 57 112.423 -3.832 0.306 1.00 0.00 C ATOM 0 H ILE A 57 114.061 -4.152 2.163 1.00 0.00 H new ATOM 0 HA ILE A 57 112.498 -1.841 2.427 1.00 0.00 H new ATOM 0 HB ILE A 57 111.409 -4.373 3.563 1.00 0.00 H new ATOM 0 HG12 ILE A 57 113.012 -5.212 1.864 1.00 0.00 H new ATOM 0 HG13 ILE A 57 111.364 -5.428 1.310 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.569 -3.807 1.997 1.00 0.00 H new ATOM 0 HG22 ILE A 57 109.974 -2.421 3.037 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.535 -2.460 1.349 1.00 0.00 H new ATOM 0 HD11 ILE A 57 112.777 -4.479 -0.496 1.00 0.00 H new ATOM 0 HD12 ILE A 57 111.518 -3.317 -0.016 1.00 0.00 H new ATOM 0 HD13 ILE A 57 113.192 -3.098 0.546 1.00 0.00 H new ATOM 899 N GLY A 58 113.219 -3.276 5.319 1.00 0.00 N ATOM 900 CA GLY A 58 113.247 -2.980 6.778 1.00 0.00 C ATOM 901 C GLY A 58 113.944 -1.632 6.963 1.00 0.00 C ATOM 902 O GLY A 58 113.486 -0.762 7.686 1.00 0.00 O ATOM 0 H GLY A 58 113.646 -4.160 5.041 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.235 -2.946 7.181 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.779 -3.763 7.318 1.00 0.00 H new ATOM 906 N PHE A 59 115.042 -1.443 6.281 1.00 0.00 N ATOM 907 CA PHE A 59 115.763 -0.149 6.379 1.00 0.00 C ATOM 908 C PHE A 59 114.778 0.959 6.021 1.00 0.00 C ATOM 909 O PHE A 59 114.751 2.003 6.638 1.00 0.00 O ATOM 910 CB PHE A 59 116.949 -0.155 5.405 1.00 0.00 C ATOM 911 CG PHE A 59 117.006 1.139 4.629 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.654 2.254 5.170 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.419 1.218 3.362 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.713 3.448 4.444 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.479 2.411 2.636 1.00 0.00 C ATOM 916 CZ PHE A 59 117.124 3.525 3.176 1.00 0.00 C ATOM 0 H PHE A 59 115.468 -2.132 5.661 1.00 0.00 H new ATOM 0 HA PHE A 59 116.149 0.011 7.386 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.879 -0.296 5.956 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.857 -0.995 4.716 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.109 2.193 6.148 1.00 0.00 H new ATOM 0 HD2 PHE A 59 115.919 0.357 2.944 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.212 4.310 4.861 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.026 2.471 1.657 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.169 4.447 2.615 1.00 0.00 H new ATOM 926 N LEU A 60 113.944 0.722 5.044 1.00 0.00 N ATOM 927 CA LEU A 60 112.935 1.746 4.668 1.00 0.00 C ATOM 928 C LEU A 60 112.173 2.132 5.932 1.00 0.00 C ATOM 929 O LEU A 60 111.963 3.293 6.215 1.00 0.00 O ATOM 930 CB LEU A 60 111.967 1.152 3.636 1.00 0.00 C ATOM 931 CG LEU A 60 112.026 1.923 2.307 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.470 2.321 1.973 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.498 1.015 1.197 1.00 0.00 C ATOM 0 H LEU A 60 113.920 -0.136 4.493 1.00 0.00 H new ATOM 0 HA LEU A 60 113.415 2.622 4.233 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.214 0.105 3.463 1.00 0.00 H new ATOM 0 HB3 LEU A 60 110.951 1.179 4.030 1.00 0.00 H new ATOM 0 HG LEU A 60 111.424 2.827 2.393 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.488 2.865 1.029 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.865 2.956 2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.084 1.424 1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.532 1.546 0.246 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.116 0.119 1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.469 0.732 1.417 1.00 0.00 H new ATOM 945 N ARG A 61 111.779 1.164 6.712 1.00 0.00 N ATOM 946 CA ARG A 61 111.057 1.485 7.969 1.00 0.00 C ATOM 947 C ARG A 61 111.860 2.547 8.714 1.00 0.00 C ATOM 948 O ARG A 61 111.316 3.426 9.351 1.00 0.00 O ATOM 949 CB ARG A 61 110.941 0.225 8.829 1.00 0.00 C ATOM 950 CG ARG A 61 110.420 -0.932 7.973 1.00 0.00 C ATOM 951 CD ARG A 61 110.436 -2.223 8.793 1.00 0.00 C ATOM 952 NE ARG A 61 110.074 -3.372 7.916 1.00 0.00 N ATOM 953 CZ ARG A 61 109.623 -4.478 8.443 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.490 -4.577 9.737 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.307 -5.485 7.676 1.00 0.00 N ATOM 0 H ARG A 61 111.926 0.171 6.533 1.00 0.00 H new ATOM 0 HA ARG A 61 110.054 1.853 7.751 1.00 0.00 H new ATOM 0 HB2 ARG A 61 111.913 -0.030 9.252 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.266 0.404 9.666 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.407 -0.718 7.632 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.039 -1.047 7.083 1.00 0.00 H new ATOM 0 HD2 ARG A 61 111.424 -2.379 9.226 1.00 0.00 H new ATOM 0 HD3 ARG A 61 109.733 -2.149 9.622 1.00 0.00 H new ATOM 0 HE ARG A 61 110.179 -3.294 6.904 1.00 0.00 H new ATOM 0 HH11 ARG A 61 109.738 -3.790 10.337 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.138 -5.441 10.149 1.00 0.00 H new ATOM 0 HH21 ARG A 61 109.412 -5.408 6.664 1.00 0.00 H new ATOM 0 HH22 ARG A 61 108.955 -6.349 8.088 1.00 0.00 H new ATOM 969 N SER A 62 113.161 2.472 8.630 1.00 0.00 N ATOM 970 CA SER A 62 114.012 3.482 9.322 1.00 0.00 C ATOM 971 C SER A 62 114.767 4.338 8.290 1.00 0.00 C ATOM 972 O SER A 62 115.623 5.124 8.639 1.00 0.00 O ATOM 973 CB SER A 62 115.011 2.765 10.231 1.00 0.00 C ATOM 974 OG SER A 62 114.303 2.080 11.256 1.00 0.00 O ATOM 0 H SER A 62 113.671 1.756 8.113 1.00 0.00 H new ATOM 0 HA SER A 62 113.377 4.135 9.920 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.607 2.060 9.651 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.703 3.484 10.669 1.00 0.00 H new ATOM 0 HG SER A 62 114.939 1.617 11.840 1.00 0.00 H new ATOM 980 N SER A 63 114.472 4.180 7.022 1.00 0.00 N ATOM 981 CA SER A 63 115.188 4.974 5.974 1.00 0.00 C ATOM 982 C SER A 63 115.302 6.439 6.390 1.00 0.00 C ATOM 983 O SER A 63 114.835 6.839 7.435 1.00 0.00 O ATOM 984 CB SER A 63 114.431 4.896 4.648 1.00 0.00 C ATOM 985 OG SER A 63 113.051 4.673 4.903 1.00 0.00 O ATOM 0 H SER A 63 113.766 3.535 6.667 1.00 0.00 H new ATOM 0 HA SER A 63 116.187 4.554 5.857 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.563 5.821 4.087 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.833 4.090 4.034 1.00 0.00 H new ATOM 0 HG SER A 63 112.534 4.858 4.091 1.00 0.00 H new ATOM 991 N GLU A 64 115.919 7.242 5.565 1.00 0.00 N ATOM 992 CA GLU A 64 116.067 8.685 5.894 1.00 0.00 C ATOM 993 C GLU A 64 114.685 9.336 5.928 1.00 0.00 C ATOM 994 O GLU A 64 114.514 10.424 6.439 1.00 0.00 O ATOM 995 CB GLU A 64 116.929 9.367 4.829 1.00 0.00 C ATOM 996 CG GLU A 64 117.241 10.805 5.261 1.00 0.00 C ATOM 997 CD GLU A 64 118.750 10.965 5.465 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.366 10.028 5.945 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.263 12.022 5.137 1.00 0.00 O ATOM 0 H GLU A 64 116.328 6.957 4.675 1.00 0.00 H new ATOM 0 HA GLU A 64 116.546 8.792 6.867 1.00 0.00 H new ATOM 0 HB2 GLU A 64 117.855 8.811 4.686 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.408 9.369 3.872 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.890 11.507 4.505 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.712 11.041 6.184 1.00 0.00 H new ATOM 1006 N GLU A 65 113.695 8.674 5.391 1.00 0.00 N ATOM 1007 CA GLU A 65 112.323 9.253 5.399 1.00 0.00 C ATOM 1008 C GLU A 65 112.051 9.857 6.776 1.00 0.00 C ATOM 1009 O GLU A 65 111.126 10.623 6.959 1.00 0.00 O ATOM 1010 CB GLU A 65 111.299 8.151 5.114 1.00 0.00 C ATOM 1011 CG GLU A 65 111.103 7.996 3.601 1.00 0.00 C ATOM 1012 CD GLU A 65 111.110 6.511 3.232 1.00 0.00 C ATOM 1013 OE1 GLU A 65 112.185 5.934 3.198 1.00 0.00 O ATOM 1014 OE2 GLU A 65 110.041 5.976 2.991 1.00 0.00 O ATOM 0 H GLU A 65 113.778 7.759 4.948 1.00 0.00 H new ATOM 0 HA GLU A 65 112.243 10.024 4.632 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.638 7.208 5.544 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.349 8.394 5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.161 8.452 3.298 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.896 8.518 3.066 1.00 0.00 H new ATOM 1021 N LEU A 66 112.858 9.522 7.745 1.00 0.00 N ATOM 1022 CA LEU A 66 112.652 10.084 9.112 1.00 0.00 C ATOM 1023 C LEU A 66 112.499 11.599 8.997 1.00 0.00 C ATOM 1024 O LEU A 66 111.851 12.237 9.802 1.00 0.00 O ATOM 1025 CB LEU A 66 113.863 9.770 10.001 1.00 0.00 C ATOM 1026 CG LEU A 66 114.260 8.295 9.857 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.778 8.186 9.674 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.852 7.529 11.117 1.00 0.00 C ATOM 0 H LEU A 66 113.649 8.885 7.651 1.00 0.00 H new ATOM 0 HA LEU A 66 111.761 9.641 9.556 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.702 10.408 9.724 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.626 9.990 11.042 1.00 0.00 H new ATOM 0 HG LEU A 66 113.754 7.871 8.989 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.058 7.137 9.572 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.076 8.730 8.778 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.281 8.613 10.542 1.00 0.00 H new ATOM 0 HD21 LEU A 66 114.135 6.481 11.013 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.357 7.957 11.983 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.773 7.602 11.254 1.00 0.00 H new ATOM 1040 N LYS A 67 113.102 12.175 7.995 1.00 0.00 N ATOM 1041 CA LYS A 67 113.015 13.649 7.805 1.00 0.00 C ATOM 1042 C LYS A 67 111.631 14.026 7.271 1.00 0.00 C ATOM 1043 O LYS A 67 110.964 14.870 7.830 1.00 0.00 O ATOM 1044 CB LYS A 67 114.079 14.088 6.800 1.00 0.00 C ATOM 1045 CG LYS A 67 114.192 13.037 5.691 1.00 0.00 C ATOM 1046 CD LYS A 67 114.008 13.702 4.330 1.00 0.00 C ATOM 1047 CE LYS A 67 113.812 12.620 3.267 1.00 0.00 C ATOM 1048 NZ LYS A 67 115.069 11.833 3.119 1.00 0.00 N ATOM 0 H LYS A 67 113.656 11.683 7.294 1.00 0.00 H new ATOM 0 HA LYS A 67 113.178 14.146 8.761 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.816 15.056 6.374 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.040 14.210 7.300 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.165 12.548 5.739 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.438 12.263 5.833 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.146 14.369 4.351 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.878 14.313 4.089 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.990 11.962 3.550 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.542 13.076 2.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 115.051 11.317 2.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.886 12.477 3.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 115.148 11.155 3.904 1.00 0.00 H new ATOM 1062 N VAL A 68 111.204 13.417 6.189 1.00 0.00 N ATOM 1063 CA VAL A 68 109.866 13.744 5.612 1.00 0.00 C ATOM 1064 C VAL A 68 110.022 14.886 4.608 1.00 0.00 C ATOM 1065 O VAL A 68 109.267 15.834 4.634 1.00 0.00 O ATOM 1066 CB VAL A 68 108.910 14.180 6.736 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.470 14.202 6.223 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.016 13.201 7.914 1.00 0.00 C ATOM 0 H VAL A 68 111.729 12.705 5.681 1.00 0.00 H new ATOM 0 HA VAL A 68 109.458 12.865 5.114 1.00 0.00 H new ATOM 0 HB VAL A 68 109.188 15.181 7.066 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.802 14.512 7.027 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.390 14.905 5.393 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.190 13.205 5.882 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.338 13.513 8.708 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.747 12.199 7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.039 13.195 8.292 1.00 0.00 H new ATOM 1078 N PHE A 69 110.989 14.812 3.719 1.00 0.00 N ATOM 1079 CA PHE A 69 111.161 15.929 2.736 1.00 0.00 C ATOM 1080 C PHE A 69 112.233 15.621 1.677 1.00 0.00 C ATOM 1081 O PHE A 69 111.949 15.597 0.496 1.00 0.00 O ATOM 1082 CB PHE A 69 111.579 17.200 3.482 1.00 0.00 C ATOM 1083 CG PHE A 69 110.401 17.774 4.229 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.363 18.400 3.529 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.346 17.678 5.625 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.269 18.929 4.226 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.254 18.207 6.321 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.215 18.833 5.622 1.00 0.00 C ATOM 0 H PHE A 69 111.653 14.042 3.633 1.00 0.00 H new ATOM 0 HA PHE A 69 110.205 16.059 2.228 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.386 16.973 4.179 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.965 17.935 2.776 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.405 18.475 2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.147 17.195 6.165 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.467 19.411 3.687 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.212 18.133 7.398 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.372 19.242 6.159 1.00 0.00 H new ATOM 1098 N ASP A 70 113.468 15.441 2.072 1.00 0.00 N ATOM 1099 CA ASP A 70 114.540 15.202 1.055 1.00 0.00 C ATOM 1100 C ASP A 70 114.095 14.147 0.043 1.00 0.00 C ATOM 1101 O ASP A 70 114.370 12.967 0.177 1.00 0.00 O ATOM 1102 CB ASP A 70 115.834 14.752 1.738 1.00 0.00 C ATOM 1103 CG ASP A 70 116.253 15.793 2.778 1.00 0.00 C ATOM 1104 OD1 ASP A 70 115.453 16.669 3.065 1.00 0.00 O ATOM 1105 OD2 ASP A 70 117.366 15.697 3.269 1.00 0.00 O ATOM 0 H ASP A 70 113.779 15.449 3.043 1.00 0.00 H new ATOM 0 HA ASP A 70 114.724 16.139 0.529 1.00 0.00 H new ATOM 0 HB2 ASP A 70 115.687 13.784 2.216 1.00 0.00 H new ATOM 0 HB3 ASP A 70 116.623 14.625 0.997 1.00 0.00 H new ATOM 1110 N THR A 71 113.419 14.582 -0.984 1.00 0.00 N ATOM 1111 CA THR A 71 112.952 13.643 -2.038 1.00 0.00 C ATOM 1112 C THR A 71 114.168 13.048 -2.746 1.00 0.00 C ATOM 1113 O THR A 71 114.164 11.905 -3.159 1.00 0.00 O ATOM 1114 CB THR A 71 112.103 14.413 -3.052 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.675 14.279 -4.344 1.00 0.00 O ATOM 1116 CG2 THR A 71 112.063 15.894 -2.668 1.00 0.00 C ATOM 0 H THR A 71 113.168 15.559 -1.138 1.00 0.00 H new ATOM 0 HA THR A 71 112.358 12.846 -1.592 1.00 0.00 H new ATOM 0 HB THR A 71 111.090 14.011 -3.055 1.00 0.00 H new ATOM 0 HG1 THR A 71 112.616 15.135 -4.818 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.458 16.441 -3.391 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.626 16.001 -1.675 1.00 0.00 H new ATOM 0 HG23 THR A 71 113.076 16.296 -2.664 1.00 0.00 H new ATOM 1124 N ALA A 72 115.211 13.819 -2.887 1.00 0.00 N ATOM 1125 CA ALA A 72 116.430 13.304 -3.567 1.00 0.00 C ATOM 1126 C ALA A 72 117.002 12.142 -2.757 1.00 0.00 C ATOM 1127 O ALA A 72 117.643 11.260 -3.289 1.00 0.00 O ATOM 1128 CB ALA A 72 117.472 14.421 -3.664 1.00 0.00 C ATOM 0 H ALA A 72 115.271 14.783 -2.560 1.00 0.00 H new ATOM 0 HA ALA A 72 116.174 12.962 -4.570 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.365 14.043 -4.162 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.061 15.253 -4.236 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.733 14.763 -2.663 1.00 0.00 H new ATOM 1134 N GLU A 73 116.771 12.137 -1.472 1.00 0.00 N ATOM 1135 CA GLU A 73 117.297 11.033 -0.621 1.00 0.00 C ATOM 1136 C GLU A 73 116.473 9.766 -0.866 1.00 0.00 C ATOM 1137 O GLU A 73 116.995 8.666 -0.896 1.00 0.00 O ATOM 1138 CB GLU A 73 117.188 11.433 0.851 1.00 0.00 C ATOM 1139 CG GLU A 73 118.456 12.179 1.278 1.00 0.00 C ATOM 1140 CD GLU A 73 118.928 13.088 0.142 1.00 0.00 C ATOM 1141 OE1 GLU A 73 118.090 13.752 -0.447 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.119 13.106 -0.120 1.00 0.00 O ATOM 0 H GLU A 73 116.240 12.852 -0.975 1.00 0.00 H new ATOM 0 HA GLU A 73 118.341 10.843 -0.872 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.314 12.066 1.002 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.050 10.546 1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.258 12.771 2.171 1.00 0.00 H new ATOM 0 HG3 GLU A 73 119.239 11.466 1.535 1.00 0.00 H new ATOM 1149 N VAL A 74 115.188 9.912 -1.047 1.00 0.00 N ATOM 1150 CA VAL A 74 114.331 8.718 -1.292 1.00 0.00 C ATOM 1151 C VAL A 74 114.731 8.084 -2.629 1.00 0.00 C ATOM 1152 O VAL A 74 115.192 6.952 -2.691 1.00 0.00 O ATOM 1153 CB VAL A 74 112.866 9.156 -1.339 1.00 0.00 C ATOM 1154 CG1 VAL A 74 111.959 7.939 -1.153 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.590 10.165 -0.216 1.00 0.00 C ATOM 0 H VAL A 74 114.696 10.805 -1.036 1.00 0.00 H new ATOM 0 HA VAL A 74 114.463 7.989 -0.493 1.00 0.00 H new ATOM 0 HB VAL A 74 112.664 9.620 -2.305 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.916 8.254 -1.187 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.147 7.220 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.167 7.474 -0.189 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.545 10.474 -0.253 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.797 9.701 0.749 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.231 11.037 -0.345 1.00 0.00 H new ATOM 1165 N ILE A 75 114.585 8.811 -3.703 1.00 0.00 N ATOM 1166 CA ILE A 75 114.988 8.254 -5.019 1.00 0.00 C ATOM 1167 C ILE A 75 116.418 7.752 -4.886 1.00 0.00 C ATOM 1168 O ILE A 75 116.864 6.908 -5.625 1.00 0.00 O ATOM 1169 CB ILE A 75 114.928 9.336 -6.100 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.585 10.621 -5.577 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.468 9.609 -6.473 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.778 10.986 -6.466 1.00 0.00 C ATOM 0 H ILE A 75 114.207 9.758 -3.724 1.00 0.00 H new ATOM 0 HA ILE A 75 114.313 7.448 -5.306 1.00 0.00 H new ATOM 0 HB ILE A 75 115.464 8.996 -6.986 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.861 11.435 -5.571 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.915 10.480 -4.548 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.427 10.380 -7.243 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.012 8.694 -6.851 1.00 0.00 H new ATOM 0 HG23 ILE A 75 112.924 9.948 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.244 11.899 -6.094 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.506 10.175 -6.450 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.435 11.145 -7.488 1.00 0.00 H new ATOM 1184 N GLU A 76 117.142 8.276 -3.940 1.00 0.00 N ATOM 1185 CA GLU A 76 118.546 7.831 -3.749 1.00 0.00 C ATOM 1186 C GLU A 76 118.554 6.338 -3.440 1.00 0.00 C ATOM 1187 O GLU A 76 119.362 5.595 -3.962 1.00 0.00 O ATOM 1188 CB GLU A 76 119.180 8.595 -2.587 1.00 0.00 C ATOM 1189 CG GLU A 76 120.679 8.766 -2.844 1.00 0.00 C ATOM 1190 CD GLU A 76 121.287 9.651 -1.755 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.530 10.174 -0.954 1.00 0.00 O ATOM 1192 OE2 GLU A 76 122.499 9.791 -1.741 1.00 0.00 O ATOM 0 H GLU A 76 116.821 8.994 -3.290 1.00 0.00 H new ATOM 0 HA GLU A 76 119.117 8.026 -4.656 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.706 9.570 -2.478 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.020 8.056 -1.653 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.170 7.793 -2.853 1.00 0.00 H new ATOM 0 HG3 GLU A 76 120.842 9.214 -3.824 1.00 0.00 H new ATOM 1199 N PHE A 77 117.664 5.879 -2.597 1.00 0.00 N ATOM 1200 CA PHE A 77 117.655 4.428 -2.285 1.00 0.00 C ATOM 1201 C PHE A 77 117.203 3.649 -3.518 1.00 0.00 C ATOM 1202 O PHE A 77 117.932 2.825 -4.028 1.00 0.00 O ATOM 1203 CB PHE A 77 116.712 4.147 -1.111 1.00 0.00 C ATOM 1204 CG PHE A 77 115.411 3.566 -1.616 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.343 2.220 -1.998 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.273 4.375 -1.705 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.137 1.686 -2.466 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.069 3.841 -2.173 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.000 2.496 -2.554 1.00 0.00 C ATOM 0 H PHE A 77 116.957 6.439 -2.121 1.00 0.00 H new ATOM 0 HA PHE A 77 118.660 4.113 -2.006 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.183 3.453 -0.415 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.519 5.068 -0.561 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.221 1.595 -1.931 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.325 5.413 -1.412 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.084 0.648 -2.759 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.191 4.467 -2.241 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.070 2.084 -2.916 1.00 0.00 H new ATOM 1219 N PHE A 78 116.015 3.891 -4.020 1.00 0.00 N ATOM 1220 CA PHE A 78 115.584 3.119 -5.220 1.00 0.00 C ATOM 1221 C PHE A 78 116.545 3.385 -6.380 1.00 0.00 C ATOM 1222 O PHE A 78 116.939 2.485 -7.086 1.00 0.00 O ATOM 1223 CB PHE A 78 114.169 3.519 -5.635 1.00 0.00 C ATOM 1224 CG PHE A 78 113.638 2.530 -6.661 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.943 1.159 -6.561 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.836 2.984 -7.716 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.447 0.258 -7.511 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.341 2.078 -8.664 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.647 0.717 -8.561 1.00 0.00 C ATOM 0 H PHE A 78 115.344 4.570 -3.661 1.00 0.00 H new ATOM 0 HA PHE A 78 115.594 2.058 -4.970 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.516 3.539 -4.763 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.173 4.525 -6.054 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.561 0.802 -5.750 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.599 4.034 -7.799 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.683 -0.793 -7.432 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.722 2.431 -9.476 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.265 0.021 -9.293 1.00 0.00 H new ATOM 1239 N ASN A 79 116.922 4.611 -6.585 1.00 0.00 N ATOM 1240 CA ASN A 79 117.854 4.924 -7.705 1.00 0.00 C ATOM 1241 C ASN A 79 119.071 4.010 -7.622 1.00 0.00 C ATOM 1242 O ASN A 79 119.490 3.426 -8.601 1.00 0.00 O ATOM 1243 CB ASN A 79 118.316 6.379 -7.605 1.00 0.00 C ATOM 1244 CG ASN A 79 119.344 6.664 -8.701 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.917 7.735 -8.749 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.603 5.745 -9.591 1.00 0.00 N ATOM 0 H ASN A 79 116.627 5.413 -6.027 1.00 0.00 H new ATOM 0 HA ASN A 79 117.337 4.770 -8.652 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.463 7.050 -7.708 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.753 6.566 -6.624 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.286 5.926 -10.327 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.122 4.846 -9.551 1.00 0.00 H new ATOM 1253 N LYS A 80 119.646 3.881 -6.463 1.00 0.00 N ATOM 1254 CA LYS A 80 120.834 3.003 -6.328 1.00 0.00 C ATOM 1255 C LYS A 80 120.399 1.547 -6.488 1.00 0.00 C ATOM 1256 O LYS A 80 121.116 0.733 -7.034 1.00 0.00 O ATOM 1257 CB LYS A 80 121.467 3.209 -4.952 1.00 0.00 C ATOM 1258 CG LYS A 80 122.374 4.443 -4.991 1.00 0.00 C ATOM 1259 CD LYS A 80 123.745 4.062 -5.556 1.00 0.00 C ATOM 1260 CE LYS A 80 124.401 3.024 -4.646 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.863 3.295 -4.554 1.00 0.00 N ATOM 0 H LYS A 80 119.345 4.345 -5.606 1.00 0.00 H new ATOM 0 HA LYS A 80 121.566 3.250 -7.097 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.691 3.338 -4.198 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.044 2.328 -4.669 1.00 0.00 H new ATOM 0 HG2 LYS A 80 121.920 5.220 -5.606 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.486 4.855 -3.988 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.636 3.661 -6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.378 4.946 -5.632 1.00 0.00 H new ATOM 0 HE2 LYS A 80 123.951 3.059 -3.654 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.230 2.021 -5.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.309 2.588 -3.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.287 3.241 -5.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.016 4.246 -4.161 1.00 0.00 H new ATOM 1275 N LEU A 81 119.230 1.208 -6.016 1.00 0.00 N ATOM 1276 CA LEU A 81 118.762 -0.200 -6.148 1.00 0.00 C ATOM 1277 C LEU A 81 118.488 -0.529 -7.622 1.00 0.00 C ATOM 1278 O LEU A 81 119.010 -1.479 -8.158 1.00 0.00 O ATOM 1279 CB LEU A 81 117.469 -0.394 -5.340 1.00 0.00 C ATOM 1280 CG LEU A 81 117.699 -0.113 -3.847 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.785 -1.020 -3.022 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.161 -0.377 -3.460 1.00 0.00 C ATOM 0 H LEU A 81 118.582 1.842 -5.547 1.00 0.00 H new ATOM 0 HA LEU A 81 119.538 -0.865 -5.768 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.695 0.271 -5.723 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.106 -1.414 -5.469 1.00 0.00 H new ATOM 0 HG LEU A 81 117.473 0.934 -3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.942 -0.827 -1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.745 -0.818 -3.277 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.016 -2.063 -3.239 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.299 -0.171 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.409 -1.419 -3.663 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.815 0.271 -4.043 1.00 0.00 H new ATOM 1294 N VAL A 82 117.669 0.235 -8.283 1.00 0.00 N ATOM 1295 CA VAL A 82 117.364 -0.070 -9.708 1.00 0.00 C ATOM 1296 C VAL A 82 118.640 -0.011 -10.563 1.00 0.00 C ATOM 1297 O VAL A 82 118.881 -0.874 -11.378 1.00 0.00 O ATOM 1298 CB VAL A 82 116.334 0.937 -10.222 1.00 0.00 C ATOM 1299 CG1 VAL A 82 116.805 2.361 -9.908 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.150 0.763 -11.736 1.00 0.00 C ATOM 0 H VAL A 82 117.198 1.055 -7.901 1.00 0.00 H new ATOM 0 HA VAL A 82 116.959 -1.079 -9.781 1.00 0.00 H new ATOM 0 HB VAL A 82 115.378 0.762 -9.728 1.00 0.00 H new ATOM 0 HG11 VAL A 82 116.070 3.077 -10.275 1.00 0.00 H new ATOM 0 HG12 VAL A 82 116.918 2.477 -8.830 1.00 0.00 H new ATOM 0 HG13 VAL A 82 117.763 2.543 -10.395 1.00 0.00 H new ATOM 0 HG21 VAL A 82 115.415 1.482 -12.098 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.102 0.931 -12.240 1.00 0.00 H new ATOM 0 HG23 VAL A 82 115.802 -0.248 -11.946 1.00 0.00 H new ATOM 1310 N THR A 83 119.448 0.999 -10.414 1.00 0.00 N ATOM 1311 CA THR A 83 120.681 1.085 -11.252 1.00 0.00 C ATOM 1312 C THR A 83 121.801 0.184 -10.700 1.00 0.00 C ATOM 1313 O THR A 83 122.464 -0.513 -11.443 1.00 0.00 O ATOM 1314 CB THR A 83 121.164 2.536 -11.292 1.00 0.00 C ATOM 1315 OG1 THR A 83 121.938 2.743 -12.465 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.015 2.824 -10.060 1.00 0.00 C ATOM 0 H THR A 83 119.313 1.765 -9.754 1.00 0.00 H new ATOM 0 HA THR A 83 120.436 0.741 -12.257 1.00 0.00 H new ATOM 0 HB THR A 83 120.304 3.206 -11.301 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.247 3.673 -12.493 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.359 3.858 -10.089 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.419 2.665 -9.161 1.00 0.00 H new ATOM 0 HG23 THR A 83 122.876 2.156 -10.048 1.00 0.00 H new ATOM 1324 N SER A 84 122.046 0.218 -9.417 1.00 0.00 N ATOM 1325 CA SER A 84 123.155 -0.609 -8.839 1.00 0.00 C ATOM 1326 C SER A 84 122.763 -2.087 -8.714 1.00 0.00 C ATOM 1327 O SER A 84 123.614 -2.951 -8.634 1.00 0.00 O ATOM 1328 CB SER A 84 123.509 -0.076 -7.450 1.00 0.00 C ATOM 1329 OG SER A 84 123.275 1.325 -7.410 1.00 0.00 O ATOM 0 H SER A 84 121.529 0.781 -8.742 1.00 0.00 H new ATOM 0 HA SER A 84 124.008 -0.538 -9.514 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.909 -0.578 -6.691 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.553 -0.288 -7.222 1.00 0.00 H new ATOM 0 HG SER A 84 124.089 1.800 -7.679 1.00 0.00 H new ATOM 1335 N PHE A 85 121.499 -2.393 -8.656 1.00 0.00 N ATOM 1336 CA PHE A 85 121.093 -3.822 -8.491 1.00 0.00 C ATOM 1337 C PHE A 85 121.429 -4.655 -9.736 1.00 0.00 C ATOM 1338 O PHE A 85 121.070 -5.808 -9.823 1.00 0.00 O ATOM 1339 CB PHE A 85 119.594 -3.909 -8.193 1.00 0.00 C ATOM 1340 CG PHE A 85 118.790 -3.804 -9.471 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.331 -3.208 -10.620 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.502 -4.338 -9.509 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.580 -3.153 -11.799 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.750 -4.278 -10.686 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.291 -3.687 -11.833 1.00 0.00 C ATOM 0 H PHE A 85 120.731 -1.724 -8.715 1.00 0.00 H new ATOM 0 HA PHE A 85 121.656 -4.233 -7.653 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.371 -4.852 -7.693 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.307 -3.110 -7.509 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.327 -2.792 -10.594 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.084 -4.799 -8.626 1.00 0.00 H new ATOM 0 HE1 PHE A 85 118.998 -2.697 -12.684 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.751 -4.688 -10.710 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.712 -3.644 -12.744 1.00 0.00 H new ATOM 1355 N ASP A 86 122.102 -4.101 -10.707 1.00 0.00 N ATOM 1356 CA ASP A 86 122.425 -4.919 -11.912 1.00 0.00 C ATOM 1357 C ASP A 86 123.754 -5.643 -11.695 1.00 0.00 C ATOM 1358 O ASP A 86 124.327 -6.208 -12.605 1.00 0.00 O ATOM 1359 CB ASP A 86 122.504 -4.035 -13.153 1.00 0.00 C ATOM 1360 CG ASP A 86 123.418 -2.840 -12.879 1.00 0.00 C ATOM 1361 OD1 ASP A 86 124.307 -2.976 -12.054 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.214 -1.809 -13.498 1.00 0.00 O ATOM 0 H ASP A 86 122.437 -3.138 -10.721 1.00 0.00 H new ATOM 0 HA ASP A 86 121.634 -5.653 -12.065 1.00 0.00 H new ATOM 0 HB2 ASP A 86 122.885 -4.610 -13.997 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.508 -3.688 -13.428 1.00 0.00 H new ATOM 1367 N PHE A 87 124.226 -5.653 -10.481 1.00 0.00 N ATOM 1368 CA PHE A 87 125.496 -6.364 -10.166 1.00 0.00 C ATOM 1369 C PHE A 87 125.295 -7.102 -8.844 1.00 0.00 C ATOM 1370 O PHE A 87 125.086 -8.299 -8.812 1.00 0.00 O ATOM 1371 CB PHE A 87 126.656 -5.355 -10.048 1.00 0.00 C ATOM 1372 CG PHE A 87 127.479 -5.641 -8.806 1.00 0.00 C ATOM 1373 CD1 PHE A 87 127.825 -6.958 -8.475 1.00 0.00 C ATOM 1374 CD2 PHE A 87 127.879 -4.588 -7.970 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.559 -7.216 -7.319 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.623 -4.853 -6.815 1.00 0.00 C ATOM 1377 CZ PHE A 87 128.960 -6.170 -6.491 1.00 0.00 C ATOM 0 H PHE A 87 123.782 -5.195 -9.685 1.00 0.00 H new ATOM 0 HA PHE A 87 125.748 -7.068 -10.959 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.289 -5.413 -10.933 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.261 -4.340 -10.005 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.523 -7.773 -9.116 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.612 -3.571 -8.218 1.00 0.00 H new ATOM 0 HE1 PHE A 87 128.818 -8.233 -7.064 1.00 0.00 H new ATOM 0 HE2 PHE A 87 128.936 -4.041 -6.175 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.532 -6.377 -5.598 1.00 0.00 H new ATOM 1387 N ASP A 88 125.349 -6.394 -7.752 1.00 0.00 N ATOM 1388 CA ASP A 88 125.151 -7.044 -6.431 1.00 0.00 C ATOM 1389 C ASP A 88 123.681 -6.934 -6.039 1.00 0.00 C ATOM 1390 O ASP A 88 123.270 -5.999 -5.383 1.00 0.00 O ATOM 1391 CB ASP A 88 126.001 -6.338 -5.381 1.00 0.00 C ATOM 1392 CG ASP A 88 126.088 -4.849 -5.718 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.328 -4.407 -6.564 1.00 0.00 O ATOM 1394 OD2 ASP A 88 126.910 -4.175 -5.124 1.00 0.00 O ATOM 0 H ASP A 88 125.522 -5.389 -7.719 1.00 0.00 H new ATOM 0 HA ASP A 88 125.445 -8.092 -6.492 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.564 -6.474 -4.392 1.00 0.00 H new ATOM 0 HB3 ASP A 88 126.999 -6.775 -5.351 1.00 0.00 H new ATOM 1399 N LEU A 89 122.886 -7.879 -6.439 1.00 0.00 N ATOM 1400 CA LEU A 89 121.446 -7.828 -6.097 1.00 0.00 C ATOM 1401 C LEU A 89 121.294 -7.910 -4.582 1.00 0.00 C ATOM 1402 O LEU A 89 120.679 -7.071 -3.963 1.00 0.00 O ATOM 1403 CB LEU A 89 120.722 -9.007 -6.750 1.00 0.00 C ATOM 1404 CG LEU A 89 121.210 -9.218 -8.194 1.00 0.00 C ATOM 1405 CD1 LEU A 89 121.854 -7.948 -8.759 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.235 -10.346 -8.235 1.00 0.00 C ATOM 0 H LEU A 89 123.173 -8.688 -6.990 1.00 0.00 H new ATOM 0 HA LEU A 89 121.013 -6.896 -6.461 1.00 0.00 H new ATOM 0 HB2 LEU A 89 120.894 -9.912 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.647 -8.826 -6.748 1.00 0.00 H new ATOM 0 HG LEU A 89 120.341 -9.471 -8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.187 -8.132 -9.780 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.125 -7.138 -8.756 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.709 -7.669 -8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.576 -10.490 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.085 -10.089 -7.602 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.778 -11.266 -7.872 1.00 0.00 H new ATOM 1418 N GLU A 90 121.848 -8.921 -3.980 1.00 0.00 N ATOM 1419 CA GLU A 90 121.726 -9.062 -2.504 1.00 0.00 C ATOM 1420 C GLU A 90 122.666 -8.082 -1.784 1.00 0.00 C ATOM 1421 O GLU A 90 122.293 -7.447 -0.815 1.00 0.00 O ATOM 1422 CB GLU A 90 122.086 -10.498 -2.106 1.00 0.00 C ATOM 1423 CG GLU A 90 121.966 -11.411 -3.326 1.00 0.00 C ATOM 1424 CD GLU A 90 122.157 -12.867 -2.895 1.00 0.00 C ATOM 1425 OE1 GLU A 90 122.919 -13.095 -1.970 1.00 0.00 O ATOM 1426 OE2 GLU A 90 121.536 -13.728 -3.497 1.00 0.00 O ATOM 0 H GLU A 90 122.380 -9.656 -4.445 1.00 0.00 H new ATOM 0 HA GLU A 90 120.700 -8.836 -2.212 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.101 -10.533 -1.711 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.423 -10.844 -1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 90 120.990 -11.284 -3.794 1.00 0.00 H new ATOM 0 HG3 GLU A 90 122.714 -11.140 -4.071 1.00 0.00 H new ATOM 1433 N ILE A 91 123.888 -7.972 -2.229 1.00 0.00 N ATOM 1434 CA ILE A 91 124.855 -7.061 -1.543 1.00 0.00 C ATOM 1435 C ILE A 91 124.631 -5.600 -1.951 1.00 0.00 C ATOM 1436 O ILE A 91 124.869 -4.694 -1.178 1.00 0.00 O ATOM 1437 CB ILE A 91 126.279 -7.481 -1.913 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.263 -8.939 -2.383 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.197 -7.342 -0.696 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.669 -9.529 -2.289 1.00 0.00 C ATOM 0 H ILE A 91 124.260 -8.472 -3.036 1.00 0.00 H new ATOM 0 HA ILE A 91 124.701 -7.138 -0.467 1.00 0.00 H new ATOM 0 HB ILE A 91 126.652 -6.840 -2.711 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.573 -9.520 -1.771 1.00 0.00 H new ATOM 0 HG13 ILE A 91 125.903 -8.996 -3.410 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.209 -7.643 -0.967 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.204 -6.304 -0.362 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.833 -7.980 0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.652 -10.566 -2.624 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.347 -8.955 -2.920 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.013 -9.488 -1.255 1.00 0.00 H new ATOM 1452 N GLY A 92 124.200 -5.356 -3.153 1.00 0.00 N ATOM 1453 CA GLY A 92 123.992 -3.944 -3.592 1.00 0.00 C ATOM 1454 C GLY A 92 123.013 -3.237 -2.650 1.00 0.00 C ATOM 1455 O GLY A 92 123.292 -2.173 -2.133 1.00 0.00 O ATOM 0 H GLY A 92 123.982 -6.067 -3.851 1.00 0.00 H new ATOM 0 HA2 GLY A 92 124.945 -3.415 -3.603 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.606 -3.925 -4.611 1.00 0.00 H new ATOM 1459 N LYS A 93 121.864 -3.811 -2.438 1.00 0.00 N ATOM 1460 CA LYS A 93 120.856 -3.167 -1.544 1.00 0.00 C ATOM 1461 C LYS A 93 121.238 -3.344 -0.069 1.00 0.00 C ATOM 1462 O LYS A 93 120.724 -2.660 0.796 1.00 0.00 O ATOM 1463 CB LYS A 93 119.472 -3.790 -1.784 1.00 0.00 C ATOM 1464 CG LYS A 93 119.594 -5.274 -2.161 1.00 0.00 C ATOM 1465 CD LYS A 93 118.783 -5.537 -3.433 1.00 0.00 C ATOM 1466 CE LYS A 93 119.533 -4.984 -4.648 1.00 0.00 C ATOM 1467 NZ LYS A 93 118.911 -3.698 -5.073 1.00 0.00 N ATOM 0 H LYS A 93 121.576 -4.701 -2.845 1.00 0.00 H new ATOM 0 HA LYS A 93 120.830 -2.102 -1.775 1.00 0.00 H new ATOM 0 HB2 LYS A 93 118.863 -3.688 -0.886 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.959 -3.250 -2.580 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.640 -5.536 -2.321 1.00 0.00 H new ATOM 0 HG3 LYS A 93 119.229 -5.900 -1.347 1.00 0.00 H new ATOM 0 HD2 LYS A 93 118.615 -6.607 -3.554 1.00 0.00 H new ATOM 0 HD3 LYS A 93 117.803 -5.067 -3.354 1.00 0.00 H new ATOM 0 HE2 LYS A 93 120.583 -4.828 -4.401 1.00 0.00 H new ATOM 0 HE3 LYS A 93 119.502 -5.703 -5.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 119.657 -3.020 -5.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 118.297 -3.865 -5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 118.345 -3.311 -4.291 1.00 0.00 H new ATOM 1481 N GLY A 94 122.116 -4.261 0.233 1.00 0.00 N ATOM 1482 CA GLY A 94 122.496 -4.485 1.661 1.00 0.00 C ATOM 1483 C GLY A 94 123.269 -3.283 2.234 1.00 0.00 C ATOM 1484 O GLY A 94 122.924 -2.762 3.275 1.00 0.00 O ATOM 0 H GLY A 94 122.586 -4.864 -0.442 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.598 -4.658 2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.108 -5.383 1.739 1.00 0.00 H new ATOM 1488 N GLU A 95 124.320 -2.849 1.585 1.00 0.00 N ATOM 1489 CA GLU A 95 125.109 -1.695 2.128 1.00 0.00 C ATOM 1490 C GLU A 95 124.452 -0.371 1.732 1.00 0.00 C ATOM 1491 O GLU A 95 124.377 0.559 2.514 1.00 0.00 O ATOM 1492 CB GLU A 95 126.538 -1.742 1.565 1.00 0.00 C ATOM 1493 CG GLU A 95 127.129 -0.324 1.501 1.00 0.00 C ATOM 1494 CD GLU A 95 126.631 0.379 0.237 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.358 -0.310 -0.732 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.531 1.595 0.259 1.00 0.00 O ATOM 0 H GLU A 95 124.666 -3.239 0.708 1.00 0.00 H new ATOM 0 HA GLU A 95 125.137 -1.767 3.215 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.163 -2.377 2.193 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.530 -2.186 0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.837 0.243 2.385 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.218 -0.372 1.498 1.00 0.00 H new ATOM 1503 N THR A 96 123.993 -0.269 0.519 1.00 0.00 N ATOM 1504 CA THR A 96 123.365 1.001 0.072 1.00 0.00 C ATOM 1505 C THR A 96 122.319 1.458 1.091 1.00 0.00 C ATOM 1506 O THR A 96 122.302 2.602 1.506 1.00 0.00 O ATOM 1507 CB THR A 96 122.707 0.792 -1.290 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.049 -0.464 -1.304 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.781 0.822 -2.377 1.00 0.00 C ATOM 0 H THR A 96 124.026 -1.010 -0.182 1.00 0.00 H new ATOM 0 HA THR A 96 124.133 1.770 -0.011 1.00 0.00 H new ATOM 0 HB THR A 96 121.981 1.583 -1.475 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.523 -1.075 -1.907 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.316 0.673 -3.352 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.289 1.786 -2.360 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.505 0.028 -2.195 1.00 0.00 H new ATOM 1517 N MET A 97 121.452 0.576 1.503 1.00 0.00 N ATOM 1518 CA MET A 97 120.411 0.965 2.497 1.00 0.00 C ATOM 1519 C MET A 97 121.086 1.609 3.710 1.00 0.00 C ATOM 1520 O MET A 97 120.481 2.362 4.455 1.00 0.00 O ATOM 1521 CB MET A 97 119.663 -0.292 2.944 1.00 0.00 C ATOM 1522 CG MET A 97 120.538 -1.087 3.915 1.00 0.00 C ATOM 1523 SD MET A 97 120.390 -0.389 5.579 1.00 0.00 S ATOM 1524 CE MET A 97 119.808 -1.890 6.405 1.00 0.00 C ATOM 0 H MET A 97 121.418 -0.396 1.196 1.00 0.00 H new ATOM 0 HA MET A 97 119.715 1.674 2.049 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.724 -0.018 3.425 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.411 -0.905 2.079 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.234 -2.134 3.921 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.578 -1.059 3.589 1.00 0.00 H new ATOM 0 HE1 MET A 97 119.530 -1.655 7.433 1.00 0.00 H new ATOM 0 HE2 MET A 97 118.941 -2.284 5.875 1.00 0.00 H new ATOM 0 HE3 MET A 97 120.602 -2.636 6.405 1.00 0.00 H new ATOM 1534 N LYS A 98 122.335 1.304 3.917 1.00 0.00 N ATOM 1535 CA LYS A 98 123.064 1.867 5.085 1.00 0.00 C ATOM 1536 C LYS A 98 123.433 3.331 4.844 1.00 0.00 C ATOM 1537 O LYS A 98 123.315 4.154 5.729 1.00 0.00 O ATOM 1538 CB LYS A 98 124.345 1.060 5.307 1.00 0.00 C ATOM 1539 CG LYS A 98 124.499 0.733 6.794 1.00 0.00 C ATOM 1540 CD LYS A 98 125.808 -0.027 7.018 1.00 0.00 C ATOM 1541 CE LYS A 98 125.538 -1.532 6.989 1.00 0.00 C ATOM 1542 NZ LYS A 98 126.811 -2.260 6.724 1.00 0.00 N ATOM 0 H LYS A 98 122.886 0.684 3.323 1.00 0.00 H new ATOM 0 HA LYS A 98 122.418 1.810 5.961 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.312 0.140 4.724 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.208 1.627 4.958 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.494 1.651 7.381 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.655 0.133 7.134 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.531 0.238 6.246 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.245 0.256 7.975 1.00 0.00 H new ATOM 0 HE2 LYS A 98 125.113 -1.854 7.940 1.00 0.00 H new ATOM 0 HE3 LYS A 98 124.805 -1.766 6.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 126.633 -3.042 6.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 127.505 -1.606 6.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 127.185 -2.641 7.616 1.00 0.00 H new ATOM 1556 N TYR A 99 123.903 3.673 3.676 1.00 0.00 N ATOM 1557 CA TYR A 99 124.291 5.094 3.451 1.00 0.00 C ATOM 1558 C TYR A 99 123.058 5.998 3.515 1.00 0.00 C ATOM 1559 O TYR A 99 123.158 7.146 3.902 1.00 0.00 O ATOM 1560 CB TYR A 99 125.024 5.252 2.111 1.00 0.00 C ATOM 1561 CG TYR A 99 124.047 5.364 0.971 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.278 6.519 0.804 1.00 0.00 C ATOM 1563 CD2 TYR A 99 123.929 4.308 0.069 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.384 6.612 -0.270 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.038 4.396 -1.005 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.264 5.550 -1.175 1.00 0.00 C ATOM 1567 OH TYR A 99 121.383 5.641 -2.232 1.00 0.00 O ATOM 0 H TYR A 99 124.033 3.045 2.883 1.00 0.00 H new ATOM 0 HA TYR A 99 124.977 5.397 4.243 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.657 6.139 2.141 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.681 4.397 1.949 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.373 7.338 1.502 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.528 3.419 0.200 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.787 7.503 -0.400 1.00 0.00 H new ATOM 0 HE2 TYR A 99 122.947 3.576 -1.702 1.00 0.00 H new ATOM 0 HH TYR A 99 121.057 4.746 -2.464 1.00 0.00 H new ATOM 1577 N ILE A 100 121.891 5.508 3.172 1.00 0.00 N ATOM 1578 CA ILE A 100 120.690 6.391 3.263 1.00 0.00 C ATOM 1579 C ILE A 100 120.387 6.650 4.737 1.00 0.00 C ATOM 1580 O ILE A 100 120.291 7.781 5.172 1.00 0.00 O ATOM 1581 CB ILE A 100 119.472 5.730 2.614 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.704 5.579 1.110 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.243 6.614 2.846 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.625 4.387 0.855 1.00 0.00 C ATOM 0 H ILE A 100 121.721 4.558 2.841 1.00 0.00 H new ATOM 0 HA ILE A 100 120.898 7.324 2.738 1.00 0.00 H new ATOM 0 HB ILE A 100 119.315 4.746 3.055 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.753 5.434 0.597 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.148 6.489 0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.370 6.151 2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.073 6.727 3.917 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.410 7.594 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.791 4.278 -0.217 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.579 4.551 1.355 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.162 3.480 1.244 1.00 0.00 H new ATOM 1596 N LEU A 101 120.245 5.610 5.516 1.00 0.00 N ATOM 1597 CA LEU A 101 119.960 5.808 6.967 1.00 0.00 C ATOM 1598 C LEU A 101 121.203 6.377 7.640 1.00 0.00 C ATOM 1599 O LEU A 101 121.165 7.425 8.255 1.00 0.00 O ATOM 1600 CB LEU A 101 119.606 4.462 7.603 1.00 0.00 C ATOM 1601 CG LEU A 101 118.202 4.533 8.197 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.739 3.127 8.584 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.219 5.433 9.437 1.00 0.00 C ATOM 0 H LEU A 101 120.313 4.639 5.213 1.00 0.00 H new ATOM 0 HA LEU A 101 119.124 6.497 7.091 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.657 3.670 6.856 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.329 4.214 8.380 1.00 0.00 H new ATOM 0 HG LEU A 101 117.514 4.947 7.460 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.736 3.178 9.008 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.727 2.491 7.699 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.424 2.708 9.321 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.217 5.485 9.863 1.00 0.00 H new ATOM 0 HD22 LEU A 101 118.906 5.021 10.176 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.546 6.434 9.156 1.00 0.00 H new ATOM 1615 N ALA A 102 122.310 5.704 7.518 1.00 0.00 N ATOM 1616 CA ALA A 102 123.553 6.219 8.140 1.00 0.00 C ATOM 1617 C ALA A 102 123.737 7.674 7.716 1.00 0.00 C ATOM 1618 O ALA A 102 123.346 8.587 8.415 1.00 0.00 O ATOM 1619 CB ALA A 102 124.749 5.391 7.666 1.00 0.00 C ATOM 0 H ALA A 102 122.406 4.822 7.015 1.00 0.00 H new ATOM 0 HA ALA A 102 123.484 6.150 9.226 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.661 5.773 8.125 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.607 4.349 7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.833 5.460 6.581 1.00 0.00 H new ATOM 1625 N LEU A 103 124.315 7.895 6.566 1.00 0.00 N ATOM 1626 CA LEU A 103 124.518 9.289 6.085 1.00 0.00 C ATOM 1627 C LEU A 103 125.298 10.092 7.129 1.00 0.00 C ATOM 1628 O LEU A 103 125.925 11.082 6.809 1.00 0.00 O ATOM 1629 CB LEU A 103 123.160 9.950 5.840 1.00 0.00 C ATOM 1630 CG LEU A 103 123.366 11.415 5.451 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.342 11.500 4.276 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.024 12.026 5.042 1.00 0.00 C ATOM 0 H LEU A 103 124.656 7.167 5.938 1.00 0.00 H new ATOM 0 HA LEU A 103 125.085 9.267 5.154 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.626 9.425 5.048 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.545 9.884 6.737 1.00 0.00 H new ATOM 0 HG LEU A 103 123.773 11.962 6.301 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.488 12.544 3.999 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.298 11.064 4.565 1.00 0.00 H new ATOM 0 HD13 LEU A 103 123.936 10.953 3.425 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.169 13.070 4.764 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.619 11.478 4.192 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.327 11.966 5.878 1.00 0.00 H new ATOM 1644 N LYS A 104 125.268 9.677 8.372 1.00 0.00 N ATOM 1645 CA LYS A 104 126.017 10.424 9.426 1.00 0.00 C ATOM 1646 C LYS A 104 127.216 11.111 8.774 1.00 0.00 C ATOM 1647 O LYS A 104 127.504 12.264 9.028 1.00 0.00 O ATOM 1648 CB LYS A 104 126.510 9.442 10.494 1.00 0.00 C ATOM 1649 CG LYS A 104 126.559 10.122 11.867 1.00 0.00 C ATOM 1650 CD LYS A 104 125.653 9.374 12.848 1.00 0.00 C ATOM 1651 CE LYS A 104 124.224 9.331 12.299 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.260 9.585 13.406 1.00 0.00 N ATOM 0 H LYS A 104 124.759 8.856 8.700 1.00 0.00 H new ATOM 0 HA LYS A 104 125.369 11.165 9.893 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.849 8.577 10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.501 9.074 10.228 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.583 10.135 12.241 1.00 0.00 H new ATOM 0 HG3 LYS A 104 126.238 11.160 11.781 1.00 0.00 H new ATOM 0 HD2 LYS A 104 126.025 8.361 13.002 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.665 9.869 13.819 1.00 0.00 H new ATOM 0 HE2 LYS A 104 124.101 10.079 11.516 1.00 0.00 H new ATOM 0 HE3 LYS A 104 124.026 8.360 11.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.289 9.556 13.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 123.372 8.855 14.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.445 10.521 13.819 1.00 0.00 H new ATOM 1666 N ASP A 105 127.902 10.408 7.915 1.00 0.00 N ATOM 1667 CA ASP A 105 129.070 11.010 7.215 1.00 0.00 C ATOM 1668 C ASP A 105 128.838 10.899 5.705 1.00 0.00 C ATOM 1669 O ASP A 105 128.319 11.803 5.083 1.00 0.00 O ATOM 1670 CB ASP A 105 130.347 10.258 7.607 1.00 0.00 C ATOM 1671 CG ASP A 105 131.270 11.188 8.399 1.00 0.00 C ATOM 1672 OD1 ASP A 105 131.400 12.335 8.006 1.00 0.00 O ATOM 1673 OD2 ASP A 105 131.830 10.736 9.384 1.00 0.00 O ATOM 0 H ASP A 105 127.702 9.439 7.667 1.00 0.00 H new ATOM 0 HA ASP A 105 129.181 12.057 7.496 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.096 9.383 8.206 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.857 9.898 6.714 1.00 0.00 H new ATOM 1678 N GLN A 106 129.199 9.787 5.120 1.00 0.00 N ATOM 1679 CA GLN A 106 128.984 9.597 3.655 1.00 0.00 C ATOM 1680 C GLN A 106 129.933 8.511 3.133 1.00 0.00 C ATOM 1681 O GLN A 106 129.503 7.455 2.707 1.00 0.00 O ATOM 1682 CB GLN A 106 129.240 10.913 2.907 1.00 0.00 C ATOM 1683 CG GLN A 106 127.905 11.584 2.564 1.00 0.00 C ATOM 1684 CD GLN A 106 127.463 11.156 1.164 1.00 0.00 C ATOM 1685 OE1 GLN A 106 127.306 11.980 0.285 1.00 0.00 O ATOM 1686 NE2 GLN A 106 127.254 9.892 0.917 1.00 0.00 N ATOM 0 H GLN A 106 129.636 8.998 5.597 1.00 0.00 H new ATOM 0 HA GLN A 106 127.952 9.290 3.484 1.00 0.00 H new ATOM 0 HB2 GLN A 106 129.845 11.579 3.522 1.00 0.00 H new ATOM 0 HB3 GLN A 106 129.805 10.720 1.995 1.00 0.00 H new ATOM 0 HG2 GLN A 106 127.147 11.306 3.297 1.00 0.00 H new ATOM 0 HG3 GLN A 106 128.009 12.668 2.608 1.00 0.00 H new ATOM 0 HE21 GLN A 106 127.386 9.200 1.654 1.00 0.00 H new ATOM 0 HE22 GLN A 106 126.959 9.596 -0.014 1.00 0.00 H new ATOM 1695 N PRO A 107 131.214 8.767 3.164 1.00 0.00 N ATOM 1696 CA PRO A 107 132.243 7.796 2.683 1.00 0.00 C ATOM 1697 C PRO A 107 132.289 6.513 3.521 1.00 0.00 C ATOM 1698 O PRO A 107 132.862 5.524 3.113 1.00 0.00 O ATOM 1699 CB PRO A 107 133.565 8.559 2.819 1.00 0.00 C ATOM 1700 CG PRO A 107 133.299 9.631 3.822 1.00 0.00 C ATOM 1701 CD PRO A 107 131.831 10.008 3.658 1.00 0.00 C ATOM 0 HA PRO A 107 132.026 7.466 1.667 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.367 7.900 3.151 1.00 0.00 H new ATOM 0 HB3 PRO A 107 133.875 8.982 1.864 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.500 9.277 4.833 1.00 0.00 H new ATOM 0 HG3 PRO A 107 133.944 10.493 3.652 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.390 10.328 4.602 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.703 10.829 2.952 1.00 0.00 H new ATOM 1709 N GLU A 108 131.700 6.514 4.687 1.00 0.00 N ATOM 1710 CA GLU A 108 131.737 5.281 5.527 1.00 0.00 C ATOM 1711 C GLU A 108 130.789 4.236 4.939 1.00 0.00 C ATOM 1712 O GLU A 108 131.176 3.118 4.646 1.00 0.00 O ATOM 1713 CB GLU A 108 131.310 5.616 6.963 1.00 0.00 C ATOM 1714 CG GLU A 108 130.525 6.928 6.982 1.00 0.00 C ATOM 1715 CD GLU A 108 129.216 6.752 6.211 1.00 0.00 C ATOM 1716 OE1 GLU A 108 128.543 5.762 6.445 1.00 0.00 O ATOM 1717 OE2 GLU A 108 128.911 7.604 5.396 1.00 0.00 O ATOM 0 H GLU A 108 131.200 7.306 5.091 1.00 0.00 H new ATOM 0 HA GLU A 108 132.752 4.884 5.540 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.697 4.810 7.366 1.00 0.00 H new ATOM 0 HB3 GLU A 108 132.189 5.699 7.603 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.317 7.224 8.010 1.00 0.00 H new ATOM 0 HG3 GLU A 108 131.118 7.725 6.535 1.00 0.00 H new ATOM 1724 N ALA A 109 129.554 4.595 4.744 1.00 0.00 N ATOM 1725 CA ALA A 109 128.586 3.633 4.163 1.00 0.00 C ATOM 1726 C ALA A 109 129.074 3.241 2.770 1.00 0.00 C ATOM 1727 O ALA A 109 128.950 2.109 2.344 1.00 0.00 O ATOM 1728 CB ALA A 109 127.212 4.298 4.073 1.00 0.00 C ATOM 0 H ALA A 109 129.174 5.516 4.963 1.00 0.00 H new ATOM 0 HA ALA A 109 128.507 2.743 4.787 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.495 3.596 3.647 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.884 4.591 5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.276 5.182 3.438 1.00 0.00 H new ATOM 1734 N ALA A 110 129.649 4.176 2.067 1.00 0.00 N ATOM 1735 CA ALA A 110 130.173 3.880 0.708 1.00 0.00 C ATOM 1736 C ALA A 110 131.380 2.951 0.835 1.00 0.00 C ATOM 1737 O ALA A 110 131.597 2.087 0.009 1.00 0.00 O ATOM 1738 CB ALA A 110 130.597 5.182 0.026 1.00 0.00 C ATOM 0 H ALA A 110 129.779 5.138 2.379 1.00 0.00 H new ATOM 0 HA ALA A 110 129.398 3.400 0.110 1.00 0.00 H new ATOM 0 HB1 ALA A 110 130.981 4.963 -0.970 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.737 5.847 -0.055 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.375 5.665 0.616 1.00 0.00 H new ATOM 1744 N GLN A 111 132.164 3.110 1.869 1.00 0.00 N ATOM 1745 CA GLN A 111 133.341 2.217 2.036 1.00 0.00 C ATOM 1746 C GLN A 111 132.859 0.777 1.925 1.00 0.00 C ATOM 1747 O GLN A 111 133.375 -0.006 1.148 1.00 0.00 O ATOM 1748 CB GLN A 111 133.986 2.449 3.403 1.00 0.00 C ATOM 1749 CG GLN A 111 134.756 3.772 3.379 1.00 0.00 C ATOM 1750 CD GLN A 111 136.255 3.500 3.531 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.791 2.613 2.897 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.959 4.232 4.350 1.00 0.00 N ATOM 0 H GLN A 111 132.040 3.813 2.597 1.00 0.00 H new ATOM 0 HA GLN A 111 134.085 2.427 1.268 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.221 2.474 4.180 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.660 1.627 3.645 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.565 4.298 2.444 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.411 4.420 4.185 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.510 4.977 4.883 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.959 4.059 4.458 1.00 0.00 H new ATOM 1761 N LEU A 112 131.846 0.423 2.667 1.00 0.00 N ATOM 1762 CA LEU A 112 131.321 -0.957 2.555 1.00 0.00 C ATOM 1763 C LEU A 112 130.997 -1.198 1.085 1.00 0.00 C ATOM 1764 O LEU A 112 131.348 -2.208 0.515 1.00 0.00 O ATOM 1765 CB LEU A 112 130.057 -1.101 3.402 1.00 0.00 C ATOM 1766 CG LEU A 112 130.437 -1.577 4.803 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.994 -3.000 4.732 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.501 -0.647 5.386 1.00 0.00 C ATOM 0 H LEU A 112 131.367 1.025 3.337 1.00 0.00 H new ATOM 0 HA LEU A 112 132.052 -1.682 2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.534 -0.147 3.460 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.373 -1.812 2.937 1.00 0.00 H new ATOM 0 HG LEU A 112 129.551 -1.566 5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.264 -3.336 5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.238 -3.667 4.317 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.878 -3.013 4.094 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.772 -0.986 6.386 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.384 -0.658 4.747 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.106 0.368 5.442 1.00 0.00 H new ATOM 1780 N ALA A 113 130.358 -0.251 0.456 1.00 0.00 N ATOM 1781 CA ALA A 113 130.045 -0.408 -0.987 1.00 0.00 C ATOM 1782 C ALA A 113 131.323 -0.837 -1.711 1.00 0.00 C ATOM 1783 O ALA A 113 131.285 -1.488 -2.735 1.00 0.00 O ATOM 1784 CB ALA A 113 129.552 0.924 -1.557 1.00 0.00 C ATOM 0 H ALA A 113 130.041 0.621 0.879 1.00 0.00 H new ATOM 0 HA ALA A 113 129.265 -1.157 -1.123 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.324 0.804 -2.616 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.654 1.237 -1.025 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.327 1.681 -1.436 1.00 0.00 H new ATOM 1790 N LEU A 114 132.459 -0.473 -1.173 1.00 0.00 N ATOM 1791 CA LEU A 114 133.752 -0.856 -1.812 1.00 0.00 C ATOM 1792 C LEU A 114 133.934 -2.368 -1.692 1.00 0.00 C ATOM 1793 O LEU A 114 134.091 -3.074 -2.680 1.00 0.00 O ATOM 1794 CB LEU A 114 134.906 -0.142 -1.103 1.00 0.00 C ATOM 1795 CG LEU A 114 136.078 0.028 -2.072 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.416 -1.323 -2.707 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.695 1.025 -3.170 1.00 0.00 C ATOM 0 H LEU A 114 132.546 0.074 -0.317 1.00 0.00 H new ATOM 0 HA LEU A 114 133.745 -0.567 -2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.577 0.832 -0.741 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.222 -0.716 -0.232 1.00 0.00 H new ATOM 0 HG LEU A 114 136.945 0.402 -1.528 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.251 -1.202 -3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.690 -2.033 -1.927 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.548 -1.697 -3.250 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.530 1.145 -3.860 1.00 0.00 H new ATOM 0 HD22 LEU A 114 134.827 0.652 -3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.455 1.988 -2.719 1.00 0.00 H new ATOM 1809 N ARG A 115 133.883 -2.892 -0.498 1.00 0.00 N ATOM 1810 CA ARG A 115 134.021 -4.360 -0.375 1.00 0.00 C ATOM 1811 C ARG A 115 132.977 -4.956 -1.309 1.00 0.00 C ATOM 1812 O ARG A 115 133.250 -5.836 -2.093 1.00 0.00 O ATOM 1813 CB ARG A 115 133.788 -4.808 1.073 1.00 0.00 C ATOM 1814 CG ARG A 115 135.098 -4.687 1.851 1.00 0.00 C ATOM 1815 CD ARG A 115 135.435 -3.210 2.060 1.00 0.00 C ATOM 1816 NE ARG A 115 136.693 -3.094 2.850 1.00 0.00 N ATOM 1817 CZ ARG A 115 136.981 -1.977 3.460 1.00 0.00 C ATOM 1818 NH1 ARG A 115 136.167 -0.960 3.376 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.082 -1.877 4.153 1.00 0.00 N ATOM 0 H ARG A 115 133.755 -2.378 0.374 1.00 0.00 H new ATOM 0 HA ARG A 115 135.024 -4.692 -0.642 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.017 -4.193 1.537 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.431 -5.838 1.095 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.009 -5.190 2.814 1.00 0.00 H new ATOM 0 HG3 ARG A 115 135.903 -5.181 1.307 1.00 0.00 H new ATOM 0 HD2 ARG A 115 135.551 -2.713 1.097 1.00 0.00 H new ATOM 0 HD3 ARG A 115 134.619 -2.710 2.581 1.00 0.00 H new ATOM 0 HE ARG A 115 137.330 -3.888 2.914 1.00 0.00 H new ATOM 0 HH11 ARG A 115 135.307 -1.039 2.834 1.00 0.00 H new ATOM 0 HH12 ARG A 115 136.391 -0.086 3.853 1.00 0.00 H new ATOM 0 HH21 ARG A 115 138.718 -2.672 4.218 1.00 0.00 H new ATOM 0 HH22 ARG A 115 138.307 -1.004 4.630 1.00 0.00 H new ATOM 1833 N VAL A 116 131.788 -4.431 -1.293 1.00 0.00 N ATOM 1834 CA VAL A 116 130.775 -4.943 -2.238 1.00 0.00 C ATOM 1835 C VAL A 116 131.455 -4.980 -3.603 1.00 0.00 C ATOM 1836 O VAL A 116 131.204 -5.838 -4.420 1.00 0.00 O ATOM 1837 CB VAL A 116 129.571 -3.994 -2.256 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.057 -3.816 -3.684 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.449 -4.560 -1.379 1.00 0.00 C ATOM 0 H VAL A 116 131.480 -3.680 -0.675 1.00 0.00 H new ATOM 0 HA VAL A 116 130.411 -5.932 -1.958 1.00 0.00 H new ATOM 0 HB VAL A 116 129.886 -3.026 -1.867 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.202 -3.140 -3.681 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.848 -3.398 -4.306 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.753 -4.783 -4.085 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.596 -3.881 -1.396 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.145 -5.534 -1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.807 -4.668 -0.355 1.00 0.00 H new ATOM 1849 N GLY A 117 132.355 -4.063 -3.836 1.00 0.00 N ATOM 1850 CA GLY A 117 133.086 -4.065 -5.126 1.00 0.00 C ATOM 1851 C GLY A 117 133.636 -5.471 -5.346 1.00 0.00 C ATOM 1852 O GLY A 117 133.464 -6.071 -6.401 1.00 0.00 O ATOM 0 H GLY A 117 132.612 -3.317 -3.189 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.421 -3.782 -5.942 1.00 0.00 H new ATOM 0 HA3 GLY A 117 133.896 -3.336 -5.107 1.00 0.00 H new ATOM 1856 N ILE A 118 134.284 -6.027 -4.350 1.00 0.00 N ATOM 1857 CA ILE A 118 134.809 -7.403 -4.541 1.00 0.00 C ATOM 1858 C ILE A 118 133.658 -8.277 -5.016 1.00 0.00 C ATOM 1859 O ILE A 118 133.846 -9.218 -5.761 1.00 0.00 O ATOM 1860 CB ILE A 118 135.452 -7.975 -3.258 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.556 -7.829 -2.015 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.749 -7.216 -2.992 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.138 -8.351 -2.272 1.00 0.00 C ATOM 0 H ILE A 118 134.465 -5.599 -3.442 1.00 0.00 H new ATOM 0 HA ILE A 118 135.606 -7.382 -5.284 1.00 0.00 H new ATOM 0 HB ILE A 118 135.616 -9.039 -3.425 1.00 0.00 H new ATOM 0 HG12 ILE A 118 134.999 -8.374 -1.182 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.510 -6.780 -1.721 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.220 -7.605 -2.089 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.425 -7.344 -3.837 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.530 -6.157 -2.859 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.537 -8.230 -1.371 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.685 -7.788 -3.088 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.182 -9.407 -2.540 1.00 0.00 H new ATOM 1875 N ALA A 119 132.456 -7.963 -4.610 1.00 0.00 N ATOM 1876 CA ALA A 119 131.303 -8.768 -5.067 1.00 0.00 C ATOM 1877 C ALA A 119 131.071 -8.487 -6.547 1.00 0.00 C ATOM 1878 O ALA A 119 130.630 -9.343 -7.281 1.00 0.00 O ATOM 1879 CB ALA A 119 130.055 -8.425 -4.252 1.00 0.00 C ATOM 0 H ALA A 119 132.231 -7.188 -3.986 1.00 0.00 H new ATOM 0 HA ALA A 119 131.513 -9.828 -4.923 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.216 -9.026 -4.601 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.239 -8.636 -3.199 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.820 -7.368 -4.375 1.00 0.00 H new ATOM 1885 N VAL A 120 131.399 -7.314 -7.023 1.00 0.00 N ATOM 1886 CA VAL A 120 131.204 -7.072 -8.475 1.00 0.00 C ATOM 1887 C VAL A 120 131.871 -8.237 -9.172 1.00 0.00 C ATOM 1888 O VAL A 120 131.352 -8.802 -10.114 1.00 0.00 O ATOM 1889 CB VAL A 120 131.854 -5.757 -8.893 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.628 -5.533 -10.387 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.224 -4.611 -8.104 1.00 0.00 C ATOM 0 H VAL A 120 131.782 -6.537 -6.485 1.00 0.00 H new ATOM 0 HA VAL A 120 130.147 -6.997 -8.732 1.00 0.00 H new ATOM 0 HB VAL A 120 132.924 -5.795 -8.690 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.092 -4.594 -10.688 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.073 -6.354 -10.949 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.558 -5.491 -10.591 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.686 -3.669 -8.400 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.155 -4.572 -8.311 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.382 -4.774 -7.038 1.00 0.00 H new ATOM 1901 N ALA A 121 132.989 -8.648 -8.658 1.00 0.00 N ATOM 1902 CA ALA A 121 133.661 -9.840 -9.229 1.00 0.00 C ATOM 1903 C ALA A 121 133.050 -11.066 -8.541 1.00 0.00 C ATOM 1904 O ALA A 121 133.153 -12.183 -9.008 1.00 0.00 O ATOM 1905 CB ALA A 121 135.163 -9.778 -8.945 1.00 0.00 C ATOM 0 H ALA A 121 133.466 -8.212 -7.869 1.00 0.00 H new ATOM 0 HA ALA A 121 133.523 -9.887 -10.309 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.650 -10.657 -9.367 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.582 -8.879 -9.397 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.329 -9.754 -7.868 1.00 0.00 H new ATOM 1911 N LYS A 122 132.416 -10.841 -7.414 1.00 0.00 N ATOM 1912 CA LYS A 122 131.784 -11.953 -6.641 1.00 0.00 C ATOM 1913 C LYS A 122 130.359 -11.550 -6.219 1.00 0.00 C ATOM 1914 O LYS A 122 130.000 -11.646 -5.063 1.00 0.00 O ATOM 1915 CB LYS A 122 132.625 -12.241 -5.395 1.00 0.00 C ATOM 1916 CG LYS A 122 133.691 -13.286 -5.727 1.00 0.00 C ATOM 1917 CD LYS A 122 133.041 -14.669 -5.829 1.00 0.00 C ATOM 1918 CE LYS A 122 133.489 -15.354 -7.122 1.00 0.00 C ATOM 1919 NZ LYS A 122 134.929 -15.723 -7.016 1.00 0.00 N ATOM 0 H LYS A 122 132.309 -9.918 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 122 131.733 -12.846 -7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.097 -11.324 -5.043 1.00 0.00 H new ATOM 0 HB3 LYS A 122 131.987 -12.601 -4.588 1.00 0.00 H new ATOM 0 HG2 LYS A 122 134.182 -13.034 -6.667 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.462 -13.291 -4.956 1.00 0.00 H new ATOM 0 HD2 LYS A 122 133.320 -15.277 -4.968 1.00 0.00 H new ATOM 0 HD3 LYS A 122 131.955 -14.573 -5.814 1.00 0.00 H new ATOM 0 HE2 LYS A 122 132.887 -16.245 -7.302 1.00 0.00 H new ATOM 0 HE3 LYS A 122 133.335 -14.688 -7.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 135.216 -16.248 -7.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 135.503 -14.860 -6.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 135.074 -16.319 -6.176 1.00 0.00 H new ATOM 1933 N SER A 123 129.561 -11.069 -7.136 1.00 0.00 N ATOM 1934 CA SER A 123 128.176 -10.624 -6.780 1.00 0.00 C ATOM 1935 C SER A 123 127.545 -11.587 -5.783 1.00 0.00 C ATOM 1936 O SER A 123 126.537 -11.290 -5.172 1.00 0.00 O ATOM 1937 CB SER A 123 127.314 -10.568 -8.041 1.00 0.00 C ATOM 1938 OG SER A 123 128.150 -10.368 -9.173 1.00 0.00 O ATOM 0 H SER A 123 129.807 -10.964 -8.120 1.00 0.00 H new ATOM 0 HA SER A 123 128.235 -9.634 -6.328 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.749 -11.494 -8.151 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.588 -9.759 -7.963 1.00 0.00 H new ATOM 0 HG SER A 123 128.554 -9.476 -9.128 1.00 0.00 H new ATOM 1944 N ASP A 124 128.121 -12.731 -5.608 1.00 0.00 N ATOM 1945 CA ASP A 124 127.540 -13.701 -4.641 1.00 0.00 C ATOM 1946 C ASP A 124 128.642 -14.615 -4.103 1.00 0.00 C ATOM 1947 O ASP A 124 128.560 -15.824 -4.198 1.00 0.00 O ATOM 1948 CB ASP A 124 126.465 -14.534 -5.345 1.00 0.00 C ATOM 1949 CG ASP A 124 127.130 -15.596 -6.223 1.00 0.00 C ATOM 1950 OD1 ASP A 124 127.950 -15.227 -7.047 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.807 -16.761 -6.056 1.00 0.00 O ATOM 0 H ASP A 124 128.966 -13.042 -6.087 1.00 0.00 H new ATOM 0 HA ASP A 124 127.090 -13.162 -3.807 1.00 0.00 H new ATOM 0 HB2 ASP A 124 125.819 -15.010 -4.607 1.00 0.00 H new ATOM 0 HB3 ASP A 124 125.832 -13.889 -5.954 1.00 0.00 H new ATOM 1956 N GLY A 125 129.676 -14.051 -3.534 1.00 0.00 N ATOM 1957 CA GLY A 125 130.772 -14.904 -2.994 1.00 0.00 C ATOM 1958 C GLY A 125 131.583 -14.134 -1.949 1.00 0.00 C ATOM 1959 O GLY A 125 132.021 -14.694 -0.964 1.00 0.00 O ATOM 0 H GLY A 125 129.807 -13.046 -3.421 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.353 -15.805 -2.546 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.425 -15.225 -3.806 1.00 0.00 H new ATOM 1963 N ASN A 126 131.803 -12.861 -2.153 1.00 0.00 N ATOM 1964 CA ASN A 126 132.603 -12.085 -1.163 1.00 0.00 C ATOM 1965 C ASN A 126 131.717 -11.058 -0.447 1.00 0.00 C ATOM 1966 O ASN A 126 130.530 -10.969 -0.692 1.00 0.00 O ATOM 1967 CB ASN A 126 133.755 -11.382 -1.881 1.00 0.00 C ATOM 1968 CG ASN A 126 134.985 -12.291 -1.883 1.00 0.00 C ATOM 1969 OD1 ASN A 126 136.097 -11.828 -2.041 1.00 0.00 O ATOM 1970 ND2 ASN A 126 134.832 -13.576 -1.712 1.00 0.00 N ATOM 0 H ASN A 126 131.466 -12.330 -2.956 1.00 0.00 H new ATOM 0 HA ASN A 126 133.007 -12.768 -0.415 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.467 -11.140 -2.904 1.00 0.00 H new ATOM 0 HB3 ASN A 126 133.987 -10.440 -1.384 1.00 0.00 H new ATOM 0 HD21 ASN A 126 135.646 -14.191 -1.711 1.00 0.00 H new ATOM 0 HD22 ASN A 126 133.899 -13.965 -1.579 1.00 0.00 H new ATOM 1977 N PHE A 127 132.293 -10.297 0.450 1.00 0.00 N ATOM 1978 CA PHE A 127 131.514 -9.276 1.217 1.00 0.00 C ATOM 1979 C PHE A 127 131.018 -9.888 2.524 1.00 0.00 C ATOM 1980 O PHE A 127 131.079 -11.084 2.728 1.00 0.00 O ATOM 1981 CB PHE A 127 130.312 -8.782 0.409 1.00 0.00 C ATOM 1982 CG PHE A 127 129.945 -7.397 0.891 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.785 -6.322 0.598 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.779 -7.189 1.638 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.464 -5.037 1.048 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.456 -5.901 2.087 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.301 -4.825 1.791 1.00 0.00 C ATOM 0 H PHE A 127 133.284 -10.341 0.687 1.00 0.00 H new ATOM 0 HA PHE A 127 132.170 -8.430 1.422 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.553 -8.761 -0.654 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.468 -9.461 0.532 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.685 -6.482 0.023 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.129 -8.020 1.868 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.117 -4.207 0.820 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.556 -5.739 2.661 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.054 -3.832 2.137 1.00 0.00 H new ATOM 1997 N ASP A 128 130.528 -9.071 3.413 1.00 0.00 N ATOM 1998 CA ASP A 128 130.026 -9.588 4.708 1.00 0.00 C ATOM 1999 C ASP A 128 131.206 -10.081 5.546 1.00 0.00 C ATOM 2000 O ASP A 128 131.060 -10.414 6.703 1.00 0.00 O ATOM 2001 CB ASP A 128 129.045 -10.734 4.451 1.00 0.00 C ATOM 2002 CG ASP A 128 128.410 -10.570 3.069 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.439 -9.838 2.969 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.902 -11.182 2.135 1.00 0.00 O ATOM 0 H ASP A 128 130.455 -8.061 3.294 1.00 0.00 H new ATOM 0 HA ASP A 128 129.511 -8.795 5.250 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.564 -11.690 4.512 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.271 -10.742 5.219 1.00 0.00 H new ATOM 2009 N ASP A 129 132.380 -10.111 4.978 1.00 0.00 N ATOM 2010 CA ASP A 129 133.566 -10.568 5.757 1.00 0.00 C ATOM 2011 C ASP A 129 134.218 -9.354 6.412 1.00 0.00 C ATOM 2012 O ASP A 129 134.633 -9.395 7.553 1.00 0.00 O ATOM 2013 CB ASP A 129 134.567 -11.246 4.819 1.00 0.00 C ATOM 2014 CG ASP A 129 135.293 -10.183 3.992 1.00 0.00 C ATOM 2015 OD1 ASP A 129 134.633 -9.509 3.218 1.00 0.00 O ATOM 2016 OD2 ASP A 129 136.497 -10.060 4.148 1.00 0.00 O ATOM 0 H ASP A 129 132.569 -9.840 4.013 1.00 0.00 H new ATOM 0 HA ASP A 129 133.257 -11.281 6.521 1.00 0.00 H new ATOM 0 HB2 ASP A 129 135.286 -11.827 5.396 1.00 0.00 H new ATOM 0 HB3 ASP A 129 134.049 -11.943 4.160 1.00 0.00 H new ATOM 2021 N ASP A 130 134.298 -8.267 5.698 1.00 0.00 N ATOM 2022 CA ASP A 130 134.906 -7.039 6.273 1.00 0.00 C ATOM 2023 C ASP A 130 133.835 -6.280 7.056 1.00 0.00 C ATOM 2024 O ASP A 130 134.133 -5.441 7.879 1.00 0.00 O ATOM 2025 CB ASP A 130 135.444 -6.155 5.146 1.00 0.00 C ATOM 2026 CG ASP A 130 136.801 -5.575 5.551 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.593 -6.311 6.115 1.00 0.00 O ATOM 2028 OD2 ASP A 130 137.024 -4.405 5.289 1.00 0.00 O ATOM 0 H ASP A 130 133.967 -8.177 4.737 1.00 0.00 H new ATOM 0 HA ASP A 130 135.728 -7.308 6.936 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.545 -6.737 4.230 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.741 -5.349 4.935 1.00 0.00 H new ATOM 2033 N GLU A 131 132.587 -6.568 6.804 1.00 0.00 N ATOM 2034 CA GLU A 131 131.500 -5.858 7.531 1.00 0.00 C ATOM 2035 C GLU A 131 131.795 -5.887 9.028 1.00 0.00 C ATOM 2036 O GLU A 131 131.427 -4.997 9.758 1.00 0.00 O ATOM 2037 CB GLU A 131 130.165 -6.561 7.266 1.00 0.00 C ATOM 2038 CG GLU A 131 129.500 -5.960 6.026 1.00 0.00 C ATOM 2039 CD GLU A 131 128.686 -4.729 6.429 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.802 -4.315 7.571 1.00 0.00 O ATOM 2041 OE2 GLU A 131 127.962 -4.221 5.589 1.00 0.00 O ATOM 0 H GLU A 131 132.275 -7.264 6.127 1.00 0.00 H new ATOM 0 HA GLU A 131 131.443 -4.826 7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.328 -7.629 7.121 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.509 -6.453 8.130 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.257 -5.684 5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 131 128.852 -6.699 5.554 1.00 0.00 H new ATOM 2048 N LYS A 132 132.465 -6.897 9.494 1.00 0.00 N ATOM 2049 CA LYS A 132 132.783 -6.960 10.946 1.00 0.00 C ATOM 2050 C LYS A 132 133.822 -5.886 11.271 1.00 0.00 C ATOM 2051 O LYS A 132 133.648 -5.097 12.179 1.00 0.00 O ATOM 2052 CB LYS A 132 133.324 -8.349 11.275 1.00 0.00 C ATOM 2053 CG LYS A 132 132.615 -9.375 10.385 1.00 0.00 C ATOM 2054 CD LYS A 132 132.241 -10.608 11.205 1.00 0.00 C ATOM 2055 CE LYS A 132 133.498 -11.184 11.850 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.316 -12.646 12.078 1.00 0.00 N ATOM 0 H LYS A 132 132.806 -7.680 8.937 1.00 0.00 H new ATOM 0 HA LYS A 132 131.889 -6.780 11.543 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.401 -8.384 11.109 1.00 0.00 H new ATOM 0 HB3 LYS A 132 133.156 -8.581 12.327 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.719 -8.933 9.949 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.264 -9.662 9.558 1.00 0.00 H new ATOM 0 HD2 LYS A 132 131.514 -10.342 11.972 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.771 -11.355 10.566 1.00 0.00 H new ATOM 0 HE2 LYS A 132 134.361 -11.010 11.208 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.698 -10.680 12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 134.173 -13.038 12.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.502 -12.801 12.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 133.145 -13.121 11.168 1.00 0.00 H new ATOM 2070 N SER A 133 134.887 -5.828 10.520 1.00 0.00 N ATOM 2071 CA SER A 133 135.915 -4.781 10.772 1.00 0.00 C ATOM 2072 C SER A 133 135.416 -3.467 10.169 1.00 0.00 C ATOM 2073 O SER A 133 135.595 -2.397 10.726 1.00 0.00 O ATOM 2074 CB SER A 133 137.234 -5.182 10.110 1.00 0.00 C ATOM 2075 OG SER A 133 137.271 -4.666 8.786 1.00 0.00 O ATOM 0 H SER A 133 135.089 -6.459 9.745 1.00 0.00 H new ATOM 0 HA SER A 133 136.081 -4.667 11.843 1.00 0.00 H new ATOM 0 HB2 SER A 133 138.075 -4.797 10.686 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.330 -6.268 10.092 1.00 0.00 H new ATOM 0 HG SER A 133 137.445 -5.396 8.155 1.00 0.00 H new ATOM 2081 N ALA A 134 134.761 -3.548 9.041 1.00 0.00 N ATOM 2082 CA ALA A 134 134.220 -2.320 8.407 1.00 0.00 C ATOM 2083 C ALA A 134 133.207 -1.718 9.367 1.00 0.00 C ATOM 2084 O ALA A 134 133.200 -0.529 9.618 1.00 0.00 O ATOM 2085 CB ALA A 134 133.537 -2.675 7.084 1.00 0.00 C ATOM 0 H ALA A 134 134.579 -4.414 8.534 1.00 0.00 H new ATOM 0 HA ALA A 134 135.021 -1.610 8.199 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.142 -1.769 6.624 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.261 -3.137 6.413 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.720 -3.372 7.272 1.00 0.00 H new ATOM 2091 N VAL A 135 132.366 -2.540 9.933 1.00 0.00 N ATOM 2092 CA VAL A 135 131.377 -2.017 10.903 1.00 0.00 C ATOM 2093 C VAL A 135 132.143 -1.328 12.033 1.00 0.00 C ATOM 2094 O VAL A 135 131.702 -0.346 12.586 1.00 0.00 O ATOM 2095 CB VAL A 135 130.526 -3.168 11.440 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.818 -2.739 12.726 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.482 -3.538 10.384 1.00 0.00 C ATOM 0 H VAL A 135 132.325 -3.545 9.764 1.00 0.00 H new ATOM 0 HA VAL A 135 130.708 -1.300 10.427 1.00 0.00 H new ATOM 0 HB VAL A 135 131.163 -4.025 11.657 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.214 -3.565 13.102 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.560 -2.462 13.475 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.175 -1.884 12.519 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.867 -4.359 10.753 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.850 -2.674 10.179 1.00 0.00 H new ATOM 0 HG23 VAL A 135 129.985 -3.845 9.467 1.00 0.00 H new ATOM 2107 N ARG A 136 133.306 -1.822 12.366 1.00 0.00 N ATOM 2108 CA ARG A 136 134.104 -1.168 13.441 1.00 0.00 C ATOM 2109 C ARG A 136 134.214 0.322 13.123 1.00 0.00 C ATOM 2110 O ARG A 136 133.916 1.171 13.940 1.00 0.00 O ATOM 2111 CB ARG A 136 135.513 -1.769 13.485 1.00 0.00 C ATOM 2112 CG ARG A 136 136.106 -1.594 14.887 1.00 0.00 C ATOM 2113 CD ARG A 136 135.608 -2.712 15.807 1.00 0.00 C ATOM 2114 NE ARG A 136 136.168 -2.513 17.174 1.00 0.00 N ATOM 2115 CZ ARG A 136 136.304 -3.531 17.978 1.00 0.00 C ATOM 2116 NH1 ARG A 136 135.947 -4.724 17.587 1.00 0.00 N ATOM 2117 NH2 ARG A 136 136.796 -3.357 19.174 1.00 0.00 N ATOM 0 H ARG A 136 133.735 -2.645 11.943 1.00 0.00 H new ATOM 0 HA ARG A 136 133.617 -1.322 14.404 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.476 -2.827 13.225 1.00 0.00 H new ATOM 0 HB3 ARG A 136 136.150 -1.282 12.747 1.00 0.00 H new ATOM 0 HG2 ARG A 136 137.195 -1.611 14.836 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.822 -0.623 15.293 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.519 -2.710 15.844 1.00 0.00 H new ATOM 0 HD3 ARG A 136 135.911 -3.683 15.415 1.00 0.00 H new ATOM 0 HE ARG A 136 136.445 -1.580 17.481 1.00 0.00 H new ATOM 0 HH11 ARG A 136 135.562 -4.860 16.653 1.00 0.00 H new ATOM 0 HH12 ARG A 136 136.053 -5.520 18.216 1.00 0.00 H new ATOM 0 HH21 ARG A 136 137.074 -2.425 19.480 1.00 0.00 H new ATOM 0 HH22 ARG A 136 136.902 -4.153 19.803 1.00 0.00 H new ATOM 2131 N GLU A 137 134.645 0.640 11.933 1.00 0.00 N ATOM 2132 CA GLU A 137 134.786 2.072 11.543 1.00 0.00 C ATOM 2133 C GLU A 137 133.408 2.677 11.252 1.00 0.00 C ATOM 2134 O GLU A 137 133.201 3.863 11.407 1.00 0.00 O ATOM 2135 CB GLU A 137 135.659 2.173 10.290 1.00 0.00 C ATOM 2136 CG GLU A 137 137.135 2.124 10.691 1.00 0.00 C ATOM 2137 CD GLU A 137 137.630 3.539 10.994 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.576 4.368 10.101 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.054 3.769 12.114 1.00 0.00 O ATOM 0 H GLU A 137 134.906 -0.032 11.212 1.00 0.00 H new ATOM 0 HA GLU A 137 135.250 2.620 12.363 1.00 0.00 H new ATOM 0 HB2 GLU A 137 135.429 1.355 9.607 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.446 3.101 9.759 1.00 0.00 H new ATOM 0 HG2 GLU A 137 137.264 1.487 11.566 1.00 0.00 H new ATOM 0 HG3 GLU A 137 137.726 1.685 9.888 1.00 0.00 H new ATOM 2146 N ILE A 138 132.468 1.880 10.818 1.00 0.00 N ATOM 2147 CA ILE A 138 131.116 2.430 10.508 1.00 0.00 C ATOM 2148 C ILE A 138 130.383 2.766 11.814 1.00 0.00 C ATOM 2149 O ILE A 138 129.953 3.880 12.026 1.00 0.00 O ATOM 2150 CB ILE A 138 130.328 1.388 9.693 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.751 2.047 8.436 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.181 0.793 10.521 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.798 2.026 7.319 1.00 0.00 C ATOM 0 H ILE A 138 132.577 0.877 10.665 1.00 0.00 H new ATOM 0 HA ILE A 138 131.208 3.345 9.922 1.00 0.00 H new ATOM 0 HB ILE A 138 131.011 0.585 9.416 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.853 1.519 8.116 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.457 3.074 8.654 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.641 0.060 9.921 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.587 0.307 11.408 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.499 1.588 10.822 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.386 2.495 6.425 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.684 2.573 7.641 1.00 0.00 H new ATOM 0 HD13 ILE A 138 131.070 0.995 7.095 1.00 0.00 H new ATOM 2165 N ALA A 139 130.243 1.815 12.690 1.00 0.00 N ATOM 2166 CA ALA A 139 129.547 2.078 13.977 1.00 0.00 C ATOM 2167 C ALA A 139 130.202 3.271 14.671 1.00 0.00 C ATOM 2168 O ALA A 139 129.537 4.131 15.212 1.00 0.00 O ATOM 2169 CB ALA A 139 129.665 0.842 14.871 1.00 0.00 C ATOM 0 H ALA A 139 130.583 0.861 12.570 1.00 0.00 H new ATOM 0 HA ALA A 139 128.496 2.298 13.790 1.00 0.00 H new ATOM 0 HB1 ALA A 139 129.157 1.027 15.817 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.205 -0.012 14.374 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.717 0.629 15.060 1.00 0.00 H new ATOM 2175 N ARG A 140 131.505 3.326 14.660 1.00 0.00 N ATOM 2176 CA ARG A 140 132.207 4.460 15.320 1.00 0.00 C ATOM 2177 C ARG A 140 132.056 5.722 14.467 1.00 0.00 C ATOM 2178 O ARG A 140 131.660 6.765 14.950 1.00 0.00 O ATOM 2179 CB ARG A 140 133.691 4.118 15.469 1.00 0.00 C ATOM 2180 CG ARG A 140 133.899 3.265 16.724 1.00 0.00 C ATOM 2181 CD ARG A 140 134.404 4.148 17.867 1.00 0.00 C ATOM 2182 NE ARG A 140 135.853 4.434 17.669 1.00 0.00 N ATOM 2183 CZ ARG A 140 136.540 5.009 18.617 1.00 0.00 C ATOM 2184 NH1 ARG A 140 135.957 5.335 19.739 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.809 5.259 18.444 1.00 0.00 N ATOM 0 H ARG A 140 132.113 2.634 14.222 1.00 0.00 H new ATOM 0 HA ARG A 140 131.772 4.635 16.304 1.00 0.00 H new ATOM 0 HB2 ARG A 140 134.040 3.579 14.589 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.280 5.033 15.537 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.963 2.784 17.009 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.617 2.470 16.521 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.839 5.080 17.898 1.00 0.00 H new ATOM 0 HD3 ARG A 140 134.248 3.649 18.823 1.00 0.00 H new ATOM 0 HE ARG A 140 136.308 4.180 16.792 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.965 5.140 19.874 1.00 0.00 H new ATOM 0 HH12 ARG A 140 136.494 5.785 20.481 1.00 0.00 H new ATOM 0 HH21 ARG A 140 138.264 5.005 17.567 1.00 0.00 H new ATOM 0 HH22 ARG A 140 138.346 5.709 19.186 1.00 0.00 H new ATOM 2199 N SER A 141 132.366 5.638 13.201 1.00 0.00 N ATOM 2200 CA SER A 141 132.238 6.834 12.322 1.00 0.00 C ATOM 2201 C SER A 141 130.834 7.421 12.472 1.00 0.00 C ATOM 2202 O SER A 141 130.662 8.615 12.617 1.00 0.00 O ATOM 2203 CB SER A 141 132.468 6.425 10.867 1.00 0.00 C ATOM 2204 OG SER A 141 133.812 5.990 10.709 1.00 0.00 O ATOM 0 H SER A 141 132.702 4.793 12.739 1.00 0.00 H new ATOM 0 HA SER A 141 132.979 7.580 12.609 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.780 5.627 10.588 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.265 7.266 10.204 1.00 0.00 H new ATOM 0 HG SER A 141 133.844 5.011 10.732 1.00 0.00 H new ATOM 2210 N LEU A 142 129.829 6.590 12.443 1.00 0.00 N ATOM 2211 CA LEU A 142 128.439 7.097 12.589 1.00 0.00 C ATOM 2212 C LEU A 142 128.073 7.120 14.075 1.00 0.00 C ATOM 2213 O LEU A 142 127.933 8.171 14.669 1.00 0.00 O ATOM 2214 CB LEU A 142 127.472 6.186 11.826 1.00 0.00 C ATOM 2215 CG LEU A 142 128.133 5.688 10.538 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.364 4.481 10.010 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.109 6.794 9.486 1.00 0.00 C ATOM 0 H LEU A 142 129.912 5.580 12.324 1.00 0.00 H new ATOM 0 HA LEU A 142 128.368 8.104 12.179 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.187 5.339 12.450 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.557 6.729 11.589 1.00 0.00 H new ATOM 0 HG LEU A 142 129.165 5.408 10.748 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.832 4.124 9.093 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.376 3.687 10.756 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.333 4.768 9.803 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.580 6.436 8.571 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.077 7.075 9.277 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.653 7.662 9.858 1.00 0.00 H new ATOM 2229 N GLY A 143 127.932 5.974 14.691 1.00 0.00 N ATOM 2230 CA GLY A 143 127.594 5.959 16.144 1.00 0.00 C ATOM 2231 C GLY A 143 126.837 4.679 16.520 1.00 0.00 C ATOM 2232 O GLY A 143 125.907 4.715 17.301 1.00 0.00 O ATOM 0 H GLY A 143 128.035 5.058 14.255 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.508 6.032 16.734 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.986 6.830 16.388 1.00 0.00 H new ATOM 2236 N PHE A 144 127.222 3.545 15.990 1.00 0.00 N ATOM 2237 CA PHE A 144 126.505 2.284 16.353 1.00 0.00 C ATOM 2238 C PHE A 144 127.393 1.421 17.257 1.00 0.00 C ATOM 2239 O PHE A 144 127.951 1.892 18.228 1.00 0.00 O ATOM 2240 CB PHE A 144 126.150 1.488 15.093 1.00 0.00 C ATOM 2241 CG PHE A 144 125.669 2.415 14.004 1.00 0.00 C ATOM 2242 CD1 PHE A 144 125.007 3.605 14.328 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.880 2.074 12.664 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.560 4.455 13.310 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.433 2.922 11.646 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.773 4.114 11.970 1.00 0.00 C ATOM 0 H PHE A 144 127.992 3.438 15.330 1.00 0.00 H new ATOM 0 HA PHE A 144 125.588 2.549 16.880 1.00 0.00 H new ATOM 0 HB2 PHE A 144 127.022 0.933 14.748 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.377 0.755 15.324 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.841 3.867 15.363 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.389 1.154 12.415 1.00 0.00 H new ATOM 0 HE1 PHE A 144 124.051 5.374 13.559 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.596 2.658 10.612 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.428 4.770 11.185 1.00 0.00 H new ATOM 2256 N ASP A 145 127.519 0.156 16.948 1.00 0.00 N ATOM 2257 CA ASP A 145 128.360 -0.744 17.791 1.00 0.00 C ATOM 2258 C ASP A 145 129.624 -1.151 17.019 1.00 0.00 C ATOM 2259 O ASP A 145 129.545 -1.762 15.972 1.00 0.00 O ATOM 2260 CB ASP A 145 127.558 -1.999 18.139 1.00 0.00 C ATOM 2261 CG ASP A 145 126.811 -1.781 19.456 1.00 0.00 C ATOM 2262 OD1 ASP A 145 127.438 -1.338 20.404 1.00 0.00 O ATOM 2263 OD2 ASP A 145 125.624 -2.060 19.494 1.00 0.00 O ATOM 0 H ASP A 145 127.075 -0.293 16.147 1.00 0.00 H new ATOM 0 HA ASP A 145 128.648 -0.220 18.703 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.851 -2.224 17.341 1.00 0.00 H new ATOM 0 HB3 ASP A 145 128.225 -2.857 18.225 1.00 0.00 H new ATOM 2268 N PRO A 146 130.782 -0.818 17.534 1.00 0.00 N ATOM 2269 CA PRO A 146 132.082 -1.158 16.885 1.00 0.00 C ATOM 2270 C PRO A 146 132.162 -2.623 16.434 1.00 0.00 C ATOM 2271 O PRO A 146 132.271 -3.527 17.238 1.00 0.00 O ATOM 2272 CB PRO A 146 133.118 -0.888 17.976 1.00 0.00 C ATOM 2273 CG PRO A 146 132.494 0.123 18.879 1.00 0.00 C ATOM 2274 CD PRO A 146 130.980 -0.075 18.791 1.00 0.00 C ATOM 0 HA PRO A 146 132.232 -0.574 15.977 1.00 0.00 H new ATOM 0 HB2 PRO A 146 133.363 -1.801 18.519 1.00 0.00 H new ATOM 0 HB3 PRO A 146 134.048 -0.512 17.549 1.00 0.00 H new ATOM 0 HG2 PRO A 146 132.841 -0.008 19.904 1.00 0.00 H new ATOM 0 HG3 PRO A 146 132.769 1.133 18.576 1.00 0.00 H new ATOM 0 HD2 PRO A 146 130.602 -0.634 19.647 1.00 0.00 H new ATOM 0 HD3 PRO A 146 130.454 0.880 18.776 1.00 0.00 H new ATOM 2282 N ALA A 147 132.122 -2.858 15.149 1.00 0.00 N ATOM 2283 CA ALA A 147 132.210 -4.254 14.629 1.00 0.00 C ATOM 2284 C ALA A 147 131.325 -5.181 15.447 1.00 0.00 C ATOM 2285 O ALA A 147 131.677 -5.599 16.532 1.00 0.00 O ATOM 2286 CB ALA A 147 133.650 -4.756 14.713 1.00 0.00 C ATOM 0 H ALA A 147 132.032 -2.138 14.433 1.00 0.00 H new ATOM 0 HA ALA A 147 131.877 -4.251 13.591 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.703 -5.776 14.331 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.295 -4.111 14.117 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.981 -4.740 15.751 1.00 0.00 H new ATOM 2292 N GLU A 148 130.186 -5.521 14.929 1.00 0.00 N ATOM 2293 CA GLU A 148 129.290 -6.438 15.674 1.00 0.00 C ATOM 2294 C GLU A 148 128.111 -6.851 14.789 1.00 0.00 C ATOM 2295 O GLU A 148 127.094 -7.298 15.281 1.00 0.00 O ATOM 2296 CB GLU A 148 128.764 -5.732 16.925 1.00 0.00 C ATOM 2297 CG GLU A 148 128.400 -6.773 17.984 1.00 0.00 C ATOM 2298 CD GLU A 148 127.690 -6.087 19.152 1.00 0.00 C ATOM 2299 OE1 GLU A 148 126.502 -5.833 19.031 1.00 0.00 O ATOM 2300 OE2 GLU A 148 128.345 -5.827 20.148 1.00 0.00 O ATOM 0 H GLU A 148 129.836 -5.205 14.024 1.00 0.00 H new ATOM 0 HA GLU A 148 129.850 -7.328 15.962 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.519 -5.050 17.315 1.00 0.00 H new ATOM 0 HB3 GLU A 148 127.890 -5.131 16.676 1.00 0.00 H new ATOM 0 HG2 GLU A 148 127.755 -7.537 17.551 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.299 -7.278 18.337 1.00 0.00 H new ATOM 2307 N PHE A 149 128.230 -6.718 13.488 1.00 0.00 N ATOM 2308 CA PHE A 149 127.099 -7.113 12.602 1.00 0.00 C ATOM 2309 C PHE A 149 127.569 -8.188 11.626 1.00 0.00 C ATOM 2310 O PHE A 149 126.976 -9.243 11.525 1.00 0.00 O ATOM 2311 CB PHE A 149 126.583 -5.902 11.815 1.00 0.00 C ATOM 2312 CG PHE A 149 126.544 -4.673 12.699 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.215 -4.782 14.055 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.840 -3.420 12.154 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.184 -3.640 14.863 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.811 -2.277 12.961 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.484 -2.387 14.317 1.00 0.00 C ATOM 0 H PHE A 149 129.055 -6.356 13.010 1.00 0.00 H new ATOM 0 HA PHE A 149 126.290 -7.501 13.220 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.227 -5.718 10.955 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.586 -6.111 11.428 1.00 0.00 H new ATOM 0 HD1 PHE A 149 125.985 -5.749 14.478 1.00 0.00 H new ATOM 0 HD2 PHE A 149 127.092 -3.334 11.107 1.00 0.00 H new ATOM 0 HE1 PHE A 149 125.928 -3.726 15.909 1.00 0.00 H new ATOM 0 HE2 PHE A 149 127.041 -1.311 12.537 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.463 -1.506 14.941 1.00 0.00 H new ATOM 2327 N GLY A 150 128.629 -7.932 10.908 1.00 0.00 N ATOM 2328 CA GLY A 150 129.134 -8.941 9.941 1.00 0.00 C ATOM 2329 C GLY A 150 127.961 -9.760 9.400 1.00 0.00 C ATOM 2330 O GLY A 150 127.750 -10.889 9.798 1.00 0.00 O ATOM 0 H GLY A 150 129.166 -7.066 10.951 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.655 -8.446 9.121 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.856 -9.597 10.427 1.00 0.00 H new