USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1185 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 15 SER OG : rot -160:sc= 0 USER MOD Set 1.2: A 176 THR OG1 : rot 132:sc= 0.428 USER MOD Set 1.3: A 178 HIS : no HE2:sc= -0.626 K(o=-0.2,f=-8.8!) USER MOD Set 2.1: A 170 GLN : amide:sc= -1.11 K(o=-0.45,f=0.28) USER MOD Set 2.2: A 173 THR OG1 : rot 38:sc= 0.653 USER MOD Set 3.1: A 134 TYR OH : rot 110:sc= 0.0404 USER MOD Set 3.2: A 136 THR OG1 : rot 32:sc= 0.521 USER MOD Set 4.1: A 108 LYS NZ :NH3+ 139:sc= 0.893 (180deg=-0.907) USER MOD Set 4.2: A 123 THR OG1 : rot 180:sc= 0.805 USER MOD Set 5.1: A 106 SER OG : rot 150:sc= -0.0994 USER MOD Set 5.2: A 125 HIS : no HD1:sc= -0.121 K(o=-0.22,f=-0.96) USER MOD Set 6.1: A 89 SER OG : rot 180:sc= 0.0021 USER MOD Set 6.2: A 92 ASN : amide:sc= -0.936 X(o=-0.93,f=-0.97) USER MOD Single : A 7 CYS SG : rot 31:sc= 0.0164 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= -0.0637 USER MOD Single : A 34 ASN : amide:sc= -0.112 K(o=-0.11,f=-1.3!) USER MOD Single : A 35 GLN : amide:sc= -2.04 K(o=-2,f=-1.2) USER MOD Single : A 39 CYS SG : rot 36:sc= 0.739 USER MOD Single : A 40 HIS : no HD1:sc= -2.8 K(o=-2.8,f=-2.3) USER MOD Single : A 43 THR OG1 : rot 140:sc= 0.653 USER MOD Single : A 45 GLN : amide:sc= -0.723 K(o=-0.72,f=-1.9!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -0.0626 X(o=-0.063,f=-0.2) USER MOD Single : A 57 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.623 K(o=-0.62,f=-0.12) USER MOD Single : A 75 GLN : amide:sc= -0.0383 X(o=-0.038,f=0) USER MOD Single : A 81 HIS : no HD1:sc= -2.09! C(o=-2.1!,f=-3!) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0856 X(o=-0.086,f=0) USER MOD Single : A 99 CYS SG : rot -140:sc= -0.932 USER MOD Single : A 100 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.18) USER MOD Single : A 109 GLN : amide:sc= -2.68 K(o=-2.7,f=-1.6) USER MOD Single : A 110 GLN : amide:sc= -0.0821 X(o=-0.082,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0427) USER MOD Single : A 126 GLN : amide:sc= -0.107 X(o=-0.11,f=-0.23) USER MOD Single : A 133 GLN : amide:sc= -0.0272 X(o=-0.027,f=-0.076) USER MOD Single : A 135 GLN : amide:sc= -0.215 X(o=-0.22,f=0) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.412 X(o=-0.41,f=-0.59) USER MOD Single : A 144 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.019) USER MOD Single : A 164 SER OG : rot 180:sc=-0.00683 USER MOD Single : A 174 SER OG : rot -102:sc= 0.158 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 2.920 15.110 -7.236 1.00 0.00 N ATOM 64 CA ARG A 5 4.094 15.573 -6.495 1.00 0.00 C ATOM 65 C ARG A 5 4.815 14.404 -5.823 1.00 0.00 C ATOM 66 O ARG A 5 4.353 13.875 -4.808 1.00 0.00 O ATOM 67 CB ARG A 5 3.697 16.625 -5.451 1.00 0.00 C ATOM 68 CG ARG A 5 2.502 16.230 -4.593 1.00 0.00 C ATOM 69 CD ARG A 5 2.558 16.887 -3.222 1.00 0.00 C ATOM 70 NE ARG A 5 2.054 18.261 -3.248 1.00 0.00 N ATOM 71 CZ ARG A 5 1.646 18.930 -2.165 1.00 0.00 C ATOM 72 NH1 ARG A 5 1.680 18.358 -0.964 1.00 0.00 N ATOM 73 NH2 ARG A 5 1.201 20.176 -2.283 1.00 0.00 N ATOM 0 HA ARG A 5 4.779 16.032 -7.208 1.00 0.00 H new ATOM 0 HB2 ARG A 5 4.551 16.816 -4.800 1.00 0.00 H new ATOM 0 HB3 ARG A 5 3.470 17.561 -5.962 1.00 0.00 H new ATOM 0 HG2 ARG A 5 1.580 16.517 -5.098 1.00 0.00 H new ATOM 0 HG3 ARG A 5 2.478 15.146 -4.478 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.972 16.300 -2.515 1.00 0.00 H new ATOM 0 HD3 ARG A 5 3.587 16.886 -2.862 1.00 0.00 H new ATOM 0 HE ARG A 5 2.011 18.738 -4.149 1.00 0.00 H new ATOM 0 HH11 ARG A 5 2.019 17.401 -0.864 1.00 0.00 H new ATOM 0 HH12 ARG A 5 1.367 18.876 -0.143 1.00 0.00 H new ATOM 0 HH21 ARG A 5 1.171 20.622 -3.200 1.00 0.00 H new ATOM 0 HH22 ARG A 5 0.890 20.687 -1.457 1.00 0.00 H new ATOM 87 N ASP A 6 5.952 14.006 -6.397 1.00 0.00 N ATOM 88 CA ASP A 6 6.745 12.901 -5.862 1.00 0.00 C ATOM 89 C ASP A 6 7.568 13.353 -4.656 1.00 0.00 C ATOM 90 O ASP A 6 8.529 14.109 -4.798 1.00 0.00 O ATOM 91 CB ASP A 6 7.671 12.335 -6.943 1.00 0.00 C ATOM 92 CG ASP A 6 6.916 11.592 -8.031 1.00 0.00 C ATOM 93 OD1 ASP A 6 6.509 10.437 -7.790 1.00 0.00 O ATOM 94 OD2 ASP A 6 6.734 12.165 -9.125 1.00 0.00 O ATOM 0 H ASP A 6 6.344 14.435 -7.235 1.00 0.00 H new ATOM 0 HA ASP A 6 6.057 12.120 -5.538 1.00 0.00 H new ATOM 0 HB2 ASP A 6 8.239 13.150 -7.392 1.00 0.00 H new ATOM 0 HB3 ASP A 6 8.392 11.660 -6.481 1.00 0.00 H new ATOM 99 N CYS A 7 7.183 12.883 -3.471 1.00 0.00 N ATOM 100 CA CYS A 7 7.881 13.235 -2.239 1.00 0.00 C ATOM 101 C CYS A 7 9.068 12.300 -1.997 1.00 0.00 C ATOM 102 O CYS A 7 8.925 11.076 -2.058 1.00 0.00 O ATOM 103 CB CYS A 7 6.920 13.178 -1.047 1.00 0.00 C ATOM 104 SG CYS A 7 5.346 14.026 -1.320 1.00 0.00 S ATOM 0 H CYS A 7 6.389 12.256 -3.339 1.00 0.00 H new ATOM 0 HA CYS A 7 8.258 14.252 -2.344 1.00 0.00 H new ATOM 0 HB2 CYS A 7 6.720 12.134 -0.806 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.410 13.617 -0.178 1.00 0.00 H new ATOM 0 HG CYS A 7 5.036 13.971 -2.581 1.00 0.00 H new ATOM 110 N PRO A 8 10.263 12.870 -1.722 1.00 0.00 N ATOM 111 CA PRO A 8 11.486 12.089 -1.471 1.00 0.00 C ATOM 112 C PRO A 8 11.306 11.052 -0.363 1.00 0.00 C ATOM 113 O PRO A 8 10.803 11.367 0.717 1.00 0.00 O ATOM 114 CB PRO A 8 12.510 13.148 -1.050 1.00 0.00 C ATOM 115 CG PRO A 8 12.013 14.418 -1.647 1.00 0.00 C ATOM 116 CD PRO A 8 10.513 14.322 -1.637 1.00 0.00 C ATOM 0 HA PRO A 8 11.782 11.514 -2.349 1.00 0.00 H new ATOM 0 HB2 PRO A 8 12.579 13.222 0.035 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.507 12.902 -1.417 1.00 0.00 H new ATOM 0 HG2 PRO A 8 12.353 15.279 -1.071 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.389 14.545 -2.662 1.00 0.00 H new ATOM 0 HD2 PRO A 8 10.089 14.750 -0.729 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.070 14.856 -2.478 1.00 0.00 H new ATOM 124 N LEU A 9 11.724 9.816 -0.640 1.00 0.00 N ATOM 125 CA LEU A 9 11.616 8.729 0.330 1.00 0.00 C ATOM 126 C LEU A 9 12.915 7.931 0.395 1.00 0.00 C ATOM 127 O LEU A 9 13.484 7.574 -0.639 1.00 0.00 O ATOM 128 CB LEU A 9 10.448 7.805 -0.028 1.00 0.00 C ATOM 129 CG LEU A 9 9.400 7.633 1.074 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.283 8.655 0.917 1.00 0.00 C ATOM 131 CD2 LEU A 9 8.838 6.219 1.059 1.00 0.00 C ATOM 0 H LEU A 9 12.141 9.544 -1.530 1.00 0.00 H new ATOM 0 HA LEU A 9 11.429 9.167 1.310 1.00 0.00 H new ATOM 0 HB2 LEU A 9 9.956 8.194 -0.919 1.00 0.00 H new ATOM 0 HB3 LEU A 9 10.846 6.824 -0.287 1.00 0.00 H new ATOM 0 HG LEU A 9 9.883 7.801 2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.548 8.516 1.710 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.699 9.661 0.980 1.00 0.00 H new ATOM 0 HD13 LEU A 9 7.801 8.521 -0.052 1.00 0.00 H new ATOM 0 HD21 LEU A 9 8.094 6.115 1.849 1.00 0.00 H new ATOM 0 HD22 LEU A 9 8.372 6.023 0.094 1.00 0.00 H new ATOM 0 HD23 LEU A 9 9.645 5.505 1.224 1.00 0.00 H new ATOM 143 N PHE A 10 13.383 7.664 1.618 1.00 0.00 N ATOM 144 CA PHE A 10 14.625 6.917 1.833 1.00 0.00 C ATOM 145 C PHE A 10 15.810 7.603 1.150 1.00 0.00 C ATOM 146 O PHE A 10 16.719 6.938 0.648 1.00 0.00 O ATOM 147 CB PHE A 10 14.490 5.478 1.318 1.00 0.00 C ATOM 148 CG PHE A 10 13.582 4.616 2.150 1.00 0.00 C ATOM 149 CD1 PHE A 10 14.066 3.951 3.266 1.00 0.00 C ATOM 150 CD2 PHE A 10 12.246 4.471 1.815 1.00 0.00 C ATOM 151 CE1 PHE A 10 13.233 3.156 4.030 1.00 0.00 C ATOM 152 CE2 PHE A 10 11.409 3.678 2.575 1.00 0.00 C ATOM 153 CZ PHE A 10 11.903 3.020 3.685 1.00 0.00 C ATOM 0 H PHE A 10 12.918 7.956 2.477 1.00 0.00 H new ATOM 0 HA PHE A 10 14.811 6.894 2.907 1.00 0.00 H new ATOM 0 HB2 PHE A 10 14.115 5.502 0.295 1.00 0.00 H new ATOM 0 HB3 PHE A 10 15.479 5.020 1.284 1.00 0.00 H new ATOM 0 HD1 PHE A 10 15.105 4.055 3.541 1.00 0.00 H new ATOM 0 HD2 PHE A 10 11.854 4.984 0.949 1.00 0.00 H new ATOM 0 HE1 PHE A 10 13.622 2.641 4.896 1.00 0.00 H new ATOM 0 HE2 PHE A 10 10.369 3.572 2.302 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.250 2.400 4.282 1.00 0.00 H new ATOM 163 N GLY A 11 15.797 8.936 1.139 1.00 0.00 N ATOM 164 CA GLY A 11 16.880 9.686 0.522 1.00 0.00 C ATOM 165 C GLY A 11 16.695 9.913 -0.975 1.00 0.00 C ATOM 166 O GLY A 11 17.521 10.578 -1.602 1.00 0.00 O ATOM 0 H GLY A 11 15.057 9.508 1.546 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.970 10.652 1.018 1.00 0.00 H new ATOM 0 HA3 GLY A 11 17.818 9.155 0.687 1.00 0.00 H new ATOM 170 N GLY A 12 15.619 9.370 -1.549 1.00 0.00 N ATOM 171 CA GLY A 12 15.364 9.541 -2.971 1.00 0.00 C ATOM 172 C GLY A 12 15.287 8.226 -3.739 1.00 0.00 C ATOM 173 O GLY A 12 15.351 8.225 -4.970 1.00 0.00 O ATOM 0 H GLY A 12 14.921 8.815 -1.053 1.00 0.00 H new ATOM 0 HA2 GLY A 12 14.428 10.084 -3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.153 10.158 -3.402 1.00 0.00 H new ATOM 177 N ALA A 13 15.145 7.107 -3.025 1.00 0.00 N ATOM 178 CA ALA A 13 15.055 5.795 -3.665 1.00 0.00 C ATOM 179 C ALA A 13 13.642 5.534 -4.186 1.00 0.00 C ATOM 180 O ALA A 13 13.463 4.913 -5.234 1.00 0.00 O ATOM 181 CB ALA A 13 15.480 4.699 -2.698 1.00 0.00 C ATOM 0 H ALA A 13 15.090 7.084 -2.007 1.00 0.00 H new ATOM 0 HA ALA A 13 15.735 5.788 -4.517 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.407 3.730 -3.191 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.510 4.870 -2.385 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.828 4.712 -1.824 1.00 0.00 H new ATOM 187 N PHE A 14 12.644 6.021 -3.450 1.00 0.00 N ATOM 188 CA PHE A 14 11.248 5.858 -3.837 1.00 0.00 C ATOM 189 C PHE A 14 10.565 7.215 -3.942 1.00 0.00 C ATOM 190 O PHE A 14 10.811 8.107 -3.127 1.00 0.00 O ATOM 191 CB PHE A 14 10.512 4.983 -2.822 1.00 0.00 C ATOM 192 CG PHE A 14 10.535 3.520 -3.158 1.00 0.00 C ATOM 193 CD1 PHE A 14 11.568 2.710 -2.713 1.00 0.00 C ATOM 194 CD2 PHE A 14 9.522 2.952 -3.913 1.00 0.00 C ATOM 195 CE1 PHE A 14 11.588 1.361 -3.016 1.00 0.00 C ATOM 196 CE2 PHE A 14 9.536 1.605 -4.216 1.00 0.00 C ATOM 197 CZ PHE A 14 10.571 0.808 -3.767 1.00 0.00 C ATOM 0 H PHE A 14 12.780 6.534 -2.579 1.00 0.00 H new ATOM 0 HA PHE A 14 11.217 5.370 -4.811 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.959 5.128 -1.839 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.476 5.315 -2.753 1.00 0.00 H new ATOM 0 HD1 PHE A 14 12.366 3.137 -2.123 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.711 3.570 -4.269 1.00 0.00 H new ATOM 0 HE1 PHE A 14 12.399 0.740 -2.665 1.00 0.00 H new ATOM 0 HE2 PHE A 14 8.738 1.175 -4.804 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.584 -0.246 -4.003 1.00 0.00 H new ATOM 207 N SER A 15 9.702 7.365 -4.944 1.00 0.00 N ATOM 208 CA SER A 15 8.981 8.615 -5.148 1.00 0.00 C ATOM 209 C SER A 15 7.496 8.413 -4.891 1.00 0.00 C ATOM 210 O SER A 15 6.828 7.669 -5.612 1.00 0.00 O ATOM 211 CB SER A 15 9.212 9.139 -6.564 1.00 0.00 C ATOM 212 OG SER A 15 10.373 9.949 -6.623 1.00 0.00 O ATOM 0 H SER A 15 9.486 6.637 -5.625 1.00 0.00 H new ATOM 0 HA SER A 15 9.359 9.355 -4.442 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.314 8.301 -7.254 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.345 9.715 -6.888 1.00 0.00 H new ATOM 0 HG SER A 15 10.335 10.518 -7.420 1.00 0.00 H new ATOM 218 N ALA A 16 6.992 9.064 -3.844 1.00 0.00 N ATOM 219 CA ALA A 16 5.589 8.937 -3.469 1.00 0.00 C ATOM 220 C ALA A 16 4.765 10.146 -3.898 1.00 0.00 C ATOM 221 O ALA A 16 5.069 11.285 -3.539 1.00 0.00 O ATOM 222 CB ALA A 16 5.474 8.713 -1.969 1.00 0.00 C ATOM 0 H ALA A 16 7.535 9.683 -3.242 1.00 0.00 H new ATOM 0 HA ALA A 16 5.181 8.074 -3.996 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.423 8.619 -1.695 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.004 7.800 -1.696 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.913 9.559 -1.440 1.00 0.00 H new ATOM 228 N ILE A 17 3.713 9.875 -4.667 1.00 0.00 N ATOM 229 CA ILE A 17 2.817 10.914 -5.163 1.00 0.00 C ATOM 230 C ILE A 17 1.610 11.084 -4.243 1.00 0.00 C ATOM 231 O ILE A 17 0.935 10.110 -3.909 1.00 0.00 O ATOM 232 CB ILE A 17 2.305 10.579 -6.580 1.00 0.00 C ATOM 233 CG1 ILE A 17 3.468 10.203 -7.503 1.00 0.00 C ATOM 234 CG2 ILE A 17 1.520 11.745 -7.158 1.00 0.00 C ATOM 235 CD1 ILE A 17 3.292 8.869 -8.197 1.00 0.00 C ATOM 0 H ILE A 17 3.459 8.932 -4.962 1.00 0.00 H new ATOM 0 HA ILE A 17 3.392 11.840 -5.191 1.00 0.00 H new ATOM 0 HB ILE A 17 1.637 9.721 -6.505 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.587 10.981 -8.257 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.389 10.180 -6.920 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.169 11.487 -8.157 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.665 11.961 -6.517 1.00 0.00 H new ATOM 0 HG23 ILE A 17 2.163 12.624 -7.215 1.00 0.00 H new ATOM 0 HD11 ILE A 17 4.155 8.673 -8.833 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.204 8.079 -7.451 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.390 8.893 -8.808 1.00 0.00 H new ATOM 247 N LEU A 18 1.339 12.328 -3.854 1.00 0.00 N ATOM 248 CA LEU A 18 0.203 12.647 -2.983 1.00 0.00 C ATOM 249 C LEU A 18 0.145 14.145 -2.682 1.00 0.00 C ATOM 250 O LEU A 18 0.832 14.633 -1.784 1.00 0.00 O ATOM 251 CB LEU A 18 0.265 11.847 -1.675 1.00 0.00 C ATOM 252 CG LEU A 18 1.575 11.959 -0.892 1.00 0.00 C ATOM 253 CD1 LEU A 18 1.291 11.968 0.600 1.00 0.00 C ATOM 254 CD2 LEU A 18 2.515 10.820 -1.253 1.00 0.00 C ATOM 0 H LEU A 18 1.893 13.139 -4.129 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.706 12.365 -3.515 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.551 12.174 -1.031 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.088 10.796 -1.904 1.00 0.00 H new ATOM 0 HG LEU A 18 2.063 12.896 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 18 2.230 12.048 1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.654 12.818 0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.785 11.044 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.440 10.918 -0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.042 9.868 -1.013 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.738 10.856 -2.319 1.00 0.00 H new ATOM 266 N PRO A 19 -0.678 14.896 -3.447 1.00 0.00 N ATOM 267 CA PRO A 19 -0.832 16.355 -3.280 1.00 0.00 C ATOM 268 C PRO A 19 -1.244 16.761 -1.862 1.00 0.00 C ATOM 269 O PRO A 19 -1.350 15.918 -0.969 1.00 0.00 O ATOM 270 CB PRO A 19 -1.938 16.708 -4.280 1.00 0.00 C ATOM 271 CG PRO A 19 -1.894 15.624 -5.298 1.00 0.00 C ATOM 272 CD PRO A 19 -1.518 14.381 -4.547 1.00 0.00 C ATOM 0 HA PRO A 19 0.109 16.878 -3.450 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.912 16.753 -3.792 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.764 17.684 -4.734 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -2.860 15.508 -5.789 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -1.165 15.847 -6.077 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.396 13.856 -4.172 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.972 13.679 -5.177 1.00 0.00 H new ATOM 280 N MET A 20 -1.471 18.064 -1.664 1.00 0.00 N ATOM 281 CA MET A 20 -1.865 18.591 -0.355 1.00 0.00 C ATOM 282 C MET A 20 -3.070 17.840 0.213 1.00 0.00 C ATOM 283 O MET A 20 -3.880 17.285 -0.532 1.00 0.00 O ATOM 284 CB MET A 20 -2.179 20.087 -0.440 1.00 0.00 C ATOM 285 CG MET A 20 -1.829 20.849 0.830 1.00 0.00 C ATOM 286 SD MET A 20 -1.842 22.637 0.595 1.00 0.00 S ATOM 287 CE MET A 20 -0.311 23.099 1.403 1.00 0.00 C ATOM 0 H MET A 20 -1.388 18.772 -2.394 1.00 0.00 H new ATOM 0 HA MET A 20 -1.021 18.444 0.318 1.00 0.00 H new ATOM 0 HB2 MET A 20 -1.631 20.519 -1.277 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.240 20.217 -0.653 1.00 0.00 H new ATOM 0 HG2 MET A 20 -2.538 20.585 1.614 1.00 0.00 H new ATOM 0 HG3 MET A 20 -0.842 20.539 1.174 1.00 0.00 H new ATOM 0 HE1 MET A 20 -0.178 24.179 1.341 1.00 0.00 H new ATOM 0 HE2 MET A 20 -0.347 22.798 2.450 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.525 22.602 0.911 1.00 0.00 H new ATOM 297 N GLY A 21 -3.167 17.821 1.541 1.00 0.00 N ATOM 298 CA GLY A 21 -4.260 17.126 2.202 1.00 0.00 C ATOM 299 C GLY A 21 -3.785 15.876 2.917 1.00 0.00 C ATOM 300 O GLY A 21 -4.266 15.552 4.002 1.00 0.00 O ATOM 0 H GLY A 21 -2.507 18.275 2.172 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.735 17.796 2.919 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.018 16.857 1.466 1.00 0.00 H new ATOM 304 N ALA A 22 -2.830 15.177 2.305 1.00 0.00 N ATOM 305 CA ALA A 22 -2.272 13.957 2.878 1.00 0.00 C ATOM 306 C ALA A 22 -1.081 14.276 3.779 1.00 0.00 C ATOM 307 O ALA A 22 0.001 14.615 3.296 1.00 0.00 O ATOM 308 CB ALA A 22 -1.858 12.999 1.766 1.00 0.00 C ATOM 0 H ALA A 22 -2.425 15.439 1.406 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.039 13.479 3.488 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.443 12.091 2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.729 12.745 1.162 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.106 13.475 1.137 1.00 0.00 H new ATOM 314 N ILE A 23 -1.287 14.172 5.090 1.00 0.00 N ATOM 315 CA ILE A 23 -0.230 14.452 6.059 1.00 0.00 C ATOM 316 C ILE A 23 0.162 13.193 6.835 1.00 0.00 C ATOM 317 O ILE A 23 -0.688 12.361 7.153 1.00 0.00 O ATOM 318 CB ILE A 23 -0.653 15.555 7.055 1.00 0.00 C ATOM 319 CG1 ILE A 23 0.522 15.918 7.970 1.00 0.00 C ATOM 320 CG2 ILE A 23 -1.859 15.107 7.874 1.00 0.00 C ATOM 321 CD1 ILE A 23 0.180 16.950 9.021 1.00 0.00 C ATOM 0 H ILE A 23 -2.176 13.896 5.506 1.00 0.00 H new ATOM 0 HA ILE A 23 0.632 14.802 5.491 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.940 16.443 6.491 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.879 15.014 8.464 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.344 16.293 7.360 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.141 15.898 8.569 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.694 14.896 7.206 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.605 14.206 8.433 1.00 0.00 H new ATOM 0 HD11 ILE A 23 1.061 17.155 9.630 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.148 17.869 8.535 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.620 16.571 9.657 1.00 0.00 H new ATOM 333 N ASP A 24 1.452 13.067 7.138 1.00 0.00 N ATOM 334 CA ASP A 24 1.958 11.917 7.880 1.00 0.00 C ATOM 335 C ASP A 24 1.662 12.060 9.370 1.00 0.00 C ATOM 336 O ASP A 24 1.913 13.112 9.960 1.00 0.00 O ATOM 337 CB ASP A 24 3.465 11.765 7.657 1.00 0.00 C ATOM 338 CG ASP A 24 3.896 10.314 7.567 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.298 9.564 6.771 1.00 0.00 O ATOM 340 OD2 ASP A 24 4.832 9.928 8.294 1.00 0.00 O ATOM 0 H ASP A 24 2.166 13.748 6.880 1.00 0.00 H new ATOM 0 HA ASP A 24 1.452 11.024 7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.747 12.282 6.740 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.000 12.250 8.473 1.00 0.00 H new ATOM 345 N VAL A 25 1.135 10.993 9.976 1.00 0.00 N ATOM 346 CA VAL A 25 0.813 11.001 11.400 1.00 0.00 C ATOM 347 C VAL A 25 2.051 10.756 12.270 1.00 0.00 C ATOM 348 O VAL A 25 1.931 10.596 13.487 1.00 0.00 O ATOM 349 CB VAL A 25 -0.265 9.953 11.759 1.00 0.00 C ATOM 350 CG1 VAL A 25 -1.657 10.492 11.465 1.00 0.00 C ATOM 351 CG2 VAL A 25 -0.031 8.631 11.037 1.00 0.00 C ATOM 0 H VAL A 25 0.924 10.115 9.501 1.00 0.00 H new ATOM 0 HA VAL A 25 0.422 11.997 11.607 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.189 9.757 12.828 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.401 9.739 11.725 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -1.831 11.392 12.055 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.738 10.732 10.405 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.810 7.921 11.316 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.058 8.795 9.960 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.943 8.230 11.318 1.00 0.00 H new ATOM 361 N SER A 26 3.239 10.736 11.654 1.00 0.00 N ATOM 362 CA SER A 26 4.480 10.518 12.398 1.00 0.00 C ATOM 363 C SER A 26 4.698 11.620 13.435 1.00 0.00 C ATOM 364 O SER A 26 5.313 11.387 14.475 1.00 0.00 O ATOM 365 CB SER A 26 5.679 10.449 11.448 1.00 0.00 C ATOM 366 OG SER A 26 6.628 9.496 11.894 1.00 0.00 O ATOM 0 H SER A 26 3.365 10.867 10.650 1.00 0.00 H new ATOM 0 HA SER A 26 4.390 9.565 12.919 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.339 10.187 10.446 1.00 0.00 H new ATOM 0 HB3 SER A 26 6.149 11.430 11.378 1.00 0.00 H new ATOM 0 HG SER A 26 7.383 9.469 11.270 1.00 0.00 H new ATOM 372 N ASP A 27 4.178 12.820 13.153 1.00 0.00 N ATOM 373 CA ASP A 27 4.306 13.945 14.076 1.00 0.00 C ATOM 374 C ASP A 27 3.486 13.700 15.345 1.00 0.00 C ATOM 375 O ASP A 27 3.797 14.236 16.410 1.00 0.00 O ATOM 376 CB ASP A 27 3.852 15.245 13.403 1.00 0.00 C ATOM 377 CG ASP A 27 4.434 16.477 14.068 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.675 16.621 14.069 1.00 0.00 O ATOM 379 OD2 ASP A 27 3.649 17.299 14.587 1.00 0.00 O ATOM 0 H ASP A 27 3.667 13.033 12.296 1.00 0.00 H new ATOM 0 HA ASP A 27 5.356 14.039 14.352 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.146 15.229 12.354 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.764 15.302 13.428 1.00 0.00 H new ATOM 384 N LEU A 28 2.438 12.883 15.218 1.00 0.00 N ATOM 385 CA LEU A 28 1.567 12.555 16.341 1.00 0.00 C ATOM 386 C LEU A 28 2.075 11.323 17.108 1.00 0.00 C ATOM 387 O LEU A 28 1.834 11.197 18.309 1.00 0.00 O ATOM 388 CB LEU A 28 0.141 12.315 15.831 1.00 0.00 C ATOM 389 CG LEU A 28 -0.983 12.652 16.818 1.00 0.00 C ATOM 390 CD1 LEU A 28 -0.872 14.096 17.289 1.00 0.00 C ATOM 391 CD2 LEU A 28 -2.343 12.401 16.179 1.00 0.00 C ATOM 0 H LEU A 28 2.174 12.435 14.341 1.00 0.00 H new ATOM 0 HA LEU A 28 1.570 13.396 17.034 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.006 12.905 14.926 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.048 11.267 15.547 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.883 12.002 17.687 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.679 14.314 17.988 1.00 0.00 H new ATOM 0 HD12 LEU A 28 0.087 14.244 17.785 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.945 14.765 16.432 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.131 12.645 16.892 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.450 13.026 15.293 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.423 11.352 15.894 1.00 0.00 H new ATOM 403 N ARG A 29 2.777 10.418 16.411 1.00 0.00 N ATOM 404 CA ARG A 29 3.311 9.202 17.039 1.00 0.00 C ATOM 405 C ARG A 29 4.505 8.646 16.252 1.00 0.00 C ATOM 406 O ARG A 29 4.616 8.869 15.048 1.00 0.00 O ATOM 407 CB ARG A 29 2.216 8.137 17.147 1.00 0.00 C ATOM 408 CG ARG A 29 1.532 7.829 15.824 1.00 0.00 C ATOM 409 CD ARG A 29 0.433 6.791 15.989 1.00 0.00 C ATOM 410 NE ARG A 29 0.778 5.518 15.355 1.00 0.00 N ATOM 411 CZ ARG A 29 0.654 5.274 14.047 1.00 0.00 C ATOM 412 NH1 ARG A 29 0.206 6.217 13.222 1.00 0.00 N ATOM 413 NH2 ARG A 29 0.981 4.083 13.561 1.00 0.00 N ATOM 0 H ARG A 29 2.987 10.505 15.417 1.00 0.00 H new ATOM 0 HA ARG A 29 3.656 9.466 18.039 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.651 7.220 17.543 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.466 8.470 17.865 1.00 0.00 H new ATOM 0 HG2 ARG A 29 1.109 8.745 15.411 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.270 7.467 15.108 1.00 0.00 H new ATOM 0 HD2 ARG A 29 0.246 6.628 17.050 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.492 7.172 15.557 1.00 0.00 H new ATOM 0 HE ARG A 29 1.136 4.770 15.949 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.046 7.136 13.586 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.115 6.021 12.225 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.327 3.355 14.186 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.887 3.896 12.563 1.00 0.00 H new ATOM 427 N PRO A 30 5.419 7.911 16.928 1.00 0.00 N ATOM 428 CA PRO A 30 6.612 7.323 16.289 1.00 0.00 C ATOM 429 C PRO A 30 6.267 6.338 15.168 1.00 0.00 C ATOM 430 O PRO A 30 5.445 5.440 15.351 1.00 0.00 O ATOM 431 CB PRO A 30 7.320 6.593 17.440 1.00 0.00 C ATOM 432 CG PRO A 30 6.276 6.413 18.489 1.00 0.00 C ATOM 433 CD PRO A 30 5.365 7.600 18.368 1.00 0.00 C ATOM 0 HA PRO A 30 7.221 8.089 15.810 1.00 0.00 H new ATOM 0 HB2 PRO A 30 7.718 5.633 17.112 1.00 0.00 H new ATOM 0 HB3 PRO A 30 8.161 7.175 17.817 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.728 5.483 18.340 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.724 6.363 19.482 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.351 7.366 18.693 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.709 8.437 18.975 1.00 0.00 H new ATOM 441 N VAL A 31 6.905 6.515 14.008 1.00 0.00 N ATOM 442 CA VAL A 31 6.670 5.643 12.855 1.00 0.00 C ATOM 443 C VAL A 31 7.961 5.417 12.062 1.00 0.00 C ATOM 444 O VAL A 31 8.465 6.339 11.416 1.00 0.00 O ATOM 445 CB VAL A 31 5.598 6.233 11.910 1.00 0.00 C ATOM 446 CG1 VAL A 31 5.243 5.246 10.808 1.00 0.00 C ATOM 447 CG2 VAL A 31 4.353 6.638 12.686 1.00 0.00 C ATOM 0 H VAL A 31 7.588 7.254 13.843 1.00 0.00 H new ATOM 0 HA VAL A 31 6.314 4.690 13.247 1.00 0.00 H new ATOM 0 HB VAL A 31 6.016 7.126 11.446 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.487 5.684 10.157 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.135 5.015 10.225 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.853 4.330 11.252 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.614 7.050 11.999 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.936 5.764 13.186 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.616 7.390 13.429 1.00 0.00 H new ATOM 457 N PRO A 32 8.519 4.187 12.104 1.00 0.00 N ATOM 458 CA PRO A 32 9.759 3.849 11.386 1.00 0.00 C ATOM 459 C PRO A 32 9.691 4.190 9.897 1.00 0.00 C ATOM 460 O PRO A 32 8.632 4.091 9.277 1.00 0.00 O ATOM 461 CB PRO A 32 9.883 2.334 11.578 1.00 0.00 C ATOM 462 CG PRO A 32 9.125 2.045 12.825 1.00 0.00 C ATOM 463 CD PRO A 32 7.990 3.031 12.859 1.00 0.00 C ATOM 0 HA PRO A 32 10.609 4.415 11.767 1.00 0.00 H new ATOM 0 HB2 PRO A 32 9.468 1.792 10.728 1.00 0.00 H new ATOM 0 HB3 PRO A 32 10.926 2.031 11.670 1.00 0.00 H new ATOM 0 HG2 PRO A 32 8.752 1.021 12.826 1.00 0.00 H new ATOM 0 HG3 PRO A 32 9.762 2.153 13.703 1.00 0.00 H new ATOM 0 HD2 PRO A 32 7.091 2.625 12.395 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.726 3.305 13.880 1.00 0.00 H new ATOM 471 N ASP A 33 10.834 4.592 9.331 1.00 0.00 N ATOM 472 CA ASP A 33 10.914 4.950 7.911 1.00 0.00 C ATOM 473 C ASP A 33 10.452 3.803 7.011 1.00 0.00 C ATOM 474 O ASP A 33 9.959 4.035 5.908 1.00 0.00 O ATOM 475 CB ASP A 33 12.342 5.355 7.541 1.00 0.00 C ATOM 476 CG ASP A 33 12.377 6.445 6.485 1.00 0.00 C ATOM 477 OD1 ASP A 33 11.831 7.539 6.741 1.00 0.00 O ATOM 478 OD2 ASP A 33 12.954 6.204 5.403 1.00 0.00 O ATOM 0 H ASP A 33 11.717 4.678 9.835 1.00 0.00 H new ATOM 0 HA ASP A 33 10.245 5.796 7.751 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.862 5.701 8.434 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.882 4.481 7.176 1.00 0.00 H new ATOM 483 N ASN A 34 10.608 2.567 7.492 1.00 0.00 N ATOM 484 CA ASN A 34 10.194 1.387 6.732 1.00 0.00 C ATOM 485 C ASN A 34 8.726 1.491 6.310 1.00 0.00 C ATOM 486 O ASN A 34 8.332 0.959 5.271 1.00 0.00 O ATOM 487 CB ASN A 34 10.416 0.116 7.560 1.00 0.00 C ATOM 488 CG ASN A 34 10.747 -1.091 6.699 1.00 0.00 C ATOM 489 OD1 ASN A 34 11.386 -0.966 5.655 1.00 0.00 O ATOM 490 ND2 ASN A 34 10.315 -2.269 7.135 1.00 0.00 N ATOM 0 H ASN A 34 11.017 2.359 8.403 1.00 0.00 H new ATOM 0 HA ASN A 34 10.805 1.335 5.831 1.00 0.00 H new ATOM 0 HB2 ASN A 34 11.227 0.285 8.269 1.00 0.00 H new ATOM 0 HB3 ASN A 34 9.520 -0.094 8.144 1.00 0.00 H new ATOM 0 HD21 ASN A 34 10.510 -3.114 6.598 1.00 0.00 H new ATOM 0 HD22 ASN A 34 9.788 -2.328 8.006 1.00 0.00 H new ATOM 497 N GLN A 35 7.923 2.183 7.122 1.00 0.00 N ATOM 498 CA GLN A 35 6.504 2.363 6.829 1.00 0.00 C ATOM 499 C GLN A 35 6.141 3.844 6.737 1.00 0.00 C ATOM 500 O GLN A 35 6.947 4.718 7.062 1.00 0.00 O ATOM 501 CB GLN A 35 5.642 1.684 7.896 1.00 0.00 C ATOM 502 CG GLN A 35 6.036 2.033 9.326 1.00 0.00 C ATOM 503 CD GLN A 35 4.869 1.950 10.292 1.00 0.00 C ATOM 504 OE1 GLN A 35 4.939 1.262 11.309 1.00 0.00 O ATOM 505 NE2 GLN A 35 3.784 2.653 9.979 1.00 0.00 N ATOM 0 H GLN A 35 8.234 2.627 7.986 1.00 0.00 H new ATOM 0 HA GLN A 35 6.307 1.899 5.863 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.600 1.963 7.739 1.00 0.00 H new ATOM 0 HB3 GLN A 35 5.705 0.604 7.766 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.825 1.357 9.656 1.00 0.00 H new ATOM 0 HG3 GLN A 35 6.450 3.041 9.349 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.767 3.211 9.126 1.00 0.00 H new ATOM 0 HE22 GLN A 35 2.969 2.634 10.592 1.00 0.00 H new ATOM 514 N GLU A 36 4.915 4.110 6.290 1.00 0.00 N ATOM 515 CA GLU A 36 4.417 5.475 6.144 1.00 0.00 C ATOM 516 C GLU A 36 2.910 5.521 6.380 1.00 0.00 C ATOM 517 O GLU A 36 2.151 4.793 5.735 1.00 0.00 O ATOM 518 CB GLU A 36 4.738 6.007 4.744 1.00 0.00 C ATOM 519 CG GLU A 36 5.309 7.417 4.737 1.00 0.00 C ATOM 520 CD GLU A 36 6.751 7.466 5.200 1.00 0.00 C ATOM 521 OE1 GLU A 36 7.653 7.248 4.362 1.00 0.00 O ATOM 522 OE2 GLU A 36 6.980 7.726 6.400 1.00 0.00 O ATOM 0 H GLU A 36 4.244 3.391 6.021 1.00 0.00 H new ATOM 0 HA GLU A 36 4.909 6.103 6.887 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.450 5.335 4.265 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.829 5.990 4.142 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.241 7.827 3.729 1.00 0.00 H new ATOM 0 HG3 GLU A 36 4.703 8.053 5.382 1.00 0.00 H new ATOM 529 N VAL A 37 2.477 6.375 7.305 1.00 0.00 N ATOM 530 CA VAL A 37 1.057 6.507 7.616 1.00 0.00 C ATOM 531 C VAL A 37 0.577 7.940 7.384 1.00 0.00 C ATOM 532 O VAL A 37 0.823 8.830 8.201 1.00 0.00 O ATOM 533 CB VAL A 37 0.750 6.085 9.073 1.00 0.00 C ATOM 534 CG1 VAL A 37 -0.753 5.973 9.295 1.00 0.00 C ATOM 535 CG2 VAL A 37 1.441 4.772 9.416 1.00 0.00 C ATOM 0 H VAL A 37 3.087 6.984 7.850 1.00 0.00 H new ATOM 0 HA VAL A 37 0.520 5.838 6.944 1.00 0.00 H new ATOM 0 HB VAL A 37 1.139 6.857 9.737 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.947 5.675 10.325 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.222 6.938 9.101 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.166 5.226 8.617 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.210 4.497 10.445 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.090 3.989 8.744 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.519 4.888 9.305 1.00 0.00 H new ATOM 545 N PHE A 38 -0.114 8.152 6.264 1.00 0.00 N ATOM 546 CA PHE A 38 -0.642 9.470 5.915 1.00 0.00 C ATOM 547 C PHE A 38 -2.140 9.545 6.219 1.00 0.00 C ATOM 548 O PHE A 38 -2.817 8.519 6.305 1.00 0.00 O ATOM 549 CB PHE A 38 -0.385 9.773 4.435 1.00 0.00 C ATOM 550 CG PHE A 38 0.981 10.341 4.166 1.00 0.00 C ATOM 551 CD1 PHE A 38 2.057 9.506 3.901 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.192 11.711 4.182 1.00 0.00 C ATOM 553 CE1 PHE A 38 3.313 10.027 3.656 1.00 0.00 C ATOM 554 CE2 PHE A 38 2.446 12.237 3.938 1.00 0.00 C ATOM 555 CZ PHE A 38 3.508 11.394 3.676 1.00 0.00 C ATOM 0 H PHE A 38 -0.322 7.424 5.580 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.128 10.218 6.519 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.508 8.856 3.858 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.138 10.477 4.080 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.911 8.436 3.886 1.00 0.00 H new ATOM 0 HD2 PHE A 38 0.366 12.375 4.388 1.00 0.00 H new ATOM 0 HE1 PHE A 38 4.141 9.366 3.449 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.596 13.306 3.952 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.489 11.803 3.487 1.00 0.00 H new ATOM 565 N CYS A 39 -2.650 10.764 6.394 1.00 0.00 N ATOM 566 CA CYS A 39 -4.063 10.969 6.702 1.00 0.00 C ATOM 567 C CYS A 39 -4.607 12.222 6.014 1.00 0.00 C ATOM 568 O CYS A 39 -3.867 13.179 5.775 1.00 0.00 O ATOM 569 CB CYS A 39 -4.249 11.081 8.218 1.00 0.00 C ATOM 570 SG CYS A 39 -5.961 11.332 8.744 1.00 0.00 S ATOM 0 H CYS A 39 -2.105 11.624 6.328 1.00 0.00 H new ATOM 0 HA CYS A 39 -4.622 10.112 6.327 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -3.867 10.174 8.687 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -3.643 11.909 8.586 1.00 0.00 H new ATOM 0 HG CYS A 39 -6.757 10.661 7.966 1.00 0.00 H new ATOM 576 N HIS A 40 -5.906 12.208 5.703 1.00 0.00 N ATOM 577 CA HIS A 40 -6.558 13.343 5.049 1.00 0.00 C ATOM 578 C HIS A 40 -7.629 13.946 5.954 1.00 0.00 C ATOM 579 O HIS A 40 -8.576 13.262 6.336 1.00 0.00 O ATOM 580 CB HIS A 40 -7.198 12.909 3.726 1.00 0.00 C ATOM 581 CG HIS A 40 -6.310 12.064 2.867 1.00 0.00 C ATOM 582 ND1 HIS A 40 -6.584 10.747 2.565 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.148 12.357 2.238 1.00 0.00 C ATOM 584 CE1 HIS A 40 -5.630 10.267 1.790 1.00 0.00 C ATOM 585 NE2 HIS A 40 -4.746 11.223 1.577 1.00 0.00 N ATOM 0 H HIS A 40 -6.527 11.421 5.894 1.00 0.00 H new ATOM 0 HA HIS A 40 -5.795 14.095 4.849 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.112 12.355 3.941 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -7.488 13.798 3.166 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.633 13.306 2.253 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -5.581 9.262 1.397 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -3.901 11.134 1.013 1.00 0.00 H new ATOM 594 N PRO A 41 -7.494 15.237 6.312 1.00 0.00 N ATOM 595 CA PRO A 41 -8.461 15.924 7.181 1.00 0.00 C ATOM 596 C PRO A 41 -9.774 16.268 6.468 1.00 0.00 C ATOM 597 O PRO A 41 -10.837 16.275 7.087 1.00 0.00 O ATOM 598 CB PRO A 41 -7.721 17.202 7.581 1.00 0.00 C ATOM 599 CG PRO A 41 -6.784 17.469 6.453 1.00 0.00 C ATOM 600 CD PRO A 41 -6.386 16.125 5.908 1.00 0.00 C ATOM 0 HA PRO A 41 -8.762 15.298 8.021 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.413 18.031 7.725 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.183 17.070 8.520 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -7.264 18.074 5.684 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.911 18.024 6.796 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -6.270 16.152 4.825 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.435 15.791 6.323 1.00 0.00 H new ATOM 608 N VAL A 42 -9.687 16.567 5.169 1.00 0.00 N ATOM 609 CA VAL A 42 -10.865 16.928 4.374 1.00 0.00 C ATOM 610 C VAL A 42 -11.876 15.782 4.286 1.00 0.00 C ATOM 611 O VAL A 42 -13.080 15.993 4.439 1.00 0.00 O ATOM 612 CB VAL A 42 -10.474 17.367 2.942 1.00 0.00 C ATOM 613 CG1 VAL A 42 -9.771 18.716 2.970 1.00 0.00 C ATOM 614 CG2 VAL A 42 -9.603 16.315 2.260 1.00 0.00 C ATOM 0 H VAL A 42 -8.812 16.566 4.645 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.331 17.766 4.893 1.00 0.00 H new ATOM 0 HB VAL A 42 -11.389 17.468 2.359 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.504 19.008 1.954 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -10.437 19.464 3.400 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.868 18.643 3.576 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.345 16.652 1.256 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.691 16.167 2.839 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -10.150 15.374 2.198 1.00 0.00 H new ATOM 624 N THR A 43 -11.380 14.572 4.031 1.00 0.00 N ATOM 625 CA THR A 43 -12.239 13.392 3.913 1.00 0.00 C ATOM 626 C THR A 43 -12.152 12.493 5.154 1.00 0.00 C ATOM 627 O THR A 43 -12.929 11.547 5.292 1.00 0.00 O ATOM 628 CB THR A 43 -11.867 12.581 2.666 1.00 0.00 C ATOM 629 OG1 THR A 43 -10.937 13.284 1.855 1.00 0.00 O ATOM 630 CG2 THR A 43 -13.061 12.226 1.800 1.00 0.00 C ATOM 0 H THR A 43 -10.386 14.382 3.902 1.00 0.00 H new ATOM 0 HA THR A 43 -13.265 13.750 3.825 1.00 0.00 H new ATOM 0 HB THR A 43 -11.430 11.659 3.049 1.00 0.00 H new ATOM 0 HG1 THR A 43 -10.267 12.659 1.509 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.726 11.653 0.936 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.766 11.630 2.379 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.550 13.140 1.462 1.00 0.00 H new ATOM 638 N ASP A 44 -11.196 12.781 6.044 1.00 0.00 N ATOM 639 CA ASP A 44 -10.997 11.992 7.265 1.00 0.00 C ATOM 640 C ASP A 44 -10.625 10.542 6.932 1.00 0.00 C ATOM 641 O ASP A 44 -10.995 9.611 7.653 1.00 0.00 O ATOM 642 CB ASP A 44 -12.249 12.037 8.151 1.00 0.00 C ATOM 643 CG ASP A 44 -12.155 13.104 9.226 1.00 0.00 C ATOM 644 OD1 ASP A 44 -12.539 14.260 8.949 1.00 0.00 O ATOM 645 OD2 ASP A 44 -11.693 12.784 10.341 1.00 0.00 O ATOM 0 H ASP A 44 -10.545 13.559 5.941 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.168 12.435 7.817 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.124 12.226 7.530 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.395 11.064 8.620 1.00 0.00 H new ATOM 650 N GLN A 45 -9.880 10.362 5.840 1.00 0.00 N ATOM 651 CA GLN A 45 -9.442 9.035 5.410 1.00 0.00 C ATOM 652 C GLN A 45 -8.090 8.685 6.033 1.00 0.00 C ATOM 653 O GLN A 45 -7.459 9.528 6.675 1.00 0.00 O ATOM 654 CB GLN A 45 -9.345 8.980 3.881 1.00 0.00 C ATOM 655 CG GLN A 45 -10.431 8.144 3.220 1.00 0.00 C ATOM 656 CD GLN A 45 -11.834 8.606 3.575 1.00 0.00 C ATOM 657 OE1 GLN A 45 -12.326 8.345 4.672 1.00 0.00 O ATOM 658 NE2 GLN A 45 -12.488 9.294 2.643 1.00 0.00 N ATOM 0 H GLN A 45 -9.567 11.122 5.236 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.178 8.305 5.746 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.393 9.995 3.488 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.371 8.576 3.604 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -10.304 8.183 2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.311 7.102 3.517 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -12.043 9.489 1.746 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -13.435 9.627 2.825 1.00 0.00 H new ATOM 667 N SER A 46 -7.648 7.440 5.843 1.00 0.00 N ATOM 668 CA SER A 46 -6.368 6.988 6.389 1.00 0.00 C ATOM 669 C SER A 46 -5.594 6.147 5.373 1.00 0.00 C ATOM 670 O SER A 46 -6.140 5.211 4.782 1.00 0.00 O ATOM 671 CB SER A 46 -6.594 6.181 7.669 1.00 0.00 C ATOM 672 OG SER A 46 -6.905 7.028 8.762 1.00 0.00 O ATOM 0 H SER A 46 -8.156 6.729 5.317 1.00 0.00 H new ATOM 0 HA SER A 46 -5.774 7.872 6.620 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.405 5.470 7.515 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.700 5.601 7.898 1.00 0.00 H new ATOM 0 HG SER A 46 -7.046 6.486 9.566 1.00 0.00 H new ATOM 678 N LEU A 47 -4.318 6.489 5.180 1.00 0.00 N ATOM 679 CA LEU A 47 -3.450 5.776 4.241 1.00 0.00 C ATOM 680 C LEU A 47 -2.219 5.216 4.955 1.00 0.00 C ATOM 681 O LEU A 47 -1.465 5.966 5.574 1.00 0.00 O ATOM 682 CB LEU A 47 -3.004 6.713 3.113 1.00 0.00 C ATOM 683 CG LEU A 47 -3.867 6.681 1.849 1.00 0.00 C ATOM 684 CD1 LEU A 47 -5.336 6.891 2.189 1.00 0.00 C ATOM 685 CD2 LEU A 47 -3.393 7.734 0.856 1.00 0.00 C ATOM 0 H LEU A 47 -3.861 7.261 5.665 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.019 4.947 3.820 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.990 7.733 3.496 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.980 6.461 2.839 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.763 5.698 1.390 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.929 6.864 1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.670 6.101 2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.462 7.859 2.675 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.017 7.699 -0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.466 8.722 1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.356 7.536 0.583 1.00 0.00 H new ATOM 697 N ILE A 48 -2.016 3.900 4.864 1.00 0.00 N ATOM 698 CA ILE A 48 -0.868 3.260 5.508 1.00 0.00 C ATOM 699 C ILE A 48 -0.073 2.401 4.521 1.00 0.00 C ATOM 700 O ILE A 48 -0.647 1.631 3.749 1.00 0.00 O ATOM 701 CB ILE A 48 -1.299 2.385 6.706 1.00 0.00 C ATOM 702 CG1 ILE A 48 -2.215 3.175 7.649 1.00 0.00 C ATOM 703 CG2 ILE A 48 -0.077 1.874 7.460 1.00 0.00 C ATOM 704 CD1 ILE A 48 -3.359 2.356 8.207 1.00 0.00 C ATOM 0 H ILE A 48 -2.627 3.261 4.355 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.231 4.067 5.870 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.854 1.529 6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.622 3.566 8.476 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -2.621 4.033 7.114 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -0.399 1.259 8.301 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.541 1.277 6.789 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.502 2.720 7.830 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.965 2.979 8.865 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.976 1.987 7.388 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.961 1.512 8.771 1.00 0.00 H new ATOM 716 N VAL A 49 1.253 2.544 4.561 1.00 0.00 N ATOM 717 CA VAL A 49 2.152 1.792 3.684 1.00 0.00 C ATOM 718 C VAL A 49 3.293 1.169 4.490 1.00 0.00 C ATOM 719 O VAL A 49 4.175 1.880 4.973 1.00 0.00 O ATOM 720 CB VAL A 49 2.754 2.695 2.585 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.525 1.867 1.566 1.00 0.00 C ATOM 722 CG2 VAL A 49 1.666 3.516 1.905 1.00 0.00 C ATOM 0 H VAL A 49 1.732 3.180 5.198 1.00 0.00 H new ATOM 0 HA VAL A 49 1.560 1.007 3.213 1.00 0.00 H new ATOM 0 HB VAL A 49 3.453 3.385 3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.940 2.524 0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.335 1.336 2.066 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.853 1.147 1.099 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.112 4.145 1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.936 2.847 1.449 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.170 4.145 2.644 1.00 0.00 H new ATOM 732 N GLU A 50 3.270 -0.157 4.636 1.00 0.00 N ATOM 733 CA GLU A 50 4.305 -0.863 5.392 1.00 0.00 C ATOM 734 C GLU A 50 5.131 -1.779 4.490 1.00 0.00 C ATOM 735 O GLU A 50 4.591 -2.439 3.598 1.00 0.00 O ATOM 736 CB GLU A 50 3.675 -1.684 6.521 1.00 0.00 C ATOM 737 CG GLU A 50 4.583 -1.852 7.734 1.00 0.00 C ATOM 738 CD GLU A 50 4.197 -3.033 8.610 1.00 0.00 C ATOM 739 OE1 GLU A 50 3.000 -3.389 8.646 1.00 0.00 O ATOM 740 OE2 GLU A 50 5.097 -3.602 9.264 1.00 0.00 O ATOM 0 H GLU A 50 2.549 -0.761 4.242 1.00 0.00 H new ATOM 0 HA GLU A 50 4.970 -0.112 5.817 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.749 -1.203 6.835 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.409 -2.669 6.138 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.611 -1.979 7.396 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.554 -0.940 8.331 1.00 0.00 H new ATOM 747 N LEU A 51 6.440 -1.819 4.738 1.00 0.00 N ATOM 748 CA LEU A 51 7.346 -2.662 3.961 1.00 0.00 C ATOM 749 C LEU A 51 7.534 -4.019 4.634 1.00 0.00 C ATOM 750 O LEU A 51 7.681 -4.104 5.855 1.00 0.00 O ATOM 751 CB LEU A 51 8.701 -1.974 3.781 1.00 0.00 C ATOM 752 CG LEU A 51 9.062 -1.621 2.337 1.00 0.00 C ATOM 753 CD1 LEU A 51 8.242 -0.433 1.855 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.550 -1.326 2.218 1.00 0.00 C ATOM 0 H LEU A 51 6.896 -1.277 5.472 1.00 0.00 H new ATOM 0 HA LEU A 51 6.900 -2.820 2.979 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.709 -1.060 4.375 1.00 0.00 H new ATOM 0 HB3 LEU A 51 9.478 -2.624 4.185 1.00 0.00 H new ATOM 0 HG LEU A 51 8.828 -2.478 1.705 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.513 -0.197 0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 51 7.181 -0.679 1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.443 0.430 2.490 1.00 0.00 H new ATOM 0 HD21 LEU A 51 10.790 -1.077 1.184 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.807 -0.486 2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.120 -2.204 2.521 1.00 0.00 H new ATOM 766 N LEU A 52 7.525 -5.074 3.824 1.00 0.00 N ATOM 767 CA LEU A 52 7.691 -6.438 4.325 1.00 0.00 C ATOM 768 C LEU A 52 8.653 -7.235 3.444 1.00 0.00 C ATOM 769 O LEU A 52 9.077 -6.763 2.388 1.00 0.00 O ATOM 770 CB LEU A 52 6.338 -7.155 4.389 1.00 0.00 C ATOM 771 CG LEU A 52 5.272 -6.470 5.251 1.00 0.00 C ATOM 772 CD1 LEU A 52 4.469 -5.475 4.426 1.00 0.00 C ATOM 773 CD2 LEU A 52 4.351 -7.504 5.882 1.00 0.00 C ATOM 0 H LEU A 52 7.404 -5.011 2.813 1.00 0.00 H new ATOM 0 HA LEU A 52 8.111 -6.373 5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.951 -7.256 3.375 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.498 -8.163 4.771 1.00 0.00 H new ATOM 0 HG LEU A 52 5.777 -5.924 6.048 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.718 -5.001 5.058 1.00 0.00 H new ATOM 0 HD12 LEU A 52 5.137 -4.714 4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.976 -5.997 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.600 -7.000 6.491 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.857 -8.078 5.098 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.935 -8.176 6.510 1.00 0.00 H new ATOM 785 N GLU A 53 8.986 -8.449 3.883 1.00 0.00 N ATOM 786 CA GLU A 53 9.889 -9.316 3.134 1.00 0.00 C ATOM 787 C GLU A 53 9.171 -10.582 2.672 1.00 0.00 C ATOM 788 O GLU A 53 8.441 -11.209 3.443 1.00 0.00 O ATOM 789 CB GLU A 53 11.105 -9.685 3.988 1.00 0.00 C ATOM 790 CG GLU A 53 12.321 -8.804 3.732 1.00 0.00 C ATOM 791 CD GLU A 53 13.521 -9.590 3.239 1.00 0.00 C ATOM 792 OE1 GLU A 53 13.523 -9.991 2.059 1.00 0.00 O ATOM 793 OE2 GLU A 53 14.458 -9.803 4.034 1.00 0.00 O ATOM 0 H GLU A 53 8.642 -8.852 4.755 1.00 0.00 H new ATOM 0 HA GLU A 53 10.227 -8.771 2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 53 10.833 -9.617 5.041 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.372 -10.724 3.795 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.064 -8.042 2.996 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.587 -8.282 4.652 1.00 0.00 H new ATOM 800 N LEU A 54 9.388 -10.949 1.406 1.00 0.00 N ATOM 801 CA LEU A 54 8.773 -12.139 0.815 1.00 0.00 C ATOM 802 C LEU A 54 8.975 -13.365 1.709 1.00 0.00 C ATOM 803 O LEU A 54 10.096 -13.858 1.861 1.00 0.00 O ATOM 804 CB LEU A 54 9.369 -12.401 -0.572 1.00 0.00 C ATOM 805 CG LEU A 54 8.350 -12.645 -1.688 1.00 0.00 C ATOM 806 CD1 LEU A 54 7.992 -11.338 -2.381 1.00 0.00 C ATOM 807 CD2 LEU A 54 8.896 -13.651 -2.692 1.00 0.00 C ATOM 0 H LEU A 54 9.991 -10.433 0.766 1.00 0.00 H new ATOM 0 HA LEU A 54 7.702 -11.958 0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.989 -11.549 -0.849 1.00 0.00 H new ATOM 0 HB3 LEU A 54 10.027 -13.267 -0.508 1.00 0.00 H new ATOM 0 HG LEU A 54 7.443 -13.056 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.267 -11.532 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.562 -10.647 -1.655 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.890 -10.897 -2.813 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.161 -13.815 -3.480 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.817 -13.265 -3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.102 -14.594 -2.186 1.00 0.00 H new ATOM 819 N GLN A 55 7.884 -13.849 2.302 1.00 0.00 N ATOM 820 CA GLN A 55 7.940 -15.010 3.187 1.00 0.00 C ATOM 821 C GLN A 55 7.540 -16.286 2.446 1.00 0.00 C ATOM 822 O GLN A 55 6.435 -16.379 1.907 1.00 0.00 O ATOM 823 CB GLN A 55 7.028 -14.794 4.396 1.00 0.00 C ATOM 824 CG GLN A 55 7.061 -15.930 5.410 1.00 0.00 C ATOM 825 CD GLN A 55 8.437 -16.141 6.017 1.00 0.00 C ATOM 826 OE1 GLN A 55 9.116 -15.185 6.390 1.00 0.00 O ATOM 827 NE2 GLN A 55 8.857 -17.398 6.119 1.00 0.00 N ATOM 0 H GLN A 55 6.951 -13.454 2.185 1.00 0.00 H new ATOM 0 HA GLN A 55 8.968 -15.126 3.531 1.00 0.00 H new ATOM 0 HB2 GLN A 55 7.316 -13.868 4.894 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.004 -14.663 4.046 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.347 -15.720 6.206 1.00 0.00 H new ATOM 0 HG3 GLN A 55 6.738 -16.852 4.926 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.263 -18.162 5.798 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.774 -17.599 6.519 1.00 0.00 H new ATOM 836 N ALA A 56 8.452 -17.262 2.429 1.00 0.00 N ATOM 837 CA ALA A 56 8.221 -18.544 1.760 1.00 0.00 C ATOM 838 C ALA A 56 7.995 -18.357 0.259 1.00 0.00 C ATOM 839 O ALA A 56 8.929 -18.489 -0.532 1.00 0.00 O ATOM 840 CB ALA A 56 7.055 -19.288 2.399 1.00 0.00 C ATOM 0 H ALA A 56 9.366 -17.186 2.876 1.00 0.00 H new ATOM 0 HA ALA A 56 9.119 -19.149 1.885 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.903 -20.237 1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.275 -19.476 3.450 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.151 -18.684 2.320 1.00 0.00 H new ATOM 846 N HIS A 57 6.755 -18.049 -0.129 1.00 0.00 N ATOM 847 CA HIS A 57 6.417 -17.844 -1.538 1.00 0.00 C ATOM 848 C HIS A 57 4.989 -17.312 -1.696 1.00 0.00 C ATOM 849 O HIS A 57 4.281 -17.675 -2.639 1.00 0.00 O ATOM 850 CB HIS A 57 6.581 -19.157 -2.318 1.00 0.00 C ATOM 851 CG HIS A 57 5.927 -20.332 -1.661 1.00 0.00 C ATOM 852 ND1 HIS A 57 4.615 -20.687 -1.886 1.00 0.00 N ATOM 853 CD2 HIS A 57 6.415 -21.237 -0.782 1.00 0.00 C ATOM 854 CE1 HIS A 57 4.324 -21.762 -1.174 1.00 0.00 C ATOM 855 NE2 HIS A 57 5.400 -22.115 -0.493 1.00 0.00 N ATOM 0 H HIS A 57 5.970 -17.936 0.512 1.00 0.00 H new ATOM 0 HA HIS A 57 7.101 -17.098 -1.943 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.163 -19.031 -3.317 1.00 0.00 H new ATOM 0 HB3 HIS A 57 7.644 -19.366 -2.442 1.00 0.00 H new ATOM 0 HD2 HIS A 57 7.418 -21.264 -0.382 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.369 -22.266 -1.153 1.00 0.00 H new ATOM 0 HE2 HIS A 57 5.466 -22.910 0.143 1.00 0.00 H new ATOM 864 N VAL A 58 4.573 -16.448 -0.769 1.00 0.00 N ATOM 865 CA VAL A 58 3.235 -15.866 -0.802 1.00 0.00 C ATOM 866 C VAL A 58 3.255 -14.507 -1.497 1.00 0.00 C ATOM 867 O VAL A 58 3.719 -13.518 -0.928 1.00 0.00 O ATOM 868 CB VAL A 58 2.649 -15.707 0.618 1.00 0.00 C ATOM 869 CG1 VAL A 58 1.159 -15.407 0.553 1.00 0.00 C ATOM 870 CG2 VAL A 58 2.918 -16.955 1.454 1.00 0.00 C ATOM 0 H VAL A 58 5.147 -16.137 0.015 1.00 0.00 H new ATOM 0 HA VAL A 58 2.600 -16.552 -1.363 1.00 0.00 H new ATOM 0 HB VAL A 58 3.143 -14.864 1.101 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.765 -15.299 1.564 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.998 -14.482 -0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.645 -16.225 0.049 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.497 -16.823 2.451 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.456 -17.819 0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.993 -17.116 1.532 1.00 0.00 H new ATOM 880 N ARG A 59 2.762 -14.470 -2.736 1.00 0.00 N ATOM 881 CA ARG A 59 2.739 -13.233 -3.515 1.00 0.00 C ATOM 882 C ARG A 59 1.497 -13.157 -4.408 1.00 0.00 C ATOM 883 O ARG A 59 0.877 -14.177 -4.713 1.00 0.00 O ATOM 884 CB ARG A 59 4.000 -13.118 -4.384 1.00 0.00 C ATOM 885 CG ARG A 59 5.243 -13.749 -3.767 1.00 0.00 C ATOM 886 CD ARG A 59 6.307 -14.033 -4.817 1.00 0.00 C ATOM 887 NE ARG A 59 6.716 -15.438 -4.824 1.00 0.00 N ATOM 888 CZ ARG A 59 6.074 -16.400 -5.493 1.00 0.00 C ATOM 889 NH1 ARG A 59 4.978 -16.121 -6.197 1.00 0.00 N ATOM 890 NH2 ARG A 59 6.527 -17.648 -5.455 1.00 0.00 N ATOM 0 H ARG A 59 2.375 -15.280 -3.220 1.00 0.00 H new ATOM 0 HA ARG A 59 2.709 -12.404 -2.808 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.808 -13.589 -5.348 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.199 -12.064 -4.578 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.650 -13.083 -3.006 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.970 -14.677 -3.265 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.925 -13.763 -5.801 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.177 -13.404 -4.629 1.00 0.00 H new ATOM 0 HE ARG A 59 7.542 -15.699 -4.285 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.622 -15.166 -6.229 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.495 -16.863 -6.704 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.364 -17.871 -4.916 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.038 -18.384 -5.965 1.00 0.00 H new ATOM 904 N GLY A 60 1.153 -11.938 -4.834 1.00 0.00 N ATOM 905 CA GLY A 60 0.001 -11.738 -5.699 1.00 0.00 C ATOM 906 C GLY A 60 -1.322 -11.881 -4.970 1.00 0.00 C ATOM 907 O GLY A 60 -1.463 -11.432 -3.833 1.00 0.00 O ATOM 0 H GLY A 60 1.656 -11.084 -4.593 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.057 -10.745 -6.146 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.038 -12.458 -6.516 1.00 0.00 H new ATOM 911 N GLU A 61 -2.295 -12.507 -5.636 1.00 0.00 N ATOM 912 CA GLU A 61 -3.621 -12.715 -5.051 1.00 0.00 C ATOM 913 C GLU A 61 -3.515 -13.511 -3.751 1.00 0.00 C ATOM 914 O GLU A 61 -4.267 -13.272 -2.802 1.00 0.00 O ATOM 915 CB GLU A 61 -4.534 -13.448 -6.036 1.00 0.00 C ATOM 916 CG GLU A 61 -5.989 -13.482 -5.597 1.00 0.00 C ATOM 917 CD GLU A 61 -6.911 -14.058 -6.653 1.00 0.00 C ATOM 918 OE1 GLU A 61 -7.059 -15.297 -6.700 1.00 0.00 O ATOM 919 OE2 GLU A 61 -7.489 -13.269 -7.429 1.00 0.00 O ATOM 0 H GLU A 61 -2.189 -12.878 -6.580 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.052 -11.738 -4.832 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.467 -12.965 -7.011 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.176 -14.470 -6.161 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -6.074 -14.074 -4.686 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -6.313 -12.471 -5.352 1.00 0.00 H new ATOM 926 N ALA A 62 -2.566 -14.453 -3.715 1.00 0.00 N ATOM 927 CA ALA A 62 -2.339 -15.281 -2.535 1.00 0.00 C ATOM 928 C ALA A 62 -1.808 -14.432 -1.383 1.00 0.00 C ATOM 929 O ALA A 62 -2.208 -14.612 -0.234 1.00 0.00 O ATOM 930 CB ALA A 62 -1.360 -16.407 -2.849 1.00 0.00 C ATOM 0 H ALA A 62 -1.942 -14.658 -4.496 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.291 -15.721 -2.238 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.204 -17.013 -1.956 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.766 -17.031 -3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.409 -15.983 -3.170 1.00 0.00 H new ATOM 936 N ALA A 63 -0.904 -13.502 -1.707 1.00 0.00 N ATOM 937 CA ALA A 63 -0.314 -12.613 -0.708 1.00 0.00 C ATOM 938 C ALA A 63 -1.383 -11.755 -0.035 1.00 0.00 C ATOM 939 O ALA A 63 -1.324 -11.510 1.170 1.00 0.00 O ATOM 940 CB ALA A 63 0.754 -11.727 -1.340 1.00 0.00 C ATOM 0 H ALA A 63 -0.566 -13.347 -2.657 1.00 0.00 H new ATOM 0 HA ALA A 63 0.154 -13.234 0.055 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.181 -11.073 -0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.540 -12.351 -1.764 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.305 -11.123 -2.128 1.00 0.00 H new ATOM 946 N ALA A 64 -2.358 -11.297 -0.825 1.00 0.00 N ATOM 947 CA ALA A 64 -3.441 -10.464 -0.306 1.00 0.00 C ATOM 948 C ALA A 64 -4.244 -11.201 0.761 1.00 0.00 C ATOM 949 O ALA A 64 -4.378 -10.719 1.885 1.00 0.00 O ATOM 950 CB ALA A 64 -4.353 -10.005 -1.438 1.00 0.00 C ATOM 0 H ALA A 64 -2.418 -11.490 -1.825 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.993 -9.586 0.159 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.153 -9.386 -1.032 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.776 -9.425 -2.158 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.783 -10.875 -1.934 1.00 0.00 H new ATOM 956 N ARG A 65 -4.778 -12.372 0.406 1.00 0.00 N ATOM 957 CA ARG A 65 -5.569 -13.172 1.342 1.00 0.00 C ATOM 958 C ARG A 65 -4.727 -13.605 2.543 1.00 0.00 C ATOM 959 O ARG A 65 -5.183 -13.536 3.685 1.00 0.00 O ATOM 960 CB ARG A 65 -6.152 -14.403 0.640 1.00 0.00 C ATOM 961 CG ARG A 65 -7.521 -14.160 0.020 1.00 0.00 C ATOM 962 CD ARG A 65 -7.741 -15.032 -1.205 1.00 0.00 C ATOM 963 NE ARG A 65 -8.833 -14.538 -2.041 1.00 0.00 N ATOM 964 CZ ARG A 65 -8.708 -13.534 -2.913 1.00 0.00 C ATOM 965 NH1 ARG A 65 -7.545 -12.901 -3.057 1.00 0.00 N ATOM 966 NH2 ARG A 65 -9.753 -13.157 -3.642 1.00 0.00 N ATOM 0 H ARG A 65 -4.677 -12.786 -0.521 1.00 0.00 H new ATOM 0 HA ARG A 65 -6.388 -12.550 1.702 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -5.462 -14.727 -0.139 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -6.228 -15.219 1.359 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.297 -14.365 0.758 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -7.614 -13.110 -0.258 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.824 -15.070 -1.792 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -7.959 -16.052 -0.889 1.00 0.00 H new ATOM 0 HE ARG A 65 -9.745 -14.987 -1.953 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.739 -13.182 -2.498 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -7.460 -12.136 -3.726 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.648 -13.634 -3.535 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -9.660 -12.391 -4.309 1.00 0.00 H new ATOM 980 N TYR A 66 -3.495 -14.047 2.276 1.00 0.00 N ATOM 981 CA TYR A 66 -2.586 -14.487 3.332 1.00 0.00 C ATOM 982 C TYR A 66 -2.382 -13.381 4.369 1.00 0.00 C ATOM 983 O TYR A 66 -2.525 -13.613 5.569 1.00 0.00 O ATOM 984 CB TYR A 66 -1.240 -14.903 2.731 1.00 0.00 C ATOM 985 CG TYR A 66 -0.242 -15.434 3.742 1.00 0.00 C ATOM 986 CD1 TYR A 66 -0.474 -16.626 4.418 1.00 0.00 C ATOM 987 CD2 TYR A 66 0.934 -14.745 4.014 1.00 0.00 C ATOM 988 CE1 TYR A 66 0.439 -17.119 5.332 1.00 0.00 C ATOM 989 CE2 TYR A 66 1.852 -15.231 4.927 1.00 0.00 C ATOM 990 CZ TYR A 66 1.599 -16.415 5.586 1.00 0.00 C ATOM 991 OH TYR A 66 2.512 -16.905 6.493 1.00 0.00 O ATOM 0 H TYR A 66 -3.106 -14.109 1.335 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.032 -15.347 3.832 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -1.414 -15.668 1.974 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.802 -14.045 2.222 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.383 -17.177 4.226 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.134 -13.814 3.504 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.246 -18.050 5.844 1.00 0.00 H new ATOM 0 HE2 TYR A 66 2.763 -14.685 5.123 1.00 0.00 H new ATOM 0 HH TYR A 66 3.273 -16.291 6.555 1.00 0.00 H new ATOM 1001 N HIS A 67 -2.051 -12.179 3.895 1.00 0.00 N ATOM 1002 CA HIS A 67 -1.832 -11.039 4.784 1.00 0.00 C ATOM 1003 C HIS A 67 -3.153 -10.545 5.377 1.00 0.00 C ATOM 1004 O HIS A 67 -3.191 -10.075 6.514 1.00 0.00 O ATOM 1005 CB HIS A 67 -1.131 -9.899 4.039 1.00 0.00 C ATOM 1006 CG HIS A 67 0.347 -10.100 3.896 1.00 0.00 C ATOM 1007 ND1 HIS A 67 1.214 -10.105 4.969 1.00 0.00 N ATOM 1008 CD2 HIS A 67 1.112 -10.305 2.797 1.00 0.00 C ATOM 1009 CE1 HIS A 67 2.447 -10.302 4.537 1.00 0.00 C ATOM 1010 NE2 HIS A 67 2.413 -10.428 3.222 1.00 0.00 N ATOM 0 H HIS A 67 -1.929 -11.971 2.904 1.00 0.00 H new ATOM 0 HA HIS A 67 -1.190 -11.371 5.600 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.574 -9.797 3.048 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -1.313 -8.963 4.568 1.00 0.00 H new ATOM 0 HD2 HIS A 67 0.764 -10.361 1.776 1.00 0.00 H new ATOM 0 HE1 HIS A 67 3.332 -10.352 5.154 1.00 0.00 H new ATOM 0 HE2 HIS A 67 3.221 -10.590 2.621 1.00 0.00 H new ATOM 1019 N PHE A 68 -4.235 -10.662 4.602 1.00 0.00 N ATOM 1020 CA PHE A 68 -5.558 -10.234 5.056 1.00 0.00 C ATOM 1021 C PHE A 68 -5.951 -10.958 6.342 1.00 0.00 C ATOM 1022 O PHE A 68 -6.388 -10.330 7.305 1.00 0.00 O ATOM 1023 CB PHE A 68 -6.610 -10.495 3.973 1.00 0.00 C ATOM 1024 CG PHE A 68 -7.930 -9.818 4.236 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -8.835 -10.355 5.139 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -8.261 -8.643 3.580 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -10.045 -9.731 5.381 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -9.469 -8.015 3.821 1.00 0.00 C ATOM 1029 CZ PHE A 68 -10.361 -8.560 4.721 1.00 0.00 C ATOM 0 H PHE A 68 -4.219 -11.049 3.659 1.00 0.00 H new ATOM 0 HA PHE A 68 -5.513 -9.163 5.256 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -6.222 -10.155 3.013 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -6.773 -11.569 3.889 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -8.592 -11.270 5.659 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.568 -8.213 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -10.742 -10.159 6.086 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -9.714 -7.098 3.305 1.00 0.00 H new ATOM 0 HZ PHE A 68 -11.306 -8.071 4.909 1.00 0.00 H new ATOM 1039 N GLU A 69 -5.790 -12.284 6.349 1.00 0.00 N ATOM 1040 CA GLU A 69 -6.125 -13.096 7.519 1.00 0.00 C ATOM 1041 C GLU A 69 -5.290 -12.688 8.732 1.00 0.00 C ATOM 1042 O GLU A 69 -5.741 -12.810 9.872 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.917 -14.582 7.218 1.00 0.00 C ATOM 1044 CG GLU A 69 -7.012 -15.186 6.353 1.00 0.00 C ATOM 1045 CD GLU A 69 -8.056 -15.926 7.167 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -8.757 -15.272 7.968 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -8.173 -17.158 7.004 1.00 0.00 O ATOM 0 H GLU A 69 -5.430 -12.817 5.557 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.176 -12.924 7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.957 -14.712 6.718 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.864 -15.131 8.158 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.496 -14.395 5.781 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.565 -15.871 5.633 1.00 0.00 H new ATOM 1054 N ASP A 70 -4.076 -12.197 8.484 1.00 0.00 N ATOM 1055 CA ASP A 70 -3.191 -11.764 9.559 1.00 0.00 C ATOM 1056 C ASP A 70 -3.625 -10.407 10.123 1.00 0.00 C ATOM 1057 O ASP A 70 -3.345 -10.090 11.280 1.00 0.00 O ATOM 1058 CB ASP A 70 -1.744 -11.687 9.064 1.00 0.00 C ATOM 1059 CG ASP A 70 -0.743 -11.754 10.199 1.00 0.00 C ATOM 1060 OD1 ASP A 70 -0.654 -12.816 10.852 1.00 0.00 O ATOM 1061 OD2 ASP A 70 -0.046 -10.745 10.437 1.00 0.00 O ATOM 0 H ASP A 70 -3.685 -12.090 7.548 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.254 -12.502 10.359 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.556 -12.505 8.369 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.601 -10.759 8.511 1.00 0.00 H new ATOM 1066 N VAL A 71 -4.308 -9.607 9.302 1.00 0.00 N ATOM 1067 CA VAL A 71 -4.776 -8.288 9.727 1.00 0.00 C ATOM 1068 C VAL A 71 -6.199 -8.363 10.277 1.00 0.00 C ATOM 1069 O VAL A 71 -6.459 -7.942 11.405 1.00 0.00 O ATOM 1070 CB VAL A 71 -4.740 -7.273 8.565 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -5.074 -5.875 9.066 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -3.383 -7.294 7.870 1.00 0.00 C ATOM 0 H VAL A 71 -4.549 -9.850 8.341 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.100 -7.951 10.513 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.495 -7.561 7.834 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.044 -5.173 8.233 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.072 -5.874 9.505 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.346 -5.575 9.820 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.381 -6.571 7.054 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -2.603 -7.035 8.586 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.194 -8.291 7.472 1.00 0.00 H new ATOM 1082 N GLY A 72 -7.112 -8.902 9.470 1.00 0.00 N ATOM 1083 CA GLY A 72 -8.500 -9.029 9.885 1.00 0.00 C ATOM 1084 C GLY A 72 -8.767 -10.282 10.707 1.00 0.00 C ATOM 1085 O GLY A 72 -9.919 -10.587 11.017 1.00 0.00 O ATOM 0 H GLY A 72 -6.914 -9.254 8.533 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.780 -8.152 10.469 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -9.137 -9.039 9.001 1.00 0.00 H new ATOM 1089 N GLY A 73 -7.707 -11.015 11.058 1.00 0.00 N ATOM 1090 CA GLY A 73 -7.863 -12.230 11.842 1.00 0.00 C ATOM 1091 C GLY A 73 -7.165 -12.153 13.186 1.00 0.00 C ATOM 1092 O GLY A 73 -7.676 -12.657 14.187 1.00 0.00 O ATOM 0 H GLY A 73 -6.744 -10.787 10.812 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -8.924 -12.422 11.999 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -7.466 -13.074 11.279 1.00 0.00 H new ATOM 1096 N VAL A 74 -5.992 -11.524 13.214 1.00 0.00 N ATOM 1097 CA VAL A 74 -5.223 -11.389 14.448 1.00 0.00 C ATOM 1098 C VAL A 74 -5.728 -10.220 15.299 1.00 0.00 C ATOM 1099 O VAL A 74 -5.618 -10.247 16.525 1.00 0.00 O ATOM 1100 CB VAL A 74 -3.719 -11.208 14.153 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -2.914 -11.193 15.446 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -3.229 -12.309 13.219 1.00 0.00 C ATOM 0 H VAL A 74 -5.554 -11.100 12.396 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.361 -12.312 15.011 1.00 0.00 H new ATOM 0 HB VAL A 74 -3.575 -10.248 13.658 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.857 -11.064 15.215 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.251 -10.369 16.075 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.058 -12.135 15.975 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.167 -12.170 13.019 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -3.386 -13.280 13.688 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.784 -12.265 12.282 1.00 0.00 H new ATOM 1112 N GLN A 75 -6.287 -9.199 14.646 1.00 0.00 N ATOM 1113 CA GLN A 75 -6.812 -8.029 15.351 1.00 0.00 C ATOM 1114 C GLN A 75 -8.319 -7.889 15.125 1.00 0.00 C ATOM 1115 O GLN A 75 -8.754 -7.293 14.137 1.00 0.00 O ATOM 1116 CB GLN A 75 -6.093 -6.756 14.891 1.00 0.00 C ATOM 1117 CG GLN A 75 -4.658 -6.648 15.385 1.00 0.00 C ATOM 1118 CD GLN A 75 -3.727 -6.054 14.344 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -3.173 -4.971 14.536 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -3.549 -6.759 13.232 1.00 0.00 N ATOM 0 H GLN A 75 -6.387 -9.159 13.632 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.632 -8.170 16.417 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -6.096 -6.722 13.802 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -6.653 -5.888 15.238 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.632 -6.032 16.284 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.299 -7.638 15.666 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.027 -7.652 13.112 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -2.934 -6.407 12.498 1.00 0.00 H new ATOM 1129 N GLY A 76 -9.107 -8.444 16.049 1.00 0.00 N ATOM 1130 CA GLY A 76 -10.559 -8.375 15.941 1.00 0.00 C ATOM 1131 C GLY A 76 -11.076 -8.899 14.612 1.00 0.00 C ATOM 1132 O GLY A 76 -10.510 -9.838 14.046 1.00 0.00 O ATOM 0 H GLY A 76 -8.765 -8.941 16.871 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.007 -8.950 16.752 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.880 -7.341 16.068 1.00 0.00 H new ATOM 1136 N ALA A 77 -12.155 -8.285 14.115 1.00 0.00 N ATOM 1137 CA ALA A 77 -12.762 -8.678 12.844 1.00 0.00 C ATOM 1138 C ALA A 77 -13.256 -10.123 12.893 1.00 0.00 C ATOM 1139 O ALA A 77 -12.469 -11.058 12.746 1.00 0.00 O ATOM 1140 CB ALA A 77 -11.766 -8.485 11.709 1.00 0.00 C ATOM 0 H ALA A 77 -12.627 -7.509 14.579 1.00 0.00 H new ATOM 0 HA ALA A 77 -13.627 -8.040 12.663 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -12.227 -8.780 10.766 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.473 -7.437 11.657 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.884 -9.100 11.890 1.00 0.00 H new ATOM 1146 N ARG A 78 -14.561 -10.305 13.111 1.00 0.00 N ATOM 1147 CA ARG A 78 -15.133 -11.647 13.192 1.00 0.00 C ATOM 1148 C ARG A 78 -15.912 -12.035 11.933 1.00 0.00 C ATOM 1149 O ARG A 78 -16.040 -13.222 11.625 1.00 0.00 O ATOM 1150 CB ARG A 78 -16.030 -11.776 14.429 1.00 0.00 C ATOM 1151 CG ARG A 78 -15.252 -11.943 15.725 1.00 0.00 C ATOM 1152 CD ARG A 78 -16.149 -11.807 16.946 1.00 0.00 C ATOM 1153 NE ARG A 78 -15.578 -12.461 18.124 1.00 0.00 N ATOM 1154 CZ ARG A 78 -16.284 -12.820 19.201 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -17.594 -12.586 19.264 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -15.678 -13.416 20.221 1.00 0.00 N ATOM 0 H ARG A 78 -15.233 -9.548 13.233 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.296 -12.340 13.277 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -16.661 -10.891 14.505 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -16.694 -12.631 14.300 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.770 -12.921 15.736 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -14.459 -11.196 15.772 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -16.310 -10.751 17.161 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -17.125 -12.241 16.728 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.577 -12.656 18.123 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -18.068 -12.129 18.485 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -18.123 -12.864 20.091 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -14.675 -13.599 20.182 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -16.215 -13.691 21.044 1.00 0.00 H new ATOM 1170 N ALA A 79 -16.425 -11.046 11.209 1.00 0.00 N ATOM 1171 CA ALA A 79 -17.184 -11.309 9.986 1.00 0.00 C ATOM 1172 C ALA A 79 -16.651 -10.487 8.819 1.00 0.00 C ATOM 1173 O ALA A 79 -16.857 -9.275 8.763 1.00 0.00 O ATOM 1174 CB ALA A 79 -18.663 -11.019 10.204 1.00 0.00 C ATOM 0 H ALA A 79 -16.331 -10.058 11.444 1.00 0.00 H new ATOM 0 HA ALA A 79 -17.065 -12.364 9.739 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -19.213 -11.220 9.284 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -19.045 -11.656 11.002 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -18.792 -9.973 10.482 1.00 0.00 H new ATOM 1180 N VAL A 80 -15.963 -11.149 7.892 1.00 0.00 N ATOM 1181 CA VAL A 80 -15.399 -10.467 6.732 1.00 0.00 C ATOM 1182 C VAL A 80 -15.804 -11.145 5.423 1.00 0.00 C ATOM 1183 O VAL A 80 -15.676 -12.362 5.273 1.00 0.00 O ATOM 1184 CB VAL A 80 -13.858 -10.388 6.817 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -13.236 -11.777 6.767 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -13.305 -9.510 5.704 1.00 0.00 C ATOM 0 H VAL A 80 -15.784 -12.153 7.922 1.00 0.00 H new ATOM 0 HA VAL A 80 -15.806 -9.456 6.739 1.00 0.00 H new ATOM 0 HB VAL A 80 -13.595 -9.937 7.774 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -12.151 -11.692 6.829 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.602 -12.370 7.605 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.509 -12.265 5.831 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -12.219 -9.467 5.781 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.584 -9.929 4.737 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -13.716 -8.504 5.796 1.00 0.00 H new ATOM 1196 N HIS A 81 -16.291 -10.341 4.479 1.00 0.00 N ATOM 1197 CA HIS A 81 -16.714 -10.841 3.174 1.00 0.00 C ATOM 1198 C HIS A 81 -15.762 -10.362 2.073 1.00 0.00 C ATOM 1199 O HIS A 81 -14.880 -9.537 2.320 1.00 0.00 O ATOM 1200 CB HIS A 81 -18.150 -10.389 2.882 1.00 0.00 C ATOM 1201 CG HIS A 81 -18.264 -8.968 2.420 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -17.278 -8.026 2.617 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -19.255 -8.336 1.756 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.657 -6.879 2.094 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.854 -7.038 1.563 1.00 0.00 N ATOM 0 H HIS A 81 -16.402 -9.334 4.596 1.00 0.00 H new ATOM 0 HA HIS A 81 -16.685 -11.930 3.191 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -18.577 -11.042 2.121 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -18.749 -10.516 3.784 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -20.190 -8.771 1.436 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -17.085 -5.963 2.099 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -19.393 -6.315 1.087 1.00 0.00 H new ATOM 1214 N VAL A 82 -15.951 -10.877 0.858 1.00 0.00 N ATOM 1215 CA VAL A 82 -15.114 -10.493 -0.279 1.00 0.00 C ATOM 1216 C VAL A 82 -15.959 -9.899 -1.403 1.00 0.00 C ATOM 1217 O VAL A 82 -16.878 -10.547 -1.906 1.00 0.00 O ATOM 1218 CB VAL A 82 -14.308 -11.689 -0.832 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -13.142 -12.018 0.087 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -15.203 -12.908 -1.028 1.00 0.00 C ATOM 0 H VAL A 82 -16.675 -11.560 0.636 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.414 -9.742 0.089 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.909 -11.407 -1.806 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.586 -12.863 -0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.483 -11.153 0.163 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -13.520 -12.274 1.077 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.610 -13.736 -1.418 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -15.642 -13.195 -0.072 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.998 -12.666 -1.734 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.647 -8.662 -1.790 1.00 0.00 N ATOM 1231 CA GLU A 83 -16.388 -7.984 -2.852 1.00 0.00 C ATOM 1232 C GLU A 83 -15.809 -8.301 -4.234 1.00 0.00 C ATOM 1233 O GLU A 83 -16.553 -8.652 -5.151 1.00 0.00 O ATOM 1234 CB GLU A 83 -16.415 -6.467 -2.608 1.00 0.00 C ATOM 1235 CG GLU A 83 -15.052 -5.795 -2.673 1.00 0.00 C ATOM 1236 CD GLU A 83 -15.095 -4.343 -2.237 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -15.234 -4.091 -1.020 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -14.989 -3.457 -3.111 1.00 0.00 O ATOM 0 H GLU A 83 -14.889 -8.112 -1.386 1.00 0.00 H new ATOM 0 HA GLU A 83 -17.412 -8.357 -2.832 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -17.070 -6.004 -3.346 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -16.854 -6.277 -1.629 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.352 -6.340 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.671 -5.853 -3.693 1.00 0.00 H new ATOM 1245 N SER A 84 -14.485 -8.180 -4.380 1.00 0.00 N ATOM 1246 CA SER A 84 -13.822 -8.458 -5.654 1.00 0.00 C ATOM 1247 C SER A 84 -12.327 -8.147 -5.572 1.00 0.00 C ATOM 1248 O SER A 84 -11.838 -7.673 -4.544 1.00 0.00 O ATOM 1249 CB SER A 84 -14.464 -7.646 -6.785 1.00 0.00 C ATOM 1250 OG SER A 84 -14.934 -8.494 -7.819 1.00 0.00 O ATOM 0 H SER A 84 -13.854 -7.892 -3.632 1.00 0.00 H new ATOM 0 HA SER A 84 -13.944 -9.520 -5.869 1.00 0.00 H new ATOM 0 HB2 SER A 84 -15.291 -7.057 -6.389 1.00 0.00 H new ATOM 0 HB3 SER A 84 -13.737 -6.942 -7.190 1.00 0.00 H new ATOM 0 HG SER A 84 -15.340 -7.952 -8.527 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.604 -8.416 -6.663 1.00 0.00 N ATOM 1257 CA VAL A 85 -10.165 -8.162 -6.715 1.00 0.00 C ATOM 1258 C VAL A 85 -9.743 -7.635 -8.085 1.00 0.00 C ATOM 1259 O VAL A 85 -10.190 -8.138 -9.117 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.349 -9.431 -6.389 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.554 -9.837 -4.937 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -9.720 -10.575 -7.325 1.00 0.00 C ATOM 0 H VAL A 85 -11.993 -8.809 -7.520 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.957 -7.405 -5.959 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.294 -9.204 -6.539 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.972 -10.733 -4.724 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -9.227 -9.028 -4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.610 -10.041 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -9.131 -11.457 -7.073 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -10.780 -10.804 -7.217 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -9.515 -10.283 -8.355 1.00 0.00 H new ATOM 1272 N GLN A 86 -8.879 -6.620 -8.086 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.396 -6.026 -9.329 1.00 0.00 C ATOM 1274 C GLN A 86 -6.900 -6.278 -9.517 1.00 0.00 C ATOM 1275 O GLN A 86 -6.077 -5.767 -8.756 1.00 0.00 O ATOM 1276 CB GLN A 86 -8.676 -4.521 -9.348 1.00 0.00 C ATOM 1277 CG GLN A 86 -9.204 -4.018 -10.683 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.159 -3.254 -11.476 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -8.223 -2.029 -11.586 1.00 0.00 O ATOM 1280 NE2 GLN A 86 -7.189 -3.973 -12.031 1.00 0.00 N ATOM 0 H GLN A 86 -8.501 -6.194 -7.240 1.00 0.00 H new ATOM 0 HA GLN A 86 -8.931 -6.499 -10.153 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -9.400 -4.284 -8.568 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -7.758 -3.986 -9.104 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.554 -4.865 -11.273 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -10.065 -3.373 -10.509 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.175 -4.986 -11.914 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -6.459 -3.512 -12.574 1.00 0.00 H new ATOM 1289 N PRO A 87 -6.528 -7.068 -10.545 1.00 0.00 N ATOM 1290 CA PRO A 87 -5.124 -7.382 -10.837 1.00 0.00 C ATOM 1291 C PRO A 87 -4.361 -6.168 -11.364 1.00 0.00 C ATOM 1292 O PRO A 87 -4.795 -5.514 -12.315 1.00 0.00 O ATOM 1293 CB PRO A 87 -5.219 -8.470 -11.909 1.00 0.00 C ATOM 1294 CG PRO A 87 -6.532 -8.234 -12.572 1.00 0.00 C ATOM 1295 CD PRO A 87 -7.450 -7.712 -11.502 1.00 0.00 C ATOM 0 HA PRO A 87 -4.578 -7.695 -9.947 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -4.397 -8.397 -12.621 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -5.171 -9.466 -11.468 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.434 -7.516 -13.386 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.922 -9.155 -13.005 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -8.173 -7.002 -11.904 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.019 -8.515 -11.034 1.00 0.00 H new ATOM 1303 N LEU A 88 -3.225 -5.866 -10.735 1.00 0.00 N ATOM 1304 CA LEU A 88 -2.404 -4.724 -11.133 1.00 0.00 C ATOM 1305 C LEU A 88 -1.211 -5.164 -11.987 1.00 0.00 C ATOM 1306 O LEU A 88 -0.216 -5.672 -11.467 1.00 0.00 O ATOM 1307 CB LEU A 88 -1.917 -3.967 -9.892 1.00 0.00 C ATOM 1308 CG LEU A 88 -2.466 -2.545 -9.745 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -3.986 -2.551 -9.793 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -1.973 -1.910 -8.452 1.00 0.00 C ATOM 0 H LEU A 88 -2.853 -6.397 -9.948 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.022 -4.060 -11.738 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.190 -4.539 -9.005 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.828 -3.919 -9.918 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.099 -1.948 -10.580 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.357 -1.532 -9.687 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.318 -2.961 -10.747 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.373 -3.165 -8.980 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.374 -0.900 -8.367 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.307 -2.506 -7.603 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.884 -1.868 -8.459 1.00 0.00 H new ATOM 1322 N SER A 89 -1.323 -4.961 -13.300 1.00 0.00 N ATOM 1323 CA SER A 89 -0.260 -5.329 -14.237 1.00 0.00 C ATOM 1324 C SER A 89 0.852 -4.274 -14.254 1.00 0.00 C ATOM 1325 O SER A 89 0.773 -3.267 -13.548 1.00 0.00 O ATOM 1326 CB SER A 89 -0.841 -5.496 -15.645 1.00 0.00 C ATOM 1327 OG SER A 89 -1.604 -4.360 -16.020 1.00 0.00 O ATOM 0 H SER A 89 -2.142 -4.542 -13.740 1.00 0.00 H new ATOM 0 HA SER A 89 0.172 -6.274 -13.907 1.00 0.00 H new ATOM 0 HB2 SER A 89 -0.032 -5.647 -16.360 1.00 0.00 H new ATOM 0 HB3 SER A 89 -1.468 -6.387 -15.680 1.00 0.00 H new ATOM 0 HG SER A 89 -1.963 -4.490 -16.923 1.00 0.00 H new ATOM 1333 N LEU A 90 1.886 -4.509 -15.069 1.00 0.00 N ATOM 1334 CA LEU A 90 3.012 -3.575 -15.178 1.00 0.00 C ATOM 1335 C LEU A 90 2.546 -2.199 -15.658 1.00 0.00 C ATOM 1336 O LEU A 90 3.095 -1.175 -15.250 1.00 0.00 O ATOM 1337 CB LEU A 90 4.081 -4.123 -16.130 1.00 0.00 C ATOM 1338 CG LEU A 90 5.522 -4.025 -15.616 1.00 0.00 C ATOM 1339 CD1 LEU A 90 6.428 -4.988 -16.371 1.00 0.00 C ATOM 1340 CD2 LEU A 90 6.041 -2.598 -15.736 1.00 0.00 C ATOM 0 H LEU A 90 1.967 -5.336 -15.661 1.00 0.00 H new ATOM 0 HA LEU A 90 3.445 -3.465 -14.184 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.857 -5.169 -16.340 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.012 -3.586 -17.076 1.00 0.00 H new ATOM 0 HG LEU A 90 5.527 -4.303 -14.562 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.446 -4.903 -15.991 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.072 -6.009 -16.230 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.415 -4.743 -17.433 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.065 -2.551 -15.366 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.018 -2.289 -16.781 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.411 -1.931 -15.147 1.00 0.00 H new ATOM 1352 N GLU A 91 1.532 -2.186 -16.526 1.00 0.00 N ATOM 1353 CA GLU A 91 0.989 -0.938 -17.065 1.00 0.00 C ATOM 1354 C GLU A 91 0.502 -0.008 -15.949 1.00 0.00 C ATOM 1355 O GLU A 91 0.542 1.214 -16.095 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.160 -1.233 -18.032 1.00 0.00 C ATOM 1357 CG GLU A 91 -0.339 -0.172 -19.110 1.00 0.00 C ATOM 1358 CD GLU A 91 -1.156 -0.657 -20.296 1.00 0.00 C ATOM 1359 OE1 GLU A 91 -2.116 -1.429 -20.087 1.00 0.00 O ATOM 1360 OE2 GLU A 91 -0.834 -0.262 -21.436 1.00 0.00 O ATOM 0 H GLU A 91 1.070 -3.027 -16.871 1.00 0.00 H new ATOM 0 HA GLU A 91 1.793 -0.433 -17.601 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.016 -2.197 -18.509 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.087 -1.323 -17.465 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.825 0.701 -18.675 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.642 0.151 -19.460 1.00 0.00 H new ATOM 1367 N ASN A 92 0.040 -0.592 -14.840 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.456 0.190 -13.704 1.00 0.00 C ATOM 1369 C ASN A 92 0.650 1.045 -13.083 1.00 0.00 C ATOM 1370 O ASN A 92 0.361 2.051 -12.433 1.00 0.00 O ATOM 1371 CB ASN A 92 -1.066 -0.728 -12.638 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.492 -1.138 -12.960 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -3.446 -0.622 -12.378 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -2.647 -2.076 -13.890 1.00 0.00 N ATOM 0 H ASN A 92 -0.001 -1.602 -14.705 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.229 0.858 -14.084 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.450 -1.621 -12.539 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.048 -0.220 -11.674 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.583 -2.393 -14.144 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.830 -2.479 -14.349 1.00 0.00 H new ATOM 1381 N LEU A 93 1.912 0.662 -13.290 1.00 0.00 N ATOM 1382 CA LEU A 93 3.023 1.424 -12.749 1.00 0.00 C ATOM 1383 C LEU A 93 3.238 2.687 -13.579 1.00 0.00 C ATOM 1384 O LEU A 93 3.740 2.627 -14.702 1.00 0.00 O ATOM 1385 CB LEU A 93 4.301 0.576 -12.717 1.00 0.00 C ATOM 1386 CG LEU A 93 4.373 -0.462 -11.590 1.00 0.00 C ATOM 1387 CD1 LEU A 93 4.137 0.195 -10.236 1.00 0.00 C ATOM 1388 CD2 LEU A 93 3.369 -1.583 -11.828 1.00 0.00 C ATOM 0 H LEU A 93 2.181 -0.164 -13.824 1.00 0.00 H new ATOM 0 HA LEU A 93 2.784 1.710 -11.725 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.398 0.059 -13.671 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.158 1.244 -12.628 1.00 0.00 H new ATOM 0 HG LEU A 93 5.373 -0.895 -11.588 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.192 -0.559 -9.451 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.898 0.956 -10.063 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.151 0.659 -10.224 1.00 0.00 H new ATOM 0 HD21 LEU A 93 3.436 -2.309 -11.018 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.362 -1.168 -11.862 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.591 -2.075 -12.775 1.00 0.00 H new ATOM 1400 N ALA A 94 2.835 3.823 -13.012 1.00 0.00 N ATOM 1401 CA ALA A 94 2.960 5.127 -13.678 1.00 0.00 C ATOM 1402 C ALA A 94 4.319 5.263 -14.358 1.00 0.00 C ATOM 1403 O ALA A 94 4.399 5.314 -15.586 1.00 0.00 O ATOM 1404 CB ALA A 94 2.750 6.260 -12.679 1.00 0.00 C ATOM 0 H ALA A 94 2.415 3.870 -12.084 1.00 0.00 H new ATOM 0 HA ALA A 94 2.187 5.191 -14.444 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.846 7.218 -13.190 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.755 6.180 -12.242 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.499 6.193 -11.890 1.00 0.00 H new ATOM 1410 N LEU A 95 5.389 5.286 -13.557 1.00 0.00 N ATOM 1411 CA LEU A 95 6.744 5.372 -14.100 1.00 0.00 C ATOM 1412 C LEU A 95 7.053 4.095 -14.881 1.00 0.00 C ATOM 1413 O LEU A 95 7.835 4.108 -15.832 1.00 0.00 O ATOM 1414 CB LEU A 95 7.777 5.574 -12.981 1.00 0.00 C ATOM 1415 CG LEU A 95 8.752 6.741 -13.183 1.00 0.00 C ATOM 1416 CD1 LEU A 95 9.745 6.430 -14.294 1.00 0.00 C ATOM 1417 CD2 LEU A 95 7.997 8.028 -13.487 1.00 0.00 C ATOM 0 H LEU A 95 5.342 5.247 -12.539 1.00 0.00 H new ATOM 0 HA LEU A 95 6.803 6.234 -14.765 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.244 5.727 -12.042 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.354 4.656 -12.874 1.00 0.00 H new ATOM 0 HG LEU A 95 9.308 6.880 -12.256 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.426 7.272 -14.419 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.315 5.538 -14.034 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.206 6.257 -15.226 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.708 8.842 -13.627 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.410 7.899 -14.396 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.332 8.265 -12.656 1.00 0.00 H new ATOM 1429 N ARG A 96 6.411 2.994 -14.470 1.00 0.00 N ATOM 1430 CA ARG A 96 6.580 1.696 -15.118 1.00 0.00 C ATOM 1431 C ARG A 96 8.042 1.234 -15.052 1.00 0.00 C ATOM 1432 O ARG A 96 8.616 0.800 -16.054 1.00 0.00 O ATOM 1433 CB ARG A 96 6.116 1.774 -16.579 1.00 0.00 C ATOM 1434 CG ARG A 96 5.096 0.714 -16.964 1.00 0.00 C ATOM 1435 CD ARG A 96 4.666 0.851 -18.419 1.00 0.00 C ATOM 1436 NE ARG A 96 4.286 2.226 -18.759 1.00 0.00 N ATOM 1437 CZ ARG A 96 4.316 2.728 -20.000 1.00 0.00 C ATOM 1438 NH1 ARG A 96 4.668 1.965 -21.031 1.00 0.00 N ATOM 1439 NH2 ARG A 96 3.985 3.997 -20.210 1.00 0.00 N ATOM 0 H ARG A 96 5.763 2.982 -13.682 1.00 0.00 H new ATOM 0 HA ARG A 96 5.969 0.966 -14.586 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.686 2.759 -16.760 1.00 0.00 H new ATOM 0 HB3 ARG A 96 6.985 1.680 -17.230 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.521 -0.277 -16.801 1.00 0.00 H new ATOM 0 HG3 ARG A 96 4.223 0.796 -16.317 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.481 0.530 -19.068 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.824 0.186 -18.611 1.00 0.00 H new ATOM 0 HE ARG A 96 3.980 2.838 -18.003 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.918 0.988 -20.880 1.00 0.00 H new ATOM 0 HH12 ARG A 96 4.688 2.357 -21.972 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.708 4.588 -19.426 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.008 4.380 -21.155 1.00 0.00 H new ATOM 1453 N GLY A 97 8.636 1.327 -13.862 1.00 0.00 N ATOM 1454 CA GLY A 97 10.019 0.909 -13.688 1.00 0.00 C ATOM 1455 C GLY A 97 10.154 -0.592 -13.802 1.00 0.00 C ATOM 1456 O GLY A 97 10.073 -1.143 -14.902 1.00 0.00 O ATOM 0 H GLY A 97 8.186 1.683 -13.019 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.645 1.391 -14.439 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.381 1.236 -12.713 1.00 0.00 H new ATOM 1460 N ARG A 98 10.327 -1.260 -12.666 1.00 0.00 N ATOM 1461 CA ARG A 98 10.431 -2.712 -12.654 1.00 0.00 C ATOM 1462 C ARG A 98 9.542 -3.284 -11.557 1.00 0.00 C ATOM 1463 O ARG A 98 9.867 -3.204 -10.370 1.00 0.00 O ATOM 1464 CB ARG A 98 11.884 -3.159 -12.438 1.00 0.00 C ATOM 1465 CG ARG A 98 12.900 -2.377 -13.258 1.00 0.00 C ATOM 1466 CD ARG A 98 13.487 -1.228 -12.455 1.00 0.00 C ATOM 1467 NE ARG A 98 14.013 -0.170 -13.314 1.00 0.00 N ATOM 1468 CZ ARG A 98 14.870 0.769 -12.901 1.00 0.00 C ATOM 1469 NH1 ARG A 98 15.324 0.770 -11.649 1.00 0.00 N ATOM 1470 NH2 ARG A 98 15.279 1.706 -13.747 1.00 0.00 N ATOM 0 H ARG A 98 10.398 -0.821 -11.748 1.00 0.00 H new ATOM 0 HA ARG A 98 10.100 -3.088 -13.622 1.00 0.00 H new ATOM 0 HB2 ARG A 98 12.131 -3.059 -11.381 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.969 -4.217 -12.686 1.00 0.00 H new ATOM 0 HG2 ARG A 98 13.699 -3.043 -13.582 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.423 -1.989 -14.158 1.00 0.00 H new ATOM 0 HD2 ARG A 98 12.720 -0.815 -11.800 1.00 0.00 H new ATOM 0 HD3 ARG A 98 14.284 -1.604 -11.814 1.00 0.00 H new ATOM 0 HE ARG A 98 13.708 -0.146 -14.287 1.00 0.00 H new ATOM 0 HH11 ARG A 98 15.018 0.050 -10.995 1.00 0.00 H new ATOM 0 HH12 ARG A 98 15.978 1.491 -11.344 1.00 0.00 H new ATOM 0 HH21 ARG A 98 14.939 1.708 -14.709 1.00 0.00 H new ATOM 0 HH22 ARG A 98 15.933 2.424 -13.435 1.00 0.00 H new ATOM 1484 N CYS A 99 8.417 -3.865 -11.963 1.00 0.00 N ATOM 1485 CA CYS A 99 7.477 -4.458 -11.019 1.00 0.00 C ATOM 1486 C CYS A 99 7.128 -5.884 -11.432 1.00 0.00 C ATOM 1487 O CYS A 99 6.555 -6.106 -12.499 1.00 0.00 O ATOM 1488 CB CYS A 99 6.208 -3.608 -10.922 1.00 0.00 C ATOM 1489 SG CYS A 99 6.180 -2.491 -9.501 1.00 0.00 S ATOM 0 H CYS A 99 8.134 -3.938 -12.940 1.00 0.00 H new ATOM 0 HA CYS A 99 7.951 -4.489 -10.038 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.105 -3.021 -11.835 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.343 -4.269 -10.869 1.00 0.00 H new ATOM 0 HG CYS A 99 4.985 -2.469 -8.990 1.00 0.00 H new ATOM 1495 N GLN A 100 7.480 -6.848 -10.581 1.00 0.00 N ATOM 1496 CA GLN A 100 7.207 -8.257 -10.858 1.00 0.00 C ATOM 1497 C GLN A 100 5.712 -8.506 -11.062 1.00 0.00 C ATOM 1498 O GLN A 100 5.311 -9.129 -12.044 1.00 0.00 O ATOM 1499 CB GLN A 100 7.728 -9.139 -9.722 1.00 0.00 C ATOM 1500 CG GLN A 100 8.833 -10.091 -10.154 1.00 0.00 C ATOM 1501 CD GLN A 100 8.409 -11.545 -10.081 1.00 0.00 C ATOM 1502 OE1 GLN A 100 9.103 -12.378 -9.499 1.00 0.00 O ATOM 1503 NE2 GLN A 100 7.262 -11.859 -10.675 1.00 0.00 N ATOM 0 H GLN A 100 7.955 -6.678 -9.694 1.00 0.00 H new ATOM 0 HA GLN A 100 7.727 -8.516 -11.780 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.100 -8.502 -8.919 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.900 -9.717 -9.312 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.133 -9.854 -11.175 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.707 -9.939 -9.521 1.00 0.00 H new ATOM 0 HE21 GLN A 100 6.717 -11.137 -11.147 1.00 0.00 H new ATOM 0 HE22 GLN A 100 6.926 -12.822 -10.659 1.00 0.00 H new ATOM 1512 N GLU A 101 4.895 -8.013 -10.127 1.00 0.00 N ATOM 1513 CA GLU A 101 3.442 -8.176 -10.200 1.00 0.00 C ATOM 1514 C GLU A 101 2.743 -7.338 -9.129 1.00 0.00 C ATOM 1515 O GLU A 101 3.398 -6.727 -8.282 1.00 0.00 O ATOM 1516 CB GLU A 101 3.053 -9.652 -10.041 1.00 0.00 C ATOM 1517 CG GLU A 101 2.554 -10.294 -11.328 1.00 0.00 C ATOM 1518 CD GLU A 101 1.088 -10.009 -11.603 1.00 0.00 C ATOM 1519 OE1 GLU A 101 0.704 -8.821 -11.612 1.00 0.00 O ATOM 1520 OE2 GLU A 101 0.323 -10.975 -11.811 1.00 0.00 O ATOM 0 H GLU A 101 5.217 -7.496 -9.309 1.00 0.00 H new ATOM 0 HA GLU A 101 3.118 -7.829 -11.181 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.917 -10.209 -9.678 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.277 -9.734 -9.280 1.00 0.00 H new ATOM 0 HG2 GLU A 101 3.152 -9.932 -12.164 1.00 0.00 H new ATOM 0 HG3 GLU A 101 2.705 -11.372 -11.272 1.00 0.00 H new ATOM 1527 N ALA A 102 1.410 -7.315 -9.171 1.00 0.00 N ATOM 1528 CA ALA A 102 0.623 -6.553 -8.203 1.00 0.00 C ATOM 1529 C ALA A 102 -0.850 -6.953 -8.246 1.00 0.00 C ATOM 1530 O ALA A 102 -1.390 -7.250 -9.311 1.00 0.00 O ATOM 1531 CB ALA A 102 0.779 -5.061 -8.459 1.00 0.00 C ATOM 0 H ALA A 102 0.854 -7.815 -9.865 1.00 0.00 H new ATOM 0 HA ALA A 102 0.999 -6.782 -7.206 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.188 -4.503 -7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.829 -4.783 -8.363 1.00 0.00 H new ATOM 0 HB3 ALA A 102 0.432 -4.826 -9.465 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.494 -6.965 -7.078 1.00 0.00 N ATOM 1538 CA TRP A 103 -2.908 -7.335 -6.979 1.00 0.00 C ATOM 1539 C TRP A 103 -3.636 -6.466 -5.953 1.00 0.00 C ATOM 1540 O TRP A 103 -3.006 -5.825 -5.109 1.00 0.00 O ATOM 1541 CB TRP A 103 -3.049 -8.813 -6.601 1.00 0.00 C ATOM 1542 CG TRP A 103 -2.651 -9.754 -7.698 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -1.380 -10.069 -8.084 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -3.525 -10.504 -8.551 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -1.409 -10.969 -9.121 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -2.714 -11.252 -9.426 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.914 -10.617 -8.659 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -3.247 -12.100 -10.395 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.442 -11.459 -9.622 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -4.609 -12.190 -10.477 1.00 0.00 C ATOM 0 H TRP A 103 -1.060 -6.723 -6.187 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.364 -7.170 -7.955 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -2.437 -9.014 -5.721 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -4.084 -9.011 -6.322 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.482 -9.668 -7.638 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -0.592 -11.363 -9.588 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -5.564 -10.057 -8.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -2.608 -12.665 -11.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -6.514 -11.554 -9.715 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -5.052 -12.839 -11.218 1.00 0.00 H new ATOM 1561 N VAL A 104 -4.969 -6.449 -6.035 1.00 0.00 N ATOM 1562 CA VAL A 104 -5.790 -5.658 -5.119 1.00 0.00 C ATOM 1563 C VAL A 104 -6.969 -6.472 -4.585 1.00 0.00 C ATOM 1564 O VAL A 104 -7.689 -7.112 -5.350 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.337 -4.388 -5.805 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -7.019 -3.478 -4.792 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -5.229 -3.643 -6.537 1.00 0.00 C ATOM 0 H VAL A 104 -5.502 -6.975 -6.728 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.142 -5.370 -4.291 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.079 -4.697 -6.541 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.397 -2.589 -5.298 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.848 -4.010 -4.325 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.301 -3.182 -4.027 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.641 -2.752 -7.011 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.456 -3.351 -5.826 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.795 -4.292 -7.298 1.00 0.00 H new ATOM 1577 N LEU A 105 -7.162 -6.422 -3.268 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.258 -7.134 -2.614 1.00 0.00 C ATOM 1579 C LEU A 105 -9.040 -6.184 -1.709 1.00 0.00 C ATOM 1580 O LEU A 105 -8.510 -5.673 -0.720 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.723 -8.316 -1.798 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.795 -9.236 -1.198 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -8.265 -10.655 -1.047 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -9.270 -8.700 0.144 1.00 0.00 C ATOM 0 H LEU A 105 -6.569 -5.892 -2.629 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.926 -7.519 -3.385 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.072 -8.912 -2.437 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.106 -7.928 -0.988 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.644 -9.259 -1.881 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -9.041 -11.290 -0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.977 -11.042 -2.025 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -7.397 -10.651 -0.388 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -10.030 -9.366 0.553 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.427 -8.644 0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -9.694 -7.705 0.009 1.00 0.00 H new ATOM 1596 N SER A 106 -10.303 -5.951 -2.060 1.00 0.00 N ATOM 1597 CA SER A 106 -11.166 -5.061 -1.288 1.00 0.00 C ATOM 1598 C SER A 106 -12.197 -5.858 -0.491 1.00 0.00 C ATOM 1599 O SER A 106 -12.589 -6.956 -0.890 1.00 0.00 O ATOM 1600 CB SER A 106 -11.874 -4.067 -2.216 1.00 0.00 C ATOM 1601 OG SER A 106 -10.967 -3.500 -3.145 1.00 0.00 O ATOM 0 H SER A 106 -10.752 -6.367 -2.876 1.00 0.00 H new ATOM 0 HA SER A 106 -10.541 -4.508 -0.587 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.678 -4.573 -2.751 1.00 0.00 H new ATOM 0 HB3 SER A 106 -12.334 -3.276 -1.624 1.00 0.00 H new ATOM 0 HG SER A 106 -11.442 -3.280 -3.973 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.629 -5.296 0.636 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.608 -5.967 1.473 1.00 0.00 C ATOM 1609 C GLY A 107 -13.823 -5.272 2.805 1.00 0.00 C ATOM 1610 O GLY A 107 -13.252 -4.209 3.060 1.00 0.00 O ATOM 0 H GLY A 107 -12.318 -4.389 0.983 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.557 -6.022 0.940 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.284 -6.992 1.652 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.645 -5.882 3.655 1.00 0.00 N ATOM 1615 CA LYS A 108 -14.947 -5.333 4.976 1.00 0.00 C ATOM 1616 C LYS A 108 -15.066 -6.451 6.007 1.00 0.00 C ATOM 1617 O LYS A 108 -15.477 -7.565 5.679 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.248 -4.524 4.948 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.243 -3.374 3.952 1.00 0.00 C ATOM 1620 CD LYS A 108 -17.250 -3.602 2.836 1.00 0.00 C ATOM 1621 CE LYS A 108 -18.053 -2.346 2.540 1.00 0.00 C ATOM 1622 NZ LYS A 108 -17.475 -1.563 1.409 1.00 0.00 N ATOM 0 H LYS A 108 -15.117 -6.763 3.451 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.127 -4.672 5.256 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -17.074 -5.193 4.710 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.437 -4.126 5.945 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -16.475 -2.442 4.468 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.245 -3.263 3.527 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.728 -3.921 1.934 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -17.927 -4.409 3.115 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -19.081 -2.621 2.302 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.089 -1.721 3.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.243 -1.209 0.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -16.932 -0.760 1.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -16.847 -2.174 0.849 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.711 -6.141 7.253 1.00 0.00 N ATOM 1637 CA GLN A 109 -14.776 -7.109 8.345 1.00 0.00 C ATOM 1638 C GLN A 109 -15.619 -6.560 9.496 1.00 0.00 C ATOM 1639 O GLN A 109 -15.913 -5.364 9.538 1.00 0.00 O ATOM 1640 CB GLN A 109 -13.363 -7.456 8.836 1.00 0.00 C ATOM 1641 CG GLN A 109 -12.472 -6.242 9.072 1.00 0.00 C ATOM 1642 CD GLN A 109 -11.861 -5.709 7.787 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -11.194 -6.438 7.055 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -12.087 -4.428 7.505 1.00 0.00 N ATOM 0 H GLN A 109 -14.373 -5.220 7.532 1.00 0.00 H new ATOM 0 HA GLN A 109 -15.248 -8.018 7.973 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -13.441 -8.022 9.764 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.885 -8.108 8.104 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -13.056 -5.454 9.547 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -11.675 -6.510 9.766 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -12.646 -3.857 8.139 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -11.701 -4.017 6.655 1.00 0.00 H new ATOM 1653 N GLN A 110 -16.001 -7.430 10.431 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.805 -7.007 11.571 1.00 0.00 C ATOM 1655 C GLN A 110 -15.933 -6.914 12.814 1.00 0.00 C ATOM 1656 O GLN A 110 -15.812 -7.877 13.577 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.972 -7.977 11.794 1.00 0.00 C ATOM 1658 CG GLN A 110 -18.732 -7.746 13.091 1.00 0.00 C ATOM 1659 CD GLN A 110 -19.768 -8.824 13.365 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -20.961 -8.543 13.455 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -19.315 -10.068 13.501 1.00 0.00 N ATOM 0 H GLN A 110 -15.768 -8.423 10.420 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.221 -6.021 11.364 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -18.666 -7.891 10.958 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -17.589 -8.997 11.787 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -18.025 -7.709 13.920 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -19.226 -6.775 13.050 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -18.316 -10.259 13.419 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -19.966 -10.830 13.687 1.00 0.00 H new ATOM 1670 N ILE A 111 -15.314 -5.753 13.008 1.00 0.00 N ATOM 1671 CA ILE A 111 -14.440 -5.548 14.151 1.00 0.00 C ATOM 1672 C ILE A 111 -15.244 -5.239 15.409 1.00 0.00 C ATOM 1673 O ILE A 111 -15.706 -4.117 15.625 1.00 0.00 O ATOM 1674 CB ILE A 111 -13.388 -4.447 13.885 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -12.380 -4.362 15.042 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -14.046 -3.097 13.619 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -12.909 -3.681 16.289 1.00 0.00 C ATOM 0 H ILE A 111 -15.403 -4.946 12.390 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.900 -6.481 14.312 1.00 0.00 H new ATOM 0 HB ILE A 111 -12.840 -4.721 12.983 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -12.060 -5.371 15.303 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -11.496 -3.826 14.698 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -13.277 -2.347 13.436 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.693 -3.174 12.745 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.639 -2.804 14.485 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -12.132 -3.666 17.053 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -13.202 -2.659 16.049 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -13.774 -4.228 16.663 1.00 0.00 H new ATOM 1689 N ALA A 112 -15.402 -6.268 16.230 1.00 0.00 N ATOM 1690 CA ALA A 112 -16.144 -6.159 17.482 1.00 0.00 C ATOM 1691 C ALA A 112 -15.239 -5.682 18.617 1.00 0.00 C ATOM 1692 O ALA A 112 -14.047 -5.999 18.644 1.00 0.00 O ATOM 1693 CB ALA A 112 -16.775 -7.497 17.832 1.00 0.00 C ATOM 0 H ALA A 112 -15.023 -7.198 16.050 1.00 0.00 H new ATOM 0 HA ALA A 112 -16.933 -5.419 17.349 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -17.326 -7.406 18.768 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -17.457 -7.797 17.037 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -15.994 -8.250 17.943 1.00 0.00 H new ATOM 1800 N ALA A 119 -20.789 -3.337 16.481 1.00 0.00 N ATOM 1801 CA ALA A 119 -20.176 -3.693 15.203 1.00 0.00 C ATOM 1802 C ALA A 119 -20.066 -2.478 14.281 1.00 0.00 C ATOM 1803 O ALA A 119 -20.908 -1.580 14.321 1.00 0.00 O ATOM 1804 CB ALA A 119 -20.976 -4.800 14.527 1.00 0.00 C ATOM 0 HA ALA A 119 -19.167 -4.054 15.402 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.510 -5.057 13.576 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.996 -5.680 15.171 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -21.995 -4.456 14.350 1.00 0.00 H new ATOM 1810 N LYS A 120 -19.021 -2.458 13.449 1.00 0.00 N ATOM 1811 CA LYS A 120 -18.800 -1.354 12.514 1.00 0.00 C ATOM 1812 C LYS A 120 -18.069 -1.832 11.259 1.00 0.00 C ATOM 1813 O LYS A 120 -16.948 -2.339 11.339 1.00 0.00 O ATOM 1814 CB LYS A 120 -17.998 -0.236 13.187 1.00 0.00 C ATOM 1815 CG LYS A 120 -18.865 0.838 13.825 1.00 0.00 C ATOM 1816 CD LYS A 120 -18.082 2.122 14.059 1.00 0.00 C ATOM 1817 CE LYS A 120 -17.085 1.969 15.198 1.00 0.00 C ATOM 1818 NZ LYS A 120 -17.755 1.952 16.529 1.00 0.00 N ATOM 0 H LYS A 120 -18.316 -3.194 13.405 1.00 0.00 H new ATOM 0 HA LYS A 120 -19.775 -0.968 12.219 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -17.354 -0.672 13.951 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -17.346 0.228 12.447 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -19.721 1.045 13.183 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -19.259 0.473 14.774 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -17.554 2.398 13.147 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -18.773 2.934 14.286 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -16.521 1.046 15.064 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.367 2.789 15.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -17.037 2.000 17.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -18.393 2.770 16.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -18.304 1.074 16.630 1.00 0.00 H new ATOM 1832 N ASP A 121 -18.709 -1.659 10.101 1.00 0.00 N ATOM 1833 CA ASP A 121 -18.119 -2.065 8.827 1.00 0.00 C ATOM 1834 C ASP A 121 -17.184 -0.982 8.296 1.00 0.00 C ATOM 1835 O ASP A 121 -17.590 0.167 8.116 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.212 -2.359 7.794 1.00 0.00 C ATOM 1837 CG ASP A 121 -19.631 -3.817 7.790 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -18.891 -4.646 7.219 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -20.700 -4.128 8.356 1.00 0.00 O ATOM 0 H ASP A 121 -19.636 -1.240 10.021 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.543 -2.974 8.999 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -20.081 -1.735 8.002 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -18.853 -2.085 6.802 1.00 0.00 H new ATOM 1844 N VAL A 122 -15.932 -1.357 8.047 1.00 0.00 N ATOM 1845 CA VAL A 122 -14.935 -0.423 7.531 1.00 0.00 C ATOM 1846 C VAL A 122 -14.367 -0.919 6.204 1.00 0.00 C ATOM 1847 O VAL A 122 -13.731 -1.974 6.150 1.00 0.00 O ATOM 1848 CB VAL A 122 -13.780 -0.216 8.536 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -12.829 0.871 8.049 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -14.323 0.119 9.919 1.00 0.00 C ATOM 0 H VAL A 122 -15.583 -2.304 8.195 1.00 0.00 H new ATOM 0 HA VAL A 122 -15.437 0.532 7.376 1.00 0.00 H new ATOM 0 HB VAL A 122 -13.220 -1.148 8.608 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -12.023 1.000 8.772 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -12.409 0.582 7.085 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -13.373 1.809 7.941 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -13.493 0.261 10.611 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -14.912 1.035 9.867 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -14.953 -0.698 10.270 1.00 0.00 H new ATOM 1860 N THR A 123 -14.597 -0.156 5.136 1.00 0.00 N ATOM 1861 CA THR A 123 -14.102 -0.529 3.812 1.00 0.00 C ATOM 1862 C THR A 123 -12.577 -0.509 3.787 1.00 0.00 C ATOM 1863 O THR A 123 -11.958 0.549 3.931 1.00 0.00 O ATOM 1864 CB THR A 123 -14.654 0.412 2.740 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.061 0.520 2.837 1.00 0.00 O ATOM 1866 CG2 THR A 123 -14.324 -0.030 1.330 1.00 0.00 C ATOM 0 H THR A 123 -15.120 0.719 5.161 1.00 0.00 H new ATOM 0 HA THR A 123 -14.446 -1.541 3.596 1.00 0.00 H new ATOM 0 HB THR A 123 -14.173 1.372 2.927 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.391 1.128 2.143 1.00 0.00 H new ATOM 0 HG21 THR A 123 -14.744 0.680 0.618 1.00 0.00 H new ATOM 0 HG22 THR A 123 -13.242 -0.071 1.205 1.00 0.00 H new ATOM 0 HG23 THR A 123 -14.748 -1.018 1.150 1.00 0.00 H new ATOM 1874 N LEU A 124 -11.979 -1.684 3.604 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.527 -1.805 3.563 1.00 0.00 C ATOM 1876 C LEU A 124 -10.034 -2.091 2.147 1.00 0.00 C ATOM 1877 O LEU A 124 -10.309 -3.151 1.582 1.00 0.00 O ATOM 1878 CB LEU A 124 -10.054 -2.904 4.517 1.00 0.00 C ATOM 1879 CG LEU A 124 -9.256 -2.410 5.728 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -8.902 -3.568 6.647 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -7.998 -1.680 5.276 1.00 0.00 C ATOM 0 H LEU A 124 -12.479 -2.565 3.482 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.105 -0.852 3.883 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.925 -3.454 4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -9.439 -3.609 3.958 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.878 -1.710 6.286 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.336 -3.195 7.500 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -9.816 -4.046 6.999 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.300 -4.295 6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.443 -1.336 6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.374 -2.357 4.693 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.275 -0.823 4.662 1.00 0.00 H new ATOM 1893 N HIS A 125 -9.295 -1.134 1.587 1.00 0.00 N ATOM 1894 CA HIS A 125 -8.743 -1.266 0.243 1.00 0.00 C ATOM 1895 C HIS A 125 -7.232 -1.475 0.319 1.00 0.00 C ATOM 1896 O HIS A 125 -6.475 -0.514 0.472 1.00 0.00 O ATOM 1897 CB HIS A 125 -9.060 -0.014 -0.582 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.705 -0.305 -1.900 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -11.059 -0.183 -2.118 1.00 0.00 N ATOM 1900 CD2 HIS A 125 -9.172 -0.714 -3.076 1.00 0.00 C ATOM 1901 CE1 HIS A 125 -11.334 -0.505 -3.369 1.00 0.00 C ATOM 1902 NE2 HIS A 125 -10.206 -0.834 -3.973 1.00 0.00 N ATOM 0 H HIS A 125 -9.065 -0.254 2.048 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.196 -2.130 -0.242 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -9.717 0.635 -0.002 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -8.137 0.539 -0.754 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -8.128 -0.910 -3.272 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -12.315 -0.500 -3.821 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -10.117 -1.129 -4.945 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.795 -2.730 0.223 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.370 -3.041 0.294 1.00 0.00 C ATOM 1913 C GLN A 126 -4.827 -3.513 -1.051 1.00 0.00 C ATOM 1914 O GLN A 126 -5.534 -4.147 -1.837 1.00 0.00 O ATOM 1915 CB GLN A 126 -5.092 -4.095 1.373 1.00 0.00 C ATOM 1916 CG GLN A 126 -5.822 -5.413 1.160 1.00 0.00 C ATOM 1917 CD GLN A 126 -6.634 -5.829 2.371 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -7.862 -5.805 2.346 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -5.946 -6.217 3.441 1.00 0.00 N ATOM 0 H GLN A 126 -7.402 -3.540 0.097 1.00 0.00 H new ATOM 0 HA GLN A 126 -4.854 -2.119 0.561 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -4.020 -4.288 1.409 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -5.375 -3.688 2.344 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.482 -5.324 0.297 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -5.097 -6.193 0.927 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -4.926 -6.221 3.418 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.438 -6.510 4.285 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.557 -3.196 -1.298 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.886 -3.579 -2.534 1.00 0.00 C ATOM 1930 C ALA A 127 -1.571 -4.289 -2.231 1.00 0.00 C ATOM 1931 O ALA A 127 -0.697 -3.731 -1.564 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.642 -2.353 -3.402 1.00 0.00 C ATOM 0 H ALA A 127 -2.970 -2.670 -0.651 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.530 -4.269 -3.079 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.140 -2.653 -4.322 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.595 -1.884 -3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -2.015 -1.643 -2.862 1.00 0.00 H new ATOM 1938 N LEU A 128 -1.436 -5.521 -2.719 1.00 0.00 N ATOM 1939 CA LEU A 128 -0.226 -6.306 -2.494 1.00 0.00 C ATOM 1940 C LEU A 128 0.766 -6.120 -3.637 1.00 0.00 C ATOM 1941 O LEU A 128 0.455 -6.404 -4.796 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.571 -7.790 -2.328 1.00 0.00 C ATOM 1943 CG LEU A 128 -0.481 -8.320 -0.896 1.00 0.00 C ATOM 1944 CD1 LEU A 128 0.957 -8.277 -0.402 1.00 0.00 C ATOM 1945 CD2 LEU A 128 -1.392 -7.522 0.029 1.00 0.00 C ATOM 0 H LEU A 128 -2.150 -5.996 -3.272 1.00 0.00 H new ATOM 0 HA LEU A 128 0.240 -5.950 -1.575 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.583 -7.955 -2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 128 0.098 -8.376 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 128 -0.815 -9.358 -0.891 1.00 0.00 H new ATOM 0 HD11 LEU A 128 1.003 -8.658 0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.582 -8.894 -1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.318 -7.249 -0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -1.314 -7.914 1.043 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -1.091 -6.474 0.021 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -2.423 -7.606 -0.314 1.00 0.00 H new ATOM 1957 N LEU A 129 1.960 -5.636 -3.301 1.00 0.00 N ATOM 1958 CA LEU A 129 3.008 -5.406 -4.290 1.00 0.00 C ATOM 1959 C LEU A 129 4.281 -6.157 -3.916 1.00 0.00 C ATOM 1960 O LEU A 129 4.725 -6.104 -2.770 1.00 0.00 O ATOM 1961 CB LEU A 129 3.311 -3.909 -4.407 1.00 0.00 C ATOM 1962 CG LEU A 129 2.095 -3.009 -4.640 1.00 0.00 C ATOM 1963 CD1 LEU A 129 2.286 -1.669 -3.944 1.00 0.00 C ATOM 1964 CD2 LEU A 129 1.855 -2.811 -6.130 1.00 0.00 C ATOM 0 H LEU A 129 2.225 -5.395 -2.346 1.00 0.00 H new ATOM 0 HA LEU A 129 2.651 -5.777 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.812 -3.585 -3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 129 4.014 -3.761 -5.227 1.00 0.00 H new ATOM 0 HG LEU A 129 1.217 -3.496 -4.215 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.413 -1.040 -4.119 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.409 -1.830 -2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.173 -1.176 -4.341 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.987 -2.169 -6.276 1.00 0.00 H new ATOM 0 HD22 LEU A 129 2.731 -2.345 -6.581 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.675 -3.777 -6.601 1.00 0.00 H new ATOM 1976 N ARG A 130 4.870 -6.849 -4.890 1.00 0.00 N ATOM 1977 CA ARG A 130 6.100 -7.603 -4.657 1.00 0.00 C ATOM 1978 C ARG A 130 7.182 -7.206 -5.659 1.00 0.00 C ATOM 1979 O ARG A 130 6.936 -7.149 -6.866 1.00 0.00 O ATOM 1980 CB ARG A 130 5.849 -9.116 -4.727 1.00 0.00 C ATOM 1981 CG ARG A 130 4.926 -9.550 -5.860 1.00 0.00 C ATOM 1982 CD ARG A 130 5.683 -9.721 -7.169 1.00 0.00 C ATOM 1983 NE ARG A 130 5.565 -11.078 -7.704 1.00 0.00 N ATOM 1984 CZ ARG A 130 6.459 -12.050 -7.491 1.00 0.00 C ATOM 1985 NH1 ARG A 130 7.525 -11.837 -6.722 1.00 0.00 N ATOM 1986 NH2 ARG A 130 6.279 -13.245 -8.044 1.00 0.00 N ATOM 0 H ARG A 130 4.516 -6.903 -5.845 1.00 0.00 H new ATOM 0 HA ARG A 130 6.446 -7.359 -3.653 1.00 0.00 H new ATOM 0 HB2 ARG A 130 6.806 -9.626 -4.839 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.421 -9.445 -3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 130 4.441 -10.489 -5.595 1.00 0.00 H new ATOM 0 HG3 ARG A 130 4.137 -8.810 -5.990 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.303 -9.009 -7.902 1.00 0.00 H new ATOM 0 HD3 ARG A 130 6.735 -9.485 -7.011 1.00 0.00 H new ATOM 0 HE ARG A 130 4.749 -11.297 -8.276 1.00 0.00 H new ATOM 0 HH11 ARG A 130 7.667 -10.925 -6.288 1.00 0.00 H new ATOM 0 HH12 ARG A 130 8.200 -12.586 -6.567 1.00 0.00 H new ATOM 0 HH21 ARG A 130 5.461 -13.418 -8.629 1.00 0.00 H new ATOM 0 HH22 ARG A 130 6.959 -13.989 -7.884 1.00 0.00 H new ATOM 2000 N LEU A 131 8.380 -6.937 -5.148 1.00 0.00 N ATOM 2001 CA LEU A 131 9.510 -6.550 -5.988 1.00 0.00 C ATOM 2002 C LEU A 131 10.667 -7.532 -5.811 1.00 0.00 C ATOM 2003 O LEU A 131 11.003 -7.908 -4.686 1.00 0.00 O ATOM 2004 CB LEU A 131 9.971 -5.129 -5.644 1.00 0.00 C ATOM 2005 CG LEU A 131 8.870 -4.064 -5.647 1.00 0.00 C ATOM 2006 CD1 LEU A 131 8.223 -3.951 -4.273 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.431 -2.720 -6.085 1.00 0.00 C ATOM 0 H LEU A 131 8.594 -6.980 -4.152 1.00 0.00 H new ATOM 0 HA LEU A 131 9.187 -6.572 -7.029 1.00 0.00 H new ATOM 0 HB2 LEU A 131 10.436 -5.144 -4.658 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.742 -4.833 -6.355 1.00 0.00 H new ATOM 0 HG LEU A 131 8.103 -4.368 -6.360 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.444 -3.189 -4.299 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.783 -4.910 -3.998 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.978 -3.674 -3.537 1.00 0.00 H new ATOM 0 HD21 LEU A 131 8.635 -1.975 -6.081 1.00 0.00 H new ATOM 0 HD22 LEU A 131 10.219 -2.413 -5.397 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.842 -2.807 -7.091 1.00 0.00 H new ATOM 2019 N PRO A 132 11.290 -7.968 -6.924 1.00 0.00 N ATOM 2020 CA PRO A 132 12.410 -8.914 -6.883 1.00 0.00 C ATOM 2021 C PRO A 132 13.743 -8.266 -6.486 1.00 0.00 C ATOM 2022 O PRO A 132 14.781 -8.929 -6.491 1.00 0.00 O ATOM 2023 CB PRO A 132 12.475 -9.427 -8.321 1.00 0.00 C ATOM 2024 CG PRO A 132 11.988 -8.286 -9.146 1.00 0.00 C ATOM 2025 CD PRO A 132 10.951 -7.579 -8.311 1.00 0.00 C ATOM 0 HA PRO A 132 12.254 -9.688 -6.132 1.00 0.00 H new ATOM 0 HB2 PRO A 132 13.491 -9.710 -8.596 1.00 0.00 H new ATOM 0 HB3 PRO A 132 11.850 -10.310 -8.456 1.00 0.00 H new ATOM 0 HG2 PRO A 132 12.806 -7.613 -9.403 1.00 0.00 H new ATOM 0 HG3 PRO A 132 11.559 -8.638 -10.084 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.997 -6.498 -8.446 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.941 -7.891 -8.579 1.00 0.00 H new ATOM 2033 N GLN A 133 13.715 -6.973 -6.136 1.00 0.00 N ATOM 2034 CA GLN A 133 14.929 -6.258 -5.732 1.00 0.00 C ATOM 2035 C GLN A 133 15.634 -6.997 -4.593 1.00 0.00 C ATOM 2036 O GLN A 133 16.862 -7.074 -4.554 1.00 0.00 O ATOM 2037 CB GLN A 133 14.591 -4.823 -5.307 1.00 0.00 C ATOM 2038 CG GLN A 133 15.323 -3.752 -6.109 1.00 0.00 C ATOM 2039 CD GLN A 133 16.835 -3.835 -5.975 1.00 0.00 C ATOM 2040 OE1 GLN A 133 17.513 -4.404 -6.830 1.00 0.00 O ATOM 2041 NE2 GLN A 133 17.371 -3.256 -4.905 1.00 0.00 N ATOM 0 H GLN A 133 12.868 -6.405 -6.125 1.00 0.00 H new ATOM 0 HA GLN A 133 15.603 -6.217 -6.588 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.517 -4.668 -5.408 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.833 -4.701 -4.251 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.052 -3.845 -7.161 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.989 -2.768 -5.780 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.772 -2.795 -4.221 1.00 0.00 H new ATOM 0 HE22 GLN A 133 18.382 -3.273 -4.769 1.00 0.00 H new ATOM 2050 N TYR A 134 14.837 -7.550 -3.681 1.00 0.00 N ATOM 2051 CA TYR A 134 15.356 -8.307 -2.543 1.00 0.00 C ATOM 2052 C TYR A 134 14.238 -9.118 -1.881 1.00 0.00 C ATOM 2053 O TYR A 134 14.245 -9.318 -0.665 1.00 0.00 O ATOM 2054 CB TYR A 134 16.002 -7.369 -1.518 1.00 0.00 C ATOM 2055 CG TYR A 134 15.051 -6.334 -0.966 1.00 0.00 C ATOM 2056 CD1 TYR A 134 14.837 -5.143 -1.637 1.00 0.00 C ATOM 2057 CD2 TYR A 134 14.364 -6.555 0.221 1.00 0.00 C ATOM 2058 CE1 TYR A 134 13.967 -4.196 -1.144 1.00 0.00 C ATOM 2059 CE2 TYR A 134 13.492 -5.615 0.721 1.00 0.00 C ATOM 2060 CZ TYR A 134 13.294 -4.434 0.035 1.00 0.00 C ATOM 2061 OH TYR A 134 12.423 -3.491 0.533 1.00 0.00 O ATOM 0 H TYR A 134 13.819 -7.487 -3.709 1.00 0.00 H new ATOM 0 HA TYR A 134 16.116 -8.995 -2.913 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.399 -7.962 -0.694 1.00 0.00 H new ATOM 0 HB3 TYR A 134 16.848 -6.863 -1.983 1.00 0.00 H new ATOM 0 HD1 TYR A 134 15.361 -4.953 -2.562 1.00 0.00 H new ATOM 0 HD2 TYR A 134 14.517 -7.479 0.760 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.813 -3.271 -1.679 1.00 0.00 H new ATOM 0 HE2 TYR A 134 12.965 -5.801 1.645 1.00 0.00 H new ATOM 0 HH TYR A 134 11.503 -3.819 0.450 1.00 0.00 H new ATOM 2071 N GLN A 135 13.269 -9.573 -2.684 1.00 0.00 N ATOM 2072 CA GLN A 135 12.141 -10.342 -2.165 1.00 0.00 C ATOM 2073 C GLN A 135 11.370 -9.503 -1.145 1.00 0.00 C ATOM 2074 O GLN A 135 11.371 -9.799 0.052 1.00 0.00 O ATOM 2075 CB GLN A 135 12.623 -11.651 -1.528 1.00 0.00 C ATOM 2076 CG GLN A 135 13.506 -12.496 -2.438 1.00 0.00 C ATOM 2077 CD GLN A 135 12.734 -13.144 -3.575 1.00 0.00 C ATOM 2078 OE1 GLN A 135 12.416 -14.332 -3.525 1.00 0.00 O ATOM 2079 NE2 GLN A 135 12.433 -12.366 -4.610 1.00 0.00 N ATOM 0 H GLN A 135 13.247 -9.421 -3.692 1.00 0.00 H new ATOM 0 HA GLN A 135 11.478 -10.594 -2.993 1.00 0.00 H new ATOM 0 HB2 GLN A 135 13.175 -11.418 -0.618 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.755 -12.240 -1.232 1.00 0.00 H new ATOM 0 HG2 GLN A 135 14.296 -11.870 -2.852 1.00 0.00 H new ATOM 0 HG3 GLN A 135 13.991 -13.272 -1.846 1.00 0.00 H new ATOM 0 HE21 GLN A 135 12.716 -11.386 -4.611 1.00 0.00 H new ATOM 0 HE22 GLN A 135 11.919 -12.749 -5.403 1.00 0.00 H new ATOM 2088 N THR A 136 10.724 -8.439 -1.626 1.00 0.00 N ATOM 2089 CA THR A 136 9.962 -7.542 -0.759 1.00 0.00 C ATOM 2090 C THR A 136 8.458 -7.664 -1.002 1.00 0.00 C ATOM 2091 O THR A 136 8.019 -8.127 -2.056 1.00 0.00 O ATOM 2092 CB THR A 136 10.407 -6.091 -0.979 1.00 0.00 C ATOM 2093 OG1 THR A 136 9.765 -5.218 -0.062 1.00 0.00 O ATOM 2094 CG2 THR A 136 10.120 -5.580 -2.373 1.00 0.00 C ATOM 0 H THR A 136 10.714 -8.178 -2.612 1.00 0.00 H new ATOM 0 HA THR A 136 10.161 -7.833 0.272 1.00 0.00 H new ATOM 0 HB THR A 136 11.486 -6.099 -0.826 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.602 -5.691 0.781 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.460 -4.548 -2.459 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.645 -6.197 -3.102 1.00 0.00 H new ATOM 0 HG23 THR A 136 9.048 -5.626 -2.564 1.00 0.00 H new ATOM 2102 N ASP A 137 7.678 -7.232 -0.015 1.00 0.00 N ATOM 2103 CA ASP A 137 6.221 -7.270 -0.097 1.00 0.00 C ATOM 2104 C ASP A 137 5.615 -6.003 0.516 1.00 0.00 C ATOM 2105 O ASP A 137 5.383 -5.941 1.724 1.00 0.00 O ATOM 2106 CB ASP A 137 5.681 -8.510 0.630 1.00 0.00 C ATOM 2107 CG ASP A 137 5.289 -9.630 -0.318 1.00 0.00 C ATOM 2108 OD1 ASP A 137 4.485 -9.378 -1.239 1.00 0.00 O ATOM 2109 OD2 ASP A 137 5.786 -10.760 -0.135 1.00 0.00 O ATOM 0 H ASP A 137 8.036 -6.848 0.860 1.00 0.00 H new ATOM 0 HA ASP A 137 5.937 -7.321 -1.148 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.438 -8.876 1.323 1.00 0.00 H new ATOM 0 HB3 ASP A 137 4.814 -8.226 1.226 1.00 0.00 H new ATOM 2114 N LEU A 138 5.365 -4.993 -0.320 1.00 0.00 N ATOM 2115 CA LEU A 138 4.787 -3.732 0.155 1.00 0.00 C ATOM 2116 C LEU A 138 3.276 -3.863 0.347 1.00 0.00 C ATOM 2117 O LEU A 138 2.562 -4.297 -0.560 1.00 0.00 O ATOM 2118 CB LEU A 138 5.096 -2.593 -0.823 1.00 0.00 C ATOM 2119 CG LEU A 138 6.380 -1.811 -0.521 1.00 0.00 C ATOM 2120 CD1 LEU A 138 7.499 -2.228 -1.464 1.00 0.00 C ATOM 2121 CD2 LEU A 138 6.127 -0.312 -0.614 1.00 0.00 C ATOM 0 H LEU A 138 5.552 -5.022 -1.322 1.00 0.00 H new ATOM 0 HA LEU A 138 5.239 -3.499 1.119 1.00 0.00 H new ATOM 0 HB2 LEU A 138 5.169 -3.007 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.257 -1.898 -0.825 1.00 0.00 H new ATOM 0 HG LEU A 138 6.691 -2.043 0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.400 -1.661 -1.232 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.699 -3.293 -1.343 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.200 -2.030 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 138 7.049 0.227 -0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.789 -0.062 -1.620 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.361 -0.027 0.108 1.00 0.00 H new ATOM 2133 N LEU A 139 2.799 -3.491 1.536 1.00 0.00 N ATOM 2134 CA LEU A 139 1.377 -3.574 1.855 1.00 0.00 C ATOM 2135 C LEU A 139 0.741 -2.186 1.948 1.00 0.00 C ATOM 2136 O LEU A 139 1.294 -1.276 2.569 1.00 0.00 O ATOM 2137 CB LEU A 139 1.173 -4.330 3.171 1.00 0.00 C ATOM 2138 CG LEU A 139 0.186 -5.497 3.101 1.00 0.00 C ATOM 2139 CD1 LEU A 139 0.905 -6.784 2.727 1.00 0.00 C ATOM 2140 CD2 LEU A 139 -0.550 -5.656 4.425 1.00 0.00 C ATOM 0 H LEU A 139 3.379 -3.129 2.293 1.00 0.00 H new ATOM 0 HA LEU A 139 0.887 -4.116 1.046 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.138 -4.710 3.508 1.00 0.00 H new ATOM 0 HB3 LEU A 139 0.826 -3.626 3.927 1.00 0.00 H new ATOM 0 HG LEU A 139 -0.549 -5.279 2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 139 0.186 -7.602 2.682 1.00 0.00 H new ATOM 0 HD12 LEU A 139 1.381 -6.665 1.754 1.00 0.00 H new ATOM 0 HD13 LEU A 139 1.664 -7.008 3.477 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.247 -6.491 4.356 1.00 0.00 H new ATOM 0 HD22 LEU A 139 0.170 -5.850 5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.100 -4.742 4.648 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.431 -2.043 1.328 1.00 0.00 N ATOM 2153 CA LEU A 140 -1.166 -0.779 1.333 1.00 0.00 C ATOM 2154 C LEU A 140 -2.482 -0.931 2.092 1.00 0.00 C ATOM 2155 O LEU A 140 -3.143 -1.967 1.993 1.00 0.00 O ATOM 2156 CB LEU A 140 -1.443 -0.318 -0.100 1.00 0.00 C ATOM 2157 CG LEU A 140 -0.284 0.402 -0.794 1.00 0.00 C ATOM 2158 CD1 LEU A 140 0.868 -0.559 -1.057 1.00 0.00 C ATOM 2159 CD2 LEU A 140 -0.759 1.039 -2.091 1.00 0.00 C ATOM 0 H LEU A 140 -0.893 -2.792 0.813 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.554 -0.029 1.834 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -1.717 -1.188 -0.697 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -2.307 0.347 -0.089 1.00 0.00 H new ATOM 0 HG LEU A 140 0.077 1.190 -0.133 1.00 0.00 H new ATOM 0 HD11 LEU A 140 1.681 -0.026 -1.551 1.00 0.00 H new ATOM 0 HD12 LEU A 140 1.224 -0.968 -0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 140 0.525 -1.372 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.076 1.547 -2.574 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -1.146 0.266 -2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.547 1.760 -1.875 1.00 0.00 H new ATOM 2171 N THR A 141 -2.856 0.096 2.853 1.00 0.00 N ATOM 2172 CA THR A 141 -4.093 0.063 3.633 1.00 0.00 C ATOM 2173 C THR A 141 -4.901 1.348 3.449 1.00 0.00 C ATOM 2174 O THR A 141 -4.406 2.447 3.708 1.00 0.00 O ATOM 2175 CB THR A 141 -3.785 -0.150 5.121 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.519 -0.764 5.302 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.813 -1.005 5.830 1.00 0.00 C ATOM 0 H THR A 141 -2.322 0.960 2.946 1.00 0.00 H new ATOM 0 HA THR A 141 -4.691 -0.772 3.268 1.00 0.00 H new ATOM 0 HB THR A 141 -3.799 0.849 5.556 1.00 0.00 H new ATOM 0 HG1 THR A 141 -2.348 -0.886 6.259 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.534 -1.115 6.878 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.791 -0.529 5.763 1.00 0.00 H new ATOM 0 HG23 THR A 141 -4.855 -1.988 5.360 1.00 0.00 H new ATOM 2185 N PHE A 142 -6.151 1.197 3.003 1.00 0.00 N ATOM 2186 CA PHE A 142 -7.043 2.335 2.788 1.00 0.00 C ATOM 2187 C PHE A 142 -8.327 2.177 3.600 1.00 0.00 C ATOM 2188 O PHE A 142 -9.043 1.186 3.453 1.00 0.00 O ATOM 2189 CB PHE A 142 -7.390 2.469 1.303 1.00 0.00 C ATOM 2190 CG PHE A 142 -6.496 3.410 0.548 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -5.161 3.103 0.337 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -6.994 4.600 0.043 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -4.342 3.962 -0.367 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -6.179 5.465 -0.660 1.00 0.00 C ATOM 2195 CZ PHE A 142 -4.853 5.146 -0.866 1.00 0.00 C ATOM 0 H PHE A 142 -6.568 0.292 2.783 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.525 3.235 3.118 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -7.339 1.484 0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -8.421 2.811 1.211 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.757 2.181 0.728 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -8.032 4.854 0.201 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -3.304 3.710 -0.528 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.579 6.390 -1.048 1.00 0.00 H new ATOM 0 HZ PHE A 142 -4.214 5.821 -1.417 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.609 3.156 4.459 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.807 3.123 5.296 1.00 0.00 C ATOM 2207 C ASN A 143 -10.848 4.125 4.801 1.00 0.00 C ATOM 2208 O ASN A 143 -10.606 5.334 4.801 1.00 0.00 O ATOM 2209 CB ASN A 143 -9.445 3.418 6.754 1.00 0.00 C ATOM 2210 CG ASN A 143 -8.541 2.355 7.356 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -8.677 1.169 7.060 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -7.611 2.775 8.209 1.00 0.00 N ATOM 0 H ASN A 143 -8.024 3.981 4.593 1.00 0.00 H new ATOM 0 HA ASN A 143 -10.237 2.123 5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.950 4.387 6.813 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -10.358 3.490 7.344 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -6.978 2.104 8.644 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -7.531 3.768 8.428 1.00 0.00 H new ATOM 2219 N GLN A 144 -12.003 3.614 4.377 1.00 0.00 N ATOM 2220 CA GLN A 144 -13.085 4.460 3.873 1.00 0.00 C ATOM 2221 C GLN A 144 -14.449 3.959 4.356 1.00 0.00 C ATOM 2222 O GLN A 144 -14.609 2.777 4.668 1.00 0.00 O ATOM 2223 CB GLN A 144 -13.052 4.507 2.340 1.00 0.00 C ATOM 2224 CG GLN A 144 -12.932 3.138 1.682 1.00 0.00 C ATOM 2225 CD GLN A 144 -12.174 3.185 0.367 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -12.683 2.759 -0.668 1.00 0.00 O ATOM 2227 NE2 GLN A 144 -10.949 3.700 0.402 1.00 0.00 N ATOM 0 H GLN A 144 -12.214 2.616 4.372 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.936 5.467 4.264 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -13.960 4.993 1.982 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -12.213 5.126 2.023 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -12.426 2.455 2.364 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -13.929 2.734 1.508 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -10.565 4.042 1.283 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -10.393 3.753 -0.452 1.00 0.00 H new ATOM 2236 N PRO A 145 -15.455 4.855 4.428 1.00 0.00 N ATOM 2237 CA PRO A 145 -16.806 4.496 4.877 1.00 0.00 C ATOM 2238 C PRO A 145 -17.570 3.663 3.842 1.00 0.00 C ATOM 2239 O PRO A 145 -17.629 4.027 2.666 1.00 0.00 O ATOM 2240 CB PRO A 145 -17.482 5.854 5.079 1.00 0.00 C ATOM 2241 CG PRO A 145 -16.776 6.771 4.141 1.00 0.00 C ATOM 2242 CD PRO A 145 -15.351 6.290 4.084 1.00 0.00 C ATOM 0 HA PRO A 145 -16.785 3.875 5.773 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -18.548 5.803 4.856 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -17.388 6.194 6.111 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -17.235 6.748 3.153 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -16.826 7.802 4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -14.918 6.435 3.094 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -14.718 6.827 4.790 1.00 0.00 H new ATOM 2473 N PRO A 162 -16.428 12.668 -1.723 1.00 0.00 N ATOM 2474 CA PRO A 162 -15.748 11.451 -1.257 1.00 0.00 C ATOM 2475 C PRO A 162 -14.779 10.891 -2.296 1.00 0.00 C ATOM 2476 O PRO A 162 -15.120 10.772 -3.475 1.00 0.00 O ATOM 2477 CB PRO A 162 -16.902 10.473 -1.010 1.00 0.00 C ATOM 2478 CG PRO A 162 -17.990 10.935 -1.915 1.00 0.00 C ATOM 2479 CD PRO A 162 -17.861 12.431 -1.989 1.00 0.00 C ATOM 0 HA PRO A 162 -15.135 11.638 -0.375 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -16.608 9.448 -1.236 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -17.220 10.491 0.032 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -17.892 10.486 -2.903 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -18.968 10.646 -1.529 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -18.156 12.811 -2.967 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -18.493 12.925 -1.251 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.569 10.549 -1.854 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.553 10.002 -2.750 1.00 0.00 C ATOM 2489 C TRP A 163 -12.939 8.603 -3.231 1.00 0.00 C ATOM 2490 O TRP A 163 -13.606 7.853 -2.516 1.00 0.00 O ATOM 2491 CB TRP A 163 -11.186 9.965 -2.058 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.253 11.040 -2.528 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -9.952 11.357 -3.822 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.500 11.943 -1.709 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -9.059 12.400 -3.857 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -8.765 12.776 -2.573 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.374 12.126 -0.329 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -7.920 13.779 -2.102 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.535 13.122 0.137 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -7.816 13.936 -0.747 1.00 0.00 C ATOM 0 H TRP A 163 -13.270 10.641 -0.883 1.00 0.00 H new ATOM 0 HA TRP A 163 -12.488 10.656 -3.619 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.329 10.063 -0.982 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -10.725 8.993 -2.231 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -10.357 10.860 -4.691 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -8.677 12.825 -4.702 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -9.922 11.501 0.361 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -7.367 14.410 -2.782 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -8.433 13.275 1.201 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.167 14.703 -0.351 1.00 0.00 H new ATOM 2511 N SER A 164 -12.520 8.264 -4.449 1.00 0.00 N ATOM 2512 CA SER A 164 -12.823 6.959 -5.038 1.00 0.00 C ATOM 2513 C SER A 164 -11.537 6.221 -5.425 1.00 0.00 C ATOM 2514 O SER A 164 -10.454 6.556 -4.940 1.00 0.00 O ATOM 2515 CB SER A 164 -13.731 7.141 -6.258 1.00 0.00 C ATOM 2516 OG SER A 164 -12.989 7.551 -7.393 1.00 0.00 O ATOM 0 H SER A 164 -11.968 8.876 -5.049 1.00 0.00 H new ATOM 0 HA SER A 164 -13.343 6.352 -4.297 1.00 0.00 H new ATOM 0 HB2 SER A 164 -14.245 6.204 -6.475 1.00 0.00 H new ATOM 0 HB3 SER A 164 -14.499 7.882 -6.036 1.00 0.00 H new ATOM 0 HG SER A 164 -13.593 7.658 -8.157 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.660 5.217 -6.304 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.503 4.439 -6.754 1.00 0.00 C ATOM 2524 C LEU A 165 -9.420 5.339 -7.349 1.00 0.00 C ATOM 2525 O LEU A 165 -8.235 5.008 -7.293 1.00 0.00 O ATOM 2526 CB LEU A 165 -10.923 3.387 -7.788 1.00 0.00 C ATOM 2527 CG LEU A 165 -10.630 1.934 -7.398 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -11.144 0.979 -8.466 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -9.136 1.734 -7.175 1.00 0.00 C ATOM 0 H LEU A 165 -12.547 4.927 -6.715 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.092 3.937 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.993 3.488 -7.972 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -10.416 3.603 -8.729 1.00 0.00 H new ATOM 0 HG LEU A 165 -11.150 1.716 -6.465 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.927 -0.048 -8.171 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -12.221 1.104 -8.578 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -10.653 1.196 -9.415 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -8.945 0.697 -6.899 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.596 1.971 -8.092 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.796 2.391 -6.374 1.00 0.00 H new ATOM 2541 N GLY A 166 -9.834 6.477 -7.914 1.00 0.00 N ATOM 2542 CA GLY A 166 -8.887 7.409 -8.507 1.00 0.00 C ATOM 2543 C GLY A 166 -7.742 7.754 -7.570 1.00 0.00 C ATOM 2544 O GLY A 166 -6.589 7.838 -7.996 1.00 0.00 O ATOM 0 H GLY A 166 -10.810 6.768 -7.970 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.484 6.978 -9.424 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.410 8.323 -8.788 1.00 0.00 H new ATOM 2548 N ASP A 167 -8.062 7.944 -6.289 1.00 0.00 N ATOM 2549 CA ASP A 167 -7.052 8.271 -5.285 1.00 0.00 C ATOM 2550 C ASP A 167 -6.213 7.044 -4.941 1.00 0.00 C ATOM 2551 O ASP A 167 -4.990 7.132 -4.831 1.00 0.00 O ATOM 2552 CB ASP A 167 -7.711 8.833 -4.020 1.00 0.00 C ATOM 2553 CG ASP A 167 -6.897 9.948 -3.389 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -6.449 10.850 -4.130 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -6.711 9.923 -2.155 1.00 0.00 O ATOM 0 H ASP A 167 -9.012 7.877 -5.924 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.394 9.033 -5.704 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -8.704 9.207 -4.267 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -7.844 8.030 -3.296 1.00 0.00 H new ATOM 2560 N PHE A 168 -6.878 5.899 -4.780 1.00 0.00 N ATOM 2561 CA PHE A 168 -6.189 4.650 -4.459 1.00 0.00 C ATOM 2562 C PHE A 168 -5.163 4.308 -5.537 1.00 0.00 C ATOM 2563 O PHE A 168 -4.019 3.966 -5.229 1.00 0.00 O ATOM 2564 CB PHE A 168 -7.197 3.505 -4.316 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.574 2.200 -3.902 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -6.132 2.012 -2.603 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -6.429 1.165 -4.811 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -5.559 0.817 -2.216 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.857 -0.034 -4.431 1.00 0.00 C ATOM 2570 CZ PHE A 168 -5.422 -0.208 -3.131 1.00 0.00 C ATOM 0 H PHE A 168 -7.891 5.811 -4.867 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.668 4.783 -3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -7.952 3.787 -3.582 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.713 3.366 -5.266 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -6.237 2.811 -1.883 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -6.767 1.297 -5.828 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -5.219 0.684 -1.200 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.750 -0.834 -5.149 1.00 0.00 H new ATOM 0 HZ PHE A 168 -4.975 -1.144 -2.831 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.578 4.410 -6.802 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.693 4.121 -7.930 1.00 0.00 C ATOM 2582 C GLU A 169 -3.449 5.006 -7.880 1.00 0.00 C ATOM 2583 O GLU A 169 -2.343 4.552 -8.178 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.431 4.322 -9.256 1.00 0.00 C ATOM 2585 CG GLU A 169 -6.477 3.253 -9.539 1.00 0.00 C ATOM 2586 CD GLU A 169 -6.394 2.707 -10.953 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -5.317 2.201 -11.332 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -7.409 2.780 -11.677 1.00 0.00 O ATOM 0 H GLU A 169 -6.521 4.691 -7.070 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.380 3.079 -7.859 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -5.915 5.299 -9.249 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -4.705 4.332 -10.069 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -6.353 2.434 -8.831 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -7.470 3.670 -9.374 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.636 6.270 -7.493 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.524 7.211 -7.394 1.00 0.00 C ATOM 2597 C GLN A 170 -1.565 6.803 -6.271 1.00 0.00 C ATOM 2598 O GLN A 170 -0.350 6.962 -6.399 1.00 0.00 O ATOM 2599 CB GLN A 170 -3.042 8.635 -7.166 1.00 0.00 C ATOM 2600 CG GLN A 170 -2.002 9.716 -7.426 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.384 9.621 -8.809 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -2.064 9.807 -9.818 1.00 0.00 O ATOM 2603 NE2 GLN A 170 -0.088 9.329 -8.865 1.00 0.00 N ATOM 0 H GLN A 170 -4.544 6.662 -7.244 1.00 0.00 H new ATOM 0 HA GLN A 170 -1.976 7.190 -8.336 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -3.901 8.807 -7.814 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -3.395 8.723 -6.139 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -2.466 10.695 -7.307 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -1.214 9.643 -6.676 1.00 0.00 H new ATOM 0 HE21 GLN A 170 0.439 9.182 -8.004 1.00 0.00 H new ATOM 0 HE22 GLN A 170 0.379 9.252 -9.769 1.00 0.00 H new ATOM 2612 N LEU A 171 -2.112 6.267 -5.173 1.00 0.00 N ATOM 2613 CA LEU A 171 -1.290 5.830 -4.045 1.00 0.00 C ATOM 2614 C LEU A 171 -0.410 4.648 -4.449 1.00 0.00 C ATOM 2615 O LEU A 171 0.742 4.553 -4.027 1.00 0.00 O ATOM 2616 CB LEU A 171 -2.166 5.453 -2.842 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.499 5.604 -1.466 1.00 0.00 C ATOM 2618 CD1 LEU A 171 -0.422 4.548 -1.268 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -0.915 7.000 -1.300 1.00 0.00 C ATOM 0 H LEU A 171 -3.114 6.127 -5.045 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.648 6.661 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.064 6.070 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -2.488 4.418 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.264 5.459 -0.703 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.036 4.675 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.869 3.556 -1.334 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.339 4.656 -2.041 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -0.448 7.085 -0.319 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.168 7.176 -2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -1.710 7.740 -1.388 1.00 0.00 H new ATOM 2631 N VAL A 172 -0.949 3.752 -5.279 1.00 0.00 N ATOM 2632 CA VAL A 172 -0.187 2.592 -5.740 1.00 0.00 C ATOM 2633 C VAL A 172 0.969 3.039 -6.631 1.00 0.00 C ATOM 2634 O VAL A 172 2.059 2.468 -6.581 1.00 0.00 O ATOM 2635 CB VAL A 172 -1.063 1.577 -6.508 1.00 0.00 C ATOM 2636 CG1 VAL A 172 -0.261 0.323 -6.833 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.319 1.226 -5.715 1.00 0.00 C ATOM 0 H VAL A 172 -1.901 3.807 -5.642 1.00 0.00 H new ATOM 0 HA VAL A 172 0.197 2.093 -4.850 1.00 0.00 H new ATOM 0 HB VAL A 172 -1.378 2.038 -7.444 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -0.892 -0.382 -7.374 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.597 0.590 -7.450 1.00 0.00 H new ATOM 0 HG13 VAL A 172 0.086 -0.137 -5.908 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.917 0.510 -6.279 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -2.035 0.788 -4.758 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -2.904 2.129 -5.541 1.00 0.00 H new ATOM 2647 N THR A 173 0.730 4.084 -7.423 1.00 0.00 N ATOM 2648 CA THR A 173 1.761 4.630 -8.298 1.00 0.00 C ATOM 2649 C THR A 173 2.761 5.474 -7.500 1.00 0.00 C ATOM 2650 O THR A 173 3.759 5.948 -8.046 1.00 0.00 O ATOM 2651 CB THR A 173 1.146 5.484 -9.404 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.053 6.248 -8.915 1.00 0.00 O ATOM 2653 CG2 THR A 173 0.661 4.675 -10.590 1.00 0.00 C ATOM 0 H THR A 173 -0.167 4.567 -7.475 1.00 0.00 H new ATOM 0 HA THR A 173 2.284 3.788 -8.751 1.00 0.00 H new ATOM 0 HB THR A 173 1.952 6.136 -9.740 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.251 6.558 -8.007 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.236 5.345 -11.338 1.00 0.00 H new ATOM 0 HG22 THR A 173 1.498 4.130 -11.025 1.00 0.00 H new ATOM 0 HG23 THR A 173 -0.101 3.968 -10.261 1.00 0.00 H new ATOM 2661 N SER A 174 2.493 5.652 -6.201 1.00 0.00 N ATOM 2662 CA SER A 174 3.366 6.432 -5.324 1.00 0.00 C ATOM 2663 C SER A 174 4.701 5.721 -5.035 1.00 0.00 C ATOM 2664 O SER A 174 5.430 6.113 -4.122 1.00 0.00 O ATOM 2665 CB SER A 174 2.648 6.741 -4.007 1.00 0.00 C ATOM 2666 OG SER A 174 1.425 7.417 -4.240 1.00 0.00 O ATOM 0 H SER A 174 1.673 5.263 -5.735 1.00 0.00 H new ATOM 0 HA SER A 174 3.598 7.359 -5.848 1.00 0.00 H new ATOM 0 HB2 SER A 174 2.457 5.814 -3.467 1.00 0.00 H new ATOM 0 HB3 SER A 174 3.290 7.353 -3.374 1.00 0.00 H new ATOM 0 HG SER A 174 1.539 8.373 -4.055 1.00 0.00 H new ATOM 2672 N LEU A 175 5.031 4.690 -5.810 1.00 0.00 N ATOM 2673 CA LEU A 175 6.290 3.973 -5.625 1.00 0.00 C ATOM 2674 C LEU A 175 7.158 4.077 -6.886 1.00 0.00 C ATOM 2675 O LEU A 175 7.964 3.190 -7.172 1.00 0.00 O ATOM 2676 CB LEU A 175 6.018 2.504 -5.286 1.00 0.00 C ATOM 2677 CG LEU A 175 6.117 2.136 -3.804 1.00 0.00 C ATOM 2678 CD1 LEU A 175 4.973 2.756 -3.013 1.00 0.00 C ATOM 2679 CD2 LEU A 175 6.126 0.625 -3.644 1.00 0.00 C ATOM 0 H LEU A 175 4.448 4.334 -6.568 1.00 0.00 H new ATOM 0 HA LEU A 175 6.830 4.429 -4.796 1.00 0.00 H new ATOM 0 HB2 LEU A 175 5.019 2.248 -5.639 1.00 0.00 H new ATOM 0 HB3 LEU A 175 6.722 1.885 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 175 7.051 2.536 -3.408 1.00 0.00 H new ATOM 0 HD11 LEU A 175 5.065 2.480 -1.963 1.00 0.00 H new ATOM 0 HD12 LEU A 175 5.011 3.841 -3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 175 4.022 2.391 -3.402 1.00 0.00 H new ATOM 0 HD21 LEU A 175 6.197 0.372 -2.586 1.00 0.00 H new ATOM 0 HD22 LEU A 175 5.206 0.210 -4.056 1.00 0.00 H new ATOM 0 HD23 LEU A 175 6.982 0.208 -4.175 1.00 0.00 H new ATOM 2691 N THR A 176 6.983 5.171 -7.638 1.00 0.00 N ATOM 2692 CA THR A 176 7.741 5.399 -8.870 1.00 0.00 C ATOM 2693 C THR A 176 9.244 5.375 -8.606 1.00 0.00 C ATOM 2694 O THR A 176 9.749 6.117 -7.762 1.00 0.00 O ATOM 2695 CB THR A 176 7.341 6.736 -9.507 1.00 0.00 C ATOM 2696 OG1 THR A 176 7.517 7.808 -8.594 1.00 0.00 O ATOM 2697 CG2 THR A 176 5.906 6.765 -9.988 1.00 0.00 C ATOM 0 H THR A 176 6.321 5.913 -7.412 1.00 0.00 H new ATOM 0 HA THR A 176 7.503 4.591 -9.562 1.00 0.00 H new ATOM 0 HB THR A 176 7.997 6.849 -10.370 1.00 0.00 H new ATOM 0 HG1 THR A 176 8.005 8.535 -9.034 1.00 0.00 H new ATOM 0 HG21 THR A 176 5.689 7.739 -10.427 1.00 0.00 H new ATOM 0 HG22 THR A 176 5.758 5.987 -10.737 1.00 0.00 H new ATOM 0 HG23 THR A 176 5.236 6.590 -9.146 1.00 0.00 H new ATOM 2705 N LEU A 177 9.953 4.511 -9.332 1.00 0.00 N ATOM 2706 CA LEU A 177 11.397 4.382 -9.179 1.00 0.00 C ATOM 2707 C LEU A 177 12.134 5.208 -10.231 1.00 0.00 C ATOM 2708 O LEU A 177 12.252 4.797 -11.388 1.00 0.00 O ATOM 2709 CB LEU A 177 11.807 2.908 -9.274 1.00 0.00 C ATOM 2710 CG LEU A 177 13.303 2.627 -9.110 1.00 0.00 C ATOM 2711 CD1 LEU A 177 13.850 3.315 -7.866 1.00 0.00 C ATOM 2712 CD2 LEU A 177 13.551 1.128 -9.047 1.00 0.00 C ATOM 0 H LEU A 177 9.548 3.890 -10.032 1.00 0.00 H new ATOM 0 HA LEU A 177 11.673 4.764 -8.196 1.00 0.00 H new ATOM 0 HB2 LEU A 177 11.265 2.348 -8.512 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.487 2.522 -10.242 1.00 0.00 H new ATOM 0 HG LEU A 177 13.828 3.031 -9.976 1.00 0.00 H new ATOM 0 HD11 LEU A 177 14.914 3.101 -7.770 1.00 0.00 H new ATOM 0 HD12 LEU A 177 13.702 4.392 -7.951 1.00 0.00 H new ATOM 0 HD13 LEU A 177 13.325 2.945 -6.985 1.00 0.00 H new ATOM 0 HD21 LEU A 177 14.618 0.940 -8.930 1.00 0.00 H new ATOM 0 HD22 LEU A 177 13.013 0.706 -8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 177 13.199 0.662 -9.967 1.00 0.00 H new ATOM 2724 N HIS A 178 12.632 6.373 -9.817 1.00 0.00 N ATOM 2725 CA HIS A 178 13.368 7.261 -10.715 1.00 0.00 C ATOM 2726 C HIS A 178 14.871 7.089 -10.515 1.00 0.00 C ATOM 2727 O HIS A 178 15.605 6.819 -11.467 1.00 0.00 O ATOM 2728 CB HIS A 178 12.980 8.725 -10.477 1.00 0.00 C ATOM 2729 CG HIS A 178 11.502 8.964 -10.443 1.00 0.00 C ATOM 2730 ND1 HIS A 178 10.810 9.579 -11.468 1.00 0.00 N ATOM 2731 CD2 HIS A 178 10.583 8.668 -9.497 1.00 0.00 C ATOM 2732 CE1 HIS A 178 9.529 9.650 -11.148 1.00 0.00 C ATOM 2733 NE2 HIS A 178 9.367 9.104 -9.959 1.00 0.00 N ATOM 0 H HIS A 178 12.539 6.724 -8.864 1.00 0.00 H new ATOM 0 HA HIS A 178 13.108 6.994 -11.739 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.413 9.057 -9.533 1.00 0.00 H new ATOM 0 HB3 HIS A 178 13.419 9.339 -11.263 1.00 0.00 H new ATOM 0 HD1 HIS A 178 11.222 9.924 -12.335 1.00 0.00 H new ATOM 0 HD2 HIS A 178 10.771 8.179 -8.553 1.00 0.00 H new ATOM 0 HE1 HIS A 178 8.748 10.082 -11.757 1.00 0.00 H new ATOM 2742 N ASP A 179 15.318 7.243 -9.268 1.00 0.00 N ATOM 2743 CA ASP A 179 16.728 7.102 -8.931 1.00 0.00 C ATOM 2744 C ASP A 179 16.939 5.891 -8.023 1.00 0.00 C ATOM 2745 O ASP A 179 16.572 5.919 -6.848 1.00 0.00 O ATOM 2746 CB ASP A 179 17.241 8.373 -8.248 1.00 0.00 C ATOM 2747 CG ASP A 179 17.210 9.580 -9.166 1.00 0.00 C ATOM 2748 OD1 ASP A 179 17.931 9.571 -10.187 1.00 0.00 O ATOM 2749 OD2 ASP A 179 16.464 10.535 -8.864 1.00 0.00 O ATOM 0 H ASP A 179 14.718 7.466 -8.474 1.00 0.00 H new ATOM 0 HA ASP A 179 17.291 6.949 -9.852 1.00 0.00 H new ATOM 0 HB2 ASP A 179 16.635 8.577 -7.365 1.00 0.00 H new ATOM 0 HB3 ASP A 179 18.262 8.209 -7.903 1.00 0.00 H new ATOM 2754 N PRO A 180 17.532 4.804 -8.562 1.00 0.00 N ATOM 2755 CA PRO A 180 17.788 3.573 -7.797 1.00 0.00 C ATOM 2756 C PRO A 180 18.901 3.748 -6.759 1.00 0.00 C ATOM 2757 O PRO A 180 19.950 3.106 -6.840 1.00 0.00 O ATOM 2758 CB PRO A 180 18.199 2.568 -8.880 1.00 0.00 C ATOM 2759 CG PRO A 180 18.773 3.405 -9.970 1.00 0.00 C ATOM 2760 CD PRO A 180 17.991 4.690 -9.962 1.00 0.00 C ATOM 0 HA PRO A 180 16.920 3.261 -7.217 1.00 0.00 H new ATOM 0 HB2 PRO A 180 18.930 1.854 -8.501 1.00 0.00 H new ATOM 0 HB3 PRO A 180 17.343 1.992 -9.231 1.00 0.00 H new ATOM 0 HG2 PRO A 180 19.833 3.593 -9.801 1.00 0.00 H new ATOM 0 HG3 PRO A 180 18.688 2.903 -10.934 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.610 5.539 -10.252 1.00 0.00 H new ATOM 0 HD3 PRO A 180 17.153 4.654 -10.658 1.00 0.00 H new