USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=23 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 176 THR OG1 : rot 79:sc= 1.41 USER MOD Set 1.2: A 178 HIS : no HE2:sc= -0.922 K(o=0.49,f=-5.4) USER MOD Set 2.1: A 45 GLN : amide:sc= -1.13 K(o=-1.2,f=-0.56) USER MOD Set 2.2: A 144 GLN : amide:sc= -0.0579 K(o=-1.2,f=-0.56) USER MOD Set 3.1: A 106 SER OG : rot 99:sc= 0.439 USER MOD Set 3.2: A 125 HIS : no HD1:sc= -0.476 X(o=-0.037,f=-0.18) USER MOD Single : A 7 CYS SG : rot -170:sc= -0.731 USER MOD Single : A 15 SER OG : rot 170:sc= -0.261 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= -0.15 USER MOD Single : A 34 ASN : amide:sc= 0.0692 X(o=0.069,f=-0.17) USER MOD Single : A 35 GLN : amide:sc= -1.55 X(o=-1.6,f=-1.8) USER MOD Single : A 39 CYS SG : rot 52:sc= 1.13 USER MOD Single : A 40 HIS : no HD1:sc= -6.14 X(o=-6.1,f=-6.5!) USER MOD Single : A 43 THR OG1 : rot 137:sc= 1.3 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -0.0727 X(o=-0.073,f=0.13) USER MOD Single : A 57 HIS : no HE2:sc= -0.0985 K(o=-0.098,f=-1.6) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HE2:sc= -3.27! C(o=-3.3!,f=-4.4!) USER MOD Single : A 75 GLN : amide:sc= -1.29 K(o=-1.3,f=-1.9) USER MOD Single : A 81 HIS : no HE2:sc= -1.52 K(o=-1.5,f=-2.8!) USER MOD Single : A 84 SER OG : rot -105:sc= 0.161 USER MOD Single : A 86 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.018) USER MOD Single : A 89 SER OG : rot 180:sc= -0.016 USER MOD Single : A 92 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.4) USER MOD Single : A 99 CYS SG : rot -150:sc=-0.00137 USER MOD Single : A 100 GLN : amide:sc= -1.44 K(o=-1.4,f=-3.9!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -2.57! K(o=-2.6!,f=-1.6) USER MOD Single : A 110 GLN : amide:sc= -1.37 K(o=-1.4,f=-8.5!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -4.08! C(o=-4.1!,f=-2.5!) USER MOD Single : A 133 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.275 X(o=-0.28,f=-0.01) USER MOD Single : A 136 THR OG1 : rot 26:sc= 0.196 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -2.08 K(o=-2.1,f=-7.1!) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 170 GLN : amide:sc= -0.458 X(o=-0.46,f=-0.43) USER MOD Single : A 173 THR OG1 : rot 26:sc= 0.918 USER MOD Single : A 174 SER OG : rot 88:sc= -0.251 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 2.878 15.984 -6.662 1.00 0.00 N ATOM 64 CA ARG A 5 3.827 16.369 -5.618 1.00 0.00 C ATOM 65 C ARG A 5 4.475 15.132 -4.992 1.00 0.00 C ATOM 66 O ARG A 5 3.933 14.533 -4.058 1.00 0.00 O ATOM 67 CB ARG A 5 3.144 17.232 -4.545 1.00 0.00 C ATOM 68 CG ARG A 5 1.969 16.558 -3.852 1.00 0.00 C ATOM 69 CD ARG A 5 2.159 16.524 -2.341 1.00 0.00 C ATOM 70 NE ARG A 5 2.151 17.863 -1.755 1.00 0.00 N ATOM 71 CZ ARG A 5 1.055 18.614 -1.618 1.00 0.00 C ATOM 72 NH1 ARG A 5 -0.134 18.154 -2.004 1.00 0.00 N ATOM 73 NH2 ARG A 5 1.145 19.827 -1.084 1.00 0.00 N ATOM 0 HA ARG A 5 4.613 16.967 -6.079 1.00 0.00 H new ATOM 0 HB2 ARG A 5 3.883 17.509 -3.794 1.00 0.00 H new ATOM 0 HB3 ARG A 5 2.797 18.157 -5.006 1.00 0.00 H new ATOM 0 HG2 ARG A 5 1.049 17.090 -4.092 1.00 0.00 H new ATOM 0 HG3 ARG A 5 1.857 15.541 -4.229 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.367 15.927 -1.890 1.00 0.00 H new ATOM 0 HD3 ARG A 5 3.103 16.032 -2.106 1.00 0.00 H new ATOM 0 HE ARG A 5 3.038 18.248 -1.430 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -0.213 17.221 -2.408 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -0.965 18.735 -1.895 1.00 0.00 H new ATOM 0 HH21 ARG A 5 2.050 20.184 -0.779 1.00 0.00 H new ATOM 0 HH22 ARG A 5 0.309 20.401 -0.979 1.00 0.00 H new ATOM 87 N ASP A 6 5.638 14.752 -5.522 1.00 0.00 N ATOM 88 CA ASP A 6 6.372 13.584 -5.032 1.00 0.00 C ATOM 89 C ASP A 6 7.083 13.896 -3.714 1.00 0.00 C ATOM 90 O ASP A 6 7.636 14.983 -3.540 1.00 0.00 O ATOM 91 CB ASP A 6 7.389 13.120 -6.079 1.00 0.00 C ATOM 92 CG ASP A 6 6.773 12.223 -7.140 1.00 0.00 C ATOM 93 OD1 ASP A 6 5.705 12.585 -7.680 1.00 0.00 O ATOM 94 OD2 ASP A 6 7.361 11.164 -7.434 1.00 0.00 O ATOM 0 H ASP A 6 6.094 15.238 -6.294 1.00 0.00 H new ATOM 0 HA ASP A 6 5.654 12.784 -4.853 1.00 0.00 H new ATOM 0 HB2 ASP A 6 7.833 13.992 -6.560 1.00 0.00 H new ATOM 0 HB3 ASP A 6 8.198 12.584 -5.581 1.00 0.00 H new ATOM 99 N CYS A 7 7.059 12.937 -2.790 1.00 0.00 N ATOM 100 CA CYS A 7 7.692 13.109 -1.484 1.00 0.00 C ATOM 101 C CYS A 7 8.902 12.185 -1.324 1.00 0.00 C ATOM 102 O CYS A 7 8.757 10.962 -1.294 1.00 0.00 O ATOM 103 CB CYS A 7 6.676 12.838 -0.371 1.00 0.00 C ATOM 104 SG CYS A 7 5.197 13.878 -0.446 1.00 0.00 S ATOM 0 H CYS A 7 6.607 12.032 -2.922 1.00 0.00 H new ATOM 0 HA CYS A 7 8.043 14.138 -1.413 1.00 0.00 H new ATOM 0 HB2 CYS A 7 6.373 11.792 -0.418 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.162 12.986 0.593 1.00 0.00 H new ATOM 0 HG CYS A 7 4.503 13.724 0.642 1.00 0.00 H new ATOM 110 N PRO A 8 10.120 12.767 -1.214 1.00 0.00 N ATOM 111 CA PRO A 8 11.368 11.999 -1.051 1.00 0.00 C ATOM 112 C PRO A 8 11.299 10.995 0.101 1.00 0.00 C ATOM 113 O PRO A 8 10.700 11.271 1.141 1.00 0.00 O ATOM 114 CB PRO A 8 12.413 13.078 -0.752 1.00 0.00 C ATOM 115 CG PRO A 8 11.867 14.317 -1.371 1.00 0.00 C ATOM 116 CD PRO A 8 10.373 14.222 -1.241 1.00 0.00 C ATOM 0 HA PRO A 8 11.589 11.399 -1.934 1.00 0.00 H new ATOM 0 HB2 PRO A 8 12.557 13.202 0.321 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.383 12.818 -1.176 1.00 0.00 H new ATOM 0 HG2 PRO A 8 12.247 15.205 -0.866 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.163 14.394 -2.417 1.00 0.00 H new ATOM 0 HD2 PRO A 8 10.018 14.708 -0.332 1.00 0.00 H new ATOM 0 HD3 PRO A 8 9.866 14.702 -2.078 1.00 0.00 H new ATOM 124 N LEU A 9 11.914 9.829 -0.098 1.00 0.00 N ATOM 125 CA LEU A 9 11.924 8.779 0.918 1.00 0.00 C ATOM 126 C LEU A 9 13.289 8.097 0.986 1.00 0.00 C ATOM 127 O LEU A 9 13.839 7.688 -0.038 1.00 0.00 O ATOM 128 CB LEU A 9 10.833 7.745 0.623 1.00 0.00 C ATOM 129 CG LEU A 9 9.973 7.344 1.823 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.652 6.750 1.358 1.00 0.00 C ATOM 131 CD2 LEU A 9 10.723 6.361 2.712 1.00 0.00 C ATOM 0 H LEU A 9 12.412 9.589 -0.955 1.00 0.00 H new ATOM 0 HA LEU A 9 11.724 9.241 1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.180 8.141 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 9 11.304 6.849 0.218 1.00 0.00 H new ATOM 0 HG LEU A 9 9.758 8.238 2.408 1.00 0.00 H new ATOM 0 HD11 LEU A 9 8.053 6.471 2.225 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.110 7.487 0.765 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.845 5.866 0.750 1.00 0.00 H new ATOM 0 HD21 LEU A 9 10.096 6.087 3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 9 10.970 5.467 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.641 6.825 3.074 1.00 0.00 H new ATOM 143 N PHE A 10 13.826 7.979 2.204 1.00 0.00 N ATOM 144 CA PHE A 10 15.129 7.348 2.428 1.00 0.00 C ATOM 145 C PHE A 10 16.248 8.076 1.677 1.00 0.00 C ATOM 146 O PHE A 10 17.233 7.461 1.266 1.00 0.00 O ATOM 147 CB PHE A 10 15.090 5.873 2.009 1.00 0.00 C ATOM 148 CG PHE A 10 14.668 4.935 3.111 1.00 0.00 C ATOM 149 CD1 PHE A 10 13.608 5.255 3.945 1.00 0.00 C ATOM 150 CD2 PHE A 10 15.331 3.734 3.307 1.00 0.00 C ATOM 151 CE1 PHE A 10 13.219 4.395 4.952 1.00 0.00 C ATOM 152 CE2 PHE A 10 14.946 2.871 4.315 1.00 0.00 C ATOM 153 CZ PHE A 10 13.888 3.202 5.139 1.00 0.00 C ATOM 0 H PHE A 10 13.374 8.315 3.055 1.00 0.00 H new ATOM 0 HA PHE A 10 15.344 7.413 3.495 1.00 0.00 H new ATOM 0 HB2 PHE A 10 14.404 5.762 1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 10 16.078 5.580 1.655 1.00 0.00 H new ATOM 0 HD1 PHE A 10 13.081 6.187 3.805 1.00 0.00 H new ATOM 0 HD2 PHE A 10 16.158 3.470 2.665 1.00 0.00 H new ATOM 0 HE1 PHE A 10 12.391 4.656 5.594 1.00 0.00 H new ATOM 0 HE2 PHE A 10 15.472 1.939 4.458 1.00 0.00 H new ATOM 0 HZ PHE A 10 13.585 2.529 5.928 1.00 0.00 H new ATOM 163 N GLY A 11 16.096 9.391 1.507 1.00 0.00 N ATOM 164 CA GLY A 11 17.111 10.170 0.817 1.00 0.00 C ATOM 165 C GLY A 11 16.821 10.379 -0.663 1.00 0.00 C ATOM 166 O GLY A 11 17.549 11.108 -1.336 1.00 0.00 O ATOM 0 H GLY A 11 15.292 9.927 1.834 1.00 0.00 H new ATOM 0 HA2 GLY A 11 17.202 11.142 1.301 1.00 0.00 H new ATOM 0 HA3 GLY A 11 18.074 9.670 0.922 1.00 0.00 H new ATOM 170 N GLY A 12 15.763 9.747 -1.172 1.00 0.00 N ATOM 171 CA GLY A 12 15.411 9.894 -2.575 1.00 0.00 C ATOM 172 C GLY A 12 15.421 8.581 -3.344 1.00 0.00 C ATOM 173 O GLY A 12 15.387 8.586 -4.575 1.00 0.00 O ATOM 0 H GLY A 12 15.145 9.137 -0.637 1.00 0.00 H new ATOM 0 HA2 GLY A 12 14.420 10.341 -2.648 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.108 10.587 -3.046 1.00 0.00 H new ATOM 177 N ALA A 13 15.455 7.454 -2.630 1.00 0.00 N ATOM 178 CA ALA A 13 15.454 6.143 -3.276 1.00 0.00 C ATOM 179 C ALA A 13 14.067 5.809 -3.817 1.00 0.00 C ATOM 180 O ALA A 13 13.932 5.172 -4.862 1.00 0.00 O ATOM 181 CB ALA A 13 15.931 5.072 -2.305 1.00 0.00 C ATOM 0 H ALA A 13 15.483 7.424 -1.611 1.00 0.00 H new ATOM 0 HA ALA A 13 16.145 6.173 -4.118 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.924 4.102 -2.802 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.944 5.304 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA A 13 15.267 5.042 -1.441 1.00 0.00 H new ATOM 187 N PHE A 14 13.040 6.258 -3.098 1.00 0.00 N ATOM 188 CA PHE A 14 11.654 6.030 -3.493 1.00 0.00 C ATOM 189 C PHE A 14 10.832 7.296 -3.272 1.00 0.00 C ATOM 190 O PHE A 14 11.060 8.027 -2.308 1.00 0.00 O ATOM 191 CB PHE A 14 11.061 4.874 -2.682 1.00 0.00 C ATOM 192 CG PHE A 14 11.146 3.540 -3.372 1.00 0.00 C ATOM 193 CD1 PHE A 14 10.582 3.351 -4.626 1.00 0.00 C ATOM 194 CD2 PHE A 14 11.786 2.473 -2.763 1.00 0.00 C ATOM 195 CE1 PHE A 14 10.659 2.123 -5.257 1.00 0.00 C ATOM 196 CE2 PHE A 14 11.865 1.244 -3.389 1.00 0.00 C ATOM 197 CZ PHE A 14 11.299 1.069 -4.637 1.00 0.00 C ATOM 0 H PHE A 14 13.145 6.786 -2.232 1.00 0.00 H new ATOM 0 HA PHE A 14 11.627 5.771 -4.551 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.579 4.811 -1.725 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.016 5.094 -2.465 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.078 4.172 -5.114 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.229 2.604 -1.787 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.219 1.989 -6.234 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.369 0.421 -2.903 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.357 0.108 -5.127 1.00 0.00 H new ATOM 207 N SER A 15 9.874 7.551 -4.161 1.00 0.00 N ATOM 208 CA SER A 15 9.017 8.728 -4.040 1.00 0.00 C ATOM 209 C SER A 15 7.594 8.302 -3.700 1.00 0.00 C ATOM 210 O SER A 15 7.228 7.145 -3.901 1.00 0.00 O ATOM 211 CB SER A 15 9.033 9.548 -5.335 1.00 0.00 C ATOM 212 OG SER A 15 9.715 10.778 -5.147 1.00 0.00 O ATOM 0 H SER A 15 9.672 6.962 -4.969 1.00 0.00 H new ATOM 0 HA SER A 15 9.401 9.356 -3.236 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.518 8.976 -6.126 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.011 9.740 -5.661 1.00 0.00 H new ATOM 0 HG SER A 15 9.855 11.211 -6.015 1.00 0.00 H new ATOM 218 N ALA A 16 6.801 9.235 -3.175 1.00 0.00 N ATOM 219 CA ALA A 16 5.416 8.943 -2.802 1.00 0.00 C ATOM 220 C ALA A 16 4.523 10.165 -2.984 1.00 0.00 C ATOM 221 O ALA A 16 4.689 11.174 -2.298 1.00 0.00 O ATOM 222 CB ALA A 16 5.344 8.449 -1.363 1.00 0.00 C ATOM 0 H ALA A 16 7.092 10.197 -2.998 1.00 0.00 H new ATOM 0 HA ALA A 16 5.052 8.157 -3.464 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.307 8.237 -1.103 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.937 7.540 -1.260 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.736 9.216 -0.695 1.00 0.00 H new ATOM 228 N ILE A 17 3.572 10.064 -3.909 1.00 0.00 N ATOM 229 CA ILE A 17 2.644 11.159 -4.171 1.00 0.00 C ATOM 230 C ILE A 17 1.635 11.281 -3.028 1.00 0.00 C ATOM 231 O ILE A 17 1.083 10.278 -2.571 1.00 0.00 O ATOM 232 CB ILE A 17 1.881 10.958 -5.500 1.00 0.00 C ATOM 233 CG1 ILE A 17 2.862 10.705 -6.654 1.00 0.00 C ATOM 234 CG2 ILE A 17 0.997 12.163 -5.802 1.00 0.00 C ATOM 235 CD1 ILE A 17 2.713 9.341 -7.295 1.00 0.00 C ATOM 0 H ILE A 17 3.424 9.237 -4.488 1.00 0.00 H new ATOM 0 HA ILE A 17 3.234 12.072 -4.247 1.00 0.00 H new ATOM 0 HB ILE A 17 1.240 10.082 -5.396 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.718 11.472 -7.415 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.881 10.812 -6.282 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.469 12.001 -6.742 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.274 12.294 -4.997 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.616 13.057 -5.883 1.00 0.00 H new ATOM 0 HD11 ILE A 17 3.439 9.237 -8.101 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.887 8.567 -6.548 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.706 9.237 -7.698 1.00 0.00 H new ATOM 247 N LEU A 18 1.413 12.507 -2.564 1.00 0.00 N ATOM 248 CA LEU A 18 0.482 12.751 -1.465 1.00 0.00 C ATOM 249 C LEU A 18 -0.619 13.730 -1.875 1.00 0.00 C ATOM 250 O LEU A 18 -0.340 14.788 -2.438 1.00 0.00 O ATOM 251 CB LEU A 18 1.233 13.303 -0.250 1.00 0.00 C ATOM 252 CG LEU A 18 1.676 12.261 0.783 1.00 0.00 C ATOM 253 CD1 LEU A 18 0.474 11.550 1.381 1.00 0.00 C ATOM 254 CD2 LEU A 18 2.635 11.255 0.159 1.00 0.00 C ATOM 0 H LEU A 18 1.863 13.346 -2.930 1.00 0.00 H new ATOM 0 HA LEU A 18 0.017 11.800 -1.206 1.00 0.00 H new ATOM 0 HB2 LEU A 18 2.115 13.837 -0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.596 14.034 0.248 1.00 0.00 H new ATOM 0 HG LEU A 18 2.200 12.782 1.585 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.812 10.815 2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.172 12.278 1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.081 11.046 0.590 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.936 10.525 0.910 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.139 10.743 -0.666 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.517 11.776 -0.215 1.00 0.00 H new ATOM 266 N PRO A 19 -1.894 13.390 -1.591 1.00 0.00 N ATOM 267 CA PRO A 19 -3.037 14.248 -1.929 1.00 0.00 C ATOM 268 C PRO A 19 -3.008 15.573 -1.171 1.00 0.00 C ATOM 269 O PRO A 19 -2.347 15.691 -0.137 1.00 0.00 O ATOM 270 CB PRO A 19 -4.260 13.426 -1.494 1.00 0.00 C ATOM 271 CG PRO A 19 -3.762 12.031 -1.340 1.00 0.00 C ATOM 272 CD PRO A 19 -2.323 12.150 -0.924 1.00 0.00 C ATOM 0 HA PRO A 19 -3.038 14.511 -2.987 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -4.673 13.802 -0.558 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -5.055 13.480 -2.238 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -4.341 11.490 -0.592 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -3.854 11.478 -2.275 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.219 12.216 0.159 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.735 11.291 -1.249 1.00 0.00 H new ATOM 280 N MET A 20 -3.738 16.562 -1.683 1.00 0.00 N ATOM 281 CA MET A 20 -3.804 17.872 -1.041 1.00 0.00 C ATOM 282 C MET A 20 -4.709 17.809 0.189 1.00 0.00 C ATOM 283 O MET A 20 -5.921 18.012 0.093 1.00 0.00 O ATOM 284 CB MET A 20 -4.319 18.926 -2.028 1.00 0.00 C ATOM 285 CG MET A 20 -4.108 20.358 -1.560 1.00 0.00 C ATOM 286 SD MET A 20 -5.594 21.076 -0.829 1.00 0.00 S ATOM 287 CE MET A 20 -4.907 22.495 0.020 1.00 0.00 C ATOM 0 H MET A 20 -4.290 16.481 -2.537 1.00 0.00 H new ATOM 0 HA MET A 20 -2.801 18.157 -0.724 1.00 0.00 H new ATOM 0 HB2 MET A 20 -3.818 18.789 -2.986 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.383 18.762 -2.198 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.300 20.382 -0.829 1.00 0.00 H new ATOM 0 HG3 MET A 20 -3.791 20.969 -2.405 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.706 23.041 0.521 1.00 0.00 H new ATOM 0 HE2 MET A 20 -4.178 22.160 0.758 1.00 0.00 H new ATOM 0 HE3 MET A 20 -4.418 23.149 -0.702 1.00 0.00 H new ATOM 297 N GLY A 21 -4.111 17.512 1.345 1.00 0.00 N ATOM 298 CA GLY A 21 -4.878 17.413 2.578 1.00 0.00 C ATOM 299 C GLY A 21 -4.329 16.367 3.539 1.00 0.00 C ATOM 300 O GLY A 21 -4.604 16.420 4.740 1.00 0.00 O ATOM 0 H GLY A 21 -3.111 17.339 1.448 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.886 18.384 3.073 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.913 17.169 2.337 1.00 0.00 H new ATOM 304 N ALA A 22 -3.557 15.409 3.015 1.00 0.00 N ATOM 305 CA ALA A 22 -2.980 14.347 3.838 1.00 0.00 C ATOM 306 C ALA A 22 -2.032 14.904 4.901 1.00 0.00 C ATOM 307 O ALA A 22 -1.530 16.025 4.777 1.00 0.00 O ATOM 308 CB ALA A 22 -2.255 13.334 2.962 1.00 0.00 C ATOM 0 H ALA A 22 -3.319 15.349 2.025 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.800 13.850 4.356 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.831 12.549 3.588 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.959 12.894 2.256 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.456 13.833 2.414 1.00 0.00 H new ATOM 314 N ILE A 23 -1.793 14.112 5.949 1.00 0.00 N ATOM 315 CA ILE A 23 -0.908 14.517 7.037 1.00 0.00 C ATOM 316 C ILE A 23 -0.250 13.303 7.696 1.00 0.00 C ATOM 317 O ILE A 23 -0.916 12.310 7.995 1.00 0.00 O ATOM 318 CB ILE A 23 -1.669 15.338 8.107 1.00 0.00 C ATOM 319 CG1 ILE A 23 -0.726 15.775 9.236 1.00 0.00 C ATOM 320 CG2 ILE A 23 -2.839 14.541 8.669 1.00 0.00 C ATOM 321 CD1 ILE A 23 0.476 16.566 8.760 1.00 0.00 C ATOM 0 H ILE A 23 -2.202 13.185 6.065 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.132 15.145 6.600 1.00 0.00 H new ATOM 0 HB ILE A 23 -2.062 16.233 7.625 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.286 16.378 9.951 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.378 14.890 9.769 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.359 15.137 9.419 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.529 14.290 7.863 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.468 13.625 9.128 1.00 0.00 H new ATOM 0 HD11 ILE A 23 1.094 16.838 9.615 1.00 0.00 H new ATOM 0 HD12 ILE A 23 1.060 15.959 8.069 1.00 0.00 H new ATOM 0 HD13 ILE A 23 0.139 17.470 8.253 1.00 0.00 H new ATOM 333 N ASP A 24 1.062 13.391 7.918 1.00 0.00 N ATOM 334 CA ASP A 24 1.810 12.309 8.541 1.00 0.00 C ATOM 335 C ASP A 24 1.480 12.200 10.027 1.00 0.00 C ATOM 336 O ASP A 24 1.845 13.071 10.817 1.00 0.00 O ATOM 337 CB ASP A 24 3.316 12.530 8.354 1.00 0.00 C ATOM 338 CG ASP A 24 3.775 13.913 8.791 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.534 14.881 8.040 1.00 0.00 O ATOM 340 OD2 ASP A 24 4.374 14.023 9.882 1.00 0.00 O ATOM 0 H ASP A 24 1.626 14.205 7.673 1.00 0.00 H new ATOM 0 HA ASP A 24 1.522 11.376 8.057 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.861 11.776 8.922 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.571 12.384 7.304 1.00 0.00 H new ATOM 345 N VAL A 25 0.786 11.126 10.406 1.00 0.00 N ATOM 346 CA VAL A 25 0.412 10.911 11.800 1.00 0.00 C ATOM 347 C VAL A 25 1.634 10.651 12.692 1.00 0.00 C ATOM 348 O VAL A 25 1.511 10.621 13.916 1.00 0.00 O ATOM 349 CB VAL A 25 -0.577 9.741 11.940 1.00 0.00 C ATOM 350 CG1 VAL A 25 -1.939 10.123 11.377 1.00 0.00 C ATOM 351 CG2 VAL A 25 -0.037 8.492 11.260 1.00 0.00 C ATOM 0 H VAL A 25 0.473 10.395 9.767 1.00 0.00 H new ATOM 0 HA VAL A 25 -0.069 11.831 12.133 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.698 9.519 13.000 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.626 9.283 11.485 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.329 10.983 11.921 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.838 10.377 10.322 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.753 7.678 11.372 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.120 8.694 10.200 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.910 8.208 11.720 1.00 0.00 H new ATOM 361 N SER A 26 2.811 10.470 12.080 1.00 0.00 N ATOM 362 CA SER A 26 4.042 10.227 12.834 1.00 0.00 C ATOM 363 C SER A 26 4.317 11.356 13.830 1.00 0.00 C ATOM 364 O SER A 26 4.916 11.133 14.882 1.00 0.00 O ATOM 365 CB SER A 26 5.228 10.070 11.880 1.00 0.00 C ATOM 366 OG SER A 26 5.175 11.023 10.830 1.00 0.00 O ATOM 0 H SER A 26 2.934 10.488 11.068 1.00 0.00 H new ATOM 0 HA SER A 26 3.911 9.303 13.397 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.160 10.187 12.433 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.230 9.064 11.461 1.00 0.00 H new ATOM 0 HG SER A 26 5.946 10.900 10.237 1.00 0.00 H new ATOM 372 N ASP A 27 3.869 12.570 13.496 1.00 0.00 N ATOM 373 CA ASP A 27 4.057 13.725 14.372 1.00 0.00 C ATOM 374 C ASP A 27 3.206 13.598 15.640 1.00 0.00 C ATOM 375 O ASP A 27 3.530 14.182 16.674 1.00 0.00 O ATOM 376 CB ASP A 27 3.698 15.019 13.631 1.00 0.00 C ATOM 377 CG ASP A 27 4.473 16.215 14.150 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.645 16.381 13.752 1.00 0.00 O ATOM 379 OD2 ASP A 27 3.907 16.984 14.956 1.00 0.00 O ATOM 0 H ASP A 27 3.375 12.776 12.627 1.00 0.00 H new ATOM 0 HA ASP A 27 5.107 13.759 14.664 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.899 14.893 12.567 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.630 15.209 13.734 1.00 0.00 H new ATOM 384 N LEU A 28 2.112 12.837 15.548 1.00 0.00 N ATOM 385 CA LEU A 28 1.207 12.636 16.679 1.00 0.00 C ATOM 386 C LEU A 28 1.422 11.272 17.354 1.00 0.00 C ATOM 387 O LEU A 28 1.104 11.108 18.534 1.00 0.00 O ATOM 388 CB LEU A 28 -0.244 12.759 16.200 1.00 0.00 C ATOM 389 CG LEU A 28 -1.236 13.296 17.239 1.00 0.00 C ATOM 390 CD1 LEU A 28 -1.203 14.817 17.275 1.00 0.00 C ATOM 391 CD2 LEU A 28 -2.643 12.799 16.935 1.00 0.00 C ATOM 0 H LEU A 28 1.832 12.349 14.697 1.00 0.00 H new ATOM 0 HA LEU A 28 1.423 13.405 17.421 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.267 13.413 15.329 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.585 11.777 15.871 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.942 12.924 18.221 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.914 15.179 18.018 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.200 15.153 17.538 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.472 15.210 16.295 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.336 13.189 17.681 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.944 13.143 15.946 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.657 11.709 16.960 1.00 0.00 H new ATOM 403 N ARG A 29 1.945 10.294 16.604 1.00 0.00 N ATOM 404 CA ARG A 29 2.181 8.948 17.147 1.00 0.00 C ATOM 405 C ARG A 29 3.455 8.316 16.569 1.00 0.00 C ATOM 406 O ARG A 29 3.936 8.726 15.514 1.00 0.00 O ATOM 407 CB ARG A 29 0.979 8.048 16.849 1.00 0.00 C ATOM 408 CG ARG A 29 -0.108 8.108 17.908 1.00 0.00 C ATOM 409 CD ARG A 29 -1.395 7.468 17.412 1.00 0.00 C ATOM 410 NE ARG A 29 -2.544 7.825 18.242 1.00 0.00 N ATOM 411 CZ ARG A 29 -2.813 7.269 19.425 1.00 0.00 C ATOM 412 NH1 ARG A 29 -2.025 6.316 19.918 1.00 0.00 N ATOM 413 NH2 ARG A 29 -3.876 7.662 20.116 1.00 0.00 N ATOM 0 H ARG A 29 2.212 10.407 15.626 1.00 0.00 H new ATOM 0 HA ARG A 29 2.314 9.045 18.225 1.00 0.00 H new ATOM 0 HB2 ARG A 29 0.553 8.333 15.887 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.323 7.018 16.752 1.00 0.00 H new ATOM 0 HG2 ARG A 29 0.231 7.598 18.810 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -0.297 9.146 18.181 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.581 7.779 16.384 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.279 6.384 17.401 1.00 0.00 H new ATOM 0 HE ARG A 29 -3.180 8.544 17.896 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.209 6.006 19.391 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -2.237 5.896 20.823 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -4.487 8.389 19.743 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -4.082 7.237 21.020 1.00 0.00 H new ATOM 427 N PRO A 30 4.018 7.296 17.258 1.00 0.00 N ATOM 428 CA PRO A 30 5.240 6.604 16.809 1.00 0.00 C ATOM 429 C PRO A 30 4.994 5.680 15.609 1.00 0.00 C ATOM 430 O PRO A 30 4.025 4.920 15.593 1.00 0.00 O ATOM 431 CB PRO A 30 5.647 5.786 18.038 1.00 0.00 C ATOM 432 CG PRO A 30 4.372 5.534 18.767 1.00 0.00 C ATOM 433 CD PRO A 30 3.506 6.742 18.528 1.00 0.00 C ATOM 0 HA PRO A 30 6.001 7.306 16.467 1.00 0.00 H new ATOM 0 HB2 PRO A 30 6.129 4.852 17.750 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.357 6.332 18.659 1.00 0.00 H new ATOM 0 HG2 PRO A 30 3.887 4.629 18.402 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.554 5.390 19.832 1.00 0.00 H new ATOM 0 HD2 PRO A 30 2.453 6.471 18.451 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.591 7.462 19.342 1.00 0.00 H new ATOM 441 N VAL A 31 5.875 5.756 14.606 1.00 0.00 N ATOM 442 CA VAL A 31 5.745 4.929 13.402 1.00 0.00 C ATOM 443 C VAL A 31 7.115 4.458 12.897 1.00 0.00 C ATOM 444 O VAL A 31 8.077 5.227 12.904 1.00 0.00 O ATOM 445 CB VAL A 31 5.032 5.702 12.268 1.00 0.00 C ATOM 446 CG1 VAL A 31 4.729 4.781 11.096 1.00 0.00 C ATOM 447 CG2 VAL A 31 3.756 6.359 12.779 1.00 0.00 C ATOM 0 H VAL A 31 6.683 6.379 14.604 1.00 0.00 H new ATOM 0 HA VAL A 31 5.148 4.060 13.679 1.00 0.00 H new ATOM 0 HB VAL A 31 5.703 6.488 11.921 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.227 5.345 10.310 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.660 4.367 10.708 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.082 3.969 11.429 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.272 6.897 11.964 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.080 5.594 13.160 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.002 7.057 13.579 1.00 0.00 H new ATOM 457 N PRO A 32 7.219 3.184 12.452 1.00 0.00 N ATOM 458 CA PRO A 32 8.479 2.612 11.941 1.00 0.00 C ATOM 459 C PRO A 32 9.048 3.395 10.755 1.00 0.00 C ATOM 460 O PRO A 32 8.408 4.315 10.241 1.00 0.00 O ATOM 461 CB PRO A 32 8.083 1.197 11.499 1.00 0.00 C ATOM 462 CG PRO A 32 6.840 0.890 12.259 1.00 0.00 C ATOM 463 CD PRO A 32 6.121 2.199 12.413 1.00 0.00 C ATOM 0 HA PRO A 32 9.262 2.636 12.699 1.00 0.00 H new ATOM 0 HB2 PRO A 32 7.909 1.153 10.424 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.871 0.478 11.724 1.00 0.00 H new ATOM 0 HG2 PRO A 32 6.224 0.166 11.725 1.00 0.00 H new ATOM 0 HG3 PRO A 32 7.073 0.455 13.231 1.00 0.00 H new ATOM 0 HD2 PRO A 32 5.442 2.386 11.581 1.00 0.00 H new ATOM 0 HD3 PRO A 32 5.524 2.226 13.324 1.00 0.00 H new ATOM 471 N ASP A 33 10.257 3.020 10.332 1.00 0.00 N ATOM 472 CA ASP A 33 10.924 3.687 9.213 1.00 0.00 C ATOM 473 C ASP A 33 10.596 3.034 7.864 1.00 0.00 C ATOM 474 O ASP A 33 10.751 3.666 6.818 1.00 0.00 O ATOM 475 CB ASP A 33 12.442 3.692 9.423 1.00 0.00 C ATOM 476 CG ASP A 33 12.929 4.935 10.148 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.446 6.041 9.826 1.00 0.00 O ATOM 478 OD2 ASP A 33 13.795 4.799 11.035 1.00 0.00 O ATOM 0 H ASP A 33 10.794 2.258 10.747 1.00 0.00 H new ATOM 0 HA ASP A 33 10.550 4.710 9.187 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.729 2.808 9.993 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.939 3.623 8.455 1.00 0.00 H new ATOM 483 N ASN A 34 10.154 1.774 7.883 1.00 0.00 N ATOM 484 CA ASN A 34 9.824 1.062 6.644 1.00 0.00 C ATOM 485 C ASN A 34 8.342 1.215 6.277 1.00 0.00 C ATOM 486 O ASN A 34 7.745 0.303 5.698 1.00 0.00 O ATOM 487 CB ASN A 34 10.195 -0.421 6.765 1.00 0.00 C ATOM 488 CG ASN A 34 9.546 -1.090 7.960 1.00 0.00 C ATOM 489 OD1 ASN A 34 10.172 -1.256 9.007 1.00 0.00 O ATOM 490 ND2 ASN A 34 8.288 -1.480 7.811 1.00 0.00 N ATOM 0 H ASN A 34 10.017 1.229 8.734 1.00 0.00 H new ATOM 0 HA ASN A 34 10.409 1.510 5.841 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.896 -0.942 5.855 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.278 -0.515 6.845 1.00 0.00 H new ATOM 0 HD21 ASN A 34 7.801 -1.938 8.582 1.00 0.00 H new ATOM 0 HD22 ASN A 34 7.807 -1.323 6.926 1.00 0.00 H new ATOM 497 N GLN A 35 7.757 2.368 6.609 1.00 0.00 N ATOM 498 CA GLN A 35 6.352 2.625 6.302 1.00 0.00 C ATOM 499 C GLN A 35 5.990 4.095 6.509 1.00 0.00 C ATOM 500 O GLN A 35 6.764 4.861 7.081 1.00 0.00 O ATOM 501 CB GLN A 35 5.446 1.744 7.168 1.00 0.00 C ATOM 502 CG GLN A 35 5.828 1.731 8.641 1.00 0.00 C ATOM 503 CD GLN A 35 4.864 0.921 9.485 1.00 0.00 C ATOM 504 OE1 GLN A 35 3.926 1.466 10.070 1.00 0.00 O ATOM 505 NE2 GLN A 35 5.087 -0.387 9.557 1.00 0.00 N ATOM 0 H GLN A 35 8.233 3.133 7.087 1.00 0.00 H new ATOM 0 HA GLN A 35 6.198 2.381 5.251 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.417 2.092 7.072 1.00 0.00 H new ATOM 0 HB3 GLN A 35 5.474 0.724 6.786 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.832 1.321 8.749 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.860 2.755 9.014 1.00 0.00 H new ATOM 0 HE21 GLN A 35 5.875 -0.798 9.057 1.00 0.00 H new ATOM 0 HE22 GLN A 35 4.470 -0.980 10.112 1.00 0.00 H new ATOM 514 N GLU A 36 4.802 4.472 6.040 1.00 0.00 N ATOM 515 CA GLU A 36 4.318 5.845 6.170 1.00 0.00 C ATOM 516 C GLU A 36 2.811 5.870 6.414 1.00 0.00 C ATOM 517 O GLU A 36 2.025 5.516 5.533 1.00 0.00 O ATOM 518 CB GLU A 36 4.653 6.652 4.912 1.00 0.00 C ATOM 519 CG GLU A 36 6.110 7.079 4.823 1.00 0.00 C ATOM 520 CD GLU A 36 6.265 8.506 4.336 1.00 0.00 C ATOM 521 OE1 GLU A 36 6.212 9.428 5.175 1.00 0.00 O ATOM 522 OE2 GLU A 36 6.437 8.701 3.114 1.00 0.00 O ATOM 0 H GLU A 36 4.155 3.843 5.565 1.00 0.00 H new ATOM 0 HA GLU A 36 4.817 6.297 7.027 1.00 0.00 H new ATOM 0 HB2 GLU A 36 4.405 6.056 4.033 1.00 0.00 H new ATOM 0 HB3 GLU A 36 4.022 7.540 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 36 6.575 6.980 5.804 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.642 6.408 4.149 1.00 0.00 H new ATOM 529 N VAL A 37 2.413 6.295 7.613 1.00 0.00 N ATOM 530 CA VAL A 37 0.999 6.370 7.970 1.00 0.00 C ATOM 531 C VAL A 37 0.473 7.794 7.802 1.00 0.00 C ATOM 532 O VAL A 37 0.920 8.715 8.489 1.00 0.00 O ATOM 533 CB VAL A 37 0.748 5.908 9.421 1.00 0.00 C ATOM 534 CG1 VAL A 37 -0.744 5.811 9.704 1.00 0.00 C ATOM 535 CG2 VAL A 37 1.436 4.576 9.695 1.00 0.00 C ATOM 0 H VAL A 37 3.050 6.592 8.352 1.00 0.00 H new ATOM 0 HA VAL A 37 0.467 5.700 7.295 1.00 0.00 H new ATOM 0 HB VAL A 37 1.176 6.653 10.092 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.899 5.484 10.732 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.206 6.788 9.561 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.198 5.092 9.022 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.244 4.272 10.724 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.047 3.819 9.014 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.510 4.683 9.543 1.00 0.00 H new ATOM 545 N PHE A 38 -0.479 7.966 6.886 1.00 0.00 N ATOM 546 CA PHE A 38 -1.068 9.276 6.625 1.00 0.00 C ATOM 547 C PHE A 38 -2.574 9.262 6.877 1.00 0.00 C ATOM 548 O PHE A 38 -3.195 8.198 6.933 1.00 0.00 O ATOM 549 CB PHE A 38 -0.791 9.702 5.182 1.00 0.00 C ATOM 550 CG PHE A 38 0.530 10.393 5.002 1.00 0.00 C ATOM 551 CD1 PHE A 38 1.712 9.667 4.975 1.00 0.00 C ATOM 552 CD2 PHE A 38 0.589 11.769 4.858 1.00 0.00 C ATOM 553 CE1 PHE A 38 2.926 10.304 4.804 1.00 0.00 C ATOM 554 CE2 PHE A 38 1.802 12.410 4.688 1.00 0.00 C ATOM 555 CZ PHE A 38 2.971 11.677 4.662 1.00 0.00 C ATOM 0 H PHE A 38 -0.858 7.213 6.312 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.610 9.992 7.308 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.821 8.822 4.540 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.588 10.367 4.849 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.683 8.593 5.089 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.323 12.348 4.879 1.00 0.00 H new ATOM 0 HE1 PHE A 38 3.840 9.728 4.781 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.835 13.484 4.576 1.00 0.00 H new ATOM 0 HZ PHE A 38 3.920 12.176 4.531 1.00 0.00 H new ATOM 565 N CYS A 39 -3.155 10.452 7.030 1.00 0.00 N ATOM 566 CA CYS A 39 -4.588 10.580 7.277 1.00 0.00 C ATOM 567 C CYS A 39 -5.119 11.919 6.766 1.00 0.00 C ATOM 568 O CYS A 39 -4.416 12.930 6.802 1.00 0.00 O ATOM 569 CB CYS A 39 -4.878 10.435 8.773 1.00 0.00 C ATOM 570 SG CYS A 39 -6.622 10.622 9.215 1.00 0.00 S ATOM 0 H CYS A 39 -2.654 11.340 6.987 1.00 0.00 H new ATOM 0 HA CYS A 39 -5.098 9.785 6.734 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.534 9.455 9.104 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -4.296 11.178 9.318 1.00 0.00 H new ATOM 0 HG CYS A 39 -7.345 9.839 8.470 1.00 0.00 H new ATOM 576 N HIS A 40 -6.364 11.916 6.294 1.00 0.00 N ATOM 577 CA HIS A 40 -6.997 13.128 5.782 1.00 0.00 C ATOM 578 C HIS A 40 -8.070 13.620 6.748 1.00 0.00 C ATOM 579 O HIS A 40 -9.135 13.018 6.858 1.00 0.00 O ATOM 580 CB HIS A 40 -7.614 12.864 4.406 1.00 0.00 C ATOM 581 CG HIS A 40 -6.689 12.154 3.466 1.00 0.00 C ATOM 582 ND1 HIS A 40 -6.873 10.847 3.068 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.565 12.580 2.847 1.00 0.00 C ATOM 584 CE1 HIS A 40 -5.901 10.499 2.244 1.00 0.00 C ATOM 585 NE2 HIS A 40 -5.095 11.533 2.094 1.00 0.00 N ATOM 0 H HIS A 40 -6.955 11.085 6.256 1.00 0.00 H new ATOM 0 HA HIS A 40 -6.233 13.900 5.685 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.520 12.271 4.530 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -7.913 13.813 3.962 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -5.120 13.561 2.930 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -5.786 9.534 1.774 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -4.257 11.551 1.512 1.00 0.00 H new ATOM 594 N PRO A 41 -7.799 14.725 7.469 1.00 0.00 N ATOM 595 CA PRO A 41 -8.749 15.293 8.438 1.00 0.00 C ATOM 596 C PRO A 41 -9.985 15.909 7.779 1.00 0.00 C ATOM 597 O PRO A 41 -11.020 16.074 8.427 1.00 0.00 O ATOM 598 CB PRO A 41 -7.929 16.376 9.145 1.00 0.00 C ATOM 599 CG PRO A 41 -6.873 16.755 8.167 1.00 0.00 C ATOM 600 CD PRO A 41 -6.546 15.502 7.404 1.00 0.00 C ATOM 0 HA PRO A 41 -9.145 14.526 9.103 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.549 17.233 9.409 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.494 16.001 10.071 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -7.225 17.539 7.497 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.991 17.143 8.676 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -6.262 15.721 6.375 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.714 14.962 7.856 1.00 0.00 H new ATOM 608 N VAL A 42 -9.873 16.256 6.496 1.00 0.00 N ATOM 609 CA VAL A 42 -10.983 16.861 5.766 1.00 0.00 C ATOM 610 C VAL A 42 -11.969 15.802 5.273 1.00 0.00 C ATOM 611 O VAL A 42 -13.125 15.770 5.699 1.00 0.00 O ATOM 612 CB VAL A 42 -10.478 17.680 4.556 1.00 0.00 C ATOM 613 CG1 VAL A 42 -11.628 18.427 3.895 1.00 0.00 C ATOM 614 CG2 VAL A 42 -9.379 18.645 4.979 1.00 0.00 C ATOM 0 H VAL A 42 -9.025 16.128 5.943 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.492 17.526 6.463 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.058 16.987 3.826 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.251 18.997 3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.375 17.713 3.550 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.082 19.107 4.616 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.038 19.211 4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.767 19.332 5.731 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.543 18.084 5.397 1.00 0.00 H new ATOM 624 N THR A 43 -11.504 14.945 4.367 1.00 0.00 N ATOM 625 CA THR A 43 -12.338 13.884 3.799 1.00 0.00 C ATOM 626 C THR A 43 -12.513 12.716 4.778 1.00 0.00 C ATOM 627 O THR A 43 -13.420 11.898 4.611 1.00 0.00 O ATOM 628 CB THR A 43 -11.727 13.386 2.485 1.00 0.00 C ATOM 629 OG1 THR A 43 -11.018 14.427 1.834 1.00 0.00 O ATOM 630 CG2 THR A 43 -12.748 12.853 1.504 1.00 0.00 C ATOM 0 H THR A 43 -10.550 14.964 4.008 1.00 0.00 H new ATOM 0 HA THR A 43 -13.326 14.302 3.604 1.00 0.00 H new ATOM 0 HB THR A 43 -11.065 12.570 2.774 1.00 0.00 H new ATOM 0 HG1 THR A 43 -10.169 14.079 1.490 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.242 12.519 0.598 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.280 12.014 1.953 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.458 13.641 1.253 1.00 0.00 H new ATOM 638 N ASP A 44 -11.644 12.644 5.793 1.00 0.00 N ATOM 639 CA ASP A 44 -11.699 11.584 6.802 1.00 0.00 C ATOM 640 C ASP A 44 -11.402 10.215 6.189 1.00 0.00 C ATOM 641 O ASP A 44 -12.311 9.499 5.761 1.00 0.00 O ATOM 642 CB ASP A 44 -13.061 11.574 7.506 1.00 0.00 C ATOM 643 CG ASP A 44 -13.016 12.259 8.859 1.00 0.00 C ATOM 644 OD1 ASP A 44 -12.539 11.631 9.828 1.00 0.00 O ATOM 645 OD2 ASP A 44 -13.453 13.425 8.947 1.00 0.00 O ATOM 0 H ASP A 44 -10.889 13.314 5.936 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.928 11.793 7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.797 12.071 6.874 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.394 10.544 7.634 1.00 0.00 H new ATOM 650 N GLN A 45 -10.118 9.857 6.158 1.00 0.00 N ATOM 651 CA GLN A 45 -9.680 8.574 5.608 1.00 0.00 C ATOM 652 C GLN A 45 -8.326 8.165 6.193 1.00 0.00 C ATOM 653 O GLN A 45 -7.764 8.872 7.031 1.00 0.00 O ATOM 654 CB GLN A 45 -9.587 8.655 4.080 1.00 0.00 C ATOM 655 CG GLN A 45 -10.323 7.535 3.364 1.00 0.00 C ATOM 656 CD GLN A 45 -11.332 8.049 2.356 1.00 0.00 C ATOM 657 OE1 GLN A 45 -12.403 8.534 2.722 1.00 0.00 O ATOM 658 NE2 GLN A 45 -10.995 7.948 1.075 1.00 0.00 N ATOM 0 H GLN A 45 -9.359 10.441 6.509 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.417 7.818 5.880 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.991 9.612 3.750 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.537 8.634 3.787 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.600 6.898 2.855 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.834 6.914 4.099 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -10.097 7.540 0.814 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -11.634 8.279 0.352 1.00 0.00 H new ATOM 667 N SER A 46 -7.803 7.022 5.744 1.00 0.00 N ATOM 668 CA SER A 46 -6.514 6.530 6.226 1.00 0.00 C ATOM 669 C SER A 46 -5.728 5.849 5.107 1.00 0.00 C ATOM 670 O SER A 46 -6.194 4.876 4.510 1.00 0.00 O ATOM 671 CB SER A 46 -6.717 5.553 7.387 1.00 0.00 C ATOM 672 OG SER A 46 -6.498 6.192 8.633 1.00 0.00 O ATOM 0 H SER A 46 -8.251 6.423 5.050 1.00 0.00 H new ATOM 0 HA SER A 46 -5.940 7.388 6.575 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.729 5.149 7.354 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.034 4.710 7.281 1.00 0.00 H new ATOM 0 HG SER A 46 -6.635 5.548 9.359 1.00 0.00 H new ATOM 678 N LEU A 47 -4.528 6.365 4.834 1.00 0.00 N ATOM 679 CA LEU A 47 -3.663 5.810 3.795 1.00 0.00 C ATOM 680 C LEU A 47 -2.283 5.488 4.369 1.00 0.00 C ATOM 681 O LEU A 47 -1.593 6.375 4.873 1.00 0.00 O ATOM 682 CB LEU A 47 -3.527 6.793 2.625 1.00 0.00 C ATOM 683 CG LEU A 47 -4.439 6.509 1.427 1.00 0.00 C ATOM 684 CD1 LEU A 47 -5.897 6.763 1.785 1.00 0.00 C ATOM 685 CD2 LEU A 47 -4.024 7.358 0.233 1.00 0.00 C ATOM 0 H LEU A 47 -4.133 7.170 5.321 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.117 4.890 3.427 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.735 7.799 2.990 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.492 6.786 2.283 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.335 5.458 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.526 6.555 0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.188 6.112 2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.023 7.804 2.083 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.681 7.145 -0.610 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.098 8.414 0.494 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.995 7.123 -0.040 1.00 0.00 H new ATOM 697 N ILE A 48 -1.894 4.214 4.306 1.00 0.00 N ATOM 698 CA ILE A 48 -0.603 3.782 4.840 1.00 0.00 C ATOM 699 C ILE A 48 0.118 2.826 3.888 1.00 0.00 C ATOM 700 O ILE A 48 -0.496 1.927 3.309 1.00 0.00 O ATOM 701 CB ILE A 48 -0.763 3.084 6.209 1.00 0.00 C ATOM 702 CG1 ILE A 48 -1.668 3.902 7.137 1.00 0.00 C ATOM 703 CG2 ILE A 48 0.599 2.856 6.857 1.00 0.00 C ATOM 704 CD1 ILE A 48 -3.141 3.592 6.980 1.00 0.00 C ATOM 0 H ILE A 48 -2.452 3.467 3.893 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.007 4.687 4.957 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.234 2.115 6.042 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.375 3.717 8.171 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.507 4.963 6.945 1.00 0.00 H new ATOM 0 HG21 ILE A 48 0.466 2.363 7.820 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.209 2.227 6.209 1.00 0.00 H new ATOM 0 HG23 ILE A 48 1.096 3.814 7.005 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.718 4.209 7.669 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.450 3.804 5.957 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.317 2.539 7.202 1.00 0.00 H new ATOM 716 N VAL A 49 1.432 3.018 3.753 1.00 0.00 N ATOM 717 CA VAL A 49 2.258 2.167 2.897 1.00 0.00 C ATOM 718 C VAL A 49 3.293 1.422 3.739 1.00 0.00 C ATOM 719 O VAL A 49 4.118 2.042 4.411 1.00 0.00 O ATOM 720 CB VAL A 49 2.985 2.979 1.804 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.712 2.051 0.838 1.00 0.00 C ATOM 722 CG2 VAL A 49 2.007 3.874 1.055 1.00 0.00 C ATOM 0 H VAL A 49 1.948 3.759 4.228 1.00 0.00 H new ATOM 0 HA VAL A 49 1.591 1.458 2.407 1.00 0.00 H new ATOM 0 HB VAL A 49 3.725 3.615 2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.218 2.643 0.076 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.447 1.460 1.385 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.992 1.385 0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.542 4.437 0.290 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.239 3.260 0.584 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.539 4.567 1.754 1.00 0.00 H new ATOM 732 N GLU A 50 3.232 0.090 3.710 1.00 0.00 N ATOM 733 CA GLU A 50 4.152 -0.744 4.482 1.00 0.00 C ATOM 734 C GLU A 50 5.101 -1.522 3.570 1.00 0.00 C ATOM 735 O GLU A 50 4.720 -1.946 2.477 1.00 0.00 O ATOM 736 CB GLU A 50 3.362 -1.714 5.363 1.00 0.00 C ATOM 737 CG GLU A 50 3.980 -1.942 6.733 1.00 0.00 C ATOM 738 CD GLU A 50 4.683 -3.281 6.844 1.00 0.00 C ATOM 739 OE1 GLU A 50 4.024 -4.319 6.624 1.00 0.00 O ATOM 740 OE2 GLU A 50 5.893 -3.292 7.151 1.00 0.00 O ATOM 0 H GLU A 50 2.553 -0.435 3.159 1.00 0.00 H new ATOM 0 HA GLU A 50 4.754 -0.088 5.111 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.349 -1.331 5.491 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.278 -2.671 4.849 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.692 -1.144 6.943 1.00 0.00 H new ATOM 0 HG3 GLU A 50 3.201 -1.882 7.493 1.00 0.00 H new ATOM 747 N LEU A 51 6.337 -1.713 4.034 1.00 0.00 N ATOM 748 CA LEU A 51 7.346 -2.449 3.273 1.00 0.00 C ATOM 749 C LEU A 51 7.798 -3.692 4.034 1.00 0.00 C ATOM 750 O LEU A 51 8.175 -3.613 5.205 1.00 0.00 O ATOM 751 CB LEU A 51 8.550 -1.550 2.970 1.00 0.00 C ATOM 752 CG LEU A 51 9.683 -2.225 2.190 1.00 0.00 C ATOM 753 CD1 LEU A 51 9.331 -2.326 0.712 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.989 -1.468 2.381 1.00 0.00 C ATOM 0 H LEU A 51 6.663 -1.367 4.936 1.00 0.00 H new ATOM 0 HA LEU A 51 6.897 -2.764 2.331 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.205 -0.685 2.404 1.00 0.00 H new ATOM 0 HB3 LEU A 51 8.951 -1.175 3.912 1.00 0.00 H new ATOM 0 HG LEU A 51 9.813 -3.235 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.148 -2.808 0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.422 -2.915 0.594 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.171 -1.327 0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.782 -1.963 1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.873 -0.446 2.021 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.249 -1.453 3.439 1.00 0.00 H new ATOM 766 N LEU A 52 7.750 -4.841 3.362 1.00 0.00 N ATOM 767 CA LEU A 52 8.146 -6.110 3.967 1.00 0.00 C ATOM 768 C LEU A 52 8.971 -6.956 2.998 1.00 0.00 C ATOM 769 O LEU A 52 9.190 -6.569 1.849 1.00 0.00 O ATOM 770 CB LEU A 52 6.902 -6.891 4.402 1.00 0.00 C ATOM 771 CG LEU A 52 6.366 -6.540 5.792 1.00 0.00 C ATOM 772 CD1 LEU A 52 5.024 -7.217 6.029 1.00 0.00 C ATOM 773 CD2 LEU A 52 7.365 -6.935 6.871 1.00 0.00 C ATOM 0 H LEU A 52 7.439 -4.918 2.394 1.00 0.00 H new ATOM 0 HA LEU A 52 8.764 -5.889 4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.111 -6.720 3.671 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.134 -7.956 4.378 1.00 0.00 H new ATOM 0 HG LEU A 52 6.222 -5.461 5.843 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.656 -6.958 7.022 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.309 -6.881 5.278 1.00 0.00 H new ATOM 0 HD13 LEU A 52 5.144 -8.298 5.958 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.964 -6.676 7.851 1.00 0.00 H new ATOM 0 HD22 LEU A 52 7.545 -8.009 6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.303 -6.403 6.711 1.00 0.00 H new ATOM 785 N GLU A 53 9.421 -8.119 3.470 1.00 0.00 N ATOM 786 CA GLU A 53 10.213 -9.033 2.651 1.00 0.00 C ATOM 787 C GLU A 53 9.455 -10.341 2.425 1.00 0.00 C ATOM 788 O GLU A 53 8.838 -10.877 3.350 1.00 0.00 O ATOM 789 CB GLU A 53 11.565 -9.311 3.317 1.00 0.00 C ATOM 790 CG GLU A 53 12.735 -9.341 2.342 1.00 0.00 C ATOM 791 CD GLU A 53 14.064 -8.998 2.995 1.00 0.00 C ATOM 792 OE1 GLU A 53 14.316 -9.473 4.124 1.00 0.00 O ATOM 793 OE2 GLU A 53 14.856 -8.257 2.373 1.00 0.00 O ATOM 0 H GLU A 53 9.249 -8.450 4.419 1.00 0.00 H new ATOM 0 HA GLU A 53 10.391 -8.563 1.684 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.752 -8.547 4.071 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.513 -10.267 3.838 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.802 -10.333 1.895 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.543 -8.638 1.532 1.00 0.00 H new ATOM 800 N LEU A 54 9.500 -10.846 1.188 1.00 0.00 N ATOM 801 CA LEU A 54 8.816 -12.092 0.827 1.00 0.00 C ATOM 802 C LEU A 54 9.160 -13.216 1.806 1.00 0.00 C ATOM 803 O LEU A 54 10.329 -13.568 1.975 1.00 0.00 O ATOM 804 CB LEU A 54 9.195 -12.507 -0.600 1.00 0.00 C ATOM 805 CG LEU A 54 8.017 -12.706 -1.558 1.00 0.00 C ATOM 806 CD1 LEU A 54 8.478 -12.592 -3.004 1.00 0.00 C ATOM 807 CD2 LEU A 54 7.353 -14.052 -1.311 1.00 0.00 C ATOM 0 H LEU A 54 10.005 -10.409 0.417 1.00 0.00 H new ATOM 0 HA LEU A 54 7.742 -11.914 0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.857 -11.749 -1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 54 9.764 -13.436 -0.552 1.00 0.00 H new ATOM 0 HG LEU A 54 7.284 -11.921 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.627 -12.736 -3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.907 -11.604 -3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.231 -13.354 -3.207 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.518 -14.178 -2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 54 8.078 -14.850 -1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.987 -14.094 -0.285 1.00 0.00 H new ATOM 819 N GLN A 55 8.133 -13.771 2.454 1.00 0.00 N ATOM 820 CA GLN A 55 8.326 -14.851 3.421 1.00 0.00 C ATOM 821 C GLN A 55 7.876 -16.196 2.852 1.00 0.00 C ATOM 822 O GLN A 55 6.772 -16.314 2.316 1.00 0.00 O ATOM 823 CB GLN A 55 7.558 -14.552 4.711 1.00 0.00 C ATOM 824 CG GLN A 55 8.027 -13.293 5.427 1.00 0.00 C ATOM 825 CD GLN A 55 9.472 -13.380 5.887 1.00 0.00 C ATOM 826 OE1 GLN A 55 10.299 -12.545 5.526 1.00 0.00 O ATOM 827 NE2 GLN A 55 9.782 -14.393 6.689 1.00 0.00 N ATOM 0 H GLN A 55 7.161 -13.490 2.326 1.00 0.00 H new ATOM 0 HA GLN A 55 9.392 -14.913 3.640 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.498 -14.452 4.477 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.657 -15.401 5.387 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.914 -12.438 4.760 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.386 -13.111 6.290 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.064 -15.064 6.964 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.738 -14.500 7.029 1.00 0.00 H new ATOM 836 N ALA A 56 8.742 -17.204 2.984 1.00 0.00 N ATOM 837 CA ALA A 56 8.463 -18.557 2.500 1.00 0.00 C ATOM 838 C ALA A 56 8.272 -18.592 0.982 1.00 0.00 C ATOM 839 O ALA A 56 9.217 -18.876 0.246 1.00 0.00 O ATOM 840 CB ALA A 56 7.252 -19.149 3.215 1.00 0.00 C ATOM 0 H ALA A 56 9.655 -17.105 3.429 1.00 0.00 H new ATOM 0 HA ALA A 56 9.334 -19.171 2.730 1.00 0.00 H new ATOM 0 HB1 ALA A 56 7.063 -20.155 2.839 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.447 -19.193 4.286 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.379 -18.523 3.031 1.00 0.00 H new ATOM 846 N HIS A 57 7.052 -18.307 0.518 1.00 0.00 N ATOM 847 CA HIS A 57 6.750 -18.313 -0.915 1.00 0.00 C ATOM 848 C HIS A 57 5.311 -17.870 -1.182 1.00 0.00 C ATOM 849 O HIS A 57 4.461 -18.681 -1.558 1.00 0.00 O ATOM 850 CB HIS A 57 6.986 -19.710 -1.512 1.00 0.00 C ATOM 851 CG HIS A 57 6.508 -20.844 -0.651 1.00 0.00 C ATOM 852 ND1 HIS A 57 5.344 -20.799 0.090 1.00 0.00 N ATOM 853 CD2 HIS A 57 7.049 -22.064 -0.426 1.00 0.00 C ATOM 854 CE1 HIS A 57 5.190 -21.944 0.732 1.00 0.00 C ATOM 855 NE2 HIS A 57 6.211 -22.728 0.434 1.00 0.00 N ATOM 0 H HIS A 57 6.259 -18.070 1.114 1.00 0.00 H new ATOM 0 HA HIS A 57 7.422 -17.602 -1.396 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.485 -19.768 -2.478 1.00 0.00 H new ATOM 0 HB3 HIS A 57 8.053 -19.836 -1.698 1.00 0.00 H new ATOM 0 HD1 HIS A 57 4.703 -20.007 0.135 1.00 0.00 H new ATOM 0 HD2 HIS A 57 7.969 -22.444 -0.845 1.00 0.00 H new ATOM 0 HE1 HIS A 57 4.370 -22.196 1.388 1.00 0.00 H new ATOM 864 N VAL A 58 5.043 -16.582 -0.987 1.00 0.00 N ATOM 865 CA VAL A 58 3.706 -16.034 -1.210 1.00 0.00 C ATOM 866 C VAL A 58 3.749 -14.834 -2.154 1.00 0.00 C ATOM 867 O VAL A 58 4.312 -13.791 -1.820 1.00 0.00 O ATOM 868 CB VAL A 58 3.032 -15.621 0.119 1.00 0.00 C ATOM 869 CG1 VAL A 58 2.606 -16.853 0.908 1.00 0.00 C ATOM 870 CG2 VAL A 58 3.957 -14.741 0.953 1.00 0.00 C ATOM 0 H VAL A 58 5.732 -15.898 -0.675 1.00 0.00 H new ATOM 0 HA VAL A 58 3.114 -16.826 -1.670 1.00 0.00 H new ATOM 0 HB VAL A 58 2.142 -15.039 -0.120 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.134 -16.543 1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.898 -17.436 0.319 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.481 -17.463 1.130 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.457 -14.466 1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.872 -15.288 1.181 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.204 -13.839 0.393 1.00 0.00 H new ATOM 880 N ARG A 59 3.154 -14.990 -3.341 1.00 0.00 N ATOM 881 CA ARG A 59 3.134 -13.914 -4.331 1.00 0.00 C ATOM 882 C ARG A 59 1.903 -13.999 -5.229 1.00 0.00 C ATOM 883 O ARG A 59 1.627 -15.039 -5.830 1.00 0.00 O ATOM 884 CB ARG A 59 4.410 -13.937 -5.187 1.00 0.00 C ATOM 885 CG ARG A 59 4.765 -15.310 -5.742 1.00 0.00 C ATOM 886 CD ARG A 59 5.373 -15.207 -7.136 1.00 0.00 C ATOM 887 NE ARG A 59 5.183 -16.431 -7.912 1.00 0.00 N ATOM 888 CZ ARG A 59 4.021 -16.794 -8.462 1.00 0.00 C ATOM 889 NH1 ARG A 59 2.935 -16.042 -8.302 1.00 0.00 N ATOM 890 NH2 ARG A 59 3.944 -17.917 -9.169 1.00 0.00 N ATOM 0 H ARG A 59 2.684 -15.846 -3.636 1.00 0.00 H new ATOM 0 HA ARG A 59 3.090 -12.972 -3.784 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.289 -13.242 -6.018 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.244 -13.574 -4.586 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.469 -15.804 -5.072 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.870 -15.932 -5.779 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.922 -14.369 -7.667 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.439 -14.994 -7.051 1.00 0.00 H new ATOM 0 HE ARG A 59 5.987 -17.046 -8.041 1.00 0.00 H new ATOM 0 HH11 ARG A 59 2.986 -15.182 -7.756 1.00 0.00 H new ATOM 0 HH12 ARG A 59 2.051 -16.326 -8.725 1.00 0.00 H new ATOM 0 HH21 ARG A 59 4.772 -18.501 -9.291 1.00 0.00 H new ATOM 0 HH22 ARG A 59 3.057 -18.195 -9.589 1.00 0.00 H new ATOM 904 N GLY A 60 1.173 -12.888 -5.316 1.00 0.00 N ATOM 905 CA GLY A 60 -0.020 -12.834 -6.141 1.00 0.00 C ATOM 906 C GLY A 60 -1.292 -12.773 -5.321 1.00 0.00 C ATOM 907 O GLY A 60 -1.310 -12.186 -4.236 1.00 0.00 O ATOM 0 H GLY A 60 1.390 -12.020 -4.826 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.031 -11.961 -6.791 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.050 -13.711 -6.787 1.00 0.00 H new ATOM 911 N GLU A 61 -2.354 -13.390 -5.836 1.00 0.00 N ATOM 912 CA GLU A 61 -3.640 -13.418 -5.141 1.00 0.00 C ATOM 913 C GLU A 61 -3.507 -14.103 -3.780 1.00 0.00 C ATOM 914 O GLU A 61 -4.265 -13.813 -2.853 1.00 0.00 O ATOM 915 CB GLU A 61 -4.689 -14.145 -5.987 1.00 0.00 C ATOM 916 CG GLU A 61 -6.112 -13.969 -5.475 1.00 0.00 C ATOM 917 CD GLU A 61 -6.635 -15.195 -4.748 1.00 0.00 C ATOM 918 OE1 GLU A 61 -6.557 -16.304 -5.316 1.00 0.00 O ATOM 919 OE2 GLU A 61 -7.126 -15.047 -3.610 1.00 0.00 O ATOM 0 H GLU A 61 -2.350 -13.877 -6.732 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.961 -12.388 -4.984 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.633 -13.780 -7.013 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.450 -15.208 -6.013 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -6.147 -13.112 -4.803 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -6.769 -13.743 -6.315 1.00 0.00 H new ATOM 926 N ALA A 62 -2.529 -15.009 -3.667 1.00 0.00 N ATOM 927 CA ALA A 62 -2.283 -15.732 -2.423 1.00 0.00 C ATOM 928 C ALA A 62 -1.572 -14.837 -1.411 1.00 0.00 C ATOM 929 O ALA A 62 -1.861 -14.885 -0.216 1.00 0.00 O ATOM 930 CB ALA A 62 -1.458 -16.985 -2.690 1.00 0.00 C ATOM 0 H ALA A 62 -1.895 -15.257 -4.427 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.245 -16.029 -2.005 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.284 -17.512 -1.752 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.998 -17.636 -3.378 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.502 -16.704 -3.131 1.00 0.00 H new ATOM 936 N ALA A 63 -0.641 -14.017 -1.906 1.00 0.00 N ATOM 937 CA ALA A 63 0.116 -13.102 -1.054 1.00 0.00 C ATOM 938 C ALA A 63 -0.794 -12.036 -0.448 1.00 0.00 C ATOM 939 O ALA A 63 -0.618 -11.644 0.706 1.00 0.00 O ATOM 940 CB ALA A 63 1.246 -12.453 -1.841 1.00 0.00 C ATOM 0 H ALA A 63 -0.395 -13.970 -2.895 1.00 0.00 H new ATOM 0 HA ALA A 63 0.548 -13.681 -0.237 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.799 -11.775 -1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.918 -13.225 -2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.831 -11.894 -2.680 1.00 0.00 H new ATOM 946 N ALA A 64 -1.769 -11.570 -1.233 1.00 0.00 N ATOM 947 CA ALA A 64 -2.710 -10.551 -0.770 1.00 0.00 C ATOM 948 C ALA A 64 -3.445 -11.012 0.486 1.00 0.00 C ATOM 949 O ALA A 64 -3.561 -10.260 1.454 1.00 0.00 O ATOM 950 CB ALA A 64 -3.704 -10.201 -1.871 1.00 0.00 C ATOM 0 H ALA A 64 -1.926 -11.883 -2.191 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.140 -9.657 -0.519 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.396 -9.441 -1.508 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.166 -9.818 -2.738 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.261 -11.094 -2.155 1.00 0.00 H new ATOM 956 N ARG A 65 -3.932 -12.252 0.467 1.00 0.00 N ATOM 957 CA ARG A 65 -4.651 -12.814 1.609 1.00 0.00 C ATOM 958 C ARG A 65 -3.736 -12.932 2.829 1.00 0.00 C ATOM 959 O ARG A 65 -4.161 -12.682 3.958 1.00 0.00 O ATOM 960 CB ARG A 65 -5.231 -14.185 1.257 1.00 0.00 C ATOM 961 CG ARG A 65 -6.492 -14.114 0.405 1.00 0.00 C ATOM 962 CD ARG A 65 -6.494 -15.170 -0.689 1.00 0.00 C ATOM 963 NE ARG A 65 -6.284 -16.519 -0.160 1.00 0.00 N ATOM 964 CZ ARG A 65 -6.548 -17.635 -0.842 1.00 0.00 C ATOM 965 NH1 ARG A 65 -7.032 -17.571 -2.079 1.00 0.00 N ATOM 966 NH2 ARG A 65 -6.322 -18.819 -0.287 1.00 0.00 N ATOM 0 H ARG A 65 -3.842 -12.886 -0.327 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.469 -12.137 1.855 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.476 -14.764 0.726 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.455 -14.723 2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -7.368 -14.247 1.040 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -6.572 -13.124 -0.045 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.444 -15.135 -1.223 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -5.713 -14.941 -1.414 1.00 0.00 H new ATOM 0 HE ARG A 65 -5.914 -16.611 0.786 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -7.204 -16.664 -2.513 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -7.231 -18.429 -2.594 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -5.947 -18.875 0.660 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -6.523 -19.673 -0.807 1.00 0.00 H new ATOM 980 N TYR A 66 -2.476 -13.307 2.594 1.00 0.00 N ATOM 981 CA TYR A 66 -1.499 -13.451 3.674 1.00 0.00 C ATOM 982 C TYR A 66 -1.384 -12.159 4.482 1.00 0.00 C ATOM 983 O TYR A 66 -1.414 -12.182 5.712 1.00 0.00 O ATOM 984 CB TYR A 66 -0.129 -13.835 3.101 1.00 0.00 C ATOM 985 CG TYR A 66 0.950 -14.031 4.150 1.00 0.00 C ATOM 986 CD1 TYR A 66 0.899 -15.101 5.037 1.00 0.00 C ATOM 987 CD2 TYR A 66 2.020 -13.148 4.248 1.00 0.00 C ATOM 988 CE1 TYR A 66 1.884 -15.284 5.989 1.00 0.00 C ATOM 989 CE2 TYR A 66 3.007 -13.327 5.198 1.00 0.00 C ATOM 990 CZ TYR A 66 2.934 -14.395 6.066 1.00 0.00 C ATOM 991 OH TYR A 66 3.918 -14.577 7.013 1.00 0.00 O ATOM 0 H TYR A 66 -2.109 -13.516 1.665 1.00 0.00 H new ATOM 0 HA TYR A 66 -1.843 -14.243 4.340 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.233 -14.755 2.526 1.00 0.00 H new ATOM 0 HB3 TYR A 66 0.192 -13.059 2.406 1.00 0.00 H new ATOM 0 HD1 TYR A 66 0.077 -15.799 4.981 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.080 -12.309 3.571 1.00 0.00 H new ATOM 0 HE1 TYR A 66 1.831 -16.121 6.670 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.832 -12.633 5.260 1.00 0.00 H new ATOM 0 HH TYR A 66 4.585 -13.864 6.933 1.00 0.00 H new ATOM 1001 N HIS A 67 -1.256 -11.034 3.780 1.00 0.00 N ATOM 1002 CA HIS A 67 -1.138 -9.733 4.434 1.00 0.00 C ATOM 1003 C HIS A 67 -2.496 -9.245 4.941 1.00 0.00 C ATOM 1004 O HIS A 67 -2.575 -8.565 5.965 1.00 0.00 O ATOM 1005 CB HIS A 67 -0.530 -8.709 3.474 1.00 0.00 C ATOM 1006 CG HIS A 67 0.940 -8.903 3.260 1.00 0.00 C ATOM 1007 ND1 HIS A 67 1.885 -8.634 4.227 1.00 0.00 N ATOM 1008 CD2 HIS A 67 1.625 -9.352 2.182 1.00 0.00 C ATOM 1009 CE1 HIS A 67 3.088 -8.907 3.754 1.00 0.00 C ATOM 1010 NE2 HIS A 67 2.957 -9.345 2.516 1.00 0.00 N ATOM 0 H HIS A 67 -1.231 -10.998 2.761 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.478 -9.846 5.294 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.042 -8.772 2.514 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.705 -7.706 3.864 1.00 0.00 H new ATOM 0 HD1 HIS A 67 1.686 -8.279 5.162 1.00 0.00 H new ATOM 0 HD2 HIS A 67 1.203 -9.658 1.236 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.019 -8.792 4.289 1.00 0.00 H new ATOM 1019 N PHE A 68 -3.564 -9.600 4.224 1.00 0.00 N ATOM 1020 CA PHE A 68 -4.916 -9.203 4.608 1.00 0.00 C ATOM 1021 C PHE A 68 -5.260 -9.726 6.002 1.00 0.00 C ATOM 1022 O PHE A 68 -5.753 -8.979 6.848 1.00 0.00 O ATOM 1023 CB PHE A 68 -5.935 -9.724 3.588 1.00 0.00 C ATOM 1024 CG PHE A 68 -7.328 -9.182 3.783 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -7.727 -8.014 3.151 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -8.237 -9.844 4.594 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -9.006 -7.518 3.324 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -9.516 -9.351 4.771 1.00 0.00 C ATOM 1029 CZ PHE A 68 -9.901 -8.187 4.135 1.00 0.00 C ATOM 0 H PHE A 68 -3.517 -10.162 3.374 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.957 -8.114 4.626 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.593 -9.468 2.585 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.968 -10.812 3.646 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.031 -7.486 2.516 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.942 -10.755 5.093 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -9.305 -6.608 2.825 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -10.214 -9.876 5.406 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.900 -7.801 4.272 1.00 0.00 H new ATOM 1039 N GLU A 69 -4.988 -11.012 6.238 1.00 0.00 N ATOM 1040 CA GLU A 69 -5.266 -11.627 7.533 1.00 0.00 C ATOM 1041 C GLU A 69 -4.372 -11.044 8.629 1.00 0.00 C ATOM 1042 O GLU A 69 -4.765 -10.988 9.794 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.080 -13.145 7.461 1.00 0.00 C ATOM 1044 CG GLU A 69 -6.315 -13.884 6.966 1.00 0.00 C ATOM 1045 CD GLU A 69 -6.719 -15.033 7.872 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -6.981 -14.784 9.067 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -6.773 -16.182 7.385 1.00 0.00 O ATOM 0 H GLU A 69 -4.577 -11.643 5.550 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.304 -11.408 7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.243 -13.370 6.801 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.815 -13.518 8.450 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.145 -13.182 6.886 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.125 -14.268 5.964 1.00 0.00 H new ATOM 1054 N ASP A 70 -3.170 -10.607 8.247 1.00 0.00 N ATOM 1055 CA ASP A 70 -2.225 -10.025 9.198 1.00 0.00 C ATOM 1056 C ASP A 70 -2.758 -8.715 9.784 1.00 0.00 C ATOM 1057 O ASP A 70 -2.416 -8.350 10.908 1.00 0.00 O ATOM 1058 CB ASP A 70 -0.870 -9.780 8.525 1.00 0.00 C ATOM 1059 CG ASP A 70 0.068 -10.968 8.645 1.00 0.00 C ATOM 1060 OD1 ASP A 70 -0.397 -12.116 8.480 1.00 0.00 O ATOM 1061 OD2 ASP A 70 1.270 -10.751 8.900 1.00 0.00 O ATOM 0 H ASP A 70 -2.830 -10.646 7.286 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.097 -10.737 10.013 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.029 -9.553 7.471 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.400 -8.904 8.973 1.00 0.00 H new ATOM 1066 N VAL A 71 -3.590 -8.008 9.019 1.00 0.00 N ATOM 1067 CA VAL A 71 -4.158 -6.741 9.475 1.00 0.00 C ATOM 1068 C VAL A 71 -5.441 -6.967 10.270 1.00 0.00 C ATOM 1069 O VAL A 71 -5.580 -6.478 11.392 1.00 0.00 O ATOM 1070 CB VAL A 71 -4.467 -5.804 8.295 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -4.878 -4.426 8.797 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -3.271 -5.707 7.357 1.00 0.00 C ATOM 0 H VAL A 71 -3.884 -8.291 8.084 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.409 -6.275 10.115 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.302 -6.223 7.734 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.092 -3.778 7.947 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.769 -4.516 9.418 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.067 -3.996 9.385 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.511 -5.039 6.529 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -2.412 -5.315 7.902 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.033 -6.697 6.967 1.00 0.00 H new ATOM 1082 N GLY A 72 -6.377 -7.710 9.679 1.00 0.00 N ATOM 1083 CA GLY A 72 -7.637 -7.992 10.341 1.00 0.00 C ATOM 1084 C GLY A 72 -7.489 -8.923 11.537 1.00 0.00 C ATOM 1085 O GLY A 72 -8.452 -9.138 12.278 1.00 0.00 O ATOM 0 H GLY A 72 -6.282 -8.122 8.751 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.085 -7.055 10.671 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.325 -8.439 9.624 1.00 0.00 H new ATOM 1089 N GLY A 73 -6.291 -9.486 11.722 1.00 0.00 N ATOM 1090 CA GLY A 73 -6.054 -10.399 12.830 1.00 0.00 C ATOM 1091 C GLY A 73 -5.467 -9.727 14.061 1.00 0.00 C ATOM 1092 O GLY A 73 -5.705 -10.178 15.183 1.00 0.00 O ATOM 0 H GLY A 73 -5.482 -9.324 11.122 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -6.995 -10.878 13.102 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.378 -11.188 12.501 1.00 0.00 H new ATOM 1096 N VAL A 74 -4.694 -8.657 13.863 1.00 0.00 N ATOM 1097 CA VAL A 74 -4.076 -7.948 14.984 1.00 0.00 C ATOM 1098 C VAL A 74 -5.116 -7.171 15.789 1.00 0.00 C ATOM 1099 O VAL A 74 -5.294 -7.411 16.985 1.00 0.00 O ATOM 1100 CB VAL A 74 -2.970 -6.980 14.514 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -2.285 -6.330 15.708 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -1.956 -7.711 13.644 1.00 0.00 C ATOM 0 H VAL A 74 -4.483 -8.266 12.945 1.00 0.00 H new ATOM 0 HA VAL A 74 -3.624 -8.710 15.620 1.00 0.00 H new ATOM 0 HB VAL A 74 -3.431 -6.194 13.916 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.508 -5.651 15.357 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.019 -5.772 16.289 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.837 -7.101 16.334 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.183 -7.013 13.321 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.500 -8.518 14.217 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -2.458 -8.126 12.770 1.00 0.00 H new ATOM 1112 N GLN A 75 -5.802 -6.242 15.129 1.00 0.00 N ATOM 1113 CA GLN A 75 -6.826 -5.434 15.783 1.00 0.00 C ATOM 1114 C GLN A 75 -8.157 -6.193 15.830 1.00 0.00 C ATOM 1115 O GLN A 75 -8.177 -7.421 15.714 1.00 0.00 O ATOM 1116 CB GLN A 75 -6.988 -4.102 15.043 1.00 0.00 C ATOM 1117 CG GLN A 75 -5.740 -3.231 15.079 1.00 0.00 C ATOM 1118 CD GLN A 75 -4.687 -3.664 14.074 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -3.516 -3.820 14.419 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -5.092 -3.860 12.821 1.00 0.00 N ATOM 0 H GLN A 75 -5.667 -6.030 14.140 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.516 -5.230 16.808 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -7.252 -4.302 14.005 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -7.819 -3.550 15.482 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -6.020 -2.196 14.881 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -5.312 -3.260 16.081 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -6.072 -3.720 12.574 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -4.423 -4.150 12.108 1.00 0.00 H new ATOM 1129 N GLY A 76 -9.267 -5.466 15.999 1.00 0.00 N ATOM 1130 CA GLY A 76 -10.571 -6.103 16.048 1.00 0.00 C ATOM 1131 C GLY A 76 -10.974 -6.680 14.706 1.00 0.00 C ATOM 1132 O GLY A 76 -10.373 -7.648 14.243 1.00 0.00 O ATOM 0 H GLY A 76 -9.282 -4.451 16.102 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.558 -6.897 16.795 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.317 -5.376 16.369 1.00 0.00 H new ATOM 1136 N ALA A 77 -11.982 -6.072 14.073 1.00 0.00 N ATOM 1137 CA ALA A 77 -12.463 -6.515 12.763 1.00 0.00 C ATOM 1138 C ALA A 77 -12.587 -8.035 12.687 1.00 0.00 C ATOM 1139 O ALA A 77 -11.710 -8.711 12.144 1.00 0.00 O ATOM 1140 CB ALA A 77 -11.536 -5.999 11.677 1.00 0.00 C ATOM 0 H ALA A 77 -12.482 -5.267 14.450 1.00 0.00 H new ATOM 0 HA ALA A 77 -13.461 -6.104 12.612 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -11.897 -6.330 10.703 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.514 -4.910 11.704 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.531 -6.386 11.843 1.00 0.00 H new ATOM 1146 N ARG A 78 -13.675 -8.573 13.234 1.00 0.00 N ATOM 1147 CA ARG A 78 -13.896 -10.017 13.226 1.00 0.00 C ATOM 1148 C ARG A 78 -14.368 -10.502 11.856 1.00 0.00 C ATOM 1149 O ARG A 78 -13.569 -11.009 11.066 1.00 0.00 O ATOM 1150 CB ARG A 78 -14.895 -10.415 14.317 1.00 0.00 C ATOM 1151 CG ARG A 78 -14.378 -10.187 15.729 1.00 0.00 C ATOM 1152 CD ARG A 78 -15.407 -9.479 16.596 1.00 0.00 C ATOM 1153 NE ARG A 78 -14.829 -8.351 17.326 1.00 0.00 N ATOM 1154 CZ ARG A 78 -14.131 -8.475 18.458 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -13.891 -9.677 18.979 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -13.663 -7.392 19.068 1.00 0.00 N ATOM 0 H ARG A 78 -14.414 -8.034 13.686 1.00 0.00 H new ATOM 0 HA ARG A 78 -12.942 -10.501 13.437 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -15.815 -9.847 14.180 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -15.150 -11.468 14.198 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.118 -11.144 16.181 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -13.464 -9.594 15.691 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -16.225 -9.124 15.970 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.833 -10.189 17.305 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.967 -7.414 16.948 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.241 -10.514 18.513 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.357 -9.761 19.844 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.837 -6.468 18.672 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.130 -7.484 19.933 1.00 0.00 H new ATOM 1170 N ALA A 79 -15.661 -10.348 11.572 1.00 0.00 N ATOM 1171 CA ALA A 79 -16.211 -10.775 10.286 1.00 0.00 C ATOM 1172 C ALA A 79 -15.666 -9.911 9.150 1.00 0.00 C ATOM 1173 O ALA A 79 -16.046 -8.748 9.005 1.00 0.00 O ATOM 1174 CB ALA A 79 -17.732 -10.728 10.308 1.00 0.00 C ATOM 0 H ALA A 79 -16.342 -9.934 12.209 1.00 0.00 H new ATOM 0 HA ALA A 79 -15.902 -11.806 10.112 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -18.120 -11.050 9.341 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -18.105 -11.392 11.088 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -18.062 -9.709 10.510 1.00 0.00 H new ATOM 1180 N VAL A 80 -14.767 -10.485 8.355 1.00 0.00 N ATOM 1181 CA VAL A 80 -14.158 -9.770 7.237 1.00 0.00 C ATOM 1182 C VAL A 80 -14.354 -10.526 5.929 1.00 0.00 C ATOM 1183 O VAL A 80 -13.835 -11.633 5.757 1.00 0.00 O ATOM 1184 CB VAL A 80 -12.648 -9.542 7.461 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -12.129 -8.445 6.546 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -12.361 -9.207 8.916 1.00 0.00 C ATOM 0 H VAL A 80 -14.443 -11.446 8.465 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.657 -8.803 7.177 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.126 -10.467 7.217 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.063 -8.300 6.720 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.292 -8.731 5.507 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.660 -7.516 6.754 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.291 -9.051 9.049 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.897 -8.299 9.193 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.689 -10.030 9.550 1.00 0.00 H new ATOM 1196 N HIS A 81 -15.102 -9.925 5.011 1.00 0.00 N ATOM 1197 CA HIS A 81 -15.364 -10.540 3.715 1.00 0.00 C ATOM 1198 C HIS A 81 -14.596 -9.835 2.596 1.00 0.00 C ATOM 1199 O HIS A 81 -13.990 -8.781 2.813 1.00 0.00 O ATOM 1200 CB HIS A 81 -16.869 -10.532 3.423 1.00 0.00 C ATOM 1201 CG HIS A 81 -17.393 -9.209 2.947 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -16.724 -8.017 3.129 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -18.525 -8.902 2.280 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.423 -7.037 2.595 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.523 -7.546 2.072 1.00 0.00 N ATOM 0 H HIS A 81 -15.538 -9.012 5.140 1.00 0.00 H new ATOM 0 HA HIS A 81 -15.015 -11.572 3.754 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -17.086 -11.289 2.670 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -17.405 -10.819 4.327 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -15.827 -7.911 3.603 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.291 -9.596 1.967 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -17.144 -5.994 2.586 1.00 0.00 H new ATOM 1214 N VAL A 82 -14.636 -10.414 1.397 1.00 0.00 N ATOM 1215 CA VAL A 82 -13.953 -9.841 0.242 1.00 0.00 C ATOM 1216 C VAL A 82 -14.958 -9.456 -0.838 1.00 0.00 C ATOM 1217 O VAL A 82 -15.590 -10.322 -1.445 1.00 0.00 O ATOM 1218 CB VAL A 82 -12.919 -10.817 -0.356 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -12.104 -10.136 -1.447 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -12.010 -11.366 0.733 1.00 0.00 C ATOM 0 H VAL A 82 -15.136 -11.281 1.202 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.428 -8.952 0.592 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.456 -11.652 -0.806 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.381 -10.842 -1.855 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.770 -9.798 -2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.577 -9.279 -1.027 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.287 -12.053 0.292 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.482 -10.543 1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.609 -11.896 1.474 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.097 -8.154 -1.074 1.00 0.00 N ATOM 1231 CA GLU A 83 -16.023 -7.650 -2.083 1.00 0.00 C ATOM 1232 C GLU A 83 -15.641 -8.153 -3.475 1.00 0.00 C ATOM 1233 O GLU A 83 -16.491 -8.634 -4.224 1.00 0.00 O ATOM 1234 CB GLU A 83 -16.045 -6.121 -2.062 1.00 0.00 C ATOM 1235 CG GLU A 83 -17.294 -5.520 -2.682 1.00 0.00 C ATOM 1236 CD GLU A 83 -17.003 -4.764 -3.964 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -16.543 -3.607 -3.877 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -17.234 -5.330 -5.054 1.00 0.00 O ATOM 0 H GLU A 83 -14.579 -7.428 -0.579 1.00 0.00 H new ATOM 0 HA GLU A 83 -17.020 -8.023 -1.848 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.962 -5.779 -1.030 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.170 -5.747 -2.593 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -18.011 -6.315 -2.888 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -17.762 -4.846 -1.965 1.00 0.00 H new ATOM 1245 N SER A 84 -14.355 -8.044 -3.809 1.00 0.00 N ATOM 1246 CA SER A 84 -13.851 -8.492 -5.108 1.00 0.00 C ATOM 1247 C SER A 84 -12.330 -8.355 -5.180 1.00 0.00 C ATOM 1248 O SER A 84 -11.729 -7.602 -4.412 1.00 0.00 O ATOM 1249 CB SER A 84 -14.499 -7.692 -6.245 1.00 0.00 C ATOM 1250 OG SER A 84 -14.388 -6.297 -6.023 1.00 0.00 O ATOM 0 H SER A 84 -13.642 -7.648 -3.197 1.00 0.00 H new ATOM 0 HA SER A 84 -14.113 -9.544 -5.222 1.00 0.00 H new ATOM 0 HB2 SER A 84 -14.023 -7.951 -7.191 1.00 0.00 H new ATOM 0 HB3 SER A 84 -15.550 -7.966 -6.332 1.00 0.00 H new ATOM 0 HG SER A 84 -15.255 -5.942 -5.735 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.717 -9.084 -6.111 1.00 0.00 N ATOM 1257 CA VAL A 85 -10.267 -9.041 -6.293 1.00 0.00 C ATOM 1258 C VAL A 85 -9.909 -8.848 -7.763 1.00 0.00 C ATOM 1259 O VAL A 85 -10.461 -9.519 -8.637 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.582 -10.322 -5.769 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.722 -10.429 -4.257 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -10.144 -11.561 -6.454 1.00 0.00 C ATOM 0 H VAL A 85 -12.202 -9.712 -6.752 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.904 -8.192 -5.714 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.521 -10.258 -6.009 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -9.232 -11.339 -3.910 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -9.256 -9.563 -3.786 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.778 -10.461 -3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -9.644 -12.449 -6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -11.214 -11.632 -6.257 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -9.976 -11.490 -7.529 1.00 0.00 H new ATOM 1272 N GLN A 86 -8.987 -7.928 -8.031 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.559 -7.648 -9.398 1.00 0.00 C ATOM 1274 C GLN A 86 -7.044 -7.466 -9.476 1.00 0.00 C ATOM 1275 O GLN A 86 -6.444 -6.807 -8.625 1.00 0.00 O ATOM 1276 CB GLN A 86 -9.270 -6.403 -9.938 1.00 0.00 C ATOM 1277 CG GLN A 86 -9.115 -5.171 -9.058 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.746 -3.932 -9.852 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -9.615 -3.192 -10.308 1.00 0.00 O ATOM 1280 NE2 GLN A 86 -7.449 -3.700 -10.023 1.00 0.00 N ATOM 0 H GLN A 86 -8.522 -7.364 -7.320 1.00 0.00 H new ATOM 0 HA GLN A 86 -8.830 -8.505 -10.015 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -8.882 -6.178 -10.932 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -10.331 -6.624 -10.052 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -10.047 -4.991 -8.523 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.348 -5.359 -8.307 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -6.760 -4.340 -9.628 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -7.142 -2.882 -10.550 1.00 0.00 H new ATOM 1289 N PRO A 87 -6.404 -8.055 -10.505 1.00 0.00 N ATOM 1290 CA PRO A 87 -4.953 -7.960 -10.696 1.00 0.00 C ATOM 1291 C PRO A 87 -4.524 -6.598 -11.241 1.00 0.00 C ATOM 1292 O PRO A 87 -5.349 -5.828 -11.737 1.00 0.00 O ATOM 1293 CB PRO A 87 -4.667 -9.062 -11.715 1.00 0.00 C ATOM 1294 CG PRO A 87 -5.921 -9.169 -12.513 1.00 0.00 C ATOM 1295 CD PRO A 87 -7.049 -8.859 -11.563 1.00 0.00 C ATOM 0 HA PRO A 87 -4.406 -8.070 -9.760 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -3.816 -8.807 -12.346 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -4.428 -10.005 -11.223 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.912 -8.469 -13.349 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.030 -10.168 -12.935 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.847 -8.305 -12.057 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -7.494 -9.768 -11.160 1.00 0.00 H new ATOM 1303 N LEU A 88 -3.227 -6.311 -11.143 1.00 0.00 N ATOM 1304 CA LEU A 88 -2.680 -5.048 -11.623 1.00 0.00 C ATOM 1305 C LEU A 88 -1.518 -5.289 -12.588 1.00 0.00 C ATOM 1306 O LEU A 88 -0.466 -5.793 -12.190 1.00 0.00 O ATOM 1307 CB LEU A 88 -2.217 -4.189 -10.442 1.00 0.00 C ATOM 1308 CG LEU A 88 -2.958 -2.860 -10.274 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -4.461 -3.086 -10.217 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -2.477 -2.139 -9.023 1.00 0.00 C ATOM 0 H LEU A 88 -2.536 -6.940 -10.734 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.466 -4.518 -12.160 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.330 -4.768 -9.526 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.153 -3.982 -10.559 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.741 -2.233 -11.139 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.969 -2.129 -10.097 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.793 -3.560 -11.141 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.700 -3.732 -9.372 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.013 -1.196 -8.918 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.664 -2.763 -8.149 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.408 -1.941 -9.105 1.00 0.00 H new ATOM 1322 N SER A 89 -1.719 -4.929 -13.854 1.00 0.00 N ATOM 1323 CA SER A 89 -0.690 -5.108 -14.880 1.00 0.00 C ATOM 1324 C SER A 89 0.448 -4.099 -14.706 1.00 0.00 C ATOM 1325 O SER A 89 0.378 -3.212 -13.854 1.00 0.00 O ATOM 1326 CB SER A 89 -1.304 -4.966 -16.274 1.00 0.00 C ATOM 1327 OG SER A 89 -0.437 -5.485 -17.268 1.00 0.00 O ATOM 0 H SER A 89 -2.585 -4.511 -14.195 1.00 0.00 H new ATOM 0 HA SER A 89 -0.276 -6.110 -14.769 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.259 -5.491 -16.310 1.00 0.00 H new ATOM 0 HB3 SER A 89 -1.510 -3.915 -16.479 1.00 0.00 H new ATOM 0 HG SER A 89 -0.853 -5.384 -18.150 1.00 0.00 H new ATOM 1333 N LEU A 90 1.495 -4.239 -15.521 1.00 0.00 N ATOM 1334 CA LEU A 90 2.646 -3.339 -15.455 1.00 0.00 C ATOM 1335 C LEU A 90 2.277 -1.926 -15.910 1.00 0.00 C ATOM 1336 O LEU A 90 2.878 -0.949 -15.462 1.00 0.00 O ATOM 1337 CB LEU A 90 3.803 -3.877 -16.302 1.00 0.00 C ATOM 1338 CG LEU A 90 5.083 -4.197 -15.520 1.00 0.00 C ATOM 1339 CD1 LEU A 90 6.163 -4.725 -16.454 1.00 0.00 C ATOM 1340 CD2 LEU A 90 5.577 -2.965 -14.772 1.00 0.00 C ATOM 0 H LEU A 90 1.569 -4.966 -16.233 1.00 0.00 H new ATOM 0 HA LEU A 90 2.963 -3.289 -14.413 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.471 -4.781 -16.812 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.040 -3.145 -17.074 1.00 0.00 H new ATOM 0 HG LEU A 90 4.853 -4.972 -14.789 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.063 -4.946 -15.881 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.810 -5.634 -16.941 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.390 -3.973 -17.210 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.486 -3.213 -14.223 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.789 -2.168 -15.484 1.00 0.00 H new ATOM 0 HD23 LEU A 90 4.810 -2.632 -14.072 1.00 0.00 H new ATOM 1352 N GLU A 91 1.284 -1.822 -16.799 1.00 0.00 N ATOM 1353 CA GLU A 91 0.842 -0.521 -17.302 1.00 0.00 C ATOM 1354 C GLU A 91 0.396 0.389 -16.158 1.00 0.00 C ATOM 1355 O GLU A 91 0.502 1.612 -16.254 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.301 -0.693 -18.306 1.00 0.00 C ATOM 1357 CG GLU A 91 -0.335 0.394 -19.372 1.00 0.00 C ATOM 1358 CD GLU A 91 -1.213 0.038 -20.560 1.00 0.00 C ATOM 1359 OE1 GLU A 91 -1.138 -1.115 -21.034 1.00 0.00 O ATOM 1360 OE2 GLU A 91 -1.972 0.918 -21.019 1.00 0.00 O ATOM 0 H GLU A 91 0.775 -2.619 -17.182 1.00 0.00 H new ATOM 0 HA GLU A 91 1.689 -0.054 -17.804 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.206 -1.665 -18.791 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.250 -0.696 -17.769 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.696 1.321 -18.926 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.680 0.583 -19.722 1.00 0.00 H new ATOM 1367 N ASN A 92 -0.100 -0.213 -15.073 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.556 0.549 -13.911 1.00 0.00 C ATOM 1369 C ASN A 92 0.570 1.401 -13.331 1.00 0.00 C ATOM 1370 O ASN A 92 0.311 2.452 -12.744 1.00 0.00 O ATOM 1371 CB ASN A 92 -1.117 -0.387 -12.834 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.634 -0.417 -12.821 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -3.275 0.375 -12.129 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -3.219 -1.334 -13.584 1.00 0.00 N ATOM 0 H ASN A 92 -0.195 -1.224 -14.977 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.351 1.216 -14.246 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.739 -1.395 -13.001 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.755 -0.069 -11.856 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.236 -1.401 -13.612 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.651 -1.971 -14.142 1.00 0.00 H new ATOM 1381 N LEU A 93 1.820 0.964 -13.503 1.00 0.00 N ATOM 1382 CA LEU A 93 2.950 1.718 -12.997 1.00 0.00 C ATOM 1383 C LEU A 93 3.247 2.894 -13.922 1.00 0.00 C ATOM 1384 O LEU A 93 3.786 2.717 -15.015 1.00 0.00 O ATOM 1385 CB LEU A 93 4.179 0.818 -12.855 1.00 0.00 C ATOM 1386 CG LEU A 93 4.139 -0.153 -11.668 1.00 0.00 C ATOM 1387 CD1 LEU A 93 3.437 -1.448 -12.060 1.00 0.00 C ATOM 1388 CD2 LEU A 93 5.547 -0.432 -11.158 1.00 0.00 C ATOM 0 H LEU A 93 2.065 0.099 -13.985 1.00 0.00 H new ATOM 0 HA LEU A 93 2.700 2.104 -12.009 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.296 0.241 -13.773 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.063 1.448 -12.759 1.00 0.00 H new ATOM 0 HG LEU A 93 3.571 0.310 -10.861 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.418 -2.125 -11.206 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.416 -1.228 -12.372 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.974 -1.918 -12.883 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.499 -1.123 -10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.142 -0.875 -11.957 1.00 0.00 H new ATOM 0 HD23 LEU A 93 6.009 0.501 -10.836 1.00 0.00 H new ATOM 1400 N ALA A 94 2.873 4.088 -13.470 1.00 0.00 N ATOM 1401 CA ALA A 94 3.077 5.321 -14.233 1.00 0.00 C ATOM 1402 C ALA A 94 4.466 5.345 -14.860 1.00 0.00 C ATOM 1403 O ALA A 94 4.601 5.287 -16.081 1.00 0.00 O ATOM 1404 CB ALA A 94 2.867 6.538 -13.343 1.00 0.00 C ATOM 0 H ALA A 94 2.421 4.230 -12.567 1.00 0.00 H new ATOM 0 HA ALA A 94 2.342 5.352 -15.038 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.022 7.446 -13.926 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.851 6.529 -12.949 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.577 6.511 -12.517 1.00 0.00 H new ATOM 1410 N LEU A 95 5.498 5.387 -14.016 1.00 0.00 N ATOM 1411 CA LEU A 95 6.874 5.367 -14.504 1.00 0.00 C ATOM 1412 C LEU A 95 7.175 4.003 -15.127 1.00 0.00 C ATOM 1413 O LEU A 95 8.032 3.884 -16.004 1.00 0.00 O ATOM 1414 CB LEU A 95 7.862 5.650 -13.366 1.00 0.00 C ATOM 1415 CG LEU A 95 8.511 7.038 -13.389 1.00 0.00 C ATOM 1416 CD1 LEU A 95 8.772 7.529 -11.972 1.00 0.00 C ATOM 1417 CD2 LEU A 95 9.806 7.016 -14.193 1.00 0.00 C ATOM 0 H LEU A 95 5.407 5.435 -13.001 1.00 0.00 H new ATOM 0 HA LEU A 95 6.988 6.147 -15.257 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.341 5.527 -12.416 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.651 4.898 -13.397 1.00 0.00 H new ATOM 0 HG LEU A 95 7.820 7.729 -13.873 1.00 0.00 H new ATOM 0 HD11 LEU A 95 9.233 8.516 -12.008 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.829 7.589 -11.428 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.441 6.834 -11.464 1.00 0.00 H new ATOM 0 HD21 LEU A 95 10.249 8.012 -14.196 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.503 6.310 -13.741 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.593 6.711 -15.217 1.00 0.00 H new ATOM 1429 N ARG A 96 6.449 2.979 -14.659 1.00 0.00 N ATOM 1430 CA ARG A 96 6.608 1.612 -15.150 1.00 0.00 C ATOM 1431 C ARG A 96 8.063 1.153 -15.005 1.00 0.00 C ATOM 1432 O ARG A 96 8.729 0.836 -15.995 1.00 0.00 O ATOM 1433 CB ARG A 96 6.160 1.518 -16.618 1.00 0.00 C ATOM 1434 CG ARG A 96 6.190 0.103 -17.189 1.00 0.00 C ATOM 1435 CD ARG A 96 4.840 -0.305 -17.769 1.00 0.00 C ATOM 1436 NE ARG A 96 4.739 -0.022 -19.203 1.00 0.00 N ATOM 1437 CZ ARG A 96 3.828 -0.577 -20.015 1.00 0.00 C ATOM 1438 NH1 ARG A 96 2.957 -1.466 -19.545 1.00 0.00 N ATOM 1439 NH2 ARG A 96 3.794 -0.244 -21.300 1.00 0.00 N ATOM 0 H ARG A 96 5.739 3.078 -13.933 1.00 0.00 H new ATOM 0 HA ARG A 96 5.979 0.954 -14.550 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.147 1.911 -16.703 1.00 0.00 H new ATOM 0 HB3 ARG A 96 6.802 2.157 -17.224 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.952 0.041 -17.966 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.475 -0.599 -16.405 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.682 -1.370 -17.600 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.046 0.223 -17.241 1.00 0.00 H new ATOM 0 HE ARG A 96 5.403 0.638 -19.608 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.979 -1.730 -18.560 1.00 0.00 H new ATOM 0 HH12 ARG A 96 2.267 -1.883 -20.170 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.461 0.434 -21.669 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.101 -0.666 -21.918 1.00 0.00 H new ATOM 1453 N GLY A 97 8.550 1.118 -13.765 1.00 0.00 N ATOM 1454 CA GLY A 97 9.916 0.691 -13.518 1.00 0.00 C ATOM 1455 C GLY A 97 10.074 -0.788 -13.780 1.00 0.00 C ATOM 1456 O GLY A 97 10.036 -1.222 -14.933 1.00 0.00 O ATOM 0 H GLY A 97 8.024 1.377 -12.931 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.598 1.252 -14.157 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.190 0.913 -12.487 1.00 0.00 H new ATOM 1460 N ARG A 98 10.210 -1.570 -12.716 1.00 0.00 N ATOM 1461 CA ARG A 98 10.321 -3.010 -12.856 1.00 0.00 C ATOM 1462 C ARG A 98 9.355 -3.691 -11.891 1.00 0.00 C ATOM 1463 O ARG A 98 9.600 -3.748 -10.683 1.00 0.00 O ATOM 1464 CB ARG A 98 11.760 -3.481 -12.583 1.00 0.00 C ATOM 1465 CG ARG A 98 12.833 -2.581 -13.179 1.00 0.00 C ATOM 1466 CD ARG A 98 13.248 -1.488 -12.204 1.00 0.00 C ATOM 1467 NE ARG A 98 14.624 -1.657 -11.738 1.00 0.00 N ATOM 1468 CZ ARG A 98 15.700 -1.280 -12.435 1.00 0.00 C ATOM 1469 NH1 ARG A 98 15.568 -0.734 -13.642 1.00 0.00 N ATOM 1470 NH2 ARG A 98 16.915 -1.454 -11.925 1.00 0.00 N ATOM 0 H ARG A 98 10.246 -1.231 -11.755 1.00 0.00 H new ATOM 0 HA ARG A 98 10.066 -3.281 -13.880 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.912 -3.544 -11.505 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.883 -4.488 -12.982 1.00 0.00 H new ATOM 0 HG2 ARG A 98 13.703 -3.180 -13.448 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.461 -2.128 -14.098 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.146 -0.516 -12.686 1.00 0.00 H new ATOM 0 HD3 ARG A 98 12.573 -1.492 -11.348 1.00 0.00 H new ATOM 0 HE ARG A 98 14.771 -2.089 -10.826 1.00 0.00 H new ATOM 0 HH11 ARG A 98 14.639 -0.600 -14.042 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.395 -0.449 -14.166 1.00 0.00 H new ATOM 0 HH21 ARG A 98 17.025 -1.875 -11.002 1.00 0.00 H new ATOM 0 HH22 ARG A 98 17.737 -1.167 -12.456 1.00 0.00 H new ATOM 1484 N CYS A 99 8.259 -4.207 -12.435 1.00 0.00 N ATOM 1485 CA CYS A 99 7.251 -4.890 -11.632 1.00 0.00 C ATOM 1486 C CYS A 99 6.924 -6.254 -12.232 1.00 0.00 C ATOM 1487 O CYS A 99 6.566 -6.354 -13.407 1.00 0.00 O ATOM 1488 CB CYS A 99 5.982 -4.041 -11.526 1.00 0.00 C ATOM 1489 SG CYS A 99 5.223 -4.056 -9.886 1.00 0.00 S ATOM 0 H CYS A 99 8.045 -4.165 -13.431 1.00 0.00 H new ATOM 0 HA CYS A 99 7.655 -5.038 -10.630 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.222 -3.012 -11.795 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.255 -4.400 -12.255 1.00 0.00 H new ATOM 0 HG CYS A 99 3.938 -3.894 -10.001 1.00 0.00 H new ATOM 1495 N GLN A 100 7.054 -7.302 -11.422 1.00 0.00 N ATOM 1496 CA GLN A 100 6.773 -8.660 -11.880 1.00 0.00 C ATOM 1497 C GLN A 100 5.280 -8.976 -11.809 1.00 0.00 C ATOM 1498 O GLN A 100 4.755 -9.689 -12.665 1.00 0.00 O ATOM 1499 CB GLN A 100 7.566 -9.681 -11.056 1.00 0.00 C ATOM 1500 CG GLN A 100 8.431 -10.612 -11.895 1.00 0.00 C ATOM 1501 CD GLN A 100 9.359 -9.864 -12.837 1.00 0.00 C ATOM 1502 OE1 GLN A 100 10.232 -9.114 -12.401 1.00 0.00 O ATOM 1503 NE2 GLN A 100 9.175 -10.066 -14.138 1.00 0.00 N ATOM 0 H GLN A 100 7.351 -7.237 -10.448 1.00 0.00 H new ATOM 0 HA GLN A 100 7.084 -8.726 -12.923 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.202 -9.148 -10.350 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.869 -10.279 -10.469 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.024 -11.244 -11.234 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.788 -11.273 -12.475 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.439 -10.696 -14.457 1.00 0.00 H new ATOM 0 HE22 GLN A 100 9.770 -9.591 -14.817 1.00 0.00 H new ATOM 1512 N GLU A 101 4.600 -8.451 -10.785 1.00 0.00 N ATOM 1513 CA GLU A 101 3.167 -8.697 -10.617 1.00 0.00 C ATOM 1514 C GLU A 101 2.547 -7.740 -9.595 1.00 0.00 C ATOM 1515 O GLU A 101 3.257 -7.063 -8.850 1.00 0.00 O ATOM 1516 CB GLU A 101 2.935 -10.146 -10.179 1.00 0.00 C ATOM 1517 CG GLU A 101 1.592 -10.713 -10.614 1.00 0.00 C ATOM 1518 CD GLU A 101 1.713 -12.096 -11.229 1.00 0.00 C ATOM 1519 OE1 GLU A 101 2.392 -12.958 -10.629 1.00 0.00 O ATOM 1520 OE2 GLU A 101 1.127 -12.318 -12.310 1.00 0.00 O ATOM 0 H GLU A 101 5.015 -7.858 -10.066 1.00 0.00 H new ATOM 0 HA GLU A 101 2.683 -8.522 -11.578 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.731 -10.770 -10.585 1.00 0.00 H new ATOM 0 HB3 GLU A 101 3.008 -10.203 -9.093 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.925 -10.760 -9.753 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.133 -10.037 -11.336 1.00 0.00 H new ATOM 1527 N ALA A 102 1.212 -7.697 -9.569 1.00 0.00 N ATOM 1528 CA ALA A 102 0.482 -6.831 -8.644 1.00 0.00 C ATOM 1529 C ALA A 102 -0.984 -7.257 -8.533 1.00 0.00 C ATOM 1530 O ALA A 102 -1.590 -7.676 -9.518 1.00 0.00 O ATOM 1531 CB ALA A 102 0.583 -5.382 -9.094 1.00 0.00 C ATOM 0 H ALA A 102 0.615 -8.254 -10.180 1.00 0.00 H new ATOM 0 HA ALA A 102 0.934 -6.926 -7.657 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.036 -4.746 -8.398 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.630 -5.080 -9.115 1.00 0.00 H new ATOM 0 HB3 ALA A 102 0.156 -5.280 -10.091 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.547 -7.148 -7.326 1.00 0.00 N ATOM 1538 CA TRP A 103 -2.942 -7.528 -7.092 1.00 0.00 C ATOM 1539 C TRP A 103 -3.631 -6.546 -6.141 1.00 0.00 C ATOM 1540 O TRP A 103 -2.968 -5.798 -5.422 1.00 0.00 O ATOM 1541 CB TRP A 103 -3.022 -8.946 -6.517 1.00 0.00 C ATOM 1542 CG TRP A 103 -2.683 -10.017 -7.510 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -1.436 -10.377 -7.935 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -3.604 -10.871 -8.202 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -1.524 -11.400 -8.847 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -2.844 -11.723 -9.027 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.995 -11.000 -8.204 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -3.429 -12.686 -9.844 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.576 -11.958 -9.014 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -4.793 -12.790 -9.825 1.00 0.00 C ATOM 0 H TRP A 103 -1.060 -6.801 -6.499 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.458 -7.500 -8.052 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -2.344 -9.023 -5.667 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -4.029 -9.119 -6.138 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.514 -9.923 -7.602 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -0.735 -11.847 -9.315 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -5.606 -10.362 -7.583 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -2.828 -13.328 -10.471 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -6.650 -12.067 -9.022 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -5.276 -13.528 -10.448 1.00 0.00 H new ATOM 1561 N VAL A 104 -4.966 -6.558 -6.144 1.00 0.00 N ATOM 1562 CA VAL A 104 -5.750 -5.671 -5.284 1.00 0.00 C ATOM 1563 C VAL A 104 -6.891 -6.427 -4.602 1.00 0.00 C ATOM 1564 O VAL A 104 -7.598 -7.210 -5.240 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.338 -4.485 -6.081 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -7.026 -3.493 -5.151 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -5.257 -3.794 -6.900 1.00 0.00 C ATOM 0 H VAL A 104 -5.526 -7.173 -6.734 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.068 -5.287 -4.525 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.086 -4.880 -6.769 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.432 -2.667 -5.736 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.835 -3.994 -4.620 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.304 -3.108 -4.432 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.695 -2.963 -7.452 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.480 -3.418 -6.234 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.821 -4.506 -7.601 1.00 0.00 H new ATOM 1577 N LEU A 105 -7.064 -6.180 -3.302 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.118 -6.826 -2.521 1.00 0.00 C ATOM 1579 C LEU A 105 -8.985 -5.786 -1.811 1.00 0.00 C ATOM 1580 O LEU A 105 -8.484 -4.981 -1.022 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.505 -7.785 -1.493 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.248 -9.113 -1.319 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -7.280 -10.283 -1.413 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -8.992 -9.140 0.008 1.00 0.00 C ATOM 0 H LEU A 105 -6.484 -5.534 -2.767 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.749 -7.392 -3.206 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.477 -7.998 -1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.464 -7.280 -0.528 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.978 -9.206 -2.123 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -7.826 -11.218 -1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -6.794 -10.275 -2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.526 -10.195 -0.631 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -9.514 -10.091 0.113 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.281 -9.023 0.826 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -9.715 -8.325 0.036 1.00 0.00 H new ATOM 1596 N SER A 106 -10.288 -5.808 -2.097 1.00 0.00 N ATOM 1597 CA SER A 106 -11.228 -4.867 -1.487 1.00 0.00 C ATOM 1598 C SER A 106 -12.259 -5.598 -0.627 1.00 0.00 C ATOM 1599 O SER A 106 -12.610 -6.746 -0.904 1.00 0.00 O ATOM 1600 CB SER A 106 -11.939 -4.051 -2.569 1.00 0.00 C ATOM 1601 OG SER A 106 -12.772 -3.057 -1.996 1.00 0.00 O ATOM 0 H SER A 106 -10.716 -6.467 -2.747 1.00 0.00 H new ATOM 0 HA SER A 106 -10.660 -4.194 -0.845 1.00 0.00 H new ATOM 0 HB2 SER A 106 -11.200 -3.581 -3.218 1.00 0.00 H new ATOM 0 HB3 SER A 106 -12.537 -4.714 -3.195 1.00 0.00 H new ATOM 0 HG SER A 106 -12.304 -2.196 -2.001 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.741 -4.922 0.416 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.727 -5.519 1.302 1.00 0.00 C ATOM 1609 C GLY A 107 -14.042 -4.647 2.505 1.00 0.00 C ATOM 1610 O GLY A 107 -13.837 -3.432 2.471 1.00 0.00 O ATOM 0 H GLY A 107 -12.465 -3.971 0.662 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.645 -5.705 0.744 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.361 -6.486 1.646 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.542 -5.274 3.570 1.00 0.00 N ATOM 1615 CA LYS A 108 -14.892 -4.560 4.798 1.00 0.00 C ATOM 1616 C LYS A 108 -14.508 -5.380 6.030 1.00 0.00 C ATOM 1617 O LYS A 108 -14.371 -6.602 5.954 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.392 -4.249 4.826 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.752 -2.907 4.207 1.00 0.00 C ATOM 1620 CD LYS A 108 -17.062 -3.034 2.723 1.00 0.00 C ATOM 1621 CE LYS A 108 -18.444 -3.624 2.484 1.00 0.00 C ATOM 1622 NZ LYS A 108 -19.509 -2.583 2.518 1.00 0.00 N ATOM 0 H LYS A 108 -14.714 -6.279 3.607 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.335 -3.623 4.815 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -16.927 -5.038 4.297 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.738 -4.267 5.859 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -17.615 -2.488 4.724 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.927 -2.209 4.347 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.999 -2.052 2.253 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.310 -3.664 2.247 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -18.461 -4.128 1.518 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.651 -4.380 3.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -20.434 -3.027 2.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -19.511 -2.119 3.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -19.326 -1.875 1.778 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.348 -4.699 7.166 1.00 0.00 N ATOM 1637 CA GLN A 109 -13.988 -5.354 8.419 1.00 0.00 C ATOM 1638 C GLN A 109 -15.115 -5.192 9.429 1.00 0.00 C ATOM 1639 O GLN A 109 -15.775 -4.157 9.452 1.00 0.00 O ATOM 1640 CB GLN A 109 -12.705 -4.740 8.984 1.00 0.00 C ATOM 1641 CG GLN A 109 -11.438 -5.489 8.604 1.00 0.00 C ATOM 1642 CD GLN A 109 -10.762 -4.909 7.376 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -10.985 -5.369 6.256 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -9.930 -3.893 7.581 1.00 0.00 N ATOM 0 H GLN A 109 -14.463 -3.688 7.241 1.00 0.00 H new ATOM 0 HA GLN A 109 -13.823 -6.414 8.226 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -12.624 -3.710 8.635 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.780 -4.704 10.071 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -10.742 -5.466 9.442 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -11.681 -6.536 8.420 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -9.775 -3.544 8.527 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -9.447 -3.463 6.793 1.00 0.00 H new ATOM 1653 N GLN A 110 -15.330 -6.202 10.271 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.383 -6.116 11.275 1.00 0.00 C ATOM 1655 C GLN A 110 -15.812 -5.619 12.593 1.00 0.00 C ATOM 1656 O GLN A 110 -15.446 -6.409 13.467 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.066 -7.471 11.471 1.00 0.00 C ATOM 1658 CG GLN A 110 -18.025 -7.512 12.652 1.00 0.00 C ATOM 1659 CD GLN A 110 -18.598 -8.895 12.895 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -17.922 -9.775 13.426 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -19.851 -9.094 12.502 1.00 0.00 N ATOM 0 H GLN A 110 -14.799 -7.073 10.278 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.132 -5.406 10.923 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -17.612 -7.727 10.563 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -16.302 -8.236 11.609 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -17.504 -7.177 13.549 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -18.841 -6.811 12.476 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -20.375 -8.336 12.066 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -20.289 -10.005 12.637 1.00 0.00 H new ATOM 1670 N ILE A 111 -15.739 -4.303 12.731 1.00 0.00 N ATOM 1671 CA ILE A 111 -15.216 -3.705 13.947 1.00 0.00 C ATOM 1672 C ILE A 111 -16.296 -3.644 15.021 1.00 0.00 C ATOM 1673 O ILE A 111 -16.984 -2.635 15.177 1.00 0.00 O ATOM 1674 CB ILE A 111 -14.670 -2.292 13.695 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -13.653 -2.303 12.551 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -14.047 -1.727 14.965 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -13.666 -1.041 11.719 1.00 0.00 C ATOM 0 H ILE A 111 -16.034 -3.634 12.020 1.00 0.00 H new ATOM 0 HA ILE A 111 -14.396 -4.336 14.288 1.00 0.00 H new ATOM 0 HB ILE A 111 -15.500 -1.648 13.405 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -12.655 -2.445 12.965 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -13.855 -3.157 11.904 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -13.665 -0.725 14.768 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.801 -1.680 15.751 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -13.228 -2.371 15.286 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -12.921 -1.119 10.928 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -14.653 -0.907 11.276 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -13.434 -0.185 12.353 1.00 0.00 H new ATOM 1689 N ALA A 112 -16.434 -4.741 15.755 1.00 0.00 N ATOM 1690 CA ALA A 112 -17.424 -4.838 16.825 1.00 0.00 C ATOM 1691 C ALA A 112 -16.959 -4.095 18.081 1.00 0.00 C ATOM 1692 O ALA A 112 -15.787 -3.731 18.198 1.00 0.00 O ATOM 1693 CB ALA A 112 -17.711 -6.297 17.147 1.00 0.00 C ATOM 0 H ALA A 112 -15.870 -5.582 15.629 1.00 0.00 H new ATOM 0 HA ALA A 112 -18.343 -4.366 16.478 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -18.450 -6.355 17.946 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -18.097 -6.797 16.259 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -16.791 -6.787 17.468 1.00 0.00 H new ATOM 1800 N ALA A 119 -21.169 -2.786 14.809 1.00 0.00 N ATOM 1801 CA ALA A 119 -19.952 -3.213 14.126 1.00 0.00 C ATOM 1802 C ALA A 119 -19.711 -2.385 12.863 1.00 0.00 C ATOM 1803 O ALA A 119 -20.440 -2.516 11.878 1.00 0.00 O ATOM 1804 CB ALA A 119 -20.029 -4.694 13.783 1.00 0.00 C ATOM 0 HA ALA A 119 -19.111 -3.052 14.801 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -19.114 -4.998 13.274 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.144 -5.274 14.699 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -20.884 -4.872 13.130 1.00 0.00 H new ATOM 1810 N LYS A 120 -18.682 -1.534 12.899 1.00 0.00 N ATOM 1811 CA LYS A 120 -18.345 -0.686 11.754 1.00 0.00 C ATOM 1812 C LYS A 120 -17.927 -1.531 10.556 1.00 0.00 C ATOM 1813 O LYS A 120 -17.253 -2.548 10.715 1.00 0.00 O ATOM 1814 CB LYS A 120 -17.214 0.282 12.113 1.00 0.00 C ATOM 1815 CG LYS A 120 -17.658 1.470 12.951 1.00 0.00 C ATOM 1816 CD LYS A 120 -16.925 1.513 14.281 1.00 0.00 C ATOM 1817 CE LYS A 120 -16.465 2.921 14.618 1.00 0.00 C ATOM 1818 NZ LYS A 120 -15.841 2.995 15.969 1.00 0.00 N ATOM 0 H LYS A 120 -18.070 -1.415 13.706 1.00 0.00 H new ATOM 0 HA LYS A 120 -19.236 -0.115 11.492 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -16.442 -0.263 12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.759 0.649 11.193 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.474 2.394 12.402 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -18.732 1.412 13.127 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -17.580 1.144 15.071 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -16.063 0.847 14.244 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -15.749 3.258 13.869 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.316 3.601 14.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -15.541 3.972 16.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -16.532 2.698 16.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -15.014 2.366 16.004 1.00 0.00 H new ATOM 1832 N ASP A 121 -18.324 -1.099 9.361 1.00 0.00 N ATOM 1833 CA ASP A 121 -17.986 -1.812 8.131 1.00 0.00 C ATOM 1834 C ASP A 121 -17.064 -0.963 7.253 1.00 0.00 C ATOM 1835 O ASP A 121 -17.409 -0.628 6.118 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.257 -2.180 7.360 1.00 0.00 C ATOM 1837 CG ASP A 121 -20.185 -3.086 8.148 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -19.689 -4.031 8.798 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -21.411 -2.853 8.112 1.00 0.00 O ATOM 0 H ASP A 121 -18.881 -0.257 9.218 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.462 -2.729 8.400 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -19.790 -1.268 7.092 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -18.981 -2.674 6.428 1.00 0.00 H new ATOM 1844 N VAL A 122 -15.895 -0.614 7.790 1.00 0.00 N ATOM 1845 CA VAL A 122 -14.928 0.201 7.053 1.00 0.00 C ATOM 1846 C VAL A 122 -14.460 -0.507 5.784 1.00 0.00 C ATOM 1847 O VAL A 122 -14.053 -1.670 5.826 1.00 0.00 O ATOM 1848 CB VAL A 122 -13.693 0.555 7.916 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -14.070 1.526 9.026 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -13.054 -0.703 8.489 1.00 0.00 C ATOM 0 H VAL A 122 -15.595 -0.881 8.728 1.00 0.00 H new ATOM 0 HA VAL A 122 -15.445 1.123 6.785 1.00 0.00 H new ATOM 0 HB VAL A 122 -12.960 1.043 7.274 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -13.187 1.761 9.620 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -14.467 2.442 8.589 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -14.827 1.072 9.666 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -12.188 -0.429 9.092 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -13.778 -1.228 9.112 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -12.737 -1.354 7.674 1.00 0.00 H new ATOM 1860 N THR A 123 -14.521 0.199 4.657 1.00 0.00 N ATOM 1861 CA THR A 123 -14.100 -0.362 3.375 1.00 0.00 C ATOM 1862 C THR A 123 -12.581 -0.324 3.246 1.00 0.00 C ATOM 1863 O THR A 123 -11.982 0.749 3.170 1.00 0.00 O ATOM 1864 CB THR A 123 -14.744 0.403 2.218 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.037 0.863 2.573 1.00 0.00 O ATOM 1866 CG2 THR A 123 -14.879 -0.423 0.958 1.00 0.00 C ATOM 0 H THR A 123 -14.858 1.160 4.605 1.00 0.00 H new ATOM 0 HA THR A 123 -14.428 -1.401 3.334 1.00 0.00 H new ATOM 0 HB THR A 123 -14.073 1.238 2.017 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.429 1.351 1.819 1.00 0.00 H new ATOM 0 HG21 THR A 123 -15.343 0.179 0.176 1.00 0.00 H new ATOM 0 HG22 THR A 123 -13.892 -0.748 0.628 1.00 0.00 H new ATOM 0 HG23 THR A 123 -15.499 -1.296 1.160 1.00 0.00 H new ATOM 1874 N LEU A 124 -11.962 -1.503 3.227 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.511 -1.600 3.118 1.00 0.00 C ATOM 1876 C LEU A 124 -10.076 -1.989 1.706 1.00 0.00 C ATOM 1877 O LEU A 124 -10.484 -3.026 1.181 1.00 0.00 O ATOM 1878 CB LEU A 124 -9.967 -2.617 4.123 1.00 0.00 C ATOM 1879 CG LEU A 124 -8.477 -2.482 4.438 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -8.255 -1.480 5.561 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -7.884 -3.839 4.798 1.00 0.00 C ATOM 0 H LEU A 124 -12.442 -2.401 3.286 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.101 -0.615 3.340 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.529 -2.523 5.052 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.152 -3.620 3.738 1.00 0.00 H new ATOM 0 HG LEU A 124 -7.968 -2.111 3.548 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.188 -1.398 5.770 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.642 -0.506 5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.776 -1.817 6.457 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -6.823 -3.725 5.019 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.396 -4.239 5.673 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.008 -4.524 3.960 1.00 0.00 H new ATOM 1893 N HIS A 125 -9.227 -1.153 1.110 1.00 0.00 N ATOM 1894 CA HIS A 125 -8.705 -1.399 -0.231 1.00 0.00 C ATOM 1895 C HIS A 125 -7.191 -1.579 -0.166 1.00 0.00 C ATOM 1896 O HIS A 125 -6.447 -0.602 -0.059 1.00 0.00 O ATOM 1897 CB HIS A 125 -9.062 -0.240 -1.166 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.630 -0.678 -2.481 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -10.981 -0.681 -2.755 1.00 0.00 N ATOM 1900 CD2 HIS A 125 -9.019 -1.126 -3.605 1.00 0.00 C ATOM 1901 CE1 HIS A 125 -11.177 -1.108 -3.990 1.00 0.00 C ATOM 1902 NE2 HIS A 125 -10.003 -1.383 -4.526 1.00 0.00 N ATOM 0 H HIS A 125 -8.885 -0.294 1.540 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.157 -2.309 -0.626 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -9.782 0.408 -0.667 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -8.168 0.357 -1.347 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -7.957 -1.256 -3.749 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -12.135 -1.214 -4.478 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -9.851 -1.731 -5.473 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.740 -2.830 -0.204 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.314 -3.127 -0.124 1.00 0.00 C ATOM 1913 C GLN A 126 -4.744 -3.564 -1.469 1.00 0.00 C ATOM 1914 O GLN A 126 -5.397 -4.274 -2.235 1.00 0.00 O ATOM 1915 CB GLN A 126 -5.058 -4.212 0.924 1.00 0.00 C ATOM 1916 CG GLN A 126 -4.258 -3.725 2.123 1.00 0.00 C ATOM 1917 CD GLN A 126 -4.452 -4.598 3.348 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -4.273 -5.815 3.292 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -4.820 -3.980 4.467 1.00 0.00 N ATOM 0 H GLN A 126 -7.339 -3.651 -0.289 1.00 0.00 H new ATOM 0 HA GLN A 126 -4.807 -2.207 0.169 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -6.014 -4.603 1.271 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -4.526 -5.040 0.455 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -3.200 -3.700 1.863 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -4.552 -2.702 2.360 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -4.958 -2.969 4.470 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -4.965 -4.517 5.322 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.510 -3.141 -1.738 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.822 -3.488 -2.976 1.00 0.00 C ATOM 1930 C ALA A 127 -1.517 -4.218 -2.674 1.00 0.00 C ATOM 1931 O ALA A 127 -0.659 -3.701 -1.956 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.555 -2.242 -3.807 1.00 0.00 C ATOM 0 H ALA A 127 -2.964 -2.553 -1.108 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.465 -4.153 -3.552 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.041 -2.521 -4.727 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.501 -1.759 -4.052 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.932 -1.552 -3.238 1.00 0.00 H new ATOM 1938 N LEU A 128 -1.373 -5.423 -3.224 1.00 0.00 N ATOM 1939 CA LEU A 128 -0.175 -6.225 -3.010 1.00 0.00 C ATOM 1940 C LEU A 128 0.823 -6.034 -4.151 1.00 0.00 C ATOM 1941 O LEU A 128 0.538 -6.376 -5.301 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.542 -7.707 -2.864 1.00 0.00 C ATOM 1943 CG LEU A 128 -0.089 -8.367 -1.558 1.00 0.00 C ATOM 1944 CD1 LEU A 128 1.427 -8.332 -1.435 1.00 0.00 C ATOM 1945 CD2 LEU A 128 -0.740 -7.684 -0.363 1.00 0.00 C ATOM 0 H LEU A 128 -2.073 -5.863 -3.821 1.00 0.00 H new ATOM 0 HA LEU A 128 0.297 -5.889 -2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.624 -7.806 -2.946 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.108 -8.256 -3.699 1.00 0.00 H new ATOM 0 HG LEU A 128 -0.405 -9.410 -1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 128 1.727 -8.806 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.873 -8.868 -2.273 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.769 -7.297 -1.443 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -0.407 -8.165 0.557 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -0.455 -6.632 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -1.824 -7.765 -0.444 1.00 0.00 H new ATOM 1957 N LEU A 129 1.994 -5.489 -3.821 1.00 0.00 N ATOM 1958 CA LEU A 129 3.048 -5.250 -4.807 1.00 0.00 C ATOM 1959 C LEU A 129 4.344 -5.940 -4.383 1.00 0.00 C ATOM 1960 O LEU A 129 4.951 -5.563 -3.382 1.00 0.00 O ATOM 1961 CB LEU A 129 3.303 -3.743 -4.965 1.00 0.00 C ATOM 1962 CG LEU A 129 2.109 -2.903 -5.435 1.00 0.00 C ATOM 1963 CD1 LEU A 129 1.470 -3.512 -6.673 1.00 0.00 C ATOM 1964 CD2 LEU A 129 1.085 -2.754 -4.317 1.00 0.00 C ATOM 0 H LEU A 129 2.237 -5.203 -2.873 1.00 0.00 H new ATOM 0 HA LEU A 129 2.718 -5.661 -5.761 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.643 -3.350 -4.007 1.00 0.00 H new ATOM 0 HB3 LEU A 129 4.120 -3.606 -5.674 1.00 0.00 H new ATOM 0 HG LEU A 129 2.475 -1.911 -5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.626 -2.898 -6.986 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.205 -3.557 -7.477 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.121 -4.519 -6.444 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.246 -2.155 -4.670 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.727 -3.739 -4.018 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.548 -2.261 -3.462 1.00 0.00 H new ATOM 1976 N ARG A 130 4.766 -6.950 -5.142 1.00 0.00 N ATOM 1977 CA ARG A 130 5.997 -7.678 -4.824 1.00 0.00 C ATOM 1978 C ARG A 130 7.008 -7.576 -5.965 1.00 0.00 C ATOM 1979 O ARG A 130 6.663 -7.758 -7.133 1.00 0.00 O ATOM 1980 CB ARG A 130 5.695 -9.149 -4.527 1.00 0.00 C ATOM 1981 CG ARG A 130 4.707 -9.353 -3.387 1.00 0.00 C ATOM 1982 CD ARG A 130 3.799 -10.551 -3.631 1.00 0.00 C ATOM 1983 NE ARG A 130 3.366 -10.653 -5.027 1.00 0.00 N ATOM 1984 CZ ARG A 130 2.467 -9.847 -5.594 1.00 0.00 C ATOM 1985 NH1 ARG A 130 1.922 -8.853 -4.902 1.00 0.00 N ATOM 1986 NH2 ARG A 130 2.109 -10.037 -6.859 1.00 0.00 N ATOM 0 H ARG A 130 4.280 -7.282 -5.975 1.00 0.00 H new ATOM 0 HA ARG A 130 6.431 -7.219 -3.935 1.00 0.00 H new ATOM 0 HB2 ARG A 130 5.299 -9.618 -5.428 1.00 0.00 H new ATOM 0 HB3 ARG A 130 6.627 -9.660 -4.284 1.00 0.00 H new ATOM 0 HG2 ARG A 130 5.253 -9.495 -2.454 1.00 0.00 H new ATOM 0 HG3 ARG A 130 4.100 -8.456 -3.268 1.00 0.00 H new ATOM 0 HD2 ARG A 130 4.324 -11.464 -3.349 1.00 0.00 H new ATOM 0 HD3 ARG A 130 2.923 -10.476 -2.987 1.00 0.00 H new ATOM 0 HE ARG A 130 3.778 -11.387 -5.602 1.00 0.00 H new ATOM 0 HH11 ARG A 130 2.190 -8.701 -3.930 1.00 0.00 H new ATOM 0 HH12 ARG A 130 1.235 -8.241 -5.343 1.00 0.00 H new ATOM 0 HH21 ARG A 130 2.522 -10.799 -7.397 1.00 0.00 H new ATOM 0 HH22 ARG A 130 1.422 -9.421 -7.293 1.00 0.00 H new ATOM 2000 N LEU A 131 8.257 -7.286 -5.607 1.00 0.00 N ATOM 2001 CA LEU A 131 9.335 -7.162 -6.585 1.00 0.00 C ATOM 2002 C LEU A 131 10.379 -8.256 -6.368 1.00 0.00 C ATOM 2003 O LEU A 131 10.814 -8.486 -5.238 1.00 0.00 O ATOM 2004 CB LEU A 131 9.996 -5.781 -6.480 1.00 0.00 C ATOM 2005 CG LEU A 131 9.036 -4.589 -6.538 1.00 0.00 C ATOM 2006 CD1 LEU A 131 8.527 -4.237 -5.147 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.719 -3.385 -7.173 1.00 0.00 C ATOM 0 H LEU A 131 8.548 -7.132 -4.642 1.00 0.00 H new ATOM 0 HA LEU A 131 8.909 -7.274 -7.582 1.00 0.00 H new ATOM 0 HB2 LEU A 131 10.552 -5.733 -5.544 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.722 -5.682 -7.287 1.00 0.00 H new ATOM 0 HG LEU A 131 8.182 -4.870 -7.154 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.847 -3.388 -5.213 1.00 0.00 H new ATOM 0 HD12 LEU A 131 8.000 -5.093 -4.725 1.00 0.00 H new ATOM 0 HD13 LEU A 131 9.370 -3.978 -4.506 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.023 -2.547 -7.206 1.00 0.00 H new ATOM 0 HD22 LEU A 131 10.592 -3.108 -6.582 1.00 0.00 H new ATOM 0 HD23 LEU A 131 10.032 -3.637 -8.186 1.00 0.00 H new ATOM 2019 N PRO A 132 10.793 -8.956 -7.443 1.00 0.00 N ATOM 2020 CA PRO A 132 11.781 -10.033 -7.352 1.00 0.00 C ATOM 2021 C PRO A 132 13.221 -9.526 -7.207 1.00 0.00 C ATOM 2022 O PRO A 132 14.162 -10.320 -7.248 1.00 0.00 O ATOM 2023 CB PRO A 132 11.621 -10.796 -8.677 1.00 0.00 C ATOM 2024 CG PRO A 132 10.480 -10.151 -9.399 1.00 0.00 C ATOM 2025 CD PRO A 132 10.329 -8.773 -8.821 1.00 0.00 C ATOM 0 HA PRO A 132 11.610 -10.642 -6.465 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.535 -10.743 -9.269 1.00 0.00 H new ATOM 0 HB3 PRO A 132 11.419 -11.852 -8.496 1.00 0.00 H new ATOM 0 HG2 PRO A 132 10.677 -10.102 -10.470 1.00 0.00 H new ATOM 0 HG3 PRO A 132 9.564 -10.728 -9.270 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.930 -8.039 -9.358 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.296 -8.428 -8.859 1.00 0.00 H new ATOM 2033 N GLN A 133 13.397 -8.210 -7.029 1.00 0.00 N ATOM 2034 CA GLN A 133 14.730 -7.632 -6.871 1.00 0.00 C ATOM 2035 C GLN A 133 15.461 -8.280 -5.698 1.00 0.00 C ATOM 2036 O GLN A 133 16.668 -8.520 -5.759 1.00 0.00 O ATOM 2037 CB GLN A 133 14.641 -6.115 -6.670 1.00 0.00 C ATOM 2038 CG GLN A 133 14.966 -5.319 -7.922 1.00 0.00 C ATOM 2039 CD GLN A 133 16.457 -5.269 -8.217 1.00 0.00 C ATOM 2040 OE1 GLN A 133 17.259 -5.917 -7.547 1.00 0.00 O ATOM 2041 NE2 GLN A 133 16.834 -4.494 -9.228 1.00 0.00 N ATOM 0 H GLN A 133 12.636 -7.532 -6.992 1.00 0.00 H new ATOM 0 HA GLN A 133 15.296 -7.827 -7.782 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.635 -5.859 -6.337 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.325 -5.821 -5.874 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.446 -5.760 -8.773 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.588 -4.303 -7.809 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.136 -3.973 -9.759 1.00 0.00 H new ATOM 0 HE22 GLN A 133 17.821 -4.420 -9.473 1.00 0.00 H new ATOM 2050 N TYR A 134 14.713 -8.567 -4.635 1.00 0.00 N ATOM 2051 CA TYR A 134 15.266 -9.200 -3.441 1.00 0.00 C ATOM 2052 C TYR A 134 14.151 -9.795 -2.576 1.00 0.00 C ATOM 2053 O TYR A 134 14.254 -9.822 -1.349 1.00 0.00 O ATOM 2054 CB TYR A 134 16.083 -8.194 -2.624 1.00 0.00 C ATOM 2055 CG TYR A 134 15.444 -6.829 -2.538 1.00 0.00 C ATOM 2056 CD1 TYR A 134 14.493 -6.542 -1.568 1.00 0.00 C ATOM 2057 CD2 TYR A 134 15.786 -5.830 -3.436 1.00 0.00 C ATOM 2058 CE1 TYR A 134 13.907 -5.297 -1.494 1.00 0.00 C ATOM 2059 CE2 TYR A 134 15.205 -4.582 -3.370 1.00 0.00 C ATOM 2060 CZ TYR A 134 14.265 -4.318 -2.396 1.00 0.00 C ATOM 2061 OH TYR A 134 13.680 -3.074 -2.327 1.00 0.00 O ATOM 0 H TYR A 134 13.714 -8.369 -4.577 1.00 0.00 H new ATOM 0 HA TYR A 134 15.925 -10.006 -3.763 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.223 -8.585 -1.616 1.00 0.00 H new ATOM 0 HB3 TYR A 134 17.073 -8.096 -3.069 1.00 0.00 H new ATOM 0 HD1 TYR A 134 14.208 -7.306 -0.860 1.00 0.00 H new ATOM 0 HD2 TYR A 134 16.521 -6.033 -4.201 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.170 -5.089 -0.732 1.00 0.00 H new ATOM 0 HE2 TYR A 134 15.484 -3.815 -4.077 1.00 0.00 H new ATOM 0 HH TYR A 134 14.044 -2.501 -3.034 1.00 0.00 H new ATOM 2071 N GLN A 135 13.075 -10.263 -3.224 1.00 0.00 N ATOM 2072 CA GLN A 135 11.938 -10.842 -2.512 1.00 0.00 C ATOM 2073 C GLN A 135 11.345 -9.812 -1.552 1.00 0.00 C ATOM 2074 O GLN A 135 11.527 -9.905 -0.336 1.00 0.00 O ATOM 2075 CB GLN A 135 12.353 -12.102 -1.738 1.00 0.00 C ATOM 2076 CG GLN A 135 13.302 -13.023 -2.494 1.00 0.00 C ATOM 2077 CD GLN A 135 12.794 -13.393 -3.876 1.00 0.00 C ATOM 2078 OE1 GLN A 135 13.460 -13.139 -4.880 1.00 0.00 O ATOM 2079 NE2 GLN A 135 11.612 -14.000 -3.940 1.00 0.00 N ATOM 0 H GLN A 135 12.973 -10.250 -4.239 1.00 0.00 H new ATOM 0 HA GLN A 135 11.185 -11.127 -3.247 1.00 0.00 H new ATOM 0 HB2 GLN A 135 12.827 -11.800 -0.804 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.456 -12.663 -1.474 1.00 0.00 H new ATOM 0 HG2 GLN A 135 14.273 -12.537 -2.588 1.00 0.00 H new ATOM 0 HG3 GLN A 135 13.456 -13.933 -1.914 1.00 0.00 H new ATOM 0 HE21 GLN A 135 11.091 -14.193 -3.085 1.00 0.00 H new ATOM 0 HE22 GLN A 135 11.227 -14.273 -4.844 1.00 0.00 H new ATOM 2088 N THR A 136 10.649 -8.820 -2.103 1.00 0.00 N ATOM 2089 CA THR A 136 10.048 -7.763 -1.292 1.00 0.00 C ATOM 2090 C THR A 136 8.521 -7.794 -1.372 1.00 0.00 C ATOM 2091 O THR A 136 7.947 -8.276 -2.351 1.00 0.00 O ATOM 2092 CB THR A 136 10.578 -6.398 -1.740 1.00 0.00 C ATOM 2093 OG1 THR A 136 10.100 -5.365 -0.894 1.00 0.00 O ATOM 2094 CG2 THR A 136 10.196 -6.042 -3.158 1.00 0.00 C ATOM 0 H THR A 136 10.487 -8.726 -3.106 1.00 0.00 H new ATOM 0 HA THR A 136 10.327 -7.934 -0.252 1.00 0.00 H new ATOM 0 HB THR A 136 11.663 -6.482 -1.683 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.890 -5.736 -0.011 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.604 -5.063 -3.410 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.598 -6.790 -3.842 1.00 0.00 H new ATOM 0 HG23 THR A 136 9.110 -6.016 -3.247 1.00 0.00 H new ATOM 2102 N ASP A 137 7.871 -7.272 -0.330 1.00 0.00 N ATOM 2103 CA ASP A 137 6.412 -7.231 -0.261 1.00 0.00 C ATOM 2104 C ASP A 137 5.921 -5.839 0.141 1.00 0.00 C ATOM 2105 O ASP A 137 6.036 -5.447 1.304 1.00 0.00 O ATOM 2106 CB ASP A 137 5.902 -8.267 0.745 1.00 0.00 C ATOM 2107 CG ASP A 137 5.318 -9.493 0.073 1.00 0.00 C ATOM 2108 OD1 ASP A 137 6.087 -10.426 -0.229 1.00 0.00 O ATOM 2109 OD2 ASP A 137 4.088 -9.524 -0.143 1.00 0.00 O ATOM 0 H ASP A 137 8.338 -6.869 0.483 1.00 0.00 H new ATOM 0 HA ASP A 137 6.021 -7.464 -1.251 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.722 -8.570 1.396 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.143 -7.809 1.380 1.00 0.00 H new ATOM 2114 N LEU A 138 5.370 -5.101 -0.820 1.00 0.00 N ATOM 2115 CA LEU A 138 4.854 -3.757 -0.559 1.00 0.00 C ATOM 2116 C LEU A 138 3.354 -3.800 -0.278 1.00 0.00 C ATOM 2117 O LEU A 138 2.583 -4.364 -1.059 1.00 0.00 O ATOM 2118 CB LEU A 138 5.139 -2.829 -1.744 1.00 0.00 C ATOM 2119 CG LEU A 138 6.454 -2.049 -1.652 1.00 0.00 C ATOM 2120 CD1 LEU A 138 6.998 -1.748 -3.042 1.00 0.00 C ATOM 2121 CD2 LEU A 138 6.257 -0.763 -0.860 1.00 0.00 C ATOM 0 H LEU A 138 5.269 -5.410 -1.787 1.00 0.00 H new ATOM 0 HA LEU A 138 5.363 -3.366 0.322 1.00 0.00 H new ATOM 0 HB2 LEU A 138 5.149 -3.423 -2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.318 -2.118 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 138 7.184 -2.666 -1.128 1.00 0.00 H new ATOM 0 HD11 LEU A 138 7.932 -1.193 -2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.179 -2.683 -3.572 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.273 -1.152 -3.595 1.00 0.00 H new ATOM 0 HD21 LEU A 138 7.201 -0.222 -0.805 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.511 -0.142 -1.355 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.918 -1.004 0.147 1.00 0.00 H new ATOM 2133 N LEU A 139 2.952 -3.208 0.844 1.00 0.00 N ATOM 2134 CA LEU A 139 1.547 -3.181 1.237 1.00 0.00 C ATOM 2135 C LEU A 139 0.992 -1.761 1.224 1.00 0.00 C ATOM 2136 O LEU A 139 1.623 -0.829 1.724 1.00 0.00 O ATOM 2137 CB LEU A 139 1.372 -3.792 2.631 1.00 0.00 C ATOM 2138 CG LEU A 139 0.488 -5.038 2.688 1.00 0.00 C ATOM 2139 CD1 LEU A 139 -0.924 -4.715 2.218 1.00 0.00 C ATOM 2140 CD2 LEU A 139 1.090 -6.152 1.849 1.00 0.00 C ATOM 0 H LEU A 139 3.581 -2.740 1.497 1.00 0.00 H new ATOM 0 HA LEU A 139 0.990 -3.772 0.510 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.356 -4.046 3.025 1.00 0.00 H new ATOM 0 HB3 LEU A 139 0.949 -3.035 3.292 1.00 0.00 H new ATOM 0 HG LEU A 139 0.433 -5.376 3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.538 -5.614 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -1.355 -3.947 2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -0.891 -4.352 1.191 1.00 0.00 H new ATOM 0 HD21 LEU A 139 0.449 -7.032 1.900 1.00 0.00 H new ATOM 0 HD22 LEU A 139 1.173 -5.823 0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 139 2.080 -6.401 2.231 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.204 -1.610 0.658 1.00 0.00 N ATOM 2153 CA LEU A 140 -0.865 -0.313 0.588 1.00 0.00 C ATOM 2154 C LEU A 140 -2.250 -0.387 1.222 1.00 0.00 C ATOM 2155 O LEU A 140 -3.209 -0.834 0.590 1.00 0.00 O ATOM 2156 CB LEU A 140 -0.974 0.159 -0.863 1.00 0.00 C ATOM 2157 CG LEU A 140 -0.743 1.657 -1.067 1.00 0.00 C ATOM 2158 CD1 LEU A 140 -0.395 1.944 -2.518 1.00 0.00 C ATOM 2159 CD2 LEU A 140 -1.970 2.452 -0.636 1.00 0.00 C ATOM 0 H LEU A 140 -0.735 -2.374 0.240 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.264 0.407 1.142 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -0.251 -0.392 -1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -1.964 -0.097 -1.241 1.00 0.00 H new ATOM 0 HG LEU A 140 0.096 1.968 -0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -0.233 3.014 -2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 140 0.513 1.404 -2.788 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.214 1.620 -3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -1.786 3.516 -0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -2.830 2.143 -1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -2.172 2.266 0.419 1.00 0.00 H new ATOM 2171 N THR A 141 -2.344 0.048 2.476 1.00 0.00 N ATOM 2172 CA THR A 141 -3.608 0.025 3.203 1.00 0.00 C ATOM 2173 C THR A 141 -4.426 1.284 2.924 1.00 0.00 C ATOM 2174 O THR A 141 -3.995 2.399 3.222 1.00 0.00 O ATOM 2175 CB THR A 141 -3.353 -0.115 4.706 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.509 -1.225 4.970 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.621 -0.300 5.510 1.00 0.00 C ATOM 0 H THR A 141 -1.558 0.421 3.009 1.00 0.00 H new ATOM 0 HA THR A 141 -4.180 -0.836 2.857 1.00 0.00 H new ATOM 0 HB THR A 141 -2.882 0.820 5.010 1.00 0.00 H new ATOM 0 HG1 THR A 141 -2.356 -1.297 5.935 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.371 -0.393 6.567 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.272 0.562 5.365 1.00 0.00 H new ATOM 0 HG23 THR A 141 -5.134 -1.202 5.178 1.00 0.00 H new ATOM 2185 N PHE A 142 -5.611 1.088 2.346 1.00 0.00 N ATOM 2186 CA PHE A 142 -6.507 2.191 2.015 1.00 0.00 C ATOM 2187 C PHE A 142 -7.854 2.024 2.721 1.00 0.00 C ATOM 2188 O PHE A 142 -8.691 1.228 2.294 1.00 0.00 O ATOM 2189 CB PHE A 142 -6.711 2.252 0.499 1.00 0.00 C ATOM 2190 CG PHE A 142 -7.089 3.610 -0.020 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -8.369 4.108 0.163 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -6.165 4.382 -0.704 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -8.720 5.350 -0.326 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -6.509 5.627 -1.193 1.00 0.00 C ATOM 2195 CZ PHE A 142 -7.788 6.113 -1.006 1.00 0.00 C ATOM 0 H PHE A 142 -5.973 0.168 2.097 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.056 3.123 2.356 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -5.793 1.931 0.007 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.488 1.540 0.220 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -9.101 3.517 0.694 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -5.164 4.006 -0.857 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -9.722 5.726 -0.178 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -5.778 6.220 -1.722 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.060 7.085 -1.389 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.051 2.772 3.805 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.295 2.697 4.571 1.00 0.00 C ATOM 2207 C ASN A 143 -10.331 3.678 4.025 1.00 0.00 C ATOM 2208 O ASN A 143 -9.980 4.717 3.464 1.00 0.00 O ATOM 2209 CB ASN A 143 -9.037 2.985 6.056 1.00 0.00 C ATOM 2210 CG ASN A 143 -7.846 2.223 6.615 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -7.301 1.329 5.965 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -7.436 2.570 7.832 1.00 0.00 N ATOM 0 H ASN A 143 -7.368 3.435 4.172 1.00 0.00 H new ATOM 0 HA ASN A 143 -9.686 1.684 4.471 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.871 4.054 6.189 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -9.927 2.727 6.630 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -6.644 2.090 8.259 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -7.914 3.316 8.338 1.00 0.00 H new ATOM 2219 N GLN A 144 -11.609 3.341 4.193 1.00 0.00 N ATOM 2220 CA GLN A 144 -12.699 4.188 3.716 1.00 0.00 C ATOM 2221 C GLN A 144 -13.911 4.089 4.644 1.00 0.00 C ATOM 2222 O GLN A 144 -14.189 3.023 5.197 1.00 0.00 O ATOM 2223 CB GLN A 144 -13.091 3.789 2.290 1.00 0.00 C ATOM 2224 CG GLN A 144 -13.411 4.971 1.390 1.00 0.00 C ATOM 2225 CD GLN A 144 -13.274 4.638 -0.085 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -13.894 3.697 -0.581 1.00 0.00 O ATOM 2227 NE2 GLN A 144 -12.460 5.411 -0.796 1.00 0.00 N ATOM 0 H GLN A 144 -11.914 2.485 4.657 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.354 5.222 3.713 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -12.277 3.216 1.846 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -13.959 3.131 2.332 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -14.428 5.309 1.589 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -12.746 5.799 1.635 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -11.965 6.181 -0.346 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -12.330 5.235 -1.792 1.00 0.00 H new ATOM 2236 N PRO A 145 -14.646 5.207 4.832 1.00 0.00 N ATOM 2237 CA PRO A 145 -15.829 5.242 5.702 1.00 0.00 C ATOM 2238 C PRO A 145 -16.861 4.174 5.341 1.00 0.00 C ATOM 2239 O PRO A 145 -17.219 4.018 4.171 1.00 0.00 O ATOM 2240 CB PRO A 145 -16.410 6.638 5.465 1.00 0.00 C ATOM 2241 CG PRO A 145 -15.262 7.457 4.993 1.00 0.00 C ATOM 2242 CD PRO A 145 -14.377 6.522 4.216 1.00 0.00 C ATOM 0 HA PRO A 145 -15.566 5.042 6.741 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -17.208 6.613 4.723 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -16.838 7.048 6.380 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -15.603 8.282 4.367 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -14.724 7.895 5.833 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -14.622 6.526 3.154 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -13.326 6.799 4.302 1.00 0.00 H new ATOM 2473 N PRO A 162 -15.688 13.375 -3.107 1.00 0.00 N ATOM 2474 CA PRO A 162 -15.202 12.230 -2.325 1.00 0.00 C ATOM 2475 C PRO A 162 -14.048 11.506 -3.019 1.00 0.00 C ATOM 2476 O PRO A 162 -13.733 11.794 -4.174 1.00 0.00 O ATOM 2477 CB PRO A 162 -16.434 11.326 -2.226 1.00 0.00 C ATOM 2478 CG PRO A 162 -17.241 11.655 -3.433 1.00 0.00 C ATOM 2479 CD PRO A 162 -17.024 13.121 -3.686 1.00 0.00 C ATOM 0 HA PRO A 162 -14.802 12.529 -1.356 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -16.153 10.273 -2.213 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -16.994 11.518 -1.311 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -16.924 11.060 -4.289 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -18.297 11.439 -3.268 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -17.051 13.353 -4.751 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -17.792 13.729 -3.207 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.422 10.567 -2.313 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.308 9.809 -2.873 1.00 0.00 C ATOM 2489 C TRP A 163 -12.762 8.428 -3.328 1.00 0.00 C ATOM 2490 O TRP A 163 -13.476 7.730 -2.606 1.00 0.00 O ATOM 2491 CB TRP A 163 -11.173 9.678 -1.853 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.175 10.792 -1.925 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -9.656 11.353 -3.055 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.579 11.480 -0.823 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -8.772 12.350 -2.723 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -8.707 12.447 -1.357 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.695 11.372 0.566 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -7.961 13.304 -0.550 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.954 12.222 1.363 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -8.095 13.174 0.804 1.00 0.00 C ATOM 0 H TRP A 163 -13.667 10.314 -1.356 1.00 0.00 H new ATOM 0 HA TRP A 163 -11.938 10.355 -3.741 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.598 9.646 -0.850 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -10.660 8.730 -2.012 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -9.904 11.056 -4.063 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -8.249 12.924 -3.384 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -10.352 10.637 1.008 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -7.301 14.044 -0.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -9.039 12.150 2.437 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.526 13.820 1.456 1.00 0.00 H new ATOM 2511 N SER A 164 -12.344 8.043 -4.532 1.00 0.00 N ATOM 2512 CA SER A 164 -12.702 6.746 -5.095 1.00 0.00 C ATOM 2513 C SER A 164 -11.454 6.012 -5.593 1.00 0.00 C ATOM 2514 O SER A 164 -10.339 6.302 -5.153 1.00 0.00 O ATOM 2515 CB SER A 164 -13.712 6.935 -6.232 1.00 0.00 C ATOM 2516 OG SER A 164 -14.641 5.866 -6.272 1.00 0.00 O ATOM 0 H SER A 164 -11.755 8.614 -5.137 1.00 0.00 H new ATOM 0 HA SER A 164 -13.161 6.137 -4.316 1.00 0.00 H new ATOM 0 HB2 SER A 164 -14.243 7.877 -6.098 1.00 0.00 H new ATOM 0 HB3 SER A 164 -13.185 6.999 -7.184 1.00 0.00 H new ATOM 0 HG SER A 164 -15.275 6.011 -7.005 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.643 5.059 -6.511 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.529 4.285 -7.067 1.00 0.00 C ATOM 2524 C LEU A 165 -9.431 5.196 -7.624 1.00 0.00 C ATOM 2525 O LEU A 165 -8.253 4.834 -7.605 1.00 0.00 O ATOM 2526 CB LEU A 165 -11.031 3.342 -8.167 1.00 0.00 C ATOM 2527 CG LEU A 165 -10.954 1.851 -7.833 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -9.505 1.406 -7.694 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -11.737 1.547 -6.563 1.00 0.00 C ATOM 0 H LEU A 165 -12.557 4.805 -6.885 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.100 3.697 -6.255 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -12.067 3.594 -8.394 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -10.452 3.525 -9.072 1.00 0.00 H new ATOM 0 HG LEU A 165 -11.403 1.291 -8.653 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -9.472 0.343 -7.456 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -8.978 1.585 -8.631 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.026 1.971 -6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -11.671 0.482 -6.341 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -11.320 2.117 -5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -12.782 1.824 -6.705 1.00 0.00 H new ATOM 2541 N GLY A 166 -9.821 6.375 -8.119 1.00 0.00 N ATOM 2542 CA GLY A 166 -8.860 7.320 -8.674 1.00 0.00 C ATOM 2543 C GLY A 166 -7.721 7.636 -7.721 1.00 0.00 C ATOM 2544 O GLY A 166 -6.561 7.690 -8.129 1.00 0.00 O ATOM 0 H GLY A 166 -10.790 6.692 -8.145 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.451 6.913 -9.598 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.376 8.244 -8.934 1.00 0.00 H new ATOM 2548 N ASP A 167 -8.054 7.837 -6.446 1.00 0.00 N ATOM 2549 CA ASP A 167 -7.053 8.142 -5.428 1.00 0.00 C ATOM 2550 C ASP A 167 -6.225 6.902 -5.099 1.00 0.00 C ATOM 2551 O ASP A 167 -4.999 6.980 -4.992 1.00 0.00 O ATOM 2552 CB ASP A 167 -7.732 8.684 -4.162 1.00 0.00 C ATOM 2553 CG ASP A 167 -6.871 9.689 -3.415 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -6.489 10.712 -4.019 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -6.586 9.454 -2.222 1.00 0.00 O ATOM 0 H ASP A 167 -9.011 7.794 -6.095 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.383 8.907 -5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -8.677 9.154 -4.435 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -7.970 7.852 -3.499 1.00 0.00 H new ATOM 2560 N PHE A 168 -6.898 5.758 -4.954 1.00 0.00 N ATOM 2561 CA PHE A 168 -6.219 4.497 -4.654 1.00 0.00 C ATOM 2562 C PHE A 168 -5.181 4.187 -5.727 1.00 0.00 C ATOM 2563 O PHE A 168 -4.022 3.906 -5.418 1.00 0.00 O ATOM 2564 CB PHE A 168 -7.229 3.346 -4.554 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.594 2.009 -4.270 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -6.111 1.713 -3.006 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -6.474 1.053 -5.269 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -5.521 0.492 -2.741 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.882 -0.169 -5.010 1.00 0.00 C ATOM 2570 CZ PHE A 168 -5.405 -0.450 -3.744 1.00 0.00 C ATOM 0 H PHE A 168 -7.911 5.680 -5.040 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.716 4.601 -3.693 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -7.948 3.572 -3.766 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.788 3.282 -5.487 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -6.197 2.446 -2.217 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -6.847 1.266 -6.260 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -5.151 0.275 -1.750 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.792 -0.904 -5.797 1.00 0.00 H new ATOM 0 HZ PHE A 168 -4.942 -1.404 -3.539 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.607 4.251 -6.990 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.717 3.987 -8.119 1.00 0.00 C ATOM 2582 C GLU A 169 -3.474 4.874 -8.039 1.00 0.00 C ATOM 2583 O GLU A 169 -2.362 4.421 -8.309 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.446 4.220 -9.447 1.00 0.00 C ATOM 2585 CG GLU A 169 -6.294 3.039 -9.898 1.00 0.00 C ATOM 2586 CD GLU A 169 -7.409 3.447 -10.843 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -7.103 3.842 -11.987 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -8.589 3.367 -10.438 1.00 0.00 O ATOM 0 H GLU A 169 -6.564 4.484 -7.255 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.406 2.943 -8.071 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.085 5.098 -9.351 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -4.711 4.444 -10.220 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -5.656 2.306 -10.391 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -6.724 2.551 -9.024 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.673 6.137 -7.652 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.569 7.085 -7.523 1.00 0.00 C ATOM 2597 C GLN A 170 -1.596 6.641 -6.431 1.00 0.00 C ATOM 2598 O GLN A 170 -0.380 6.697 -6.617 1.00 0.00 O ATOM 2599 CB GLN A 170 -3.096 8.490 -7.213 1.00 0.00 C ATOM 2600 CG GLN A 170 -3.229 9.383 -8.438 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.947 9.477 -9.251 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -1.959 9.296 -10.469 1.00 0.00 O ATOM 2603 NE2 GLN A 170 -0.831 9.761 -8.585 1.00 0.00 N ATOM 0 H GLN A 170 -4.589 6.524 -7.423 1.00 0.00 H new ATOM 0 HA GLN A 170 -2.037 7.111 -8.474 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -4.070 8.404 -6.731 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -2.427 8.969 -6.498 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -4.028 9.001 -9.074 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -3.525 10.383 -8.121 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -0.862 9.904 -7.576 1.00 0.00 H new ATOM 0 HE22 GLN A 170 0.056 9.836 -9.084 1.00 0.00 H new ATOM 2612 N LEU A 171 -2.136 6.196 -5.292 1.00 0.00 N ATOM 2613 CA LEU A 171 -1.304 5.735 -4.179 1.00 0.00 C ATOM 2614 C LEU A 171 -0.532 4.473 -4.569 1.00 0.00 C ATOM 2615 O LEU A 171 0.601 4.276 -4.135 1.00 0.00 O ATOM 2616 CB LEU A 171 -2.155 5.467 -2.931 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.551 5.950 -1.603 1.00 0.00 C ATOM 2618 CD1 LEU A 171 -0.236 5.241 -1.310 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -1.348 7.459 -1.625 1.00 0.00 C ATOM 0 H LEU A 171 -3.140 6.146 -5.118 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.590 6.525 -3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.125 5.946 -3.064 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -2.336 4.395 -2.859 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.253 5.705 -0.806 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.169 5.602 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.409 4.167 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.474 5.446 -2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -0.920 7.782 -0.676 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.671 7.723 -2.438 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -2.308 7.953 -1.777 1.00 0.00 H new ATOM 2631 N VAL A 172 -1.144 3.622 -5.399 1.00 0.00 N ATOM 2632 CA VAL A 172 -0.488 2.392 -5.843 1.00 0.00 C ATOM 2633 C VAL A 172 0.821 2.715 -6.565 1.00 0.00 C ATOM 2634 O VAL A 172 1.814 2.000 -6.420 1.00 0.00 O ATOM 2635 CB VAL A 172 -1.394 1.551 -6.772 1.00 0.00 C ATOM 2636 CG1 VAL A 172 -0.722 0.230 -7.115 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.758 1.308 -6.131 1.00 0.00 C ATOM 0 H VAL A 172 -2.083 3.761 -5.773 1.00 0.00 H new ATOM 0 HA VAL A 172 -0.281 1.802 -4.950 1.00 0.00 H new ATOM 0 HB VAL A 172 -1.549 2.112 -7.694 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -1.373 -0.350 -7.769 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.223 0.424 -7.622 1.00 0.00 H new ATOM 0 HG13 VAL A 172 -0.535 -0.331 -6.200 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -3.376 0.714 -6.805 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -2.628 0.772 -5.191 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -3.245 2.264 -5.939 1.00 0.00 H new ATOM 2647 N THR A 173 0.821 3.814 -7.320 1.00 0.00 N ATOM 2648 CA THR A 173 2.015 4.248 -8.035 1.00 0.00 C ATOM 2649 C THR A 173 2.875 5.147 -7.159 1.00 0.00 C ATOM 2650 O THR A 173 4.036 5.396 -7.486 1.00 0.00 O ATOM 2651 CB THR A 173 1.654 5.003 -9.309 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.560 5.880 -9.087 1.00 0.00 O ATOM 2653 CG2 THR A 173 1.293 4.095 -10.462 1.00 0.00 C ATOM 0 H THR A 173 0.008 4.417 -7.450 1.00 0.00 H new ATOM 0 HA THR A 173 2.574 3.350 -8.297 1.00 0.00 H new ATOM 0 HB THR A 173 2.553 5.559 -9.576 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.530 6.133 -8.141 1.00 0.00 H new ATOM 0 HG21 THR A 173 1.047 4.698 -11.336 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.139 3.447 -10.694 1.00 0.00 H new ATOM 0 HG23 THR A 173 0.433 3.484 -10.189 1.00 0.00 H new ATOM 2661 N SER A 174 2.292 5.648 -6.059 1.00 0.00 N ATOM 2662 CA SER A 174 3.002 6.533 -5.136 1.00 0.00 C ATOM 2663 C SER A 174 4.493 6.215 -5.106 1.00 0.00 C ATOM 2664 O SER A 174 5.316 7.100 -5.313 1.00 0.00 O ATOM 2665 CB SER A 174 2.425 6.417 -3.722 1.00 0.00 C ATOM 2666 OG SER A 174 2.586 7.628 -3.011 1.00 0.00 O ATOM 0 H SER A 174 1.328 5.452 -5.791 1.00 0.00 H new ATOM 0 HA SER A 174 2.869 7.554 -5.494 1.00 0.00 H new ATOM 0 HB2 SER A 174 1.367 6.160 -3.776 1.00 0.00 H new ATOM 0 HB3 SER A 174 2.922 5.608 -3.187 1.00 0.00 H new ATOM 0 HG SER A 174 1.817 8.211 -3.180 1.00 0.00 H new ATOM 2672 N LEU A 175 4.824 4.940 -4.871 1.00 0.00 N ATOM 2673 CA LEU A 175 6.221 4.486 -4.824 1.00 0.00 C ATOM 2674 C LEU A 175 6.865 4.480 -6.217 1.00 0.00 C ATOM 2675 O LEU A 175 7.369 3.451 -6.675 1.00 0.00 O ATOM 2676 CB LEU A 175 6.306 3.086 -4.207 1.00 0.00 C ATOM 2677 CG LEU A 175 5.655 2.931 -2.830 1.00 0.00 C ATOM 2678 CD1 LEU A 175 4.999 1.563 -2.709 1.00 0.00 C ATOM 2679 CD2 LEU A 175 6.683 3.131 -1.724 1.00 0.00 C ATOM 0 H LEU A 175 4.141 4.200 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 175 6.772 5.191 -4.202 1.00 0.00 H new ATOM 0 HB2 LEU A 175 5.840 2.378 -4.892 1.00 0.00 H new ATOM 0 HB3 LEU A 175 7.357 2.807 -4.126 1.00 0.00 H new ATOM 0 HG LEU A 175 4.886 3.696 -2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 175 4.540 1.465 -1.725 1.00 0.00 H new ATOM 0 HD12 LEU A 175 4.234 1.457 -3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 175 5.752 0.786 -2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 175 6.200 3.017 -0.753 1.00 0.00 H new ATOM 0 HD22 LEU A 175 7.475 2.389 -1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 175 7.111 4.131 -1.801 1.00 0.00 H new ATOM 2691 N THR A 176 6.861 5.636 -6.878 1.00 0.00 N ATOM 2692 CA THR A 176 7.453 5.765 -8.206 1.00 0.00 C ATOM 2693 C THR A 176 8.967 5.577 -8.138 1.00 0.00 C ATOM 2694 O THR A 176 9.673 6.371 -7.512 1.00 0.00 O ATOM 2695 CB THR A 176 7.117 7.133 -8.813 1.00 0.00 C ATOM 2696 OG1 THR A 176 7.609 8.189 -7.998 1.00 0.00 O ATOM 2697 CG2 THR A 176 5.634 7.355 -9.005 1.00 0.00 C ATOM 0 H THR A 176 6.453 6.497 -6.514 1.00 0.00 H new ATOM 0 HA THR A 176 7.034 4.987 -8.844 1.00 0.00 H new ATOM 0 HB THR A 176 7.600 7.136 -9.790 1.00 0.00 H new ATOM 0 HG1 THR A 176 8.569 8.305 -8.158 1.00 0.00 H new ATOM 0 HG21 THR A 176 5.467 8.341 -9.438 1.00 0.00 H new ATOM 0 HG22 THR A 176 5.236 6.593 -9.675 1.00 0.00 H new ATOM 0 HG23 THR A 176 5.129 7.291 -8.041 1.00 0.00 H new ATOM 2705 N LEU A 177 9.464 4.518 -8.772 1.00 0.00 N ATOM 2706 CA LEU A 177 10.895 4.234 -8.764 1.00 0.00 C ATOM 2707 C LEU A 177 11.635 5.093 -9.785 1.00 0.00 C ATOM 2708 O LEU A 177 11.513 4.886 -10.995 1.00 0.00 O ATOM 2709 CB LEU A 177 11.161 2.752 -9.045 1.00 0.00 C ATOM 2710 CG LEU A 177 12.626 2.327 -8.905 1.00 0.00 C ATOM 2711 CD1 LEU A 177 13.070 2.417 -7.453 1.00 0.00 C ATOM 2712 CD2 LEU A 177 12.833 0.921 -9.451 1.00 0.00 C ATOM 0 H LEU A 177 8.901 3.847 -9.294 1.00 0.00 H new ATOM 0 HA LEU A 177 11.268 4.477 -7.769 1.00 0.00 H new ATOM 0 HB2 LEU A 177 10.556 2.153 -8.364 1.00 0.00 H new ATOM 0 HB3 LEU A 177 10.825 2.522 -10.056 1.00 0.00 H new ATOM 0 HG LEU A 177 13.241 3.010 -9.492 1.00 0.00 H new ATOM 0 HD11 LEU A 177 14.113 2.111 -7.372 1.00 0.00 H new ATOM 0 HD12 LEU A 177 12.964 3.444 -7.103 1.00 0.00 H new ATOM 0 HD13 LEU A 177 12.451 1.760 -6.842 1.00 0.00 H new ATOM 0 HD21 LEU A 177 13.880 0.639 -9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 177 12.209 0.220 -8.897 1.00 0.00 H new ATOM 0 HD23 LEU A 177 12.559 0.896 -10.506 1.00 0.00 H new ATOM 2724 N HIS A 178 12.415 6.046 -9.284 1.00 0.00 N ATOM 2725 CA HIS A 178 13.197 6.932 -10.140 1.00 0.00 C ATOM 2726 C HIS A 178 14.638 6.430 -10.241 1.00 0.00 C ATOM 2727 O HIS A 178 15.251 6.485 -11.307 1.00 0.00 O ATOM 2728 CB HIS A 178 13.180 8.364 -9.597 1.00 0.00 C ATOM 2729 CG HIS A 178 11.803 8.914 -9.384 1.00 0.00 C ATOM 2730 ND1 HIS A 178 11.022 9.399 -10.411 1.00 0.00 N ATOM 2731 CD2 HIS A 178 11.066 9.050 -8.258 1.00 0.00 C ATOM 2732 CE1 HIS A 178 9.864 9.810 -9.923 1.00 0.00 C ATOM 2733 NE2 HIS A 178 9.861 9.607 -8.618 1.00 0.00 N ATOM 0 H HIS A 178 12.523 6.225 -8.286 1.00 0.00 H new ATOM 0 HA HIS A 178 12.748 6.933 -11.133 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.722 8.390 -8.652 1.00 0.00 H new ATOM 0 HB3 HIS A 178 13.717 9.012 -10.290 1.00 0.00 H new ATOM 0 HD1 HIS A 178 11.295 9.435 -11.393 1.00 0.00 H new ATOM 0 HD2 HIS A 178 11.368 8.772 -7.259 1.00 0.00 H new ATOM 0 HE1 HIS A 178 9.056 10.240 -10.496 1.00 0.00 H new ATOM 2742 N ASP A 179 15.164 5.932 -9.117 1.00 0.00 N ATOM 2743 CA ASP A 179 16.527 5.411 -9.061 1.00 0.00 C ATOM 2744 C ASP A 179 16.634 4.293 -8.021 1.00 0.00 C ATOM 2745 O ASP A 179 16.408 4.525 -6.833 1.00 0.00 O ATOM 2746 CB ASP A 179 17.513 6.535 -8.723 1.00 0.00 C ATOM 2747 CG ASP A 179 18.670 6.603 -9.701 1.00 0.00 C ATOM 2748 OD1 ASP A 179 19.606 5.784 -9.573 1.00 0.00 O ATOM 2749 OD2 ASP A 179 18.640 7.472 -10.596 1.00 0.00 O ATOM 0 H ASP A 179 14.661 5.880 -8.231 1.00 0.00 H new ATOM 0 HA ASP A 179 16.777 5.002 -10.040 1.00 0.00 H new ATOM 0 HB2 ASP A 179 16.986 7.489 -8.722 1.00 0.00 H new ATOM 0 HB3 ASP A 179 17.901 6.384 -7.716 1.00 0.00 H new ATOM 2754 N PRO A 180 16.978 3.059 -8.455 1.00 0.00 N ATOM 2755 CA PRO A 180 17.111 1.906 -7.550 1.00 0.00 C ATOM 2756 C PRO A 180 18.352 1.999 -6.655 1.00 0.00 C ATOM 2757 O PRO A 180 19.265 1.174 -6.747 1.00 0.00 O ATOM 2758 CB PRO A 180 17.215 0.716 -8.510 1.00 0.00 C ATOM 2759 CG PRO A 180 17.796 1.290 -9.756 1.00 0.00 C ATOM 2760 CD PRO A 180 17.261 2.692 -9.859 1.00 0.00 C ATOM 0 HA PRO A 180 16.276 1.834 -6.853 1.00 0.00 H new ATOM 0 HB2 PRO A 180 17.851 -0.069 -8.101 1.00 0.00 H new ATOM 0 HB3 PRO A 180 16.238 0.270 -8.697 1.00 0.00 H new ATOM 0 HG2 PRO A 180 18.885 1.291 -9.714 1.00 0.00 H new ATOM 0 HG3 PRO A 180 17.511 0.699 -10.627 1.00 0.00 H new ATOM 0 HD2 PRO A 180 17.988 3.367 -10.311 1.00 0.00 H new ATOM 0 HD3 PRO A 180 16.362 2.734 -10.474 1.00 0.00 H new