USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1224 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 147 ASN : amide:sc= -8.39! K(o=-7.8!,f=-1.2) USER MOD Set 1.2: A 165 ASN : amide:sc= 0.461 K(o=-7.8,f=-5!) USER MOD Set 1.3: A 166 SER OG : rot 180:sc= 0.121 USER MOD Set 2.1: A 125 LYS NZ :NH3+ -118:sc= 0.0754 (180deg=-1.92!) USER MOD Set 2.2: A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 73 TYR OH : rot 115:sc= 0.743 USER MOD Set 3.2: A 92 TYR OH : rot -15:sc= -0.353 USER MOD Set 4.1: A 39 ASN : amide:sc= -1.67! K(o=-2.7!,f=-11) USER MOD Set 4.2: A 43 LYS NZ :NH3+ 176:sc= -1.03 (180deg=-2.06) USER MOD Set 5.1: A 32 LYS NZ :NH3+ -154:sc= -2.62 (180deg=-5.22!) USER MOD Set 5.2: A 74 ASN : amide:sc= 0.241 K(o=-2.4,f=-3.2) USER MOD Single : A 13 SER OG : rot 153:sc= 0.292 USER MOD Single : A 15 SER OG : rot -1:sc= 0.335 USER MOD Single : A 20 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0203) USER MOD Single : A 21 THR OG1 : rot 67:sc= 0.212 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -110:sc= -0.503 USER MOD Single : A 44 THR OG1 : rot 63:sc= 0.337 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -3.56! C(o=-3.6!,f=-4.2!) USER MOD Single : A 50 THR OG1 : rot 30:sc= 0.0649 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.112 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0363 USER MOD Single : A 57 SER OG : rot 2:sc= 1.21 USER MOD Single : A 63 HIS : no HE2:sc= -0.253 K(o=-0.25,f=-1.1) USER MOD Single : A 64 LYS NZ :NH3+ -168:sc=-0.00928 (180deg=-0.142) USER MOD Single : A 67 HIS : no HD1:sc= 0.0207 K(o=0.021,f=-0.52) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.154 X(o=-0.15,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 35:sc= 0.281 USER MOD Single : A 94 MET CE :methyl -161:sc= -2.01 (180deg=-3.58!) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 99 THR OG1 : rot -168:sc= -1.42 USER MOD Single : A 105 SER OG : rot 180:sc= -0.555 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 127:sc= 0.474 USER MOD Single : A 115 ASN : amide:sc= -5.51! C(o=-5.5!,f=-7.3!) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 TYR OH : rot 68:sc= 0.591 USER MOD Single : A 123 LYS NZ :NH3+ -166:sc=-0.00719 (180deg=-0.141) USER MOD Single : A 130 GLN : amide:sc= -0.828 K(o=-0.83,f=-3.6!) USER MOD Single : A 133 TYR OH : rot 180:sc= -0.852 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HE2:sc= -2.91! C(o=-2.9!,f=-3.1!) USER MOD Single : A 151 THR OG1 : rot 160:sc= -0.371 USER MOD Single : A 153 ASN : amide:sc= -0.836 K(o=-0.84,f=-0.2) USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ -107:sc= -0.0923 (180deg=-3.01) USER MOD Single : A 160 SER OG : rot 23:sc= -2.22! USER MOD Single : A 164 MET CE :methyl 167:sc= -0.474 (180deg=-0.781) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 169 HIS : no HD1:sc= -2.61! C(o=-2.6!,f=-3.6!) USER MOD Single : A 175 HIS : no HE2:sc= -6.12! C(o=-6.1!,f=-3.3!) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 79 N VAL A 8 9.619 12.337 -4.358 1.00 0.00 N ATOM 80 CA VAL A 8 10.082 11.062 -3.804 1.00 0.00 C ATOM 81 C VAL A 8 11.257 11.287 -2.851 1.00 0.00 C ATOM 82 O VAL A 8 12.014 12.244 -3.013 1.00 0.00 O ATOM 83 CB VAL A 8 10.501 10.063 -4.910 1.00 0.00 C ATOM 84 CG1 VAL A 8 9.281 9.493 -5.623 1.00 0.00 C ATOM 85 CG2 VAL A 8 11.442 10.725 -5.907 1.00 0.00 C ATOM 0 HA VAL A 8 9.243 10.630 -3.259 1.00 0.00 H new ATOM 0 HB VAL A 8 11.030 9.238 -4.433 1.00 0.00 H new ATOM 0 HG11 VAL A 8 9.604 8.794 -6.395 1.00 0.00 H new ATOM 0 HG12 VAL A 8 8.649 8.972 -4.903 1.00 0.00 H new ATOM 0 HG13 VAL A 8 8.716 10.304 -6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.724 10.005 -6.675 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.941 11.574 -6.372 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.336 11.071 -5.389 1.00 0.00 H new ATOM 95 N ILE A 9 11.391 10.420 -1.853 1.00 0.00 N ATOM 96 CA ILE A 9 12.468 10.541 -0.869 1.00 0.00 C ATOM 97 C ILE A 9 13.688 9.710 -1.268 1.00 0.00 C ATOM 98 O ILE A 9 13.550 8.618 -1.823 1.00 0.00 O ATOM 99 CB ILE A 9 12.003 10.100 0.533 1.00 0.00 C ATOM 100 CG1 ILE A 9 10.687 10.782 0.914 1.00 0.00 C ATOM 101 CG2 ILE A 9 13.072 10.406 1.562 1.00 0.00 C ATOM 102 CD1 ILE A 9 10.767 12.293 0.938 1.00 0.00 C ATOM 0 H ILE A 9 10.769 9.626 -1.702 1.00 0.00 H new ATOM 0 HA ILE A 9 12.745 11.595 -0.842 1.00 0.00 H new ATOM 0 HB ILE A 9 11.833 9.024 0.511 1.00 0.00 H new ATOM 0 HG12 ILE A 9 9.914 10.480 0.208 1.00 0.00 H new ATOM 0 HG13 ILE A 9 10.376 10.428 1.897 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.730 10.089 2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 9 13.987 9.871 1.306 1.00 0.00 H new ATOM 0 HG23 ILE A 9 13.269 11.478 1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.797 12.704 1.216 1.00 0.00 H new ATOM 0 HD12 ILE A 9 11.516 12.606 1.665 1.00 0.00 H new ATOM 0 HD13 ILE A 9 11.046 12.658 -0.050 1.00 0.00 H new ATOM 114 N ASP A 10 14.879 10.224 -0.973 1.00 0.00 N ATOM 115 CA ASP A 10 16.135 9.534 -1.301 1.00 0.00 C ATOM 116 C ASP A 10 16.474 8.419 -0.314 1.00 0.00 C ATOM 117 O ASP A 10 17.647 8.113 -0.100 1.00 0.00 O ATOM 118 CB ASP A 10 17.307 10.521 -1.349 1.00 0.00 C ATOM 119 CG ASP A 10 17.181 11.551 -2.453 1.00 0.00 C ATOM 120 OD1 ASP A 10 16.226 12.350 -2.422 1.00 0.00 O ATOM 121 OD2 ASP A 10 18.046 11.577 -3.348 1.00 0.00 O ATOM 0 H ASP A 10 15.007 11.121 -0.505 1.00 0.00 H new ATOM 0 HA ASP A 10 15.980 9.085 -2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 10 17.380 11.034 -0.390 1.00 0.00 H new ATOM 0 HB3 ASP A 10 18.235 9.965 -1.485 1.00 0.00 H new ATOM 126 N GLY A 11 15.454 7.799 0.271 1.00 0.00 N ATOM 127 CA GLY A 11 15.675 6.708 1.208 1.00 0.00 C ATOM 128 C GLY A 11 16.243 7.138 2.549 1.00 0.00 C ATOM 129 O GLY A 11 16.190 6.376 3.514 1.00 0.00 O ATOM 0 H GLY A 11 14.474 8.033 0.113 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.729 6.193 1.376 1.00 0.00 H new ATOM 0 HA3 GLY A 11 16.355 5.987 0.754 1.00 0.00 H new ATOM 133 N ALA A 12 16.803 8.337 2.617 1.00 0.00 N ATOM 134 CA ALA A 12 17.388 8.816 3.860 1.00 0.00 C ATOM 135 C ALA A 12 17.079 10.292 4.111 1.00 0.00 C ATOM 136 O ALA A 12 17.611 10.890 5.043 1.00 0.00 O ATOM 137 CB ALA A 12 18.892 8.573 3.863 1.00 0.00 C ATOM 0 H ALA A 12 16.864 8.989 1.835 1.00 0.00 H new ATOM 0 HA ALA A 12 16.935 8.252 4.675 1.00 0.00 H new ATOM 0 HB1 ALA A 12 19.317 8.936 4.799 1.00 0.00 H new ATOM 0 HB2 ALA A 12 19.088 7.505 3.765 1.00 0.00 H new ATOM 0 HB3 ALA A 12 19.348 9.104 3.027 1.00 0.00 H new ATOM 143 N SER A 13 16.210 10.875 3.296 1.00 0.00 N ATOM 144 CA SER A 13 15.839 12.271 3.469 1.00 0.00 C ATOM 145 C SER A 13 14.393 12.393 3.958 1.00 0.00 C ATOM 146 O SER A 13 13.607 13.185 3.436 1.00 0.00 O ATOM 147 CB SER A 13 16.053 13.052 2.167 1.00 0.00 C ATOM 148 OG SER A 13 15.763 12.261 1.024 1.00 0.00 O ATOM 0 H SER A 13 15.752 10.406 2.514 1.00 0.00 H new ATOM 0 HA SER A 13 16.485 12.706 4.231 1.00 0.00 H new ATOM 0 HB2 SER A 13 15.418 13.938 2.166 1.00 0.00 H new ATOM 0 HB3 SER A 13 17.085 13.399 2.117 1.00 0.00 H new ATOM 0 HG SER A 13 15.487 12.843 0.285 1.00 0.00 H new ATOM 154 N LEU A 14 14.051 11.597 4.971 1.00 0.00 N ATOM 155 CA LEU A 14 12.705 11.606 5.542 1.00 0.00 C ATOM 156 C LEU A 14 12.736 11.303 7.030 1.00 0.00 C ATOM 157 O LEU A 14 13.721 10.787 7.556 1.00 0.00 O ATOM 158 CB LEU A 14 11.735 10.633 4.815 1.00 0.00 C ATOM 159 CG LEU A 14 11.978 9.104 4.918 1.00 0.00 C ATOM 160 CD1 LEU A 14 13.432 8.735 4.683 1.00 0.00 C ATOM 161 CD2 LEU A 14 11.482 8.534 6.243 1.00 0.00 C ATOM 0 H LEU A 14 14.690 10.936 5.414 1.00 0.00 H new ATOM 0 HA LEU A 14 12.320 12.615 5.395 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.730 10.831 5.189 1.00 0.00 H new ATOM 0 HB3 LEU A 14 11.739 10.895 3.757 1.00 0.00 H new ATOM 0 HG LEU A 14 11.391 8.649 4.120 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.551 7.655 4.766 1.00 0.00 H new ATOM 0 HD12 LEU A 14 13.733 9.058 3.686 1.00 0.00 H new ATOM 0 HD13 LEU A 14 14.057 9.227 5.428 1.00 0.00 H new ATOM 0 HD21 LEU A 14 11.672 7.461 6.272 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.007 9.018 7.067 1.00 0.00 H new ATOM 0 HD23 LEU A 14 10.411 8.715 6.339 1.00 0.00 H new ATOM 173 N SER A 15 11.636 11.633 7.684 1.00 0.00 N ATOM 174 CA SER A 15 11.460 11.422 9.111 1.00 0.00 C ATOM 175 C SER A 15 9.966 11.402 9.414 1.00 0.00 C ATOM 176 O SER A 15 9.168 11.866 8.593 1.00 0.00 O ATOM 177 CB SER A 15 12.150 12.530 9.922 1.00 0.00 C ATOM 178 OG SER A 15 13.548 12.572 9.667 1.00 0.00 O ATOM 0 H SER A 15 10.828 12.061 7.232 1.00 0.00 H new ATOM 0 HA SER A 15 11.916 10.473 9.395 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.705 13.494 9.674 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.978 12.364 10.986 1.00 0.00 H new ATOM 0 HG SER A 15 13.785 11.870 9.026 1.00 0.00 H new ATOM 184 N PHE A 16 9.594 10.858 10.568 1.00 0.00 N ATOM 185 CA PHE A 16 8.187 10.763 10.969 1.00 0.00 C ATOM 186 C PHE A 16 7.477 12.119 10.900 1.00 0.00 C ATOM 187 O PHE A 16 6.275 12.182 10.656 1.00 0.00 O ATOM 188 CB PHE A 16 8.052 10.154 12.374 1.00 0.00 C ATOM 189 CG PHE A 16 8.930 10.772 13.430 1.00 0.00 C ATOM 190 CD1 PHE A 16 8.668 12.039 13.931 1.00 0.00 C ATOM 191 CD2 PHE A 16 10.009 10.068 13.938 1.00 0.00 C ATOM 192 CE1 PHE A 16 9.469 12.591 14.911 1.00 0.00 C ATOM 193 CE2 PHE A 16 10.813 10.615 14.922 1.00 0.00 C ATOM 194 CZ PHE A 16 10.543 11.878 15.408 1.00 0.00 C ATOM 0 H PHE A 16 10.249 10.473 11.249 1.00 0.00 H new ATOM 0 HA PHE A 16 7.698 10.100 10.256 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.013 10.242 12.692 1.00 0.00 H new ATOM 0 HB3 PHE A 16 8.278 9.089 12.314 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.828 12.600 13.550 1.00 0.00 H new ATOM 0 HD2 PHE A 16 10.226 9.079 13.561 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.256 13.580 15.289 1.00 0.00 H new ATOM 0 HE2 PHE A 16 11.651 10.054 15.309 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.170 12.308 16.175 1.00 0.00 H new ATOM 204 N ASP A 17 8.231 13.196 11.103 1.00 0.00 N ATOM 205 CA ASP A 17 7.674 14.549 11.052 1.00 0.00 C ATOM 206 C ASP A 17 7.216 14.878 9.632 1.00 0.00 C ATOM 207 O ASP A 17 6.138 15.437 9.429 1.00 0.00 O ATOM 208 CB ASP A 17 8.708 15.570 11.549 1.00 0.00 C ATOM 209 CG ASP A 17 8.167 16.988 11.609 1.00 0.00 C ATOM 210 OD1 ASP A 17 8.038 17.623 10.548 1.00 0.00 O ATOM 211 OD2 ASP A 17 7.872 17.471 12.720 1.00 0.00 O ATOM 0 H ASP A 17 9.230 13.160 11.305 1.00 0.00 H new ATOM 0 HA ASP A 17 6.806 14.600 11.709 1.00 0.00 H new ATOM 0 HB2 ASP A 17 9.051 15.277 12.541 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.577 15.547 10.891 1.00 0.00 H new ATOM 216 N ILE A 18 8.020 14.488 8.647 1.00 0.00 N ATOM 217 CA ILE A 18 7.673 14.702 7.248 1.00 0.00 C ATOM 218 C ILE A 18 6.419 13.905 6.924 1.00 0.00 C ATOM 219 O ILE A 18 5.532 14.385 6.227 1.00 0.00 O ATOM 220 CB ILE A 18 8.819 14.298 6.284 1.00 0.00 C ATOM 221 CG1 ILE A 18 9.997 15.280 6.390 1.00 0.00 C ATOM 222 CG2 ILE A 18 8.320 14.226 4.844 1.00 0.00 C ATOM 223 CD1 ILE A 18 10.834 15.119 7.643 1.00 0.00 C ATOM 0 H ILE A 18 8.916 14.022 8.793 1.00 0.00 H new ATOM 0 HA ILE A 18 7.499 15.768 7.104 1.00 0.00 H new ATOM 0 HB ILE A 18 9.167 13.308 6.578 1.00 0.00 H new ATOM 0 HG12 ILE A 18 10.640 15.153 5.519 1.00 0.00 H new ATOM 0 HG13 ILE A 18 9.610 16.298 6.354 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.142 13.941 4.188 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.524 13.485 4.771 1.00 0.00 H new ATOM 0 HG23 ILE A 18 7.937 15.201 4.543 1.00 0.00 H new ATOM 0 HD11 ILE A 18 11.642 15.850 7.637 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.208 15.277 8.521 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.254 14.114 7.673 1.00 0.00 H new ATOM 235 N LEU A 19 6.333 12.698 7.479 1.00 0.00 N ATOM 236 CA LEU A 19 5.162 11.859 7.285 1.00 0.00 C ATOM 237 C LEU A 19 3.947 12.524 7.913 1.00 0.00 C ATOM 238 O LEU A 19 2.844 12.459 7.371 1.00 0.00 O ATOM 239 CB LEU A 19 5.382 10.470 7.879 1.00 0.00 C ATOM 240 CG LEU A 19 6.142 9.503 6.977 1.00 0.00 C ATOM 241 CD1 LEU A 19 6.655 8.319 7.783 1.00 0.00 C ATOM 242 CD2 LEU A 19 5.246 9.027 5.845 1.00 0.00 C ATOM 0 H LEU A 19 7.059 12.284 8.064 1.00 0.00 H new ATOM 0 HA LEU A 19 4.990 11.739 6.215 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.926 10.573 8.818 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.412 10.035 8.119 1.00 0.00 H new ATOM 0 HG LEU A 19 6.998 10.024 6.548 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.195 7.638 7.125 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.325 8.675 8.566 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.813 7.795 8.236 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.800 8.337 5.208 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.375 8.519 6.259 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.919 9.883 5.255 1.00 0.00 H new ATOM 254 N LYS A 20 4.167 13.199 9.042 1.00 0.00 N ATOM 255 CA LYS A 20 3.102 13.918 9.722 1.00 0.00 C ATOM 256 C LYS A 20 2.607 15.029 8.806 1.00 0.00 C ATOM 257 O LYS A 20 1.411 15.311 8.733 1.00 0.00 O ATOM 258 CB LYS A 20 3.610 14.489 11.050 1.00 0.00 C ATOM 259 CG LYS A 20 2.547 15.193 11.881 1.00 0.00 C ATOM 260 CD LYS A 20 3.102 15.586 13.243 1.00 0.00 C ATOM 261 CE LYS A 20 2.066 16.275 14.119 1.00 0.00 C ATOM 262 NZ LYS A 20 1.656 17.599 13.583 1.00 0.00 N ATOM 0 H LYS A 20 5.076 13.260 9.501 1.00 0.00 H new ATOM 0 HA LYS A 20 2.278 13.241 9.948 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.037 13.678 11.640 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.417 15.192 10.844 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.197 16.081 11.355 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.685 14.538 12.009 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.469 14.695 13.753 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.956 16.249 13.106 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.188 15.635 14.209 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.471 16.403 15.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.001 18.056 14.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.497 18.198 13.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.182 17.471 12.666 1.00 0.00 H new ATOM 276 N THR A 21 3.546 15.626 8.082 1.00 0.00 N ATOM 277 CA THR A 21 3.241 16.676 7.129 1.00 0.00 C ATOM 278 C THR A 21 2.471 16.099 5.935 1.00 0.00 C ATOM 279 O THR A 21 1.478 16.677 5.491 1.00 0.00 O ATOM 280 CB THR A 21 4.532 17.374 6.653 1.00 0.00 C ATOM 281 OG1 THR A 21 5.228 17.926 7.779 1.00 0.00 O ATOM 282 CG2 THR A 21 4.215 18.483 5.663 1.00 0.00 C ATOM 0 H THR A 21 4.537 15.394 8.142 1.00 0.00 H new ATOM 0 HA THR A 21 2.615 17.420 7.623 1.00 0.00 H new ATOM 0 HB THR A 21 5.159 16.633 6.158 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.562 17.199 8.346 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.141 18.960 5.342 1.00 0.00 H new ATOM 0 HG22 THR A 21 3.704 18.062 4.797 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.572 19.223 6.139 1.00 0.00 H new ATOM 290 N VAL A 22 2.913 14.933 5.446 1.00 0.00 N ATOM 291 CA VAL A 22 2.241 14.251 4.335 1.00 0.00 C ATOM 292 C VAL A 22 0.794 13.944 4.725 1.00 0.00 C ATOM 293 O VAL A 22 -0.128 13.988 3.903 1.00 0.00 O ATOM 294 CB VAL A 22 2.964 12.935 3.933 1.00 0.00 C ATOM 295 CG1 VAL A 22 2.230 12.250 2.788 1.00 0.00 C ATOM 296 CG2 VAL A 22 4.409 13.212 3.537 1.00 0.00 C ATOM 0 H VAL A 22 3.733 14.443 5.803 1.00 0.00 H new ATOM 0 HA VAL A 22 2.267 14.917 3.473 1.00 0.00 H new ATOM 0 HB VAL A 22 2.963 12.271 4.797 1.00 0.00 H new ATOM 0 HG11 VAL A 22 2.751 11.331 2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.212 12.013 3.098 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.201 12.915 1.925 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.896 12.277 3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.429 13.897 2.689 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.937 13.660 4.378 1.00 0.00 H new ATOM 306 N LEU A 23 0.609 13.650 6.001 1.00 0.00 N ATOM 307 CA LEU A 23 -0.700 13.352 6.555 1.00 0.00 C ATOM 308 C LEU A 23 -1.537 14.629 6.680 1.00 0.00 C ATOM 309 O LEU A 23 -2.726 14.633 6.364 1.00 0.00 O ATOM 310 CB LEU A 23 -0.517 12.697 7.925 1.00 0.00 C ATOM 311 CG LEU A 23 -1.788 12.216 8.618 1.00 0.00 C ATOM 312 CD1 LEU A 23 -2.476 11.120 7.820 1.00 0.00 C ATOM 313 CD2 LEU A 23 -1.452 11.721 10.007 1.00 0.00 C ATOM 0 H LEU A 23 1.366 13.611 6.684 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.230 12.670 5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.154 11.845 7.811 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.018 13.410 8.581 1.00 0.00 H new ATOM 0 HG LEU A 23 -2.479 13.056 8.688 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.378 10.801 8.343 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.743 11.501 6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.801 10.271 7.710 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.361 11.378 10.501 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.743 10.896 9.938 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.009 12.532 10.585 1.00 0.00 H new ATOM 325 N GLU A 24 -0.896 15.697 7.148 1.00 0.00 N ATOM 326 CA GLU A 24 -1.545 16.993 7.340 1.00 0.00 C ATOM 327 C GLU A 24 -2.020 17.602 6.012 1.00 0.00 C ATOM 328 O GLU A 24 -3.164 18.045 5.903 1.00 0.00 O ATOM 329 CB GLU A 24 -0.563 17.944 8.029 1.00 0.00 C ATOM 330 CG GLU A 24 -1.185 19.242 8.506 1.00 0.00 C ATOM 331 CD GLU A 24 -0.171 20.172 9.140 1.00 0.00 C ATOM 332 OE1 GLU A 24 0.532 19.746 10.083 1.00 0.00 O ATOM 333 OE2 GLU A 24 -0.081 21.337 8.707 1.00 0.00 O ATOM 0 H GLU A 24 0.091 15.689 7.406 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.428 16.844 7.961 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -0.118 17.433 8.882 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.247 18.175 7.337 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -1.658 19.746 7.663 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -1.971 19.021 9.228 1.00 0.00 H new ATOM 340 N ALA A 25 -1.131 17.634 5.015 1.00 0.00 N ATOM 341 CA ALA A 25 -1.447 18.203 3.697 1.00 0.00 C ATOM 342 C ALA A 25 -2.626 17.490 3.034 1.00 0.00 C ATOM 343 O ALA A 25 -3.437 18.109 2.347 1.00 0.00 O ATOM 344 CB ALA A 25 -0.221 18.143 2.794 1.00 0.00 C ATOM 0 H ALA A 25 -0.181 17.271 5.094 1.00 0.00 H new ATOM 0 HA ALA A 25 -1.736 19.243 3.848 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -0.465 18.567 1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.591 18.714 3.245 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.090 17.105 2.671 1.00 0.00 H new ATOM 350 N LEU A 26 -2.711 16.183 3.256 1.00 0.00 N ATOM 351 CA LEU A 26 -3.784 15.359 2.701 1.00 0.00 C ATOM 352 C LEU A 26 -5.039 15.467 3.578 1.00 0.00 C ATOM 353 O LEU A 26 -5.643 14.457 3.949 1.00 0.00 O ATOM 354 CB LEU A 26 -3.312 13.900 2.625 1.00 0.00 C ATOM 355 CG LEU A 26 -3.685 13.112 1.359 1.00 0.00 C ATOM 356 CD1 LEU A 26 -5.188 13.038 1.175 1.00 0.00 C ATOM 357 CD2 LEU A 26 -3.020 13.718 0.136 1.00 0.00 C ATOM 0 H LEU A 26 -2.041 15.664 3.824 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.032 15.711 1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.226 13.889 2.723 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -3.715 13.368 3.487 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.318 12.093 1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.417 12.474 0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.636 12.541 2.035 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.594 14.046 1.086 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.297 13.146 -0.750 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.348 14.751 0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.937 13.693 0.261 1.00 0.00 H new ATOM 369 N GLY A 27 -5.409 16.693 3.915 1.00 0.00 N ATOM 370 CA GLY A 27 -6.564 16.927 4.747 1.00 0.00 C ATOM 371 C GLY A 27 -7.850 16.876 3.960 1.00 0.00 C ATOM 372 O GLY A 27 -8.115 17.731 3.111 1.00 0.00 O ATOM 0 H GLY A 27 -4.920 17.539 3.621 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.596 16.181 5.541 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -6.472 17.901 5.228 1.00 0.00 H new ATOM 376 N ASN A 28 -8.643 15.865 4.246 1.00 0.00 N ATOM 377 CA ASN A 28 -9.924 15.665 3.572 1.00 0.00 C ATOM 378 C ASN A 28 -10.791 14.676 4.349 1.00 0.00 C ATOM 379 O ASN A 28 -11.982 14.896 4.549 1.00 0.00 O ATOM 380 CB ASN A 28 -9.693 15.159 2.144 1.00 0.00 C ATOM 381 CG ASN A 28 -10.961 15.143 1.316 1.00 0.00 C ATOM 382 OD1 ASN A 28 -11.617 16.167 1.140 1.00 0.00 O ATOM 383 ND2 ASN A 28 -11.312 13.981 0.793 1.00 0.00 N ATOM 0 H ASN A 28 -8.426 15.157 4.948 1.00 0.00 H new ATOM 0 HA ASN A 28 -10.447 16.621 3.529 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -8.952 15.791 1.654 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -9.277 14.152 2.183 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -12.154 13.913 0.221 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -10.741 13.153 0.962 1.00 0.00 H new ATOM 390 N VAL A 29 -10.179 13.590 4.793 1.00 0.00 N ATOM 391 CA VAL A 29 -10.890 12.570 5.559 1.00 0.00 C ATOM 392 C VAL A 29 -10.451 12.596 7.024 1.00 0.00 C ATOM 393 O VAL A 29 -9.344 13.029 7.339 1.00 0.00 O ATOM 394 CB VAL A 29 -10.659 11.153 4.983 1.00 0.00 C ATOM 395 CG1 VAL A 29 -11.623 10.150 5.598 1.00 0.00 C ATOM 396 CG2 VAL A 29 -10.780 11.162 3.466 1.00 0.00 C ATOM 0 H VAL A 29 -9.191 13.389 4.638 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.953 12.801 5.489 1.00 0.00 H new ATOM 0 HB VAL A 29 -9.646 10.845 5.242 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.439 9.162 5.176 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.474 10.117 6.677 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -12.648 10.451 5.383 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -10.614 10.156 3.082 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -11.777 11.499 3.183 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -10.036 11.838 3.046 1.00 0.00 H new ATOM 406 N LYS A 30 -11.331 12.132 7.907 1.00 0.00 N ATOM 407 CA LYS A 30 -11.061 12.088 9.347 1.00 0.00 C ATOM 408 C LYS A 30 -9.885 11.159 9.668 1.00 0.00 C ATOM 409 O LYS A 30 -9.165 11.370 10.643 1.00 0.00 O ATOM 410 CB LYS A 30 -12.309 11.626 10.110 1.00 0.00 C ATOM 411 CG LYS A 30 -13.451 12.637 10.111 1.00 0.00 C ATOM 412 CD LYS A 30 -14.706 12.065 10.763 1.00 0.00 C ATOM 413 CE LYS A 30 -15.267 10.902 9.957 1.00 0.00 C ATOM 414 NZ LYS A 30 -16.497 10.325 10.568 1.00 0.00 N ATOM 0 H LYS A 30 -12.251 11.776 7.648 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.796 13.097 9.664 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -12.665 10.693 9.672 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.031 11.408 11.141 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -13.141 13.536 10.643 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.676 12.934 9.087 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -14.473 11.731 11.774 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.461 12.846 10.852 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -15.492 11.240 8.946 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.508 10.124 9.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.839 9.537 9.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -16.279 9.977 11.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -17.232 11.058 10.626 1.00 0.00 H new ATOM 428 N ARG A 31 -9.686 10.137 8.842 1.00 0.00 N ATOM 429 CA ARG A 31 -8.593 9.188 9.038 1.00 0.00 C ATOM 430 C ARG A 31 -7.886 8.924 7.712 1.00 0.00 C ATOM 431 O ARG A 31 -8.519 8.936 6.658 1.00 0.00 O ATOM 432 CB ARG A 31 -9.113 7.875 9.648 1.00 0.00 C ATOM 433 CG ARG A 31 -10.170 7.170 8.818 1.00 0.00 C ATOM 434 CD ARG A 31 -10.820 6.045 9.592 1.00 0.00 C ATOM 435 NE ARG A 31 -11.637 5.198 8.723 1.00 0.00 N ATOM 436 CZ ARG A 31 -12.716 5.606 8.069 1.00 0.00 C ATOM 437 NH1 ARG A 31 -13.193 6.826 8.256 1.00 0.00 N ATOM 438 NH2 ARG A 31 -13.347 4.772 7.259 1.00 0.00 N ATOM 0 H ARG A 31 -10.269 9.943 8.028 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.877 9.621 9.736 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -8.271 7.198 9.792 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -9.525 8.086 10.635 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -10.930 7.887 8.509 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.717 6.774 7.909 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.051 5.440 10.072 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.441 6.460 10.386 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.357 4.224 8.612 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.730 7.460 8.907 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.023 7.132 7.749 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -13.003 3.819 7.139 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -14.177 5.082 6.754 1.00 0.00 H new ATOM 452 N LYS A 32 -6.578 8.701 7.769 1.00 0.00 N ATOM 453 CA LYS A 32 -5.787 8.445 6.571 1.00 0.00 C ATOM 454 C LYS A 32 -4.541 7.658 6.929 1.00 0.00 C ATOM 455 O LYS A 32 -3.992 7.808 8.025 1.00 0.00 O ATOM 456 CB LYS A 32 -5.367 9.754 5.887 1.00 0.00 C ATOM 457 CG LYS A 32 -4.943 9.566 4.436 1.00 0.00 C ATOM 458 CD LYS A 32 -4.086 10.715 3.916 1.00 0.00 C ATOM 459 CE LYS A 32 -2.667 10.658 4.466 1.00 0.00 C ATOM 460 NZ LYS A 32 -1.737 11.554 3.720 1.00 0.00 N ATOM 0 H LYS A 32 -6.041 8.692 8.636 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.409 7.872 5.883 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.197 10.460 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.543 10.199 6.444 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.387 8.633 4.343 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.832 9.471 3.812 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.055 10.681 2.827 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -4.545 11.664 4.192 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.676 10.941 5.519 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.300 9.633 4.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.766 11.190 3.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.014 11.586 2.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.781 12.512 4.122 1.00 0.00 H new ATOM 474 N ILE A 33 -4.094 6.824 6.011 1.00 0.00 N ATOM 475 CA ILE A 33 -2.909 6.029 6.239 1.00 0.00 C ATOM 476 C ILE A 33 -1.760 6.505 5.355 1.00 0.00 C ATOM 477 O ILE A 33 -1.916 6.682 4.150 1.00 0.00 O ATOM 478 CB ILE A 33 -3.195 4.519 6.047 1.00 0.00 C ATOM 479 CG1 ILE A 33 -1.929 3.682 6.269 1.00 0.00 C ATOM 480 CG2 ILE A 33 -3.810 4.239 4.681 1.00 0.00 C ATOM 481 CD1 ILE A 33 -1.318 3.136 5.000 1.00 0.00 C ATOM 0 H ILE A 33 -4.534 6.681 5.102 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.606 6.165 7.277 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.924 4.224 6.802 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -1.187 4.294 6.782 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.168 2.850 6.931 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -3.998 3.170 4.579 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.750 4.784 4.586 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -3.123 4.563 3.899 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.428 2.557 5.245 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.041 2.495 4.495 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.044 3.962 4.343 1.00 0.00 H new ATOM 493 N ALA A 34 -0.613 6.731 5.980 1.00 0.00 N ATOM 494 CA ALA A 34 0.577 7.198 5.276 1.00 0.00 C ATOM 495 C ALA A 34 1.677 6.140 5.319 1.00 0.00 C ATOM 496 O ALA A 34 2.045 5.649 6.388 1.00 0.00 O ATOM 497 CB ALA A 34 1.074 8.509 5.870 1.00 0.00 C ATOM 0 H ALA A 34 -0.479 6.598 6.982 1.00 0.00 H new ATOM 0 HA ALA A 34 0.309 7.374 4.234 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.962 8.839 5.331 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.294 9.266 5.784 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.322 8.361 6.921 1.00 0.00 H new ATOM 503 N VAL A 35 2.192 5.788 4.153 1.00 0.00 N ATOM 504 CA VAL A 35 3.249 4.784 4.051 1.00 0.00 C ATOM 505 C VAL A 35 4.622 5.441 3.880 1.00 0.00 C ATOM 506 O VAL A 35 4.738 6.481 3.234 1.00 0.00 O ATOM 507 CB VAL A 35 2.991 3.821 2.868 1.00 0.00 C ATOM 508 CG1 VAL A 35 4.063 2.741 2.789 1.00 0.00 C ATOM 509 CG2 VAL A 35 1.613 3.192 2.986 1.00 0.00 C ATOM 0 H VAL A 35 1.897 6.181 3.259 1.00 0.00 H new ATOM 0 HA VAL A 35 3.242 4.215 4.981 1.00 0.00 H new ATOM 0 HB VAL A 35 3.034 4.403 1.948 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.853 2.081 1.948 1.00 0.00 H new ATOM 0 HG12 VAL A 35 5.039 3.206 2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.065 2.162 3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.448 2.517 2.146 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.547 2.632 3.919 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.854 3.974 2.978 1.00 0.00 H new ATOM 519 N GLY A 36 5.650 4.820 4.453 1.00 0.00 N ATOM 520 CA GLY A 36 7.006 5.336 4.352 1.00 0.00 C ATOM 521 C GLY A 36 8.039 4.257 4.637 1.00 0.00 C ATOM 522 O GLY A 36 8.497 4.104 5.768 1.00 0.00 O ATOM 0 H GLY A 36 5.566 3.958 4.992 1.00 0.00 H new ATOM 0 HA2 GLY A 36 7.168 5.741 3.353 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.136 6.159 5.055 1.00 0.00 H new ATOM 526 N VAL A 37 8.383 3.491 3.605 1.00 0.00 N ATOM 527 CA VAL A 37 9.353 2.400 3.731 1.00 0.00 C ATOM 528 C VAL A 37 10.657 2.750 3.049 1.00 0.00 C ATOM 529 O VAL A 37 10.716 2.940 1.832 1.00 0.00 O ATOM 530 CB VAL A 37 8.807 1.080 3.136 1.00 0.00 C ATOM 531 CG1 VAL A 37 9.777 -0.072 3.377 1.00 0.00 C ATOM 532 CG2 VAL A 37 7.431 0.758 3.706 1.00 0.00 C ATOM 0 H VAL A 37 8.003 3.605 2.665 1.00 0.00 H new ATOM 0 HA VAL A 37 9.530 2.258 4.797 1.00 0.00 H new ATOM 0 HB VAL A 37 8.706 1.214 2.059 1.00 0.00 H new ATOM 0 HG11 VAL A 37 9.368 -0.987 2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.734 0.153 2.906 1.00 0.00 H new ATOM 0 HG13 VAL A 37 9.923 -0.207 4.449 1.00 0.00 H new ATOM 0 HG21 VAL A 37 7.067 -0.174 3.274 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.501 0.653 4.789 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.739 1.565 3.464 1.00 0.00 H new ATOM 542 N ASP A 38 11.701 2.826 3.850 1.00 0.00 N ATOM 543 CA ASP A 38 13.027 3.144 3.358 1.00 0.00 C ATOM 544 C ASP A 38 13.697 1.883 2.832 1.00 0.00 C ATOM 545 O ASP A 38 14.334 1.144 3.587 1.00 0.00 O ATOM 546 CB ASP A 38 13.896 3.742 4.459 1.00 0.00 C ATOM 547 CG ASP A 38 13.222 4.835 5.253 1.00 0.00 C ATOM 548 OD1 ASP A 38 12.667 5.761 4.639 1.00 0.00 O ATOM 549 OD2 ASP A 38 13.271 4.768 6.501 1.00 0.00 O ATOM 0 H ASP A 38 11.655 2.670 4.857 1.00 0.00 H new ATOM 0 HA ASP A 38 12.920 3.877 2.558 1.00 0.00 H new ATOM 0 HB2 ASP A 38 14.198 2.947 5.140 1.00 0.00 H new ATOM 0 HB3 ASP A 38 14.806 4.141 4.012 1.00 0.00 H new ATOM 554 N ASN A 39 13.540 1.628 1.546 1.00 0.00 N ATOM 555 CA ASN A 39 14.128 0.441 0.930 1.00 0.00 C ATOM 556 C ASN A 39 15.639 0.606 0.741 1.00 0.00 C ATOM 557 O ASN A 39 16.091 1.243 -0.209 1.00 0.00 O ATOM 558 CB ASN A 39 13.467 0.132 -0.419 1.00 0.00 C ATOM 559 CG ASN A 39 13.803 -1.267 -0.932 1.00 0.00 C ATOM 560 OD1 ASN A 39 14.658 -1.970 -0.377 1.00 0.00 O ATOM 561 ND2 ASN A 39 13.125 -1.697 -1.986 1.00 0.00 N ATOM 0 H ASN A 39 13.013 2.221 0.905 1.00 0.00 H new ATOM 0 HA ASN A 39 13.950 -0.395 1.606 1.00 0.00 H new ATOM 0 HB2 ASN A 39 12.386 0.229 -0.320 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.787 0.871 -1.154 1.00 0.00 H new ATOM 0 HD21 ASN A 39 13.302 -2.629 -2.360 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.426 -1.096 -2.423 1.00 0.00 H new ATOM 568 N GLU A 40 16.413 0.009 1.642 1.00 0.00 N ATOM 569 CA GLU A 40 17.869 0.064 1.570 1.00 0.00 C ATOM 570 C GLU A 40 18.419 -1.357 1.664 1.00 0.00 C ATOM 571 O GLU A 40 19.431 -1.623 2.311 1.00 0.00 O ATOM 572 CB GLU A 40 18.427 0.932 2.703 1.00 0.00 C ATOM 573 CG GLU A 40 19.780 1.550 2.391 1.00 0.00 C ATOM 574 CD GLU A 40 20.239 2.526 3.454 1.00 0.00 C ATOM 575 OE1 GLU A 40 20.426 2.107 4.612 1.00 0.00 O ATOM 576 OE2 GLU A 40 20.401 3.718 3.131 1.00 0.00 O ATOM 0 H GLU A 40 16.053 -0.522 2.435 1.00 0.00 H new ATOM 0 HA GLU A 40 18.174 0.511 0.624 1.00 0.00 H new ATOM 0 HB2 GLU A 40 17.716 1.728 2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 40 18.514 0.325 3.604 1.00 0.00 H new ATOM 0 HG2 GLU A 40 20.521 0.757 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 40 19.727 2.064 1.431 1.00 0.00 H new ATOM 583 N SER A 41 17.716 -2.273 1.016 1.00 0.00 N ATOM 584 CA SER A 41 18.089 -3.677 1.015 1.00 0.00 C ATOM 585 C SER A 41 18.904 -4.038 -0.220 1.00 0.00 C ATOM 586 O SER A 41 19.585 -5.060 -0.246 1.00 0.00 O ATOM 587 CB SER A 41 16.826 -4.536 1.079 1.00 0.00 C ATOM 588 OG SER A 41 17.119 -5.920 1.096 1.00 0.00 O ATOM 0 H SER A 41 16.875 -2.064 0.479 1.00 0.00 H new ATOM 0 HA SER A 41 18.712 -3.868 1.889 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.257 -4.276 1.972 1.00 0.00 H new ATOM 0 HB3 SER A 41 16.192 -4.311 0.221 1.00 0.00 H new ATOM 0 HG SER A 41 16.844 -6.323 0.246 1.00 0.00 H new ATOM 594 N GLY A 42 18.798 -3.212 -1.252 1.00 0.00 N ATOM 595 CA GLY A 42 19.500 -3.485 -2.489 1.00 0.00 C ATOM 596 C GLY A 42 18.716 -4.452 -3.354 1.00 0.00 C ATOM 597 O GLY A 42 19.286 -5.317 -4.013 1.00 0.00 O ATOM 0 H GLY A 42 18.239 -2.359 -1.254 1.00 0.00 H new ATOM 0 HA2 GLY A 42 19.663 -2.554 -3.033 1.00 0.00 H new ATOM 0 HA3 GLY A 42 20.483 -3.902 -2.270 1.00 0.00 H new ATOM 601 N LYS A 43 17.396 -4.298 -3.341 1.00 0.00 N ATOM 602 CA LYS A 43 16.517 -5.162 -4.119 1.00 0.00 C ATOM 603 C LYS A 43 15.610 -4.337 -5.031 1.00 0.00 C ATOM 604 O LYS A 43 14.921 -3.426 -4.574 1.00 0.00 O ATOM 605 CB LYS A 43 15.687 -6.053 -3.178 1.00 0.00 C ATOM 606 CG LYS A 43 14.847 -5.302 -2.146 1.00 0.00 C ATOM 607 CD LYS A 43 14.134 -6.272 -1.209 1.00 0.00 C ATOM 608 CE LYS A 43 13.130 -5.571 -0.303 1.00 0.00 C ATOM 609 NZ LYS A 43 13.749 -4.495 0.515 1.00 0.00 N ATOM 0 H LYS A 43 16.912 -3.582 -2.800 1.00 0.00 H new ATOM 0 HA LYS A 43 17.130 -5.802 -4.753 1.00 0.00 H new ATOM 0 HB2 LYS A 43 15.024 -6.673 -3.781 1.00 0.00 H new ATOM 0 HB3 LYS A 43 16.363 -6.727 -2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 43 15.487 -4.636 -1.567 1.00 0.00 H new ATOM 0 HG3 LYS A 43 14.113 -4.677 -2.655 1.00 0.00 H new ATOM 0 HD2 LYS A 43 13.619 -7.031 -1.799 1.00 0.00 H new ATOM 0 HD3 LYS A 43 14.872 -6.790 -0.597 1.00 0.00 H new ATOM 0 HE2 LYS A 43 12.332 -5.145 -0.912 1.00 0.00 H new ATOM 0 HE3 LYS A 43 12.669 -6.305 0.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 13.011 -4.007 1.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 14.445 -4.911 1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 14.225 -3.814 -0.110 1.00 0.00 H new ATOM 623 N THR A 44 15.622 -4.654 -6.322 1.00 0.00 N ATOM 624 CA THR A 44 14.805 -3.943 -7.301 1.00 0.00 C ATOM 625 C THR A 44 13.365 -4.422 -7.279 1.00 0.00 C ATOM 626 O THR A 44 13.102 -5.605 -7.099 1.00 0.00 O ATOM 627 CB THR A 44 15.365 -4.110 -8.721 1.00 0.00 C ATOM 628 OG1 THR A 44 15.910 -5.430 -8.872 1.00 0.00 O ATOM 629 CG2 THR A 44 16.430 -3.059 -9.017 1.00 0.00 C ATOM 0 H THR A 44 16.192 -5.403 -6.717 1.00 0.00 H new ATOM 0 HA THR A 44 14.833 -2.889 -7.024 1.00 0.00 H new ATOM 0 HB THR A 44 14.552 -3.972 -9.434 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.195 -6.093 -8.769 1.00 0.00 H new ATOM 0 HG21 THR A 44 16.809 -3.201 -10.029 1.00 0.00 H new ATOM 0 HG22 THR A 44 15.994 -2.064 -8.929 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.249 -3.160 -8.305 1.00 0.00 H new ATOM 637 N TRP A 45 12.434 -3.495 -7.456 1.00 0.00 N ATOM 638 CA TRP A 45 11.015 -3.824 -7.451 1.00 0.00 C ATOM 639 C TRP A 45 10.368 -3.442 -8.771 1.00 0.00 C ATOM 640 O TRP A 45 10.683 -2.405 -9.347 1.00 0.00 O ATOM 641 CB TRP A 45 10.300 -3.110 -6.293 1.00 0.00 C ATOM 642 CG TRP A 45 10.574 -3.724 -4.957 1.00 0.00 C ATOM 643 CD1 TRP A 45 11.694 -4.394 -4.596 1.00 0.00 C ATOM 644 CD2 TRP A 45 9.722 -3.716 -3.805 1.00 0.00 C ATOM 645 NE1 TRP A 45 11.591 -4.840 -3.306 1.00 0.00 N ATOM 646 CE2 TRP A 45 10.390 -4.428 -2.790 1.00 0.00 C ATOM 647 CE3 TRP A 45 8.461 -3.184 -3.535 1.00 0.00 C ATOM 648 CZ2 TRP A 45 9.836 -4.620 -1.529 1.00 0.00 C ATOM 649 CZ3 TRP A 45 7.912 -3.372 -2.281 1.00 0.00 C ATOM 650 CH2 TRP A 45 8.601 -4.086 -1.290 1.00 0.00 C ATOM 0 H TRP A 45 12.636 -2.506 -7.605 1.00 0.00 H new ATOM 0 HA TRP A 45 10.920 -4.901 -7.315 1.00 0.00 H new ATOM 0 HB2 TRP A 45 10.609 -2.065 -6.274 1.00 0.00 H new ATOM 0 HB3 TRP A 45 9.226 -3.122 -6.477 1.00 0.00 H new ATOM 0 HD1 TRP A 45 12.549 -4.554 -5.236 1.00 0.00 H new ATOM 0 HE1 TRP A 45 12.293 -5.389 -2.810 1.00 0.00 H new ATOM 0 HE3 TRP A 45 7.923 -2.634 -4.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 10.363 -5.172 -0.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 6.937 -2.963 -2.061 1.00 0.00 H new ATOM 0 HH2 TRP A 45 8.147 -4.216 -0.319 1.00 0.00 H new ATOM 661 N THR A 46 9.463 -4.282 -9.230 1.00 0.00 N ATOM 662 CA THR A 46 8.735 -4.053 -10.466 1.00 0.00 C ATOM 663 C THR A 46 7.275 -4.427 -10.234 1.00 0.00 C ATOM 664 O THR A 46 6.938 -5.604 -10.141 1.00 0.00 O ATOM 665 CB THR A 46 9.308 -4.878 -11.640 1.00 0.00 C ATOM 666 OG1 THR A 46 10.741 -4.815 -11.639 1.00 0.00 O ATOM 667 CG2 THR A 46 8.786 -4.350 -12.967 1.00 0.00 C ATOM 0 H THR A 46 9.209 -5.148 -8.755 1.00 0.00 H new ATOM 0 HA THR A 46 8.831 -3.002 -10.739 1.00 0.00 H new ATOM 0 HB THR A 46 8.989 -5.913 -11.515 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.092 -5.343 -12.386 1.00 0.00 H new ATOM 0 HG21 THR A 46 9.200 -4.943 -13.783 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.698 -4.419 -12.984 1.00 0.00 H new ATOM 0 HG23 THR A 46 9.085 -3.309 -13.087 1.00 0.00 H new ATOM 675 N ALA A 47 6.431 -3.411 -10.088 1.00 0.00 N ATOM 676 CA ALA A 47 5.004 -3.594 -9.803 1.00 0.00 C ATOM 677 C ALA A 47 4.363 -4.690 -10.648 1.00 0.00 C ATOM 678 O ALA A 47 4.303 -4.596 -11.874 1.00 0.00 O ATOM 679 CB ALA A 47 4.265 -2.277 -9.990 1.00 0.00 C ATOM 0 H ALA A 47 6.713 -2.434 -10.163 1.00 0.00 H new ATOM 0 HA ALA A 47 4.924 -3.918 -8.765 1.00 0.00 H new ATOM 0 HB1 ALA A 47 3.206 -2.421 -9.777 1.00 0.00 H new ATOM 0 HB2 ALA A 47 4.674 -1.530 -9.309 1.00 0.00 H new ATOM 0 HB3 ALA A 47 4.385 -1.935 -11.018 1.00 0.00 H new ATOM 685 N LEU A 48 3.885 -5.728 -9.964 1.00 0.00 N ATOM 686 CA LEU A 48 3.237 -6.855 -10.617 1.00 0.00 C ATOM 687 C LEU A 48 1.720 -6.714 -10.496 1.00 0.00 C ATOM 688 O LEU A 48 0.997 -6.806 -11.489 1.00 0.00 O ATOM 689 CB LEU A 48 3.713 -8.176 -9.987 1.00 0.00 C ATOM 690 CG LEU A 48 3.601 -9.428 -10.876 1.00 0.00 C ATOM 691 CD1 LEU A 48 4.312 -10.603 -10.230 1.00 0.00 C ATOM 692 CD2 LEU A 48 2.152 -9.799 -11.158 1.00 0.00 C ATOM 0 H LEU A 48 3.937 -5.808 -8.948 1.00 0.00 H new ATOM 0 HA LEU A 48 3.505 -6.865 -11.673 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.755 -8.058 -9.689 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.139 -8.349 -9.077 1.00 0.00 H new ATOM 0 HG LEU A 48 4.078 -9.190 -11.827 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.223 -11.480 -10.872 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.366 -10.360 -10.092 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.859 -10.815 -9.262 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.120 -10.688 -11.788 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.639 -10.002 -10.218 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.658 -8.973 -11.670 1.00 0.00 H new ATOM 704 N ASN A 49 1.246 -6.481 -9.275 1.00 0.00 N ATOM 705 CA ASN A 49 -0.182 -6.319 -9.016 1.00 0.00 C ATOM 706 C ASN A 49 -0.393 -5.645 -7.666 1.00 0.00 C ATOM 707 O ASN A 49 0.376 -5.861 -6.732 1.00 0.00 O ATOM 708 CB ASN A 49 -0.915 -7.675 -9.060 1.00 0.00 C ATOM 709 CG ASN A 49 -0.476 -8.645 -7.975 1.00 0.00 C ATOM 710 OD1 ASN A 49 -0.725 -8.435 -6.791 1.00 0.00 O ATOM 711 ND2 ASN A 49 0.177 -9.724 -8.371 1.00 0.00 N ATOM 0 H ASN A 49 1.834 -6.400 -8.445 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.601 -5.688 -9.800 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -1.987 -7.501 -8.967 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.750 -8.135 -10.034 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.490 -10.411 -7.685 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.368 -9.869 -9.362 1.00 0.00 H new ATOM 718 N THR A 50 -1.418 -4.812 -7.573 1.00 0.00 N ATOM 719 CA THR A 50 -1.727 -4.093 -6.339 1.00 0.00 C ATOM 720 C THR A 50 -3.228 -3.871 -6.234 1.00 0.00 C ATOM 721 O THR A 50 -3.843 -3.362 -7.169 1.00 0.00 O ATOM 722 CB THR A 50 -1.006 -2.726 -6.277 1.00 0.00 C ATOM 723 OG1 THR A 50 -1.169 -2.017 -7.518 1.00 0.00 O ATOM 724 CG2 THR A 50 0.475 -2.905 -5.974 1.00 0.00 C ATOM 0 H THR A 50 -2.057 -4.614 -8.343 1.00 0.00 H new ATOM 0 HA THR A 50 -1.377 -4.702 -5.506 1.00 0.00 H new ATOM 0 HB THR A 50 -1.456 -2.145 -5.472 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.025 -2.265 -7.926 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.959 -1.929 -5.936 1.00 0.00 H new ATOM 0 HG22 THR A 50 0.592 -3.406 -5.013 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.936 -3.508 -6.756 1.00 0.00 H new ATOM 732 N TYR A 51 -3.820 -4.264 -5.114 1.00 0.00 N ATOM 733 CA TYR A 51 -5.256 -4.112 -4.930 1.00 0.00 C ATOM 734 C TYR A 51 -5.613 -3.742 -3.495 1.00 0.00 C ATOM 735 O TYR A 51 -4.947 -4.167 -2.548 1.00 0.00 O ATOM 736 CB TYR A 51 -5.972 -5.400 -5.335 1.00 0.00 C ATOM 737 CG TYR A 51 -6.812 -5.238 -6.583 1.00 0.00 C ATOM 738 CD1 TYR A 51 -6.218 -5.040 -7.824 1.00 0.00 C ATOM 739 CD2 TYR A 51 -8.197 -5.266 -6.517 1.00 0.00 C ATOM 740 CE1 TYR A 51 -6.981 -4.875 -8.963 1.00 0.00 C ATOM 741 CE2 TYR A 51 -8.968 -5.105 -7.654 1.00 0.00 C ATOM 742 CZ TYR A 51 -8.355 -4.910 -8.875 1.00 0.00 C ATOM 743 OH TYR A 51 -9.114 -4.745 -10.012 1.00 0.00 O ATOM 0 H TYR A 51 -3.332 -4.687 -4.325 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.586 -3.293 -5.569 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -5.233 -6.184 -5.499 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.609 -5.729 -4.514 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.141 -5.015 -7.899 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.681 -5.416 -5.563 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -6.502 -4.719 -9.919 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -10.046 -5.132 -7.587 1.00 0.00 H new ATOM 0 HH TYR A 51 -10.065 -4.797 -9.781 1.00 0.00 H new ATOM 753 N PHE A 52 -6.663 -2.944 -3.337 1.00 0.00 N ATOM 754 CA PHE A 52 -7.109 -2.523 -2.015 1.00 0.00 C ATOM 755 C PHE A 52 -8.397 -3.239 -1.633 1.00 0.00 C ATOM 756 O PHE A 52 -9.385 -3.187 -2.360 1.00 0.00 O ATOM 757 CB PHE A 52 -7.327 -1.001 -1.937 1.00 0.00 C ATOM 758 CG PHE A 52 -6.096 -0.198 -2.253 1.00 0.00 C ATOM 759 CD1 PHE A 52 -5.644 -0.069 -3.556 1.00 0.00 C ATOM 760 CD2 PHE A 52 -5.383 0.419 -1.236 1.00 0.00 C ATOM 761 CE1 PHE A 52 -4.507 0.660 -3.841 1.00 0.00 C ATOM 762 CE2 PHE A 52 -4.242 1.146 -1.515 1.00 0.00 C ATOM 763 CZ PHE A 52 -3.804 1.265 -2.820 1.00 0.00 C ATOM 0 H PHE A 52 -7.221 -2.576 -4.108 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.319 -2.789 -1.313 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -8.121 -0.720 -2.629 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -7.671 -0.743 -0.936 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -6.188 -0.545 -4.359 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.723 0.330 -0.215 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.168 0.757 -4.862 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.693 1.620 -0.715 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.911 1.832 -3.041 1.00 0.00 H new ATOM 773 N ARG A 53 -8.382 -3.887 -0.475 1.00 0.00 N ATOM 774 CA ARG A 53 -9.549 -4.595 0.028 1.00 0.00 C ATOM 775 C ARG A 53 -10.630 -3.607 0.460 1.00 0.00 C ATOM 776 O ARG A 53 -11.822 -3.916 0.438 1.00 0.00 O ATOM 777 CB ARG A 53 -9.162 -5.497 1.203 1.00 0.00 C ATOM 778 CG ARG A 53 -8.269 -6.663 0.808 1.00 0.00 C ATOM 779 CD ARG A 53 -8.184 -7.705 1.914 1.00 0.00 C ATOM 780 NE ARG A 53 -7.275 -7.320 2.995 1.00 0.00 N ATOM 781 CZ ARG A 53 -7.104 -8.034 4.107 1.00 0.00 C ATOM 782 NH1 ARG A 53 -7.848 -9.105 4.333 1.00 0.00 N ATOM 783 NH2 ARG A 53 -6.205 -7.658 5.002 1.00 0.00 N ATOM 0 H ARG A 53 -7.567 -3.936 0.136 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.945 -5.216 -0.776 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.651 -4.898 1.957 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.069 -5.886 1.666 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.655 -7.126 -0.100 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.269 -6.294 0.577 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.179 -7.871 2.326 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.853 -8.652 1.488 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.742 -6.456 2.891 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.556 -9.387 3.655 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.714 -9.649 5.186 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.643 -6.822 4.841 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -6.074 -8.204 5.853 1.00 0.00 H new ATOM 797 N SER A 54 -10.198 -2.414 0.854 1.00 0.00 N ATOM 798 CA SER A 54 -11.105 -1.362 1.292 1.00 0.00 C ATOM 799 C SER A 54 -10.444 -0.010 1.081 1.00 0.00 C ATOM 800 O SER A 54 -9.273 0.164 1.403 1.00 0.00 O ATOM 801 CB SER A 54 -11.454 -1.528 2.777 1.00 0.00 C ATOM 802 OG SER A 54 -11.890 -2.848 3.061 1.00 0.00 O ATOM 0 H SER A 54 -9.213 -2.151 0.878 1.00 0.00 H new ATOM 0 HA SER A 54 -12.023 -1.427 0.708 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.581 -1.292 3.386 1.00 0.00 H new ATOM 0 HB3 SER A 54 -12.235 -0.818 3.051 1.00 0.00 H new ATOM 0 HG SER A 54 -12.104 -2.924 4.014 1.00 0.00 H new ATOM 808 N GLY A 55 -11.179 0.936 0.537 1.00 0.00 N ATOM 809 CA GLY A 55 -10.624 2.244 0.303 1.00 0.00 C ATOM 810 C GLY A 55 -9.740 2.283 -0.919 1.00 0.00 C ATOM 811 O GLY A 55 -9.826 1.424 -1.796 1.00 0.00 O ATOM 0 H GLY A 55 -12.152 0.823 0.252 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.434 2.964 0.185 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.048 2.553 1.175 1.00 0.00 H new ATOM 815 N THR A 56 -8.882 3.277 -0.963 1.00 0.00 N ATOM 816 CA THR A 56 -7.958 3.449 -2.069 1.00 0.00 C ATOM 817 C THR A 56 -6.944 4.527 -1.761 1.00 0.00 C ATOM 818 O THR A 56 -7.219 5.474 -1.027 1.00 0.00 O ATOM 819 CB THR A 56 -8.675 3.787 -3.392 1.00 0.00 C ATOM 820 OG1 THR A 56 -7.721 4.138 -4.409 1.00 0.00 O ATOM 821 CG2 THR A 56 -9.682 4.920 -3.209 1.00 0.00 C ATOM 0 H THR A 56 -8.802 3.989 -0.237 1.00 0.00 H new ATOM 0 HA THR A 56 -7.452 2.492 -2.196 1.00 0.00 H new ATOM 0 HB THR A 56 -9.219 2.896 -3.706 1.00 0.00 H new ATOM 0 HG1 THR A 56 -8.193 4.348 -5.242 1.00 0.00 H new ATOM 0 HG21 THR A 56 -10.168 5.132 -4.161 1.00 0.00 H new ATOM 0 HG22 THR A 56 -10.433 4.625 -2.476 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.165 5.813 -2.859 1.00 0.00 H new ATOM 829 N SER A 57 -5.777 4.378 -2.342 1.00 0.00 N ATOM 830 CA SER A 57 -4.709 5.339 -2.156 1.00 0.00 C ATOM 831 C SER A 57 -4.729 6.358 -3.296 1.00 0.00 C ATOM 832 O SER A 57 -4.843 7.561 -3.062 1.00 0.00 O ATOM 833 CB SER A 57 -3.359 4.617 -2.078 1.00 0.00 C ATOM 834 OG SER A 57 -2.349 5.469 -1.575 1.00 0.00 O ATOM 0 H SER A 57 -5.539 3.596 -2.952 1.00 0.00 H new ATOM 0 HA SER A 57 -4.858 5.873 -1.217 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.450 3.740 -1.438 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.077 4.261 -3.069 1.00 0.00 H new ATOM 0 HG SER A 57 -2.739 6.338 -1.346 1.00 0.00 H new ATOM 840 N ASP A 58 -4.635 5.860 -4.528 1.00 0.00 N ATOM 841 CA ASP A 58 -4.654 6.706 -5.720 1.00 0.00 C ATOM 842 C ASP A 58 -4.647 5.821 -6.973 1.00 0.00 C ATOM 843 O ASP A 58 -4.003 6.142 -7.959 1.00 0.00 O ATOM 844 CB ASP A 58 -3.445 7.661 -5.706 1.00 0.00 C ATOM 845 CG ASP A 58 -3.455 8.673 -6.833 1.00 0.00 C ATOM 846 OD1 ASP A 58 -4.501 9.318 -7.051 1.00 0.00 O ATOM 847 OD2 ASP A 58 -2.404 8.845 -7.480 1.00 0.00 O ATOM 0 H ASP A 58 -4.544 4.864 -4.727 1.00 0.00 H new ATOM 0 HA ASP A 58 -5.560 7.311 -5.729 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -3.423 8.191 -4.754 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.529 7.074 -5.765 1.00 0.00 H new ATOM 852 N ILE A 59 -5.395 4.699 -6.878 1.00 0.00 N ATOM 853 CA ILE A 59 -5.567 3.658 -7.935 1.00 0.00 C ATOM 854 C ILE A 59 -4.239 3.091 -8.493 1.00 0.00 C ATOM 855 O ILE A 59 -4.037 1.878 -8.490 1.00 0.00 O ATOM 856 CB ILE A 59 -6.519 4.088 -9.098 1.00 0.00 C ATOM 857 CG1 ILE A 59 -6.816 2.905 -10.034 1.00 0.00 C ATOM 858 CG2 ILE A 59 -5.955 5.245 -9.917 1.00 0.00 C ATOM 859 CD1 ILE A 59 -7.591 1.770 -9.392 1.00 0.00 C ATOM 0 H ILE A 59 -5.920 4.478 -6.032 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.057 2.843 -7.402 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.442 4.424 -8.626 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.378 3.271 -10.893 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.872 2.514 -10.414 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.655 5.504 -10.711 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.804 6.109 -9.270 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -5.002 4.950 -10.356 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.755 0.981 -10.126 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -7.023 1.372 -8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -8.553 2.141 -9.038 1.00 0.00 H new ATOM 871 N VAL A 60 -3.343 3.954 -8.945 1.00 0.00 N ATOM 872 CA VAL A 60 -2.051 3.540 -9.473 1.00 0.00 C ATOM 873 C VAL A 60 -0.950 3.905 -8.472 1.00 0.00 C ATOM 874 O VAL A 60 -1.168 4.723 -7.580 1.00 0.00 O ATOM 875 CB VAL A 60 -1.781 4.181 -10.859 1.00 0.00 C ATOM 876 CG1 VAL A 60 -1.678 5.695 -10.762 1.00 0.00 C ATOM 877 CG2 VAL A 60 -0.540 3.587 -11.510 1.00 0.00 C ATOM 0 H VAL A 60 -3.491 4.963 -8.956 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.057 2.459 -9.614 1.00 0.00 H new ATOM 0 HB VAL A 60 -2.634 3.950 -11.497 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.488 6.111 -11.752 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.612 6.099 -10.371 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.860 5.962 -10.093 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -0.378 4.057 -12.480 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.326 3.764 -10.872 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.678 2.514 -11.645 1.00 0.00 H new ATOM 887 N LEU A 61 0.211 3.277 -8.594 1.00 0.00 N ATOM 888 CA LEU A 61 1.316 3.521 -7.676 1.00 0.00 C ATOM 889 C LEU A 61 2.667 3.258 -8.350 1.00 0.00 C ATOM 890 O LEU A 61 2.716 2.650 -9.420 1.00 0.00 O ATOM 891 CB LEU A 61 1.151 2.650 -6.414 1.00 0.00 C ATOM 892 CG LEU A 61 0.554 1.250 -6.620 1.00 0.00 C ATOM 893 CD1 LEU A 61 1.521 0.335 -7.357 1.00 0.00 C ATOM 894 CD2 LEU A 61 0.174 0.650 -5.275 1.00 0.00 C ATOM 0 H LEU A 61 0.413 2.592 -9.322 1.00 0.00 H new ATOM 0 HA LEU A 61 1.297 4.571 -7.384 1.00 0.00 H new ATOM 0 HB2 LEU A 61 2.129 2.538 -5.947 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.520 3.189 -5.708 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.340 1.347 -7.236 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.066 -0.647 -7.486 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.750 0.759 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.440 0.236 -6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.249 -0.343 -5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.061 0.575 -4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.563 1.288 -4.787 1.00 0.00 H new ATOM 906 N PRO A 62 3.775 3.728 -7.728 1.00 0.00 N ATOM 907 CA PRO A 62 5.140 3.558 -8.250 1.00 0.00 C ATOM 908 C PRO A 62 5.396 2.153 -8.806 1.00 0.00 C ATOM 909 O PRO A 62 4.974 1.154 -8.225 1.00 0.00 O ATOM 910 CB PRO A 62 6.004 3.812 -7.019 1.00 0.00 C ATOM 911 CG PRO A 62 5.230 4.806 -6.228 1.00 0.00 C ATOM 912 CD PRO A 62 3.778 4.481 -6.456 1.00 0.00 C ATOM 0 HA PRO A 62 5.344 4.224 -9.088 1.00 0.00 H new ATOM 0 HB2 PRO A 62 6.170 2.895 -6.453 1.00 0.00 H new ATOM 0 HB3 PRO A 62 6.985 4.199 -7.294 1.00 0.00 H new ATOM 0 HG2 PRO A 62 5.482 4.743 -5.169 1.00 0.00 H new ATOM 0 HG3 PRO A 62 5.457 5.822 -6.550 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.369 3.886 -5.639 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.173 5.385 -6.526 1.00 0.00 H new ATOM 920 N HIS A 63 6.052 2.094 -9.960 1.00 0.00 N ATOM 921 CA HIS A 63 6.322 0.826 -10.630 1.00 0.00 C ATOM 922 C HIS A 63 7.630 0.165 -10.166 1.00 0.00 C ATOM 923 O HIS A 63 7.805 -1.038 -10.350 1.00 0.00 O ATOM 924 CB HIS A 63 6.339 1.048 -12.147 1.00 0.00 C ATOM 925 CG HIS A 63 5.988 -0.167 -12.957 1.00 0.00 C ATOM 926 ND1 HIS A 63 6.756 -1.311 -12.980 1.00 0.00 N ATOM 927 CD2 HIS A 63 4.937 -0.410 -13.778 1.00 0.00 C ATOM 928 CE1 HIS A 63 6.196 -2.199 -13.780 1.00 0.00 C ATOM 929 NE2 HIS A 63 5.094 -1.677 -14.273 1.00 0.00 N ATOM 0 H HIS A 63 6.408 2.913 -10.453 1.00 0.00 H new ATOM 0 HA HIS A 63 5.522 0.136 -10.360 1.00 0.00 H new ATOM 0 HB2 HIS A 63 5.640 1.847 -12.393 1.00 0.00 H new ATOM 0 HB3 HIS A 63 7.331 1.391 -12.440 1.00 0.00 H new ATOM 0 HD1 HIS A 63 7.622 -1.450 -12.460 1.00 0.00 H new ATOM 0 HD2 HIS A 63 4.127 0.269 -14.000 1.00 0.00 H new ATOM 0 HE1 HIS A 63 6.578 -3.186 -13.994 1.00 0.00 H new ATOM 938 N LYS A 64 8.553 0.931 -9.588 1.00 0.00 N ATOM 939 CA LYS A 64 9.830 0.359 -9.143 1.00 0.00 C ATOM 940 C LYS A 64 10.311 0.958 -7.824 1.00 0.00 C ATOM 941 O LYS A 64 10.066 2.130 -7.537 1.00 0.00 O ATOM 942 CB LYS A 64 10.902 0.548 -10.221 1.00 0.00 C ATOM 943 CG LYS A 64 11.140 1.995 -10.619 1.00 0.00 C ATOM 944 CD LYS A 64 12.296 2.105 -11.598 1.00 0.00 C ATOM 945 CE LYS A 64 12.524 3.537 -12.048 1.00 0.00 C ATOM 946 NZ LYS A 64 11.375 4.062 -12.832 1.00 0.00 N ATOM 0 H LYS A 64 8.448 1.931 -9.417 1.00 0.00 H new ATOM 0 HA LYS A 64 9.659 -0.704 -8.975 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.840 0.123 -9.863 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.613 -0.018 -11.107 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.236 2.406 -11.070 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.352 2.590 -9.731 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.204 1.722 -11.132 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.096 1.479 -12.468 1.00 0.00 H new ATOM 0 HE2 LYS A 64 12.688 4.170 -11.176 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.429 3.588 -12.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.646 4.955 -13.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.105 3.369 -13.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 10.569 4.230 -12.197 1.00 0.00 H new ATOM 960 N VAL A 65 10.999 0.137 -7.020 1.00 0.00 N ATOM 961 CA VAL A 65 11.522 0.575 -5.727 1.00 0.00 C ATOM 962 C VAL A 65 12.978 0.134 -5.557 1.00 0.00 C ATOM 963 O VAL A 65 13.263 -0.870 -4.902 1.00 0.00 O ATOM 964 CB VAL A 65 10.694 0.014 -4.554 1.00 0.00 C ATOM 965 CG1 VAL A 65 11.137 0.655 -3.248 1.00 0.00 C ATOM 966 CG2 VAL A 65 9.209 0.230 -4.789 1.00 0.00 C ATOM 0 H VAL A 65 11.205 -0.836 -7.246 1.00 0.00 H new ATOM 0 HA VAL A 65 11.458 1.663 -5.713 1.00 0.00 H new ATOM 0 HB VAL A 65 10.867 -1.060 -4.488 1.00 0.00 H new ATOM 0 HG11 VAL A 65 10.546 0.252 -2.426 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.192 0.440 -3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 65 10.992 1.734 -3.304 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.645 -0.174 -3.948 1.00 0.00 H new ATOM 0 HG22 VAL A 65 9.007 1.297 -4.882 1.00 0.00 H new ATOM 0 HG23 VAL A 65 8.908 -0.278 -5.705 1.00 0.00 H new ATOM 976 N PRO A 66 13.918 0.866 -6.165 1.00 0.00 N ATOM 977 CA PRO A 66 15.348 0.552 -6.093 1.00 0.00 C ATOM 978 C PRO A 66 15.961 0.897 -4.733 1.00 0.00 C ATOM 979 O PRO A 66 15.396 1.677 -3.965 1.00 0.00 O ATOM 980 CB PRO A 66 15.972 1.426 -7.191 1.00 0.00 C ATOM 981 CG PRO A 66 14.824 2.003 -7.950 1.00 0.00 C ATOM 982 CD PRO A 66 13.678 2.053 -6.982 1.00 0.00 C ATOM 0 HA PRO A 66 15.527 -0.515 -6.224 1.00 0.00 H new ATOM 0 HB2 PRO A 66 16.591 2.213 -6.760 1.00 0.00 H new ATOM 0 HB3 PRO A 66 16.615 0.835 -7.843 1.00 0.00 H new ATOM 0 HG2 PRO A 66 15.063 2.998 -8.324 1.00 0.00 H new ATOM 0 HG3 PRO A 66 14.578 1.387 -8.815 1.00 0.00 H new ATOM 0 HD2 PRO A 66 13.686 2.966 -6.387 1.00 0.00 H new ATOM 0 HD3 PRO A 66 12.714 2.011 -7.489 1.00 0.00 H new ATOM 990 N HIS A 67 17.118 0.302 -4.447 1.00 0.00 N ATOM 991 CA HIS A 67 17.817 0.534 -3.179 1.00 0.00 C ATOM 992 C HIS A 67 18.120 2.019 -2.953 1.00 0.00 C ATOM 993 O HIS A 67 18.533 2.735 -3.869 1.00 0.00 O ATOM 994 CB HIS A 67 19.134 -0.261 -3.102 1.00 0.00 C ATOM 995 CG HIS A 67 20.146 0.079 -4.168 1.00 0.00 C ATOM 996 ND1 HIS A 67 20.034 -0.323 -5.481 1.00 0.00 N ATOM 997 CD2 HIS A 67 21.284 0.814 -4.105 1.00 0.00 C ATOM 998 CE1 HIS A 67 21.051 0.151 -6.176 1.00 0.00 C ATOM 999 NE2 HIS A 67 21.825 0.848 -5.369 1.00 0.00 N ATOM 0 H HIS A 67 17.594 -0.345 -5.075 1.00 0.00 H new ATOM 0 HA HIS A 67 17.141 0.188 -2.397 1.00 0.00 H new ATOM 0 HB2 HIS A 67 19.587 -0.092 -2.125 1.00 0.00 H new ATOM 0 HB3 HIS A 67 18.904 -1.324 -3.167 1.00 0.00 H new ATOM 0 HD2 HIS A 67 21.691 1.286 -3.223 1.00 0.00 H new ATOM 0 HE1 HIS A 67 21.221 -0.006 -7.231 1.00 0.00 H new ATOM 0 HE2 HIS A 67 22.682 1.332 -5.637 1.00 0.00 H new ATOM 1008 N GLY A 68 17.923 2.463 -1.718 1.00 0.00 N ATOM 1009 CA GLY A 68 18.182 3.842 -1.361 1.00 0.00 C ATOM 1010 C GLY A 68 17.039 4.762 -1.707 1.00 0.00 C ATOM 1011 O GLY A 68 17.257 5.892 -2.135 1.00 0.00 O ATOM 0 H GLY A 68 17.584 1.884 -0.950 1.00 0.00 H new ATOM 0 HA2 GLY A 68 18.381 3.904 -0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 68 19.083 4.181 -1.872 1.00 0.00 H new ATOM 1015 N LYS A 69 15.818 4.287 -1.512 1.00 0.00 N ATOM 1016 CA LYS A 69 14.637 5.093 -1.803 1.00 0.00 C ATOM 1017 C LYS A 69 13.469 4.715 -0.899 1.00 0.00 C ATOM 1018 O LYS A 69 13.165 3.537 -0.704 1.00 0.00 O ATOM 1019 CB LYS A 69 14.241 4.955 -3.274 1.00 0.00 C ATOM 1020 CG LYS A 69 15.016 5.884 -4.202 1.00 0.00 C ATOM 1021 CD LYS A 69 14.775 5.549 -5.666 1.00 0.00 C ATOM 1022 CE LYS A 69 15.633 6.410 -6.588 1.00 0.00 C ATOM 1023 NZ LYS A 69 15.301 6.191 -8.021 1.00 0.00 N ATOM 0 H LYS A 69 15.617 3.353 -1.155 1.00 0.00 H new ATOM 0 HA LYS A 69 14.889 6.135 -1.605 1.00 0.00 H new ATOM 0 HB2 LYS A 69 14.400 3.924 -3.590 1.00 0.00 H new ATOM 0 HB3 LYS A 69 13.175 5.159 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 69 14.722 6.916 -4.012 1.00 0.00 H new ATOM 0 HG3 LYS A 69 16.081 5.811 -3.983 1.00 0.00 H new ATOM 0 HD2 LYS A 69 14.997 4.496 -5.840 1.00 0.00 H new ATOM 0 HD3 LYS A 69 13.722 5.697 -5.905 1.00 0.00 H new ATOM 0 HE2 LYS A 69 15.490 7.462 -6.339 1.00 0.00 H new ATOM 0 HE3 LYS A 69 16.686 6.183 -6.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 15.906 6.795 -8.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 15.461 5.193 -8.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 14.303 6.432 -8.187 1.00 0.00 H new ATOM 1037 N ALA A 70 12.819 5.730 -0.348 1.00 0.00 N ATOM 1038 CA ALA A 70 11.682 5.525 0.538 1.00 0.00 C ATOM 1039 C ALA A 70 10.374 5.659 -0.233 1.00 0.00 C ATOM 1040 O ALA A 70 10.127 6.687 -0.866 1.00 0.00 O ATOM 1041 CB ALA A 70 11.715 6.523 1.687 1.00 0.00 C ATOM 0 H ALA A 70 13.061 6.709 -0.500 1.00 0.00 H new ATOM 0 HA ALA A 70 11.745 4.517 0.948 1.00 0.00 H new ATOM 0 HB1 ALA A 70 10.858 6.355 2.339 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.635 6.392 2.256 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.675 7.537 1.289 1.00 0.00 H new ATOM 1047 N LEU A 71 9.539 4.633 -0.173 1.00 0.00 N ATOM 1048 CA LEU A 71 8.253 4.668 -0.863 1.00 0.00 C ATOM 1049 C LEU A 71 7.171 5.231 0.055 1.00 0.00 C ATOM 1050 O LEU A 71 6.839 4.639 1.083 1.00 0.00 O ATOM 1051 CB LEU A 71 7.842 3.279 -1.385 1.00 0.00 C ATOM 1052 CG LEU A 71 7.898 2.132 -0.367 1.00 0.00 C ATOM 1053 CD1 LEU A 71 6.812 1.106 -0.656 1.00 0.00 C ATOM 1054 CD2 LEU A 71 9.264 1.461 -0.390 1.00 0.00 C ATOM 0 H LEU A 71 9.724 3.772 0.341 1.00 0.00 H new ATOM 0 HA LEU A 71 8.364 5.323 -1.727 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.825 3.345 -1.772 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.487 3.024 -2.226 1.00 0.00 H new ATOM 0 HG LEU A 71 7.730 2.552 0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.868 0.301 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.834 1.584 -0.595 1.00 0.00 H new ATOM 0 HD13 LEU A 71 6.955 0.697 -1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.284 0.651 0.339 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.455 1.059 -1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 71 10.033 2.192 -0.140 1.00 0.00 H new ATOM 1066 N LEU A 72 6.626 6.378 -0.325 1.00 0.00 N ATOM 1067 CA LEU A 72 5.580 7.026 0.457 1.00 0.00 C ATOM 1068 C LEU A 72 4.209 6.841 -0.193 1.00 0.00 C ATOM 1069 O LEU A 72 4.091 6.800 -1.418 1.00 0.00 O ATOM 1070 CB LEU A 72 5.878 8.527 0.722 1.00 0.00 C ATOM 1071 CG LEU A 72 6.451 9.395 -0.426 1.00 0.00 C ATOM 1072 CD1 LEU A 72 7.881 9.003 -0.767 1.00 0.00 C ATOM 1073 CD2 LEU A 72 5.576 9.347 -1.669 1.00 0.00 C ATOM 0 H LEU A 72 6.891 6.881 -1.172 1.00 0.00 H new ATOM 0 HA LEU A 72 5.565 6.533 1.429 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.950 8.993 1.054 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.578 8.581 1.556 1.00 0.00 H new ATOM 0 HG LEU A 72 6.457 10.423 -0.063 1.00 0.00 H new ATOM 0 HD11 LEU A 72 8.248 9.634 -1.576 1.00 0.00 H new ATOM 0 HD12 LEU A 72 8.513 9.134 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.907 7.959 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.016 9.970 -2.448 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.504 8.319 -2.024 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.580 9.718 -1.427 1.00 0.00 H new ATOM 1085 N TYR A 73 3.178 6.715 0.634 1.00 0.00 N ATOM 1086 CA TYR A 73 1.808 6.523 0.147 1.00 0.00 C ATOM 1087 C TYR A 73 0.801 7.155 1.108 1.00 0.00 C ATOM 1088 O TYR A 73 1.166 7.572 2.207 1.00 0.00 O ATOM 1089 CB TYR A 73 1.461 5.033 -0.007 1.00 0.00 C ATOM 1090 CG TYR A 73 2.243 4.281 -1.063 1.00 0.00 C ATOM 1091 CD1 TYR A 73 3.506 3.768 -0.794 1.00 0.00 C ATOM 1092 CD2 TYR A 73 1.708 4.075 -2.328 1.00 0.00 C ATOM 1093 CE1 TYR A 73 4.212 3.075 -1.754 1.00 0.00 C ATOM 1094 CE2 TYR A 73 2.412 3.381 -3.293 1.00 0.00 C ATOM 1095 CZ TYR A 73 3.662 2.883 -3.001 1.00 0.00 C ATOM 1096 OH TYR A 73 4.366 2.190 -3.960 1.00 0.00 O ATOM 0 H TYR A 73 3.261 6.742 1.650 1.00 0.00 H new ATOM 0 HA TYR A 73 1.752 7.005 -0.829 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.618 4.542 0.953 1.00 0.00 H new ATOM 0 HB3 TYR A 73 0.399 4.948 -0.239 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.942 3.915 0.183 1.00 0.00 H new ATOM 0 HD2 TYR A 73 0.727 4.463 -2.561 1.00 0.00 H new ATOM 0 HE1 TYR A 73 5.193 2.684 -1.528 1.00 0.00 H new ATOM 0 HE2 TYR A 73 1.984 3.230 -4.273 1.00 0.00 H new ATOM 0 HH TYR A 73 3.895 1.358 -4.174 1.00 0.00 H new ATOM 1106 N ASN A 74 -0.464 7.187 0.694 1.00 0.00 N ATOM 1107 CA ASN A 74 -1.552 7.733 1.509 1.00 0.00 C ATOM 1108 C ASN A 74 -2.909 7.237 0.997 1.00 0.00 C ATOM 1109 O ASN A 74 -3.302 7.515 -0.131 1.00 0.00 O ATOM 1110 CB ASN A 74 -1.501 9.273 1.571 1.00 0.00 C ATOM 1111 CG ASN A 74 -1.322 10.006 0.244 1.00 0.00 C ATOM 1112 OD1 ASN A 74 -0.936 11.170 0.244 1.00 0.00 O ATOM 1113 ND2 ASN A 74 -1.642 9.381 -0.871 1.00 0.00 N ATOM 0 H ASN A 74 -0.766 6.836 -0.215 1.00 0.00 H new ATOM 0 HA ASN A 74 -1.421 7.370 2.529 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.423 9.626 2.033 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -0.683 9.560 2.232 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -1.572 9.866 -1.766 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.960 8.412 -0.839 1.00 0.00 H new ATOM 1120 N GLY A 75 -3.602 6.468 1.822 1.00 0.00 N ATOM 1121 CA GLY A 75 -4.884 5.914 1.419 1.00 0.00 C ATOM 1122 C GLY A 75 -6.055 6.531 2.151 1.00 0.00 C ATOM 1123 O GLY A 75 -5.948 6.872 3.329 1.00 0.00 O ATOM 0 H GLY A 75 -3.303 6.216 2.764 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -5.015 6.061 0.347 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.879 4.838 1.595 1.00 0.00 H new ATOM 1127 N GLN A 76 -7.174 6.663 1.450 1.00 0.00 N ATOM 1128 CA GLN A 76 -8.388 7.232 2.019 1.00 0.00 C ATOM 1129 C GLN A 76 -9.541 6.234 1.941 1.00 0.00 C ATOM 1130 O GLN A 76 -9.385 5.135 1.408 1.00 0.00 O ATOM 1131 CB GLN A 76 -8.769 8.519 1.287 1.00 0.00 C ATOM 1132 CG GLN A 76 -7.724 9.613 1.391 1.00 0.00 C ATOM 1133 CD GLN A 76 -8.047 10.808 0.523 1.00 0.00 C ATOM 1134 OE1 GLN A 76 -8.151 10.696 -0.696 1.00 0.00 O ATOM 1135 NE2 GLN A 76 -8.213 11.962 1.142 1.00 0.00 N ATOM 0 H GLN A 76 -7.265 6.380 0.474 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.194 7.462 3.066 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -8.940 8.291 0.235 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -9.712 8.890 1.690 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -7.641 9.934 2.429 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.752 9.211 1.103 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -8.118 12.015 2.156 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.436 12.801 0.606 1.00 0.00 H new ATOM 1144 N LYS A 77 -10.694 6.633 2.477 1.00 0.00 N ATOM 1145 CA LYS A 77 -11.887 5.787 2.485 1.00 0.00 C ATOM 1146 C LYS A 77 -12.527 5.685 1.098 1.00 0.00 C ATOM 1147 O LYS A 77 -12.297 6.532 0.229 1.00 0.00 O ATOM 1148 CB LYS A 77 -12.905 6.303 3.519 1.00 0.00 C ATOM 1149 CG LYS A 77 -13.359 7.748 3.312 1.00 0.00 C ATOM 1150 CD LYS A 77 -14.553 7.852 2.372 1.00 0.00 C ATOM 1151 CE LYS A 77 -15.050 9.283 2.250 1.00 0.00 C ATOM 1152 NZ LYS A 77 -16.156 9.397 1.267 1.00 0.00 N ATOM 0 H LYS A 77 -10.827 7.545 2.915 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.575 4.782 2.770 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -13.782 5.656 3.498 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.467 6.214 4.513 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -13.619 8.186 4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -12.531 8.332 2.910 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -14.274 7.479 1.387 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -15.360 7.216 2.737 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -15.391 9.634 3.224 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -14.226 9.930 1.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -16.469 10.387 1.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -15.823 9.085 0.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -16.951 8.799 1.569 1.00 0.00 H new ATOM 1249 N THR A 84 -15.379 1.874 4.349 1.00 0.00 N ATOM 1250 CA THR A 84 -14.752 1.038 5.357 1.00 0.00 C ATOM 1251 C THR A 84 -13.498 1.722 5.906 1.00 0.00 C ATOM 1252 O THR A 84 -13.362 1.922 7.111 1.00 0.00 O ATOM 1253 CB THR A 84 -14.375 -0.336 4.770 1.00 0.00 C ATOM 1254 OG1 THR A 84 -15.466 -0.853 3.994 1.00 0.00 O ATOM 1255 CG2 THR A 84 -14.016 -1.324 5.869 1.00 0.00 C ATOM 0 HA THR A 84 -15.467 0.890 6.167 1.00 0.00 H new ATOM 0 HB THR A 84 -13.502 -0.202 4.131 1.00 0.00 H new ATOM 0 HG1 THR A 84 -15.925 -0.114 3.543 1.00 0.00 H new ATOM 0 HG21 THR A 84 -13.755 -2.284 5.424 1.00 0.00 H new ATOM 0 HG22 THR A 84 -13.167 -0.944 6.437 1.00 0.00 H new ATOM 0 HG23 THR A 84 -14.869 -1.453 6.535 1.00 0.00 H new ATOM 1263 N GLY A 85 -12.589 2.092 5.017 1.00 0.00 N ATOM 1264 CA GLY A 85 -11.369 2.750 5.436 1.00 0.00 C ATOM 1265 C GLY A 85 -10.292 2.648 4.388 1.00 0.00 C ATOM 1266 O GLY A 85 -10.484 3.092 3.263 1.00 0.00 O ATOM 0 H GLY A 85 -12.675 1.948 4.011 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -11.575 3.800 5.645 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -11.016 2.304 6.365 1.00 0.00 H new ATOM 1270 N ALA A 86 -9.168 2.055 4.748 1.00 0.00 N ATOM 1271 CA ALA A 86 -8.065 1.897 3.814 1.00 0.00 C ATOM 1272 C ALA A 86 -7.300 0.613 4.096 1.00 0.00 C ATOM 1273 O ALA A 86 -6.490 0.539 5.016 1.00 0.00 O ATOM 1274 CB ALA A 86 -7.140 3.098 3.889 1.00 0.00 C ATOM 0 H ALA A 86 -8.994 1.675 5.678 1.00 0.00 H new ATOM 0 HA ALA A 86 -8.472 1.833 2.805 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.318 2.968 3.185 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.695 4.001 3.636 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.742 3.188 4.900 1.00 0.00 H new ATOM 1280 N VAL A 87 -7.573 -0.393 3.293 1.00 0.00 N ATOM 1281 CA VAL A 87 -6.938 -1.695 3.412 1.00 0.00 C ATOM 1282 C VAL A 87 -6.457 -2.127 2.031 1.00 0.00 C ATOM 1283 O VAL A 87 -7.200 -2.007 1.064 1.00 0.00 O ATOM 1284 CB VAL A 87 -7.938 -2.746 3.951 1.00 0.00 C ATOM 1285 CG1 VAL A 87 -7.237 -4.064 4.242 1.00 0.00 C ATOM 1286 CG2 VAL A 87 -8.660 -2.230 5.191 1.00 0.00 C ATOM 0 H VAL A 87 -8.248 -0.333 2.531 1.00 0.00 H new ATOM 0 HA VAL A 87 -6.102 -1.622 4.108 1.00 0.00 H new ATOM 0 HB VAL A 87 -8.685 -2.924 3.177 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.961 -4.786 4.620 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -6.787 -4.447 3.326 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.460 -3.905 4.989 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -9.356 -2.988 5.549 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -7.931 -2.010 5.971 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -9.209 -1.322 4.941 1.00 0.00 H new ATOM 1296 N GLY A 88 -5.228 -2.614 1.919 1.00 0.00 N ATOM 1297 CA GLY A 88 -4.729 -3.017 0.617 1.00 0.00 C ATOM 1298 C GLY A 88 -3.429 -3.795 0.669 1.00 0.00 C ATOM 1299 O GLY A 88 -2.703 -3.746 1.663 1.00 0.00 O ATOM 0 H GLY A 88 -4.575 -2.736 2.693 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.485 -3.626 0.122 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -4.584 -2.128 0.004 1.00 0.00 H new ATOM 1303 N VAL A 89 -3.154 -4.506 -0.418 1.00 0.00 N ATOM 1304 CA VAL A 89 -1.942 -5.314 -0.567 1.00 0.00 C ATOM 1305 C VAL A 89 -1.174 -4.883 -1.812 1.00 0.00 C ATOM 1306 O VAL A 89 -1.766 -4.667 -2.875 1.00 0.00 O ATOM 1307 CB VAL A 89 -2.252 -6.830 -0.693 1.00 0.00 C ATOM 1308 CG1 VAL A 89 -0.974 -7.632 -0.915 1.00 0.00 C ATOM 1309 CG2 VAL A 89 -2.974 -7.337 0.541 1.00 0.00 C ATOM 0 H VAL A 89 -3.770 -4.541 -1.230 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.349 -5.153 0.334 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.901 -6.964 -1.558 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.219 -8.691 -1.000 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -0.489 -7.297 -1.832 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.299 -7.482 -0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -3.181 -8.401 0.430 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.348 -7.179 1.419 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -3.912 -6.796 0.662 1.00 0.00 H new ATOM 1319 N LEU A 90 0.140 -4.774 -1.685 1.00 0.00 N ATOM 1320 CA LEU A 90 0.988 -4.398 -2.805 1.00 0.00 C ATOM 1321 C LEU A 90 1.946 -5.539 -3.117 1.00 0.00 C ATOM 1322 O LEU A 90 2.498 -6.161 -2.205 1.00 0.00 O ATOM 1323 CB LEU A 90 1.763 -3.096 -2.528 1.00 0.00 C ATOM 1324 CG LEU A 90 2.598 -3.055 -1.240 1.00 0.00 C ATOM 1325 CD1 LEU A 90 3.749 -2.068 -1.382 1.00 0.00 C ATOM 1326 CD2 LEU A 90 1.723 -2.664 -0.056 1.00 0.00 C ATOM 0 H LEU A 90 0.643 -4.941 -0.814 1.00 0.00 H new ATOM 0 HA LEU A 90 0.351 -4.209 -3.669 1.00 0.00 H new ATOM 0 HB2 LEU A 90 2.428 -2.909 -3.371 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.048 -2.274 -2.497 1.00 0.00 H new ATOM 0 HG LEU A 90 3.008 -4.049 -1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.330 -2.052 -0.460 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.390 -2.373 -2.210 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.352 -1.072 -1.578 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.328 -2.639 0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.292 -1.679 -0.232 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.923 -3.395 0.062 1.00 0.00 H new ATOM 1338 N ALA A 91 2.121 -5.832 -4.397 1.00 0.00 N ATOM 1339 CA ALA A 91 2.988 -6.914 -4.813 1.00 0.00 C ATOM 1340 C ALA A 91 3.860 -6.494 -5.990 1.00 0.00 C ATOM 1341 O ALA A 91 3.367 -6.129 -7.061 1.00 0.00 O ATOM 1342 CB ALA A 91 2.150 -8.129 -5.168 1.00 0.00 C ATOM 0 H ALA A 91 1.671 -5.332 -5.164 1.00 0.00 H new ATOM 0 HA ALA A 91 3.652 -7.170 -3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.804 -8.943 -5.481 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.574 -8.441 -4.297 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.470 -7.877 -5.981 1.00 0.00 H new ATOM 1348 N TYR A 92 5.164 -6.545 -5.777 1.00 0.00 N ATOM 1349 CA TYR A 92 6.131 -6.169 -6.797 1.00 0.00 C ATOM 1350 C TYR A 92 7.102 -7.310 -7.072 1.00 0.00 C ATOM 1351 O TYR A 92 7.545 -7.996 -6.149 1.00 0.00 O ATOM 1352 CB TYR A 92 6.949 -4.942 -6.358 1.00 0.00 C ATOM 1353 CG TYR A 92 6.147 -3.691 -6.061 1.00 0.00 C ATOM 1354 CD1 TYR A 92 5.227 -3.652 -5.019 1.00 0.00 C ATOM 1355 CD2 TYR A 92 6.322 -2.541 -6.819 1.00 0.00 C ATOM 1356 CE1 TYR A 92 4.507 -2.506 -4.745 1.00 0.00 C ATOM 1357 CE2 TYR A 92 5.603 -1.392 -6.551 1.00 0.00 C ATOM 1358 CZ TYR A 92 4.698 -1.380 -5.514 1.00 0.00 C ATOM 1359 OH TYR A 92 3.983 -0.237 -5.246 1.00 0.00 O ATOM 0 H TYR A 92 5.582 -6.847 -4.897 1.00 0.00 H new ATOM 0 HA TYR A 92 5.566 -5.934 -7.699 1.00 0.00 H new ATOM 0 HB2 TYR A 92 7.518 -5.207 -5.467 1.00 0.00 H new ATOM 0 HB3 TYR A 92 7.672 -4.711 -7.140 1.00 0.00 H new ATOM 0 HD1 TYR A 92 5.073 -4.533 -4.414 1.00 0.00 H new ATOM 0 HD2 TYR A 92 7.033 -2.545 -7.632 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.797 -2.493 -3.931 1.00 0.00 H new ATOM 0 HE2 TYR A 92 5.750 -0.507 -7.153 1.00 0.00 H new ATOM 0 HH TYR A 92 3.230 -0.453 -4.657 1.00 0.00 H new ATOM 1369 N LEU A 93 7.466 -7.477 -8.337 1.00 0.00 N ATOM 1370 CA LEU A 93 8.425 -8.498 -8.740 1.00 0.00 C ATOM 1371 C LEU A 93 9.820 -7.993 -8.368 1.00 0.00 C ATOM 1372 O LEU A 93 10.104 -6.812 -8.523 1.00 0.00 O ATOM 1373 CB LEU A 93 8.308 -8.751 -10.252 1.00 0.00 C ATOM 1374 CG LEU A 93 8.652 -10.166 -10.735 1.00 0.00 C ATOM 1375 CD1 LEU A 93 10.120 -10.467 -10.535 1.00 0.00 C ATOM 1376 CD2 LEU A 93 7.802 -11.205 -10.023 1.00 0.00 C ATOM 0 H LEU A 93 7.108 -6.913 -9.108 1.00 0.00 H new ATOM 0 HA LEU A 93 8.231 -9.444 -8.234 1.00 0.00 H new ATOM 0 HB2 LEU A 93 7.287 -8.524 -10.558 1.00 0.00 H new ATOM 0 HB3 LEU A 93 8.960 -8.046 -10.768 1.00 0.00 H new ATOM 0 HG LEU A 93 8.434 -10.212 -11.802 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.336 -11.476 -10.886 1.00 0.00 H new ATOM 0 HD12 LEU A 93 10.718 -9.751 -11.099 1.00 0.00 H new ATOM 0 HD13 LEU A 93 10.366 -10.391 -9.476 1.00 0.00 H new ATOM 0 HD21 LEU A 93 8.065 -12.199 -10.383 1.00 0.00 H new ATOM 0 HD22 LEU A 93 7.982 -11.149 -8.949 1.00 0.00 H new ATOM 0 HD23 LEU A 93 6.748 -11.013 -10.225 1.00 0.00 H new ATOM 1388 N MET A 94 10.662 -8.861 -7.829 1.00 0.00 N ATOM 1389 CA MET A 94 11.988 -8.441 -7.391 1.00 0.00 C ATOM 1390 C MET A 94 13.056 -8.621 -8.471 1.00 0.00 C ATOM 1391 O MET A 94 13.946 -7.784 -8.616 1.00 0.00 O ATOM 1392 CB MET A 94 12.365 -9.195 -6.120 1.00 0.00 C ATOM 1393 CG MET A 94 13.628 -8.687 -5.458 1.00 0.00 C ATOM 1394 SD MET A 94 13.810 -9.333 -3.786 1.00 0.00 S ATOM 1395 CE MET A 94 12.273 -8.761 -3.065 1.00 0.00 C ATOM 0 H MET A 94 10.456 -9.850 -7.685 1.00 0.00 H new ATOM 0 HA MET A 94 11.945 -7.371 -7.185 1.00 0.00 H new ATOM 0 HB2 MET A 94 11.541 -9.125 -5.410 1.00 0.00 H new ATOM 0 HB3 MET A 94 12.491 -10.251 -6.359 1.00 0.00 H new ATOM 0 HG2 MET A 94 14.493 -8.975 -6.055 1.00 0.00 H new ATOM 0 HG3 MET A 94 13.610 -7.598 -5.427 1.00 0.00 H new ATOM 0 HE1 MET A 94 12.356 -8.768 -1.978 1.00 0.00 H new ATOM 0 HE2 MET A 94 12.066 -7.747 -3.406 1.00 0.00 H new ATOM 0 HE3 MET A 94 11.460 -9.419 -3.371 1.00 0.00 H new ATOM 1405 N SER A 95 12.982 -9.705 -9.225 1.00 0.00 N ATOM 1406 CA SER A 95 13.968 -9.939 -10.266 1.00 0.00 C ATOM 1407 C SER A 95 13.441 -10.854 -11.361 1.00 0.00 C ATOM 1408 O SER A 95 13.231 -10.422 -12.492 1.00 0.00 O ATOM 1409 CB SER A 95 15.244 -10.536 -9.659 1.00 0.00 C ATOM 1410 OG SER A 95 16.251 -10.715 -10.644 1.00 0.00 O ATOM 0 H SER A 95 12.264 -10.424 -9.139 1.00 0.00 H new ATOM 0 HA SER A 95 14.193 -8.975 -10.722 1.00 0.00 H new ATOM 0 HB2 SER A 95 15.616 -9.880 -8.872 1.00 0.00 H new ATOM 0 HB3 SER A 95 15.014 -11.494 -9.194 1.00 0.00 H new ATOM 0 HG SER A 95 17.052 -11.095 -10.227 1.00 0.00 H new ATOM 1416 N ASP A 96 13.259 -12.120 -11.029 1.00 0.00 N ATOM 1417 CA ASP A 96 12.795 -13.106 -12.009 1.00 0.00 C ATOM 1418 C ASP A 96 11.412 -13.668 -11.694 1.00 0.00 C ATOM 1419 O ASP A 96 10.618 -13.908 -12.602 1.00 0.00 O ATOM 1420 CB ASP A 96 13.796 -14.260 -12.108 1.00 0.00 C ATOM 1421 CG ASP A 96 14.973 -13.934 -13.002 1.00 0.00 C ATOM 1422 OD1 ASP A 96 14.771 -13.782 -14.222 1.00 0.00 O ATOM 1423 OD2 ASP A 96 16.110 -13.847 -12.485 1.00 0.00 O ATOM 0 H ASP A 96 13.422 -12.495 -10.095 1.00 0.00 H new ATOM 0 HA ASP A 96 12.720 -12.579 -12.960 1.00 0.00 H new ATOM 0 HB2 ASP A 96 14.160 -14.507 -11.111 1.00 0.00 H new ATOM 0 HB3 ASP A 96 13.288 -15.145 -12.491 1.00 0.00 H new ATOM 1428 N GLY A 97 11.119 -13.899 -10.422 1.00 0.00 N ATOM 1429 CA GLY A 97 9.826 -14.455 -10.082 1.00 0.00 C ATOM 1430 C GLY A 97 9.583 -14.539 -8.594 1.00 0.00 C ATOM 1431 O GLY A 97 9.074 -15.541 -8.096 1.00 0.00 O ATOM 0 H GLY A 97 11.740 -13.716 -9.634 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.045 -13.845 -10.536 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.743 -15.453 -10.513 1.00 0.00 H new ATOM 1435 N ASN A 98 9.907 -13.467 -7.896 1.00 0.00 N ATOM 1436 CA ASN A 98 9.686 -13.374 -6.461 1.00 0.00 C ATOM 1437 C ASN A 98 8.954 -12.072 -6.200 1.00 0.00 C ATOM 1438 O ASN A 98 9.215 -11.073 -6.870 1.00 0.00 O ATOM 1439 CB ASN A 98 10.996 -13.420 -5.671 1.00 0.00 C ATOM 1440 CG ASN A 98 11.756 -14.718 -5.862 1.00 0.00 C ATOM 1441 OD1 ASN A 98 11.216 -15.804 -5.669 1.00 0.00 O ATOM 1442 ND2 ASN A 98 13.020 -14.613 -6.236 1.00 0.00 N ATOM 0 H ASN A 98 10.331 -12.635 -8.306 1.00 0.00 H new ATOM 0 HA ASN A 98 9.099 -14.229 -6.128 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.628 -12.586 -5.977 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.780 -13.284 -4.611 1.00 0.00 H new ATOM 0 HD21 ASN A 98 13.582 -15.453 -6.374 1.00 0.00 H new ATOM 0 HD22 ASN A 98 13.433 -13.692 -6.386 1.00 0.00 H new ATOM 1449 N THR A 99 8.015 -12.086 -5.284 1.00 0.00 N ATOM 1450 CA THR A 99 7.222 -10.899 -5.006 1.00 0.00 C ATOM 1451 C THR A 99 7.114 -10.605 -3.515 1.00 0.00 C ATOM 1452 O THR A 99 6.653 -11.435 -2.746 1.00 0.00 O ATOM 1453 CB THR A 99 5.801 -11.084 -5.574 1.00 0.00 C ATOM 1454 OG1 THR A 99 5.872 -11.303 -6.987 1.00 0.00 O ATOM 1455 CG2 THR A 99 4.933 -9.877 -5.288 1.00 0.00 C ATOM 0 H THR A 99 7.777 -12.900 -4.717 1.00 0.00 H new ATOM 0 HA THR A 99 7.728 -10.058 -5.480 1.00 0.00 H new ATOM 0 HB THR A 99 5.350 -11.949 -5.088 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.975 -11.231 -7.375 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.937 -10.039 -5.701 1.00 0.00 H new ATOM 0 HG22 THR A 99 4.859 -9.729 -4.211 1.00 0.00 H new ATOM 0 HG23 THR A 99 5.377 -8.993 -5.746 1.00 0.00 H new ATOM 1463 N LEU A 100 7.499 -9.406 -3.115 1.00 0.00 N ATOM 1464 CA LEU A 100 7.393 -9.022 -1.717 1.00 0.00 C ATOM 1465 C LEU A 100 6.013 -8.416 -1.486 1.00 0.00 C ATOM 1466 O LEU A 100 5.708 -7.330 -1.981 1.00 0.00 O ATOM 1467 CB LEU A 100 8.500 -8.033 -1.339 1.00 0.00 C ATOM 1468 CG LEU A 100 8.947 -8.086 0.129 1.00 0.00 C ATOM 1469 CD1 LEU A 100 10.461 -7.981 0.221 1.00 0.00 C ATOM 1470 CD2 LEU A 100 8.291 -6.982 0.949 1.00 0.00 C ATOM 0 H LEU A 100 7.884 -8.688 -3.729 1.00 0.00 H new ATOM 0 HA LEU A 100 7.516 -9.899 -1.082 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.366 -8.221 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 100 8.155 -7.023 -1.561 1.00 0.00 H new ATOM 0 HG LEU A 100 8.630 -9.044 0.542 1.00 0.00 H new ATOM 0 HD11 LEU A 100 10.766 -8.020 1.267 1.00 0.00 H new ATOM 0 HD12 LEU A 100 10.917 -8.810 -0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 100 10.788 -7.038 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 100 8.628 -7.048 1.983 1.00 0.00 H new ATOM 0 HD22 LEU A 100 8.567 -6.011 0.538 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.208 -7.097 0.913 1.00 0.00 H new ATOM 1482 N ALA A 101 5.176 -9.142 -0.761 1.00 0.00 N ATOM 1483 CA ALA A 101 3.816 -8.709 -0.480 1.00 0.00 C ATOM 1484 C ALA A 101 3.733 -7.973 0.845 1.00 0.00 C ATOM 1485 O ALA A 101 4.307 -8.399 1.846 1.00 0.00 O ATOM 1486 CB ALA A 101 2.877 -9.904 -0.485 1.00 0.00 C ATOM 0 H ALA A 101 5.419 -10.044 -0.352 1.00 0.00 H new ATOM 0 HA ALA A 101 3.512 -8.015 -1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.861 -9.570 -0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 101 2.905 -10.384 -1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 101 3.191 -10.616 0.278 1.00 0.00 H new ATOM 1492 N VAL A 102 3.004 -6.873 0.836 1.00 0.00 N ATOM 1493 CA VAL A 102 2.811 -6.056 2.023 1.00 0.00 C ATOM 1494 C VAL A 102 1.331 -5.698 2.149 1.00 0.00 C ATOM 1495 O VAL A 102 0.678 -5.426 1.142 1.00 0.00 O ATOM 1496 CB VAL A 102 3.630 -4.747 1.956 1.00 0.00 C ATOM 1497 CG1 VAL A 102 3.562 -4.004 3.279 1.00 0.00 C ATOM 1498 CG2 VAL A 102 5.076 -5.008 1.553 1.00 0.00 C ATOM 0 H VAL A 102 2.528 -6.519 0.006 1.00 0.00 H new ATOM 0 HA VAL A 102 3.150 -6.631 2.884 1.00 0.00 H new ATOM 0 HB VAL A 102 3.185 -4.119 1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.145 -3.086 3.211 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.524 -3.759 3.506 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.968 -4.633 4.071 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.620 -4.064 1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.544 -5.668 2.283 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.101 -5.479 0.570 1.00 0.00 H new ATOM 1508 N LEU A 103 0.798 -5.702 3.364 1.00 0.00 N ATOM 1509 CA LEU A 103 -0.609 -5.372 3.562 1.00 0.00 C ATOM 1510 C LEU A 103 -0.787 -4.255 4.585 1.00 0.00 C ATOM 1511 O LEU A 103 -0.027 -4.161 5.549 1.00 0.00 O ATOM 1512 CB LEU A 103 -1.416 -6.614 3.974 1.00 0.00 C ATOM 1513 CG LEU A 103 -1.017 -7.285 5.294 1.00 0.00 C ATOM 1514 CD1 LEU A 103 -1.812 -6.712 6.459 1.00 0.00 C ATOM 1515 CD2 LEU A 103 -1.225 -8.786 5.203 1.00 0.00 C ATOM 0 H LEU A 103 1.310 -5.927 4.217 1.00 0.00 H new ATOM 0 HA LEU A 103 -0.993 -5.013 2.607 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.467 -6.331 4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.334 -7.353 3.177 1.00 0.00 H new ATOM 0 HG LEU A 103 0.039 -7.084 5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.510 -7.205 7.383 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.620 -5.642 6.539 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.876 -6.878 6.290 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.938 -9.251 6.146 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.275 -8.996 4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.611 -9.190 4.398 1.00 0.00 H new ATOM 1527 N PHE A 104 -1.801 -3.426 4.354 1.00 0.00 N ATOM 1528 CA PHE A 104 -2.145 -2.304 5.226 1.00 0.00 C ATOM 1529 C PHE A 104 -3.640 -2.337 5.501 1.00 0.00 C ATOM 1530 O PHE A 104 -4.405 -2.750 4.634 1.00 0.00 O ATOM 1531 CB PHE A 104 -1.788 -0.964 4.578 1.00 0.00 C ATOM 1532 CG PHE A 104 -0.321 -0.753 4.376 1.00 0.00 C ATOM 1533 CD1 PHE A 104 0.330 -1.296 3.282 1.00 0.00 C ATOM 1534 CD2 PHE A 104 0.406 -0.007 5.284 1.00 0.00 C ATOM 1535 CE1 PHE A 104 1.682 -1.096 3.097 1.00 0.00 C ATOM 1536 CE2 PHE A 104 1.757 0.195 5.107 1.00 0.00 C ATOM 1537 CZ PHE A 104 2.397 -0.351 4.010 1.00 0.00 C ATOM 0 H PHE A 104 -2.416 -3.515 3.545 1.00 0.00 H new ATOM 0 HA PHE A 104 -1.577 -2.399 6.151 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -2.290 -0.894 3.613 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -2.178 -0.157 5.199 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -0.226 -1.882 2.566 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -0.090 0.422 6.142 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.180 -1.522 2.238 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.315 0.779 5.824 1.00 0.00 H new ATOM 0 HZ PHE A 104 3.456 -0.194 3.869 1.00 0.00 H new ATOM 1547 N SER A 105 -4.056 -1.931 6.692 1.00 0.00 N ATOM 1548 CA SER A 105 -5.464 -1.953 7.039 1.00 0.00 C ATOM 1549 C SER A 105 -5.804 -0.842 8.034 1.00 0.00 C ATOM 1550 O SER A 105 -5.125 -0.672 9.044 1.00 0.00 O ATOM 1551 CB SER A 105 -5.809 -3.319 7.642 1.00 0.00 C ATOM 1552 OG SER A 105 -7.208 -3.543 7.672 1.00 0.00 O ATOM 0 H SER A 105 -3.441 -1.585 7.428 1.00 0.00 H new ATOM 0 HA SER A 105 -6.051 -1.785 6.136 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.327 -4.105 7.060 1.00 0.00 H new ATOM 0 HB3 SER A 105 -5.409 -3.381 8.654 1.00 0.00 H new ATOM 0 HG SER A 105 -7.390 -4.424 8.061 1.00 0.00 H new ATOM 1558 N VAL A 106 -6.862 -0.094 7.732 1.00 0.00 N ATOM 1559 CA VAL A 106 -7.327 1.000 8.580 1.00 0.00 C ATOM 1560 C VAL A 106 -8.848 0.938 8.717 1.00 0.00 C ATOM 1561 O VAL A 106 -9.575 1.006 7.720 1.00 0.00 O ATOM 1562 CB VAL A 106 -6.923 2.380 8.013 1.00 0.00 C ATOM 1563 CG1 VAL A 106 -7.454 3.508 8.889 1.00 0.00 C ATOM 1564 CG2 VAL A 106 -5.413 2.475 7.883 1.00 0.00 C ATOM 0 H VAL A 106 -7.422 -0.230 6.891 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.855 0.883 9.555 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.368 2.484 7.023 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -7.155 4.468 8.467 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.542 3.454 8.933 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -7.045 3.411 9.895 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -5.143 3.452 7.482 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -4.955 2.345 8.863 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -5.056 1.696 7.210 1.00 0.00 H new ATOM 1574 N PRO A 107 -9.341 0.790 9.952 1.00 0.00 N ATOM 1575 CA PRO A 107 -10.771 0.695 10.253 1.00 0.00 C ATOM 1576 C PRO A 107 -11.481 2.053 10.247 1.00 0.00 C ATOM 1577 O PRO A 107 -10.845 3.101 10.287 1.00 0.00 O ATOM 1578 CB PRO A 107 -10.808 0.089 11.668 1.00 0.00 C ATOM 1579 CG PRO A 107 -9.386 -0.196 12.038 1.00 0.00 C ATOM 1580 CD PRO A 107 -8.540 0.686 11.171 1.00 0.00 C ATOM 0 HA PRO A 107 -11.290 0.103 9.500 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -11.263 0.781 12.376 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -11.405 -0.823 11.685 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.210 0.012 13.093 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.145 -1.247 11.876 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -8.368 1.660 11.628 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -7.561 0.247 10.978 1.00 0.00 H new ATOM 1588 N TYR A 108 -12.808 2.006 10.208 1.00 0.00 N ATOM 1589 CA TYR A 108 -13.655 3.187 10.217 1.00 0.00 C ATOM 1590 C TYR A 108 -13.788 3.681 11.654 1.00 0.00 C ATOM 1591 O TYR A 108 -13.680 2.899 12.595 1.00 0.00 O ATOM 1592 CB TYR A 108 -15.028 2.811 9.617 1.00 0.00 C ATOM 1593 CG TYR A 108 -16.080 3.909 9.554 1.00 0.00 C ATOM 1594 CD1 TYR A 108 -15.847 5.112 8.900 1.00 0.00 C ATOM 1595 CD2 TYR A 108 -17.331 3.713 10.123 1.00 0.00 C ATOM 1596 CE1 TYR A 108 -16.825 6.085 8.819 1.00 0.00 C ATOM 1597 CE2 TYR A 108 -18.314 4.683 10.051 1.00 0.00 C ATOM 1598 CZ TYR A 108 -18.057 5.865 9.398 1.00 0.00 C ATOM 1599 OH TYR A 108 -19.036 6.830 9.313 1.00 0.00 O ATOM 0 H TYR A 108 -13.331 1.131 10.169 1.00 0.00 H new ATOM 0 HA TYR A 108 -13.224 3.989 9.617 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -14.865 2.440 8.605 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -15.436 1.984 10.198 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -14.883 5.290 8.446 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -17.541 2.784 10.632 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -16.625 7.013 8.305 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -19.279 4.513 10.506 1.00 0.00 H new ATOM 0 HH TYR A 108 -19.844 6.518 9.772 1.00 0.00 H new ATOM 1701 N SER A 114 -7.227 -1.144 15.751 1.00 0.00 N ATOM 1702 CA SER A 114 -5.882 -0.761 15.356 1.00 0.00 C ATOM 1703 C SER A 114 -5.619 -1.089 13.885 1.00 0.00 C ATOM 1704 O SER A 114 -6.336 -1.885 13.277 1.00 0.00 O ATOM 1705 CB SER A 114 -4.861 -1.477 16.242 1.00 0.00 C ATOM 1706 OG SER A 114 -4.954 -2.886 16.103 1.00 0.00 O ATOM 0 HA SER A 114 -5.784 0.317 15.482 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.855 -1.149 15.979 1.00 0.00 H new ATOM 0 HB3 SER A 114 -5.024 -1.201 17.284 1.00 0.00 H new ATOM 0 HG SER A 114 -4.070 -3.253 15.893 1.00 0.00 H new ATOM 1712 N ASN A 115 -4.568 -0.491 13.332 1.00 0.00 N ATOM 1713 CA ASN A 115 -4.166 -0.737 11.945 1.00 0.00 C ATOM 1714 C ASN A 115 -3.570 -2.130 11.834 1.00 0.00 C ATOM 1715 O ASN A 115 -3.318 -2.780 12.839 1.00 0.00 O ATOM 1716 CB ASN A 115 -3.138 0.307 11.480 1.00 0.00 C ATOM 1717 CG ASN A 115 -1.758 0.131 12.095 1.00 0.00 C ATOM 1718 OD1 ASN A 115 -1.079 -0.866 11.870 1.00 0.00 O ATOM 1719 ND2 ASN A 115 -1.322 1.118 12.861 1.00 0.00 N ATOM 0 H ASN A 115 -3.973 0.174 13.826 1.00 0.00 H new ATOM 0 HA ASN A 115 -5.046 -0.659 11.306 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.050 0.257 10.395 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.510 1.302 11.725 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -0.396 1.064 13.285 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -1.912 1.933 13.028 1.00 0.00 H new ATOM 1726 N TRP A 116 -3.337 -2.590 10.626 1.00 0.00 N ATOM 1727 CA TRP A 116 -2.757 -3.903 10.431 1.00 0.00 C ATOM 1728 C TRP A 116 -1.770 -3.864 9.277 1.00 0.00 C ATOM 1729 O TRP A 116 -2.080 -3.322 8.219 1.00 0.00 O ATOM 1730 CB TRP A 116 -3.854 -4.938 10.154 1.00 0.00 C ATOM 1731 CG TRP A 116 -4.758 -5.194 11.330 1.00 0.00 C ATOM 1732 CD1 TRP A 116 -4.454 -5.915 12.448 1.00 0.00 C ATOM 1733 CD2 TRP A 116 -6.113 -4.744 11.505 1.00 0.00 C ATOM 1734 NE1 TRP A 116 -5.520 -5.925 13.313 1.00 0.00 N ATOM 1735 CE2 TRP A 116 -6.552 -5.219 12.757 1.00 0.00 C ATOM 1736 CE3 TRP A 116 -6.994 -3.982 10.734 1.00 0.00 C ATOM 1737 CZ2 TRP A 116 -7.828 -4.961 13.248 1.00 0.00 C ATOM 1738 CZ3 TRP A 116 -8.263 -3.726 11.223 1.00 0.00 C ATOM 1739 CH2 TRP A 116 -8.668 -4.214 12.471 1.00 0.00 C ATOM 0 H TRP A 116 -3.538 -2.079 9.766 1.00 0.00 H new ATOM 0 HA TRP A 116 -2.231 -4.193 11.340 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -4.457 -4.599 9.311 1.00 0.00 H new ATOM 0 HB3 TRP A 116 -3.388 -5.877 9.855 1.00 0.00 H new ATOM 0 HD1 TRP A 116 -3.510 -6.407 12.627 1.00 0.00 H new ATOM 0 HE1 TRP A 116 -5.540 -6.385 14.223 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -6.690 -3.599 9.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 -8.144 -5.338 14.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -8.952 -3.140 10.632 1.00 0.00 H new ATOM 0 HH2 TRP A 116 -9.664 -3.996 12.827 1.00 0.00 H new ATOM 1750 N TRP A 117 -0.583 -4.434 9.475 1.00 0.00 N ATOM 1751 CA TRP A 117 0.419 -4.444 8.415 1.00 0.00 C ATOM 1752 C TRP A 117 1.273 -5.704 8.508 1.00 0.00 C ATOM 1753 O TRP A 117 1.607 -6.155 9.604 1.00 0.00 O ATOM 1754 CB TRP A 117 1.283 -3.170 8.451 1.00 0.00 C ATOM 1755 CG TRP A 117 2.450 -3.212 9.394 1.00 0.00 C ATOM 1756 CD1 TRP A 117 2.490 -2.725 10.667 1.00 0.00 C ATOM 1757 CD2 TRP A 117 3.759 -3.727 9.118 1.00 0.00 C ATOM 1758 NE1 TRP A 117 3.737 -2.924 11.206 1.00 0.00 N ATOM 1759 CE2 TRP A 117 4.532 -3.539 10.277 1.00 0.00 C ATOM 1760 CE3 TRP A 117 4.347 -4.338 8.009 1.00 0.00 C ATOM 1761 CZ2 TRP A 117 5.862 -3.938 10.355 1.00 0.00 C ATOM 1762 CZ3 TRP A 117 5.667 -4.733 8.089 1.00 0.00 C ATOM 1763 CH2 TRP A 117 6.413 -4.534 9.255 1.00 0.00 C ATOM 0 H TRP A 117 -0.296 -4.887 10.343 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.095 -4.453 7.454 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.656 -2.976 7.446 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.647 -2.327 8.723 1.00 0.00 H new ATOM 0 HD1 TRP A 117 1.663 -2.253 11.176 1.00 0.00 H new ATOM 0 HE1 TRP A 117 4.025 -2.657 12.147 1.00 0.00 H new ATOM 0 HE3 TRP A 117 3.779 -4.499 7.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 6.440 -3.782 11.254 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.132 -5.204 7.236 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.443 -4.857 9.287 1.00 0.00 H new ATOM 1774 N ASN A 118 1.599 -6.292 7.362 1.00 0.00 N ATOM 1775 CA ASN A 118 2.400 -7.522 7.343 1.00 0.00 C ATOM 1776 C ASN A 118 3.147 -7.689 6.022 1.00 0.00 C ATOM 1777 O ASN A 118 2.535 -7.745 4.955 1.00 0.00 O ATOM 1778 CB ASN A 118 1.508 -8.749 7.577 1.00 0.00 C ATOM 1779 CG ASN A 118 2.257 -10.068 7.426 1.00 0.00 C ATOM 1780 OD1 ASN A 118 3.221 -10.341 8.143 1.00 0.00 O ATOM 1781 ND2 ASN A 118 1.814 -10.895 6.487 1.00 0.00 N ATOM 0 H ASN A 118 1.327 -5.946 6.442 1.00 0.00 H new ATOM 0 HA ASN A 118 3.132 -7.441 8.147 1.00 0.00 H new ATOM 0 HB2 ASN A 118 1.079 -8.694 8.577 1.00 0.00 H new ATOM 0 HB3 ASN A 118 0.677 -8.727 6.872 1.00 0.00 H new ATOM 0 HD21 ASN A 118 2.275 -11.793 6.339 1.00 0.00 H new ATOM 0 HD22 ASN A 118 1.012 -10.633 5.913 1.00 0.00 H new ATOM 1788 N VAL A 119 4.466 -7.791 6.113 1.00 0.00 N ATOM 1789 CA VAL A 119 5.319 -7.991 4.941 1.00 0.00 C ATOM 1790 C VAL A 119 5.756 -9.461 4.839 1.00 0.00 C ATOM 1791 O VAL A 119 6.065 -10.090 5.858 1.00 0.00 O ATOM 1792 CB VAL A 119 6.575 -7.096 4.989 1.00 0.00 C ATOM 1793 CG1 VAL A 119 6.216 -5.633 4.798 1.00 0.00 C ATOM 1794 CG2 VAL A 119 7.317 -7.288 6.299 1.00 0.00 C ATOM 0 H VAL A 119 4.976 -7.738 6.995 1.00 0.00 H new ATOM 0 HA VAL A 119 4.730 -7.717 4.066 1.00 0.00 H new ATOM 0 HB VAL A 119 7.227 -7.395 4.168 1.00 0.00 H new ATOM 0 HG11 VAL A 119 7.122 -5.028 4.837 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.732 -5.500 3.830 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.536 -5.319 5.590 1.00 0.00 H new ATOM 0 HG21 VAL A 119 8.200 -6.649 6.314 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.663 -7.023 7.130 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.622 -8.330 6.395 1.00 0.00 H new ATOM 1804 N ARG A 120 5.798 -10.008 3.623 1.00 0.00 N ATOM 1805 CA ARG A 120 6.216 -11.400 3.421 1.00 0.00 C ATOM 1806 C ARG A 120 6.507 -11.663 1.943 1.00 0.00 C ATOM 1807 O ARG A 120 5.779 -11.199 1.071 1.00 0.00 O ATOM 1808 CB ARG A 120 5.141 -12.367 3.937 1.00 0.00 C ATOM 1809 CG ARG A 120 5.582 -13.824 3.979 1.00 0.00 C ATOM 1810 CD ARG A 120 4.591 -14.681 4.756 1.00 0.00 C ATOM 1811 NE ARG A 120 4.427 -14.209 6.136 1.00 0.00 N ATOM 1812 CZ ARG A 120 3.704 -14.832 7.064 1.00 0.00 C ATOM 1813 NH1 ARG A 120 3.096 -15.976 6.794 1.00 0.00 N ATOM 1814 NH2 ARG A 120 3.593 -14.309 8.274 1.00 0.00 N ATOM 0 H ARG A 120 5.550 -9.513 2.766 1.00 0.00 H new ATOM 0 HA ARG A 120 7.131 -11.569 3.988 1.00 0.00 H new ATOM 0 HB2 ARG A 120 4.843 -12.060 4.939 1.00 0.00 H new ATOM 0 HB3 ARG A 120 4.259 -12.284 3.303 1.00 0.00 H new ATOM 0 HG2 ARG A 120 5.678 -14.206 2.963 1.00 0.00 H new ATOM 0 HG3 ARG A 120 6.567 -13.895 4.440 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.625 -14.669 4.250 1.00 0.00 H new ATOM 0 HD3 ARG A 120 4.933 -15.716 4.764 1.00 0.00 H new ATOM 0 HE ARG A 120 4.899 -13.345 6.402 1.00 0.00 H new ATOM 0 HH11 ARG A 120 3.178 -16.391 5.866 1.00 0.00 H new ATOM 0 HH12 ARG A 120 2.545 -16.443 7.514 1.00 0.00 H new ATOM 0 HH21 ARG A 120 4.061 -13.430 8.495 1.00 0.00 H new ATOM 0 HH22 ARG A 120 3.039 -14.785 8.986 1.00 0.00 H new ATOM 1828 N ILE A 121 7.582 -12.393 1.667 1.00 0.00 N ATOM 1829 CA ILE A 121 7.967 -12.693 0.289 1.00 0.00 C ATOM 1830 C ILE A 121 7.159 -13.868 -0.277 1.00 0.00 C ATOM 1831 O ILE A 121 7.042 -14.922 0.348 1.00 0.00 O ATOM 1832 CB ILE A 121 9.480 -13.011 0.163 1.00 0.00 C ATOM 1833 CG1 ILE A 121 10.338 -11.895 0.772 1.00 0.00 C ATOM 1834 CG2 ILE A 121 9.867 -13.232 -1.295 1.00 0.00 C ATOM 1835 CD1 ILE A 121 10.615 -12.077 2.249 1.00 0.00 C ATOM 0 H ILE A 121 8.202 -12.788 2.375 1.00 0.00 H new ATOM 0 HA ILE A 121 7.750 -11.795 -0.289 1.00 0.00 H new ATOM 0 HB ILE A 121 9.669 -13.929 0.720 1.00 0.00 H new ATOM 0 HG12 ILE A 121 11.286 -11.845 0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 121 9.836 -10.939 0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 121 10.932 -13.453 -1.359 1.00 0.00 H new ATOM 0 HG22 ILE A 121 9.297 -14.069 -1.700 1.00 0.00 H new ATOM 0 HG23 ILE A 121 9.648 -12.332 -1.870 1.00 0.00 H new ATOM 0 HD11 ILE A 121 11.227 -11.250 2.609 1.00 0.00 H new ATOM 0 HD12 ILE A 121 9.673 -12.096 2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 121 11.145 -13.016 2.407 1.00 0.00 H new ATOM 1847 N TYR A 122 6.622 -13.668 -1.469 1.00 0.00 N ATOM 1848 CA TYR A 122 5.838 -14.675 -2.169 1.00 0.00 C ATOM 1849 C TYR A 122 6.451 -14.926 -3.545 1.00 0.00 C ATOM 1850 O TYR A 122 7.448 -14.304 -3.907 1.00 0.00 O ATOM 1851 CB TYR A 122 4.385 -14.203 -2.349 1.00 0.00 C ATOM 1852 CG TYR A 122 3.532 -14.228 -1.095 1.00 0.00 C ATOM 1853 CD1 TYR A 122 3.860 -13.467 0.022 1.00 0.00 C ATOM 1854 CD2 TYR A 122 2.385 -15.009 -1.038 1.00 0.00 C ATOM 1855 CE1 TYR A 122 3.072 -13.487 1.155 1.00 0.00 C ATOM 1856 CE2 TYR A 122 1.593 -15.033 0.092 1.00 0.00 C ATOM 1857 CZ TYR A 122 1.942 -14.270 1.184 1.00 0.00 C ATOM 1858 OH TYR A 122 1.161 -14.301 2.311 1.00 0.00 O ATOM 0 H TYR A 122 6.718 -12.793 -1.984 1.00 0.00 H new ATOM 0 HA TYR A 122 5.843 -15.591 -1.579 1.00 0.00 H new ATOM 0 HB2 TYR A 122 4.397 -13.185 -2.739 1.00 0.00 H new ATOM 0 HB3 TYR A 122 3.909 -14.828 -3.104 1.00 0.00 H new ATOM 0 HD1 TYR A 122 4.746 -12.850 0.002 1.00 0.00 H new ATOM 0 HD2 TYR A 122 2.108 -15.608 -1.893 1.00 0.00 H new ATOM 0 HE1 TYR A 122 3.342 -12.891 2.014 1.00 0.00 H new ATOM 0 HE2 TYR A 122 0.705 -15.647 0.120 1.00 0.00 H new ATOM 0 HH TYR A 122 0.730 -13.429 2.435 1.00 0.00 H new ATOM 1868 N LYS A 123 5.840 -15.807 -4.318 1.00 0.00 N ATOM 1869 CA LYS A 123 6.314 -16.096 -5.664 1.00 0.00 C ATOM 1870 C LYS A 123 5.669 -15.126 -6.649 1.00 0.00 C ATOM 1871 O LYS A 123 4.556 -14.645 -6.417 1.00 0.00 O ATOM 1872 CB LYS A 123 5.999 -17.543 -6.061 1.00 0.00 C ATOM 1873 CG LYS A 123 6.883 -18.577 -5.383 1.00 0.00 C ATOM 1874 CD LYS A 123 6.513 -19.995 -5.803 1.00 0.00 C ATOM 1875 CE LYS A 123 5.250 -20.483 -5.108 1.00 0.00 C ATOM 1876 NZ LYS A 123 5.483 -20.751 -3.664 1.00 0.00 N ATOM 0 H LYS A 123 5.014 -16.336 -4.038 1.00 0.00 H new ATOM 0 HA LYS A 123 7.397 -15.972 -5.687 1.00 0.00 H new ATOM 0 HB2 LYS A 123 4.958 -17.756 -5.820 1.00 0.00 H new ATOM 0 HB3 LYS A 123 6.103 -17.643 -7.141 1.00 0.00 H new ATOM 0 HG2 LYS A 123 7.926 -18.384 -5.632 1.00 0.00 H new ATOM 0 HG3 LYS A 123 6.791 -18.482 -4.301 1.00 0.00 H new ATOM 0 HD2 LYS A 123 6.368 -20.027 -6.883 1.00 0.00 H new ATOM 0 HD3 LYS A 123 7.338 -20.669 -5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 123 4.464 -19.736 -5.217 1.00 0.00 H new ATOM 0 HE3 LYS A 123 4.896 -21.392 -5.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 4.686 -21.298 -3.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 6.363 -21.294 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 5.563 -19.849 -3.152 1.00 0.00 H new ATOM 1890 N GLY A 124 6.377 -14.837 -7.732 1.00 0.00 N ATOM 1891 CA GLY A 124 5.885 -13.921 -8.748 1.00 0.00 C ATOM 1892 C GLY A 124 4.773 -14.507 -9.597 1.00 0.00 C ATOM 1893 O GLY A 124 4.951 -14.726 -10.793 1.00 0.00 O ATOM 0 H GLY A 124 7.299 -15.227 -7.929 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.524 -13.013 -8.265 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.712 -13.630 -9.396 1.00 0.00 H new ATOM 1897 N LYS A 125 3.623 -14.764 -8.981 1.00 0.00 N ATOM 1898 CA LYS A 125 2.482 -15.324 -9.695 1.00 0.00 C ATOM 1899 C LYS A 125 1.702 -14.207 -10.410 1.00 0.00 C ATOM 1900 O LYS A 125 2.281 -13.446 -11.179 1.00 0.00 O ATOM 1901 CB LYS A 125 1.578 -16.112 -8.736 1.00 0.00 C ATOM 1902 CG LYS A 125 0.647 -17.085 -9.446 1.00 0.00 C ATOM 1903 CD LYS A 125 -0.179 -17.924 -8.476 1.00 0.00 C ATOM 1904 CE LYS A 125 -1.278 -17.120 -7.790 1.00 0.00 C ATOM 1905 NZ LYS A 125 -0.772 -16.292 -6.659 1.00 0.00 N ATOM 0 H LYS A 125 3.457 -14.593 -7.989 1.00 0.00 H new ATOM 0 HA LYS A 125 2.846 -16.019 -10.451 1.00 0.00 H new ATOM 0 HB2 LYS A 125 2.201 -16.664 -8.033 1.00 0.00 H new ATOM 0 HB3 LYS A 125 0.982 -15.411 -8.152 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.024 -16.528 -10.100 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.236 -17.746 -10.082 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.628 -18.758 -9.015 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.480 -18.351 -7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.757 -16.471 -8.523 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -2.043 -17.802 -7.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.222 -16.602 -5.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.259 -16.404 -6.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.000 -15.292 -6.832 1.00 0.00 H new ATOM 1919 N ARG A 126 0.399 -14.100 -10.157 1.00 0.00 N ATOM 1920 CA ARG A 126 -0.418 -13.061 -10.792 1.00 0.00 C ATOM 1921 C ARG A 126 -1.573 -12.635 -9.890 1.00 0.00 C ATOM 1922 O ARG A 126 -1.801 -11.450 -9.684 1.00 0.00 O ATOM 1923 CB ARG A 126 -0.980 -13.535 -12.144 1.00 0.00 C ATOM 1924 CG ARG A 126 0.039 -13.599 -13.284 1.00 0.00 C ATOM 1925 CD ARG A 126 0.623 -12.228 -13.618 1.00 0.00 C ATOM 1926 NE ARG A 126 1.496 -12.267 -14.799 1.00 0.00 N ATOM 1927 CZ ARG A 126 2.697 -12.844 -14.835 1.00 0.00 C ATOM 1928 NH1 ARG A 126 3.223 -13.368 -13.741 1.00 0.00 N ATOM 1929 NH2 ARG A 126 3.386 -12.872 -15.966 1.00 0.00 N ATOM 0 H ARG A 126 -0.113 -14.713 -9.523 1.00 0.00 H new ATOM 0 HA ARG A 126 0.237 -12.206 -10.961 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.416 -14.525 -12.011 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -1.789 -12.867 -12.438 1.00 0.00 H new ATOM 0 HG2 ARG A 126 0.846 -14.278 -13.009 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -0.438 -14.014 -14.172 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -0.189 -11.522 -13.792 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.189 -11.858 -12.763 1.00 0.00 H new ATOM 0 HE ARG A 126 1.159 -11.821 -15.652 1.00 0.00 H new ATOM 0 HH11 ARG A 126 2.709 -13.333 -12.861 1.00 0.00 H new ATOM 0 HH12 ARG A 126 4.143 -13.808 -13.777 1.00 0.00 H new ATOM 0 HH21 ARG A 126 2.998 -12.452 -16.810 1.00 0.00 H new ATOM 0 HH22 ARG A 126 4.305 -13.314 -15.993 1.00 0.00 H new ATOM 1943 N ARG A 127 -2.307 -13.611 -9.381 1.00 0.00 N ATOM 1944 CA ARG A 127 -3.462 -13.347 -8.520 1.00 0.00 C ATOM 1945 C ARG A 127 -3.049 -13.185 -7.056 1.00 0.00 C ATOM 1946 O ARG A 127 -2.423 -14.077 -6.477 1.00 0.00 O ATOM 1947 CB ARG A 127 -4.465 -14.496 -8.670 1.00 0.00 C ATOM 1948 CG ARG A 127 -5.832 -14.251 -8.044 1.00 0.00 C ATOM 1949 CD ARG A 127 -6.819 -15.308 -8.516 1.00 0.00 C ATOM 1950 NE ARG A 127 -8.188 -15.075 -8.048 1.00 0.00 N ATOM 1951 CZ ARG A 127 -8.654 -15.479 -6.873 1.00 0.00 C ATOM 1952 NH1 ARG A 127 -7.860 -16.126 -6.034 1.00 0.00 N ATOM 1953 NH2 ARG A 127 -9.914 -15.240 -6.539 1.00 0.00 N ATOM 0 H ARG A 127 -2.127 -14.601 -9.547 1.00 0.00 H new ATOM 0 HA ARG A 127 -3.922 -12.408 -8.829 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -4.601 -14.702 -9.732 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -4.035 -15.393 -8.224 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -5.753 -14.276 -6.957 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -6.192 -13.259 -8.315 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -6.815 -15.337 -9.606 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -6.486 -16.286 -8.170 1.00 0.00 H new ATOM 0 HE ARG A 127 -8.824 -14.570 -8.665 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -6.891 -16.314 -6.291 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -8.217 -16.437 -5.131 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -10.528 -14.745 -7.186 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -10.270 -15.552 -5.635 1.00 0.00 H new ATOM 1967 N ALA A 128 -3.410 -12.048 -6.468 1.00 0.00 N ATOM 1968 CA ALA A 128 -3.094 -11.750 -5.070 1.00 0.00 C ATOM 1969 C ALA A 128 -4.073 -10.734 -4.494 1.00 0.00 C ATOM 1970 O ALA A 128 -4.399 -9.741 -5.143 1.00 0.00 O ATOM 1971 CB ALA A 128 -1.679 -11.215 -4.934 1.00 0.00 C ATOM 0 H ALA A 128 -3.928 -11.308 -6.943 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.178 -12.683 -4.512 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.470 -11.002 -3.886 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.972 -11.959 -5.301 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.578 -10.300 -5.518 1.00 0.00 H new ATOM 1977 N ASP A 129 -4.518 -10.998 -3.269 1.00 0.00 N ATOM 1978 CA ASP A 129 -5.455 -10.133 -2.545 1.00 0.00 C ATOM 1979 C ASP A 129 -5.809 -10.816 -1.212 1.00 0.00 C ATOM 1980 O ASP A 129 -4.980 -11.539 -0.664 1.00 0.00 O ATOM 1981 CB ASP A 129 -6.718 -9.878 -3.389 1.00 0.00 C ATOM 1982 CG ASP A 129 -7.628 -8.817 -2.796 1.00 0.00 C ATOM 1983 OD1 ASP A 129 -7.207 -7.657 -2.670 1.00 0.00 O ATOM 1984 OD2 ASP A 129 -8.766 -9.163 -2.430 1.00 0.00 O ATOM 0 H ASP A 129 -4.238 -11.826 -2.743 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.996 -9.164 -2.349 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.421 -9.574 -4.393 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.274 -10.810 -3.490 1.00 0.00 H new ATOM 1989 N GLN A 130 -7.030 -10.630 -0.705 1.00 0.00 N ATOM 1990 CA GLN A 130 -7.448 -11.267 0.547 1.00 0.00 C ATOM 1991 C GLN A 130 -7.426 -12.792 0.418 1.00 0.00 C ATOM 1992 O GLN A 130 -7.019 -13.496 1.340 1.00 0.00 O ATOM 1993 CB GLN A 130 -8.863 -10.813 0.938 1.00 0.00 C ATOM 1994 CG GLN A 130 -9.876 -11.001 -0.181 1.00 0.00 C ATOM 1995 CD GLN A 130 -11.292 -10.579 0.172 1.00 0.00 C ATOM 1996 OE1 GLN A 130 -12.180 -10.604 -0.683 1.00 0.00 O ATOM 1997 NE2 GLN A 130 -11.529 -10.208 1.420 1.00 0.00 N ATOM 0 H GLN A 130 -7.744 -10.046 -1.140 1.00 0.00 H new ATOM 0 HA GLN A 130 -6.744 -10.965 1.322 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -9.189 -11.373 1.814 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -8.836 -9.761 1.223 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -9.547 -10.432 -1.051 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -9.886 -12.051 -0.472 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -10.771 -10.199 2.102 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -12.470 -9.931 1.700 1.00 0.00 H new ATOM 2006 N ARG A 131 -7.875 -13.288 -0.735 1.00 0.00 N ATOM 2007 CA ARG A 131 -7.936 -14.727 -0.998 1.00 0.00 C ATOM 2008 C ARG A 131 -6.558 -15.393 -0.945 1.00 0.00 C ATOM 2009 O ARG A 131 -6.464 -16.602 -0.778 1.00 0.00 O ATOM 2010 CB ARG A 131 -8.599 -15.015 -2.358 1.00 0.00 C ATOM 2011 CG ARG A 131 -10.113 -14.795 -2.396 1.00 0.00 C ATOM 2012 CD ARG A 131 -10.483 -13.327 -2.559 1.00 0.00 C ATOM 2013 NE ARG A 131 -9.916 -12.750 -3.782 1.00 0.00 N ATOM 2014 CZ ARG A 131 -10.178 -11.515 -4.222 1.00 0.00 C ATOM 2015 NH1 ARG A 131 -11.018 -10.733 -3.567 1.00 0.00 N ATOM 2016 NH2 ARG A 131 -9.591 -11.066 -5.322 1.00 0.00 N ATOM 0 H ARG A 131 -8.204 -12.710 -1.508 1.00 0.00 H new ATOM 0 HA ARG A 131 -8.544 -15.157 -0.202 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -8.135 -14.381 -3.113 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -8.389 -16.048 -2.637 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -10.540 -15.368 -3.219 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -10.556 -15.179 -1.477 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -11.568 -13.227 -2.580 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -10.128 -12.766 -1.695 1.00 0.00 H new ATOM 0 HE ARG A 131 -9.281 -13.328 -4.332 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -11.472 -11.070 -2.718 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -11.212 -9.792 -3.910 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -8.940 -11.663 -5.832 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -9.790 -10.124 -5.658 1.00 0.00 H new ATOM 2030 N MET A 132 -5.499 -14.607 -1.098 1.00 0.00 N ATOM 2031 CA MET A 132 -4.138 -15.139 -1.074 1.00 0.00 C ATOM 2032 C MET A 132 -3.680 -15.462 0.356 1.00 0.00 C ATOM 2033 O MET A 132 -2.908 -16.398 0.572 1.00 0.00 O ATOM 2034 CB MET A 132 -3.185 -14.126 -1.715 1.00 0.00 C ATOM 2035 CG MET A 132 -1.802 -14.673 -2.030 1.00 0.00 C ATOM 2036 SD MET A 132 -1.822 -15.940 -3.317 1.00 0.00 S ATOM 2037 CE MET A 132 -0.118 -16.495 -3.249 1.00 0.00 C ATOM 0 H MET A 132 -5.554 -13.598 -1.240 1.00 0.00 H new ATOM 0 HA MET A 132 -4.126 -16.070 -1.641 1.00 0.00 H new ATOM 0 HB2 MET A 132 -3.634 -13.756 -2.637 1.00 0.00 H new ATOM 0 HB3 MET A 132 -3.080 -13.271 -1.047 1.00 0.00 H new ATOM 0 HG2 MET A 132 -1.156 -13.853 -2.344 1.00 0.00 H new ATOM 0 HG3 MET A 132 -1.367 -15.091 -1.122 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.038 -17.282 -3.987 1.00 0.00 H new ATOM 0 HE2 MET A 132 0.546 -15.658 -3.465 1.00 0.00 H new ATOM 0 HE3 MET A 132 0.099 -16.882 -2.254 1.00 0.00 H new ATOM 2047 N TYR A 133 -4.141 -14.667 1.319 1.00 0.00 N ATOM 2048 CA TYR A 133 -3.762 -14.848 2.719 1.00 0.00 C ATOM 2049 C TYR A 133 -4.751 -15.741 3.466 1.00 0.00 C ATOM 2050 O TYR A 133 -4.351 -16.588 4.264 1.00 0.00 O ATOM 2051 CB TYR A 133 -3.662 -13.490 3.425 1.00 0.00 C ATOM 2052 CG TYR A 133 -2.603 -12.568 2.849 1.00 0.00 C ATOM 2053 CD1 TYR A 133 -2.788 -11.933 1.624 1.00 0.00 C ATOM 2054 CD2 TYR A 133 -1.421 -12.325 3.537 1.00 0.00 C ATOM 2055 CE1 TYR A 133 -1.825 -11.090 1.104 1.00 0.00 C ATOM 2056 CE2 TYR A 133 -0.454 -11.482 3.021 1.00 0.00 C ATOM 2057 CZ TYR A 133 -0.661 -10.870 1.806 1.00 0.00 C ATOM 2058 OH TYR A 133 0.299 -10.033 1.292 1.00 0.00 O ATOM 0 H TYR A 133 -4.780 -13.889 1.155 1.00 0.00 H new ATOM 0 HA TYR A 133 -2.789 -15.339 2.729 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -4.630 -12.992 3.371 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.448 -13.656 4.481 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -3.700 -12.102 1.071 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -1.254 -12.803 4.491 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -1.984 -10.606 0.152 1.00 0.00 H new ATOM 0 HE2 TYR A 133 0.460 -11.305 3.569 1.00 0.00 H new ATOM 0 HH TYR A 133 1.057 -9.985 1.911 1.00 0.00 H new ATOM 2173 N LEU A 140 -1.740 -15.070 6.715 1.00 0.00 N ATOM 2174 CA LEU A 140 -2.359 -13.951 7.399 1.00 0.00 C ATOM 2175 C LEU A 140 -1.820 -13.834 8.823 1.00 0.00 C ATOM 2176 O LEU A 140 -1.923 -14.765 9.623 1.00 0.00 O ATOM 2177 CB LEU A 140 -3.887 -14.130 7.387 1.00 0.00 C ATOM 2178 CG LEU A 140 -4.723 -12.863 7.609 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -4.802 -12.517 9.087 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -4.148 -11.697 6.813 1.00 0.00 C ATOM 0 HA LEU A 140 -2.115 -13.023 6.881 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.173 -14.565 6.429 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -4.152 -14.854 8.157 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.735 -13.057 7.254 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -5.400 -11.615 9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -5.265 -13.341 9.629 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -3.798 -12.346 9.475 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -4.754 -10.807 6.983 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -3.124 -11.506 7.135 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -4.154 -11.943 5.751 1.00 0.00 H new ATOM 2192 N SER A 141 -1.231 -12.676 9.112 1.00 0.00 N ATOM 2193 CA SER A 141 -0.648 -12.387 10.419 1.00 0.00 C ATOM 2194 C SER A 141 -0.183 -10.924 10.484 1.00 0.00 C ATOM 2195 O SER A 141 1.017 -10.646 10.488 1.00 0.00 O ATOM 2196 CB SER A 141 0.541 -13.320 10.697 1.00 0.00 C ATOM 2197 OG SER A 141 0.967 -13.225 12.048 1.00 0.00 O ATOM 0 H SER A 141 -1.145 -11.910 8.444 1.00 0.00 H new ATOM 0 HA SER A 141 -1.413 -12.553 11.178 1.00 0.00 H new ATOM 0 HB2 SER A 141 0.258 -14.349 10.474 1.00 0.00 H new ATOM 0 HB3 SER A 141 1.368 -13.066 10.034 1.00 0.00 H new ATOM 0 HG SER A 141 1.723 -13.830 12.196 1.00 0.00 H new ATOM 2203 N PRO A 142 -1.121 -9.966 10.521 1.00 0.00 N ATOM 2204 CA PRO A 142 -0.796 -8.536 10.579 1.00 0.00 C ATOM 2205 C PRO A 142 -0.202 -8.134 11.932 1.00 0.00 C ATOM 2206 O PRO A 142 -0.466 -8.770 12.952 1.00 0.00 O ATOM 2207 CB PRO A 142 -2.146 -7.841 10.350 1.00 0.00 C ATOM 2208 CG PRO A 142 -3.078 -8.913 9.895 1.00 0.00 C ATOM 2209 CD PRO A 142 -2.568 -10.183 10.510 1.00 0.00 C ATOM 0 HA PRO A 142 -0.041 -8.261 9.843 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -2.506 -7.372 11.266 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -2.059 -7.053 9.601 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -4.099 -8.706 10.215 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -3.093 -8.983 8.807 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -2.964 -10.336 11.514 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -2.843 -11.059 9.922 1.00 0.00 H new ATOM 2217 N PHE A 143 0.624 -7.089 11.929 1.00 0.00 N ATOM 2218 CA PHE A 143 1.283 -6.617 13.147 1.00 0.00 C ATOM 2219 C PHE A 143 0.301 -5.992 14.141 1.00 0.00 C ATOM 2220 O PHE A 143 0.578 -5.943 15.336 1.00 0.00 O ATOM 2221 CB PHE A 143 2.393 -5.613 12.802 1.00 0.00 C ATOM 2222 CG PHE A 143 3.153 -5.104 14.002 1.00 0.00 C ATOM 2223 CD1 PHE A 143 3.709 -5.988 14.917 1.00 0.00 C ATOM 2224 CD2 PHE A 143 3.301 -3.741 14.223 1.00 0.00 C ATOM 2225 CE1 PHE A 143 4.393 -5.522 16.026 1.00 0.00 C ATOM 2226 CE2 PHE A 143 3.987 -3.272 15.330 1.00 0.00 C ATOM 2227 CZ PHE A 143 4.532 -4.163 16.232 1.00 0.00 C ATOM 0 H PHE A 143 0.854 -6.551 11.094 1.00 0.00 H new ATOM 0 HA PHE A 143 1.720 -7.492 13.629 1.00 0.00 H new ATOM 0 HB2 PHE A 143 3.094 -6.084 12.113 1.00 0.00 H new ATOM 0 HB3 PHE A 143 1.952 -4.765 12.277 1.00 0.00 H new ATOM 0 HD1 PHE A 143 3.606 -7.052 14.761 1.00 0.00 H new ATOM 0 HD2 PHE A 143 2.875 -3.038 13.522 1.00 0.00 H new ATOM 0 HE1 PHE A 143 4.818 -6.221 16.731 1.00 0.00 H new ATOM 0 HE2 PHE A 143 4.096 -2.209 15.488 1.00 0.00 H new ATOM 0 HZ PHE A 143 5.066 -3.799 17.097 1.00 0.00 H new ATOM 2237 N ARG A 144 -0.824 -5.500 13.627 1.00 0.00 N ATOM 2238 CA ARG A 144 -1.857 -4.845 14.443 1.00 0.00 C ATOM 2239 C ARG A 144 -1.443 -3.421 14.801 1.00 0.00 C ATOM 2240 O ARG A 144 -2.146 -2.735 15.537 1.00 0.00 O ATOM 2241 CB ARG A 144 -2.188 -5.627 15.722 1.00 0.00 C ATOM 2242 CG ARG A 144 -2.825 -6.985 15.476 1.00 0.00 C ATOM 2243 CD ARG A 144 -3.162 -7.683 16.787 1.00 0.00 C ATOM 2244 NE ARG A 144 -3.828 -8.975 16.585 1.00 0.00 N ATOM 2245 CZ ARG A 144 -5.071 -9.126 16.132 1.00 0.00 C ATOM 2246 NH1 ARG A 144 -5.854 -8.081 15.935 1.00 0.00 N ATOM 2247 NH2 ARG A 144 -5.555 -10.337 15.920 1.00 0.00 N ATOM 0 H ARG A 144 -1.050 -5.542 12.633 1.00 0.00 H new ATOM 0 HA ARG A 144 -2.760 -4.820 13.833 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -1.272 -5.767 16.296 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -2.861 -5.029 16.336 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -3.732 -6.862 14.883 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -2.146 -7.608 14.894 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -2.246 -7.836 17.358 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -3.806 -7.036 17.383 1.00 0.00 H new ATOM 0 HE ARG A 144 -3.300 -9.819 16.808 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -5.509 -7.141 16.130 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -6.804 -8.214 15.588 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -4.976 -11.157 16.103 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -6.507 -10.452 15.573 1.00 0.00 H new ATOM 2261 N GLY A 145 -0.325 -2.980 14.232 1.00 0.00 N ATOM 2262 CA GLY A 145 0.163 -1.620 14.450 1.00 0.00 C ATOM 2263 C GLY A 145 0.591 -1.313 15.883 1.00 0.00 C ATOM 2264 O GLY A 145 -0.023 -1.769 16.847 1.00 0.00 O ATOM 0 H GLY A 145 0.261 -3.544 13.616 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.010 -1.443 13.787 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.619 -0.918 14.162 1.00 0.00 H new ATOM 2268 N ASP A 146 1.635 -0.506 16.021 1.00 0.00 N ATOM 2269 CA ASP A 146 2.126 -0.106 17.329 1.00 0.00 C ATOM 2270 C ASP A 146 3.189 0.979 17.183 1.00 0.00 C ATOM 2271 O ASP A 146 4.149 0.821 16.427 1.00 0.00 O ATOM 2272 CB ASP A 146 2.692 -1.296 18.107 1.00 0.00 C ATOM 2273 CG ASP A 146 3.174 -0.886 19.481 1.00 0.00 C ATOM 2274 OD1 ASP A 146 2.348 -0.406 20.282 1.00 0.00 O ATOM 2275 OD2 ASP A 146 4.380 -1.025 19.757 1.00 0.00 O ATOM 0 H ASP A 146 2.159 -0.115 15.238 1.00 0.00 H new ATOM 0 HA ASP A 146 1.282 0.290 17.894 1.00 0.00 H new ATOM 0 HB2 ASP A 146 1.926 -2.065 18.204 1.00 0.00 H new ATOM 0 HB3 ASP A 146 3.517 -1.737 17.548 1.00 0.00 H new ATOM 2280 N ASN A 147 2.985 2.097 17.875 1.00 0.00 N ATOM 2281 CA ASN A 147 3.895 3.248 17.815 1.00 0.00 C ATOM 2282 C ASN A 147 5.273 2.920 18.415 1.00 0.00 C ATOM 2283 O ASN A 147 6.125 3.801 18.528 1.00 0.00 O ATOM 2284 CB ASN A 147 3.324 4.451 18.593 1.00 0.00 C ATOM 2285 CG ASN A 147 1.806 4.623 18.534 1.00 0.00 C ATOM 2286 OD1 ASN A 147 1.248 5.440 19.266 1.00 0.00 O ATOM 2287 ND2 ASN A 147 1.120 3.886 17.674 1.00 0.00 N ATOM 0 H ASN A 147 2.186 2.235 18.494 1.00 0.00 H new ATOM 0 HA ASN A 147 4.001 3.493 16.758 1.00 0.00 H new ATOM 0 HB2 ASN A 147 3.619 4.357 19.638 1.00 0.00 H new ATOM 0 HB3 ASN A 147 3.789 5.360 18.211 1.00 0.00 H new ATOM 0 HD21 ASN A 147 0.107 3.989 17.608 1.00 0.00 H new ATOM 0 HD22 ASN A 147 1.604 3.215 17.077 1.00 0.00 H new ATOM 2294 N GLY A 148 5.462 1.670 18.817 1.00 0.00 N ATOM 2295 CA GLY A 148 6.709 1.235 19.430 1.00 0.00 C ATOM 2296 C GLY A 148 7.904 1.223 18.488 1.00 0.00 C ATOM 2297 O GLY A 148 8.265 2.243 17.905 1.00 0.00 O ATOM 0 H GLY A 148 4.761 0.935 18.728 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.933 1.890 20.272 1.00 0.00 H new ATOM 0 HA3 GLY A 148 6.570 0.232 19.834 1.00 0.00 H new ATOM 2301 N TRP A 149 8.533 0.060 18.371 1.00 0.00 N ATOM 2302 CA TRP A 149 9.711 -0.116 17.527 1.00 0.00 C ATOM 2303 C TRP A 149 10.049 -1.597 17.439 1.00 0.00 C ATOM 2304 O TRP A 149 10.101 -2.278 18.459 1.00 0.00 O ATOM 2305 CB TRP A 149 10.905 0.642 18.119 1.00 0.00 C ATOM 2306 CG TRP A 149 12.179 0.498 17.335 1.00 0.00 C ATOM 2307 CD1 TRP A 149 13.232 -0.318 17.634 1.00 0.00 C ATOM 2308 CD2 TRP A 149 12.546 1.206 16.144 1.00 0.00 C ATOM 2309 NE1 TRP A 149 14.223 -0.173 16.694 1.00 0.00 N ATOM 2310 CE2 TRP A 149 13.828 0.759 15.771 1.00 0.00 C ATOM 2311 CE3 TRP A 149 11.917 2.172 15.352 1.00 0.00 C ATOM 2312 CZ2 TRP A 149 14.490 1.243 14.647 1.00 0.00 C ATOM 2313 CZ3 TRP A 149 12.577 2.652 14.236 1.00 0.00 C ATOM 2314 CH2 TRP A 149 13.852 2.187 13.893 1.00 0.00 C ATOM 0 H TRP A 149 8.242 -0.788 18.858 1.00 0.00 H new ATOM 0 HA TRP A 149 9.498 0.277 16.533 1.00 0.00 H new ATOM 0 HB2 TRP A 149 10.651 1.700 18.187 1.00 0.00 H new ATOM 0 HB3 TRP A 149 11.076 0.289 19.136 1.00 0.00 H new ATOM 0 HD1 TRP A 149 13.279 -0.981 18.485 1.00 0.00 H new ATOM 0 HE1 TRP A 149 15.109 -0.678 16.685 1.00 0.00 H new ATOM 0 HE3 TRP A 149 10.933 2.537 15.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 15.473 0.885 14.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 12.101 3.399 13.618 1.00 0.00 H new ATOM 0 HH2 TRP A 149 14.341 2.582 13.015 1.00 0.00 H new ATOM 2325 N HIS A 150 10.275 -2.110 16.236 1.00 0.00 N ATOM 2326 CA HIS A 150 10.604 -3.525 16.105 1.00 0.00 C ATOM 2327 C HIS A 150 11.417 -3.824 14.851 1.00 0.00 C ATOM 2328 O HIS A 150 11.405 -3.060 13.886 1.00 0.00 O ATOM 2329 CB HIS A 150 9.344 -4.408 16.137 1.00 0.00 C ATOM 2330 CG HIS A 150 8.442 -4.290 14.938 1.00 0.00 C ATOM 2331 ND1 HIS A 150 7.506 -5.246 14.617 1.00 0.00 N ATOM 2332 CD2 HIS A 150 8.331 -3.330 13.988 1.00 0.00 C ATOM 2333 CE1 HIS A 150 6.862 -4.886 13.526 1.00 0.00 C ATOM 2334 NE2 HIS A 150 7.343 -3.725 13.124 1.00 0.00 N ATOM 0 H HIS A 150 10.239 -1.587 15.361 1.00 0.00 H new ATOM 0 HA HIS A 150 11.223 -3.768 16.968 1.00 0.00 H new ATOM 0 HB2 HIS A 150 9.653 -5.449 16.237 1.00 0.00 H new ATOM 0 HB3 HIS A 150 8.769 -4.159 17.029 1.00 0.00 H new ATOM 0 HD1 HIS A 150 7.337 -6.103 15.144 1.00 0.00 H new ATOM 0 HD2 HIS A 150 8.913 -2.422 13.924 1.00 0.00 H new ATOM 0 HE1 HIS A 150 6.075 -5.446 13.043 1.00 0.00 H new ATOM 2343 N THR A 151 12.115 -4.951 14.885 1.00 0.00 N ATOM 2344 CA THR A 151 12.940 -5.396 13.770 1.00 0.00 C ATOM 2345 C THR A 151 12.502 -6.790 13.314 1.00 0.00 C ATOM 2346 O THR A 151 12.049 -7.602 14.123 1.00 0.00 O ATOM 2347 CB THR A 151 14.422 -5.457 14.175 1.00 0.00 C ATOM 2348 OG1 THR A 151 14.786 -4.264 14.881 1.00 0.00 O ATOM 2349 CG2 THR A 151 15.318 -5.629 12.957 1.00 0.00 C ATOM 0 H THR A 151 12.125 -5.582 15.686 1.00 0.00 H new ATOM 0 HA THR A 151 12.816 -4.680 12.958 1.00 0.00 H new ATOM 0 HB THR A 151 14.560 -6.321 14.825 1.00 0.00 H new ATOM 0 HG1 THR A 151 15.598 -4.429 15.404 1.00 0.00 H new ATOM 0 HG21 THR A 151 16.360 -5.669 13.275 1.00 0.00 H new ATOM 0 HG22 THR A 151 15.060 -6.555 12.443 1.00 0.00 H new ATOM 0 HG23 THR A 151 15.177 -4.787 12.280 1.00 0.00 H new ATOM 2357 N ARG A 152 12.644 -7.058 12.027 1.00 0.00 N ATOM 2358 CA ARG A 152 12.278 -8.352 11.451 1.00 0.00 C ATOM 2359 C ARG A 152 12.930 -8.521 10.081 1.00 0.00 C ATOM 2360 O ARG A 152 12.841 -7.636 9.232 1.00 0.00 O ATOM 2361 CB ARG A 152 10.751 -8.495 11.336 1.00 0.00 C ATOM 2362 CG ARG A 152 10.073 -7.357 10.591 1.00 0.00 C ATOM 2363 CD ARG A 152 8.564 -7.564 10.471 1.00 0.00 C ATOM 2364 NE ARG A 152 8.208 -8.551 9.447 1.00 0.00 N ATOM 2365 CZ ARG A 152 8.143 -9.862 9.651 1.00 0.00 C ATOM 2366 NH1 ARG A 152 8.299 -10.360 10.865 1.00 0.00 N ATOM 2367 NH2 ARG A 152 7.888 -10.675 8.637 1.00 0.00 N ATOM 0 H ARG A 152 13.014 -6.391 11.350 1.00 0.00 H new ATOM 0 HA ARG A 152 12.641 -9.135 12.116 1.00 0.00 H new ATOM 0 HB2 ARG A 152 10.522 -9.433 10.830 1.00 0.00 H new ATOM 0 HB3 ARG A 152 10.327 -8.562 12.338 1.00 0.00 H new ATOM 0 HG2 ARG A 152 10.269 -6.418 11.109 1.00 0.00 H new ATOM 0 HG3 ARG A 152 10.506 -7.268 9.595 1.00 0.00 H new ATOM 0 HD2 ARG A 152 8.168 -7.887 11.434 1.00 0.00 H new ATOM 0 HD3 ARG A 152 8.089 -6.612 10.233 1.00 0.00 H new ATOM 0 HE ARG A 152 7.995 -8.206 8.511 1.00 0.00 H new ATOM 0 HH11 ARG A 152 8.471 -9.737 11.654 1.00 0.00 H new ATOM 0 HH12 ARG A 152 8.248 -11.368 11.013 1.00 0.00 H new ATOM 0 HH21 ARG A 152 7.742 -10.294 7.702 1.00 0.00 H new ATOM 0 HH22 ARG A 152 7.838 -11.682 8.791 1.00 0.00 H new ATOM 2381 N ASN A 153 13.596 -9.649 9.869 1.00 0.00 N ATOM 2382 CA ASN A 153 14.262 -9.907 8.594 1.00 0.00 C ATOM 2383 C ASN A 153 13.255 -10.130 7.482 1.00 0.00 C ATOM 2384 O ASN A 153 12.238 -10.798 7.678 1.00 0.00 O ATOM 2385 CB ASN A 153 15.256 -11.083 8.676 1.00 0.00 C ATOM 2386 CG ASN A 153 14.784 -12.261 9.512 1.00 0.00 C ATOM 2387 OD1 ASN A 153 15.593 -13.021 10.040 1.00 0.00 O ATOM 2388 ND2 ASN A 153 13.487 -12.448 9.621 1.00 0.00 N ATOM 0 H ASN A 153 13.690 -10.396 10.557 1.00 0.00 H new ATOM 0 HA ASN A 153 14.841 -9.014 8.360 1.00 0.00 H new ATOM 0 HB2 ASN A 153 15.466 -11.434 7.666 1.00 0.00 H new ATOM 0 HB3 ASN A 153 16.196 -10.717 9.088 1.00 0.00 H new ATOM 0 HD21 ASN A 153 13.129 -13.240 10.155 1.00 0.00 H new ATOM 0 HD22 ASN A 153 12.839 -11.801 9.172 1.00 0.00 H new ATOM 2395 N LEU A 154 13.542 -9.561 6.314 1.00 0.00 N ATOM 2396 CA LEU A 154 12.652 -9.704 5.177 1.00 0.00 C ATOM 2397 C LEU A 154 13.355 -9.446 3.845 1.00 0.00 C ATOM 2398 O LEU A 154 12.936 -9.971 2.816 1.00 0.00 O ATOM 2399 CB LEU A 154 11.427 -8.782 5.306 1.00 0.00 C ATOM 2400 CG LEU A 154 11.661 -7.284 5.034 1.00 0.00 C ATOM 2401 CD1 LEU A 154 11.596 -6.967 3.544 1.00 0.00 C ATOM 2402 CD2 LEU A 154 10.633 -6.455 5.769 1.00 0.00 C ATOM 0 H LEU A 154 14.377 -9.003 6.136 1.00 0.00 H new ATOM 0 HA LEU A 154 12.320 -10.742 5.182 1.00 0.00 H new ATOM 0 HB2 LEU A 154 10.659 -9.137 4.619 1.00 0.00 H new ATOM 0 HB3 LEU A 154 11.026 -8.887 6.314 1.00 0.00 H new ATOM 0 HG LEU A 154 12.660 -7.037 5.393 1.00 0.00 H new ATOM 0 HD11 LEU A 154 11.766 -5.901 3.391 1.00 0.00 H new ATOM 0 HD12 LEU A 154 12.362 -7.536 3.017 1.00 0.00 H new ATOM 0 HD13 LEU A 154 10.613 -7.237 3.157 1.00 0.00 H new ATOM 0 HD21 LEU A 154 10.808 -5.398 5.570 1.00 0.00 H new ATOM 0 HD22 LEU A 154 9.634 -6.728 5.428 1.00 0.00 H new ATOM 0 HD23 LEU A 154 10.714 -6.640 6.840 1.00 0.00 H new ATOM 2414 N GLY A 155 14.390 -8.606 3.856 1.00 0.00 N ATOM 2415 CA GLY A 155 15.098 -8.269 2.625 1.00 0.00 C ATOM 2416 C GLY A 155 15.925 -9.413 2.067 1.00 0.00 C ATOM 2417 O GLY A 155 17.103 -9.230 1.768 1.00 0.00 O ATOM 0 H GLY A 155 14.752 -8.152 4.694 1.00 0.00 H new ATOM 0 HA2 GLY A 155 14.374 -7.955 1.873 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.752 -7.417 2.813 1.00 0.00 H new ATOM 2421 N TYR A 156 15.308 -10.593 1.946 1.00 0.00 N ATOM 2422 CA TYR A 156 15.978 -11.795 1.444 1.00 0.00 C ATOM 2423 C TYR A 156 17.264 -12.015 2.239 1.00 0.00 C ATOM 2424 O TYR A 156 18.320 -12.325 1.692 1.00 0.00 O ATOM 2425 CB TYR A 156 16.262 -11.666 -0.062 1.00 0.00 C ATOM 2426 CG TYR A 156 16.713 -12.951 -0.736 1.00 0.00 C ATOM 2427 CD1 TYR A 156 15.966 -14.120 -0.621 1.00 0.00 C ATOM 2428 CD2 TYR A 156 17.880 -12.995 -1.493 1.00 0.00 C ATOM 2429 CE1 TYR A 156 16.368 -15.292 -1.240 1.00 0.00 C ATOM 2430 CE2 TYR A 156 18.289 -14.165 -2.112 1.00 0.00 C ATOM 2431 CZ TYR A 156 17.528 -15.310 -1.983 1.00 0.00 C ATOM 2432 OH TYR A 156 17.925 -16.478 -2.605 1.00 0.00 O ATOM 0 H TYR A 156 14.330 -10.741 2.194 1.00 0.00 H new ATOM 0 HA TYR A 156 15.330 -12.661 1.576 1.00 0.00 H new ATOM 0 HB2 TYR A 156 15.360 -11.309 -0.559 1.00 0.00 H new ATOM 0 HB3 TYR A 156 17.029 -10.906 -0.209 1.00 0.00 H new ATOM 0 HD1 TYR A 156 15.057 -14.113 -0.039 1.00 0.00 H new ATOM 0 HD2 TYR A 156 18.477 -12.101 -1.600 1.00 0.00 H new ATOM 0 HE1 TYR A 156 15.774 -16.189 -1.141 1.00 0.00 H new ATOM 0 HE2 TYR A 156 19.199 -14.181 -2.693 1.00 0.00 H new ATOM 0 HH TYR A 156 18.763 -16.322 -3.089 1.00 0.00 H new ATOM 2442 N GLY A 157 17.156 -11.807 3.546 1.00 0.00 N ATOM 2443 CA GLY A 157 18.298 -11.944 4.419 1.00 0.00 C ATOM 2444 C GLY A 157 18.444 -10.734 5.315 1.00 0.00 C ATOM 2445 O GLY A 157 18.782 -10.851 6.489 1.00 0.00 O ATOM 0 H GLY A 157 16.290 -11.544 4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 157 18.189 -12.841 5.028 1.00 0.00 H new ATOM 0 HA3 GLY A 157 19.202 -12.071 3.824 1.00 0.00 H new ATOM 2449 N LEU A 158 18.173 -9.562 4.742 1.00 0.00 N ATOM 2450 CA LEU A 158 18.254 -8.294 5.464 1.00 0.00 C ATOM 2451 C LEU A 158 17.071 -8.148 6.436 1.00 0.00 C ATOM 2452 O LEU A 158 16.266 -9.065 6.553 1.00 0.00 O ATOM 2453 CB LEU A 158 18.327 -7.137 4.461 1.00 0.00 C ATOM 2454 CG LEU A 158 19.691 -6.975 3.761 1.00 0.00 C ATOM 2455 CD1 LEU A 158 19.933 -8.074 2.734 1.00 0.00 C ATOM 2456 CD2 LEU A 158 19.808 -5.608 3.111 1.00 0.00 C ATOM 0 H LEU A 158 17.892 -9.465 3.766 1.00 0.00 H new ATOM 0 HA LEU A 158 19.162 -8.273 6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 158 17.559 -7.284 3.701 1.00 0.00 H new ATOM 0 HB3 LEU A 158 18.088 -6.209 4.980 1.00 0.00 H new ATOM 0 HG LEU A 158 20.460 -7.063 4.529 1.00 0.00 H new ATOM 0 HD11 LEU A 158 20.904 -7.924 2.263 1.00 0.00 H new ATOM 0 HD12 LEU A 158 19.916 -9.045 3.229 1.00 0.00 H new ATOM 0 HD13 LEU A 158 19.152 -8.040 1.974 1.00 0.00 H new ATOM 0 HD21 LEU A 158 20.779 -5.519 2.624 1.00 0.00 H new ATOM 0 HD22 LEU A 158 19.018 -5.489 2.370 1.00 0.00 H new ATOM 0 HD23 LEU A 158 19.711 -4.834 3.872 1.00 0.00 H new ATOM 2468 N LYS A 159 16.944 -7.014 7.134 1.00 0.00 N ATOM 2469 CA LYS A 159 15.842 -6.843 8.092 1.00 0.00 C ATOM 2470 C LYS A 159 15.253 -5.442 8.057 1.00 0.00 C ATOM 2471 O LYS A 159 15.914 -4.483 7.673 1.00 0.00 O ATOM 2472 CB LYS A 159 16.297 -7.095 9.539 1.00 0.00 C ATOM 2473 CG LYS A 159 16.842 -8.483 9.822 1.00 0.00 C ATOM 2474 CD LYS A 159 16.828 -8.806 11.314 1.00 0.00 C ATOM 2475 CE LYS A 159 18.145 -8.472 11.999 1.00 0.00 C ATOM 2476 NZ LYS A 159 18.442 -7.019 11.999 1.00 0.00 N ATOM 0 H LYS A 159 17.575 -6.216 7.058 1.00 0.00 H new ATOM 0 HA LYS A 159 15.092 -7.574 7.788 1.00 0.00 H new ATOM 0 HB2 LYS A 159 17.065 -6.364 9.792 1.00 0.00 H new ATOM 0 HB3 LYS A 159 15.452 -6.913 10.204 1.00 0.00 H new ATOM 0 HG2 LYS A 159 16.248 -9.223 9.285 1.00 0.00 H new ATOM 0 HG3 LYS A 159 17.862 -8.557 9.444 1.00 0.00 H new ATOM 0 HD2 LYS A 159 16.022 -8.251 11.794 1.00 0.00 H new ATOM 0 HD3 LYS A 159 16.611 -9.865 11.450 1.00 0.00 H new ATOM 0 HE2 LYS A 159 18.116 -8.832 13.027 1.00 0.00 H new ATOM 0 HE3 LYS A 159 18.954 -9.003 11.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 19.205 -6.821 11.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 17.589 -6.490 11.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 18.740 -6.726 12.951 1.00 0.00 H new ATOM 2490 N SER A 160 14.020 -5.339 8.509 1.00 0.00 N ATOM 2491 CA SER A 160 13.328 -4.068 8.586 1.00 0.00 C ATOM 2492 C SER A 160 13.251 -3.613 10.035 1.00 0.00 C ATOM 2493 O SER A 160 12.879 -4.387 10.920 1.00 0.00 O ATOM 2494 CB SER A 160 11.913 -4.194 8.009 1.00 0.00 C ATOM 2495 OG SER A 160 11.183 -2.984 8.127 1.00 0.00 O ATOM 0 H SER A 160 13.469 -6.134 8.833 1.00 0.00 H new ATOM 0 HA SER A 160 13.881 -3.332 8.002 1.00 0.00 H new ATOM 0 HB2 SER A 160 11.974 -4.480 6.959 1.00 0.00 H new ATOM 0 HB3 SER A 160 11.380 -4.991 8.527 1.00 0.00 H new ATOM 0 HG SER A 160 11.807 -2.232 8.207 1.00 0.00 H new ATOM 2501 N ARG A 161 13.585 -2.362 10.268 1.00 0.00 N ATOM 2502 CA ARG A 161 13.530 -1.781 11.598 1.00 0.00 C ATOM 2503 C ARG A 161 12.565 -0.607 11.573 1.00 0.00 C ATOM 2504 O ARG A 161 12.757 0.335 10.801 1.00 0.00 O ATOM 2505 CB ARG A 161 14.907 -1.282 12.041 1.00 0.00 C ATOM 2506 CG ARG A 161 15.957 -2.361 12.247 1.00 0.00 C ATOM 2507 CD ARG A 161 17.317 -1.733 12.533 1.00 0.00 C ATOM 2508 NE ARG A 161 18.368 -2.718 12.816 1.00 0.00 N ATOM 2509 CZ ARG A 161 18.552 -3.300 14.001 1.00 0.00 C ATOM 2510 NH1 ARG A 161 17.739 -3.034 15.008 1.00 0.00 N ATOM 2511 NH2 ARG A 161 19.555 -4.146 14.178 1.00 0.00 N ATOM 0 H ARG A 161 13.902 -1.717 9.544 1.00 0.00 H new ATOM 0 HA ARG A 161 13.199 -2.545 12.301 1.00 0.00 H new ATOM 0 HB2 ARG A 161 15.276 -0.577 11.296 1.00 0.00 H new ATOM 0 HB3 ARG A 161 14.791 -0.729 12.973 1.00 0.00 H new ATOM 0 HG2 ARG A 161 15.666 -3.007 13.076 1.00 0.00 H new ATOM 0 HG3 ARG A 161 16.020 -2.990 11.359 1.00 0.00 H new ATOM 0 HD2 ARG A 161 17.617 -1.129 11.677 1.00 0.00 H new ATOM 0 HD3 ARG A 161 17.225 -1.057 13.383 1.00 0.00 H new ATOM 0 HE ARG A 161 18.999 -2.974 12.056 1.00 0.00 H new ATOM 0 HH11 ARG A 161 16.966 -2.381 14.881 1.00 0.00 H new ATOM 0 HH12 ARG A 161 17.884 -3.482 15.913 1.00 0.00 H new ATOM 0 HH21 ARG A 161 20.189 -4.354 13.407 1.00 0.00 H new ATOM 0 HH22 ARG A 161 19.694 -4.590 15.086 1.00 0.00 H new ATOM 2525 N GLY A 162 11.533 -0.643 12.397 1.00 0.00 N ATOM 2526 CA GLY A 162 10.595 0.459 12.399 1.00 0.00 C ATOM 2527 C GLY A 162 9.378 0.230 13.251 1.00 0.00 C ATOM 2528 O GLY A 162 9.437 -0.469 14.257 1.00 0.00 O ATOM 0 H GLY A 162 11.329 -1.398 13.052 1.00 0.00 H new ATOM 0 HA2 GLY A 162 11.106 1.356 12.749 1.00 0.00 H new ATOM 0 HA3 GLY A 162 10.277 0.652 11.375 1.00 0.00 H new ATOM 2532 N PHE A 163 8.270 0.831 12.839 1.00 0.00 N ATOM 2533 CA PHE A 163 7.017 0.708 13.568 1.00 0.00 C ATOM 2534 C PHE A 163 5.855 1.243 12.735 1.00 0.00 C ATOM 2535 O PHE A 163 5.998 1.497 11.540 1.00 0.00 O ATOM 2536 CB PHE A 163 7.101 1.454 14.914 1.00 0.00 C ATOM 2537 CG PHE A 163 7.445 2.921 14.807 1.00 0.00 C ATOM 2538 CD1 PHE A 163 6.476 3.862 14.492 1.00 0.00 C ATOM 2539 CD2 PHE A 163 8.743 3.357 15.029 1.00 0.00 C ATOM 2540 CE1 PHE A 163 6.793 5.203 14.401 1.00 0.00 C ATOM 2541 CE2 PHE A 163 9.066 4.697 14.938 1.00 0.00 C ATOM 2542 CZ PHE A 163 8.089 5.621 14.625 1.00 0.00 C ATOM 0 H PHE A 163 8.215 1.410 12.001 1.00 0.00 H new ATOM 0 HA PHE A 163 6.839 -0.349 13.767 1.00 0.00 H new ATOM 0 HB2 PHE A 163 6.144 1.356 15.427 1.00 0.00 H new ATOM 0 HB3 PHE A 163 7.849 0.965 15.538 1.00 0.00 H new ATOM 0 HD1 PHE A 163 5.460 3.542 14.315 1.00 0.00 H new ATOM 0 HD2 PHE A 163 9.511 2.639 15.276 1.00 0.00 H new ATOM 0 HE1 PHE A 163 6.027 5.924 14.155 1.00 0.00 H new ATOM 0 HE2 PHE A 163 10.081 5.021 15.111 1.00 0.00 H new ATOM 0 HZ PHE A 163 8.339 6.669 14.556 1.00 0.00 H new ATOM 2552 N MET A 164 4.719 1.431 13.384 1.00 0.00 N ATOM 2553 CA MET A 164 3.529 1.955 12.725 1.00 0.00 C ATOM 2554 C MET A 164 2.597 2.569 13.753 1.00 0.00 C ATOM 2555 O MET A 164 2.149 1.888 14.663 1.00 0.00 O ATOM 2556 CB MET A 164 2.773 0.853 11.970 1.00 0.00 C ATOM 2557 CG MET A 164 1.673 1.391 11.064 1.00 0.00 C ATOM 2558 SD MET A 164 1.074 0.176 9.876 1.00 0.00 S ATOM 2559 CE MET A 164 -0.172 1.130 9.013 1.00 0.00 C ATOM 0 H MET A 164 4.593 1.227 14.375 1.00 0.00 H new ATOM 0 HA MET A 164 3.855 2.710 12.009 1.00 0.00 H new ATOM 0 HB2 MET A 164 3.481 0.281 11.370 1.00 0.00 H new ATOM 0 HB3 MET A 164 2.335 0.162 12.691 1.00 0.00 H new ATOM 0 HG2 MET A 164 0.839 1.731 11.678 1.00 0.00 H new ATOM 0 HG3 MET A 164 2.048 2.262 10.526 1.00 0.00 H new ATOM 0 HE1 MET A 164 -0.470 0.603 8.106 1.00 0.00 H new ATOM 0 HE2 MET A 164 -1.040 1.262 9.658 1.00 0.00 H new ATOM 0 HE3 MET A 164 0.235 2.106 8.748 1.00 0.00 H new ATOM 2569 N ASN A 165 2.276 3.838 13.601 1.00 0.00 N ATOM 2570 CA ASN A 165 1.367 4.483 14.539 1.00 0.00 C ATOM 2571 C ASN A 165 -0.064 4.048 14.238 1.00 0.00 C ATOM 2572 O ASN A 165 -0.473 4.009 13.073 1.00 0.00 O ATOM 2573 CB ASN A 165 1.473 6.009 14.456 1.00 0.00 C ATOM 2574 CG ASN A 165 0.487 6.708 15.376 1.00 0.00 C ATOM 2575 OD1 ASN A 165 0.651 6.715 16.591 1.00 0.00 O ATOM 2576 ND2 ASN A 165 -0.563 7.278 14.808 1.00 0.00 N ATOM 0 H ASN A 165 2.622 4.438 12.852 1.00 0.00 H new ATOM 0 HA ASN A 165 1.643 4.180 15.549 1.00 0.00 H new ATOM 0 HB2 ASN A 165 2.487 6.315 14.715 1.00 0.00 H new ATOM 0 HB3 ASN A 165 1.296 6.328 13.429 1.00 0.00 H new ATOM 0 HD21 ASN A 165 -1.266 7.741 15.384 1.00 0.00 H new ATOM 0 HD22 ASN A 165 -0.670 7.254 13.794 1.00 0.00 H new ATOM 2583 N SER A 166 -0.790 3.703 15.295 1.00 0.00 N ATOM 2584 CA SER A 166 -2.168 3.241 15.212 1.00 0.00 C ATOM 2585 C SER A 166 -3.163 4.408 15.124 1.00 0.00 C ATOM 2586 O SER A 166 -2.968 5.338 14.345 1.00 0.00 O ATOM 2587 CB SER A 166 -2.455 2.376 16.441 1.00 0.00 C ATOM 2588 OG SER A 166 -1.895 2.968 17.605 1.00 0.00 O ATOM 0 H SER A 166 -0.431 3.737 16.249 1.00 0.00 H new ATOM 0 HA SER A 166 -2.295 2.659 14.299 1.00 0.00 H new ATOM 0 HB2 SER A 166 -3.531 2.258 16.567 1.00 0.00 H new ATOM 0 HB3 SER A 166 -2.040 1.379 16.297 1.00 0.00 H new ATOM 0 HG SER A 166 -2.088 2.405 18.383 1.00 0.00 H new ATOM 2594 N SER A 167 -4.225 4.337 15.930 1.00 0.00 N ATOM 2595 CA SER A 167 -5.270 5.370 15.965 1.00 0.00 C ATOM 2596 C SER A 167 -5.975 5.489 14.604 1.00 0.00 C ATOM 2597 O SER A 167 -6.076 4.502 13.871 1.00 0.00 O ATOM 2598 CB SER A 167 -4.671 6.717 16.399 1.00 0.00 C ATOM 2599 OG SER A 167 -3.989 6.594 17.638 1.00 0.00 O ATOM 0 H SER A 167 -4.387 3.565 16.576 1.00 0.00 H new ATOM 0 HA SER A 167 -6.021 5.076 16.698 1.00 0.00 H new ATOM 0 HB2 SER A 167 -3.982 7.076 15.634 1.00 0.00 H new ATOM 0 HB3 SER A 167 -5.464 7.460 16.488 1.00 0.00 H new ATOM 0 HG SER A 167 -3.615 7.463 17.893 1.00 0.00 H new ATOM 2605 N GLY A 168 -6.441 6.693 14.265 1.00 0.00 N ATOM 2606 CA GLY A 168 -7.102 6.905 12.985 1.00 0.00 C ATOM 2607 C GLY A 168 -6.097 7.219 11.897 1.00 0.00 C ATOM 2608 O GLY A 168 -6.211 6.748 10.764 1.00 0.00 O ATOM 0 H GLY A 168 -6.372 7.523 14.853 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -7.670 6.015 12.714 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -7.816 7.724 13.072 1.00 0.00 H new ATOM 2612 N HIS A 169 -5.102 8.017 12.256 1.00 0.00 N ATOM 2613 CA HIS A 169 -4.046 8.399 11.331 1.00 0.00 C ATOM 2614 C HIS A 169 -2.897 7.407 11.448 1.00 0.00 C ATOM 2615 O HIS A 169 -2.063 7.514 12.347 1.00 0.00 O ATOM 2616 CB HIS A 169 -3.574 9.824 11.632 1.00 0.00 C ATOM 2617 CG HIS A 169 -4.600 10.876 11.326 1.00 0.00 C ATOM 2618 ND1 HIS A 169 -4.380 12.227 11.494 1.00 0.00 N ATOM 2619 CD2 HIS A 169 -5.860 10.766 10.846 1.00 0.00 C ATOM 2620 CE1 HIS A 169 -5.459 12.897 11.133 1.00 0.00 C ATOM 2621 NE2 HIS A 169 -6.370 12.033 10.735 1.00 0.00 N ATOM 0 H HIS A 169 -5.004 8.415 13.190 1.00 0.00 H new ATOM 0 HA HIS A 169 -4.425 8.380 10.309 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -3.300 9.892 12.685 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -2.673 10.029 11.054 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -6.371 9.848 10.596 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -5.575 13.970 11.160 1.00 0.00 H new ATOM 0 HE2 HIS A 169 -7.304 12.269 10.399 1.00 0.00 H new ATOM 2630 N ALA A 170 -2.878 6.428 10.556 1.00 0.00 N ATOM 2631 CA ALA A 170 -1.853 5.398 10.588 1.00 0.00 C ATOM 2632 C ALA A 170 -0.656 5.759 9.731 1.00 0.00 C ATOM 2633 O ALA A 170 -0.803 6.254 8.614 1.00 0.00 O ATOM 2634 CB ALA A 170 -2.426 4.061 10.149 1.00 0.00 C ATOM 0 H ALA A 170 -3.559 6.326 9.803 1.00 0.00 H new ATOM 0 HA ALA A 170 -1.509 5.319 11.619 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -1.644 3.302 10.179 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -3.236 3.774 10.820 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.810 4.146 9.132 1.00 0.00 H new ATOM 2640 N ILE A 171 0.529 5.485 10.253 1.00 0.00 N ATOM 2641 CA ILE A 171 1.765 5.758 9.528 1.00 0.00 C ATOM 2642 C ILE A 171 2.785 4.649 9.765 1.00 0.00 C ATOM 2643 O ILE A 171 3.110 4.323 10.909 1.00 0.00 O ATOM 2644 CB ILE A 171 2.403 7.118 9.910 1.00 0.00 C ATOM 2645 CG1 ILE A 171 2.623 7.212 11.421 1.00 0.00 C ATOM 2646 CG2 ILE A 171 1.553 8.282 9.416 1.00 0.00 C ATOM 2647 CD1 ILE A 171 3.306 8.490 11.857 1.00 0.00 C ATOM 0 H ILE A 171 0.664 5.073 11.177 1.00 0.00 H new ATOM 0 HA ILE A 171 1.492 5.801 8.474 1.00 0.00 H new ATOM 0 HB ILE A 171 3.374 7.179 9.419 1.00 0.00 H new ATOM 0 HG12 ILE A 171 1.660 7.135 11.925 1.00 0.00 H new ATOM 0 HG13 ILE A 171 3.222 6.361 11.746 1.00 0.00 H new ATOM 0 HG21 ILE A 171 2.025 9.223 9.698 1.00 0.00 H new ATOM 0 HG22 ILE A 171 1.463 8.232 8.331 1.00 0.00 H new ATOM 0 HG23 ILE A 171 0.561 8.225 9.865 1.00 0.00 H new ATOM 0 HD11 ILE A 171 3.428 8.486 12.940 1.00 0.00 H new ATOM 0 HD12 ILE A 171 4.284 8.560 11.382 1.00 0.00 H new ATOM 0 HD13 ILE A 171 2.698 9.346 11.564 1.00 0.00 H new ATOM 2659 N LEU A 172 3.286 4.073 8.681 1.00 0.00 N ATOM 2660 CA LEU A 172 4.278 3.003 8.760 1.00 0.00 C ATOM 2661 C LEU A 172 5.662 3.562 8.464 1.00 0.00 C ATOM 2662 O LEU A 172 5.905 4.092 7.380 1.00 0.00 O ATOM 2663 CB LEU A 172 3.943 1.889 7.760 1.00 0.00 C ATOM 2664 CG LEU A 172 4.843 0.651 7.830 1.00 0.00 C ATOM 2665 CD1 LEU A 172 4.543 -0.164 9.075 1.00 0.00 C ATOM 2666 CD2 LEU A 172 4.679 -0.204 6.586 1.00 0.00 C ATOM 0 H LEU A 172 3.021 4.329 7.730 1.00 0.00 H new ATOM 0 HA LEU A 172 4.264 2.585 9.767 1.00 0.00 H new ATOM 0 HB2 LEU A 172 2.911 1.577 7.922 1.00 0.00 H new ATOM 0 HB3 LEU A 172 3.997 2.300 6.752 1.00 0.00 H new ATOM 0 HG LEU A 172 5.878 0.989 7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 172 5.194 -1.038 9.103 1.00 0.00 H new ATOM 0 HD12 LEU A 172 4.717 0.447 9.961 1.00 0.00 H new ATOM 0 HD13 LEU A 172 3.502 -0.487 9.056 1.00 0.00 H new ATOM 0 HD21 LEU A 172 5.327 -1.078 6.657 1.00 0.00 H new ATOM 0 HD22 LEU A 172 3.642 -0.528 6.501 1.00 0.00 H new ATOM 0 HD23 LEU A 172 4.950 0.379 5.706 1.00 0.00 H new ATOM 2678 N GLU A 173 6.560 3.431 9.426 1.00 0.00 N ATOM 2679 CA GLU A 173 7.925 3.912 9.279 1.00 0.00 C ATOM 2680 C GLU A 173 8.889 2.751 9.497 1.00 0.00 C ATOM 2681 O GLU A 173 9.473 2.597 10.571 1.00 0.00 O ATOM 2682 CB GLU A 173 8.199 5.042 10.275 1.00 0.00 C ATOM 2683 CG GLU A 173 9.551 5.713 10.086 1.00 0.00 C ATOM 2684 CD GLU A 173 9.806 6.820 11.093 1.00 0.00 C ATOM 2685 OE1 GLU A 173 8.917 7.095 11.923 1.00 0.00 O ATOM 2686 OE2 GLU A 173 10.906 7.417 11.054 1.00 0.00 O ATOM 0 H GLU A 173 6.366 2.991 10.326 1.00 0.00 H new ATOM 0 HA GLU A 173 8.068 4.310 8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 173 7.415 5.793 10.182 1.00 0.00 H new ATOM 0 HB3 GLU A 173 8.140 4.643 11.288 1.00 0.00 H new ATOM 0 HG2 GLU A 173 10.338 4.964 10.170 1.00 0.00 H new ATOM 0 HG3 GLU A 173 9.609 6.125 9.078 1.00 0.00 H new ATOM 2693 N ILE A 174 9.036 1.920 8.476 1.00 0.00 N ATOM 2694 CA ILE A 174 9.923 0.769 8.566 1.00 0.00 C ATOM 2695 C ILE A 174 11.090 0.900 7.597 1.00 0.00 C ATOM 2696 O ILE A 174 10.910 1.074 6.390 1.00 0.00 O ATOM 2697 CB ILE A 174 9.187 -0.573 8.321 1.00 0.00 C ATOM 2698 CG1 ILE A 174 8.429 -0.559 6.994 1.00 0.00 C ATOM 2699 CG2 ILE A 174 8.245 -0.895 9.477 1.00 0.00 C ATOM 2700 CD1 ILE A 174 7.898 -1.920 6.598 1.00 0.00 C ATOM 0 H ILE A 174 8.556 2.019 7.581 1.00 0.00 H new ATOM 0 HA ILE A 174 10.302 0.756 9.588 1.00 0.00 H new ATOM 0 HB ILE A 174 9.942 -1.357 8.265 1.00 0.00 H new ATOM 0 HG12 ILE A 174 7.597 0.142 7.065 1.00 0.00 H new ATOM 0 HG13 ILE A 174 9.090 -0.191 6.209 1.00 0.00 H new ATOM 0 HG21 ILE A 174 7.740 -1.841 9.282 1.00 0.00 H new ATOM 0 HG22 ILE A 174 8.817 -0.973 10.402 1.00 0.00 H new ATOM 0 HG23 ILE A 174 7.504 -0.102 9.574 1.00 0.00 H new ATOM 0 HD11 ILE A 174 7.370 -1.842 5.648 1.00 0.00 H new ATOM 0 HD12 ILE A 174 8.728 -2.619 6.496 1.00 0.00 H new ATOM 0 HD13 ILE A 174 7.213 -2.280 7.365 1.00 0.00 H new ATOM 2712 N HIS A 175 12.289 0.833 8.141 1.00 0.00 N ATOM 2713 CA HIS A 175 13.502 0.956 7.343 1.00 0.00 C ATOM 2714 C HIS A 175 14.177 -0.401 7.161 1.00 0.00 C ATOM 2715 O HIS A 175 14.732 -0.967 8.105 1.00 0.00 O ATOM 2716 CB HIS A 175 14.463 1.935 8.019 1.00 0.00 C ATOM 2717 CG HIS A 175 15.637 2.332 7.176 1.00 0.00 C ATOM 2718 ND1 HIS A 175 16.627 3.185 7.607 1.00 0.00 N ATOM 2719 CD2 HIS A 175 15.968 1.988 5.913 1.00 0.00 C ATOM 2720 CE1 HIS A 175 17.521 3.343 6.649 1.00 0.00 C ATOM 2721 NE2 HIS A 175 17.145 2.627 5.610 1.00 0.00 N ATOM 0 H HIS A 175 12.454 0.693 9.138 1.00 0.00 H new ATOM 0 HA HIS A 175 13.232 1.334 6.357 1.00 0.00 H new ATOM 0 HB2 HIS A 175 13.911 2.833 8.298 1.00 0.00 H new ATOM 0 HB3 HIS A 175 14.829 1.486 8.942 1.00 0.00 H new ATOM 0 HD1 HIS A 175 16.664 3.627 8.525 1.00 0.00 H new ATOM 0 HD2 HIS A 175 15.410 1.332 5.262 1.00 0.00 H new ATOM 0 HE1 HIS A 175 18.409 3.955 6.707 1.00 0.00 H new ATOM 2730 N VAL A 176 14.146 -0.898 5.938 1.00 0.00 N ATOM 2731 CA VAL A 176 14.769 -2.180 5.609 1.00 0.00 C ATOM 2732 C VAL A 176 16.245 -1.979 5.268 1.00 0.00 C ATOM 2733 O VAL A 176 16.589 -1.215 4.365 1.00 0.00 O ATOM 2734 CB VAL A 176 14.027 -2.904 4.448 1.00 0.00 C ATOM 2735 CG1 VAL A 176 12.594 -3.212 4.850 1.00 0.00 C ATOM 2736 CG2 VAL A 176 14.041 -2.092 3.161 1.00 0.00 C ATOM 0 H VAL A 176 13.695 -0.436 5.148 1.00 0.00 H new ATOM 0 HA VAL A 176 14.694 -2.821 6.488 1.00 0.00 H new ATOM 0 HB VAL A 176 14.561 -3.834 4.255 1.00 0.00 H new ATOM 0 HG11 VAL A 176 12.087 -3.718 4.029 1.00 0.00 H new ATOM 0 HG12 VAL A 176 12.593 -3.856 5.729 1.00 0.00 H new ATOM 0 HG13 VAL A 176 12.073 -2.283 5.081 1.00 0.00 H new ATOM 0 HG21 VAL A 176 13.511 -2.638 2.380 1.00 0.00 H new ATOM 0 HG22 VAL A 176 13.550 -1.134 3.330 1.00 0.00 H new ATOM 0 HG23 VAL A 176 15.072 -1.922 2.849 1.00 0.00 H new ATOM 2746 N THR A 177 17.103 -2.675 6.004 1.00 0.00 N ATOM 2747 CA THR A 177 18.548 -2.602 5.810 1.00 0.00 C ATOM 2748 C THR A 177 19.179 -3.947 6.169 1.00 0.00 C ATOM 2749 O THR A 177 18.460 -4.909 6.425 1.00 0.00 O ATOM 2750 CB THR A 177 19.193 -1.490 6.672 1.00 0.00 C ATOM 2751 OG1 THR A 177 18.736 -1.584 8.030 1.00 0.00 O ATOM 2752 CG2 THR A 177 18.868 -0.115 6.127 1.00 0.00 C ATOM 0 H THR A 177 16.818 -3.306 6.753 1.00 0.00 H new ATOM 0 HA THR A 177 18.730 -2.362 4.762 1.00 0.00 H new ATOM 0 HB THR A 177 20.273 -1.631 6.639 1.00 0.00 H new ATOM 0 HG1 THR A 177 19.153 -0.876 8.565 1.00 0.00 H new ATOM 0 HG21 THR A 177 19.335 0.645 6.754 1.00 0.00 H new ATOM 0 HG22 THR A 177 19.247 -0.028 5.109 1.00 0.00 H new ATOM 0 HG23 THR A 177 17.788 0.030 6.126 1.00 0.00 H new ATOM 2760 N LYS A 178 20.510 -4.017 6.189 1.00 0.00 N ATOM 2761 CA LYS A 178 21.217 -5.260 6.517 1.00 0.00 C ATOM 2762 C LYS A 178 20.782 -5.821 7.877 1.00 0.00 C ATOM 2763 O LYS A 178 20.539 -5.069 8.824 1.00 0.00 O ATOM 2764 CB LYS A 178 22.741 -5.038 6.466 1.00 0.00 C ATOM 2765 CG LYS A 178 23.233 -3.814 7.234 1.00 0.00 C ATOM 2766 CD LYS A 178 23.452 -4.100 8.713 1.00 0.00 C ATOM 2767 CE LYS A 178 24.007 -2.882 9.434 1.00 0.00 C ATOM 2768 NZ LYS A 178 24.165 -3.124 10.892 1.00 0.00 N ATOM 0 H LYS A 178 21.123 -3.228 5.982 1.00 0.00 H new ATOM 0 HA LYS A 178 20.951 -6.005 5.767 1.00 0.00 H new ATOM 0 HB2 LYS A 178 23.237 -5.923 6.864 1.00 0.00 H new ATOM 0 HB3 LYS A 178 23.046 -4.943 5.424 1.00 0.00 H new ATOM 0 HG2 LYS A 178 24.167 -3.464 6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 178 22.508 -3.007 7.127 1.00 0.00 H new ATOM 0 HD2 LYS A 178 22.509 -4.399 9.171 1.00 0.00 H new ATOM 0 HD3 LYS A 178 24.141 -4.937 8.826 1.00 0.00 H new ATOM 0 HE2 LYS A 178 24.972 -2.614 9.004 1.00 0.00 H new ATOM 0 HE3 LYS A 178 23.342 -2.033 9.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 24.546 -2.270 11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 23.240 -3.354 11.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 24.820 -3.918 11.043 1.00 0.00 H new ATOM 2782 N ALA A 179 20.664 -7.148 7.964 1.00 0.00 N ATOM 2783 CA ALA A 179 20.247 -7.793 9.206 1.00 0.00 C ATOM 2784 C ALA A 179 21.277 -7.552 10.312 1.00 0.00 C ATOM 2785 O ALA A 179 22.411 -8.061 10.200 1.00 0.00 O ATOM 2786 CB ALA A 179 20.007 -9.291 9.002 1.00 0.00 C ATOM 2787 OXT ALA A 179 20.944 -6.848 11.293 1.00 0.00 O ATOM 0 H ALA A 179 20.850 -7.791 7.194 1.00 0.00 H new ATOM 0 HA ALA A 179 19.302 -7.346 9.514 1.00 0.00 H new ATOM 0 HB1 ALA A 179 19.698 -9.742 9.945 1.00 0.00 H new ATOM 0 HB2 ALA A 179 19.225 -9.436 8.257 1.00 0.00 H new ATOM 0 HB3 ALA A 179 20.927 -9.763 8.659 1.00 0.00 H new