USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 819 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 218 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 222 SER OG : rot 172:sc= 0 USER MOD Set 1.3: A 223 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.16) USER MOD Set 2.1: A 187 HIS : no HE2:sc= -3.83 K(o=-4.1,f=-5.6!) USER MOD Set 2.2: A 206 MET CE :methyl -159:sc= -0.264 (180deg=-0.522) USER MOD Set 3.1: A 171 ASN : amide:sc= -0.841! K(o=-0.018!,f=0.98) USER MOD Set 3.2: A 174 THR OG1 : rot 180:sc= 0.823 USER MOD Set 4.1: A 159 ASN : amide:sc= -0.521 K(o=-0.0013,f=0.64) USER MOD Set 4.2: A 160 GLN : amide:sc= 0.52 K(o=-0.0013,f=-0.87) USER MOD Set 5.1: A 153 ASN : amide:sc= 0.516 K(o=0.52,f=-0.057) USER MOD Set 5.2: A 155 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 150 TYR OH : rot 165:sc= 1.27 USER MOD Set 6.2: A 154 MET CE :methyl 153:sc= -1.45 (180deg=-2.42) USER MOD Set 7.1: A 134 MET CE :methyl 162:sc= -0.0137 (180deg=-0.225) USER MOD Set 7.2: A 213 MET CE :methyl -163:sc= -0.0131 (180deg=-0.508) USER MOD Single : A 128 TYR OH : rot 30:sc= -0.255 USER MOD Single : A 129 MET CE :methyl 168:sc= -1.06 (180deg=-1.86!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl 162:sc= 0 (180deg=-0.121) USER MOD Single : A 140 HIS : no HD1:sc= -0.349 X(o=-0.35,f=-0.71) USER MOD Single : A 143 ASN : amide:sc= -0.265 K(o=-0.26,f=-4.4!) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 24:sc= 1.23 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot -122:sc= 1.29 USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 169 TYR OH : rot 180:sc= -0.0217 USER MOD Single : A 170 ASN : amide:sc= -0.0679 X(o=-0.068,f=-0.23) USER MOD Single : A 172 GLN : amide:sc= -1.38 K(o=-1.4,f=-0.0036) USER MOD Single : A 173 ASN : amide:sc= -0.0461 X(o=-0.046,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : A 181 ASN : amide:sc=-0.00838 X(o=-0.0084,f=0) USER MOD Single : A 183 THR OG1 : rot 84:sc= 1.61 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -1.99 K(o=-2,f=-0.76) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 86:sc= 0.969 USER MOD Single : A 191 THR OG1 : rot 180:sc= -0.0558 USER MOD Single : A 192 THR OG1 : rot 73:sc= 0.646 USER MOD Single : A 193 THR OG1 : rot 81:sc= 0.183 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0491 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -163:sc= 1.25 (180deg=0.652) USER MOD Single : A 205 MET CE :methyl 179:sc= -0.779 (180deg=-0.806) USER MOD Single : A 212 GLN : amide:sc= -3.07! C(o=-3.1!,f=-2.2!) USER MOD Single : A 216 THR OG1 : rot 84:sc= 0.0341 USER MOD Single : A 217 GLN : amide:sc= 0.347 K(o=0.35,f=-3.1!) USER MOD Single : A 219 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 TYR OH : rot 180:sc=-0.000495 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N LEU A 125 5.848 -14.231 0.339 1.00 0.00 N ATOM 48 CA LEU A 125 6.548 -13.076 0.848 1.00 0.00 C ATOM 49 C LEU A 125 8.000 -13.508 1.051 1.00 0.00 C ATOM 50 O LEU A 125 8.364 -14.051 2.097 1.00 0.00 O ATOM 51 CB LEU A 125 5.915 -12.618 2.164 1.00 0.00 C ATOM 52 CG LEU A 125 4.937 -11.440 2.100 1.00 0.00 C ATOM 53 CD1 LEU A 125 3.481 -11.890 1.885 1.00 0.00 C ATOM 54 CD2 LEU A 125 5.042 -10.729 3.452 1.00 0.00 C ATOM 0 HA LEU A 125 6.493 -12.233 0.159 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.391 -13.468 2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.719 -12.352 2.851 1.00 0.00 H new ATOM 0 HG LEU A 125 5.194 -10.799 1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.832 -11.015 1.848 1.00 0.00 H new ATOM 0 HD12 LEU A 125 3.405 -12.439 0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 125 3.174 -12.535 2.709 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.364 -9.875 3.468 1.00 0.00 H new ATOM 0 HD22 LEU A 125 4.772 -11.422 4.249 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.065 -10.383 3.603 1.00 0.00 H new ATOM 66 N GLY A 126 8.835 -13.270 0.048 1.00 0.00 N ATOM 67 CA GLY A 126 10.274 -13.504 0.091 1.00 0.00 C ATOM 68 C GLY A 126 10.988 -12.400 0.871 1.00 0.00 C ATOM 69 O GLY A 126 11.791 -11.660 0.307 1.00 0.00 O ATOM 0 H GLY A 126 8.520 -12.897 -0.847 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.475 -14.470 0.555 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.669 -13.550 -0.924 1.00 0.00 H new ATOM 73 N GLY A 127 10.688 -12.260 2.165 1.00 0.00 N ATOM 74 CA GLY A 127 11.367 -11.315 3.049 1.00 0.00 C ATOM 75 C GLY A 127 11.000 -9.855 2.758 1.00 0.00 C ATOM 76 O GLY A 127 11.881 -9.022 2.536 1.00 0.00 O ATOM 0 H GLY A 127 9.961 -12.804 2.630 1.00 0.00 H new ATOM 0 HA2 GLY A 127 11.115 -11.548 4.084 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.445 -11.440 2.947 1.00 0.00 H new ATOM 80 N TYR A 128 9.706 -9.541 2.664 1.00 0.00 N ATOM 81 CA TYR A 128 9.209 -8.167 2.500 1.00 0.00 C ATOM 82 C TYR A 128 9.368 -7.392 3.806 1.00 0.00 C ATOM 83 O TYR A 128 9.549 -7.979 4.879 1.00 0.00 O ATOM 84 CB TYR A 128 7.762 -8.188 1.994 1.00 0.00 C ATOM 85 CG TYR A 128 7.694 -8.580 0.535 1.00 0.00 C ATOM 86 CD1 TYR A 128 7.808 -9.928 0.166 1.00 0.00 C ATOM 87 CD2 TYR A 128 7.610 -7.591 -0.458 1.00 0.00 C ATOM 88 CE1 TYR A 128 7.822 -10.291 -1.190 1.00 0.00 C ATOM 89 CE2 TYR A 128 7.647 -7.939 -1.816 1.00 0.00 C ATOM 90 CZ TYR A 128 7.740 -9.305 -2.188 1.00 0.00 C ATOM 91 OH TYR A 128 7.739 -9.710 -3.489 1.00 0.00 O ATOM 0 H TYR A 128 8.963 -10.239 2.700 1.00 0.00 H new ATOM 0 HA TYR A 128 9.802 -7.646 1.748 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.177 -8.890 2.589 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.313 -7.204 2.129 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.885 -10.690 0.928 1.00 0.00 H new ATOM 0 HD2 TYR A 128 7.516 -6.553 -0.174 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.896 -11.332 -1.467 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.605 -7.171 -2.575 1.00 0.00 H new ATOM 0 HH TYR A 128 7.331 -10.599 -3.555 1.00 0.00 H new ATOM 101 N MET A 129 9.281 -6.072 3.691 1.00 0.00 N ATOM 102 CA MET A 129 9.333 -5.094 4.768 1.00 0.00 C ATOM 103 C MET A 129 8.000 -4.369 4.805 1.00 0.00 C ATOM 104 O MET A 129 7.251 -4.413 3.826 1.00 0.00 O ATOM 105 CB MET A 129 10.493 -4.079 4.599 1.00 0.00 C ATOM 106 CG MET A 129 10.810 -3.735 3.153 1.00 0.00 C ATOM 107 SD MET A 129 11.793 -5.030 2.341 1.00 0.00 S ATOM 108 CE MET A 129 13.330 -4.138 2.118 1.00 0.00 C ATOM 0 H MET A 129 9.164 -5.628 2.780 1.00 0.00 H new ATOM 0 HA MET A 129 9.522 -5.617 5.705 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.240 -3.163 5.132 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.388 -4.485 5.069 1.00 0.00 H new ATOM 0 HG2 MET A 129 9.880 -3.588 2.604 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.354 -2.791 3.116 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.117 -4.835 1.829 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.205 -3.388 1.337 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.605 -3.648 3.052 1.00 0.00 H new ATOM 118 N LEU A 130 7.726 -3.695 5.918 1.00 0.00 N ATOM 119 CA LEU A 130 6.532 -2.902 6.149 1.00 0.00 C ATOM 120 C LEU A 130 6.957 -1.501 6.575 1.00 0.00 C ATOM 121 O LEU A 130 8.010 -1.333 7.197 1.00 0.00 O ATOM 122 CB LEU A 130 5.677 -3.613 7.213 1.00 0.00 C ATOM 123 CG LEU A 130 4.285 -2.987 7.409 1.00 0.00 C ATOM 124 CD1 LEU A 130 3.478 -2.987 6.096 1.00 0.00 C ATOM 125 CD2 LEU A 130 3.541 -3.723 8.529 1.00 0.00 C ATOM 0 H LEU A 130 8.361 -3.689 6.716 1.00 0.00 H new ATOM 0 HA LEU A 130 5.926 -2.803 5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.558 -4.659 6.931 1.00 0.00 H new ATOM 0 HB3 LEU A 130 6.210 -3.597 8.164 1.00 0.00 H new ATOM 0 HG LEU A 130 4.408 -1.944 7.701 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.500 -2.538 6.270 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.012 -2.411 5.340 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.350 -4.012 5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.556 -3.277 8.665 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.430 -4.774 8.263 1.00 0.00 H new ATOM 0 HD23 LEU A 130 4.107 -3.642 9.457 1.00 0.00 H new ATOM 137 N GLY A 131 6.151 -0.498 6.243 1.00 0.00 N ATOM 138 CA GLY A 131 6.533 0.887 6.459 1.00 0.00 C ATOM 139 C GLY A 131 6.301 1.371 7.885 1.00 0.00 C ATOM 140 O GLY A 131 5.874 0.621 8.759 1.00 0.00 O ATOM 0 H GLY A 131 5.230 -0.622 5.823 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.588 1.007 6.211 1.00 0.00 H new ATOM 0 HA3 GLY A 131 5.971 1.521 5.774 1.00 0.00 H new ATOM 144 N SER A 132 6.597 2.649 8.104 1.00 0.00 N ATOM 145 CA SER A 132 6.514 3.352 9.368 1.00 0.00 C ATOM 146 C SER A 132 5.111 3.785 9.794 1.00 0.00 C ATOM 147 O SER A 132 4.923 4.077 10.975 1.00 0.00 O ATOM 148 CB SER A 132 7.337 4.615 9.177 1.00 0.00 C ATOM 149 OG SER A 132 8.726 4.328 9.167 1.00 0.00 O ATOM 0 H SER A 132 6.922 3.255 7.350 1.00 0.00 H new ATOM 0 HA SER A 132 6.859 2.671 10.146 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.056 5.097 8.240 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.115 5.321 9.977 1.00 0.00 H new ATOM 0 HG SER A 132 9.231 5.159 9.041 1.00 0.00 H new ATOM 155 N ALA A 133 4.179 3.833 8.843 1.00 0.00 N ATOM 156 CA ALA A 133 2.817 4.357 8.838 1.00 0.00 C ATOM 157 C ALA A 133 2.757 5.772 8.268 1.00 0.00 C ATOM 158 O ALA A 133 3.763 6.490 8.190 1.00 0.00 O ATOM 159 CB ALA A 133 2.167 4.341 10.223 1.00 0.00 C ATOM 0 H ALA A 133 4.398 3.447 7.925 1.00 0.00 H new ATOM 0 HA ALA A 133 2.251 3.685 8.193 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.156 4.742 10.155 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.127 3.317 10.594 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.755 4.952 10.908 1.00 0.00 H new ATOM 165 N MET A 134 1.546 6.134 7.843 1.00 0.00 N ATOM 166 CA MET A 134 1.127 7.400 7.257 1.00 0.00 C ATOM 167 C MET A 134 -0.332 7.652 7.669 1.00 0.00 C ATOM 168 O MET A 134 -0.967 6.805 8.311 1.00 0.00 O ATOM 169 CB MET A 134 1.269 7.308 5.728 1.00 0.00 C ATOM 170 CG MET A 134 2.712 7.500 5.248 1.00 0.00 C ATOM 171 SD MET A 134 2.895 7.409 3.446 1.00 0.00 S ATOM 172 CE MET A 134 3.151 5.629 3.229 1.00 0.00 C ATOM 0 H MET A 134 0.763 5.484 7.908 1.00 0.00 H new ATOM 0 HA MET A 134 1.743 8.228 7.607 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.907 6.336 5.393 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.634 8.062 5.264 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.075 8.468 5.593 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.343 6.740 5.708 1.00 0.00 H new ATOM 0 HE1 MET A 134 2.964 5.358 2.190 1.00 0.00 H new ATOM 0 HE2 MET A 134 4.178 5.375 3.491 1.00 0.00 H new ATOM 0 HE3 MET A 134 2.465 5.081 3.876 1.00 0.00 H new ATOM 182 N SER A 135 -0.863 8.823 7.322 1.00 0.00 N ATOM 183 CA SER A 135 -2.280 9.143 7.425 1.00 0.00 C ATOM 184 C SER A 135 -3.049 8.511 6.264 1.00 0.00 C ATOM 185 O SER A 135 -2.468 7.877 5.379 1.00 0.00 O ATOM 186 CB SER A 135 -2.477 10.663 7.416 1.00 0.00 C ATOM 187 OG SER A 135 -3.216 11.072 8.553 1.00 0.00 O ATOM 0 H SER A 135 -0.304 9.592 6.953 1.00 0.00 H new ATOM 0 HA SER A 135 -2.663 8.741 8.363 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.508 11.162 7.406 1.00 0.00 H new ATOM 0 HB3 SER A 135 -2.999 10.963 6.508 1.00 0.00 H new ATOM 0 HG SER A 135 -3.333 12.045 8.535 1.00 0.00 H new ATOM 193 N ARG A 136 -4.370 8.687 6.256 1.00 0.00 N ATOM 194 CA ARG A 136 -5.241 8.378 5.129 1.00 0.00 C ATOM 195 C ARG A 136 -5.199 9.616 4.228 1.00 0.00 C ATOM 196 O ARG A 136 -5.722 10.651 4.643 1.00 0.00 O ATOM 197 CB ARG A 136 -6.666 8.068 5.626 1.00 0.00 C ATOM 198 CG ARG A 136 -6.657 7.041 6.767 1.00 0.00 C ATOM 199 CD ARG A 136 -8.030 6.434 7.052 1.00 0.00 C ATOM 200 NE ARG A 136 -7.944 5.462 8.147 1.00 0.00 N ATOM 201 CZ ARG A 136 -7.416 4.231 8.102 1.00 0.00 C ATOM 202 NH1 ARG A 136 -6.943 3.727 6.972 1.00 0.00 N ATOM 203 NH2 ARG A 136 -7.367 3.491 9.195 1.00 0.00 N ATOM 0 H ARG A 136 -4.876 9.060 7.059 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.917 7.493 4.581 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.141 8.988 5.968 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.266 7.688 4.799 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.959 6.241 6.520 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.285 7.520 7.673 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.736 7.223 7.312 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.412 5.947 6.155 1.00 0.00 H new ATOM 0 HE ARG A 136 -8.330 5.756 9.044 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.977 4.278 6.114 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.545 2.788 6.960 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.731 3.856 10.075 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.965 2.554 9.159 1.00 0.00 H new ATOM 217 N PRO A 137 -4.514 9.584 3.075 1.00 0.00 N ATOM 218 CA PRO A 137 -4.429 10.746 2.204 1.00 0.00 C ATOM 219 C PRO A 137 -5.778 11.004 1.544 1.00 0.00 C ATOM 220 O PRO A 137 -6.481 10.046 1.220 1.00 0.00 O ATOM 221 CB PRO A 137 -3.387 10.371 1.154 1.00 0.00 C ATOM 222 CG PRO A 137 -3.482 8.850 1.058 1.00 0.00 C ATOM 223 CD PRO A 137 -3.823 8.446 2.490 1.00 0.00 C ATOM 0 HA PRO A 137 -4.159 11.653 2.745 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.599 10.845 0.195 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.388 10.690 1.453 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.252 8.536 0.354 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.544 8.406 0.724 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.454 7.557 2.505 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.921 8.206 3.053 1.00 0.00 H new ATOM 231 N MET A 138 -6.096 12.264 1.250 1.00 0.00 N ATOM 232 CA MET A 138 -7.193 12.565 0.349 1.00 0.00 C ATOM 233 C MET A 138 -6.711 12.242 -1.055 1.00 0.00 C ATOM 234 O MET A 138 -5.848 12.929 -1.611 1.00 0.00 O ATOM 235 CB MET A 138 -7.683 14.013 0.495 1.00 0.00 C ATOM 236 CG MET A 138 -8.917 14.269 -0.383 1.00 0.00 C ATOM 237 SD MET A 138 -10.297 13.100 -0.177 1.00 0.00 S ATOM 238 CE MET A 138 -10.761 13.458 1.538 1.00 0.00 C ATOM 0 H MET A 138 -5.612 13.081 1.621 1.00 0.00 H new ATOM 0 HA MET A 138 -8.067 11.959 0.590 1.00 0.00 H new ATOM 0 HB2 MET A 138 -7.927 14.215 1.538 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.885 14.701 0.216 1.00 0.00 H new ATOM 0 HG2 MET A 138 -9.284 15.274 -0.176 1.00 0.00 H new ATOM 0 HG3 MET A 138 -8.605 14.253 -1.427 1.00 0.00 H new ATOM 0 HE1 MET A 138 -11.765 13.080 1.730 1.00 0.00 H new ATOM 0 HE2 MET A 138 -10.056 12.974 2.214 1.00 0.00 H new ATOM 0 HE3 MET A 138 -10.741 14.535 1.703 1.00 0.00 H new ATOM 248 N ILE A 139 -7.204 11.130 -1.585 1.00 0.00 N ATOM 249 CA ILE A 139 -7.035 10.761 -2.974 1.00 0.00 C ATOM 250 C ILE A 139 -8.180 11.472 -3.677 1.00 0.00 C ATOM 251 O ILE A 139 -9.342 11.285 -3.315 1.00 0.00 O ATOM 252 CB ILE A 139 -7.129 9.238 -3.156 1.00 0.00 C ATOM 253 CG1 ILE A 139 -6.161 8.459 -2.232 1.00 0.00 C ATOM 254 CG2 ILE A 139 -6.918 8.898 -4.646 1.00 0.00 C ATOM 255 CD1 ILE A 139 -4.825 8.090 -2.869 1.00 0.00 C ATOM 0 H ILE A 139 -7.742 10.450 -1.047 1.00 0.00 H new ATOM 0 HA ILE A 139 -6.060 11.042 -3.371 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.125 8.914 -2.853 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -5.970 9.058 -1.342 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -6.654 7.545 -1.901 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -6.983 7.819 -4.786 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -7.687 9.388 -5.243 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -5.935 9.246 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -4.215 7.547 -2.147 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -5.000 7.461 -3.742 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -4.304 8.998 -3.174 1.00 0.00 H new ATOM 267 N HIS A 140 -7.853 12.314 -4.645 1.00 0.00 N ATOM 268 CA HIS A 140 -8.829 13.051 -5.419 1.00 0.00 C ATOM 269 C HIS A 140 -9.228 12.119 -6.557 1.00 0.00 C ATOM 270 O HIS A 140 -8.498 11.967 -7.536 1.00 0.00 O ATOM 271 CB HIS A 140 -8.217 14.392 -5.845 1.00 0.00 C ATOM 272 CG HIS A 140 -7.825 15.230 -4.641 1.00 0.00 C ATOM 273 ND1 HIS A 140 -6.803 14.938 -3.759 1.00 0.00 N ATOM 274 CD2 HIS A 140 -8.473 16.341 -4.165 1.00 0.00 C ATOM 275 CE1 HIS A 140 -6.840 15.839 -2.770 1.00 0.00 C ATOM 276 NE2 HIS A 140 -7.832 16.723 -2.979 1.00 0.00 N ATOM 0 H HIS A 140 -6.888 12.504 -4.916 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.732 13.326 -4.874 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -7.340 14.212 -6.466 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.933 14.942 -6.456 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.321 16.831 -4.620 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.169 15.854 -1.924 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -8.072 17.519 -2.388 1.00 0.00 H new ATOM 284 N PHE A 141 -10.324 11.386 -6.372 1.00 0.00 N ATOM 285 CA PHE A 141 -10.791 10.369 -7.305 1.00 0.00 C ATOM 286 C PHE A 141 -11.407 10.977 -8.560 1.00 0.00 C ATOM 287 O PHE A 141 -11.617 10.261 -9.536 1.00 0.00 O ATOM 288 CB PHE A 141 -11.784 9.459 -6.604 1.00 0.00 C ATOM 289 CG PHE A 141 -11.088 8.387 -5.800 1.00 0.00 C ATOM 290 CD1 PHE A 141 -10.633 7.222 -6.443 1.00 0.00 C ATOM 291 CD2 PHE A 141 -10.857 8.563 -4.426 1.00 0.00 C ATOM 292 CE1 PHE A 141 -9.989 6.220 -5.703 1.00 0.00 C ATOM 293 CE2 PHE A 141 -10.241 7.541 -3.686 1.00 0.00 C ATOM 294 CZ PHE A 141 -9.817 6.361 -4.317 1.00 0.00 C ATOM 0 H PHE A 141 -10.923 11.486 -5.552 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.929 9.787 -7.631 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.420 10.052 -5.946 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.436 8.994 -7.343 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.779 7.099 -7.506 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.152 9.481 -3.940 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -9.623 5.335 -6.202 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.092 7.664 -2.623 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.362 5.568 -3.741 1.00 0.00 H new ATOM 304 N GLY A 142 -11.731 12.268 -8.554 1.00 0.00 N ATOM 305 CA GLY A 142 -12.315 12.979 -9.683 1.00 0.00 C ATOM 306 C GLY A 142 -13.809 12.692 -9.839 1.00 0.00 C ATOM 307 O GLY A 142 -14.571 13.593 -10.184 1.00 0.00 O ATOM 0 H GLY A 142 -11.589 12.864 -7.738 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -12.165 14.051 -9.552 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -11.795 12.694 -10.598 1.00 0.00 H new ATOM 311 N ASN A 143 -14.253 11.465 -9.550 1.00 0.00 N ATOM 312 CA ASN A 143 -15.664 11.132 -9.450 1.00 0.00 C ATOM 313 C ASN A 143 -16.278 11.793 -8.222 1.00 0.00 C ATOM 314 O ASN A 143 -15.562 12.229 -7.321 1.00 0.00 O ATOM 315 CB ASN A 143 -15.852 9.614 -9.342 1.00 0.00 C ATOM 316 CG ASN A 143 -17.130 9.193 -10.015 1.00 0.00 C ATOM 317 OD1 ASN A 143 -18.201 9.294 -9.422 1.00 0.00 O ATOM 318 ND2 ASN A 143 -17.054 8.722 -11.241 1.00 0.00 N ATOM 0 H ASN A 143 -13.633 10.674 -9.379 1.00 0.00 H new ATOM 0 HA ASN A 143 -16.160 11.496 -10.350 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.006 9.103 -9.802 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -15.871 9.318 -8.293 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -17.901 8.428 -11.728 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -16.148 8.651 -11.705 1.00 0.00 H new ATOM 325 N ASP A 144 -17.601 11.735 -8.115 1.00 0.00 N ATOM 326 CA ASP A 144 -18.311 12.063 -6.890 1.00 0.00 C ATOM 327 C ASP A 144 -18.144 10.949 -5.875 1.00 0.00 C ATOM 328 O ASP A 144 -17.631 11.172 -4.776 1.00 0.00 O ATOM 329 CB ASP A 144 -19.817 12.257 -7.155 1.00 0.00 C ATOM 330 CG ASP A 144 -20.147 13.552 -7.874 1.00 0.00 C ATOM 331 OD1 ASP A 144 -20.029 14.629 -7.253 1.00 0.00 O ATOM 332 OD2 ASP A 144 -20.559 13.500 -9.054 1.00 0.00 O ATOM 0 H ASP A 144 -18.212 11.457 -8.883 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.890 12.992 -6.506 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.184 11.419 -7.748 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.350 12.233 -6.205 1.00 0.00 H new ATOM 337 N TRP A 145 -18.649 9.758 -6.204 1.00 0.00 N ATOM 338 CA TRP A 145 -18.770 8.718 -5.200 1.00 0.00 C ATOM 339 C TRP A 145 -17.442 8.027 -4.994 1.00 0.00 C ATOM 340 O TRP A 145 -17.196 7.621 -3.871 1.00 0.00 O ATOM 341 CB TRP A 145 -19.828 7.673 -5.519 1.00 0.00 C ATOM 342 CG TRP A 145 -19.451 6.755 -6.638 1.00 0.00 C ATOM 343 CD1 TRP A 145 -19.531 7.011 -7.962 1.00 0.00 C ATOM 344 CD2 TRP A 145 -18.701 5.515 -6.522 1.00 0.00 C ATOM 345 NE1 TRP A 145 -18.960 5.972 -8.667 1.00 0.00 N ATOM 346 CE2 TRP A 145 -18.383 5.045 -7.825 1.00 0.00 C ATOM 347 CE3 TRP A 145 -18.162 4.809 -5.431 1.00 0.00 C ATOM 348 CZ2 TRP A 145 -17.586 3.910 -8.029 1.00 0.00 C ATOM 349 CZ3 TRP A 145 -17.326 3.701 -5.623 1.00 0.00 C ATOM 350 CH2 TRP A 145 -17.053 3.237 -6.921 1.00 0.00 C ATOM 0 H TRP A 145 -18.972 9.500 -7.137 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.087 9.226 -4.289 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.021 7.080 -4.625 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.759 8.178 -5.774 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.974 7.893 -8.401 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.964 5.899 -9.684 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.397 5.127 -4.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.385 3.558 -9.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.890 3.202 -4.770 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.434 2.364 -7.065 1.00 0.00 H new ATOM 361 N GLU A 146 -16.579 7.910 -6.012 1.00 0.00 N ATOM 362 CA GLU A 146 -15.263 7.310 -5.790 1.00 0.00 C ATOM 363 C GLU A 146 -14.533 8.128 -4.709 1.00 0.00 C ATOM 364 O GLU A 146 -13.716 7.583 -3.982 1.00 0.00 O ATOM 365 CB GLU A 146 -14.434 7.188 -7.092 1.00 0.00 C ATOM 366 CG GLU A 146 -15.102 6.191 -8.055 1.00 0.00 C ATOM 367 CD GLU A 146 -14.336 5.901 -9.354 1.00 0.00 C ATOM 368 OE1 GLU A 146 -13.450 5.010 -9.341 1.00 0.00 O ATOM 369 OE2 GLU A 146 -14.700 6.480 -10.409 1.00 0.00 O ATOM 0 H GLU A 146 -16.762 8.213 -6.968 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.394 6.285 -5.445 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.347 8.164 -7.570 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.422 6.857 -6.858 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.253 5.250 -7.526 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.090 6.572 -8.315 1.00 0.00 H new ATOM 376 N ASP A 147 -14.877 9.415 -4.551 1.00 0.00 N ATOM 377 CA ASP A 147 -14.275 10.313 -3.579 1.00 0.00 C ATOM 378 C ASP A 147 -15.019 10.228 -2.247 1.00 0.00 C ATOM 379 O ASP A 147 -14.414 10.034 -1.191 1.00 0.00 O ATOM 380 CB ASP A 147 -14.359 11.719 -4.171 1.00 0.00 C ATOM 381 CG ASP A 147 -13.120 12.539 -3.872 1.00 0.00 C ATOM 382 OD1 ASP A 147 -13.038 13.137 -2.780 1.00 0.00 O ATOM 383 OD2 ASP A 147 -12.280 12.658 -4.791 1.00 0.00 O ATOM 0 H ASP A 147 -15.600 9.862 -5.114 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.238 10.045 -3.379 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.496 11.650 -5.250 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.236 12.228 -3.771 1.00 0.00 H new ATOM 388 N ARG A 148 -16.356 10.315 -2.290 1.00 0.00 N ATOM 389 CA ARG A 148 -17.181 10.261 -1.098 1.00 0.00 C ATOM 390 C ARG A 148 -17.039 8.905 -0.419 1.00 0.00 C ATOM 391 O ARG A 148 -16.741 8.852 0.770 1.00 0.00 O ATOM 392 CB ARG A 148 -18.649 10.581 -1.417 1.00 0.00 C ATOM 393 CG ARG A 148 -19.481 10.457 -0.138 1.00 0.00 C ATOM 394 CD ARG A 148 -20.977 10.662 -0.363 1.00 0.00 C ATOM 395 NE ARG A 148 -21.730 9.497 0.113 1.00 0.00 N ATOM 396 CZ ARG A 148 -22.449 8.629 -0.592 1.00 0.00 C ATOM 397 NH1 ARG A 148 -22.602 8.762 -1.907 1.00 0.00 N ATOM 398 NH2 ARG A 148 -22.987 7.599 0.038 1.00 0.00 N ATOM 0 H ARG A 148 -16.885 10.424 -3.155 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.832 11.027 -0.405 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -18.734 11.589 -1.824 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.026 9.897 -2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.319 9.471 0.297 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.127 11.188 0.589 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.311 11.558 0.161 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.173 10.821 -1.423 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.698 9.331 1.119 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -22.163 9.543 -2.395 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -23.158 8.083 -2.427 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.846 7.485 1.042 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -23.543 6.918 -0.480 1.00 0.00 H new ATOM 412 N TYR A 149 -17.330 7.830 -1.150 1.00 0.00 N ATOM 413 CA TYR A 149 -17.334 6.468 -0.667 1.00 0.00 C ATOM 414 C TYR A 149 -16.003 6.145 0.001 1.00 0.00 C ATOM 415 O TYR A 149 -15.976 5.440 1.009 1.00 0.00 O ATOM 416 CB TYR A 149 -17.621 5.507 -1.820 1.00 0.00 C ATOM 417 CG TYR A 149 -17.776 4.064 -1.408 1.00 0.00 C ATOM 418 CD1 TYR A 149 -18.976 3.635 -0.821 1.00 0.00 C ATOM 419 CD2 TYR A 149 -16.718 3.162 -1.605 1.00 0.00 C ATOM 420 CE1 TYR A 149 -19.110 2.296 -0.416 1.00 0.00 C ATOM 421 CE2 TYR A 149 -16.842 1.817 -1.225 1.00 0.00 C ATOM 422 CZ TYR A 149 -18.043 1.386 -0.604 1.00 0.00 C ATOM 423 OH TYR A 149 -18.201 0.103 -0.185 1.00 0.00 O ATOM 0 H TYR A 149 -17.579 7.898 -2.137 1.00 0.00 H new ATOM 0 HA TYR A 149 -18.122 6.352 0.077 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.532 5.827 -2.325 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.812 5.579 -2.547 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.791 4.329 -0.681 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -15.799 3.507 -2.054 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -20.030 1.961 0.040 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -16.036 1.121 -1.402 1.00 0.00 H new ATOM 0 HH TYR A 149 -17.388 -0.407 -0.380 1.00 0.00 H new ATOM 433 N TYR A 150 -14.909 6.686 -0.543 1.00 0.00 N ATOM 434 CA TYR A 150 -13.601 6.594 0.062 1.00 0.00 C ATOM 435 C TYR A 150 -13.599 7.266 1.437 1.00 0.00 C ATOM 436 O TYR A 150 -13.404 6.569 2.434 1.00 0.00 O ATOM 437 CB TYR A 150 -12.542 7.176 -0.890 1.00 0.00 C ATOM 438 CG TYR A 150 -11.158 7.299 -0.294 1.00 0.00 C ATOM 439 CD1 TYR A 150 -10.352 6.156 -0.153 1.00 0.00 C ATOM 440 CD2 TYR A 150 -10.666 8.560 0.092 1.00 0.00 C ATOM 441 CE1 TYR A 150 -9.082 6.254 0.440 1.00 0.00 C ATOM 442 CE2 TYR A 150 -9.384 8.673 0.652 1.00 0.00 C ATOM 443 CZ TYR A 150 -8.598 7.515 0.853 1.00 0.00 C ATOM 444 OH TYR A 150 -7.385 7.609 1.457 1.00 0.00 O ATOM 0 H TYR A 150 -14.919 7.202 -1.423 1.00 0.00 H new ATOM 0 HA TYR A 150 -13.344 5.548 0.227 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.486 6.547 -1.778 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.871 8.162 -1.218 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.710 5.199 -0.502 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.275 9.441 -0.043 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.479 5.369 0.579 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.998 9.643 0.929 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.092 8.544 1.458 1.00 0.00 H new ATOM 454 N ARG A 151 -13.819 8.586 1.535 1.00 0.00 N ATOM 455 CA ARG A 151 -13.723 9.285 2.827 1.00 0.00 C ATOM 456 C ARG A 151 -14.677 8.720 3.883 1.00 0.00 C ATOM 457 O ARG A 151 -14.301 8.610 5.056 1.00 0.00 O ATOM 458 CB ARG A 151 -13.858 10.809 2.664 1.00 0.00 C ATOM 459 CG ARG A 151 -15.205 11.300 2.110 1.00 0.00 C ATOM 460 CD ARG A 151 -15.447 12.769 2.461 1.00 0.00 C ATOM 461 NE ARG A 151 -16.793 13.213 2.062 1.00 0.00 N ATOM 462 CZ ARG A 151 -17.111 13.956 0.995 1.00 0.00 C ATOM 463 NH1 ARG A 151 -16.188 14.328 0.115 1.00 0.00 N ATOM 464 NH2 ARG A 151 -18.376 14.314 0.812 1.00 0.00 N ATOM 0 H ARG A 151 -14.062 9.185 0.746 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.719 9.095 3.207 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -13.692 11.276 3.635 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -13.065 11.158 2.003 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -15.223 11.175 1.027 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -16.012 10.689 2.515 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.321 12.912 3.534 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.699 13.389 1.967 1.00 0.00 H new ATOM 0 HE ARG A 151 -17.565 12.924 2.662 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.216 14.047 0.246 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.451 14.894 -0.692 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -19.090 14.023 1.480 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -18.634 14.880 0.004 1.00 0.00 H new ATOM 478 N GLU A 152 -15.858 8.272 3.463 1.00 0.00 N ATOM 479 CA GLU A 152 -16.852 7.696 4.355 1.00 0.00 C ATOM 480 C GLU A 152 -16.407 6.360 4.946 1.00 0.00 C ATOM 481 O GLU A 152 -16.942 5.973 5.987 1.00 0.00 O ATOM 482 CB GLU A 152 -18.183 7.492 3.619 1.00 0.00 C ATOM 483 CG GLU A 152 -18.993 8.782 3.443 1.00 0.00 C ATOM 484 CD GLU A 152 -20.480 8.446 3.307 1.00 0.00 C ATOM 485 OE1 GLU A 152 -20.912 7.922 2.259 1.00 0.00 O ATOM 486 OE2 GLU A 152 -21.227 8.656 4.290 1.00 0.00 O ATOM 0 H GLU A 152 -16.151 8.300 2.486 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.977 8.405 5.173 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.983 7.062 2.638 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.785 6.768 4.168 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.836 9.440 4.298 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -18.650 9.320 2.559 1.00 0.00 H new ATOM 493 N ASN A 153 -15.465 5.640 4.327 1.00 0.00 N ATOM 494 CA ASN A 153 -15.172 4.240 4.657 1.00 0.00 C ATOM 495 C ASN A 153 -13.675 3.965 4.795 1.00 0.00 C ATOM 496 O ASN A 153 -13.277 2.832 5.065 1.00 0.00 O ATOM 497 CB ASN A 153 -15.825 3.316 3.620 1.00 0.00 C ATOM 498 CG ASN A 153 -17.344 3.466 3.625 1.00 0.00 C ATOM 499 OD1 ASN A 153 -18.008 3.196 4.625 1.00 0.00 O ATOM 500 ND2 ASN A 153 -17.903 3.965 2.539 1.00 0.00 N ATOM 0 H ASN A 153 -14.881 6.014 3.579 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.601 4.032 5.637 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -15.437 3.547 2.628 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.559 2.281 3.833 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -18.908 4.136 2.515 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -17.330 4.180 1.723 1.00 0.00 H new ATOM 507 N MET A 154 -12.825 4.986 4.651 1.00 0.00 N ATOM 508 CA MET A 154 -11.373 4.858 4.547 1.00 0.00 C ATOM 509 C MET A 154 -10.711 4.157 5.735 1.00 0.00 C ATOM 510 O MET A 154 -9.615 3.627 5.571 1.00 0.00 O ATOM 511 CB MET A 154 -10.712 6.225 4.288 1.00 0.00 C ATOM 512 CG MET A 154 -11.134 7.271 5.329 1.00 0.00 C ATOM 513 SD MET A 154 -10.145 8.788 5.492 1.00 0.00 S ATOM 514 CE MET A 154 -9.744 9.145 3.772 1.00 0.00 C ATOM 0 H MET A 154 -13.141 5.954 4.602 1.00 0.00 H new ATOM 0 HA MET A 154 -11.207 4.206 3.690 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.628 6.113 4.305 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.981 6.575 3.292 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.159 7.567 5.104 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.150 6.781 6.302 1.00 0.00 H new ATOM 0 HE1 MET A 154 -9.584 10.216 3.650 1.00 0.00 H new ATOM 0 HE2 MET A 154 -8.838 8.609 3.491 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.567 8.826 3.133 1.00 0.00 H new ATOM 524 N TYR A 155 -11.358 4.105 6.903 1.00 0.00 N ATOM 525 CA TYR A 155 -10.880 3.379 8.078 1.00 0.00 C ATOM 526 C TYR A 155 -10.705 1.877 7.827 1.00 0.00 C ATOM 527 O TYR A 155 -9.974 1.216 8.566 1.00 0.00 O ATOM 528 CB TYR A 155 -11.826 3.629 9.261 1.00 0.00 C ATOM 529 CG TYR A 155 -13.290 3.396 8.940 1.00 0.00 C ATOM 530 CD1 TYR A 155 -13.841 2.098 8.988 1.00 0.00 C ATOM 531 CD2 TYR A 155 -14.102 4.490 8.583 1.00 0.00 C ATOM 532 CE1 TYR A 155 -15.194 1.894 8.660 1.00 0.00 C ATOM 533 CE2 TYR A 155 -15.451 4.288 8.257 1.00 0.00 C ATOM 534 CZ TYR A 155 -16.000 2.984 8.268 1.00 0.00 C ATOM 535 OH TYR A 155 -17.299 2.762 7.932 1.00 0.00 O ATOM 0 H TYR A 155 -12.248 4.578 7.059 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.887 3.762 8.314 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -11.538 2.979 10.087 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -11.699 4.656 9.604 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -13.224 1.260 9.277 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -13.685 5.486 8.560 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -15.616 0.901 8.708 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -16.073 5.131 7.996 1.00 0.00 H new ATOM 0 HH TYR A 155 -17.723 3.611 7.686 1.00 0.00 H new ATOM 545 N ARG A 156 -11.372 1.315 6.813 1.00 0.00 N ATOM 546 CA ARG A 156 -11.269 -0.107 6.481 1.00 0.00 C ATOM 547 C ARG A 156 -9.946 -0.403 5.778 1.00 0.00 C ATOM 548 O ARG A 156 -9.461 -1.532 5.817 1.00 0.00 O ATOM 549 CB ARG A 156 -12.452 -0.519 5.591 1.00 0.00 C ATOM 550 CG ARG A 156 -13.811 -0.319 6.288 1.00 0.00 C ATOM 551 CD ARG A 156 -15.001 -0.801 5.449 1.00 0.00 C ATOM 552 NE ARG A 156 -15.006 -2.267 5.321 1.00 0.00 N ATOM 553 CZ ARG A 156 -15.761 -3.026 4.519 1.00 0.00 C ATOM 554 NH1 ARG A 156 -16.599 -2.503 3.629 1.00 0.00 N ATOM 555 NH2 ARG A 156 -15.647 -4.342 4.624 1.00 0.00 N ATOM 0 H ARG A 156 -11.999 1.836 6.200 1.00 0.00 H new ATOM 0 HA ARG A 156 -11.299 -0.686 7.404 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.430 0.064 4.670 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.343 -1.566 5.308 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.806 -0.853 7.238 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -13.942 0.739 6.517 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.932 -0.471 5.911 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.958 -0.347 4.459 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.350 -2.768 5.920 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.682 -1.490 3.541 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.159 -3.115 3.035 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.999 -4.745 5.301 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -16.207 -4.952 4.028 1.00 0.00 H new ATOM 569 N TYR A 157 -9.355 0.593 5.117 1.00 0.00 N ATOM 570 CA TYR A 157 -8.069 0.425 4.467 1.00 0.00 C ATOM 571 C TYR A 157 -6.968 0.406 5.537 1.00 0.00 C ATOM 572 O TYR A 157 -7.149 0.978 6.614 1.00 0.00 O ATOM 573 CB TYR A 157 -7.865 1.560 3.454 1.00 0.00 C ATOM 574 CG TYR A 157 -8.973 1.674 2.421 1.00 0.00 C ATOM 575 CD1 TYR A 157 -9.457 0.531 1.754 1.00 0.00 C ATOM 576 CD2 TYR A 157 -9.577 2.921 2.190 1.00 0.00 C ATOM 577 CE1 TYR A 157 -10.570 0.621 0.901 1.00 0.00 C ATOM 578 CE2 TYR A 157 -10.701 3.018 1.354 1.00 0.00 C ATOM 579 CZ TYR A 157 -11.199 1.870 0.704 1.00 0.00 C ATOM 580 OH TYR A 157 -12.312 1.986 -0.065 1.00 0.00 O ATOM 0 H TYR A 157 -9.755 1.527 5.021 1.00 0.00 H new ATOM 0 HA TYR A 157 -8.028 -0.519 3.924 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.786 2.504 3.993 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.917 1.407 2.939 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.969 -0.421 1.899 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.175 3.808 2.657 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.942 -0.260 0.399 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.185 3.973 1.209 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.773 1.122 -0.106 1.00 0.00 H new ATOM 590 N PRO A 158 -5.802 -0.198 5.266 1.00 0.00 N ATOM 591 CA PRO A 158 -4.642 -0.118 6.137 1.00 0.00 C ATOM 592 C PRO A 158 -4.115 1.312 6.243 1.00 0.00 C ATOM 593 O PRO A 158 -4.547 2.230 5.539 1.00 0.00 O ATOM 594 CB PRO A 158 -3.567 -1.038 5.550 1.00 0.00 C ATOM 595 CG PRO A 158 -4.165 -1.611 4.281 1.00 0.00 C ATOM 596 CD PRO A 158 -5.532 -0.987 4.090 1.00 0.00 C ATOM 0 HA PRO A 158 -4.916 -0.428 7.146 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.652 -0.485 5.337 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.304 -1.830 6.251 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -3.524 -1.396 3.426 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -4.247 -2.696 4.353 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.550 -0.365 3.195 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -6.293 -1.757 3.959 1.00 0.00 H new ATOM 604 N ASN A 159 -3.103 1.463 7.088 1.00 0.00 N ATOM 605 CA ASN A 159 -2.363 2.687 7.345 1.00 0.00 C ATOM 606 C ASN A 159 -0.863 2.529 7.062 1.00 0.00 C ATOM 607 O ASN A 159 -0.080 3.427 7.386 1.00 0.00 O ATOM 608 CB ASN A 159 -2.634 3.144 8.783 1.00 0.00 C ATOM 609 CG ASN A 159 -1.929 2.252 9.788 1.00 0.00 C ATOM 610 OD1 ASN A 159 -2.479 1.280 10.291 1.00 0.00 O ATOM 611 ND2 ASN A 159 -0.693 2.577 10.111 1.00 0.00 N ATOM 0 H ASN A 159 -2.757 0.683 7.646 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.710 3.458 6.658 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -2.298 4.173 8.909 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -3.707 3.133 8.974 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -0.179 2.016 10.790 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.251 3.390 9.682 1.00 0.00 H new ATOM 618 N GLN A 160 -0.459 1.399 6.478 1.00 0.00 N ATOM 619 CA GLN A 160 0.908 1.026 6.131 1.00 0.00 C ATOM 620 C GLN A 160 0.893 0.332 4.762 1.00 0.00 C ATOM 621 O GLN A 160 -0.159 -0.143 4.323 1.00 0.00 O ATOM 622 CB GLN A 160 1.456 0.080 7.226 1.00 0.00 C ATOM 623 CG GLN A 160 2.647 0.644 8.023 1.00 0.00 C ATOM 624 CD GLN A 160 2.459 0.578 9.542 1.00 0.00 C ATOM 625 OE1 GLN A 160 1.375 0.814 10.061 1.00 0.00 O ATOM 626 NE2 GLN A 160 3.509 0.321 10.293 1.00 0.00 N ATOM 0 H GLN A 160 -1.126 0.673 6.219 1.00 0.00 H new ATOM 0 HA GLN A 160 1.552 1.904 6.073 1.00 0.00 H new ATOM 0 HB2 GLN A 160 0.650 -0.156 7.921 1.00 0.00 H new ATOM 0 HB3 GLN A 160 1.759 -0.857 6.759 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.547 0.092 7.753 1.00 0.00 H new ATOM 0 HG3 GLN A 160 2.810 1.681 7.731 1.00 0.00 H new ATOM 0 HE21 GLN A 160 4.411 0.125 9.859 1.00 0.00 H new ATOM 0 HE22 GLN A 160 3.421 0.318 11.309 1.00 0.00 H new ATOM 635 N VAL A 161 2.056 0.233 4.113 1.00 0.00 N ATOM 636 CA VAL A 161 2.268 -0.502 2.863 1.00 0.00 C ATOM 637 C VAL A 161 3.534 -1.361 3.016 1.00 0.00 C ATOM 638 O VAL A 161 4.451 -0.952 3.740 1.00 0.00 O ATOM 639 CB VAL A 161 2.313 0.463 1.647 1.00 0.00 C ATOM 640 CG1 VAL A 161 1.077 1.380 1.571 1.00 0.00 C ATOM 641 CG2 VAL A 161 3.548 1.378 1.602 1.00 0.00 C ATOM 0 H VAL A 161 2.907 0.679 4.456 1.00 0.00 H new ATOM 0 HA VAL A 161 1.430 -1.170 2.662 1.00 0.00 H new ATOM 0 HB VAL A 161 2.347 -0.221 0.799 1.00 0.00 H new ATOM 0 HG11 VAL A 161 1.161 2.033 0.702 1.00 0.00 H new ATOM 0 HG12 VAL A 161 0.177 0.771 1.481 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.017 1.985 2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 161 3.496 2.017 0.720 1.00 0.00 H new ATOM 0 HG22 VAL A 161 3.574 1.998 2.498 1.00 0.00 H new ATOM 0 HG23 VAL A 161 4.451 0.769 1.555 1.00 0.00 H new ATOM 651 N TYR A 162 3.589 -2.532 2.368 1.00 0.00 N ATOM 652 CA TYR A 162 4.756 -3.419 2.353 1.00 0.00 C ATOM 653 C TYR A 162 5.490 -3.270 1.018 1.00 0.00 C ATOM 654 O TYR A 162 4.876 -2.924 0.010 1.00 0.00 O ATOM 655 CB TYR A 162 4.364 -4.899 2.464 1.00 0.00 C ATOM 656 CG TYR A 162 3.695 -5.422 3.720 1.00 0.00 C ATOM 657 CD1 TYR A 162 2.309 -5.238 3.905 1.00 0.00 C ATOM 658 CD2 TYR A 162 4.441 -6.124 4.689 1.00 0.00 C ATOM 659 CE1 TYR A 162 1.686 -5.683 5.084 1.00 0.00 C ATOM 660 CE2 TYR A 162 3.821 -6.574 5.870 1.00 0.00 C ATOM 661 CZ TYR A 162 2.447 -6.323 6.087 1.00 0.00 C ATOM 662 OH TYR A 162 1.875 -6.636 7.283 1.00 0.00 O ATOM 0 H TYR A 162 2.804 -2.896 1.828 1.00 0.00 H new ATOM 0 HA TYR A 162 5.374 -3.136 3.206 1.00 0.00 H new ATOM 0 HB2 TYR A 162 3.700 -5.120 1.629 1.00 0.00 H new ATOM 0 HB3 TYR A 162 5.271 -5.485 2.314 1.00 0.00 H new ATOM 0 HD1 TYR A 162 1.724 -4.753 3.138 1.00 0.00 H new ATOM 0 HD2 TYR A 162 5.491 -6.317 4.525 1.00 0.00 H new ATOM 0 HE1 TYR A 162 0.625 -5.535 5.223 1.00 0.00 H new ATOM 0 HE2 TYR A 162 4.395 -7.111 6.610 1.00 0.00 H new ATOM 0 HH TYR A 162 2.537 -7.073 7.858 1.00 0.00 H new ATOM 672 N TYR A 163 6.785 -3.592 0.981 1.00 0.00 N ATOM 673 CA TYR A 163 7.665 -3.233 -0.134 1.00 0.00 C ATOM 674 C TYR A 163 8.993 -3.980 -0.030 1.00 0.00 C ATOM 675 O TYR A 163 9.098 -4.955 0.716 1.00 0.00 O ATOM 676 CB TYR A 163 7.866 -1.700 -0.162 1.00 0.00 C ATOM 677 CG TYR A 163 8.425 -1.105 1.115 1.00 0.00 C ATOM 678 CD1 TYR A 163 7.541 -0.743 2.148 1.00 0.00 C ATOM 679 CD2 TYR A 163 9.809 -0.866 1.262 1.00 0.00 C ATOM 680 CE1 TYR A 163 8.027 -0.151 3.315 1.00 0.00 C ATOM 681 CE2 TYR A 163 10.307 -0.268 2.435 1.00 0.00 C ATOM 682 CZ TYR A 163 9.402 0.092 3.460 1.00 0.00 C ATOM 683 OH TYR A 163 9.827 0.783 4.546 1.00 0.00 O ATOM 0 H TYR A 163 7.254 -4.110 1.724 1.00 0.00 H new ATOM 0 HA TYR A 163 7.202 -3.531 -1.075 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.536 -1.451 -0.985 1.00 0.00 H new ATOM 0 HB3 TYR A 163 6.908 -1.227 -0.377 1.00 0.00 H new ATOM 0 HD1 TYR A 163 6.482 -0.924 2.038 1.00 0.00 H new ATOM 0 HD2 TYR A 163 10.489 -1.144 0.470 1.00 0.00 H new ATOM 0 HE1 TYR A 163 7.345 0.120 4.107 1.00 0.00 H new ATOM 0 HE2 TYR A 163 11.365 -0.087 2.550 1.00 0.00 H new ATOM 0 HH TYR A 163 10.319 1.579 4.255 1.00 0.00 H new ATOM 693 N ARG A 164 9.959 -3.568 -0.856 1.00 0.00 N ATOM 694 CA ARG A 164 11.259 -4.166 -1.125 1.00 0.00 C ATOM 695 C ARG A 164 12.287 -3.066 -1.303 1.00 0.00 C ATOM 696 O ARG A 164 11.870 -1.924 -1.486 1.00 0.00 O ATOM 697 CB ARG A 164 11.141 -5.015 -2.392 1.00 0.00 C ATOM 698 CG ARG A 164 10.674 -6.391 -1.948 1.00 0.00 C ATOM 699 CD ARG A 164 10.390 -7.396 -3.062 1.00 0.00 C ATOM 700 NE ARG A 164 9.508 -6.862 -4.099 1.00 0.00 N ATOM 701 CZ ARG A 164 9.004 -7.582 -5.095 1.00 0.00 C ATOM 702 NH1 ARG A 164 9.653 -8.602 -5.636 1.00 0.00 N ATOM 703 NH2 ARG A 164 7.770 -7.294 -5.475 1.00 0.00 N ATOM 0 H ARG A 164 9.831 -2.719 -1.407 1.00 0.00 H new ATOM 0 HA ARG A 164 11.577 -4.799 -0.296 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.432 -4.572 -3.091 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.100 -5.078 -2.907 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.432 -6.814 -1.289 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.767 -6.271 -1.355 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.332 -7.703 -3.516 1.00 0.00 H new ATOM 0 HD3 ARG A 164 9.937 -8.289 -2.632 1.00 0.00 H new ATOM 0 HE ARG A 164 9.264 -5.873 -4.055 1.00 0.00 H new ATOM 0 HH11 ARG A 164 10.577 -8.861 -5.289 1.00 0.00 H new ATOM 0 HH12 ARG A 164 9.229 -9.129 -6.400 1.00 0.00 H new ATOM 0 HH21 ARG A 164 7.253 -6.549 -5.008 1.00 0.00 H new ATOM 0 HH22 ARG A 164 7.335 -7.817 -6.235 1.00 0.00 H new ATOM 717 N PRO A 165 13.596 -3.370 -1.265 1.00 0.00 N ATOM 718 CA PRO A 165 14.588 -2.327 -1.357 1.00 0.00 C ATOM 719 C PRO A 165 14.504 -1.730 -2.759 1.00 0.00 C ATOM 720 O PRO A 165 14.653 -2.447 -3.756 1.00 0.00 O ATOM 721 CB PRO A 165 15.931 -2.991 -1.045 1.00 0.00 C ATOM 722 CG PRO A 165 15.726 -4.451 -1.434 1.00 0.00 C ATOM 723 CD PRO A 165 14.240 -4.679 -1.176 1.00 0.00 C ATOM 0 HA PRO A 165 14.443 -1.504 -0.657 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.742 -2.537 -1.615 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.189 -2.892 0.010 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.985 -4.629 -2.478 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.345 -5.118 -0.834 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.821 -5.368 -1.909 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.081 -5.123 -0.193 1.00 0.00 H new ATOM 731 N VAL A 166 14.263 -0.420 -2.813 1.00 0.00 N ATOM 732 CA VAL A 166 14.442 0.420 -4.004 1.00 0.00 C ATOM 733 C VAL A 166 15.804 0.125 -4.643 1.00 0.00 C ATOM 734 O VAL A 166 15.893 -0.008 -5.864 1.00 0.00 O ATOM 735 CB VAL A 166 14.251 1.913 -3.625 1.00 0.00 C ATOM 736 CG1 VAL A 166 15.170 2.416 -2.498 1.00 0.00 C ATOM 737 CG2 VAL A 166 14.385 2.887 -4.801 1.00 0.00 C ATOM 0 H VAL A 166 13.927 0.105 -2.005 1.00 0.00 H new ATOM 0 HA VAL A 166 13.686 0.188 -4.754 1.00 0.00 H new ATOM 0 HB VAL A 166 13.221 1.912 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.964 3.469 -2.303 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.986 1.837 -1.593 1.00 0.00 H new ATOM 0 HG13 VAL A 166 16.211 2.299 -2.798 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.237 3.907 -4.447 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.379 2.795 -5.238 1.00 0.00 H new ATOM 0 HG23 VAL A 166 13.634 2.652 -5.555 1.00 0.00 H new ATOM 747 N ASP A 167 16.829 -0.046 -3.801 1.00 0.00 N ATOM 748 CA ASP A 167 18.165 -0.555 -4.097 1.00 0.00 C ATOM 749 C ASP A 167 18.081 -2.009 -4.568 1.00 0.00 C ATOM 750 O ASP A 167 18.379 -2.955 -3.834 1.00 0.00 O ATOM 751 CB ASP A 167 19.024 -0.440 -2.834 1.00 0.00 C ATOM 752 CG ASP A 167 20.422 -1.030 -3.018 1.00 0.00 C ATOM 753 OD1 ASP A 167 20.969 -0.958 -4.144 1.00 0.00 O ATOM 754 OD2 ASP A 167 20.929 -1.604 -2.030 1.00 0.00 O ATOM 0 H ASP A 167 16.733 0.189 -2.813 1.00 0.00 H new ATOM 0 HA ASP A 167 18.620 0.030 -4.897 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.111 0.609 -2.552 1.00 0.00 H new ATOM 0 HB3 ASP A 167 18.524 -0.950 -2.011 1.00 0.00 H new ATOM 759 N GLN A 168 17.593 -2.184 -5.791 1.00 0.00 N ATOM 760 CA GLN A 168 17.507 -3.430 -6.530 1.00 0.00 C ATOM 761 C GLN A 168 16.927 -3.142 -7.908 1.00 0.00 C ATOM 762 O GLN A 168 17.404 -3.684 -8.907 1.00 0.00 O ATOM 763 CB GLN A 168 16.611 -4.467 -5.816 1.00 0.00 C ATOM 764 CG GLN A 168 17.311 -5.828 -5.866 1.00 0.00 C ATOM 765 CD GLN A 168 16.455 -6.938 -5.273 1.00 0.00 C ATOM 766 OE1 GLN A 168 15.651 -7.555 -5.972 1.00 0.00 O ATOM 767 NE2 GLN A 168 16.618 -7.246 -4.000 1.00 0.00 N ATOM 0 H GLN A 168 17.221 -1.400 -6.327 1.00 0.00 H new ATOM 0 HA GLN A 168 18.510 -3.849 -6.604 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.436 -4.169 -4.782 1.00 0.00 H new ATOM 0 HB3 GLN A 168 15.637 -4.524 -6.301 1.00 0.00 H new ATOM 0 HG2 GLN A 168 17.553 -6.072 -6.900 1.00 0.00 H new ATOM 0 HG3 GLN A 168 18.254 -5.770 -5.323 1.00 0.00 H new ATOM 0 HE21 GLN A 168 17.287 -6.727 -3.431 1.00 0.00 H new ATOM 0 HE22 GLN A 168 16.075 -8.003 -3.585 1.00 0.00 H new ATOM 776 N TYR A 169 15.898 -2.298 -7.938 1.00 0.00 N ATOM 777 CA TYR A 169 15.068 -2.006 -9.088 1.00 0.00 C ATOM 778 C TYR A 169 15.753 -1.054 -10.072 1.00 0.00 C ATOM 779 O TYR A 169 16.879 -0.589 -9.867 1.00 0.00 O ATOM 780 CB TYR A 169 13.742 -1.433 -8.570 1.00 0.00 C ATOM 781 CG TYR A 169 12.791 -2.467 -8.004 1.00 0.00 C ATOM 782 CD1 TYR A 169 12.807 -2.773 -6.629 1.00 0.00 C ATOM 783 CD2 TYR A 169 11.794 -3.015 -8.837 1.00 0.00 C ATOM 784 CE1 TYR A 169 11.838 -3.634 -6.081 1.00 0.00 C ATOM 785 CE2 TYR A 169 10.801 -3.844 -8.294 1.00 0.00 C ATOM 786 CZ TYR A 169 10.835 -4.168 -6.923 1.00 0.00 C ATOM 787 OH TYR A 169 9.863 -4.959 -6.411 1.00 0.00 O ATOM 0 H TYR A 169 15.611 -1.774 -7.111 1.00 0.00 H new ATOM 0 HA TYR A 169 14.887 -2.921 -9.652 1.00 0.00 H new ATOM 0 HB2 TYR A 169 13.957 -0.694 -7.798 1.00 0.00 H new ATOM 0 HB3 TYR A 169 13.244 -0.907 -9.385 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.567 -2.345 -5.992 1.00 0.00 H new ATOM 0 HD2 TYR A 169 11.795 -2.796 -9.895 1.00 0.00 H new ATOM 0 HE1 TYR A 169 11.860 -3.884 -5.031 1.00 0.00 H new ATOM 0 HE2 TYR A 169 10.014 -4.232 -8.924 1.00 0.00 H new ATOM 0 HH TYR A 169 9.256 -5.238 -7.128 1.00 0.00 H new ATOM 797 N ASN A 170 15.039 -0.781 -11.166 1.00 0.00 N ATOM 798 CA ASN A 170 15.473 -0.021 -12.336 1.00 0.00 C ATOM 799 C ASN A 170 14.672 1.273 -12.536 1.00 0.00 C ATOM 800 O ASN A 170 15.112 2.161 -13.262 1.00 0.00 O ATOM 801 CB ASN A 170 15.362 -0.923 -13.580 1.00 0.00 C ATOM 802 CG ASN A 170 13.976 -1.537 -13.767 1.00 0.00 C ATOM 803 OD1 ASN A 170 12.998 -0.869 -14.078 1.00 0.00 O ATOM 804 ND2 ASN A 170 13.822 -2.825 -13.505 1.00 0.00 N ATOM 0 H ASN A 170 14.078 -1.108 -11.263 1.00 0.00 H new ATOM 0 HA ASN A 170 16.507 0.284 -12.177 1.00 0.00 H new ATOM 0 HB2 ASN A 170 15.614 -0.340 -14.465 1.00 0.00 H new ATOM 0 HB3 ASN A 170 16.098 -1.724 -13.505 1.00 0.00 H new ATOM 0 HD21 ASN A 170 12.897 -3.250 -13.563 1.00 0.00 H new ATOM 0 HD22 ASN A 170 14.629 -3.393 -13.245 1.00 0.00 H new ATOM 811 N ASN A 171 13.511 1.416 -11.892 1.00 0.00 N ATOM 812 CA ASN A 171 12.696 2.626 -11.901 1.00 0.00 C ATOM 813 C ASN A 171 11.758 2.584 -10.698 1.00 0.00 C ATOM 814 O ASN A 171 11.383 1.488 -10.268 1.00 0.00 O ATOM 815 CB ASN A 171 11.871 2.785 -13.208 1.00 0.00 C ATOM 816 CG ASN A 171 10.964 1.641 -13.652 1.00 0.00 C ATOM 817 OD1 ASN A 171 10.495 1.585 -14.782 1.00 0.00 O ATOM 818 ND2 ASN A 171 10.580 0.747 -12.771 1.00 0.00 N ATOM 0 H ASN A 171 13.102 0.667 -11.333 1.00 0.00 H new ATOM 0 HA ASN A 171 13.364 3.485 -11.848 1.00 0.00 H new ATOM 0 HB2 ASN A 171 11.250 3.674 -13.100 1.00 0.00 H new ATOM 0 HB3 ASN A 171 12.573 2.983 -14.018 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.906 0.028 -13.034 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.955 0.771 -11.823 1.00 0.00 H new ATOM 825 N GLN A 172 11.278 3.745 -10.241 1.00 0.00 N ATOM 826 CA GLN A 172 10.338 3.839 -9.126 1.00 0.00 C ATOM 827 C GLN A 172 9.062 3.059 -9.411 1.00 0.00 C ATOM 828 O GLN A 172 8.474 2.478 -8.506 1.00 0.00 O ATOM 829 CB GLN A 172 9.961 5.311 -8.895 1.00 0.00 C ATOM 830 CG GLN A 172 8.975 5.511 -7.728 1.00 0.00 C ATOM 831 CD GLN A 172 7.601 5.982 -8.182 1.00 0.00 C ATOM 832 OE1 GLN A 172 7.341 7.172 -8.347 1.00 0.00 O ATOM 833 NE2 GLN A 172 6.691 5.056 -8.397 1.00 0.00 N ATOM 0 H GLN A 172 11.534 4.649 -10.638 1.00 0.00 H new ATOM 0 HA GLN A 172 10.823 3.419 -8.245 1.00 0.00 H new ATOM 0 HB2 GLN A 172 10.867 5.884 -8.699 1.00 0.00 H new ATOM 0 HB3 GLN A 172 9.520 5.714 -9.807 1.00 0.00 H new ATOM 0 HG2 GLN A 172 8.869 4.572 -7.184 1.00 0.00 H new ATOM 0 HG3 GLN A 172 9.390 6.238 -7.030 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.921 4.072 -8.256 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.756 5.322 -8.705 1.00 0.00 H new ATOM 842 N ASN A 173 8.577 3.147 -10.647 1.00 0.00 N ATOM 843 CA ASN A 173 7.198 2.845 -10.996 1.00 0.00 C ATOM 844 C ASN A 173 6.867 1.421 -10.689 1.00 0.00 C ATOM 845 O ASN A 173 6.114 1.127 -9.776 1.00 0.00 O ATOM 846 CB ASN A 173 6.987 3.121 -12.481 1.00 0.00 C ATOM 847 CG ASN A 173 6.869 4.613 -12.586 1.00 0.00 C ATOM 848 OD1 ASN A 173 7.844 5.342 -12.763 1.00 0.00 O ATOM 849 ND2 ASN A 173 5.695 5.101 -12.263 1.00 0.00 N ATOM 0 H ASN A 173 9.143 3.435 -11.445 1.00 0.00 H new ATOM 0 HA ASN A 173 6.538 3.478 -10.403 1.00 0.00 H new ATOM 0 HB2 ASN A 173 7.822 2.748 -13.074 1.00 0.00 H new ATOM 0 HB3 ASN A 173 6.088 2.627 -12.850 1.00 0.00 H new ATOM 0 HD21 ASN A 173 5.574 6.108 -12.153 1.00 0.00 H new ATOM 0 HD22 ASN A 173 4.903 4.474 -12.122 1.00 0.00 H new ATOM 856 N THR A 174 7.484 0.556 -11.463 1.00 0.00 N ATOM 857 CA THR A 174 7.373 -0.883 -11.372 1.00 0.00 C ATOM 858 C THR A 174 7.573 -1.373 -9.925 1.00 0.00 C ATOM 859 O THR A 174 6.836 -2.233 -9.456 1.00 0.00 O ATOM 860 CB THR A 174 8.406 -1.469 -12.339 1.00 0.00 C ATOM 861 OG1 THR A 174 8.374 -0.796 -13.588 1.00 0.00 O ATOM 862 CG2 THR A 174 8.092 -2.916 -12.644 1.00 0.00 C ATOM 0 H THR A 174 8.109 0.853 -12.212 1.00 0.00 H new ATOM 0 HA THR A 174 6.373 -1.217 -11.650 1.00 0.00 H new ATOM 0 HB THR A 174 9.377 -1.361 -11.856 1.00 0.00 H new ATOM 0 HG1 THR A 174 9.043 -1.187 -14.188 1.00 0.00 H new ATOM 0 HG21 THR A 174 8.838 -3.313 -13.333 1.00 0.00 H new ATOM 0 HG22 THR A 174 8.107 -3.494 -11.720 1.00 0.00 H new ATOM 0 HG23 THR A 174 7.104 -2.986 -13.100 1.00 0.00 H new ATOM 870 N PHE A 175 8.533 -0.800 -9.195 1.00 0.00 N ATOM 871 CA PHE A 175 8.795 -1.099 -7.793 1.00 0.00 C ATOM 872 C PHE A 175 7.581 -0.795 -6.907 1.00 0.00 C ATOM 873 O PHE A 175 7.127 -1.639 -6.132 1.00 0.00 O ATOM 874 CB PHE A 175 10.031 -0.288 -7.379 1.00 0.00 C ATOM 875 CG PHE A 175 10.134 0.039 -5.910 1.00 0.00 C ATOM 876 CD1 PHE A 175 9.985 -0.964 -4.932 1.00 0.00 C ATOM 877 CD2 PHE A 175 10.323 1.377 -5.526 1.00 0.00 C ATOM 878 CE1 PHE A 175 9.998 -0.622 -3.573 1.00 0.00 C ATOM 879 CE2 PHE A 175 10.362 1.709 -4.169 1.00 0.00 C ATOM 880 CZ PHE A 175 10.206 0.714 -3.198 1.00 0.00 C ATOM 0 H PHE A 175 9.165 -0.096 -9.577 1.00 0.00 H new ATOM 0 HA PHE A 175 8.985 -2.164 -7.662 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.922 -0.842 -7.673 1.00 0.00 H new ATOM 0 HB3 PHE A 175 10.036 0.645 -7.942 1.00 0.00 H new ATOM 0 HD1 PHE A 175 9.861 -1.995 -5.229 1.00 0.00 H new ATOM 0 HD2 PHE A 175 10.438 2.146 -6.276 1.00 0.00 H new ATOM 0 HE1 PHE A 175 9.849 -1.381 -2.820 1.00 0.00 H new ATOM 0 HE2 PHE A 175 10.513 2.736 -3.869 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.246 0.976 -2.151 1.00 0.00 H new ATOM 890 N VAL A 176 7.070 0.427 -7.000 1.00 0.00 N ATOM 891 CA VAL A 176 5.897 0.913 -6.289 1.00 0.00 C ATOM 892 C VAL A 176 4.648 0.139 -6.739 1.00 0.00 C ATOM 893 O VAL A 176 3.794 -0.160 -5.912 1.00 0.00 O ATOM 894 CB VAL A 176 5.847 2.429 -6.531 1.00 0.00 C ATOM 895 CG1 VAL A 176 4.442 3.024 -6.565 1.00 0.00 C ATOM 896 CG2 VAL A 176 6.770 3.127 -5.505 1.00 0.00 C ATOM 0 H VAL A 176 7.483 1.139 -7.603 1.00 0.00 H new ATOM 0 HA VAL A 176 5.942 0.742 -5.213 1.00 0.00 H new ATOM 0 HB VAL A 176 6.215 2.613 -7.540 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.506 4.098 -6.741 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.869 2.558 -7.367 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.946 2.841 -5.612 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.744 4.205 -5.666 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.427 2.902 -4.495 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.791 2.766 -5.630 1.00 0.00 H new ATOM 906 N HIS A 177 4.540 -0.242 -8.010 1.00 0.00 N ATOM 907 CA HIS A 177 3.453 -1.056 -8.529 1.00 0.00 C ATOM 908 C HIS A 177 3.487 -2.416 -7.821 1.00 0.00 C ATOM 909 O HIS A 177 2.473 -2.900 -7.322 1.00 0.00 O ATOM 910 CB HIS A 177 3.599 -1.160 -10.060 1.00 0.00 C ATOM 911 CG HIS A 177 2.404 -1.705 -10.805 1.00 0.00 C ATOM 912 ND1 HIS A 177 2.223 -1.645 -12.171 1.00 0.00 N ATOM 913 CD2 HIS A 177 1.306 -2.322 -10.271 1.00 0.00 C ATOM 914 CE1 HIS A 177 1.024 -2.188 -12.452 1.00 0.00 C ATOM 915 NE2 HIS A 177 0.461 -2.668 -11.329 1.00 0.00 N ATOM 0 H HIS A 177 5.224 0.015 -8.721 1.00 0.00 H new ATOM 0 HA HIS A 177 2.478 -0.611 -8.332 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.824 -0.168 -10.451 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.459 -1.793 -10.281 1.00 0.00 H new ATOM 0 HD2 HIS A 177 1.125 -2.508 -9.223 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.579 -2.232 -13.435 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -0.415 -3.186 -11.262 1.00 0.00 H new ATOM 923 N ASP A 178 4.664 -3.022 -7.698 1.00 0.00 N ATOM 924 CA ASP A 178 4.819 -4.276 -6.997 1.00 0.00 C ATOM 925 C ASP A 178 4.545 -4.097 -5.491 1.00 0.00 C ATOM 926 O ASP A 178 4.030 -5.015 -4.856 1.00 0.00 O ATOM 927 CB ASP A 178 6.228 -4.819 -7.278 1.00 0.00 C ATOM 928 CG ASP A 178 6.507 -5.263 -8.718 1.00 0.00 C ATOM 929 OD1 ASP A 178 5.576 -5.477 -9.526 1.00 0.00 O ATOM 930 OD2 ASP A 178 7.700 -5.521 -9.027 1.00 0.00 O ATOM 0 H ASP A 178 5.532 -2.651 -8.084 1.00 0.00 H new ATOM 0 HA ASP A 178 4.090 -5.003 -7.354 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.952 -4.049 -7.011 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.406 -5.667 -6.617 1.00 0.00 H new ATOM 935 N CYS A 179 4.837 -2.919 -4.916 1.00 0.00 N ATOM 936 CA CYS A 179 4.447 -2.523 -3.554 1.00 0.00 C ATOM 937 C CYS A 179 2.919 -2.517 -3.415 1.00 0.00 C ATOM 938 O CYS A 179 2.411 -3.056 -2.429 1.00 0.00 O ATOM 939 CB CYS A 179 5.110 -1.177 -3.182 1.00 0.00 C ATOM 940 SG CYS A 179 4.582 -0.244 -1.706 1.00 0.00 S ATOM 0 H CYS A 179 5.367 -2.195 -5.401 1.00 0.00 H new ATOM 0 HA CYS A 179 4.812 -3.256 -2.834 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.178 -1.366 -3.074 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.989 -0.514 -4.039 1.00 0.00 H new ATOM 945 N VAL A 180 2.173 -2.002 -4.403 1.00 0.00 N ATOM 946 CA VAL A 180 0.714 -2.108 -4.432 1.00 0.00 C ATOM 947 C VAL A 180 0.313 -3.577 -4.371 1.00 0.00 C ATOM 948 O VAL A 180 -0.429 -3.972 -3.469 1.00 0.00 O ATOM 949 CB VAL A 180 0.084 -1.382 -5.645 1.00 0.00 C ATOM 950 CG1 VAL A 180 -1.442 -1.535 -5.672 1.00 0.00 C ATOM 951 CG2 VAL A 180 0.384 0.117 -5.638 1.00 0.00 C ATOM 0 H VAL A 180 2.566 -1.502 -5.201 1.00 0.00 H new ATOM 0 HA VAL A 180 0.318 -1.596 -3.555 1.00 0.00 H new ATOM 0 HB VAL A 180 0.530 -1.851 -6.522 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.845 -1.011 -6.539 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.701 -2.592 -5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.866 -1.111 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.078 0.585 -6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.018 0.564 -4.729 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.462 0.272 -5.673 1.00 0.00 H new ATOM 961 N ASN A 181 0.814 -4.389 -5.304 1.00 0.00 N ATOM 962 CA ASN A 181 0.367 -5.769 -5.438 1.00 0.00 C ATOM 963 C ASN A 181 0.650 -6.583 -4.174 1.00 0.00 C ATOM 964 O ASN A 181 -0.160 -7.421 -3.791 1.00 0.00 O ATOM 965 CB ASN A 181 1.030 -6.434 -6.647 1.00 0.00 C ATOM 966 CG ASN A 181 0.301 -7.721 -7.008 1.00 0.00 C ATOM 967 OD1 ASN A 181 0.865 -8.809 -6.892 1.00 0.00 O ATOM 968 ND2 ASN A 181 -0.946 -7.645 -7.451 1.00 0.00 N ATOM 0 H ASN A 181 1.529 -4.111 -5.976 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.712 -5.747 -5.588 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.020 -5.752 -7.497 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.075 -6.650 -6.424 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -1.451 -8.495 -7.701 1.00 0.00 H new ATOM 0 HD22 ASN A 181 -1.400 -6.736 -7.542 1.00 0.00 H new ATOM 975 N ILE A 182 1.785 -6.334 -3.517 1.00 0.00 N ATOM 976 CA ILE A 182 2.187 -6.951 -2.257 1.00 0.00 C ATOM 977 C ILE A 182 1.316 -6.482 -1.102 1.00 0.00 C ATOM 978 O ILE A 182 0.950 -7.298 -0.255 1.00 0.00 O ATOM 979 CB ILE A 182 3.685 -6.675 -2.023 1.00 0.00 C ATOM 980 CG1 ILE A 182 4.499 -7.583 -2.966 1.00 0.00 C ATOM 981 CG2 ILE A 182 4.060 -6.858 -0.544 1.00 0.00 C ATOM 982 CD1 ILE A 182 4.631 -9.035 -2.477 1.00 0.00 C ATOM 0 H ILE A 182 2.476 -5.669 -3.865 1.00 0.00 H new ATOM 0 HA ILE A 182 2.040 -8.030 -2.314 1.00 0.00 H new ATOM 0 HB ILE A 182 3.919 -5.636 -2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 182 4.028 -7.583 -3.949 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.496 -7.160 -3.090 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.123 -6.656 -0.410 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.480 -6.166 0.067 1.00 0.00 H new ATOM 0 HG23 ILE A 182 3.844 -7.881 -0.238 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.217 -9.609 -3.195 1.00 0.00 H new ATOM 0 HD12 ILE A 182 5.130 -9.049 -1.508 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.640 -9.478 -2.381 1.00 0.00 H new ATOM 994 N THR A 183 1.042 -5.188 -1.015 1.00 0.00 N ATOM 995 CA THR A 183 0.234 -4.642 0.056 1.00 0.00 C ATOM 996 C THR A 183 -1.164 -5.257 -0.060 1.00 0.00 C ATOM 997 O THR A 183 -1.615 -5.902 0.886 1.00 0.00 O ATOM 998 CB THR A 183 0.313 -3.115 -0.040 1.00 0.00 C ATOM 999 OG1 THR A 183 1.657 -2.727 0.173 1.00 0.00 O ATOM 1000 CG2 THR A 183 -0.545 -2.350 0.962 1.00 0.00 C ATOM 0 H THR A 183 1.374 -4.493 -1.684 1.00 0.00 H new ATOM 0 HA THR A 183 0.581 -4.891 1.059 1.00 0.00 H new ATOM 0 HB THR A 183 -0.069 -2.864 -1.030 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.156 -2.803 -0.667 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.416 -1.279 0.808 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.593 -2.613 0.819 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.240 -2.611 1.976 1.00 0.00 H new ATOM 1008 N ILE A 184 -1.790 -5.188 -1.239 1.00 0.00 N ATOM 1009 CA ILE A 184 -3.076 -5.825 -1.497 1.00 0.00 C ATOM 1010 C ILE A 184 -2.999 -7.327 -1.224 1.00 0.00 C ATOM 1011 O ILE A 184 -3.890 -7.833 -0.552 1.00 0.00 O ATOM 1012 CB ILE A 184 -3.589 -5.455 -2.906 1.00 0.00 C ATOM 1013 CG1 ILE A 184 -3.971 -3.956 -2.888 1.00 0.00 C ATOM 1014 CG2 ILE A 184 -4.783 -6.342 -3.302 1.00 0.00 C ATOM 1015 CD1 ILE A 184 -4.436 -3.411 -4.237 1.00 0.00 C ATOM 0 H ILE A 184 -1.413 -4.685 -2.042 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.824 -5.443 -0.803 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.815 -5.627 -3.654 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.763 -3.803 -2.155 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -3.110 -3.377 -2.552 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -5.128 -6.064 -4.298 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.475 -7.388 -3.303 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.593 -6.203 -2.586 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.684 -2.354 -4.137 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.639 -3.528 -4.971 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -5.317 -3.961 -4.567 1.00 0.00 H new ATOM 1027 N LYS A 185 -1.945 -8.034 -1.651 1.00 0.00 N ATOM 1028 CA LYS A 185 -1.728 -9.436 -1.278 1.00 0.00 C ATOM 1029 C LYS A 185 -1.873 -9.622 0.225 1.00 0.00 C ATOM 1030 O LYS A 185 -2.603 -10.499 0.679 1.00 0.00 O ATOM 1031 CB LYS A 185 -0.367 -9.936 -1.789 1.00 0.00 C ATOM 1032 CG LYS A 185 0.315 -10.990 -0.890 1.00 0.00 C ATOM 1033 CD LYS A 185 1.336 -11.794 -1.681 1.00 0.00 C ATOM 1034 CE LYS A 185 0.568 -12.838 -2.487 1.00 0.00 C ATOM 1035 NZ LYS A 185 1.063 -12.940 -3.869 1.00 0.00 N ATOM 0 H LYS A 185 -1.223 -7.652 -2.262 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.495 -10.044 -1.758 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.502 -10.360 -2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.302 -9.082 -1.895 1.00 0.00 H new ATOM 0 HG2 LYS A 185 0.805 -10.497 -0.051 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.437 -11.659 -0.472 1.00 0.00 H new ATOM 0 HD2 LYS A 185 1.908 -11.143 -2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 185 2.049 -12.274 -1.011 1.00 0.00 H new ATOM 0 HE2 LYS A 185 0.654 -13.809 -1.998 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -0.491 -12.580 -2.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.515 -13.660 -4.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.958 -12.021 -4.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 2.067 -13.212 -3.859 1.00 0.00 H new ATOM 1049 N GLN A 186 -1.128 -8.842 0.998 1.00 0.00 N ATOM 1050 CA GLN A 186 -1.075 -9.001 2.432 1.00 0.00 C ATOM 1051 C GLN A 186 -2.462 -8.870 3.041 1.00 0.00 C ATOM 1052 O GLN A 186 -2.760 -9.655 3.941 1.00 0.00 O ATOM 1053 CB GLN A 186 -0.047 -8.017 3.009 1.00 0.00 C ATOM 1054 CG GLN A 186 1.285 -8.734 3.241 1.00 0.00 C ATOM 1055 CD GLN A 186 1.304 -9.539 4.553 1.00 0.00 C ATOM 1056 OE1 GLN A 186 0.671 -9.206 5.553 1.00 0.00 O ATOM 1057 NE2 GLN A 186 2.033 -10.641 4.589 1.00 0.00 N ATOM 0 H GLN A 186 -0.546 -8.084 0.641 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.740 -10.005 2.692 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.094 -7.181 2.324 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -0.415 -7.601 3.947 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.483 -9.405 2.405 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.090 -8.000 3.258 1.00 0.00 H new ATOM 0 HE21 GLN A 186 2.563 -10.929 3.766 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.065 -11.203 5.439 1.00 0.00 H new ATOM 1066 N HIS A 187 -3.319 -7.981 2.536 1.00 0.00 N ATOM 1067 CA HIS A 187 -4.681 -7.893 3.038 1.00 0.00 C ATOM 1068 C HIS A 187 -5.528 -9.031 2.481 1.00 0.00 C ATOM 1069 O HIS A 187 -6.189 -9.719 3.257 1.00 0.00 O ATOM 1070 CB HIS A 187 -5.350 -6.551 2.748 1.00 0.00 C ATOM 1071 CG HIS A 187 -4.435 -5.372 2.656 1.00 0.00 C ATOM 1072 ND1 HIS A 187 -3.277 -5.137 3.360 1.00 0.00 N ATOM 1073 CD2 HIS A 187 -4.620 -4.346 1.786 1.00 0.00 C ATOM 1074 CE1 HIS A 187 -2.745 -4.011 2.868 1.00 0.00 C ATOM 1075 NE2 HIS A 187 -3.539 -3.481 1.916 1.00 0.00 N ATOM 0 H HIS A 187 -3.094 -7.323 1.790 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.612 -7.979 4.122 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -5.898 -6.635 1.810 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -6.084 -6.357 3.530 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -2.896 -5.711 4.113 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.456 -4.224 1.114 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -1.806 -3.585 3.190 1.00 0.00 H new ATOM 1083 N THR A 188 -5.546 -9.234 1.161 1.00 0.00 N ATOM 1084 CA THR A 188 -6.459 -10.151 0.482 1.00 0.00 C ATOM 1085 C THR A 188 -6.221 -11.605 0.954 1.00 0.00 C ATOM 1086 O THR A 188 -7.074 -12.472 0.755 1.00 0.00 O ATOM 1087 CB THR A 188 -6.299 -10.013 -1.054 1.00 0.00 C ATOM 1088 OG1 THR A 188 -7.527 -10.301 -1.697 1.00 0.00 O ATOM 1089 CG2 THR A 188 -5.217 -10.891 -1.698 1.00 0.00 C ATOM 0 H THR A 188 -4.912 -8.754 0.523 1.00 0.00 H new ATOM 0 HA THR A 188 -7.486 -9.891 0.739 1.00 0.00 H new ATOM 0 HB THR A 188 -5.981 -8.980 -1.194 1.00 0.00 H new ATOM 0 HG1 THR A 188 -7.418 -10.210 -2.667 1.00 0.00 H new ATOM 0 HG21 THR A 188 -5.195 -10.712 -2.773 1.00 0.00 H new ATOM 0 HG22 THR A 188 -4.246 -10.645 -1.269 1.00 0.00 H new ATOM 0 HG23 THR A 188 -5.441 -11.941 -1.510 1.00 0.00 H new ATOM 1097 N VAL A 189 -5.064 -11.864 1.577 1.00 0.00 N ATOM 1098 CA VAL A 189 -4.734 -13.046 2.353 1.00 0.00 C ATOM 1099 C VAL A 189 -5.122 -12.784 3.819 1.00 0.00 C ATOM 1100 O VAL A 189 -6.143 -13.276 4.301 1.00 0.00 O ATOM 1101 CB VAL A 189 -3.231 -13.359 2.133 1.00 0.00 C ATOM 1102 CG1 VAL A 189 -2.675 -14.480 3.020 1.00 0.00 C ATOM 1103 CG2 VAL A 189 -2.962 -13.756 0.669 1.00 0.00 C ATOM 0 H VAL A 189 -4.288 -11.203 1.544 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.288 -13.931 2.040 1.00 0.00 H new ATOM 0 HB VAL A 189 -2.723 -12.433 2.404 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.618 -14.630 2.798 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.790 -14.205 4.069 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -3.221 -15.403 2.825 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -1.901 -13.971 0.539 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -3.545 -14.643 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -3.249 -12.936 0.011 1.00 0.00 H new ATOM 1113 N THR A 190 -4.317 -12.011 4.550 1.00 0.00 N ATOM 1114 CA THR A 190 -4.347 -11.981 6.007 1.00 0.00 C ATOM 1115 C THR A 190 -5.660 -11.406 6.531 1.00 0.00 C ATOM 1116 O THR A 190 -6.318 -12.017 7.379 1.00 0.00 O ATOM 1117 CB THR A 190 -3.163 -11.145 6.523 1.00 0.00 C ATOM 1118 OG1 THR A 190 -1.957 -11.434 5.839 1.00 0.00 O ATOM 1119 CG2 THR A 190 -2.954 -11.383 8.011 1.00 0.00 C ATOM 0 H THR A 190 -3.623 -11.385 4.142 1.00 0.00 H new ATOM 0 HA THR A 190 -4.267 -13.005 6.372 1.00 0.00 H new ATOM 0 HB THR A 190 -3.416 -10.101 6.339 1.00 0.00 H new ATOM 0 HG1 THR A 190 -1.907 -10.895 5.022 1.00 0.00 H new ATOM 0 HG21 THR A 190 -2.113 -10.784 8.361 1.00 0.00 H new ATOM 0 HG22 THR A 190 -3.854 -11.097 8.555 1.00 0.00 H new ATOM 0 HG23 THR A 190 -2.745 -12.439 8.185 1.00 0.00 H new ATOM 1127 N THR A 191 -6.001 -10.212 6.071 1.00 0.00 N ATOM 1128 CA THR A 191 -7.136 -9.419 6.513 1.00 0.00 C ATOM 1129 C THR A 191 -8.448 -10.076 6.073 1.00 0.00 C ATOM 1130 O THR A 191 -9.466 -9.982 6.754 1.00 0.00 O ATOM 1131 CB THR A 191 -6.907 -8.004 5.944 1.00 0.00 C ATOM 1132 OG1 THR A 191 -5.632 -7.533 6.350 1.00 0.00 O ATOM 1133 CG2 THR A 191 -7.937 -6.944 6.232 1.00 0.00 C ATOM 0 H THR A 191 -5.464 -9.746 5.340 1.00 0.00 H new ATOM 0 HA THR A 191 -7.218 -9.355 7.598 1.00 0.00 H new ATOM 0 HB THR A 191 -6.991 -8.155 4.868 1.00 0.00 H new ATOM 0 HG1 THR A 191 -5.485 -6.634 5.988 1.00 0.00 H new ATOM 0 HG21 THR A 191 -7.635 -6.006 5.765 1.00 0.00 H new ATOM 0 HG22 THR A 191 -8.901 -7.255 5.830 1.00 0.00 H new ATOM 0 HG23 THR A 191 -8.022 -6.802 7.309 1.00 0.00 H new ATOM 1141 N THR A 192 -8.381 -10.853 5.000 1.00 0.00 N ATOM 1142 CA THR A 192 -9.509 -11.280 4.192 1.00 0.00 C ATOM 1143 C THR A 192 -9.678 -12.782 4.370 1.00 0.00 C ATOM 1144 O THR A 192 -9.153 -13.605 3.619 1.00 0.00 O ATOM 1145 CB THR A 192 -9.215 -10.905 2.742 1.00 0.00 C ATOM 1146 OG1 THR A 192 -8.731 -9.582 2.681 1.00 0.00 O ATOM 1147 CG2 THR A 192 -10.436 -11.001 1.844 1.00 0.00 C ATOM 0 H THR A 192 -7.494 -11.219 4.655 1.00 0.00 H new ATOM 0 HA THR A 192 -10.439 -10.796 4.491 1.00 0.00 H new ATOM 0 HB THR A 192 -8.474 -11.619 2.384 1.00 0.00 H new ATOM 0 HG1 THR A 192 -7.815 -9.552 3.029 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.162 -10.722 0.827 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.813 -12.024 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.210 -10.326 2.209 1.00 0.00 H new ATOM 1155 N THR A 193 -10.319 -13.152 5.463 1.00 0.00 N ATOM 1156 CA THR A 193 -10.416 -14.517 5.943 1.00 0.00 C ATOM 1157 C THR A 193 -11.715 -14.584 6.736 1.00 0.00 C ATOM 1158 O THR A 193 -12.721 -15.036 6.194 1.00 0.00 O ATOM 1159 CB THR A 193 -9.117 -14.872 6.706 1.00 0.00 C ATOM 1160 OG1 THR A 193 -8.029 -15.011 5.803 1.00 0.00 O ATOM 1161 CG2 THR A 193 -9.190 -16.177 7.499 1.00 0.00 C ATOM 0 H THR A 193 -10.804 -12.485 6.063 1.00 0.00 H new ATOM 0 HA THR A 193 -10.477 -15.278 5.165 1.00 0.00 H new ATOM 0 HB THR A 193 -8.978 -14.046 7.404 1.00 0.00 H new ATOM 0 HG1 THR A 193 -7.675 -14.125 5.579 1.00 0.00 H new ATOM 0 HG21 THR A 193 -8.239 -16.350 8.003 1.00 0.00 H new ATOM 0 HG22 THR A 193 -9.986 -16.108 8.240 1.00 0.00 H new ATOM 0 HG23 THR A 193 -9.397 -17.004 6.820 1.00 0.00 H new ATOM 1169 N LYS A 194 -11.741 -14.086 7.973 1.00 0.00 N ATOM 1170 CA LYS A 194 -12.923 -14.078 8.830 1.00 0.00 C ATOM 1171 C LYS A 194 -12.915 -12.756 9.570 1.00 0.00 C ATOM 1172 O LYS A 194 -12.711 -12.713 10.786 1.00 0.00 O ATOM 1173 CB LYS A 194 -12.935 -15.302 9.753 1.00 0.00 C ATOM 1174 CG LYS A 194 -13.013 -16.576 8.906 1.00 0.00 C ATOM 1175 CD LYS A 194 -13.292 -17.812 9.740 1.00 0.00 C ATOM 1176 CE LYS A 194 -13.200 -19.028 8.815 1.00 0.00 C ATOM 1177 NZ LYS A 194 -12.548 -20.165 9.488 1.00 0.00 N ATOM 0 H LYS A 194 -10.922 -13.668 8.415 1.00 0.00 H new ATOM 0 HA LYS A 194 -13.845 -14.157 8.255 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -12.036 -15.316 10.369 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -13.786 -15.251 10.432 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -13.796 -16.463 8.157 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -12.074 -16.709 8.368 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -12.571 -17.895 10.554 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -14.281 -17.751 10.195 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -14.200 -19.318 8.492 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -12.640 -18.764 7.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -12.500 -20.974 8.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -11.586 -19.894 9.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -13.097 -20.431 10.330 1.00 0.00 H new ATOM 1191 N GLY A 195 -13.058 -11.666 8.828 1.00 0.00 N ATOM 1192 CA GLY A 195 -12.965 -10.337 9.382 1.00 0.00 C ATOM 1193 C GLY A 195 -13.375 -9.322 8.339 1.00 0.00 C ATOM 1194 O GLY A 195 -14.549 -8.984 8.231 1.00 0.00 O ATOM 0 H GLY A 195 -13.242 -11.687 7.825 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -13.607 -10.252 10.259 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.945 -10.141 9.714 1.00 0.00 H new ATOM 1198 N GLU A 196 -12.419 -8.842 7.562 1.00 0.00 N ATOM 1199 CA GLU A 196 -12.628 -7.805 6.568 1.00 0.00 C ATOM 1200 C GLU A 196 -12.946 -8.459 5.217 1.00 0.00 C ATOM 1201 O GLU A 196 -12.495 -9.583 4.981 1.00 0.00 O ATOM 1202 CB GLU A 196 -11.288 -7.074 6.521 1.00 0.00 C ATOM 1203 CG GLU A 196 -11.242 -5.786 5.712 1.00 0.00 C ATOM 1204 CD GLU A 196 -12.070 -4.687 6.390 1.00 0.00 C ATOM 1205 OE1 GLU A 196 -11.673 -4.201 7.469 1.00 0.00 O ATOM 1206 OE2 GLU A 196 -13.167 -4.385 5.851 1.00 0.00 O ATOM 0 H GLU A 196 -11.454 -9.170 7.606 1.00 0.00 H new ATOM 0 HA GLU A 196 -13.455 -7.133 6.798 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -10.989 -6.845 7.544 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.541 -7.757 6.116 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.209 -5.455 5.605 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -11.624 -5.968 4.708 1.00 0.00 H new ATOM 1213 N ASN A 197 -13.578 -7.756 4.267 1.00 0.00 N ATOM 1214 CA ASN A 197 -13.669 -8.190 2.870 1.00 0.00 C ATOM 1215 C ASN A 197 -13.678 -6.997 1.922 1.00 0.00 C ATOM 1216 O ASN A 197 -14.669 -6.265 1.886 1.00 0.00 O ATOM 1217 CB ASN A 197 -14.897 -9.073 2.660 1.00 0.00 C ATOM 1218 CG ASN A 197 -15.344 -9.129 1.205 1.00 0.00 C ATOM 1219 OD1 ASN A 197 -16.462 -8.745 0.887 1.00 0.00 O ATOM 1220 ND2 ASN A 197 -14.519 -9.622 0.300 1.00 0.00 N ATOM 0 H ASN A 197 -14.042 -6.866 4.449 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.783 -8.783 2.641 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.676 -10.083 3.006 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.717 -8.698 3.273 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -14.811 -9.686 -0.675 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -13.590 -9.939 0.576 1.00 0.00 H new ATOM 1227 N PHE A 198 -12.607 -6.830 1.139 1.00 0.00 N ATOM 1228 CA PHE A 198 -12.535 -5.769 0.131 1.00 0.00 C ATOM 1229 C PHE A 198 -13.112 -6.264 -1.200 1.00 0.00 C ATOM 1230 O PHE A 198 -12.489 -7.098 -1.858 1.00 0.00 O ATOM 1231 CB PHE A 198 -11.101 -5.250 -0.058 1.00 0.00 C ATOM 1232 CG PHE A 198 -10.312 -5.023 1.205 1.00 0.00 C ATOM 1233 CD1 PHE A 198 -10.337 -3.800 1.895 1.00 0.00 C ATOM 1234 CD2 PHE A 198 -9.515 -6.072 1.675 1.00 0.00 C ATOM 1235 CE1 PHE A 198 -9.580 -3.657 3.072 1.00 0.00 C ATOM 1236 CE2 PHE A 198 -8.701 -5.915 2.795 1.00 0.00 C ATOM 1237 CZ PHE A 198 -8.734 -4.699 3.506 1.00 0.00 C ATOM 0 H PHE A 198 -11.775 -7.419 1.185 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.134 -4.932 0.489 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.557 -5.961 -0.680 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.145 -4.311 -0.610 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -10.932 -2.977 1.526 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.531 -7.021 1.160 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -9.647 -2.745 3.646 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.052 -6.717 3.115 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.114 -4.565 4.380 1.00 0.00 H new ATOM 1247 N THR A 199 -14.286 -5.772 -1.597 1.00 0.00 N ATOM 1248 CA THR A 199 -14.914 -6.042 -2.893 1.00 0.00 C ATOM 1249 C THR A 199 -14.142 -5.383 -4.050 1.00 0.00 C ATOM 1250 O THR A 199 -13.253 -4.577 -3.791 1.00 0.00 O ATOM 1251 CB THR A 199 -16.369 -5.556 -2.825 1.00 0.00 C ATOM 1252 OG1 THR A 199 -16.468 -4.314 -2.155 1.00 0.00 O ATOM 1253 CG2 THR A 199 -17.242 -6.515 -2.025 1.00 0.00 C ATOM 0 H THR A 199 -14.845 -5.155 -1.007 1.00 0.00 H new ATOM 0 HA THR A 199 -14.894 -7.113 -3.097 1.00 0.00 H new ATOM 0 HB THR A 199 -16.700 -5.482 -3.861 1.00 0.00 H new ATOM 0 HG1 THR A 199 -17.406 -4.030 -2.129 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.265 -6.139 -1.998 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.229 -7.498 -2.496 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.858 -6.595 -1.008 1.00 0.00 H new ATOM 1261 N GLU A 200 -14.518 -5.616 -5.318 1.00 0.00 N ATOM 1262 CA GLU A 200 -13.936 -4.955 -6.495 1.00 0.00 C ATOM 1263 C GLU A 200 -13.967 -3.422 -6.357 1.00 0.00 C ATOM 1264 O GLU A 200 -13.022 -2.728 -6.722 1.00 0.00 O ATOM 1265 CB GLU A 200 -14.720 -5.367 -7.749 1.00 0.00 C ATOM 1266 CG GLU A 200 -13.961 -5.037 -9.035 1.00 0.00 C ATOM 1267 CD GLU A 200 -14.874 -5.053 -10.262 1.00 0.00 C ATOM 1268 OE1 GLU A 200 -15.272 -6.157 -10.717 1.00 0.00 O ATOM 1269 OE2 GLU A 200 -15.216 -3.956 -10.754 1.00 0.00 O ATOM 0 H GLU A 200 -15.251 -6.284 -5.557 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.895 -5.267 -6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.924 -6.437 -7.713 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -15.684 -4.859 -7.757 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -13.499 -4.054 -8.941 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -13.154 -5.757 -9.174 1.00 0.00 H new ATOM 1276 N THR A 201 -15.043 -2.874 -5.798 1.00 0.00 N ATOM 1277 CA THR A 201 -15.135 -1.444 -5.541 1.00 0.00 C ATOM 1278 C THR A 201 -14.007 -0.989 -4.615 1.00 0.00 C ATOM 1279 O THR A 201 -13.435 0.073 -4.840 1.00 0.00 O ATOM 1280 CB THR A 201 -16.516 -1.158 -4.949 1.00 0.00 C ATOM 1281 OG1 THR A 201 -17.500 -1.604 -5.853 1.00 0.00 O ATOM 1282 CG2 THR A 201 -16.737 0.315 -4.653 1.00 0.00 C ATOM 0 H THR A 201 -15.867 -3.404 -5.514 1.00 0.00 H new ATOM 0 HA THR A 201 -15.020 -0.880 -6.466 1.00 0.00 H new ATOM 0 HB THR A 201 -16.583 -1.689 -3.999 1.00 0.00 H new ATOM 0 HG1 THR A 201 -18.390 -1.427 -5.482 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.734 0.457 -4.235 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.991 0.658 -3.936 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.645 0.889 -5.575 1.00 0.00 H new ATOM 1290 N ASP A 202 -13.676 -1.775 -3.589 1.00 0.00 N ATOM 1291 CA ASP A 202 -12.604 -1.423 -2.674 1.00 0.00 C ATOM 1292 C ASP A 202 -11.270 -1.665 -3.360 1.00 0.00 C ATOM 1293 O ASP A 202 -10.435 -0.783 -3.280 1.00 0.00 O ATOM 1294 CB ASP A 202 -12.677 -2.189 -1.345 1.00 0.00 C ATOM 1295 CG ASP A 202 -13.619 -1.504 -0.357 1.00 0.00 C ATOM 1296 OD1 ASP A 202 -13.671 -0.259 -0.276 1.00 0.00 O ATOM 1297 OD2 ASP A 202 -14.409 -2.196 0.330 1.00 0.00 O ATOM 0 H ASP A 202 -14.139 -2.659 -3.376 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.712 -0.368 -2.421 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.019 -3.208 -1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.680 -2.261 -0.910 1.00 0.00 H new ATOM 1302 N VAL A 203 -11.082 -2.778 -4.083 1.00 0.00 N ATOM 1303 CA VAL A 203 -9.901 -3.091 -4.903 1.00 0.00 C ATOM 1304 C VAL A 203 -9.455 -1.850 -5.684 1.00 0.00 C ATOM 1305 O VAL A 203 -8.285 -1.466 -5.606 1.00 0.00 O ATOM 1306 CB VAL A 203 -10.238 -4.306 -5.802 1.00 0.00 C ATOM 1307 CG1 VAL A 203 -9.385 -4.502 -7.058 1.00 0.00 C ATOM 1308 CG2 VAL A 203 -10.265 -5.626 -5.018 1.00 0.00 C ATOM 0 H VAL A 203 -11.781 -3.520 -4.114 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.050 -3.369 -4.281 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.233 -4.039 -6.158 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.726 -5.387 -7.595 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -9.479 -3.628 -7.702 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.341 -4.631 -6.772 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.506 -6.446 -5.694 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.288 -5.802 -4.568 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.020 -5.568 -4.234 1.00 0.00 H new ATOM 1318 N LYS A 204 -10.381 -1.186 -6.380 1.00 0.00 N ATOM 1319 CA LYS A 204 -10.061 0.020 -7.143 1.00 0.00 C ATOM 1320 C LYS A 204 -9.569 1.154 -6.246 1.00 0.00 C ATOM 1321 O LYS A 204 -8.614 1.846 -6.608 1.00 0.00 O ATOM 1322 CB LYS A 204 -11.278 0.430 -7.984 1.00 0.00 C ATOM 1323 CG LYS A 204 -11.521 -0.667 -9.029 1.00 0.00 C ATOM 1324 CD LYS A 204 -12.678 -0.395 -9.978 1.00 0.00 C ATOM 1325 CE LYS A 204 -14.023 -0.713 -9.330 1.00 0.00 C ATOM 1326 NZ LYS A 204 -14.968 -1.267 -10.315 1.00 0.00 N ATOM 0 H LYS A 204 -11.361 -1.465 -6.430 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.233 -0.202 -7.817 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.156 0.554 -7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.099 1.388 -8.472 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.612 -0.800 -9.615 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.707 -1.608 -8.512 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -12.660 0.651 -10.285 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -12.558 -0.994 -10.881 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -13.880 -1.426 -8.518 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -14.441 0.192 -8.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -15.936 -1.206 -9.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -14.905 -0.724 -11.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -14.731 -2.262 -10.502 1.00 0.00 H new ATOM 1340 N MET A 205 -10.180 1.359 -5.080 1.00 0.00 N ATOM 1341 CA MET A 205 -9.723 2.368 -4.127 1.00 0.00 C ATOM 1342 C MET A 205 -8.373 1.992 -3.526 1.00 0.00 C ATOM 1343 O MET A 205 -7.572 2.879 -3.247 1.00 0.00 O ATOM 1344 CB MET A 205 -10.736 2.567 -2.993 1.00 0.00 C ATOM 1345 CG MET A 205 -12.121 2.873 -3.553 1.00 0.00 C ATOM 1346 SD MET A 205 -13.129 3.986 -2.570 1.00 0.00 S ATOM 1347 CE MET A 205 -14.205 4.455 -3.938 1.00 0.00 C ATOM 0 H MET A 205 -10.999 0.835 -4.772 1.00 0.00 H new ATOM 0 HA MET A 205 -9.621 3.300 -4.683 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.778 1.670 -2.375 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.411 3.383 -2.348 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.004 3.302 -4.548 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.660 1.933 -3.672 1.00 0.00 H new ATOM 0 HE1 MET A 205 -14.962 5.154 -3.582 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.613 4.929 -4.721 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.691 3.566 -4.340 1.00 0.00 H new ATOM 1357 N MET A 206 -8.119 0.703 -3.302 1.00 0.00 N ATOM 1358 CA MET A 206 -6.897 0.202 -2.701 1.00 0.00 C ATOM 1359 C MET A 206 -5.752 0.456 -3.673 1.00 0.00 C ATOM 1360 O MET A 206 -4.757 1.042 -3.264 1.00 0.00 O ATOM 1361 CB MET A 206 -6.999 -1.300 -2.374 1.00 0.00 C ATOM 1362 CG MET A 206 -8.114 -1.667 -1.381 1.00 0.00 C ATOM 1363 SD MET A 206 -8.696 -3.367 -1.526 1.00 0.00 S ATOM 1364 CE MET A 206 -7.450 -4.213 -0.533 1.00 0.00 C ATOM 0 H MET A 206 -8.779 -0.036 -3.542 1.00 0.00 H new ATOM 0 HA MET A 206 -6.721 0.721 -1.759 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.162 -1.850 -3.301 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.045 -1.635 -1.968 1.00 0.00 H new ATOM 0 HG2 MET A 206 -7.751 -1.504 -0.366 1.00 0.00 H new ATOM 0 HG3 MET A 206 -8.956 -0.992 -1.531 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.423 -5.268 -0.805 1.00 0.00 H new ATOM 0 HE2 MET A 206 -6.473 -3.765 -0.716 1.00 0.00 H new ATOM 0 HE3 MET A 206 -7.700 -4.117 0.524 1.00 0.00 H new ATOM 1374 N GLU A 207 -5.877 0.078 -4.952 1.00 0.00 N ATOM 1375 CA GLU A 207 -4.804 0.330 -5.913 1.00 0.00 C ATOM 1376 C GLU A 207 -4.517 1.828 -6.043 1.00 0.00 C ATOM 1377 O GLU A 207 -3.358 2.202 -6.209 1.00 0.00 O ATOM 1378 CB GLU A 207 -5.070 -0.319 -7.283 1.00 0.00 C ATOM 1379 CG GLU A 207 -4.884 -1.845 -7.234 1.00 0.00 C ATOM 1380 CD GLU A 207 -4.569 -2.465 -8.601 1.00 0.00 C ATOM 1381 OE1 GLU A 207 -5.419 -2.379 -9.516 1.00 0.00 O ATOM 1382 OE2 GLU A 207 -3.466 -3.043 -8.774 1.00 0.00 O ATOM 0 H GLU A 207 -6.695 -0.394 -5.337 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.908 -0.149 -5.517 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.085 -0.086 -7.605 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.394 0.107 -8.025 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.077 -2.083 -6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -5.791 -2.301 -6.837 1.00 0.00 H new ATOM 1389 N ARG A 208 -5.519 2.702 -5.893 1.00 0.00 N ATOM 1390 CA ARG A 208 -5.275 4.138 -5.780 1.00 0.00 C ATOM 1391 C ARG A 208 -4.504 4.468 -4.511 1.00 0.00 C ATOM 1392 O ARG A 208 -3.409 5.027 -4.593 1.00 0.00 O ATOM 1393 CB ARG A 208 -6.596 4.931 -5.842 1.00 0.00 C ATOM 1394 CG ARG A 208 -6.722 5.647 -7.189 1.00 0.00 C ATOM 1395 CD ARG A 208 -5.672 6.742 -7.393 1.00 0.00 C ATOM 1396 NE ARG A 208 -5.115 6.675 -8.755 1.00 0.00 N ATOM 1397 CZ ARG A 208 -4.284 7.537 -9.349 1.00 0.00 C ATOM 1398 NH1 ARG A 208 -3.919 8.671 -8.766 1.00 0.00 N ATOM 1399 NH2 ARG A 208 -3.835 7.250 -10.558 1.00 0.00 N ATOM 0 H ARG A 208 -6.503 2.437 -5.848 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.662 4.437 -6.630 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.440 4.256 -5.701 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -6.630 5.658 -5.031 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.634 4.915 -7.992 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -7.716 6.087 -7.267 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.121 7.721 -7.225 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -4.873 6.629 -6.661 1.00 0.00 H new ATOM 0 HE ARG A 208 -5.399 5.871 -9.314 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -4.274 8.905 -7.839 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -3.283 9.309 -9.245 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -4.124 6.386 -11.017 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -3.200 7.892 -11.032 1.00 0.00 H new ATOM 1413 N VAL A 209 -5.094 4.187 -3.347 1.00 0.00 N ATOM 1414 CA VAL A 209 -4.580 4.670 -2.079 1.00 0.00 C ATOM 1415 C VAL A 209 -3.175 4.141 -1.852 1.00 0.00 C ATOM 1416 O VAL A 209 -2.288 4.896 -1.457 1.00 0.00 O ATOM 1417 CB VAL A 209 -5.581 4.428 -0.929 1.00 0.00 C ATOM 1418 CG1 VAL A 209 -5.478 3.079 -0.217 1.00 0.00 C ATOM 1419 CG2 VAL A 209 -5.393 5.488 0.151 1.00 0.00 C ATOM 0 H VAL A 209 -5.938 3.620 -3.265 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.480 5.755 -2.106 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.551 4.463 -1.425 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -6.230 3.025 0.570 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.645 2.275 -0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.486 2.974 0.222 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.102 5.313 0.960 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.377 5.434 0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.566 6.476 -0.275 1.00 0.00 H new ATOM 1429 N VAL A 210 -2.962 2.860 -2.130 1.00 0.00 N ATOM 1430 CA VAL A 210 -1.693 2.212 -1.918 1.00 0.00 C ATOM 1431 C VAL A 210 -0.681 2.726 -2.934 1.00 0.00 C ATOM 1432 O VAL A 210 0.453 2.924 -2.522 1.00 0.00 O ATOM 1433 CB VAL A 210 -1.866 0.687 -1.950 1.00 0.00 C ATOM 1434 CG1 VAL A 210 -0.534 -0.023 -1.731 1.00 0.00 C ATOM 1435 CG2 VAL A 210 -2.807 0.193 -0.839 1.00 0.00 C ATOM 0 H VAL A 210 -3.679 2.244 -2.513 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.303 2.456 -0.930 1.00 0.00 H new ATOM 0 HB VAL A 210 -2.280 0.458 -2.932 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.688 -1.102 -1.759 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.165 0.264 -2.517 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -0.126 0.260 -0.761 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.902 -0.891 -0.898 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.399 0.469 0.133 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.789 0.650 -0.964 1.00 0.00 H new ATOM 1445 N GLU A 211 -1.021 2.986 -4.206 1.00 0.00 N ATOM 1446 CA GLU A 211 0.001 3.463 -5.136 1.00 0.00 C ATOM 1447 C GLU A 211 0.492 4.833 -4.684 1.00 0.00 C ATOM 1448 O GLU A 211 1.692 5.028 -4.499 1.00 0.00 O ATOM 1449 CB GLU A 211 -0.497 3.546 -6.583 1.00 0.00 C ATOM 1450 CG GLU A 211 0.700 3.579 -7.552 1.00 0.00 C ATOM 1451 CD GLU A 211 0.455 4.415 -8.803 1.00 0.00 C ATOM 1452 OE1 GLU A 211 -0.700 4.500 -9.280 1.00 0.00 O ATOM 1453 OE2 GLU A 211 1.433 5.033 -9.288 1.00 0.00 O ATOM 0 H GLU A 211 -1.957 2.879 -4.598 1.00 0.00 H new ATOM 0 HA GLU A 211 0.814 2.737 -5.123 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.133 2.690 -6.807 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.107 4.439 -6.715 1.00 0.00 H new ATOM 0 HG2 GLU A 211 1.570 3.974 -7.027 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.943 2.559 -7.850 1.00 0.00 H new ATOM 1460 N GLN A 212 -0.433 5.772 -4.463 1.00 0.00 N ATOM 1461 CA GLN A 212 -0.110 7.128 -4.058 1.00 0.00 C ATOM 1462 C GLN A 212 0.695 7.113 -2.746 1.00 0.00 C ATOM 1463 O GLN A 212 1.567 7.956 -2.527 1.00 0.00 O ATOM 1464 CB GLN A 212 -1.433 7.903 -3.919 1.00 0.00 C ATOM 1465 CG GLN A 212 -1.226 9.417 -4.076 1.00 0.00 C ATOM 1466 CD GLN A 212 -2.256 10.255 -3.329 1.00 0.00 C ATOM 1467 OE1 GLN A 212 -3.075 10.961 -3.916 1.00 0.00 O ATOM 1468 NE2 GLN A 212 -2.264 10.144 -2.010 1.00 0.00 N ATOM 0 H GLN A 212 -1.434 5.603 -4.563 1.00 0.00 H new ATOM 0 HA GLN A 212 0.516 7.621 -4.801 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.140 7.553 -4.671 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.875 7.696 -2.945 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -0.230 9.678 -3.719 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -1.262 9.672 -5.135 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.576 9.553 -1.544 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -2.959 10.649 -1.460 1.00 0.00 H new ATOM 1477 N MET A 213 0.417 6.158 -1.855 1.00 0.00 N ATOM 1478 CA MET A 213 1.161 5.968 -0.619 1.00 0.00 C ATOM 1479 C MET A 213 2.528 5.331 -0.869 1.00 0.00 C ATOM 1480 O MET A 213 3.497 5.797 -0.283 1.00 0.00 O ATOM 1481 CB MET A 213 0.343 5.129 0.358 1.00 0.00 C ATOM 1482 CG MET A 213 -0.838 5.950 0.917 1.00 0.00 C ATOM 1483 SD MET A 213 -0.637 6.566 2.610 1.00 0.00 S ATOM 1484 CE MET A 213 -0.779 5.011 3.536 1.00 0.00 C ATOM 0 H MET A 213 -0.343 5.489 -1.979 1.00 0.00 H new ATOM 0 HA MET A 213 1.341 6.950 -0.181 1.00 0.00 H new ATOM 0 HB2 MET A 213 -0.032 4.237 -0.144 1.00 0.00 H new ATOM 0 HB3 MET A 213 0.978 4.791 1.177 1.00 0.00 H new ATOM 0 HG2 MET A 213 -1.008 6.802 0.258 1.00 0.00 H new ATOM 0 HG3 MET A 213 -1.736 5.333 0.879 1.00 0.00 H new ATOM 0 HE1 MET A 213 -0.980 5.229 4.585 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.595 4.417 3.126 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.153 4.452 3.454 1.00 0.00 H new ATOM 1494 N CYS A 214 2.655 4.309 -1.719 1.00 0.00 N ATOM 1495 CA CYS A 214 3.921 3.679 -2.066 1.00 0.00 C ATOM 1496 C CYS A 214 4.841 4.728 -2.715 1.00 0.00 C ATOM 1497 O CYS A 214 6.028 4.757 -2.402 1.00 0.00 O ATOM 1498 CB CYS A 214 3.686 2.464 -2.986 1.00 0.00 C ATOM 1499 SG CYS A 214 3.002 0.931 -2.272 1.00 0.00 S ATOM 0 H CYS A 214 1.856 3.889 -2.195 1.00 0.00 H new ATOM 0 HA CYS A 214 4.410 3.303 -1.167 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.017 2.782 -3.785 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.640 2.213 -3.450 1.00 0.00 H new ATOM 1504 N VAL A 215 4.327 5.638 -3.553 1.00 0.00 N ATOM 1505 CA VAL A 215 5.059 6.745 -4.123 1.00 0.00 C ATOM 1506 C VAL A 215 5.618 7.623 -2.993 1.00 0.00 C ATOM 1507 O VAL A 215 6.807 7.929 -2.983 1.00 0.00 O ATOM 1508 CB VAL A 215 4.086 7.481 -5.071 1.00 0.00 C ATOM 1509 CG1 VAL A 215 4.633 8.835 -5.467 1.00 0.00 C ATOM 1510 CG2 VAL A 215 3.814 6.714 -6.370 1.00 0.00 C ATOM 0 H VAL A 215 3.353 5.610 -3.855 1.00 0.00 H new ATOM 0 HA VAL A 215 5.926 6.429 -4.703 1.00 0.00 H new ATOM 0 HB VAL A 215 3.158 7.574 -4.506 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.928 9.331 -6.134 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.778 9.444 -4.575 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.587 8.707 -5.978 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.124 7.284 -6.992 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.750 6.567 -6.909 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.374 5.745 -6.135 1.00 0.00 H new ATOM 1520 N THR A 216 4.791 8.035 -2.032 1.00 0.00 N ATOM 1521 CA THR A 216 5.246 8.791 -0.870 1.00 0.00 C ATOM 1522 C THR A 216 6.262 8.010 -0.044 1.00 0.00 C ATOM 1523 O THR A 216 7.248 8.598 0.383 1.00 0.00 O ATOM 1524 CB THR A 216 4.006 9.150 -0.041 1.00 0.00 C ATOM 1525 OG1 THR A 216 3.183 10.097 -0.706 1.00 0.00 O ATOM 1526 CG2 THR A 216 4.400 9.724 1.318 1.00 0.00 C ATOM 0 H THR A 216 3.787 7.853 -2.039 1.00 0.00 H new ATOM 0 HA THR A 216 5.761 9.695 -1.194 1.00 0.00 H new ATOM 0 HB THR A 216 3.448 8.223 0.095 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.591 9.632 -1.334 1.00 0.00 H new ATOM 0 HG21 THR A 216 3.501 9.969 1.884 1.00 0.00 H new ATOM 0 HG22 THR A 216 4.985 8.987 1.868 1.00 0.00 H new ATOM 0 HG23 THR A 216 4.995 10.626 1.173 1.00 0.00 H new ATOM 1534 N GLN A 217 6.051 6.728 0.233 1.00 0.00 N ATOM 1535 CA GLN A 217 6.958 5.975 1.081 1.00 0.00 C ATOM 1536 C GLN A 217 8.334 5.919 0.380 1.00 0.00 C ATOM 1537 O GLN A 217 9.353 6.220 1.008 1.00 0.00 O ATOM 1538 CB GLN A 217 6.280 4.651 1.499 1.00 0.00 C ATOM 1539 CG GLN A 217 6.752 3.395 0.773 1.00 0.00 C ATOM 1540 CD GLN A 217 8.143 2.958 1.224 1.00 0.00 C ATOM 1541 OE1 GLN A 217 8.530 3.200 2.362 1.00 0.00 O ATOM 1542 NE2 GLN A 217 8.913 2.353 0.349 1.00 0.00 N ATOM 0 H GLN A 217 5.258 6.191 -0.119 1.00 0.00 H new ATOM 0 HA GLN A 217 7.174 6.444 2.041 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.437 4.508 2.568 1.00 0.00 H new ATOM 0 HB3 GLN A 217 5.206 4.753 1.345 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.043 2.586 0.951 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.761 3.580 -0.301 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.566 2.164 -0.591 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.858 2.072 0.610 1.00 0.00 H new ATOM 1551 N TYR A 218 8.339 5.703 -0.944 1.00 0.00 N ATOM 1552 CA TYR A 218 9.508 5.838 -1.801 1.00 0.00 C ATOM 1553 C TYR A 218 10.121 7.226 -1.702 1.00 0.00 C ATOM 1554 O TYR A 218 11.343 7.308 -1.690 1.00 0.00 O ATOM 1555 CB TYR A 218 9.161 5.507 -3.267 1.00 0.00 C ATOM 1556 CG TYR A 218 10.040 6.167 -4.331 1.00 0.00 C ATOM 1557 CD1 TYR A 218 9.709 7.453 -4.814 1.00 0.00 C ATOM 1558 CD2 TYR A 218 11.172 5.509 -4.853 1.00 0.00 C ATOM 1559 CE1 TYR A 218 10.503 8.083 -5.789 1.00 0.00 C ATOM 1560 CE2 TYR A 218 11.935 6.102 -5.876 1.00 0.00 C ATOM 1561 CZ TYR A 218 11.597 7.389 -6.352 1.00 0.00 C ATOM 1562 OH TYR A 218 12.289 7.942 -7.386 1.00 0.00 O ATOM 0 H TYR A 218 7.502 5.422 -1.455 1.00 0.00 H new ATOM 0 HA TYR A 218 10.249 5.120 -1.449 1.00 0.00 H new ATOM 0 HB2 TYR A 218 9.217 4.426 -3.397 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.126 5.797 -3.449 1.00 0.00 H new ATOM 0 HD1 TYR A 218 8.835 7.958 -4.430 1.00 0.00 H new ATOM 0 HD2 TYR A 218 11.456 4.542 -4.465 1.00 0.00 H new ATOM 0 HE1 TYR A 218 10.278 9.091 -6.105 1.00 0.00 H new ATOM 0 HE2 TYR A 218 12.778 5.574 -6.297 1.00 0.00 H new ATOM 0 HH TYR A 218 13.011 7.338 -7.656 1.00 0.00 H new ATOM 1572 N GLN A 219 9.333 8.309 -1.622 1.00 0.00 N ATOM 1573 CA GLN A 219 9.903 9.654 -1.602 1.00 0.00 C ATOM 1574 C GLN A 219 10.983 9.776 -0.528 1.00 0.00 C ATOM 1575 O GLN A 219 12.033 10.348 -0.815 1.00 0.00 O ATOM 1576 CB GLN A 219 8.869 10.788 -1.505 1.00 0.00 C ATOM 1577 CG GLN A 219 8.212 11.125 -2.852 1.00 0.00 C ATOM 1578 CD GLN A 219 7.464 12.459 -2.831 1.00 0.00 C ATOM 1579 OE1 GLN A 219 7.132 13.002 -1.779 1.00 0.00 O ATOM 1580 NE2 GLN A 219 7.163 13.016 -3.990 1.00 0.00 N ATOM 0 H GLN A 219 8.315 8.276 -1.571 1.00 0.00 H new ATOM 0 HA GLN A 219 10.365 9.788 -2.580 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.095 10.505 -0.791 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.355 11.681 -1.111 1.00 0.00 H new ATOM 0 HG2 GLN A 219 8.978 11.156 -3.627 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.518 10.329 -3.121 1.00 0.00 H new ATOM 0 HE21 GLN A 219 7.440 12.563 -4.861 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.654 13.899 -4.014 1.00 0.00 H new ATOM 1589 N LYS A 220 10.760 9.168 0.642 1.00 0.00 N ATOM 1590 CA LYS A 220 11.726 9.045 1.715 1.00 0.00 C ATOM 1591 C LYS A 220 12.814 8.114 1.243 1.00 0.00 C ATOM 1592 O LYS A 220 13.878 8.612 0.938 1.00 0.00 O ATOM 1593 CB LYS A 220 11.089 8.560 3.031 1.00 0.00 C ATOM 1594 CG LYS A 220 10.040 9.535 3.583 1.00 0.00 C ATOM 1595 CD LYS A 220 8.680 9.386 2.888 1.00 0.00 C ATOM 1596 CE LYS A 220 7.586 10.151 3.636 1.00 0.00 C ATOM 1597 NZ LYS A 220 7.746 11.603 3.458 1.00 0.00 N ATOM 0 H LYS A 220 9.864 8.735 0.866 1.00 0.00 H new ATOM 0 HA LYS A 220 12.141 10.026 1.946 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.623 7.588 2.867 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.872 8.416 3.776 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.919 9.366 4.653 1.00 0.00 H new ATOM 0 HG3 LYS A 220 10.398 10.557 3.460 1.00 0.00 H new ATOM 0 HD2 LYS A 220 8.750 9.755 1.865 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.413 8.331 2.829 1.00 0.00 H new ATOM 0 HE2 LYS A 220 6.606 9.842 3.272 1.00 0.00 H new ATOM 0 HE3 LYS A 220 7.624 9.904 4.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 6.993 12.101 3.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.672 11.898 3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.686 11.837 2.447 1.00 0.00 H new ATOM 1611 N GLU A 221 12.594 6.801 1.170 1.00 0.00 N ATOM 1612 CA GLU A 221 13.687 5.828 1.015 1.00 0.00 C ATOM 1613 C GLU A 221 14.573 6.116 -0.190 1.00 0.00 C ATOM 1614 O GLU A 221 15.769 5.856 -0.101 1.00 0.00 O ATOM 1615 CB GLU A 221 13.131 4.429 0.846 1.00 0.00 C ATOM 1616 CG GLU A 221 12.598 3.895 2.186 1.00 0.00 C ATOM 1617 CD GLU A 221 11.762 2.666 2.152 1.00 0.00 C ATOM 1618 OE1 GLU A 221 11.542 2.071 1.070 1.00 0.00 O ATOM 1619 OE2 GLU A 221 11.491 2.235 3.297 1.00 0.00 O ATOM 0 H GLU A 221 11.666 6.381 1.216 1.00 0.00 H new ATOM 0 HA GLU A 221 14.287 5.911 1.921 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.330 4.437 0.107 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.909 3.766 0.467 1.00 0.00 H new ATOM 0 HG2 GLU A 221 13.452 3.703 2.835 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.013 4.687 2.655 1.00 0.00 H new ATOM 1626 N SER A 222 14.023 6.628 -1.296 1.00 0.00 N ATOM 1627 CA SER A 222 14.833 6.985 -2.440 1.00 0.00 C ATOM 1628 C SER A 222 15.769 8.107 -2.028 1.00 0.00 C ATOM 1629 O SER A 222 16.980 7.921 -2.054 1.00 0.00 O ATOM 1630 CB SER A 222 13.996 7.322 -3.687 1.00 0.00 C ATOM 1631 OG SER A 222 14.281 8.551 -4.342 1.00 0.00 O ATOM 0 H SER A 222 13.024 6.800 -1.412 1.00 0.00 H new ATOM 0 HA SER A 222 15.424 6.122 -2.746 1.00 0.00 H new ATOM 0 HB2 SER A 222 14.124 6.516 -4.409 1.00 0.00 H new ATOM 0 HB3 SER A 222 12.945 7.328 -3.398 1.00 0.00 H new ATOM 0 HG SER A 222 13.782 8.596 -5.184 1.00 0.00 H new ATOM 1637 N GLN A 223 15.205 9.254 -1.629 1.00 0.00 N ATOM 1638 CA GLN A 223 15.999 10.434 -1.328 1.00 0.00 C ATOM 1639 C GLN A 223 16.917 10.161 -0.151 1.00 0.00 C ATOM 1640 O GLN A 223 18.064 10.556 -0.156 1.00 0.00 O ATOM 1641 CB GLN A 223 15.155 11.666 -0.964 1.00 0.00 C ATOM 1642 CG GLN A 223 14.328 12.248 -2.101 1.00 0.00 C ATOM 1643 CD GLN A 223 15.159 12.639 -3.310 1.00 0.00 C ATOM 1644 OE1 GLN A 223 15.822 13.671 -3.286 1.00 0.00 O ATOM 1645 NE2 GLN A 223 15.134 11.863 -4.377 1.00 0.00 N ATOM 0 H GLN A 223 14.200 9.382 -1.509 1.00 0.00 H new ATOM 0 HA GLN A 223 16.555 10.649 -2.241 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.483 11.397 -0.149 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.820 12.443 -0.586 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.578 11.518 -2.405 1.00 0.00 H new ATOM 0 HG3 GLN A 223 13.792 13.125 -1.739 1.00 0.00 H new ATOM 0 HE21 GLN A 223 14.575 11.010 -4.374 1.00 0.00 H new ATOM 0 HE22 GLN A 223 15.673 12.117 -5.205 1.00 0.00 H new ATOM 1654 N ALA A 224 16.443 9.448 0.852 1.00 0.00 N ATOM 1655 CA ALA A 224 17.175 9.004 2.016 1.00 0.00 C ATOM 1656 C ALA A 224 18.373 8.142 1.636 1.00 0.00 C ATOM 1657 O ALA A 224 19.346 8.095 2.388 1.00 0.00 O ATOM 1658 CB ALA A 224 16.176 8.182 2.849 1.00 0.00 C ATOM 0 H ALA A 224 15.469 9.144 0.874 1.00 0.00 H new ATOM 0 HA ALA A 224 17.572 9.856 2.568 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.669 7.814 3.749 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.331 8.811 3.129 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.819 7.337 2.260 1.00 0.00 H new ATOM 1664 N TYR A 225 18.309 7.472 0.492 1.00 0.00 N ATOM 1665 CA TYR A 225 19.380 6.684 -0.071 1.00 0.00 C ATOM 1666 C TYR A 225 20.220 7.486 -1.066 1.00 0.00 C ATOM 1667 O TYR A 225 21.260 7.009 -1.495 1.00 0.00 O ATOM 1668 CB TYR A 225 18.758 5.423 -0.651 1.00 0.00 C ATOM 1669 CG TYR A 225 19.712 4.301 -0.960 1.00 0.00 C ATOM 1670 CD1 TYR A 225 20.341 3.616 0.097 1.00 0.00 C ATOM 1671 CD2 TYR A 225 19.914 3.904 -2.292 1.00 0.00 C ATOM 1672 CE1 TYR A 225 21.206 2.543 -0.188 1.00 0.00 C ATOM 1673 CE2 TYR A 225 20.740 2.815 -2.580 1.00 0.00 C ATOM 1674 CZ TYR A 225 21.410 2.150 -1.533 1.00 0.00 C ATOM 1675 OH TYR A 225 22.271 1.148 -1.841 1.00 0.00 O ATOM 0 H TYR A 225 17.470 7.468 -0.088 1.00 0.00 H new ATOM 0 HA TYR A 225 20.099 6.396 0.696 1.00 0.00 H new ATOM 0 HB2 TYR A 225 18.010 5.055 0.051 1.00 0.00 H new ATOM 0 HB3 TYR A 225 18.232 5.689 -1.568 1.00 0.00 H new ATOM 0 HD1 TYR A 225 20.161 3.912 1.120 1.00 0.00 H new ATOM 0 HD2 TYR A 225 19.430 4.441 -3.094 1.00 0.00 H new ATOM 0 HE1 TYR A 225 21.710 2.023 0.613 1.00 0.00 H new ATOM 0 HE2 TYR A 225 20.865 2.484 -3.600 1.00 0.00 H new ATOM 0 HH TYR A 225 22.283 1.014 -2.812 1.00 0.00 H new ATOM 1685 N TYR A 226 19.830 8.717 -1.390 1.00 0.00 N ATOM 1686 CA TYR A 226 20.423 9.529 -2.442 1.00 0.00 C ATOM 1687 C TYR A 226 20.981 10.854 -1.965 1.00 0.00 C ATOM 1688 O TYR A 226 21.734 11.517 -2.674 1.00 0.00 O ATOM 1689 CB TYR A 226 19.357 9.809 -3.507 1.00 0.00 C ATOM 1690 CG TYR A 226 19.642 9.101 -4.800 1.00 0.00 C ATOM 1691 CD1 TYR A 226 20.557 9.673 -5.698 1.00 0.00 C ATOM 1692 CD2 TYR A 226 19.016 7.877 -5.081 1.00 0.00 C ATOM 1693 CE1 TYR A 226 20.822 9.032 -6.928 1.00 0.00 C ATOM 1694 CE2 TYR A 226 19.311 7.208 -6.283 1.00 0.00 C ATOM 1695 CZ TYR A 226 20.204 7.787 -7.212 1.00 0.00 C ATOM 1696 OH TYR A 226 20.491 7.100 -8.350 1.00 0.00 O ATOM 0 H TYR A 226 19.065 9.190 -0.908 1.00 0.00 H new ATOM 0 HA TYR A 226 21.264 8.957 -2.835 1.00 0.00 H new ATOM 0 HB2 TYR A 226 18.382 9.498 -3.132 1.00 0.00 H new ATOM 0 HB3 TYR A 226 19.301 10.882 -3.688 1.00 0.00 H new ATOM 0 HD1 TYR A 226 21.056 10.598 -5.449 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.313 7.452 -4.380 1.00 0.00 H new ATOM 0 HE1 TYR A 226 21.489 9.485 -7.646 1.00 0.00 H new ATOM 0 HE2 TYR A 226 18.855 6.252 -6.495 1.00 0.00 H new ATOM 0 HH TYR A 226 19.972 6.269 -8.370 1.00 0.00 H new ATOM 1706 N ASP A 227 20.554 11.279 -0.791 1.00 0.00 N ATOM 1707 CA ASP A 227 20.743 12.613 -0.266 1.00 0.00 C ATOM 1708 C ASP A 227 22.209 12.808 0.073 1.00 0.00 C ATOM 1709 O ASP A 227 22.800 13.854 -0.197 1.00 0.00 O ATOM 1710 CB ASP A 227 19.903 12.726 1.022 1.00 0.00 C ATOM 1711 CG ASP A 227 20.305 13.889 1.925 1.00 0.00 C ATOM 1712 OD1 ASP A 227 19.708 14.977 1.787 1.00 0.00 O ATOM 1713 OD2 ASP A 227 21.103 13.691 2.875 1.00 0.00 O ATOM 0 H ASP A 227 20.042 10.673 -0.149 1.00 0.00 H new ATOM 0 HA ASP A 227 20.439 13.366 -0.993 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.853 12.836 0.750 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.991 11.796 1.584 1.00 0.00 H new ATOM 1718 N GLY A 228 22.767 11.767 0.681 1.00 0.00 N ATOM 1719 CA GLY A 228 24.133 11.799 1.166 1.00 0.00 C ATOM 1720 C GLY A 228 24.676 10.412 1.439 1.00 0.00 C ATOM 1721 O GLY A 228 25.463 10.258 2.373 1.00 0.00 O ATOM 0 H GLY A 228 22.285 10.884 0.849 1.00 0.00 H new ATOM 0 HA2 GLY A 228 24.766 12.297 0.431 1.00 0.00 H new ATOM 0 HA3 GLY A 228 24.178 12.391 2.080 1.00 0.00 H new ATOM 1725 N ARG A 229 24.185 9.397 0.717 1.00 0.00 N ATOM 1726 CA ARG A 229 24.232 8.019 1.148 1.00 0.00 C ATOM 1727 C ARG A 229 24.668 7.094 0.007 1.00 0.00 C ATOM 1728 O ARG A 229 25.463 6.188 0.248 1.00 0.00 O ATOM 1729 CB ARG A 229 22.830 7.746 1.729 1.00 0.00 C ATOM 1730 CG ARG A 229 22.395 6.301 1.708 1.00 0.00 C ATOM 1731 CD ARG A 229 23.354 5.317 2.376 1.00 0.00 C ATOM 1732 NE ARG A 229 22.752 4.625 3.525 1.00 0.00 N ATOM 1733 CZ ARG A 229 23.339 3.614 4.170 1.00 0.00 C ATOM 1734 NH1 ARG A 229 24.571 3.235 3.840 1.00 0.00 N ATOM 1735 NH2 ARG A 229 22.684 2.987 5.134 1.00 0.00 N ATOM 0 H ARG A 229 23.741 9.525 -0.192 1.00 0.00 H new ATOM 0 HA ARG A 229 24.985 7.821 1.911 1.00 0.00 H new ATOM 0 HB2 ARG A 229 22.806 8.101 2.759 1.00 0.00 H new ATOM 0 HB3 ARG A 229 22.102 8.336 1.172 1.00 0.00 H new ATOM 0 HG2 ARG A 229 21.424 6.225 2.197 1.00 0.00 H new ATOM 0 HG3 ARG A 229 22.254 5.997 0.671 1.00 0.00 H new ATOM 0 HD2 ARG A 229 23.679 4.579 1.643 1.00 0.00 H new ATOM 0 HD3 ARG A 229 24.245 5.852 2.706 1.00 0.00 H new ATOM 0 HE ARG A 229 21.835 4.934 3.847 1.00 0.00 H new ATOM 0 HH11 ARG A 229 25.070 3.717 3.092 1.00 0.00 H new ATOM 0 HH12 ARG A 229 25.017 2.462 4.335 1.00 0.00 H new ATOM 0 HH21 ARG A 229 21.737 3.277 5.380 1.00 0.00 H new ATOM 0 HH22 ARG A 229 23.126 2.214 5.631 1.00 0.00 H new