USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 887 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 Single : A 1 SER N :NH3+ -177:sc= 1.04 (180deg=0.986) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -170:sc= 1.27 (180deg=1.12) USER MOD Single : A 8 GLN : amide:sc= -0.799 X(o=-0.8,f=-0.63) USER MOD Single : A 9 THR OG1 : rot -160:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 1.24 K(o=1.2,f=-1) USER MOD Single : A 18 GLN : amide:sc= 1.47 K(o=1.5,f=-6.9!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.51 K(o=-0.51,f=-1.8!) USER MOD Single : A 44 GLN : amide:sc=-0.00464 X(o=-0.0046,f=-0.011) USER MOD Single : A 45 LYS NZ :NH3+ -165:sc= 1.26 (180deg=1.1) USER MOD Single : A 46 HIS : no HE2:sc= -0.209 K(o=-0.21,f=-2.9!) USER MOD Single : A 48 GLN : amide:sc= -0.0414 K(o=-0.041,f=-0.91) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 54 GLN : amide:sc= -0.143 K(o=-0.14,f=-3.4!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0272 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= 0.741 K(o=0.74,f=-4.1!) USER MOD Single : A 67 GLN : amide:sc= -0.0647 X(o=-0.065,f=-0.061) USER MOD Single : A 70 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.41) USER MOD Single : A 73 GLN : amide:sc= -0.872 K(o=-0.87,f=-2.1!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 163:sc= -0.0595 (180deg=-0.395) USER MOD Single : A 86 SER OG : rot -96:sc= 1.01 USER MOD Single : A 89 GLN : amide:sc= -0.215 K(o=-0.21,f=-0.79) USER MOD Single : A 96 GLN : amide:sc= 0.831 K(o=0.83,f=0) USER MOD Single : A 99 GLN : amide:sc= 0.543 K(o=0.54,f=-0.39) USER MOD Single : A 100 LYS NZ :NH3+ 160:sc= -0.0397 (180deg=-0.382) USER MOD Single : A 107 LYS NZ :NH3+ -108:sc= 1.22 (180deg=-0.427) USER MOD Single : A 108 LYS NZ :NH3+ -169:sc= 1.23 (180deg=0.939) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.081) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 12.169 3.737 18.276 1.00 0.00 N ATOM 2 CA SER A 1 12.965 3.672 17.043 1.00 0.00 C ATOM 3 C SER A 1 12.387 2.633 16.087 1.00 0.00 C ATOM 4 O SER A 1 12.740 2.590 14.901 1.00 0.00 O ATOM 5 CB SER A 1 14.404 3.309 17.391 1.00 0.00 C ATOM 6 OG SER A 1 14.887 4.118 18.450 1.00 0.00 O ATOM 0 H1 SER A 1 12.546 4.484 18.893 1.00 0.00 H new ATOM 0 H2 SER A 1 11.179 3.950 18.039 1.00 0.00 H new ATOM 0 H3 SER A 1 12.218 2.823 18.769 1.00 0.00 H new ATOM 0 HA SER A 1 12.939 4.645 16.553 1.00 0.00 H new ATOM 0 HB2 SER A 1 14.460 2.258 17.676 1.00 0.00 H new ATOM 0 HB3 SER A 1 15.038 3.435 16.513 1.00 0.00 H new ATOM 0 HG SER A 1 15.811 3.867 18.658 1.00 0.00 H new ATOM 14 N GLU A 2 11.495 1.807 16.610 1.00 0.00 N ATOM 15 CA GLU A 2 10.888 0.732 15.862 1.00 0.00 C ATOM 16 C GLU A 2 9.847 1.275 14.899 1.00 0.00 C ATOM 17 O GLU A 2 9.935 1.055 13.686 1.00 0.00 O ATOM 18 CB GLU A 2 10.249 -0.292 16.817 1.00 0.00 C ATOM 19 CG GLU A 2 11.182 -0.798 17.926 1.00 0.00 C ATOM 20 CD GLU A 2 11.297 0.162 19.106 1.00 0.00 C ATOM 21 OE1 GLU A 2 10.556 -0.014 20.091 1.00 0.00 O ATOM 22 OE2 GLU A 2 12.128 1.098 19.053 1.00 0.00 O1- ATOM 0 H GLU A 2 11.173 1.870 17.576 1.00 0.00 H new ATOM 0 HA GLU A 2 11.666 0.232 15.285 1.00 0.00 H new ATOM 0 HB2 GLU A 2 9.370 0.159 17.277 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.902 -1.145 16.235 1.00 0.00 H new ATOM 0 HG2 GLU A 2 10.819 -1.761 18.285 1.00 0.00 H new ATOM 0 HG3 GLU A 2 12.174 -0.967 17.507 1.00 0.00 H new ATOM 29 N PHE A 3 8.875 2.014 15.435 1.00 0.00 N ATOM 30 CA PHE A 3 7.824 2.602 14.612 1.00 0.00 C ATOM 31 C PHE A 3 8.409 3.600 13.618 1.00 0.00 C ATOM 32 O PHE A 3 7.810 3.883 12.595 1.00 0.00 O ATOM 33 CB PHE A 3 6.742 3.270 15.474 1.00 0.00 C ATOM 34 CG PHE A 3 5.702 4.006 14.662 1.00 0.00 C ATOM 35 CD1 PHE A 3 4.964 3.344 13.691 1.00 0.00 C ATOM 36 CD2 PHE A 3 5.479 5.359 14.860 1.00 0.00 C ATOM 37 CE1 PHE A 3 4.025 4.019 12.934 1.00 0.00 C ATOM 38 CE2 PHE A 3 4.538 6.036 14.108 1.00 0.00 C ATOM 39 CZ PHE A 3 3.812 5.367 13.144 1.00 0.00 C ATOM 0 H PHE A 3 8.796 2.218 16.431 1.00 0.00 H new ATOM 0 HA PHE A 3 7.353 1.793 14.054 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.249 2.510 16.080 1.00 0.00 H new ATOM 0 HB3 PHE A 3 7.216 3.969 16.163 1.00 0.00 H new ATOM 0 HD1 PHE A 3 5.125 2.289 13.525 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.047 5.890 15.610 1.00 0.00 H new ATOM 0 HE1 PHE A 3 3.459 3.493 12.180 1.00 0.00 H new ATOM 0 HE2 PHE A 3 4.371 7.090 14.275 1.00 0.00 H new ATOM 0 HZ PHE A 3 3.078 5.897 12.555 1.00 0.00 H new ATOM 49 N GLU A 4 9.590 4.104 13.917 1.00 0.00 N ATOM 50 CA GLU A 4 10.270 5.034 13.032 1.00 0.00 C ATOM 51 C GLU A 4 10.485 4.398 11.665 1.00 0.00 C ATOM 52 O GLU A 4 10.268 5.030 10.632 1.00 0.00 O ATOM 53 CB GLU A 4 11.613 5.425 13.630 1.00 0.00 C ATOM 54 CG GLU A 4 12.457 6.298 12.731 1.00 0.00 C ATOM 55 CD GLU A 4 13.869 6.404 13.218 1.00 0.00 C ATOM 56 OE1 GLU A 4 14.657 5.479 12.946 1.00 0.00 O ATOM 57 OE2 GLU A 4 14.200 7.404 13.879 1.00 0.00 O1- ATOM 0 H GLU A 4 10.103 3.884 14.771 1.00 0.00 H new ATOM 0 HA GLU A 4 9.652 5.924 12.916 1.00 0.00 H new ATOM 0 HB2 GLU A 4 11.441 5.949 14.570 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.171 4.519 13.867 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.452 5.890 11.720 1.00 0.00 H new ATOM 0 HG3 GLU A 4 12.017 7.294 12.675 1.00 0.00 H new ATOM 64 N LYS A 5 10.879 3.136 11.667 1.00 0.00 N ATOM 65 CA LYS A 5 11.120 2.419 10.430 1.00 0.00 C ATOM 66 C LYS A 5 9.798 2.159 9.718 1.00 0.00 C ATOM 67 O LYS A 5 9.688 2.329 8.503 1.00 0.00 O ATOM 68 CB LYS A 5 11.840 1.099 10.714 1.00 0.00 C ATOM 69 CG LYS A 5 13.101 1.247 11.559 1.00 0.00 C ATOM 70 CD LYS A 5 14.111 2.182 10.910 1.00 0.00 C ATOM 71 CE LYS A 5 15.380 2.298 11.744 1.00 0.00 C ATOM 72 NZ LYS A 5 15.118 2.878 13.089 1.00 0.00 N ATOM 0 H LYS A 5 11.038 2.588 12.512 1.00 0.00 H new ATOM 0 HA LYS A 5 11.755 3.027 9.785 1.00 0.00 H new ATOM 0 HB2 LYS A 5 11.152 0.424 11.223 1.00 0.00 H new ATOM 0 HB3 LYS A 5 12.104 0.630 9.766 1.00 0.00 H new ATOM 0 HG2 LYS A 5 12.835 1.628 12.545 1.00 0.00 H new ATOM 0 HG3 LYS A 5 13.556 0.268 11.708 1.00 0.00 H new ATOM 0 HD2 LYS A 5 14.361 1.815 9.915 1.00 0.00 H new ATOM 0 HD3 LYS A 5 13.666 3.169 10.784 1.00 0.00 H new ATOM 0 HE2 LYS A 5 15.830 1.312 11.857 1.00 0.00 H new ATOM 0 HE3 LYS A 5 16.104 2.920 11.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 16.022 3.095 13.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 14.562 3.751 12.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 14.587 2.194 13.665 1.00 0.00 H new ATOM 86 N LEU A 6 8.790 1.776 10.496 1.00 0.00 N ATOM 87 CA LEU A 6 7.453 1.517 9.966 1.00 0.00 C ATOM 88 C LEU A 6 6.856 2.792 9.386 1.00 0.00 C ATOM 89 O LEU A 6 6.199 2.767 8.345 1.00 0.00 O ATOM 90 CB LEU A 6 6.524 0.964 11.064 1.00 0.00 C ATOM 91 CG LEU A 6 6.656 -0.534 11.411 1.00 0.00 C ATOM 92 CD1 LEU A 6 6.370 -1.400 10.195 1.00 0.00 C ATOM 93 CD2 LEU A 6 8.026 -0.856 11.990 1.00 0.00 C ATOM 0 H LEU A 6 8.874 1.637 11.503 1.00 0.00 H new ATOM 0 HA LEU A 6 7.544 0.771 9.176 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.698 1.538 11.974 1.00 0.00 H new ATOM 0 HB3 LEU A 6 5.494 1.151 10.761 1.00 0.00 H new ATOM 0 HG LEU A 6 5.912 -0.759 12.176 1.00 0.00 H new ATOM 0 HD11 LEU A 6 6.470 -2.451 10.465 1.00 0.00 H new ATOM 0 HD12 LEU A 6 5.356 -1.210 9.844 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.079 -1.160 9.403 1.00 0.00 H new ATOM 0 HD21 LEU A 6 8.082 -1.919 12.222 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.797 -0.602 11.263 1.00 0.00 H new ATOM 0 HD23 LEU A 6 8.181 -0.277 12.900 1.00 0.00 H new ATOM 105 N ARG A 7 7.104 3.905 10.062 1.00 0.00 N ATOM 106 CA ARG A 7 6.604 5.195 9.633 1.00 0.00 C ATOM 107 C ARG A 7 7.185 5.567 8.287 1.00 0.00 C ATOM 108 O ARG A 7 6.468 6.040 7.414 1.00 0.00 O ATOM 109 CB ARG A 7 6.954 6.282 10.654 1.00 0.00 C ATOM 110 CG ARG A 7 6.415 7.657 10.284 1.00 0.00 C ATOM 111 CD ARG A 7 7.032 8.758 11.134 1.00 0.00 C ATOM 112 NE ARG A 7 6.774 8.577 12.564 1.00 0.00 N ATOM 113 CZ ARG A 7 5.879 9.283 13.262 1.00 0.00 C ATOM 114 NH1 ARG A 7 5.094 10.167 12.646 1.00 0.00 N ATOM 115 NH2 ARG A 7 5.763 9.096 14.572 1.00 0.00 N ATOM 0 H ARG A 7 7.656 3.935 10.919 1.00 0.00 H new ATOM 0 HA ARG A 7 5.520 5.121 9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 7 6.558 5.995 11.628 1.00 0.00 H new ATOM 0 HB3 ARG A 7 8.038 6.340 10.754 1.00 0.00 H new ATOM 0 HG2 ARG A 7 6.618 7.855 9.231 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.332 7.667 10.407 1.00 0.00 H new ATOM 0 HD2 ARG A 7 8.108 8.784 10.963 1.00 0.00 H new ATOM 0 HD3 ARG A 7 6.636 9.722 10.816 1.00 0.00 H new ATOM 0 HE ARG A 7 7.312 7.866 13.060 1.00 0.00 H new ATOM 0 HH11 ARG A 7 5.175 10.306 11.639 1.00 0.00 H new ATOM 0 HH12 ARG A 7 4.412 10.704 13.182 1.00 0.00 H new ATOM 0 HH21 ARG A 7 6.357 8.414 15.044 1.00 0.00 H new ATOM 0 HH22 ARG A 7 5.080 9.634 15.106 1.00 0.00 H new ATOM 129 N GLN A 8 8.484 5.333 8.115 1.00 0.00 N ATOM 130 CA GLN A 8 9.152 5.681 6.872 1.00 0.00 C ATOM 131 C GLN A 8 8.559 4.916 5.704 1.00 0.00 C ATOM 132 O GLN A 8 8.197 5.509 4.701 1.00 0.00 O ATOM 133 CB GLN A 8 10.650 5.383 6.960 1.00 0.00 C ATOM 134 CG GLN A 8 11.395 6.229 7.973 1.00 0.00 C ATOM 135 CD GLN A 8 12.863 5.858 8.071 1.00 0.00 C ATOM 136 OE1 GLN A 8 13.471 5.402 7.098 1.00 0.00 O ATOM 137 NE2 GLN A 8 13.444 6.058 9.237 1.00 0.00 N ATOM 0 H GLN A 8 9.088 4.907 8.818 1.00 0.00 H new ATOM 0 HA GLN A 8 9.006 6.749 6.710 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.785 4.331 7.213 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.097 5.535 5.978 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.307 7.280 7.699 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.928 6.114 8.951 1.00 0.00 H new ATOM 0 HE21 GLN A 8 12.906 6.437 10.017 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.432 5.834 9.360 1.00 0.00 H new ATOM 146 N THR A 9 8.398 3.612 5.871 1.00 0.00 N ATOM 147 CA THR A 9 7.869 2.771 4.810 1.00 0.00 C ATOM 148 C THR A 9 6.384 3.051 4.560 1.00 0.00 C ATOM 149 O THR A 9 5.948 3.171 3.410 1.00 0.00 O ATOM 150 CB THR A 9 8.081 1.283 5.129 1.00 0.00 C ATOM 151 OG1 THR A 9 9.481 1.043 5.337 1.00 0.00 O ATOM 152 CG2 THR A 9 7.581 0.407 3.993 1.00 0.00 C ATOM 0 H THR A 9 8.626 3.114 6.731 1.00 0.00 H new ATOM 0 HA THR A 9 8.418 3.014 3.900 1.00 0.00 H new ATOM 0 HB THR A 9 7.517 1.034 6.028 1.00 0.00 H new ATOM 0 HG1 THR A 9 9.669 0.088 5.225 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.743 -0.641 4.244 1.00 0.00 H new ATOM 0 HG22 THR A 9 6.516 0.583 3.839 1.00 0.00 H new ATOM 0 HG23 THR A 9 8.125 0.650 3.080 1.00 0.00 H new ATOM 160 N GLY A 10 5.619 3.168 5.639 1.00 0.00 N ATOM 161 CA GLY A 10 4.208 3.467 5.519 1.00 0.00 C ATOM 162 C GLY A 10 3.979 4.793 4.829 1.00 0.00 C ATOM 163 O GLY A 10 3.065 4.936 4.017 1.00 0.00 O ATOM 0 H GLY A 10 5.954 3.060 6.597 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.713 2.674 4.958 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.754 3.488 6.510 1.00 0.00 H new ATOM 167 N ASP A 11 4.816 5.761 5.156 1.00 0.00 N ATOM 168 CA ASP A 11 4.731 7.085 4.569 1.00 0.00 C ATOM 169 C ASP A 11 5.138 7.055 3.094 1.00 0.00 C ATOM 170 O ASP A 11 4.558 7.765 2.275 1.00 0.00 O ATOM 171 CB ASP A 11 5.598 8.071 5.352 1.00 0.00 C ATOM 172 CG ASP A 11 5.338 9.508 4.975 1.00 0.00 C ATOM 173 OD1 ASP A 11 4.228 10.015 5.268 1.00 0.00 O ATOM 174 OD2 ASP A 11 6.239 10.147 4.406 1.00 0.00 O1- ATOM 0 H ASP A 11 5.571 5.652 5.833 1.00 0.00 H new ATOM 0 HA ASP A 11 3.695 7.419 4.624 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.414 7.941 6.419 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.649 7.840 5.179 1.00 0.00 H new ATOM 179 N GLU A 12 6.130 6.212 2.758 1.00 0.00 N ATOM 180 CA GLU A 12 6.581 6.067 1.365 1.00 0.00 C ATOM 181 C GLU A 12 5.443 5.579 0.488 1.00 0.00 C ATOM 182 O GLU A 12 5.302 6.011 -0.656 1.00 0.00 O ATOM 183 CB GLU A 12 7.757 5.095 1.257 1.00 0.00 C ATOM 184 CG GLU A 12 9.024 5.578 1.927 1.00 0.00 C ATOM 185 CD GLU A 12 10.166 4.599 1.786 1.00 0.00 C ATOM 186 OE1 GLU A 12 10.075 3.482 2.336 1.00 0.00 O ATOM 187 OE2 GLU A 12 11.170 4.951 1.132 1.00 0.00 O1- ATOM 0 H GLU A 12 6.630 5.626 3.426 1.00 0.00 H new ATOM 0 HA GLU A 12 6.910 7.049 1.024 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.467 4.141 1.698 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.965 4.909 0.203 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.316 6.536 1.496 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.828 5.751 2.985 1.00 0.00 H new ATOM 194 N LEU A 13 4.628 4.681 1.033 1.00 0.00 N ATOM 195 CA LEU A 13 3.470 4.172 0.318 1.00 0.00 C ATOM 196 C LEU A 13 2.539 5.318 -0.021 1.00 0.00 C ATOM 197 O LEU A 13 2.104 5.461 -1.159 1.00 0.00 O ATOM 198 CB LEU A 13 2.729 3.128 1.164 1.00 0.00 C ATOM 199 CG LEU A 13 3.454 1.798 1.377 1.00 0.00 C ATOM 200 CD1 LEU A 13 2.720 0.956 2.410 1.00 0.00 C ATOM 201 CD2 LEU A 13 3.564 1.038 0.065 1.00 0.00 C ATOM 0 H LEU A 13 4.751 4.293 1.968 1.00 0.00 H new ATOM 0 HA LEU A 13 3.807 3.694 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.518 3.564 2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 13 1.768 2.923 0.692 1.00 0.00 H new ATOM 0 HG LEU A 13 4.459 2.007 1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 13 3.247 0.012 2.551 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.680 1.495 3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.706 0.757 2.063 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.082 0.094 0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.566 0.839 -0.325 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.123 1.635 -0.656 1.00 0.00 H new ATOM 213 N VAL A 14 2.267 6.153 0.969 1.00 0.00 N ATOM 214 CA VAL A 14 1.404 7.306 0.787 1.00 0.00 C ATOM 215 C VAL A 14 1.986 8.251 -0.264 1.00 0.00 C ATOM 216 O VAL A 14 1.271 8.718 -1.151 1.00 0.00 O ATOM 217 CB VAL A 14 1.199 8.075 2.115 1.00 0.00 C ATOM 218 CG1 VAL A 14 0.249 9.246 1.920 1.00 0.00 C ATOM 219 CG2 VAL A 14 0.683 7.143 3.200 1.00 0.00 C ATOM 0 H VAL A 14 2.636 6.051 1.914 1.00 0.00 H new ATOM 0 HA VAL A 14 0.436 6.938 0.448 1.00 0.00 H new ATOM 0 HB VAL A 14 2.165 8.469 2.431 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.120 9.771 2.866 1.00 0.00 H new ATOM 0 HG12 VAL A 14 0.662 9.930 1.178 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -0.717 8.877 1.575 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.546 7.703 4.125 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.270 6.716 2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.403 6.342 3.364 1.00 0.00 H new ATOM 229 N GLN A 15 3.293 8.496 -0.179 1.00 0.00 N ATOM 230 CA GLN A 15 3.971 9.390 -1.116 1.00 0.00 C ATOM 231 C GLN A 15 3.870 8.866 -2.541 1.00 0.00 C ATOM 232 O GLN A 15 3.518 9.607 -3.460 1.00 0.00 O ATOM 233 CB GLN A 15 5.452 9.531 -0.755 1.00 0.00 C ATOM 234 CG GLN A 15 5.732 10.199 0.579 1.00 0.00 C ATOM 235 CD GLN A 15 7.221 10.290 0.861 1.00 0.00 C ATOM 236 OE1 GLN A 15 8.032 10.376 -0.059 1.00 0.00 O ATOM 237 NE2 GLN A 15 7.594 10.270 2.125 1.00 0.00 N ATOM 0 H GLN A 15 3.903 8.088 0.529 1.00 0.00 H new ATOM 0 HA GLN A 15 3.480 10.361 -1.049 1.00 0.00 H new ATOM 0 HB2 GLN A 15 5.904 8.539 -0.748 1.00 0.00 H new ATOM 0 HB3 GLN A 15 5.948 10.102 -1.540 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.299 11.199 0.583 1.00 0.00 H new ATOM 0 HG3 GLN A 15 5.244 9.638 1.376 1.00 0.00 H new ATOM 0 HE21 GLN A 15 6.893 10.198 2.862 1.00 0.00 H new ATOM 0 HE22 GLN A 15 8.584 10.327 2.366 1.00 0.00 H new ATOM 246 N ALA A 16 4.152 7.584 -2.710 1.00 0.00 N ATOM 247 CA ALA A 16 4.145 6.966 -4.023 1.00 0.00 C ATOM 248 C ALA A 16 2.735 6.867 -4.592 1.00 0.00 C ATOM 249 O ALA A 16 2.517 7.158 -5.765 1.00 0.00 O ATOM 250 CB ALA A 16 4.801 5.598 -3.967 1.00 0.00 C ATOM 0 H ALA A 16 4.390 6.949 -1.948 1.00 0.00 H new ATOM 0 HA ALA A 16 4.721 7.603 -4.694 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.788 5.147 -4.959 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.832 5.702 -3.629 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.255 4.961 -3.272 1.00 0.00 H new ATOM 256 N PHE A 17 1.778 6.470 -3.759 1.00 0.00 N ATOM 257 CA PHE A 17 0.393 6.343 -4.199 1.00 0.00 C ATOM 258 C PHE A 17 -0.190 7.683 -4.649 1.00 0.00 C ATOM 259 O PHE A 17 -0.949 7.740 -5.619 1.00 0.00 O ATOM 260 CB PHE A 17 -0.487 5.683 -3.132 1.00 0.00 C ATOM 261 CG PHE A 17 -0.361 4.176 -3.095 1.00 0.00 C ATOM 262 CD1 PHE A 17 -0.019 3.515 -1.926 1.00 0.00 C ATOM 263 CD2 PHE A 17 -0.592 3.424 -4.236 1.00 0.00 C ATOM 264 CE1 PHE A 17 0.087 2.135 -1.896 1.00 0.00 C ATOM 265 CE2 PHE A 17 -0.484 2.046 -4.211 1.00 0.00 C ATOM 266 CZ PHE A 17 -0.146 1.403 -3.039 1.00 0.00 C ATOM 0 H PHE A 17 1.935 6.232 -2.780 1.00 0.00 H new ATOM 0 HA PHE A 17 0.401 5.685 -5.068 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.223 6.086 -2.154 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.528 5.948 -3.316 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.167 4.084 -1.027 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.860 3.921 -5.157 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.352 1.633 -0.977 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -0.664 1.473 -5.109 1.00 0.00 H new ATOM 0 HZ PHE A 17 -0.064 0.326 -3.017 1.00 0.00 H new ATOM 276 N GLN A 18 0.161 8.762 -3.948 1.00 0.00 N ATOM 277 CA GLN A 18 -0.303 10.090 -4.335 1.00 0.00 C ATOM 278 C GLN A 18 0.205 10.446 -5.733 1.00 0.00 C ATOM 279 O GLN A 18 -0.543 10.961 -6.565 1.00 0.00 O ATOM 280 CB GLN A 18 0.151 11.143 -3.320 1.00 0.00 C ATOM 281 CG GLN A 18 -0.537 11.036 -1.967 1.00 0.00 C ATOM 282 CD GLN A 18 -2.045 11.179 -2.060 1.00 0.00 C ATOM 283 OE1 GLN A 18 -2.564 11.885 -2.930 1.00 0.00 O ATOM 284 NE2 GLN A 18 -2.754 10.509 -1.171 1.00 0.00 N ATOM 0 H GLN A 18 0.757 8.742 -3.121 1.00 0.00 H new ATOM 0 HA GLN A 18 -1.393 10.078 -4.351 1.00 0.00 H new ATOM 0 HB2 GLN A 18 1.228 11.054 -3.177 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -0.035 12.135 -3.733 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -0.295 10.073 -1.517 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -0.144 11.806 -1.303 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -2.283 9.937 -0.469 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -3.772 10.563 -1.186 1.00 0.00 H new ATOM 293 N ARG A 19 1.474 10.143 -5.990 1.00 0.00 N ATOM 294 CA ARG A 19 2.078 10.386 -7.302 1.00 0.00 C ATOM 295 C ARG A 19 1.495 9.447 -8.342 1.00 0.00 C ATOM 296 O ARG A 19 1.364 9.802 -9.511 1.00 0.00 O ATOM 297 CB ARG A 19 3.609 10.273 -7.255 1.00 0.00 C ATOM 298 CG ARG A 19 4.305 11.546 -6.781 1.00 0.00 C ATOM 299 CD ARG A 19 3.884 11.919 -5.373 1.00 0.00 C ATOM 300 NE ARG A 19 4.362 13.237 -4.976 1.00 0.00 N ATOM 301 CZ ARG A 19 4.402 13.662 -3.715 1.00 0.00 C ATOM 302 NH1 ARG A 19 4.020 12.854 -2.726 1.00 0.00 N ATOM 303 NH2 ARG A 19 4.815 14.892 -3.439 1.00 0.00 N ATOM 0 H ARG A 19 2.108 9.728 -5.307 1.00 0.00 H new ATOM 0 HA ARG A 19 1.839 11.410 -7.590 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.883 9.452 -6.593 1.00 0.00 H new ATOM 0 HB3 ARG A 19 3.976 10.018 -8.249 1.00 0.00 H new ATOM 0 HG2 ARG A 19 5.385 11.405 -6.813 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.070 12.365 -7.461 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.796 11.895 -5.305 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.264 11.173 -4.675 1.00 0.00 H new ATOM 0 HE ARG A 19 4.685 13.871 -5.707 1.00 0.00 H new ATOM 0 HH11 ARG A 19 3.697 11.909 -2.935 1.00 0.00 H new ATOM 0 HH12 ARG A 19 4.051 13.180 -1.760 1.00 0.00 H new ATOM 0 HH21 ARG A 19 5.103 15.515 -4.194 1.00 0.00 H new ATOM 0 HH22 ARG A 19 4.845 15.215 -2.472 1.00 0.00 H new ATOM 317 N LEU A 20 1.144 8.248 -7.903 1.00 0.00 N ATOM 318 CA LEU A 20 0.545 7.250 -8.772 1.00 0.00 C ATOM 319 C LEU A 20 -0.751 7.792 -9.362 1.00 0.00 C ATOM 320 O LEU A 20 -1.016 7.632 -10.552 1.00 0.00 O ATOM 321 CB LEU A 20 0.254 5.974 -7.977 1.00 0.00 C ATOM 322 CG LEU A 20 -0.315 4.804 -8.775 1.00 0.00 C ATOM 323 CD1 LEU A 20 0.734 4.236 -9.703 1.00 0.00 C ATOM 324 CD2 LEU A 20 -0.841 3.731 -7.841 1.00 0.00 C ATOM 0 H LEU A 20 1.266 7.941 -6.938 1.00 0.00 H new ATOM 0 HA LEU A 20 1.240 7.018 -9.579 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.178 5.648 -7.501 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.447 6.219 -7.179 1.00 0.00 H new ATOM 0 HG LEU A 20 -1.145 5.169 -9.380 1.00 0.00 H new ATOM 0 HD11 LEU A 20 0.311 3.403 -10.264 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.064 5.010 -10.396 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.585 3.885 -9.119 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.243 2.904 -8.426 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -0.030 3.368 -7.210 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.629 4.149 -7.214 1.00 0.00 H new ATOM 336 N ARG A 21 -1.545 8.452 -8.527 1.00 0.00 N ATOM 337 CA ARG A 21 -2.788 9.054 -8.977 1.00 0.00 C ATOM 338 C ARG A 21 -2.508 10.174 -9.964 1.00 0.00 C ATOM 339 O ARG A 21 -3.224 10.339 -10.947 1.00 0.00 O ATOM 340 CB ARG A 21 -3.602 9.572 -7.796 1.00 0.00 C ATOM 341 CG ARG A 21 -4.912 10.241 -8.199 1.00 0.00 C ATOM 342 CD ARG A 21 -5.895 10.292 -7.045 1.00 0.00 C ATOM 343 NE ARG A 21 -5.309 10.871 -5.840 1.00 0.00 N ATOM 344 CZ ARG A 21 -5.764 10.642 -4.609 1.00 0.00 C ATOM 345 NH1 ARG A 21 -6.843 9.884 -4.420 1.00 0.00 N ATOM 346 NH2 ARG A 21 -5.149 11.177 -3.566 1.00 0.00 N ATOM 0 H ARG A 21 -1.347 8.582 -7.535 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.375 8.286 -9.481 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -3.820 8.741 -7.125 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -2.998 10.285 -7.235 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.711 11.253 -8.550 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.357 9.697 -9.032 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -6.766 10.877 -7.339 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -6.247 9.284 -6.826 1.00 0.00 H new ATOM 0 HE ARG A 21 -4.503 11.487 -5.947 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -7.326 9.475 -5.220 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -7.187 9.712 -3.475 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -4.327 11.765 -3.705 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -5.497 11.002 -2.623 1.00 0.00 H new ATOM 360 N GLU A 22 -1.457 10.933 -9.699 1.00 0.00 N ATOM 361 CA GLU A 22 -1.047 12.017 -10.588 1.00 0.00 C ATOM 362 C GLU A 22 -0.697 11.472 -11.969 1.00 0.00 C ATOM 363 O GLU A 22 -1.114 12.022 -12.992 1.00 0.00 O ATOM 364 CB GLU A 22 0.153 12.761 -10.012 1.00 0.00 C ATOM 365 CG GLU A 22 -0.119 13.447 -8.691 1.00 0.00 C ATOM 366 CD GLU A 22 1.077 14.219 -8.190 1.00 0.00 C ATOM 367 OE1 GLU A 22 1.661 13.823 -7.163 1.00 0.00 O ATOM 368 OE2 GLU A 22 1.442 15.227 -8.822 1.00 0.00 O1- ATOM 0 H GLU A 22 -0.868 10.821 -8.874 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.882 12.711 -10.680 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.974 12.057 -9.881 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.485 13.507 -10.734 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.965 14.125 -8.804 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.404 12.701 -7.949 1.00 0.00 H new ATOM 375 N ILE A 23 0.064 10.389 -11.989 1.00 0.00 N ATOM 376 CA ILE A 23 0.448 9.740 -13.233 1.00 0.00 C ATOM 377 C ILE A 23 -0.777 9.126 -13.913 1.00 0.00 C ATOM 378 O ILE A 23 -0.924 9.193 -15.135 1.00 0.00 O ATOM 379 CB ILE A 23 1.518 8.651 -12.988 1.00 0.00 C ATOM 380 CG1 ILE A 23 2.782 9.287 -12.396 1.00 0.00 C ATOM 381 CG2 ILE A 23 1.843 7.918 -14.279 1.00 0.00 C ATOM 382 CD1 ILE A 23 3.884 8.296 -12.089 1.00 0.00 C ATOM 0 H ILE A 23 0.430 9.938 -11.151 1.00 0.00 H new ATOM 0 HA ILE A 23 0.877 10.499 -13.888 1.00 0.00 H new ATOM 0 HB ILE A 23 1.123 7.924 -12.278 1.00 0.00 H new ATOM 0 HG12 ILE A 23 3.162 10.033 -13.094 1.00 0.00 H new ATOM 0 HG13 ILE A 23 2.516 9.814 -11.480 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.598 7.156 -14.085 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.941 7.444 -14.666 1.00 0.00 H new ATOM 0 HG23 ILE A 23 2.224 8.627 -15.014 1.00 0.00 H new ATOM 0 HD11 ILE A 23 4.743 8.824 -11.674 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.524 7.564 -11.366 1.00 0.00 H new ATOM 0 HD13 ILE A 23 4.180 7.786 -13.006 1.00 0.00 H new ATOM 394 N PHE A 24 -1.657 8.544 -13.108 1.00 0.00 N ATOM 395 CA PHE A 24 -2.908 7.976 -13.599 1.00 0.00 C ATOM 396 C PHE A 24 -3.754 9.067 -14.249 1.00 0.00 C ATOM 397 O PHE A 24 -4.380 8.855 -15.292 1.00 0.00 O ATOM 398 CB PHE A 24 -3.670 7.317 -12.438 1.00 0.00 C ATOM 399 CG PHE A 24 -5.056 6.856 -12.783 1.00 0.00 C ATOM 400 CD1 PHE A 24 -5.263 5.906 -13.768 1.00 0.00 C ATOM 401 CD2 PHE A 24 -6.155 7.371 -12.113 1.00 0.00 C ATOM 402 CE1 PHE A 24 -6.537 5.480 -14.080 1.00 0.00 C ATOM 403 CE2 PHE A 24 -7.432 6.949 -12.420 1.00 0.00 C ATOM 404 CZ PHE A 24 -7.624 6.003 -13.404 1.00 0.00 C ATOM 0 H PHE A 24 -1.526 8.452 -12.101 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.691 7.215 -14.349 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.095 6.462 -12.082 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.732 8.026 -11.612 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.417 5.494 -14.298 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -6.010 8.112 -11.341 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.686 4.739 -14.851 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -8.279 7.359 -11.891 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.622 5.671 -13.647 1.00 0.00 H new ATOM 414 N ASP A 25 -3.750 10.235 -13.630 1.00 0.00 N ATOM 415 CA ASP A 25 -4.466 11.396 -14.139 1.00 0.00 C ATOM 416 C ASP A 25 -3.896 11.833 -15.486 1.00 0.00 C ATOM 417 O ASP A 25 -4.625 12.304 -16.355 1.00 0.00 O ATOM 418 CB ASP A 25 -4.392 12.543 -13.128 1.00 0.00 C ATOM 419 CG ASP A 25 -4.950 13.840 -13.666 1.00 0.00 C ATOM 420 OD1 ASP A 25 -6.189 13.954 -13.802 1.00 0.00 O ATOM 421 OD2 ASP A 25 -4.152 14.759 -13.942 1.00 0.00 O1- ATOM 0 H ASP A 25 -3.249 10.407 -12.758 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.511 11.124 -14.285 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.940 12.263 -12.228 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.353 12.695 -12.834 1.00 0.00 H new ATOM 426 N LYS A 26 -2.597 11.649 -15.662 1.00 0.00 N ATOM 427 CA LYS A 26 -1.939 12.002 -16.915 1.00 0.00 C ATOM 428 C LYS A 26 -2.113 10.894 -17.953 1.00 0.00 C ATOM 429 O LYS A 26 -1.932 11.114 -19.150 1.00 0.00 O ATOM 430 CB LYS A 26 -0.458 12.273 -16.684 1.00 0.00 C ATOM 431 CG LYS A 26 -0.182 13.468 -15.793 1.00 0.00 C ATOM 432 CD LYS A 26 1.311 13.673 -15.578 1.00 0.00 C ATOM 433 CE LYS A 26 2.040 13.905 -16.895 1.00 0.00 C ATOM 434 NZ LYS A 26 3.466 14.247 -16.683 1.00 0.00 N ATOM 0 H LYS A 26 -1.975 11.257 -14.954 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.407 12.909 -17.296 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.002 11.388 -16.240 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.027 12.431 -17.647 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.612 14.364 -16.241 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.673 13.326 -14.830 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.471 14.526 -14.918 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.731 12.800 -15.078 1.00 0.00 H new ATOM 0 HE2 LYS A 26 1.969 13.009 -17.512 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.551 14.710 -17.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 3.927 14.397 -17.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.534 15.116 -16.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.939 13.468 -16.182 1.00 0.00 H new ATOM 448 N GLY A 27 -2.467 9.711 -17.486 1.00 0.00 N ATOM 449 CA GLY A 27 -2.701 8.595 -18.377 1.00 0.00 C ATOM 450 C GLY A 27 -1.423 7.966 -18.893 1.00 0.00 C ATOM 451 O GLY A 27 -1.415 7.365 -19.966 1.00 0.00 O ATOM 0 H GLY A 27 -2.598 9.501 -16.497 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.286 7.838 -17.855 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.299 8.933 -19.223 1.00 0.00 H new ATOM 455 N ASP A 28 -0.342 8.104 -18.143 1.00 0.00 N ATOM 456 CA ASP A 28 0.937 7.516 -18.535 1.00 0.00 C ATOM 457 C ASP A 28 1.038 6.087 -18.025 1.00 0.00 C ATOM 458 O ASP A 28 1.474 5.848 -16.901 1.00 0.00 O ATOM 459 CB ASP A 28 2.118 8.348 -18.015 1.00 0.00 C ATOM 460 CG ASP A 28 2.267 9.676 -18.729 1.00 0.00 C ATOM 461 OD1 ASP A 28 3.095 9.767 -19.660 1.00 0.00 O ATOM 462 OD2 ASP A 28 1.566 10.634 -18.366 1.00 0.00 O1- ATOM 0 H ASP A 28 -0.320 8.616 -17.261 1.00 0.00 H new ATOM 0 HA ASP A 28 0.983 7.511 -19.624 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.986 8.528 -16.948 1.00 0.00 H new ATOM 0 HB3 ASP A 28 3.038 7.775 -18.130 1.00 0.00 H new ATOM 467 N ASP A 29 0.619 5.146 -18.857 1.00 0.00 N ATOM 468 CA ASP A 29 0.593 3.720 -18.496 1.00 0.00 C ATOM 469 C ASP A 29 1.973 3.203 -18.108 1.00 0.00 C ATOM 470 O ASP A 29 2.118 2.492 -17.111 1.00 0.00 O ATOM 471 CB ASP A 29 0.046 2.881 -19.656 1.00 0.00 C ATOM 472 CG ASP A 29 -1.345 3.291 -20.078 1.00 0.00 C ATOM 473 OD1 ASP A 29 -1.466 4.232 -20.893 1.00 0.00 O ATOM 474 OD2 ASP A 29 -2.328 2.672 -19.610 1.00 0.00 O1- ATOM 0 H ASP A 29 0.286 5.339 -19.802 1.00 0.00 H new ATOM 0 HA ASP A 29 -0.063 3.624 -17.630 1.00 0.00 H new ATOM 0 HB2 ASP A 29 0.719 2.969 -20.509 1.00 0.00 H new ATOM 0 HB3 ASP A 29 0.036 1.831 -19.364 1.00 0.00 H new ATOM 479 N ASP A 30 2.984 3.574 -18.885 1.00 0.00 N ATOM 480 CA ASP A 30 4.353 3.108 -18.637 1.00 0.00 C ATOM 481 C ASP A 30 4.856 3.591 -17.277 1.00 0.00 C ATOM 482 O ASP A 30 5.448 2.832 -16.514 1.00 0.00 O ATOM 483 CB ASP A 30 5.310 3.573 -19.755 1.00 0.00 C ATOM 484 CG ASP A 30 5.674 5.047 -19.661 1.00 0.00 C ATOM 485 OD1 ASP A 30 4.818 5.900 -19.972 1.00 0.00 O ATOM 486 OD2 ASP A 30 6.816 5.356 -19.271 1.00 0.00 O1- ATOM 0 H ASP A 30 2.888 4.193 -19.690 1.00 0.00 H new ATOM 0 HA ASP A 30 4.334 2.018 -18.633 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.222 2.977 -19.714 1.00 0.00 H new ATOM 0 HB3 ASP A 30 4.847 3.381 -20.723 1.00 0.00 H new ATOM 491 N SER A 31 4.599 4.851 -16.978 1.00 0.00 N ATOM 492 CA SER A 31 5.021 5.437 -15.727 1.00 0.00 C ATOM 493 C SER A 31 4.192 4.889 -14.571 1.00 0.00 C ATOM 494 O SER A 31 4.687 4.731 -13.458 1.00 0.00 O ATOM 495 CB SER A 31 4.907 6.952 -15.806 1.00 0.00 C ATOM 496 OG SER A 31 5.572 7.443 -16.961 1.00 0.00 O ATOM 0 H SER A 31 4.095 5.490 -17.593 1.00 0.00 H new ATOM 0 HA SER A 31 6.063 5.173 -15.544 1.00 0.00 H new ATOM 0 HB2 SER A 31 3.857 7.242 -15.833 1.00 0.00 H new ATOM 0 HB3 SER A 31 5.339 7.402 -14.912 1.00 0.00 H new ATOM 0 HG SER A 31 5.487 8.419 -16.997 1.00 0.00 H new ATOM 502 N LEU A 32 2.930 4.592 -14.855 1.00 0.00 N ATOM 503 CA LEU A 32 2.017 4.063 -13.858 1.00 0.00 C ATOM 504 C LEU A 32 2.512 2.710 -13.351 1.00 0.00 C ATOM 505 O LEU A 32 2.591 2.481 -12.148 1.00 0.00 O ATOM 506 CB LEU A 32 0.618 3.907 -14.470 1.00 0.00 C ATOM 507 CG LEU A 32 -0.519 3.615 -13.494 1.00 0.00 C ATOM 508 CD1 LEU A 32 -0.856 4.853 -12.685 1.00 0.00 C ATOM 509 CD2 LEU A 32 -1.743 3.114 -14.238 1.00 0.00 C ATOM 0 H LEU A 32 2.515 4.711 -15.779 1.00 0.00 H new ATOM 0 HA LEU A 32 1.971 4.757 -13.019 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.378 4.822 -15.011 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.654 3.102 -15.204 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.192 2.835 -12.807 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.668 4.626 -11.995 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.022 5.169 -12.121 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.164 5.654 -13.357 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.543 2.911 -13.527 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.073 3.872 -14.948 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.493 2.198 -14.774 1.00 0.00 H new ATOM 521 N GLU A 33 2.887 1.838 -14.284 1.00 0.00 N ATOM 522 CA GLU A 33 3.373 0.507 -13.947 1.00 0.00 C ATOM 523 C GLU A 33 4.669 0.581 -13.141 1.00 0.00 C ATOM 524 O GLU A 33 4.892 -0.217 -12.226 1.00 0.00 O ATOM 525 CB GLU A 33 3.590 -0.318 -15.214 1.00 0.00 C ATOM 526 CG GLU A 33 4.064 -1.731 -14.941 1.00 0.00 C ATOM 527 CD GLU A 33 4.347 -2.509 -16.200 1.00 0.00 C ATOM 528 OE1 GLU A 33 5.477 -2.412 -16.722 1.00 0.00 O ATOM 529 OE2 GLU A 33 3.450 -3.237 -16.670 1.00 0.00 O1- ATOM 0 H GLU A 33 2.862 2.033 -15.285 1.00 0.00 H new ATOM 0 HA GLU A 33 2.616 0.020 -13.332 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.657 -0.358 -15.776 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.321 0.186 -15.846 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.967 -1.694 -14.332 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.308 -2.256 -14.358 1.00 0.00 H new ATOM 536 N GLN A 34 5.503 1.557 -13.473 1.00 0.00 N ATOM 537 CA GLN A 34 6.787 1.738 -12.811 1.00 0.00 C ATOM 538 C GLN A 34 6.587 1.957 -11.311 1.00 0.00 C ATOM 539 O GLN A 34 7.324 1.410 -10.490 1.00 0.00 O ATOM 540 CB GLN A 34 7.536 2.925 -13.457 1.00 0.00 C ATOM 541 CG GLN A 34 8.983 3.116 -12.998 1.00 0.00 C ATOM 542 CD GLN A 34 9.106 3.879 -11.692 1.00 0.00 C ATOM 543 OE1 GLN A 34 8.266 4.717 -11.366 1.00 0.00 O ATOM 544 NE2 GLN A 34 10.157 3.606 -10.946 1.00 0.00 N ATOM 0 H GLN A 34 5.310 2.242 -14.204 1.00 0.00 H new ATOM 0 HA GLN A 34 7.390 0.839 -12.935 1.00 0.00 H new ATOM 0 HB2 GLN A 34 7.531 2.791 -14.539 1.00 0.00 H new ATOM 0 HB3 GLN A 34 6.982 3.840 -13.247 1.00 0.00 H new ATOM 0 HG2 GLN A 34 9.452 2.139 -12.885 1.00 0.00 H new ATOM 0 HG3 GLN A 34 9.535 3.647 -13.774 1.00 0.00 H new ATOM 0 HE21 GLN A 34 10.831 2.904 -11.252 1.00 0.00 H new ATOM 0 HE22 GLN A 34 10.297 4.097 -10.063 1.00 0.00 H new ATOM 553 N VAL A 35 5.568 2.729 -10.961 1.00 0.00 N ATOM 554 CA VAL A 35 5.269 3.004 -9.564 1.00 0.00 C ATOM 555 C VAL A 35 4.744 1.751 -8.858 1.00 0.00 C ATOM 556 O VAL A 35 5.054 1.522 -7.695 1.00 0.00 O ATOM 557 CB VAL A 35 4.261 4.164 -9.409 1.00 0.00 C ATOM 558 CG1 VAL A 35 3.988 4.457 -7.938 1.00 0.00 C ATOM 559 CG2 VAL A 35 4.777 5.410 -10.107 1.00 0.00 C ATOM 0 H VAL A 35 4.935 3.175 -11.625 1.00 0.00 H new ATOM 0 HA VAL A 35 6.204 3.307 -9.092 1.00 0.00 H new ATOM 0 HB VAL A 35 3.323 3.862 -9.876 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.275 5.278 -7.857 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.574 3.569 -7.461 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.919 4.735 -7.443 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.056 6.218 -9.989 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.729 5.706 -9.666 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.917 5.201 -11.168 1.00 0.00 H new ATOM 569 N LEU A 36 3.964 0.932 -9.571 1.00 0.00 N ATOM 570 CA LEU A 36 3.454 -0.316 -8.999 1.00 0.00 C ATOM 571 C LEU A 36 4.603 -1.229 -8.594 1.00 0.00 C ATOM 572 O LEU A 36 4.529 -1.925 -7.577 1.00 0.00 O ATOM 573 CB LEU A 36 2.530 -1.043 -9.983 1.00 0.00 C ATOM 574 CG LEU A 36 1.052 -0.648 -9.934 1.00 0.00 C ATOM 575 CD1 LEU A 36 0.841 0.774 -10.400 1.00 0.00 C ATOM 576 CD2 LEU A 36 0.214 -1.611 -10.752 1.00 0.00 C ATOM 0 H LEU A 36 3.675 1.108 -10.533 1.00 0.00 H new ATOM 0 HA LEU A 36 2.875 -0.059 -8.112 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.899 -0.868 -10.994 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.605 -2.114 -9.797 1.00 0.00 H new ATOM 0 HG LEU A 36 0.729 -0.704 -8.894 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.220 1.019 -10.352 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.400 1.454 -9.758 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.190 0.876 -11.427 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.833 -1.313 -10.704 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.549 -1.595 -11.789 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.323 -2.619 -10.351 1.00 0.00 H new ATOM 588 N GLU A 37 5.663 -1.220 -9.386 1.00 0.00 N ATOM 589 CA GLU A 37 6.848 -1.998 -9.076 1.00 0.00 C ATOM 590 C GLU A 37 7.508 -1.459 -7.809 1.00 0.00 C ATOM 591 O GLU A 37 7.948 -2.222 -6.948 1.00 0.00 O ATOM 592 CB GLU A 37 7.826 -1.962 -10.245 1.00 0.00 C ATOM 593 CG GLU A 37 7.287 -2.605 -11.513 1.00 0.00 C ATOM 594 CD GLU A 37 8.266 -2.534 -12.658 1.00 0.00 C ATOM 595 OE1 GLU A 37 7.871 -2.130 -13.766 1.00 0.00 O ATOM 596 OE2 GLU A 37 9.447 -2.872 -12.454 1.00 0.00 O1- ATOM 0 H GLU A 37 5.725 -0.681 -10.250 1.00 0.00 H new ATOM 0 HA GLU A 37 6.556 -3.034 -8.905 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.087 -0.925 -10.457 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.746 -2.469 -9.954 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.043 -3.648 -11.312 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.359 -2.110 -11.801 1.00 0.00 H new ATOM 603 N GLU A 38 7.545 -0.136 -7.697 1.00 0.00 N ATOM 604 CA GLU A 38 8.102 0.531 -6.527 1.00 0.00 C ATOM 605 C GLU A 38 7.278 0.200 -5.291 1.00 0.00 C ATOM 606 O GLU A 38 7.822 -0.084 -4.218 1.00 0.00 O ATOM 607 CB GLU A 38 8.123 2.044 -6.749 1.00 0.00 C ATOM 608 CG GLU A 38 8.970 2.479 -7.927 1.00 0.00 C ATOM 609 CD GLU A 38 10.434 2.157 -7.742 1.00 0.00 C ATOM 610 OE1 GLU A 38 11.170 3.014 -7.215 1.00 0.00 O ATOM 611 OE2 GLU A 38 10.860 1.058 -8.134 1.00 0.00 O1- ATOM 0 H GLU A 38 7.192 0.501 -8.411 1.00 0.00 H new ATOM 0 HA GLU A 38 9.122 0.179 -6.375 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.102 2.394 -6.899 1.00 0.00 H new ATOM 0 HB3 GLU A 38 8.496 2.529 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.606 1.991 -8.831 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.854 3.553 -8.076 1.00 0.00 H new ATOM 618 N ILE A 39 5.961 0.230 -5.457 1.00 0.00 N ATOM 619 CA ILE A 39 5.031 -0.092 -4.388 1.00 0.00 C ATOM 620 C ILE A 39 5.260 -1.512 -3.900 1.00 0.00 C ATOM 621 O ILE A 39 5.225 -1.779 -2.702 1.00 0.00 O ATOM 622 CB ILE A 39 3.557 0.054 -4.865 1.00 0.00 C ATOM 623 CG1 ILE A 39 3.226 1.517 -5.182 1.00 0.00 C ATOM 624 CG2 ILE A 39 2.587 -0.504 -3.833 1.00 0.00 C ATOM 625 CD1 ILE A 39 3.337 2.445 -3.991 1.00 0.00 C ATOM 0 H ILE A 39 5.510 0.479 -6.338 1.00 0.00 H new ATOM 0 HA ILE A 39 5.208 0.609 -3.572 1.00 0.00 H new ATOM 0 HB ILE A 39 3.446 -0.527 -5.780 1.00 0.00 H new ATOM 0 HG12 ILE A 39 3.895 1.868 -5.967 1.00 0.00 H new ATOM 0 HG13 ILE A 39 2.212 1.572 -5.579 1.00 0.00 H new ATOM 0 HG21 ILE A 39 1.565 -0.388 -4.194 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.797 -1.561 -3.671 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.704 0.037 -2.894 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.087 3.461 -4.297 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.647 2.121 -3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 39 4.356 2.422 -3.606 1.00 0.00 H new ATOM 637 N GLU A 40 5.534 -2.409 -4.838 1.00 0.00 N ATOM 638 CA GLU A 40 5.747 -3.813 -4.525 1.00 0.00 C ATOM 639 C GLU A 40 6.919 -3.974 -3.558 1.00 0.00 C ATOM 640 O GLU A 40 6.859 -4.759 -2.609 1.00 0.00 O ATOM 641 CB GLU A 40 6.003 -4.599 -5.808 1.00 0.00 C ATOM 642 CG GLU A 40 6.019 -6.103 -5.623 1.00 0.00 C ATOM 643 CD GLU A 40 6.295 -6.834 -6.915 1.00 0.00 C ATOM 644 OE1 GLU A 40 7.406 -7.390 -7.064 1.00 0.00 O ATOM 645 OE2 GLU A 40 5.410 -6.850 -7.799 1.00 0.00 O1- ATOM 0 H GLU A 40 5.614 -2.185 -5.830 1.00 0.00 H new ATOM 0 HA GLU A 40 4.851 -4.205 -4.044 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.235 -4.342 -6.537 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.959 -4.286 -6.228 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.779 -6.369 -4.888 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.059 -6.428 -5.222 1.00 0.00 H new ATOM 652 N GLU A 41 7.974 -3.214 -3.796 1.00 0.00 N ATOM 653 CA GLU A 41 9.143 -3.244 -2.946 1.00 0.00 C ATOM 654 C GLU A 41 8.821 -2.660 -1.572 1.00 0.00 C ATOM 655 O GLU A 41 9.253 -3.183 -0.547 1.00 0.00 O ATOM 656 CB GLU A 41 10.272 -2.459 -3.595 1.00 0.00 C ATOM 657 CG GLU A 41 10.628 -2.932 -4.994 1.00 0.00 C ATOM 658 CD GLU A 41 11.722 -2.102 -5.624 1.00 0.00 C ATOM 659 OE1 GLU A 41 12.316 -2.552 -6.618 1.00 0.00 O ATOM 660 OE2 GLU A 41 11.998 -0.991 -5.120 1.00 0.00 O1- ATOM 0 H GLU A 41 8.041 -2.564 -4.579 1.00 0.00 H new ATOM 0 HA GLU A 41 9.455 -4.280 -2.816 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.991 -1.407 -3.639 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.158 -2.526 -2.963 1.00 0.00 H new ATOM 0 HG2 GLU A 41 10.945 -3.974 -4.952 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.739 -2.894 -5.624 1.00 0.00 H new ATOM 667 N LEU A 42 8.043 -1.582 -1.564 1.00 0.00 N ATOM 668 CA LEU A 42 7.657 -0.914 -0.322 1.00 0.00 C ATOM 669 C LEU A 42 6.791 -1.824 0.548 1.00 0.00 C ATOM 670 O LEU A 42 6.955 -1.869 1.768 1.00 0.00 O ATOM 671 CB LEU A 42 6.917 0.391 -0.621 1.00 0.00 C ATOM 672 CG LEU A 42 7.690 1.428 -1.439 1.00 0.00 C ATOM 673 CD1 LEU A 42 6.828 2.648 -1.705 1.00 0.00 C ATOM 674 CD2 LEU A 42 8.975 1.827 -0.728 1.00 0.00 C ATOM 0 H LEU A 42 7.665 -1.149 -2.407 1.00 0.00 H new ATOM 0 HA LEU A 42 8.569 -0.683 0.229 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.997 0.150 -1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.628 0.847 0.326 1.00 0.00 H new ATOM 0 HG LEU A 42 7.955 0.978 -2.396 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.395 3.374 -2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.939 2.351 -2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.530 3.097 -0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.508 2.565 -1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.735 2.255 0.245 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.604 0.947 -0.592 1.00 0.00 H new ATOM 686 N ILE A 43 5.882 -2.554 -0.086 1.00 0.00 N ATOM 687 CA ILE A 43 5.009 -3.485 0.626 1.00 0.00 C ATOM 688 C ILE A 43 5.844 -4.548 1.340 1.00 0.00 C ATOM 689 O ILE A 43 5.574 -4.903 2.495 1.00 0.00 O ATOM 690 CB ILE A 43 4.009 -4.173 -0.343 1.00 0.00 C ATOM 691 CG1 ILE A 43 3.091 -3.128 -0.985 1.00 0.00 C ATOM 692 CG2 ILE A 43 3.185 -5.231 0.389 1.00 0.00 C ATOM 693 CD1 ILE A 43 2.224 -3.673 -2.103 1.00 0.00 C ATOM 0 H ILE A 43 5.728 -2.521 -1.094 1.00 0.00 H new ATOM 0 HA ILE A 43 4.440 -2.914 1.360 1.00 0.00 H new ATOM 0 HB ILE A 43 4.578 -4.670 -1.129 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.448 -2.702 -0.215 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.702 -2.314 -1.376 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.492 -5.700 -0.309 1.00 0.00 H new ATOM 0 HG22 ILE A 43 3.851 -5.989 0.803 1.00 0.00 H new ATOM 0 HG23 ILE A 43 2.624 -4.761 1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.603 -2.872 -2.505 1.00 0.00 H new ATOM 0 HD12 ILE A 43 2.859 -4.073 -2.894 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.586 -4.466 -1.715 1.00 0.00 H new ATOM 705 N GLN A 44 6.870 -5.029 0.654 1.00 0.00 N ATOM 706 CA GLN A 44 7.772 -6.025 1.211 1.00 0.00 C ATOM 707 C GLN A 44 8.542 -5.461 2.401 1.00 0.00 C ATOM 708 O GLN A 44 8.786 -6.169 3.379 1.00 0.00 O ATOM 709 CB GLN A 44 8.739 -6.519 0.144 1.00 0.00 C ATOM 710 CG GLN A 44 8.073 -7.338 -0.946 1.00 0.00 C ATOM 711 CD GLN A 44 9.004 -7.624 -2.097 1.00 0.00 C ATOM 712 OE1 GLN A 44 9.732 -8.618 -2.096 1.00 0.00 O ATOM 713 NE2 GLN A 44 8.984 -6.760 -3.088 1.00 0.00 N ATOM 0 H GLN A 44 7.100 -4.742 -0.298 1.00 0.00 H new ATOM 0 HA GLN A 44 7.173 -6.866 1.561 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.236 -5.661 -0.310 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.513 -7.122 0.618 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.719 -8.279 -0.525 1.00 0.00 H new ATOM 0 HG3 GLN A 44 7.197 -6.804 -1.314 1.00 0.00 H new ATOM 0 HE21 GLN A 44 8.365 -5.950 -3.046 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.588 -6.899 -3.898 1.00 0.00 H new ATOM 722 N LYS A 45 8.907 -4.179 2.318 1.00 0.00 N ATOM 723 CA LYS A 45 9.630 -3.510 3.402 1.00 0.00 C ATOM 724 C LYS A 45 8.793 -3.498 4.672 1.00 0.00 C ATOM 725 O LYS A 45 9.291 -3.795 5.754 1.00 0.00 O ATOM 726 CB LYS A 45 9.990 -2.072 3.012 1.00 0.00 C ATOM 727 CG LYS A 45 10.953 -1.963 1.844 1.00 0.00 C ATOM 728 CD LYS A 45 11.146 -0.514 1.408 1.00 0.00 C ATOM 729 CE LYS A 45 11.839 0.320 2.478 1.00 0.00 C ATOM 730 NZ LYS A 45 12.016 1.732 2.049 1.00 0.00 N ATOM 0 H LYS A 45 8.714 -3.584 1.512 1.00 0.00 H new ATOM 0 HA LYS A 45 10.550 -4.066 3.583 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.074 -1.535 2.764 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.428 -1.573 3.876 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.916 -2.390 2.124 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.576 -2.549 1.005 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.734 -0.487 0.491 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.176 -0.073 1.177 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.254 0.290 3.397 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.812 -0.116 2.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 12.702 2.201 2.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.367 1.756 1.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.103 2.228 2.102 1.00 0.00 H new ATOM 744 N HIS A 46 7.511 -3.175 4.527 1.00 0.00 N ATOM 745 CA HIS A 46 6.597 -3.140 5.667 1.00 0.00 C ATOM 746 C HIS A 46 6.500 -4.520 6.317 1.00 0.00 C ATOM 747 O HIS A 46 6.510 -4.646 7.542 1.00 0.00 O ATOM 748 CB HIS A 46 5.202 -2.661 5.231 1.00 0.00 C ATOM 749 CG HIS A 46 4.221 -2.538 6.363 1.00 0.00 C ATOM 750 ND1 HIS A 46 3.215 -3.448 6.617 1.00 0.00 N ATOM 751 CD2 HIS A 46 4.114 -1.589 7.326 1.00 0.00 C ATOM 752 CE1 HIS A 46 2.546 -3.032 7.699 1.00 0.00 C ATOM 753 NE2 HIS A 46 3.053 -1.910 8.168 1.00 0.00 N ATOM 0 H HIS A 46 7.081 -2.934 3.634 1.00 0.00 H new ATOM 0 HA HIS A 46 6.992 -2.435 6.398 1.00 0.00 H new ATOM 0 HB2 HIS A 46 5.298 -1.693 4.739 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.804 -3.356 4.492 1.00 0.00 H new ATOM 0 HD1 HIS A 46 3.016 -4.289 6.076 1.00 0.00 H new ATOM 0 HD2 HIS A 46 4.751 -0.722 7.424 1.00 0.00 H new ATOM 0 HE1 HIS A 46 1.701 -3.548 8.131 1.00 0.00 H new ATOM 761 N ARG A 47 6.422 -5.550 5.485 1.00 0.00 N ATOM 762 CA ARG A 47 6.337 -6.917 5.975 1.00 0.00 C ATOM 763 C ARG A 47 7.628 -7.321 6.666 1.00 0.00 C ATOM 764 O ARG A 47 7.604 -7.993 7.691 1.00 0.00 O ATOM 765 CB ARG A 47 6.006 -7.884 4.833 1.00 0.00 C ATOM 766 CG ARG A 47 4.659 -7.617 4.177 1.00 0.00 C ATOM 767 CD ARG A 47 3.524 -7.739 5.180 1.00 0.00 C ATOM 768 NE ARG A 47 2.243 -7.318 4.620 1.00 0.00 N ATOM 769 CZ ARG A 47 1.219 -6.862 5.346 1.00 0.00 C ATOM 770 NH1 ARG A 47 1.301 -6.829 6.676 1.00 0.00 N ATOM 771 NH2 ARG A 47 0.104 -6.463 4.742 1.00 0.00 N ATOM 0 H ARG A 47 6.416 -5.464 4.469 1.00 0.00 H new ATOM 0 HA ARG A 47 5.530 -6.967 6.706 1.00 0.00 H new ATOM 0 HB2 ARG A 47 6.788 -7.820 4.076 1.00 0.00 H new ATOM 0 HB3 ARG A 47 6.017 -8.904 5.217 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.656 -6.618 3.741 1.00 0.00 H new ATOM 0 HG3 ARG A 47 4.503 -8.322 3.360 1.00 0.00 H new ATOM 0 HD2 ARG A 47 3.449 -8.773 5.516 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.751 -7.134 6.058 1.00 0.00 H new ATOM 0 HE ARG A 47 2.122 -7.376 3.609 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.148 -7.153 7.143 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.517 -6.480 7.227 1.00 0.00 H new ATOM 0 HH21 ARG A 47 0.031 -6.505 3.725 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.679 -6.115 5.295 1.00 0.00 H new ATOM 785 N GLN A 48 8.752 -6.885 6.110 1.00 0.00 N ATOM 786 CA GLN A 48 10.055 -7.170 6.680 1.00 0.00 C ATOM 787 C GLN A 48 10.180 -6.523 8.059 1.00 0.00 C ATOM 788 O GLN A 48 10.717 -7.114 8.990 1.00 0.00 O ATOM 789 CB GLN A 48 11.152 -6.642 5.756 1.00 0.00 C ATOM 790 CG GLN A 48 12.553 -7.062 6.156 1.00 0.00 C ATOM 791 CD GLN A 48 12.798 -8.545 5.949 1.00 0.00 C ATOM 792 OE1 GLN A 48 12.238 -9.158 5.040 1.00 0.00 O ATOM 793 NE2 GLN A 48 13.616 -9.132 6.794 1.00 0.00 N ATOM 0 H GLN A 48 8.782 -6.327 5.256 1.00 0.00 H new ATOM 0 HA GLN A 48 10.165 -8.249 6.786 1.00 0.00 H new ATOM 0 HB2 GLN A 48 10.956 -6.989 4.741 1.00 0.00 H new ATOM 0 HB3 GLN A 48 11.102 -5.553 5.736 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.279 -6.493 5.575 1.00 0.00 H new ATOM 0 HG3 GLN A 48 12.718 -6.813 7.204 1.00 0.00 H new ATOM 0 HE21 GLN A 48 14.061 -8.589 7.534 1.00 0.00 H new ATOM 0 HE22 GLN A 48 13.806 -10.131 6.710 1.00 0.00 H new ATOM 802 N LEU A 49 9.666 -5.308 8.177 1.00 0.00 N ATOM 803 CA LEU A 49 9.702 -4.572 9.434 1.00 0.00 C ATOM 804 C LEU A 49 8.798 -5.224 10.473 1.00 0.00 C ATOM 805 O LEU A 49 9.134 -5.278 11.658 1.00 0.00 O ATOM 806 CB LEU A 49 9.295 -3.122 9.210 1.00 0.00 C ATOM 807 CG LEU A 49 10.216 -2.312 8.299 1.00 0.00 C ATOM 808 CD1 LEU A 49 9.624 -0.947 8.023 1.00 0.00 C ATOM 809 CD2 LEU A 49 11.599 -2.179 8.918 1.00 0.00 C ATOM 0 H LEU A 49 9.215 -4.807 7.411 1.00 0.00 H new ATOM 0 HA LEU A 49 10.724 -4.594 9.813 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.290 -3.106 8.788 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.242 -2.624 10.178 1.00 0.00 H new ATOM 0 HG LEU A 49 10.314 -2.842 7.352 1.00 0.00 H new ATOM 0 HD11 LEU A 49 10.294 -0.385 7.373 1.00 0.00 H new ATOM 0 HD12 LEU A 49 8.656 -1.062 7.535 1.00 0.00 H new ATOM 0 HD13 LEU A 49 9.495 -0.410 8.963 1.00 0.00 H new ATOM 0 HD21 LEU A 49 12.240 -1.599 8.254 1.00 0.00 H new ATOM 0 HD22 LEU A 49 11.520 -1.673 9.880 1.00 0.00 H new ATOM 0 HD23 LEU A 49 12.029 -3.170 9.064 1.00 0.00 H new ATOM 821 N PHE A 50 7.650 -5.720 10.028 1.00 0.00 N ATOM 822 CA PHE A 50 6.738 -6.421 10.917 1.00 0.00 C ATOM 823 C PHE A 50 7.385 -7.727 11.362 1.00 0.00 C ATOM 824 O PHE A 50 7.275 -8.133 12.523 1.00 0.00 O ATOM 825 CB PHE A 50 5.402 -6.695 10.216 1.00 0.00 C ATOM 826 CG PHE A 50 4.335 -7.239 11.129 1.00 0.00 C ATOM 827 CD1 PHE A 50 3.549 -6.379 11.881 1.00 0.00 C ATOM 828 CD2 PHE A 50 4.117 -8.604 11.237 1.00 0.00 C ATOM 829 CE1 PHE A 50 2.568 -6.870 12.721 1.00 0.00 C ATOM 830 CE2 PHE A 50 3.138 -9.101 12.076 1.00 0.00 C ATOM 831 CZ PHE A 50 2.362 -8.232 12.819 1.00 0.00 C ATOM 0 H PHE A 50 7.331 -5.649 9.062 1.00 0.00 H new ATOM 0 HA PHE A 50 6.535 -5.799 11.789 1.00 0.00 H new ATOM 0 HB2 PHE A 50 5.043 -5.770 9.764 1.00 0.00 H new ATOM 0 HB3 PHE A 50 5.567 -7.403 9.404 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.705 -5.313 11.809 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.720 -9.288 10.658 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.963 -6.189 13.301 1.00 0.00 H new ATOM 0 HE2 PHE A 50 2.980 -10.167 12.151 1.00 0.00 H new ATOM 0 HZ PHE A 50 1.596 -8.617 13.475 1.00 0.00 H new ATOM 841 N ASP A 51 8.073 -8.366 10.424 1.00 0.00 N ATOM 842 CA ASP A 51 8.808 -9.596 10.686 1.00 0.00 C ATOM 843 C ASP A 51 9.942 -9.339 11.673 1.00 0.00 C ATOM 844 O ASP A 51 10.273 -10.194 12.490 1.00 0.00 O ATOM 845 CB ASP A 51 9.360 -10.166 9.376 1.00 0.00 C ATOM 846 CG ASP A 51 10.340 -11.295 9.590 1.00 0.00 C ATOM 847 OD1 ASP A 51 9.920 -12.380 10.037 1.00 0.00 O ATOM 848 OD2 ASP A 51 11.539 -11.105 9.300 1.00 0.00 O1- ATOM 0 H ASP A 51 8.137 -8.045 9.458 1.00 0.00 H new ATOM 0 HA ASP A 51 8.127 -10.324 11.127 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.532 -10.523 8.764 1.00 0.00 H new ATOM 0 HB3 ASP A 51 9.849 -9.369 8.817 1.00 0.00 H new ATOM 853 N ASN A 52 10.526 -8.149 11.590 1.00 0.00 N ATOM 854 CA ASN A 52 11.586 -7.736 12.511 1.00 0.00 C ATOM 855 C ASN A 52 11.059 -7.695 13.941 1.00 0.00 C ATOM 856 O ASN A 52 11.766 -8.039 14.888 1.00 0.00 O ATOM 857 CB ASN A 52 12.142 -6.360 12.112 1.00 0.00 C ATOM 858 CG ASN A 52 13.174 -5.829 13.095 1.00 0.00 C ATOM 859 OD1 ASN A 52 12.841 -5.104 14.037 1.00 0.00 O ATOM 860 ND2 ASN A 52 14.424 -6.185 12.886 1.00 0.00 N ATOM 0 H ASN A 52 10.283 -7.447 10.891 1.00 0.00 H new ATOM 0 HA ASN A 52 12.394 -8.466 12.455 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.593 -6.430 11.122 1.00 0.00 H new ATOM 0 HB3 ASN A 52 11.319 -5.649 12.038 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.159 -5.860 13.515 1.00 0.00 H new ATOM 0 HD22 ASN A 52 14.658 -6.786 12.096 1.00 0.00 H new ATOM 867 N ARG A 53 9.810 -7.273 14.091 1.00 0.00 N ATOM 868 CA ARG A 53 9.174 -7.237 15.398 1.00 0.00 C ATOM 869 C ARG A 53 8.791 -8.648 15.827 1.00 0.00 C ATOM 870 O ARG A 53 8.978 -9.021 16.983 1.00 0.00 O ATOM 871 CB ARG A 53 7.927 -6.350 15.357 1.00 0.00 C ATOM 872 CG ARG A 53 8.223 -4.868 15.199 1.00 0.00 C ATOM 873 CD ARG A 53 6.951 -4.073 14.923 1.00 0.00 C ATOM 874 NE ARG A 53 5.872 -4.395 15.865 1.00 0.00 N ATOM 875 CZ ARG A 53 4.678 -3.796 15.881 1.00 0.00 C ATOM 876 NH1 ARG A 53 4.424 -2.777 15.066 1.00 0.00 N ATOM 877 NH2 ARG A 53 3.746 -4.210 16.724 1.00 0.00 N ATOM 0 H ARG A 53 9.219 -6.952 13.324 1.00 0.00 H new ATOM 0 HA ARG A 53 9.878 -6.821 16.119 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.292 -6.672 14.532 1.00 0.00 H new ATOM 0 HB3 ARG A 53 7.358 -6.500 16.274 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.700 -4.492 16.104 1.00 0.00 H new ATOM 0 HG3 ARG A 53 8.930 -4.722 14.382 1.00 0.00 H new ATOM 0 HD2 ARG A 53 7.173 -3.007 14.980 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.614 -4.275 13.906 1.00 0.00 H new ATOM 0 HE ARG A 53 6.046 -5.126 16.555 1.00 0.00 H new ATOM 0 HH11 ARG A 53 5.143 -2.447 14.422 1.00 0.00 H new ATOM 0 HH12 ARG A 53 3.510 -2.325 15.084 1.00 0.00 H new ATOM 0 HH21 ARG A 53 3.940 -4.984 17.359 1.00 0.00 H new ATOM 0 HH22 ARG A 53 2.833 -3.755 16.739 1.00 0.00 H new ATOM 891 N GLN A 54 8.296 -9.427 14.857 1.00 0.00 N ATOM 892 CA GLN A 54 7.877 -10.823 15.050 1.00 0.00 C ATOM 893 C GLN A 54 7.169 -11.044 16.382 1.00 0.00 C ATOM 894 O GLN A 54 7.782 -11.459 17.367 1.00 0.00 O ATOM 895 CB GLN A 54 9.061 -11.782 14.908 1.00 0.00 C ATOM 896 CG GLN A 54 8.650 -13.245 14.851 1.00 0.00 C ATOM 897 CD GLN A 54 7.570 -13.492 13.815 1.00 0.00 C ATOM 898 OE1 GLN A 54 6.371 -13.436 14.122 1.00 0.00 O ATOM 899 NE2 GLN A 54 7.976 -13.742 12.586 1.00 0.00 N ATOM 0 H GLN A 54 8.173 -9.100 13.899 1.00 0.00 H new ATOM 0 HA GLN A 54 7.156 -11.039 14.262 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.615 -11.532 14.003 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.740 -11.636 15.748 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.521 -13.858 14.619 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.291 -13.559 15.831 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.973 -13.779 12.376 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.293 -13.898 11.845 1.00 0.00 H new ATOM 908 N GLU A 55 5.889 -10.764 16.413 1.00 0.00 N ATOM 909 CA GLU A 55 5.122 -10.919 17.630 1.00 0.00 C ATOM 910 C GLU A 55 4.135 -12.074 17.522 1.00 0.00 C ATOM 911 O GLU A 55 3.119 -12.104 18.213 1.00 0.00 O ATOM 912 CB GLU A 55 4.427 -9.612 17.983 1.00 0.00 C ATOM 913 CG GLU A 55 5.409 -8.490 18.287 1.00 0.00 C ATOM 914 CD GLU A 55 4.746 -7.254 18.826 1.00 0.00 C ATOM 915 OE1 GLU A 55 4.445 -7.220 20.041 1.00 0.00 O ATOM 916 OE2 GLU A 55 4.539 -6.306 18.054 1.00 0.00 O1- ATOM 0 H GLU A 55 5.355 -10.428 15.612 1.00 0.00 H new ATOM 0 HA GLU A 55 5.807 -11.167 18.441 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.783 -9.312 17.156 1.00 0.00 H new ATOM 0 HB3 GLU A 55 3.782 -9.770 18.848 1.00 0.00 H new ATOM 0 HG2 GLU A 55 6.144 -8.845 19.009 1.00 0.00 H new ATOM 0 HG3 GLU A 55 5.953 -8.236 17.377 1.00 0.00 H new ATOM 923 N ALA A 56 4.454 -13.023 16.636 1.00 0.00 N ATOM 924 CA ALA A 56 3.671 -14.254 16.454 1.00 0.00 C ATOM 925 C ALA A 56 2.240 -13.997 15.975 1.00 0.00 C ATOM 926 O ALA A 56 1.405 -14.901 15.999 1.00 0.00 O ATOM 927 CB ALA A 56 3.663 -15.076 17.736 1.00 0.00 C ATOM 0 H ALA A 56 5.266 -12.961 16.021 1.00 0.00 H new ATOM 0 HA ALA A 56 4.165 -14.818 15.663 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.079 -15.983 17.583 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.685 -15.343 18.003 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.219 -14.490 18.541 1.00 0.00 H new ATOM 933 N ALA A 57 1.960 -12.782 15.531 1.00 0.00 N ATOM 934 CA ALA A 57 0.638 -12.448 15.021 1.00 0.00 C ATOM 935 C ALA A 57 0.503 -12.920 13.577 1.00 0.00 C ATOM 936 O ALA A 57 0.371 -12.118 12.653 1.00 0.00 O ATOM 937 CB ALA A 57 0.384 -10.950 15.131 1.00 0.00 C ATOM 0 H ALA A 57 2.628 -12.012 15.513 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.113 -12.959 15.624 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.609 -10.720 14.745 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.446 -10.646 16.176 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.133 -10.410 14.551 1.00 0.00 H new ATOM 943 N ASP A 58 0.548 -14.229 13.397 1.00 0.00 N ATOM 944 CA ASP A 58 0.505 -14.837 12.074 1.00 0.00 C ATOM 945 C ASP A 58 -0.860 -14.680 11.435 1.00 0.00 C ATOM 946 O ASP A 58 -0.964 -14.350 10.254 1.00 0.00 O ATOM 947 CB ASP A 58 0.878 -16.319 12.155 1.00 0.00 C ATOM 948 CG ASP A 58 0.893 -16.990 10.796 1.00 0.00 C ATOM 949 OD1 ASP A 58 1.853 -16.764 10.032 1.00 0.00 O ATOM 950 OD2 ASP A 58 -0.045 -17.751 10.489 1.00 0.00 O1- ATOM 0 H ASP A 58 0.615 -14.901 14.161 1.00 0.00 H new ATOM 0 HA ASP A 58 1.232 -14.319 11.449 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.861 -16.418 12.616 1.00 0.00 H new ATOM 0 HB3 ASP A 58 0.168 -16.834 12.803 1.00 0.00 H new ATOM 955 N THR A 59 -1.900 -14.894 12.220 1.00 0.00 N ATOM 956 CA THR A 59 -3.261 -14.796 11.725 1.00 0.00 C ATOM 957 C THR A 59 -3.609 -13.366 11.315 1.00 0.00 C ATOM 958 O THR A 59 -4.237 -13.144 10.277 1.00 0.00 O ATOM 959 CB THR A 59 -4.265 -15.300 12.772 1.00 0.00 C ATOM 960 OG1 THR A 59 -3.903 -14.802 14.066 1.00 0.00 O ATOM 961 CG2 THR A 59 -4.292 -16.818 12.800 1.00 0.00 C ATOM 0 H THR A 59 -1.827 -15.138 13.208 1.00 0.00 H new ATOM 0 HA THR A 59 -3.327 -15.429 10.840 1.00 0.00 H new ATOM 0 HB THR A 59 -5.258 -14.938 12.504 1.00 0.00 H new ATOM 0 HG1 THR A 59 -4.546 -15.124 14.732 1.00 0.00 H new ATOM 0 HG21 THR A 59 -5.009 -17.155 13.548 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.585 -17.195 11.820 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.301 -17.195 13.052 1.00 0.00 H new ATOM 969 N GLU A 60 -3.189 -12.403 12.120 1.00 0.00 N ATOM 970 CA GLU A 60 -3.448 -11.002 11.827 1.00 0.00 C ATOM 971 C GLU A 60 -2.644 -10.554 10.609 1.00 0.00 C ATOM 972 O GLU A 60 -3.159 -9.848 9.738 1.00 0.00 O ATOM 973 CB GLU A 60 -3.119 -10.130 13.044 1.00 0.00 C ATOM 974 CG GLU A 60 -3.389 -8.649 12.841 1.00 0.00 C ATOM 975 CD GLU A 60 -3.236 -7.853 14.117 1.00 0.00 C ATOM 976 OE1 GLU A 60 -2.088 -7.551 14.504 1.00 0.00 O ATOM 977 OE2 GLU A 60 -4.267 -7.519 14.739 1.00 0.00 O1- ATOM 0 H GLU A 60 -2.667 -12.566 12.981 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.508 -10.886 11.599 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -3.702 -10.480 13.896 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.068 -10.264 13.300 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.705 -8.258 12.088 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -4.399 -8.517 12.453 1.00 0.00 H new ATOM 984 N ALA A 61 -1.392 -10.991 10.541 1.00 0.00 N ATOM 985 CA ALA A 61 -0.511 -10.641 9.434 1.00 0.00 C ATOM 986 C ALA A 61 -1.006 -11.238 8.122 1.00 0.00 C ATOM 987 O ALA A 61 -1.028 -10.565 7.093 1.00 0.00 O ATOM 988 CB ALA A 61 0.908 -11.102 9.721 1.00 0.00 C ATOM 0 H ALA A 61 -0.962 -11.592 11.244 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.516 -9.556 9.332 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.554 -10.833 8.885 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.270 -10.620 10.629 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.919 -12.184 9.855 1.00 0.00 H new ATOM 994 N ALA A 62 -1.411 -12.498 8.164 1.00 0.00 N ATOM 995 CA ALA A 62 -1.891 -13.184 6.975 1.00 0.00 C ATOM 996 C ALA A 62 -3.205 -12.594 6.493 1.00 0.00 C ATOM 997 O ALA A 62 -3.412 -12.422 5.299 1.00 0.00 O ATOM 998 CB ALA A 62 -2.045 -14.671 7.241 1.00 0.00 C ATOM 0 H ALA A 62 -1.417 -13.067 9.011 1.00 0.00 H new ATOM 0 HA ALA A 62 -1.150 -13.045 6.188 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -2.405 -15.167 6.339 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.080 -15.092 7.526 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.760 -14.824 8.049 1.00 0.00 H new ATOM 1004 N LYS A 63 -4.081 -12.262 7.431 1.00 0.00 N ATOM 1005 CA LYS A 63 -5.393 -11.722 7.094 1.00 0.00 C ATOM 1006 C LYS A 63 -5.266 -10.384 6.369 1.00 0.00 C ATOM 1007 O LYS A 63 -5.919 -10.155 5.349 1.00 0.00 O ATOM 1008 CB LYS A 63 -6.221 -11.548 8.365 1.00 0.00 C ATOM 1009 CG LYS A 63 -7.662 -11.136 8.127 1.00 0.00 C ATOM 1010 CD LYS A 63 -8.400 -10.979 9.443 1.00 0.00 C ATOM 1011 CE LYS A 63 -9.879 -10.716 9.229 1.00 0.00 C ATOM 1012 NZ LYS A 63 -10.608 -10.604 10.517 1.00 0.00 N ATOM 0 H LYS A 63 -3.908 -12.357 8.432 1.00 0.00 H new ATOM 0 HA LYS A 63 -5.892 -12.424 6.427 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -6.212 -12.486 8.921 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -5.742 -10.799 8.996 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -7.690 -10.197 7.574 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.162 -11.883 7.511 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.274 -11.882 10.041 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.962 -10.157 10.010 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.006 -9.797 8.658 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.310 -11.522 8.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.615 -10.424 10.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.507 -11.491 11.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -10.213 -9.818 11.072 1.00 0.00 H new ATOM 1026 N GLN A 64 -4.405 -9.517 6.881 1.00 0.00 N ATOM 1027 CA GLN A 64 -4.196 -8.211 6.273 1.00 0.00 C ATOM 1028 C GLN A 64 -3.359 -8.325 5.002 1.00 0.00 C ATOM 1029 O GLN A 64 -3.604 -7.628 4.023 1.00 0.00 O ATOM 1030 CB GLN A 64 -3.531 -7.245 7.261 1.00 0.00 C ATOM 1031 CG GLN A 64 -2.162 -7.697 7.736 1.00 0.00 C ATOM 1032 CD GLN A 64 -1.501 -6.704 8.654 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -0.777 -5.816 8.202 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -1.732 -6.852 9.940 1.00 0.00 N ATOM 0 H GLN A 64 -3.842 -9.693 7.713 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.174 -7.812 6.006 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -3.436 -6.267 6.790 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -4.182 -7.120 8.126 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -2.260 -8.652 8.252 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -1.521 -7.867 6.871 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.340 -7.604 10.266 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -1.304 -6.215 10.612 1.00 0.00 H new ATOM 1043 N GLY A 65 -2.376 -9.217 5.025 1.00 0.00 N ATOM 1044 CA GLY A 65 -1.498 -9.382 3.892 1.00 0.00 C ATOM 1045 C GLY A 65 -2.196 -9.976 2.697 1.00 0.00 C ATOM 1046 O GLY A 65 -2.071 -9.467 1.586 1.00 0.00 O ATOM 0 H GLY A 65 -2.174 -9.830 5.815 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -1.079 -8.414 3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.663 -10.022 4.175 1.00 0.00 H new ATOM 1050 N ASP A 66 -2.959 -11.033 2.929 1.00 0.00 N ATOM 1051 CA ASP A 66 -3.668 -11.723 1.854 1.00 0.00 C ATOM 1052 C ASP A 66 -4.702 -10.814 1.205 1.00 0.00 C ATOM 1053 O ASP A 66 -4.828 -10.779 -0.021 1.00 0.00 O ATOM 1054 CB ASP A 66 -4.342 -12.982 2.393 1.00 0.00 C ATOM 1055 CG ASP A 66 -5.139 -13.719 1.344 1.00 0.00 C ATOM 1056 OD1 ASP A 66 -4.532 -14.442 0.527 1.00 0.00 O ATOM 1057 OD2 ASP A 66 -6.384 -13.602 1.343 1.00 0.00 O1- ATOM 0 H ASP A 66 -3.106 -11.436 3.855 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.939 -12.004 1.094 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.582 -13.649 2.799 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.001 -12.710 3.218 1.00 0.00 H new ATOM 1062 N GLN A 67 -5.419 -10.060 2.026 1.00 0.00 N ATOM 1063 CA GLN A 67 -6.433 -9.145 1.523 1.00 0.00 C ATOM 1064 C GLN A 67 -5.782 -8.000 0.755 1.00 0.00 C ATOM 1065 O GLN A 67 -6.305 -7.541 -0.259 1.00 0.00 O ATOM 1066 CB GLN A 67 -7.285 -8.596 2.672 1.00 0.00 C ATOM 1067 CG GLN A 67 -8.447 -7.720 2.216 1.00 0.00 C ATOM 1068 CD GLN A 67 -9.455 -8.478 1.368 1.00 0.00 C ATOM 1069 OE1 GLN A 67 -9.337 -8.541 0.141 1.00 0.00 O ATOM 1070 NE2 GLN A 67 -10.452 -9.050 2.012 1.00 0.00 N ATOM 0 H GLN A 67 -5.318 -10.064 3.041 1.00 0.00 H new ATOM 0 HA GLN A 67 -7.084 -9.696 0.844 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.678 -9.432 3.251 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.647 -8.017 3.340 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -8.951 -7.308 3.090 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -8.059 -6.877 1.645 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -10.513 -8.974 3.027 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -11.162 -9.568 1.495 1.00 0.00 H new ATOM 1079 N TRP A 68 -4.627 -7.556 1.232 1.00 0.00 N ATOM 1080 CA TRP A 68 -3.910 -6.481 0.599 1.00 0.00 C ATOM 1081 C TRP A 68 -3.407 -6.920 -0.776 1.00 0.00 C ATOM 1082 O TRP A 68 -3.465 -6.156 -1.740 1.00 0.00 O ATOM 1083 CB TRP A 68 -2.756 -6.035 1.493 1.00 0.00 C ATOM 1084 CG TRP A 68 -1.950 -4.922 0.927 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -0.758 -5.036 0.303 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -2.278 -3.530 0.931 1.00 0.00 C ATOM 1087 NE1 TRP A 68 -0.309 -3.799 -0.084 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -1.226 -2.856 0.290 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -3.360 -2.787 1.415 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -1.218 -1.476 0.118 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -3.352 -1.416 1.243 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -2.287 -0.774 0.600 1.00 0.00 C ATOM 0 H TRP A 68 -4.172 -7.934 2.063 1.00 0.00 H new ATOM 0 HA TRP A 68 -4.580 -5.633 0.455 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -3.156 -5.726 2.459 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -2.102 -6.887 1.677 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -0.235 -5.965 0.133 1.00 0.00 H new ATOM 0 HE1 TRP A 68 0.567 -3.613 -0.572 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -4.185 -3.275 1.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -0.398 -0.978 -0.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -4.181 -0.830 1.611 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -2.311 0.299 0.482 1.00 0.00 H new ATOM 1103 N VAL A 69 -2.930 -8.161 -0.862 1.00 0.00 N ATOM 1104 CA VAL A 69 -2.471 -8.712 -2.132 1.00 0.00 C ATOM 1105 C VAL A 69 -3.637 -8.799 -3.115 1.00 0.00 C ATOM 1106 O VAL A 69 -3.499 -8.448 -4.287 1.00 0.00 O ATOM 1107 CB VAL A 69 -1.826 -10.114 -1.957 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -1.440 -10.704 -3.308 1.00 0.00 C ATOM 1109 CG2 VAL A 69 -0.605 -10.031 -1.054 1.00 0.00 C ATOM 0 H VAL A 69 -2.852 -8.800 -0.070 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.707 -8.041 -2.524 1.00 0.00 H new ATOM 0 HB VAL A 69 -2.562 -10.769 -1.491 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -0.990 -11.686 -3.161 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.330 -10.802 -3.930 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -0.723 -10.047 -3.801 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -0.166 -11.023 -0.943 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.129 -9.357 -1.496 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.901 -9.654 -0.075 1.00 0.00 H new ATOM 1119 N GLN A 70 -4.788 -9.246 -2.623 1.00 0.00 N ATOM 1120 CA GLN A 70 -5.990 -9.336 -3.446 1.00 0.00 C ATOM 1121 C GLN A 70 -6.424 -7.956 -3.918 1.00 0.00 C ATOM 1122 O GLN A 70 -6.826 -7.783 -5.066 1.00 0.00 O ATOM 1123 CB GLN A 70 -7.123 -10.012 -2.676 1.00 0.00 C ATOM 1124 CG GLN A 70 -6.917 -11.500 -2.474 1.00 0.00 C ATOM 1125 CD GLN A 70 -6.961 -12.273 -3.779 1.00 0.00 C ATOM 1126 OE1 GLN A 70 -5.941 -12.460 -4.446 1.00 0.00 O ATOM 1127 NE2 GLN A 70 -8.139 -12.727 -4.149 1.00 0.00 N ATOM 0 H GLN A 70 -4.914 -9.552 -1.658 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.755 -9.943 -4.320 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -7.226 -9.533 -1.702 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -8.060 -9.853 -3.210 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -5.956 -11.668 -1.988 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.686 -11.882 -1.802 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -8.959 -12.551 -3.568 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -8.232 -13.255 -5.016 1.00 0.00 H new ATOM 1136 N LEU A 71 -6.325 -6.976 -3.030 1.00 0.00 N ATOM 1137 CA LEU A 71 -6.667 -5.617 -3.349 1.00 0.00 C ATOM 1138 C LEU A 71 -5.740 -5.085 -4.440 1.00 0.00 C ATOM 1139 O LEU A 71 -6.189 -4.465 -5.407 1.00 0.00 O ATOM 1140 CB LEU A 71 -6.564 -4.757 -2.089 1.00 0.00 C ATOM 1141 CG LEU A 71 -6.723 -3.264 -2.297 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -8.134 -2.924 -2.762 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -6.369 -2.499 -1.031 1.00 0.00 C ATOM 0 H LEU A 71 -6.004 -7.112 -2.071 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.691 -5.578 -3.721 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.324 -5.089 -1.381 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.595 -4.939 -1.625 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.029 -2.959 -3.081 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.221 -1.847 -2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.339 -3.432 -3.705 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.853 -3.250 -2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.491 -1.430 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.028 -2.812 -0.221 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.334 -2.706 -0.758 1.00 0.00 H new ATOM 1155 N PHE A 72 -4.448 -5.353 -4.284 1.00 0.00 N ATOM 1156 CA PHE A 72 -3.452 -4.928 -5.256 1.00 0.00 C ATOM 1157 C PHE A 72 -3.676 -5.635 -6.593 1.00 0.00 C ATOM 1158 O PHE A 72 -3.530 -5.032 -7.655 1.00 0.00 O ATOM 1159 CB PHE A 72 -2.037 -5.210 -4.730 1.00 0.00 C ATOM 1160 CG PHE A 72 -0.938 -4.669 -5.607 1.00 0.00 C ATOM 1161 CD1 PHE A 72 -0.585 -3.330 -5.548 1.00 0.00 C ATOM 1162 CD2 PHE A 72 -0.257 -5.499 -6.485 1.00 0.00 C ATOM 1163 CE1 PHE A 72 0.425 -2.828 -6.349 1.00 0.00 C ATOM 1164 CE2 PHE A 72 0.753 -5.002 -7.287 1.00 0.00 C ATOM 1165 CZ PHE A 72 1.093 -3.665 -7.220 1.00 0.00 C ATOM 0 H PHE A 72 -4.066 -5.865 -3.489 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.555 -3.854 -5.412 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.938 -4.779 -3.734 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.907 -6.287 -4.625 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.105 -2.671 -4.869 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.519 -6.545 -6.543 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.691 -1.783 -6.293 1.00 0.00 H new ATOM 0 HE2 PHE A 72 1.276 -5.659 -7.966 1.00 0.00 H new ATOM 0 HZ PHE A 72 1.880 -3.275 -7.848 1.00 0.00 H new ATOM 1175 N GLN A 73 -4.038 -6.913 -6.532 1.00 0.00 N ATOM 1176 CA GLN A 73 -4.309 -7.693 -7.732 1.00 0.00 C ATOM 1177 C GLN A 73 -5.496 -7.105 -8.486 1.00 0.00 C ATOM 1178 O GLN A 73 -5.442 -6.934 -9.701 1.00 0.00 O ATOM 1179 CB GLN A 73 -4.555 -9.174 -7.369 1.00 0.00 C ATOM 1180 CG GLN A 73 -4.793 -10.098 -8.569 1.00 0.00 C ATOM 1181 CD GLN A 73 -6.230 -10.076 -9.067 1.00 0.00 C ATOM 1182 OE1 GLN A 73 -7.168 -9.893 -8.291 1.00 0.00 O ATOM 1183 NE2 GLN A 73 -6.411 -10.253 -10.360 1.00 0.00 N ATOM 0 H GLN A 73 -4.150 -7.431 -5.660 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.438 -7.649 -8.386 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -3.697 -9.544 -6.808 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.418 -9.233 -6.706 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.129 -9.805 -9.382 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -4.527 -11.118 -8.292 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -5.608 -10.402 -10.972 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.354 -10.241 -10.749 1.00 0.00 H new ATOM 1192 N ARG A 74 -6.555 -6.777 -7.754 1.00 0.00 N ATOM 1193 CA ARG A 74 -7.747 -6.176 -8.350 1.00 0.00 C ATOM 1194 C ARG A 74 -7.408 -4.830 -8.969 1.00 0.00 C ATOM 1195 O ARG A 74 -7.890 -4.489 -10.048 1.00 0.00 O ATOM 1196 CB ARG A 74 -8.840 -6.012 -7.299 1.00 0.00 C ATOM 1197 CG ARG A 74 -9.390 -7.326 -6.775 1.00 0.00 C ATOM 1198 CD ARG A 74 -10.332 -7.108 -5.606 1.00 0.00 C ATOM 1199 NE ARG A 74 -11.465 -6.255 -5.963 1.00 0.00 N ATOM 1200 CZ ARG A 74 -12.473 -5.961 -5.140 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -12.493 -6.456 -3.903 1.00 0.00 N ATOM 1202 NH2 ARG A 74 -13.456 -5.171 -5.553 1.00 0.00 N ATOM 0 H ARG A 74 -6.614 -6.917 -6.745 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.113 -6.838 -9.135 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.443 -5.436 -6.463 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -9.658 -5.432 -7.726 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.916 -7.846 -7.575 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -8.566 -7.969 -6.465 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.701 -8.071 -5.254 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.784 -6.655 -4.779 1.00 0.00 H new ATOM 0 HE ARG A 74 -11.486 -5.859 -6.903 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.737 -7.061 -3.584 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -13.265 -6.230 -3.276 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.440 -4.789 -6.499 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -14.227 -4.946 -4.925 1.00 0.00 H new ATOM 1216 N PHE A 75 -6.567 -4.076 -8.279 1.00 0.00 N ATOM 1217 CA PHE A 75 -6.118 -2.780 -8.758 1.00 0.00 C ATOM 1218 C PHE A 75 -5.316 -2.955 -10.050 1.00 0.00 C ATOM 1219 O PHE A 75 -5.512 -2.229 -11.023 1.00 0.00 O ATOM 1220 CB PHE A 75 -5.268 -2.097 -7.676 1.00 0.00 C ATOM 1221 CG PHE A 75 -4.841 -0.695 -8.008 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -5.746 0.351 -7.938 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -3.535 -0.423 -8.376 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -5.357 1.643 -8.232 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -3.139 0.866 -8.671 1.00 0.00 C ATOM 1226 CZ PHE A 75 -4.052 1.900 -8.599 1.00 0.00 C ATOM 0 H PHE A 75 -6.178 -4.344 -7.375 1.00 0.00 H new ATOM 0 HA PHE A 75 -6.981 -2.149 -8.971 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.835 -2.079 -6.745 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -4.378 -2.701 -7.496 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.768 0.154 -7.650 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -2.818 -1.228 -8.433 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.072 2.450 -8.175 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -2.117 1.066 -8.958 1.00 0.00 H new ATOM 0 HZ PHE A 75 -3.745 2.909 -8.830 1.00 0.00 H new ATOM 1236 N ARG A 76 -4.428 -3.941 -10.047 1.00 0.00 N ATOM 1237 CA ARG A 76 -3.602 -4.259 -11.208 1.00 0.00 C ATOM 1238 C ARG A 76 -4.486 -4.698 -12.377 1.00 0.00 C ATOM 1239 O ARG A 76 -4.273 -4.295 -13.524 1.00 0.00 O ATOM 1240 CB ARG A 76 -2.625 -5.386 -10.849 1.00 0.00 C ATOM 1241 CG ARG A 76 -1.181 -5.120 -11.239 1.00 0.00 C ATOM 1242 CD ARG A 76 -1.015 -4.959 -12.740 1.00 0.00 C ATOM 1243 NE ARG A 76 0.384 -4.740 -13.102 1.00 0.00 N ATOM 1244 CZ ARG A 76 0.813 -4.437 -14.323 1.00 0.00 C ATOM 1245 NH1 ARG A 76 -0.046 -4.325 -15.330 1.00 0.00 N ATOM 1246 NH2 ARG A 76 2.106 -4.253 -14.534 1.00 0.00 N ATOM 0 H ARG A 76 -4.259 -4.543 -9.241 1.00 0.00 H new ATOM 0 HA ARG A 76 -3.042 -3.371 -11.501 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -2.671 -5.560 -9.774 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -2.956 -6.304 -11.335 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -0.831 -4.218 -10.737 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -0.555 -5.942 -10.892 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -1.388 -5.849 -13.246 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -1.618 -4.119 -13.086 1.00 0.00 H new ATOM 0 HE ARG A 76 1.082 -4.826 -12.364 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.042 -4.472 -15.169 1.00 0.00 H new ATOM 0 HH12 ARG A 76 0.291 -4.092 -16.264 1.00 0.00 H new ATOM 0 HH21 ARG A 76 2.767 -4.344 -13.762 1.00 0.00 H new ATOM 0 HH22 ARG A 76 2.442 -4.020 -15.468 1.00 0.00 H new ATOM 1260 N GLU A 77 -5.474 -5.521 -12.060 1.00 0.00 N ATOM 1261 CA GLU A 77 -6.421 -6.044 -13.033 1.00 0.00 C ATOM 1262 C GLU A 77 -7.206 -4.908 -13.688 1.00 0.00 C ATOM 1263 O GLU A 77 -7.353 -4.858 -14.913 1.00 0.00 O ATOM 1264 CB GLU A 77 -7.387 -6.996 -12.328 1.00 0.00 C ATOM 1265 CG GLU A 77 -8.336 -7.728 -13.251 1.00 0.00 C ATOM 1266 CD GLU A 77 -7.642 -8.776 -14.080 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -7.428 -9.894 -13.567 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -7.321 -8.501 -15.248 1.00 0.00 O1- ATOM 0 H GLU A 77 -5.643 -5.848 -11.109 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.873 -6.576 -13.810 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -6.808 -7.730 -11.767 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.971 -6.429 -11.603 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.122 -8.199 -12.660 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.821 -7.010 -13.912 1.00 0.00 H new ATOM 1275 N ALA A 78 -7.699 -3.997 -12.864 1.00 0.00 N ATOM 1276 CA ALA A 78 -8.480 -2.869 -13.339 1.00 0.00 C ATOM 1277 C ALA A 78 -7.656 -1.969 -14.256 1.00 0.00 C ATOM 1278 O ALA A 78 -8.174 -1.431 -15.238 1.00 0.00 O ATOM 1279 CB ALA A 78 -9.025 -2.083 -12.165 1.00 0.00 C ATOM 0 H ALA A 78 -7.569 -4.019 -11.853 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.316 -3.255 -13.923 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.609 -1.239 -12.532 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.661 -2.728 -11.559 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.198 -1.715 -11.558 1.00 0.00 H new ATOM 1285 N ILE A 79 -6.373 -1.816 -13.937 1.00 0.00 N ATOM 1286 CA ILE A 79 -5.468 -1.010 -14.754 1.00 0.00 C ATOM 1287 C ILE A 79 -5.289 -1.634 -16.134 1.00 0.00 C ATOM 1288 O ILE A 79 -5.282 -0.935 -17.149 1.00 0.00 O ATOM 1289 CB ILE A 79 -4.074 -0.854 -14.085 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -4.189 -0.046 -12.794 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -3.080 -0.197 -15.042 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -2.879 0.114 -12.058 1.00 0.00 C ATOM 0 H ILE A 79 -5.936 -2.240 -13.118 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.921 -0.023 -14.851 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.701 -1.849 -13.840 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.587 0.941 -13.028 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.909 -0.532 -12.135 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.112 -0.099 -14.550 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.973 -0.813 -15.935 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.445 0.790 -15.324 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.040 0.698 -11.152 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.489 -0.868 -11.792 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.162 0.627 -12.699 1.00 0.00 H new ATOM 1304 N ASP A 80 -5.164 -2.955 -16.163 1.00 0.00 N ATOM 1305 CA ASP A 80 -4.963 -3.680 -17.414 1.00 0.00 C ATOM 1306 C ASP A 80 -6.191 -3.574 -18.309 1.00 0.00 C ATOM 1307 O ASP A 80 -6.078 -3.488 -19.531 1.00 0.00 O ATOM 1308 CB ASP A 80 -4.636 -5.150 -17.136 1.00 0.00 C ATOM 1309 CG ASP A 80 -4.241 -5.909 -18.388 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -3.082 -5.762 -18.835 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -5.074 -6.668 -18.922 1.00 0.00 O1- ATOM 0 H ASP A 80 -5.198 -3.548 -15.334 1.00 0.00 H new ATOM 0 HA ASP A 80 -4.120 -3.226 -17.935 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.824 -5.206 -16.411 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.503 -5.631 -16.683 1.00 0.00 H new ATOM 1316 N LYS A 81 -7.366 -3.571 -17.693 1.00 0.00 N ATOM 1317 CA LYS A 81 -8.615 -3.452 -18.437 1.00 0.00 C ATOM 1318 C LYS A 81 -8.909 -1.996 -18.777 1.00 0.00 C ATOM 1319 O LYS A 81 -9.771 -1.704 -19.610 1.00 0.00 O ATOM 1320 CB LYS A 81 -9.778 -4.041 -17.637 1.00 0.00 C ATOM 1321 CG LYS A 81 -9.644 -5.525 -17.350 1.00 0.00 C ATOM 1322 CD LYS A 81 -10.841 -6.044 -16.577 1.00 0.00 C ATOM 1323 CE LYS A 81 -10.701 -7.524 -16.265 1.00 0.00 C ATOM 1324 NZ LYS A 81 -11.868 -8.037 -15.507 1.00 0.00 N ATOM 0 H LYS A 81 -7.481 -3.649 -16.683 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.504 -4.012 -19.365 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.863 -3.505 -16.692 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.705 -3.870 -18.184 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.548 -6.072 -18.288 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.733 -5.707 -16.780 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.947 -5.483 -15.648 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.750 -5.877 -17.155 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -10.596 -8.084 -17.194 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -9.791 -7.690 -15.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.737 -9.050 -15.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -11.953 -7.520 -14.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.733 -7.901 -16.068 1.00 0.00 H new ATOM 1338 N GLY A 82 -8.188 -1.090 -18.136 1.00 0.00 N ATOM 1339 CA GLY A 82 -8.396 0.321 -18.367 1.00 0.00 C ATOM 1340 C GLY A 82 -9.708 0.803 -17.784 1.00 0.00 C ATOM 1341 O GLY A 82 -10.332 1.720 -18.316 1.00 0.00 O ATOM 0 H GLY A 82 -7.459 -1.309 -17.457 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -7.574 0.886 -17.927 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -8.381 0.519 -19.439 1.00 0.00 H new ATOM 1345 N ASP A 83 -10.127 0.183 -16.693 1.00 0.00 N ATOM 1346 CA ASP A 83 -11.380 0.543 -16.045 1.00 0.00 C ATOM 1347 C ASP A 83 -11.124 1.495 -14.892 1.00 0.00 C ATOM 1348 O ASP A 83 -10.784 1.073 -13.788 1.00 0.00 O ATOM 1349 CB ASP A 83 -12.119 -0.704 -15.547 1.00 0.00 C ATOM 1350 CG ASP A 83 -13.478 -0.376 -14.959 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -13.582 -0.235 -13.724 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -14.448 -0.258 -15.732 1.00 0.00 O1- ATOM 0 H ASP A 83 -9.618 -0.573 -16.236 1.00 0.00 H new ATOM 0 HA ASP A 83 -12.010 1.042 -16.782 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -12.243 -1.403 -16.374 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -11.512 -1.206 -14.794 1.00 0.00 H new ATOM 1357 N LYS A 84 -11.269 2.782 -15.156 1.00 0.00 N ATOM 1358 CA LYS A 84 -11.015 3.802 -14.146 1.00 0.00 C ATOM 1359 C LYS A 84 -12.081 3.784 -13.061 1.00 0.00 C ATOM 1360 O LYS A 84 -11.835 4.215 -11.942 1.00 0.00 O ATOM 1361 CB LYS A 84 -10.920 5.202 -14.772 1.00 0.00 C ATOM 1362 CG LYS A 84 -12.237 5.746 -15.303 1.00 0.00 C ATOM 1363 CD LYS A 84 -12.086 7.178 -15.790 1.00 0.00 C ATOM 1364 CE LYS A 84 -13.425 7.780 -16.203 1.00 0.00 C ATOM 1365 NZ LYS A 84 -14.408 7.788 -15.083 1.00 0.00 N ATOM 0 H LYS A 84 -11.562 3.149 -16.062 1.00 0.00 H new ATOM 0 HA LYS A 84 -10.054 3.566 -13.689 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -10.530 5.894 -14.026 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -10.198 5.173 -15.588 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -12.590 5.117 -16.120 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -12.993 5.704 -14.519 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -11.642 7.785 -15.001 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -11.399 7.204 -16.636 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -13.270 8.800 -16.555 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -13.834 7.213 -17.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -15.181 8.447 -15.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -14.795 6.831 -14.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -13.935 8.091 -14.208 1.00 0.00 H new ATOM 1379 N ASP A 85 -13.266 3.289 -13.401 1.00 0.00 N ATOM 1380 CA ASP A 85 -14.382 3.255 -12.460 1.00 0.00 C ATOM 1381 C ASP A 85 -14.031 2.455 -11.204 1.00 0.00 C ATOM 1382 O ASP A 85 -14.289 2.897 -10.082 1.00 0.00 O ATOM 1383 CB ASP A 85 -15.631 2.678 -13.126 1.00 0.00 C ATOM 1384 CG ASP A 85 -16.789 2.548 -12.164 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -17.395 3.578 -11.813 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -17.094 1.409 -11.748 1.00 0.00 O1- ATOM 0 H ASP A 85 -13.480 2.905 -14.322 1.00 0.00 H new ATOM 0 HA ASP A 85 -14.589 4.281 -12.157 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -15.924 3.318 -13.959 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -15.397 1.699 -13.543 1.00 0.00 H new ATOM 1391 N SER A 86 -13.447 1.283 -11.389 1.00 0.00 N ATOM 1392 CA SER A 86 -13.024 0.473 -10.257 1.00 0.00 C ATOM 1393 C SER A 86 -11.816 1.102 -9.570 1.00 0.00 C ATOM 1394 O SER A 86 -11.735 1.131 -8.343 1.00 0.00 O ATOM 1395 CB SER A 86 -12.721 -0.963 -10.696 1.00 0.00 C ATOM 1396 OG SER A 86 -11.922 -0.982 -11.865 1.00 0.00 O ATOM 0 H SER A 86 -13.256 0.873 -12.303 1.00 0.00 H new ATOM 0 HA SER A 86 -13.842 0.436 -9.538 1.00 0.00 H new ATOM 0 HB2 SER A 86 -12.208 -1.491 -9.893 1.00 0.00 H new ATOM 0 HB3 SER A 86 -13.655 -1.494 -10.881 1.00 0.00 H new ATOM 0 HG SER A 86 -12.497 -1.079 -12.653 1.00 0.00 H new ATOM 1402 N LEU A 87 -10.900 1.641 -10.376 1.00 0.00 N ATOM 1403 CA LEU A 87 -9.686 2.278 -9.865 1.00 0.00 C ATOM 1404 C LEU A 87 -10.026 3.441 -8.944 1.00 0.00 C ATOM 1405 O LEU A 87 -9.409 3.611 -7.901 1.00 0.00 O ATOM 1406 CB LEU A 87 -8.817 2.780 -11.024 1.00 0.00 C ATOM 1407 CG LEU A 87 -8.265 1.703 -11.957 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -7.506 2.325 -13.113 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -7.369 0.760 -11.194 1.00 0.00 C ATOM 0 H LEU A 87 -10.978 1.649 -11.393 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.133 1.531 -9.296 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.405 3.481 -11.617 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.978 3.339 -10.609 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.106 1.141 -12.363 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.123 1.538 -13.762 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.175 2.971 -13.682 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.674 2.914 -12.727 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.983 -0.002 -11.871 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.538 1.317 -10.762 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.938 0.282 -10.397 1.00 0.00 H new ATOM 1421 N GLU A 88 -11.022 4.216 -9.333 1.00 0.00 N ATOM 1422 CA GLU A 88 -11.458 5.380 -8.570 1.00 0.00 C ATOM 1423 C GLU A 88 -11.871 4.997 -7.147 1.00 0.00 C ATOM 1424 O GLU A 88 -11.447 5.628 -6.175 1.00 0.00 O ATOM 1425 CB GLU A 88 -12.628 6.037 -9.296 1.00 0.00 C ATOM 1426 CG GLU A 88 -13.294 7.159 -8.533 1.00 0.00 C ATOM 1427 CD GLU A 88 -14.462 7.730 -9.289 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -15.531 7.090 -9.313 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -14.315 8.823 -9.876 1.00 0.00 O1- ATOM 0 H GLU A 88 -11.555 4.059 -10.188 1.00 0.00 H new ATOM 0 HA GLU A 88 -10.624 6.078 -8.492 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -12.274 6.425 -10.251 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.374 5.274 -9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -13.633 6.790 -7.565 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -12.567 7.947 -8.337 1.00 0.00 H new ATOM 1436 N GLN A 89 -12.671 3.951 -7.025 1.00 0.00 N ATOM 1437 CA GLN A 89 -13.127 3.504 -5.718 1.00 0.00 C ATOM 1438 C GLN A 89 -11.979 2.900 -4.929 1.00 0.00 C ATOM 1439 O GLN A 89 -11.868 3.100 -3.716 1.00 0.00 O ATOM 1440 CB GLN A 89 -14.278 2.506 -5.853 1.00 0.00 C ATOM 1441 CG GLN A 89 -15.505 3.087 -6.538 1.00 0.00 C ATOM 1442 CD GLN A 89 -16.020 4.342 -5.854 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -15.891 4.505 -4.638 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -16.600 5.238 -6.629 1.00 0.00 N ATOM 0 H GLN A 89 -13.017 3.398 -7.809 1.00 0.00 H new ATOM 0 HA GLN A 89 -13.497 4.372 -5.172 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -13.933 1.639 -6.417 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -14.559 2.151 -4.862 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -15.262 3.317 -7.575 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -16.296 2.337 -6.555 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -16.687 5.066 -7.631 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -16.961 6.103 -6.227 1.00 0.00 H new ATOM 1453 N LEU A 90 -11.114 2.178 -5.629 1.00 0.00 N ATOM 1454 CA LEU A 90 -9.959 1.565 -5.006 1.00 0.00 C ATOM 1455 C LEU A 90 -9.016 2.628 -4.459 1.00 0.00 C ATOM 1456 O LEU A 90 -8.494 2.486 -3.369 1.00 0.00 O ATOM 1457 CB LEU A 90 -9.221 0.655 -5.995 1.00 0.00 C ATOM 1458 CG LEU A 90 -10.019 -0.542 -6.526 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -9.197 -1.334 -7.527 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -10.476 -1.438 -5.384 1.00 0.00 C ATOM 0 H LEU A 90 -11.195 2.005 -6.631 1.00 0.00 H new ATOM 0 HA LEU A 90 -10.311 0.953 -4.176 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.900 1.258 -6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.319 0.280 -5.511 1.00 0.00 H new ATOM 0 HG LEU A 90 -10.904 -0.159 -7.034 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.782 -2.179 -7.891 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.927 -0.692 -8.365 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.291 -1.701 -7.044 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -11.040 -2.280 -5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.606 -1.809 -4.842 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -11.110 -0.867 -4.705 1.00 0.00 H new ATOM 1472 N LEU A 91 -8.825 3.706 -5.222 1.00 0.00 N ATOM 1473 CA LEU A 91 -7.952 4.807 -4.808 1.00 0.00 C ATOM 1474 C LEU A 91 -8.448 5.457 -3.521 1.00 0.00 C ATOM 1475 O LEU A 91 -7.664 5.715 -2.604 1.00 0.00 O ATOM 1476 CB LEU A 91 -7.845 5.866 -5.916 1.00 0.00 C ATOM 1477 CG LEU A 91 -7.107 5.439 -7.191 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -7.218 6.519 -8.256 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -5.645 5.140 -6.892 1.00 0.00 C ATOM 0 H LEU A 91 -9.264 3.840 -6.133 1.00 0.00 H new ATOM 0 HA LEU A 91 -6.964 4.385 -4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -8.853 6.177 -6.191 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.342 6.742 -5.506 1.00 0.00 H new ATOM 0 HG LEU A 91 -7.574 4.529 -7.567 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -6.689 6.200 -9.154 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.268 6.688 -8.494 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -6.777 7.444 -7.884 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.140 4.839 -7.810 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.166 6.033 -6.490 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.581 4.334 -6.161 1.00 0.00 H new ATOM 1491 N GLU A 92 -9.755 5.701 -3.446 1.00 0.00 N ATOM 1492 CA GLU A 92 -10.346 6.339 -2.273 1.00 0.00 C ATOM 1493 C GLU A 92 -10.161 5.465 -1.029 1.00 0.00 C ATOM 1494 O GLU A 92 -9.767 5.952 0.036 1.00 0.00 O ATOM 1495 CB GLU A 92 -11.835 6.608 -2.511 1.00 0.00 C ATOM 1496 CG GLU A 92 -12.526 7.331 -1.365 1.00 0.00 C ATOM 1497 CD GLU A 92 -13.999 7.551 -1.623 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -14.810 6.685 -1.230 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -14.354 8.589 -2.222 1.00 0.00 O1- ATOM 0 H GLU A 92 -10.422 5.467 -4.181 1.00 0.00 H new ATOM 0 HA GLU A 92 -9.837 7.288 -2.106 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -11.946 7.200 -3.419 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -12.341 5.659 -2.686 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -12.403 6.753 -0.449 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -12.041 8.294 -1.202 1.00 0.00 H new ATOM 1506 N GLU A 93 -10.428 4.178 -1.171 1.00 0.00 N ATOM 1507 CA GLU A 93 -10.253 3.241 -0.073 1.00 0.00 C ATOM 1508 C GLU A 93 -8.782 3.032 0.244 1.00 0.00 C ATOM 1509 O GLU A 93 -8.411 2.834 1.396 1.00 0.00 O ATOM 1510 CB GLU A 93 -10.935 1.906 -0.364 1.00 0.00 C ATOM 1511 CG GLU A 93 -12.447 1.960 -0.249 1.00 0.00 C ATOM 1512 CD GLU A 93 -12.903 2.490 1.100 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -12.458 1.955 2.141 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -13.712 3.437 1.128 1.00 0.00 O1- ATOM 0 H GLU A 93 -10.767 3.757 -2.036 1.00 0.00 H new ATOM 0 HA GLU A 93 -10.730 3.678 0.804 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -10.667 1.582 -1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -10.553 1.154 0.326 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -12.847 2.594 -1.040 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -12.857 0.962 -0.402 1.00 0.00 H new ATOM 1521 N LEU A 94 -7.955 3.086 -0.787 1.00 0.00 N ATOM 1522 CA LEU A 94 -6.518 2.870 -0.660 1.00 0.00 C ATOM 1523 C LEU A 94 -5.882 3.897 0.272 1.00 0.00 C ATOM 1524 O LEU A 94 -5.100 3.538 1.148 1.00 0.00 O ATOM 1525 CB LEU A 94 -5.869 2.941 -2.042 1.00 0.00 C ATOM 1526 CG LEU A 94 -4.373 2.664 -2.112 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -4.067 1.245 -1.666 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -3.873 2.900 -3.524 1.00 0.00 C ATOM 0 H LEU A 94 -8.260 3.281 -1.741 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.355 1.883 -0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.377 2.230 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.050 3.935 -2.452 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.858 3.346 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.993 1.069 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.402 1.106 -0.638 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.586 0.540 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.802 2.701 -3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.395 2.234 -4.211 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.061 3.935 -3.808 1.00 0.00 H new ATOM 1540 N GLU A 95 -6.233 5.170 0.095 1.00 0.00 N ATOM 1541 CA GLU A 95 -5.696 6.233 0.948 1.00 0.00 C ATOM 1542 C GLU A 95 -6.063 5.982 2.404 1.00 0.00 C ATOM 1543 O GLU A 95 -5.230 6.103 3.303 1.00 0.00 O ATOM 1544 CB GLU A 95 -6.225 7.599 0.513 1.00 0.00 C ATOM 1545 CG GLU A 95 -5.836 7.994 -0.897 1.00 0.00 C ATOM 1546 CD GLU A 95 -6.282 9.395 -1.245 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -7.418 9.562 -1.736 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -5.492 10.342 -1.042 1.00 0.00 O1- ATOM 0 H GLU A 95 -6.881 5.490 -0.625 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.611 6.229 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.312 7.597 0.591 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.857 8.356 1.205 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.754 7.922 -1.006 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.275 7.290 -1.603 1.00 0.00 H new ATOM 1555 N GLN A 96 -7.314 5.621 2.621 1.00 0.00 N ATOM 1556 CA GLN A 96 -7.821 5.333 3.952 1.00 0.00 C ATOM 1557 C GLN A 96 -7.170 4.069 4.523 1.00 0.00 C ATOM 1558 O GLN A 96 -6.902 3.981 5.721 1.00 0.00 O ATOM 1559 CB GLN A 96 -9.335 5.179 3.906 1.00 0.00 C ATOM 1560 CG GLN A 96 -10.068 6.440 3.474 1.00 0.00 C ATOM 1561 CD GLN A 96 -11.536 6.191 3.205 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -12.376 6.298 4.099 1.00 0.00 O ATOM 1563 NE2 GLN A 96 -11.856 5.866 1.971 1.00 0.00 N ATOM 0 H GLN A 96 -8.008 5.519 1.881 1.00 0.00 H new ATOM 0 HA GLN A 96 -7.569 6.166 4.608 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.588 4.370 3.220 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -9.691 4.883 4.893 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -9.967 7.199 4.250 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -9.599 6.839 2.575 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -11.129 5.788 1.259 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -12.831 5.692 1.726 1.00 0.00 H new ATOM 1572 N ALA A 97 -6.926 3.094 3.658 1.00 0.00 N ATOM 1573 CA ALA A 97 -6.289 1.847 4.062 1.00 0.00 C ATOM 1574 C ALA A 97 -4.859 2.097 4.512 1.00 0.00 C ATOM 1575 O ALA A 97 -4.387 1.495 5.475 1.00 0.00 O ATOM 1576 CB ALA A 97 -6.321 0.835 2.926 1.00 0.00 C ATOM 0 H ALA A 97 -7.161 3.143 2.667 1.00 0.00 H new ATOM 0 HA ALA A 97 -6.847 1.436 4.903 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.841 -0.089 3.248 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.355 0.629 2.651 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -5.790 1.239 2.064 1.00 0.00 H new ATOM 1582 N LEU A 98 -4.179 3.008 3.821 1.00 0.00 N ATOM 1583 CA LEU A 98 -2.803 3.364 4.159 1.00 0.00 C ATOM 1584 C LEU A 98 -2.746 3.965 5.551 1.00 0.00 C ATOM 1585 O LEU A 98 -1.816 3.708 6.315 1.00 0.00 O ATOM 1586 CB LEU A 98 -2.243 4.362 3.145 1.00 0.00 C ATOM 1587 CG LEU A 98 -2.133 3.866 1.705 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -1.674 4.988 0.793 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -1.182 2.682 1.617 1.00 0.00 C ATOM 0 H LEU A 98 -4.559 3.515 3.021 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.198 2.458 4.133 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.874 5.251 3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.252 4.670 3.478 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.119 3.536 1.378 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.601 4.618 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.393 5.806 0.832 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.698 5.347 1.120 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.117 2.343 0.583 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.193 2.983 1.963 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.553 1.870 2.242 1.00 0.00 H new ATOM 1601 N GLN A 99 -3.762 4.750 5.879 1.00 0.00 N ATOM 1602 CA GLN A 99 -3.867 5.375 7.177 1.00 0.00 C ATOM 1603 C GLN A 99 -3.991 4.309 8.259 1.00 0.00 C ATOM 1604 O GLN A 99 -3.318 4.371 9.292 1.00 0.00 O ATOM 1605 CB GLN A 99 -5.077 6.317 7.194 1.00 0.00 C ATOM 1606 CG GLN A 99 -5.486 6.798 8.574 1.00 0.00 C ATOM 1607 CD GLN A 99 -4.409 7.601 9.279 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -3.602 8.284 8.648 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -4.383 7.508 10.594 1.00 0.00 N ATOM 0 H GLN A 99 -4.534 4.968 5.248 1.00 0.00 H new ATOM 0 HA GLN A 99 -2.968 5.958 7.377 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -4.854 7.185 6.573 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -5.924 5.807 6.736 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -6.384 7.409 8.486 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -5.746 5.936 9.188 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -5.071 6.931 11.078 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -3.675 8.013 11.127 1.00 0.00 H new ATOM 1618 N LYS A 100 -4.834 3.316 8.000 1.00 0.00 N ATOM 1619 CA LYS A 100 -5.037 2.222 8.934 1.00 0.00 C ATOM 1620 C LYS A 100 -3.755 1.428 9.117 1.00 0.00 C ATOM 1621 O LYS A 100 -3.391 1.082 10.234 1.00 0.00 O ATOM 1622 CB LYS A 100 -6.149 1.296 8.456 1.00 0.00 C ATOM 1623 CG LYS A 100 -7.502 1.964 8.322 1.00 0.00 C ATOM 1624 CD LYS A 100 -8.586 0.939 8.053 1.00 0.00 C ATOM 1625 CE LYS A 100 -9.901 1.597 7.672 1.00 0.00 C ATOM 1626 NZ LYS A 100 -9.796 2.345 6.394 1.00 0.00 N ATOM 0 H LYS A 100 -5.389 3.249 7.147 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.328 2.654 9.892 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -5.867 0.877 7.490 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.236 0.462 9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -7.733 2.513 9.235 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.474 2.692 7.511 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -8.266 0.274 7.251 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -8.731 0.322 8.940 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -10.676 0.836 7.584 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -10.210 2.277 8.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.746 2.488 5.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -9.351 3.269 6.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.217 1.803 5.721 1.00 0.00 H new ATOM 1640 N ILE A 101 -3.064 1.157 8.011 1.00 0.00 N ATOM 1641 CA ILE A 101 -1.813 0.406 8.050 1.00 0.00 C ATOM 1642 C ILE A 101 -0.784 1.127 8.911 1.00 0.00 C ATOM 1643 O ILE A 101 -0.102 0.510 9.726 1.00 0.00 O ATOM 1644 CB ILE A 101 -1.235 0.182 6.627 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -2.178 -0.697 5.801 1.00 0.00 C ATOM 1646 CG2 ILE A 101 0.157 -0.444 6.696 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -1.708 -0.929 4.380 1.00 0.00 C ATOM 0 H ILE A 101 -3.351 1.447 7.076 1.00 0.00 H new ATOM 0 HA ILE A 101 -2.033 -0.568 8.487 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.146 1.152 6.139 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.291 -1.660 6.298 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.164 -0.233 5.777 1.00 0.00 H new ATOM 0 HG21 ILE A 101 0.540 -0.591 5.686 1.00 0.00 H new ATOM 0 HG22 ILE A 101 0.827 0.218 7.246 1.00 0.00 H new ATOM 0 HG23 ILE A 101 0.099 -1.406 7.205 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -2.427 -1.560 3.857 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -1.622 0.027 3.864 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -0.736 -1.422 4.394 1.00 0.00 H new ATOM 1659 N ARG A 102 -0.700 2.439 8.745 1.00 0.00 N ATOM 1660 CA ARG A 102 0.228 3.247 9.525 1.00 0.00 C ATOM 1661 C ARG A 102 -0.108 3.169 11.010 1.00 0.00 C ATOM 1662 O ARG A 102 0.784 3.098 11.853 1.00 0.00 O ATOM 1663 CB ARG A 102 0.210 4.696 9.046 1.00 0.00 C ATOM 1664 CG ARG A 102 0.733 4.876 7.631 1.00 0.00 C ATOM 1665 CD ARG A 102 0.610 6.317 7.166 1.00 0.00 C ATOM 1666 NE ARG A 102 1.352 7.238 8.029 1.00 0.00 N ATOM 1667 CZ ARG A 102 2.123 8.232 7.588 1.00 0.00 C ATOM 1668 NH1 ARG A 102 2.259 8.447 6.281 1.00 0.00 N ATOM 1669 NH2 ARG A 102 2.747 9.014 8.457 1.00 0.00 N ATOM 0 H ARG A 102 -1.263 2.967 8.078 1.00 0.00 H new ATOM 0 HA ARG A 102 1.233 2.850 9.381 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -0.811 5.074 9.098 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.809 5.302 9.726 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.777 4.567 7.587 1.00 0.00 H new ATOM 0 HG3 ARG A 102 0.180 4.226 6.953 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.980 6.401 6.144 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -0.441 6.604 7.149 1.00 0.00 H new ATOM 0 HE ARG A 102 1.274 7.110 9.038 1.00 0.00 H new ATOM 0 HH11 ARG A 102 1.772 7.850 5.613 1.00 0.00 H new ATOM 0 HH12 ARG A 102 2.850 9.209 5.948 1.00 0.00 H new ATOM 0 HH21 ARG A 102 2.636 8.854 9.458 1.00 0.00 H new ATOM 0 HH22 ARG A 102 3.338 9.776 8.125 1.00 0.00 H new ATOM 1683 N GLU A 103 -1.399 3.164 11.323 1.00 0.00 N ATOM 1684 CA GLU A 103 -1.845 3.054 12.703 1.00 0.00 C ATOM 1685 C GLU A 103 -1.550 1.665 13.258 1.00 0.00 C ATOM 1686 O GLU A 103 -1.147 1.524 14.409 1.00 0.00 O ATOM 1687 CB GLU A 103 -3.337 3.363 12.825 1.00 0.00 C ATOM 1688 CG GLU A 103 -3.688 4.812 12.550 1.00 0.00 C ATOM 1689 CD GLU A 103 -5.160 5.097 12.742 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -5.620 5.110 13.903 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -5.866 5.316 11.735 1.00 0.00 O1- ATOM 0 H GLU A 103 -2.153 3.235 10.639 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.293 3.789 13.289 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -3.888 2.728 12.131 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.671 3.103 13.829 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.107 5.455 13.211 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -3.402 5.064 11.529 1.00 0.00 H new ATOM 1698 N LEU A 104 -1.748 0.642 12.427 1.00 0.00 N ATOM 1699 CA LEU A 104 -1.493 -0.742 12.826 1.00 0.00 C ATOM 1700 C LEU A 104 -0.009 -0.964 13.066 1.00 0.00 C ATOM 1701 O LEU A 104 0.380 -1.642 14.012 1.00 0.00 O ATOM 1702 CB LEU A 104 -2.004 -1.721 11.764 1.00 0.00 C ATOM 1703 CG LEU A 104 -3.504 -1.666 11.465 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -3.880 -2.706 10.423 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -4.314 -1.863 12.738 1.00 0.00 C ATOM 0 H LEU A 104 -2.085 0.746 11.470 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.032 -0.927 13.755 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.462 -1.535 10.837 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.754 -2.733 12.082 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.736 -0.680 11.063 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.950 -2.651 10.224 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.329 -2.514 9.502 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.630 -3.700 10.794 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.377 -1.820 12.503 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.077 -2.834 13.173 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.068 -1.076 13.451 1.00 0.00 H new ATOM 1717 N ALA A 105 0.813 -0.377 12.213 1.00 0.00 N ATOM 1718 CA ALA A 105 2.259 -0.484 12.341 1.00 0.00 C ATOM 1719 C ALA A 105 2.736 0.210 13.612 1.00 0.00 C ATOM 1720 O ALA A 105 3.788 -0.117 14.158 1.00 0.00 O ATOM 1721 CB ALA A 105 2.937 0.113 11.122 1.00 0.00 C ATOM 0 H ALA A 105 0.502 0.183 11.419 1.00 0.00 H new ATOM 0 HA ALA A 105 2.526 -1.539 12.407 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.018 0.027 11.229 1.00 0.00 H new ATOM 0 HB2 ALA A 105 2.617 -0.423 10.229 1.00 0.00 H new ATOM 0 HB3 ALA A 105 2.663 1.164 11.032 1.00 0.00 H new ATOM 1727 N GLU A 106 1.940 1.157 14.078 1.00 0.00 N ATOM 1728 CA GLU A 106 2.233 1.903 15.291 1.00 0.00 C ATOM 1729 C GLU A 106 1.697 1.155 16.514 1.00 0.00 C ATOM 1730 O GLU A 106 2.002 1.500 17.664 1.00 0.00 O ATOM 1731 CB GLU A 106 1.592 3.292 15.197 1.00 0.00 C ATOM 1732 CG GLU A 106 1.902 4.211 16.360 1.00 0.00 C ATOM 1733 CD GLU A 106 1.158 5.519 16.266 1.00 0.00 C ATOM 1734 OE1 GLU A 106 -0.069 5.521 16.501 1.00 0.00 O ATOM 1735 OE2 GLU A 106 1.794 6.551 15.970 1.00 0.00 O1- ATOM 0 H GLU A 106 1.069 1.432 13.624 1.00 0.00 H new ATOM 0 HA GLU A 106 3.312 2.009 15.398 1.00 0.00 H new ATOM 0 HB2 GLU A 106 1.925 3.769 14.275 1.00 0.00 H new ATOM 0 HB3 GLU A 106 0.511 3.174 15.123 1.00 0.00 H new ATOM 0 HG2 GLU A 106 1.641 3.713 17.294 1.00 0.00 H new ATOM 0 HG3 GLU A 106 2.974 4.406 16.391 1.00 0.00 H new ATOM 1742 N LYS A 107 0.905 0.129 16.262 1.00 0.00 N ATOM 1743 CA LYS A 107 0.298 -0.645 17.324 1.00 0.00 C ATOM 1744 C LYS A 107 1.127 -1.855 17.684 1.00 0.00 C ATOM 1745 O LYS A 107 1.455 -2.680 16.827 1.00 0.00 O ATOM 1746 CB LYS A 107 -1.108 -1.106 16.937 1.00 0.00 C ATOM 1747 CG LYS A 107 -2.149 -0.006 16.919 1.00 0.00 C ATOM 1748 CD LYS A 107 -3.539 -0.553 16.603 1.00 0.00 C ATOM 1749 CE LYS A 107 -3.972 -1.611 17.615 1.00 0.00 C ATOM 1750 NZ LYS A 107 -4.028 -1.072 19.000 1.00 0.00 N ATOM 0 H LYS A 107 0.667 -0.188 15.322 1.00 0.00 H new ATOM 0 HA LYS A 107 0.241 0.013 18.191 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -1.067 -1.565 15.949 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -1.428 -1.880 17.635 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.166 0.496 17.887 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.875 0.743 16.176 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -4.260 0.265 16.600 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -3.542 -0.984 15.602 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.953 -1.998 17.337 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.277 -2.450 17.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -3.238 -1.458 19.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.957 -0.035 18.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.928 -1.346 19.443 1.00 0.00 H new ATOM 1764 N LYS A 108 1.475 -1.953 18.942 1.00 0.00 N ATOM 1765 CA LYS A 108 2.147 -3.122 19.444 1.00 0.00 C ATOM 1766 C LYS A 108 1.184 -3.881 20.346 1.00 0.00 C ATOM 1767 O LYS A 108 1.345 -5.069 20.595 1.00 0.00 O ATOM 1768 CB LYS A 108 3.419 -2.745 20.207 1.00 0.00 C ATOM 1769 CG LYS A 108 4.362 -3.919 20.413 1.00 0.00 C ATOM 1770 CD LYS A 108 5.580 -3.531 21.225 1.00 0.00 C ATOM 1771 CE LYS A 108 6.591 -4.668 21.287 1.00 0.00 C ATOM 1772 NZ LYS A 108 5.987 -5.929 21.788 1.00 0.00 N ATOM 0 H LYS A 108 1.302 -1.231 19.641 1.00 0.00 H new ATOM 0 HA LYS A 108 2.449 -3.753 18.608 1.00 0.00 H new ATOM 0 HB2 LYS A 108 3.942 -1.958 19.663 1.00 0.00 H new ATOM 0 HB3 LYS A 108 3.144 -2.333 21.178 1.00 0.00 H new ATOM 0 HG2 LYS A 108 3.831 -4.726 20.918 1.00 0.00 H new ATOM 0 HG3 LYS A 108 4.680 -4.304 19.444 1.00 0.00 H new ATOM 0 HD2 LYS A 108 6.047 -2.650 20.785 1.00 0.00 H new ATOM 0 HD3 LYS A 108 5.274 -3.258 22.235 1.00 0.00 H new ATOM 0 HE2 LYS A 108 7.007 -4.836 20.294 1.00 0.00 H new ATOM 0 HE3 LYS A 108 7.419 -4.381 21.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 6.739 -6.618 21.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 5.451 -5.736 22.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 5.347 -6.318 21.067 1.00 0.00 H new ATOM 1786 N ASN A 109 0.167 -3.172 20.816 1.00 0.00 N ATOM 1787 CA ASN A 109 -0.856 -3.753 21.663 1.00 0.00 C ATOM 1788 C ASN A 109 -2.188 -3.774 20.931 1.00 0.00 C ATOM 1789 O ASN A 109 -2.756 -2.690 20.700 1.00 0.00 O ATOM 1790 CB ASN A 109 -0.994 -2.971 22.971 1.00 0.00 C ATOM 1791 CG ASN A 109 -2.088 -3.527 23.869 1.00 0.00 C ATOM 1792 OD1 ASN A 109 -3.248 -3.122 23.784 1.00 0.00 O ATOM 1793 ND2 ASN A 109 -1.726 -4.450 24.734 1.00 0.00 N ATOM 1794 OXT ASN A 109 -2.666 -4.873 20.595 1.00 0.00 O ATOM 0 H ASN A 109 0.031 -2.180 20.619 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.559 -4.774 21.903 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.044 -2.992 23.505 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -1.209 -1.927 22.745 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -2.417 -4.857 25.365 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -0.755 -4.759 24.774 1.00 0.00 H new TER 1801 ASN A 109