USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=14 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 Set 1.1: A 9 THR OG1 : rot 76:sc= 0.942 USER MOD Set 1.2: A 45 LYS NZ :NH3+ -144:sc= 0.933 (180deg=-0.431) USER MOD Set 2.1: A 5 LYS NZ :NH3+ -167:sc= 1.18 (180deg=0) USER MOD Set 2.2: A 8 GLN : amide:sc= 1.09 K(o=2.3,f=-8.9!) USER MOD Single : A 1 SER N :NH3+ 133:sc= 0.0308 (180deg=0) USER MOD Single : A 1 SER OG : rot -116:sc= 0.34 USER MOD Single : A 15 GLN : amide:sc= -0.18 X(o=-0.18,f=-0.21) USER MOD Single : A 18 GLN : amide:sc= 0.586 K(o=0.59,f=-2) USER MOD Single : A 26 LYS NZ :NH3+ -150:sc= 2.34 (180deg=2.32) USER MOD Single : A 31 SER OG : rot 68:sc= 1.15 USER MOD Single : A 34 GLN : amide:sc= -0.226 K(o=-0.23,f=-0.9) USER MOD Single : A 44 GLN : amide:sc= -0.0708 X(o=-0.071,f=-0.56) USER MOD Single : A 46 HIS : no HD1:sc= -0.388 K(o=-0.39,f=-1.7!) USER MOD Single : A 48 GLN : amide:sc= -0.21 X(o=-0.21,f=-0.37) USER MOD Single : A 52 ASN : amide:sc=-0.00594 X(o=-0.0059,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0919 K(o=-0.092,f=-0.63) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.14) USER MOD Single : A 67 GLN : amide:sc= -0.873 X(o=-0.87,f=-0.7) USER MOD Single : A 70 GLN : amide:sc= -0.259 K(o=-0.26,f=-0.95) USER MOD Single : A 73 GLN : amide:sc= -0.369 K(o=-0.37,f=-2.1!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -168:sc= 0.971 (180deg=0.858) USER MOD Single : A 86 SER OG : rot 65:sc= 1.24 USER MOD Single : A 89 GLN : amide:sc= -0.14 K(o=-0.14,f=-0.75) USER MOD Single : A 96 GLN :FLIP amide:sc= -0.78 F(o=-1.4,f=-0.78) USER MOD Single : A 99 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 100 LYS NZ :NH3+ -122:sc= 0.0347 (180deg=-0.39) USER MOD Single : A 107 LYS NZ :NH3+ 172:sc=-0.00297 (180deg=-0.0778) USER MOD Single : A 108 LYS NZ :NH3+ 152:sc= 1.21 (180deg=1.12) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.084) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 14.108 -4.666 19.001 1.00 0.00 N ATOM 2 CA SER A 1 12.820 -4.341 18.382 1.00 0.00 C ATOM 3 C SER A 1 12.854 -2.930 17.822 1.00 0.00 C ATOM 4 O SER A 1 13.443 -2.031 18.428 1.00 0.00 O ATOM 5 CB SER A 1 11.689 -4.475 19.411 1.00 0.00 C ATOM 6 OG SER A 1 10.435 -4.143 18.844 1.00 0.00 O ATOM 0 H1 SER A 1 13.946 -5.096 19.934 1.00 0.00 H new ATOM 0 H2 SER A 1 14.625 -5.336 18.396 1.00 0.00 H new ATOM 0 H3 SER A 1 14.669 -3.797 19.113 1.00 0.00 H new ATOM 0 HA SER A 1 12.635 -5.040 17.566 1.00 0.00 H new ATOM 0 HB2 SER A 1 11.660 -5.496 19.791 1.00 0.00 H new ATOM 0 HB3 SER A 1 11.890 -3.824 20.262 1.00 0.00 H new ATOM 0 HG SER A 1 10.074 -3.349 19.290 1.00 0.00 H new ATOM 14 N GLU A 2 12.234 -2.735 16.673 1.00 0.00 N ATOM 15 CA GLU A 2 12.192 -1.434 16.046 1.00 0.00 C ATOM 16 C GLU A 2 10.774 -1.094 15.624 1.00 0.00 C ATOM 17 O GLU A 2 10.061 -1.928 15.069 1.00 0.00 O ATOM 18 CB GLU A 2 13.140 -1.379 14.840 1.00 0.00 C ATOM 19 CG GLU A 2 13.113 -0.051 14.084 1.00 0.00 C ATOM 20 CD GLU A 2 13.514 1.135 14.944 1.00 0.00 C ATOM 21 OE1 GLU A 2 14.640 1.644 14.773 1.00 0.00 O ATOM 22 OE2 GLU A 2 12.703 1.566 15.787 1.00 0.00 O1- ATOM 0 H GLU A 2 11.751 -3.469 16.155 1.00 0.00 H new ATOM 0 HA GLU A 2 12.524 -0.694 16.774 1.00 0.00 H new ATOM 0 HB2 GLU A 2 14.157 -1.569 15.182 1.00 0.00 H new ATOM 0 HB3 GLU A 2 12.880 -2.182 14.151 1.00 0.00 H new ATOM 0 HG2 GLU A 2 13.784 -0.114 13.228 1.00 0.00 H new ATOM 0 HG3 GLU A 2 12.110 0.116 13.691 1.00 0.00 H new ATOM 29 N PHE A 3 10.375 0.127 15.897 1.00 0.00 N ATOM 30 CA PHE A 3 9.050 0.600 15.556 1.00 0.00 C ATOM 31 C PHE A 3 9.157 1.767 14.591 1.00 0.00 C ATOM 32 O PHE A 3 8.352 1.908 13.672 1.00 0.00 O ATOM 33 CB PHE A 3 8.298 1.044 16.818 1.00 0.00 C ATOM 34 CG PHE A 3 8.195 -0.019 17.879 1.00 0.00 C ATOM 35 CD1 PHE A 3 9.171 -0.138 18.856 1.00 0.00 C ATOM 36 CD2 PHE A 3 7.125 -0.894 17.899 1.00 0.00 C ATOM 37 CE1 PHE A 3 9.081 -1.111 19.830 1.00 0.00 C ATOM 38 CE2 PHE A 3 7.029 -1.870 18.872 1.00 0.00 C ATOM 39 CZ PHE A 3 8.008 -1.978 19.837 1.00 0.00 C ATOM 0 H PHE A 3 10.959 0.822 16.362 1.00 0.00 H new ATOM 0 HA PHE A 3 8.498 -0.214 15.086 1.00 0.00 H new ATOM 0 HB2 PHE A 3 8.800 1.915 17.239 1.00 0.00 H new ATOM 0 HB3 PHE A 3 7.293 1.360 16.537 1.00 0.00 H new ATOM 0 HD1 PHE A 3 10.012 0.539 18.855 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.355 -0.814 17.146 1.00 0.00 H new ATOM 0 HE1 PHE A 3 9.849 -1.194 20.585 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.188 -2.548 18.877 1.00 0.00 H new ATOM 0 HZ PHE A 3 7.935 -2.741 20.598 1.00 0.00 H new ATOM 49 N GLU A 4 10.193 2.574 14.786 1.00 0.00 N ATOM 50 CA GLU A 4 10.413 3.782 14.003 1.00 0.00 C ATOM 51 C GLU A 4 10.567 3.476 12.515 1.00 0.00 C ATOM 52 O GLU A 4 9.992 4.163 11.670 1.00 0.00 O ATOM 53 CB GLU A 4 11.648 4.512 14.524 1.00 0.00 C ATOM 54 CG GLU A 4 11.952 5.813 13.812 1.00 0.00 C ATOM 55 CD GLU A 4 13.199 6.469 14.345 1.00 0.00 C ATOM 56 OE1 GLU A 4 13.095 7.281 15.291 1.00 0.00 O ATOM 57 OE2 GLU A 4 14.292 6.172 13.833 1.00 0.00 O1- ATOM 0 H GLU A 4 10.907 2.407 15.495 1.00 0.00 H new ATOM 0 HA GLU A 4 9.536 4.420 14.113 1.00 0.00 H new ATOM 0 HB2 GLU A 4 11.513 4.716 15.586 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.511 3.852 14.433 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.069 5.624 12.745 1.00 0.00 H new ATOM 0 HG3 GLU A 4 11.108 6.494 13.924 1.00 0.00 H new ATOM 64 N LYS A 5 11.326 2.436 12.196 1.00 0.00 N ATOM 65 CA LYS A 5 11.559 2.080 10.802 1.00 0.00 C ATOM 66 C LYS A 5 10.260 1.633 10.132 1.00 0.00 C ATOM 67 O LYS A 5 10.047 1.867 8.934 1.00 0.00 O ATOM 68 CB LYS A 5 12.630 0.990 10.683 1.00 0.00 C ATOM 69 CG LYS A 5 13.135 0.781 9.260 1.00 0.00 C ATOM 70 CD LYS A 5 13.771 2.052 8.714 1.00 0.00 C ATOM 71 CE LYS A 5 14.214 1.889 7.273 1.00 0.00 C ATOM 72 NZ LYS A 5 14.796 3.144 6.738 1.00 0.00 N ATOM 0 H LYS A 5 11.786 1.830 12.875 1.00 0.00 H new ATOM 0 HA LYS A 5 11.923 2.969 10.286 1.00 0.00 H new ATOM 0 HB2 LYS A 5 13.473 1.249 11.324 1.00 0.00 H new ATOM 0 HB3 LYS A 5 12.223 0.050 11.056 1.00 0.00 H new ATOM 0 HG2 LYS A 5 13.863 -0.030 9.244 1.00 0.00 H new ATOM 0 HG3 LYS A 5 12.308 0.479 8.618 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.058 2.874 8.784 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.629 2.322 9.329 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.950 1.088 7.206 1.00 0.00 H new ATOM 0 HE3 LYS A 5 13.363 1.592 6.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 14.885 3.072 5.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 14.176 3.944 6.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 15.736 3.297 7.156 1.00 0.00 H new ATOM 86 N LEU A 6 9.388 1.006 10.907 1.00 0.00 N ATOM 87 CA LEU A 6 8.106 0.568 10.392 1.00 0.00 C ATOM 88 C LEU A 6 7.201 1.774 10.172 1.00 0.00 C ATOM 89 O LEU A 6 6.426 1.815 9.220 1.00 0.00 O ATOM 90 CB LEU A 6 7.447 -0.439 11.344 1.00 0.00 C ATOM 91 CG LEU A 6 6.113 -1.031 10.869 1.00 0.00 C ATOM 92 CD1 LEU A 6 6.283 -1.746 9.535 1.00 0.00 C ATOM 93 CD2 LEU A 6 5.552 -1.983 11.912 1.00 0.00 C ATOM 0 H LEU A 6 9.547 0.791 11.891 1.00 0.00 H new ATOM 0 HA LEU A 6 8.265 0.066 9.438 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.145 -1.258 11.517 1.00 0.00 H new ATOM 0 HB3 LEU A 6 7.285 0.050 12.305 1.00 0.00 H new ATOM 0 HG LEU A 6 5.408 -0.212 10.731 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.325 -2.158 9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.640 -1.039 8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.006 -2.554 9.645 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.606 -2.393 11.559 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.259 -2.795 12.081 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.388 -1.444 12.845 1.00 0.00 H new ATOM 105 N ARG A 7 7.334 2.768 11.048 1.00 0.00 N ATOM 106 CA ARG A 7 6.562 4.003 10.935 1.00 0.00 C ATOM 107 C ARG A 7 6.916 4.721 9.645 1.00 0.00 C ATOM 108 O ARG A 7 6.037 5.187 8.915 1.00 0.00 O ATOM 109 CB ARG A 7 6.838 4.930 12.122 1.00 0.00 C ATOM 110 CG ARG A 7 6.511 4.327 13.472 1.00 0.00 C ATOM 111 CD ARG A 7 6.676 5.340 14.586 1.00 0.00 C ATOM 112 NE ARG A 7 5.810 6.502 14.401 1.00 0.00 N ATOM 113 CZ ARG A 7 5.580 7.422 15.334 1.00 0.00 C ATOM 114 NH1 ARG A 7 6.151 7.318 16.531 1.00 0.00 N ATOM 115 NH2 ARG A 7 4.776 8.443 15.069 1.00 0.00 N ATOM 0 H ARG A 7 7.970 2.742 11.845 1.00 0.00 H new ATOM 0 HA ARG A 7 5.504 3.741 10.932 1.00 0.00 H new ATOM 0 HB2 ARG A 7 7.890 5.214 12.109 1.00 0.00 H new ATOM 0 HB3 ARG A 7 6.259 5.845 11.996 1.00 0.00 H new ATOM 0 HG2 ARG A 7 5.487 3.954 13.467 1.00 0.00 H new ATOM 0 HG3 ARG A 7 7.161 3.472 13.657 1.00 0.00 H new ATOM 0 HD2 ARG A 7 6.450 4.868 15.542 1.00 0.00 H new ATOM 0 HD3 ARG A 7 7.715 5.666 14.629 1.00 0.00 H new ATOM 0 HE ARG A 7 5.352 6.615 13.497 1.00 0.00 H new ATOM 0 HH11 ARG A 7 6.767 6.531 16.736 1.00 0.00 H new ATOM 0 HH12 ARG A 7 5.973 8.025 17.244 1.00 0.00 H new ATOM 0 HH21 ARG A 7 4.336 8.521 14.152 1.00 0.00 H new ATOM 0 HH22 ARG A 7 4.598 9.150 15.782 1.00 0.00 H new ATOM 129 N GLN A 8 8.216 4.786 9.357 1.00 0.00 N ATOM 130 CA GLN A 8 8.700 5.429 8.144 1.00 0.00 C ATOM 131 C GLN A 8 8.148 4.717 6.921 1.00 0.00 C ATOM 132 O GLN A 8 7.686 5.350 5.982 1.00 0.00 O ATOM 133 CB GLN A 8 10.228 5.399 8.088 1.00 0.00 C ATOM 134 CG GLN A 8 10.806 6.181 6.916 1.00 0.00 C ATOM 135 CD GLN A 8 12.157 5.663 6.464 1.00 0.00 C ATOM 136 OE1 GLN A 8 12.921 5.102 7.248 1.00 0.00 O ATOM 137 NE2 GLN A 8 12.457 5.846 5.193 1.00 0.00 N ATOM 0 H GLN A 8 8.950 4.400 9.950 1.00 0.00 H new ATOM 0 HA GLN A 8 8.362 6.465 8.153 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.626 5.805 9.018 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.562 4.363 8.024 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.109 6.138 6.079 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.901 7.229 7.198 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.795 6.316 4.575 1.00 0.00 H new ATOM 0 HE22 GLN A 8 13.351 5.517 4.828 1.00 0.00 H new ATOM 146 N THR A 9 8.188 3.395 6.956 1.00 0.00 N ATOM 147 CA THR A 9 7.710 2.583 5.854 1.00 0.00 C ATOM 148 C THR A 9 6.185 2.705 5.696 1.00 0.00 C ATOM 149 O THR A 9 5.661 2.675 4.581 1.00 0.00 O ATOM 150 CB THR A 9 8.117 1.108 6.043 1.00 0.00 C ATOM 151 OG1 THR A 9 9.535 1.035 6.265 1.00 0.00 O ATOM 152 CG2 THR A 9 7.765 0.284 4.814 1.00 0.00 C ATOM 0 H THR A 9 8.551 2.859 7.745 1.00 0.00 H new ATOM 0 HA THR A 9 8.176 2.954 4.941 1.00 0.00 H new ATOM 0 HB THR A 9 7.575 0.706 6.899 1.00 0.00 H new ATOM 0 HG1 THR A 9 9.738 1.320 7.181 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.063 -0.752 4.973 1.00 0.00 H new ATOM 0 HG22 THR A 9 6.690 0.330 4.641 1.00 0.00 H new ATOM 0 HG23 THR A 9 8.290 0.683 3.946 1.00 0.00 H new ATOM 160 N GLY A 10 5.481 2.839 6.815 1.00 0.00 N ATOM 161 CA GLY A 10 4.044 3.017 6.764 1.00 0.00 C ATOM 162 C GLY A 10 3.677 4.329 6.104 1.00 0.00 C ATOM 163 O GLY A 10 2.802 4.378 5.240 1.00 0.00 O ATOM 0 H GLY A 10 5.880 2.827 7.754 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.592 2.192 6.214 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.635 2.988 7.774 1.00 0.00 H new ATOM 167 N ASP A 11 4.368 5.389 6.502 1.00 0.00 N ATOM 168 CA ASP A 11 4.160 6.716 5.925 1.00 0.00 C ATOM 169 C ASP A 11 4.596 6.716 4.467 1.00 0.00 C ATOM 170 O ASP A 11 3.979 7.358 3.619 1.00 0.00 O ATOM 171 CB ASP A 11 4.957 7.768 6.709 1.00 0.00 C ATOM 172 CG ASP A 11 4.644 9.191 6.279 1.00 0.00 C ATOM 173 OD1 ASP A 11 3.689 9.787 6.836 1.00 0.00 O ATOM 174 OD2 ASP A 11 5.356 9.731 5.401 1.00 0.00 O1- ATOM 0 H ASP A 11 5.084 5.357 7.228 1.00 0.00 H new ATOM 0 HA ASP A 11 3.100 6.965 5.984 1.00 0.00 H new ATOM 0 HB2 ASP A 11 4.743 7.660 7.772 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.023 7.581 6.578 1.00 0.00 H new ATOM 179 N GLU A 12 5.652 5.958 4.192 1.00 0.00 N ATOM 180 CA GLU A 12 6.228 5.846 2.857 1.00 0.00 C ATOM 181 C GLU A 12 5.210 5.323 1.860 1.00 0.00 C ATOM 182 O GLU A 12 5.076 5.866 0.768 1.00 0.00 O ATOM 183 CB GLU A 12 7.433 4.907 2.908 1.00 0.00 C ATOM 184 CG GLU A 12 8.055 4.596 1.562 1.00 0.00 C ATOM 185 CD GLU A 12 9.149 3.563 1.674 1.00 0.00 C ATOM 186 OE1 GLU A 12 8.832 2.365 1.794 1.00 0.00 O ATOM 187 OE2 GLU A 12 10.335 3.941 1.650 1.00 0.00 O1- ATOM 0 H GLU A 12 6.136 5.400 4.895 1.00 0.00 H new ATOM 0 HA GLU A 12 6.540 6.838 2.529 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.194 5.350 3.550 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.127 3.971 3.376 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.284 4.236 0.880 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.462 5.510 1.130 1.00 0.00 H new ATOM 194 N LEU A 13 4.481 4.284 2.242 1.00 0.00 N ATOM 195 CA LEU A 13 3.476 3.713 1.360 1.00 0.00 C ATOM 196 C LEU A 13 2.404 4.737 1.038 1.00 0.00 C ATOM 197 O LEU A 13 2.042 4.922 -0.122 1.00 0.00 O ATOM 198 CB LEU A 13 2.837 2.466 1.977 1.00 0.00 C ATOM 199 CG LEU A 13 3.762 1.265 2.180 1.00 0.00 C ATOM 200 CD1 LEU A 13 2.978 0.084 2.721 1.00 0.00 C ATOM 201 CD2 LEU A 13 4.457 0.890 0.879 1.00 0.00 C ATOM 0 H LEU A 13 4.566 3.824 3.148 1.00 0.00 H new ATOM 0 HA LEU A 13 3.977 3.420 0.437 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.414 2.740 2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.007 2.156 1.342 1.00 0.00 H new ATOM 0 HG LEU A 13 4.527 1.541 2.906 1.00 0.00 H new ATOM 0 HD11 LEU A 13 3.648 -0.764 2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.528 0.353 3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 13 2.193 -0.186 2.014 1.00 0.00 H new ATOM 0 HD21 LEU A 13 5.109 0.033 1.049 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.710 0.634 0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.050 1.734 0.527 1.00 0.00 H new ATOM 213 N VAL A 14 1.922 5.420 2.067 1.00 0.00 N ATOM 214 CA VAL A 14 0.875 6.415 1.899 1.00 0.00 C ATOM 215 C VAL A 14 1.324 7.517 0.945 1.00 0.00 C ATOM 216 O VAL A 14 0.596 7.889 0.024 1.00 0.00 O ATOM 217 CB VAL A 14 0.474 7.049 3.253 1.00 0.00 C ATOM 218 CG1 VAL A 14 -0.696 8.008 3.077 1.00 0.00 C ATOM 219 CG2 VAL A 14 0.138 5.972 4.273 1.00 0.00 C ATOM 0 H VAL A 14 2.241 5.302 3.029 1.00 0.00 H new ATOM 0 HA VAL A 14 0.009 5.902 1.481 1.00 0.00 H new ATOM 0 HB VAL A 14 1.326 7.618 3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -0.960 8.441 4.042 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.414 8.803 2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -1.553 7.467 2.676 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.141 6.440 5.217 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.694 5.370 3.906 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.008 5.333 4.427 1.00 0.00 H new ATOM 229 N GLN A 15 2.537 8.008 1.152 1.00 0.00 N ATOM 230 CA GLN A 15 3.086 9.072 0.324 1.00 0.00 C ATOM 231 C GLN A 15 3.345 8.594 -1.101 1.00 0.00 C ATOM 232 O GLN A 15 3.085 9.321 -2.066 1.00 0.00 O ATOM 233 CB GLN A 15 4.371 9.620 0.935 1.00 0.00 C ATOM 234 CG GLN A 15 4.188 10.210 2.323 1.00 0.00 C ATOM 235 CD GLN A 15 3.153 11.313 2.359 1.00 0.00 C ATOM 236 OE1 GLN A 15 1.971 11.066 2.596 1.00 0.00 O ATOM 237 NE2 GLN A 15 3.585 12.529 2.122 1.00 0.00 N ATOM 0 H GLN A 15 3.163 7.685 1.890 1.00 0.00 H new ATOM 0 HA GLN A 15 2.345 9.870 0.283 1.00 0.00 H new ATOM 0 HB2 GLN A 15 5.109 8.819 0.985 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.778 10.387 0.275 1.00 0.00 H new ATOM 0 HG2 GLN A 15 3.894 9.419 3.013 1.00 0.00 H new ATOM 0 HG3 GLN A 15 5.142 10.602 2.675 1.00 0.00 H new ATOM 0 HE21 GLN A 15 4.574 12.691 1.930 1.00 0.00 H new ATOM 0 HE22 GLN A 15 2.932 13.313 2.130 1.00 0.00 H new ATOM 246 N ALA A 16 3.849 7.371 -1.228 1.00 0.00 N ATOM 247 CA ALA A 16 4.147 6.792 -2.532 1.00 0.00 C ATOM 248 C ALA A 16 2.888 6.682 -3.381 1.00 0.00 C ATOM 249 O ALA A 16 2.909 6.953 -4.580 1.00 0.00 O ATOM 250 CB ALA A 16 4.805 5.432 -2.372 1.00 0.00 C ATOM 0 H ALA A 16 4.060 6.760 -0.439 1.00 0.00 H new ATOM 0 HA ALA A 16 4.843 7.455 -3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.021 5.014 -3.355 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.734 5.541 -1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.133 4.764 -1.833 1.00 0.00 H new ATOM 256 N PHE A 17 1.790 6.294 -2.754 1.00 0.00 N ATOM 257 CA PHE A 17 0.520 6.197 -3.450 1.00 0.00 C ATOM 258 C PHE A 17 0.015 7.569 -3.866 1.00 0.00 C ATOM 259 O PHE A 17 -0.581 7.719 -4.927 1.00 0.00 O ATOM 260 CB PHE A 17 -0.522 5.453 -2.624 1.00 0.00 C ATOM 261 CG PHE A 17 -0.340 3.961 -2.648 1.00 0.00 C ATOM 262 CD1 PHE A 17 0.079 3.280 -1.524 1.00 0.00 C ATOM 263 CD2 PHE A 17 -0.588 3.242 -3.805 1.00 0.00 C ATOM 264 CE1 PHE A 17 0.246 1.913 -1.545 1.00 0.00 C ATOM 265 CE2 PHE A 17 -0.423 1.872 -3.835 1.00 0.00 C ATOM 266 CZ PHE A 17 -0.006 1.207 -2.702 1.00 0.00 C ATOM 0 H PHE A 17 1.753 6.042 -1.766 1.00 0.00 H new ATOM 0 HA PHE A 17 0.691 5.615 -4.355 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.476 5.802 -1.592 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.516 5.698 -2.999 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.279 3.827 -0.614 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.915 3.760 -4.695 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.574 1.395 -0.656 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -0.620 1.323 -4.744 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.123 0.135 -2.721 1.00 0.00 H new ATOM 276 N GLN A 18 0.241 8.568 -3.023 1.00 0.00 N ATOM 277 CA GLN A 18 -0.166 9.929 -3.339 1.00 0.00 C ATOM 278 C GLN A 18 0.542 10.427 -4.596 1.00 0.00 C ATOM 279 O GLN A 18 -0.080 11.037 -5.463 1.00 0.00 O ATOM 280 CB GLN A 18 0.109 10.867 -2.169 1.00 0.00 C ATOM 281 CG GLN A 18 -0.667 10.520 -0.912 1.00 0.00 C ATOM 282 CD GLN A 18 -2.166 10.468 -1.141 1.00 0.00 C ATOM 283 OE1 GLN A 18 -2.709 11.188 -1.987 1.00 0.00 O ATOM 284 NE2 GLN A 18 -2.842 9.618 -0.394 1.00 0.00 N ATOM 0 H GLN A 18 0.702 8.462 -2.119 1.00 0.00 H new ATOM 0 HA GLN A 18 -1.240 9.922 -3.526 1.00 0.00 H new ATOM 0 HB2 GLN A 18 1.175 10.849 -1.943 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -0.137 11.886 -2.467 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -0.328 9.555 -0.536 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -0.448 11.257 -0.140 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -2.354 9.042 0.292 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -3.853 9.536 -0.502 1.00 0.00 H new ATOM 293 N ARG A 19 1.842 10.146 -4.707 1.00 0.00 N ATOM 294 CA ARG A 19 2.588 10.540 -5.897 1.00 0.00 C ATOM 295 C ARG A 19 2.116 9.717 -7.095 1.00 0.00 C ATOM 296 O ARG A 19 2.108 10.190 -8.230 1.00 0.00 O ATOM 297 CB ARG A 19 4.118 10.434 -5.698 1.00 0.00 C ATOM 298 CG ARG A 19 4.718 9.049 -5.907 1.00 0.00 C ATOM 299 CD ARG A 19 6.237 9.105 -5.828 1.00 0.00 C ATOM 300 NE ARG A 19 6.876 7.861 -6.275 1.00 0.00 N ATOM 301 CZ ARG A 19 7.464 7.708 -7.471 1.00 0.00 C ATOM 302 NH1 ARG A 19 7.411 8.689 -8.373 1.00 0.00 N ATOM 303 NH2 ARG A 19 8.097 6.578 -7.768 1.00 0.00 N ATOM 0 H ARG A 19 2.389 9.656 -4.000 1.00 0.00 H new ATOM 0 HA ARG A 19 2.385 11.593 -6.090 1.00 0.00 H new ATOM 0 HB2 ARG A 19 4.604 11.127 -6.384 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.358 10.765 -4.688 1.00 0.00 H new ATOM 0 HG2 ARG A 19 4.334 8.363 -5.152 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.413 8.658 -6.878 1.00 0.00 H new ATOM 0 HD2 ARG A 19 6.598 9.933 -6.438 1.00 0.00 H new ATOM 0 HD3 ARG A 19 6.535 9.313 -4.800 1.00 0.00 H new ATOM 0 HE ARG A 19 6.873 7.065 -5.637 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.923 9.557 -8.154 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.859 8.571 -9.282 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.138 5.821 -7.085 1.00 0.00 H new ATOM 0 HH22 ARG A 19 8.542 6.467 -8.679 1.00 0.00 H new ATOM 317 N LEU A 20 1.731 8.471 -6.825 1.00 0.00 N ATOM 318 CA LEU A 20 1.180 7.589 -7.844 1.00 0.00 C ATOM 319 C LEU A 20 -0.108 8.197 -8.405 1.00 0.00 C ATOM 320 O LEU A 20 -0.367 8.134 -9.606 1.00 0.00 O ATOM 321 CB LEU A 20 0.889 6.210 -7.244 1.00 0.00 C ATOM 322 CG LEU A 20 0.392 5.143 -8.218 1.00 0.00 C ATOM 323 CD1 LEU A 20 1.506 4.710 -9.154 1.00 0.00 C ATOM 324 CD2 LEU A 20 -0.170 3.952 -7.461 1.00 0.00 C ATOM 0 H LEU A 20 1.793 8.049 -5.898 1.00 0.00 H new ATOM 0 HA LEU A 20 1.905 7.475 -8.650 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.799 5.844 -6.769 1.00 0.00 H new ATOM 0 HB3 LEU A 20 0.145 6.329 -6.457 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.408 5.573 -8.821 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.131 3.950 -9.839 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.858 5.570 -9.724 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.331 4.299 -8.572 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.519 3.202 -8.170 1.00 0.00 H new ATOM 0 HD22 LEU A 20 0.608 3.521 -6.831 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.003 4.277 -6.837 1.00 0.00 H new ATOM 336 N ARG A 21 -0.907 8.794 -7.512 1.00 0.00 N ATOM 337 CA ARG A 21 -2.147 9.465 -7.897 1.00 0.00 C ATOM 338 C ARG A 21 -1.865 10.590 -8.882 1.00 0.00 C ATOM 339 O ARG A 21 -2.621 10.803 -9.825 1.00 0.00 O ATOM 340 CB ARG A 21 -2.872 10.016 -6.671 1.00 0.00 C ATOM 341 CG ARG A 21 -3.479 8.944 -5.786 1.00 0.00 C ATOM 342 CD ARG A 21 -4.211 9.550 -4.606 1.00 0.00 C ATOM 343 NE ARG A 21 -5.296 10.443 -5.028 1.00 0.00 N ATOM 344 CZ ARG A 21 -6.205 10.988 -4.204 1.00 0.00 C ATOM 345 NH1 ARG A 21 -6.195 10.714 -2.903 1.00 0.00 N ATOM 346 NH2 ARG A 21 -7.131 11.803 -4.693 1.00 0.00 N ATOM 0 H ARG A 21 -0.711 8.824 -6.511 1.00 0.00 H new ATOM 0 HA ARG A 21 -2.790 8.728 -8.379 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -2.171 10.607 -6.081 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -3.661 10.692 -7.000 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.169 8.335 -6.370 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -2.694 8.279 -5.426 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -4.619 8.753 -3.985 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -3.505 10.105 -3.988 1.00 0.00 H new ATOM 0 HE ARG A 21 -5.365 10.666 -6.021 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -5.491 10.083 -2.520 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -6.891 11.135 -2.288 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -7.150 12.013 -5.691 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -7.824 12.219 -4.071 1.00 0.00 H new ATOM 360 N GLU A 22 -0.764 11.296 -8.657 1.00 0.00 N ATOM 361 CA GLU A 22 -0.345 12.383 -9.522 1.00 0.00 C ATOM 362 C GLU A 22 -0.102 11.865 -10.943 1.00 0.00 C ATOM 363 O GLU A 22 -0.529 12.476 -11.926 1.00 0.00 O ATOM 364 CB GLU A 22 0.933 12.996 -8.962 1.00 0.00 C ATOM 365 CG GLU A 22 0.872 14.491 -8.767 1.00 0.00 C ATOM 366 CD GLU A 22 0.770 15.240 -10.070 1.00 0.00 C ATOM 367 OE1 GLU A 22 1.810 15.419 -10.741 1.00 0.00 O ATOM 368 OE2 GLU A 22 -0.343 15.651 -10.435 1.00 0.00 O1- ATOM 0 H GLU A 22 -0.139 11.128 -7.869 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.128 13.140 -9.562 1.00 0.00 H new ATOM 0 HB2 GLU A 22 1.158 12.526 -8.005 1.00 0.00 H new ATOM 0 HB3 GLU A 22 1.759 12.763 -9.634 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.014 14.738 -8.142 1.00 0.00 H new ATOM 0 HG3 GLU A 22 1.762 14.821 -8.231 1.00 0.00 H new ATOM 375 N ILE A 23 0.585 10.740 -11.039 1.00 0.00 N ATOM 376 CA ILE A 23 0.861 10.110 -12.323 1.00 0.00 C ATOM 377 C ILE A 23 -0.431 9.579 -12.944 1.00 0.00 C ATOM 378 O ILE A 23 -0.662 9.715 -14.152 1.00 0.00 O ATOM 379 CB ILE A 23 1.876 8.960 -12.166 1.00 0.00 C ATOM 380 CG1 ILE A 23 3.176 9.496 -11.564 1.00 0.00 C ATOM 381 CG2 ILE A 23 2.142 8.290 -13.510 1.00 0.00 C ATOM 382 CD1 ILE A 23 4.191 8.427 -11.254 1.00 0.00 C ATOM 0 H ILE A 23 0.966 10.239 -10.237 1.00 0.00 H new ATOM 0 HA ILE A 23 1.291 10.864 -12.982 1.00 0.00 H new ATOM 0 HB ILE A 23 1.458 8.211 -11.494 1.00 0.00 H new ATOM 0 HG12 ILE A 23 3.617 10.213 -12.257 1.00 0.00 H new ATOM 0 HG13 ILE A 23 2.944 10.040 -10.648 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.861 7.481 -13.377 1.00 0.00 H new ATOM 0 HG22 ILE A 23 1.210 7.886 -13.906 1.00 0.00 H new ATOM 0 HG23 ILE A 23 2.545 9.023 -14.209 1.00 0.00 H new ATOM 0 HD11 ILE A 23 5.085 8.886 -10.831 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.770 7.723 -10.537 1.00 0.00 H new ATOM 0 HD13 ILE A 23 4.454 7.898 -12.170 1.00 0.00 H new ATOM 394 N PHE A 24 -1.273 8.991 -12.104 1.00 0.00 N ATOM 395 CA PHE A 24 -2.560 8.456 -12.530 1.00 0.00 C ATOM 396 C PHE A 24 -3.432 9.563 -13.110 1.00 0.00 C ATOM 397 O PHE A 24 -4.128 9.359 -14.101 1.00 0.00 O ATOM 398 CB PHE A 24 -3.275 7.778 -11.352 1.00 0.00 C ATOM 399 CG PHE A 24 -4.617 7.196 -11.707 1.00 0.00 C ATOM 400 CD1 PHE A 24 -4.710 5.959 -12.321 1.00 0.00 C ATOM 401 CD2 PHE A 24 -5.785 7.890 -11.427 1.00 0.00 C ATOM 402 CE1 PHE A 24 -5.939 5.425 -12.651 1.00 0.00 C ATOM 403 CE2 PHE A 24 -7.017 7.361 -11.755 1.00 0.00 C ATOM 404 CZ PHE A 24 -7.095 6.127 -12.367 1.00 0.00 C ATOM 0 H PHE A 24 -1.083 8.871 -11.109 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.383 7.711 -13.306 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.638 6.985 -10.961 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.406 8.506 -10.551 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.810 5.405 -12.544 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.730 8.856 -10.947 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -5.997 4.459 -13.131 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.919 7.912 -11.533 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.058 5.710 -12.624 1.00 0.00 H new ATOM 414 N ASP A 25 -3.366 10.737 -12.495 1.00 0.00 N ATOM 415 CA ASP A 25 -4.147 11.900 -12.924 1.00 0.00 C ATOM 416 C ASP A 25 -3.790 12.308 -14.348 1.00 0.00 C ATOM 417 O ASP A 25 -4.646 12.754 -15.108 1.00 0.00 O ATOM 418 CB ASP A 25 -3.899 13.075 -11.971 1.00 0.00 C ATOM 419 CG ASP A 25 -4.555 14.361 -12.433 1.00 0.00 C ATOM 420 OD1 ASP A 25 -5.751 14.563 -12.140 1.00 0.00 O ATOM 421 OD2 ASP A 25 -3.869 15.183 -13.086 1.00 0.00 O1- ATOM 0 H ASP A 25 -2.772 10.914 -11.685 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.202 11.627 -12.901 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.274 12.818 -10.980 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.825 13.236 -11.873 1.00 0.00 H new ATOM 426 N LYS A 26 -2.530 12.133 -14.710 1.00 0.00 N ATOM 427 CA LYS A 26 -2.067 12.481 -16.048 1.00 0.00 C ATOM 428 C LYS A 26 -2.334 11.347 -17.033 1.00 0.00 C ATOM 429 O LYS A 26 -2.133 11.495 -18.239 1.00 0.00 O ATOM 430 CB LYS A 26 -0.573 12.861 -16.036 1.00 0.00 C ATOM 431 CG LYS A 26 -0.299 14.310 -15.612 1.00 0.00 C ATOM 432 CD LYS A 26 -0.872 14.616 -14.237 1.00 0.00 C ATOM 433 CE LYS A 26 -0.795 16.095 -13.905 1.00 0.00 C ATOM 434 NZ LYS A 26 -1.505 16.404 -12.639 1.00 0.00 N ATOM 0 H LYS A 26 -1.808 11.752 -14.098 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.632 13.352 -16.380 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.044 12.190 -15.360 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.160 12.701 -17.032 1.00 0.00 H new ATOM 0 HG2 LYS A 26 0.776 14.489 -15.605 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.731 14.991 -16.345 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.911 14.289 -14.196 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.329 14.046 -13.483 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.249 16.397 -13.821 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.230 16.675 -14.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.879 17.374 -12.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.290 15.735 -12.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.844 16.321 -11.841 1.00 0.00 H new ATOM 448 N GLY A 27 -2.781 10.213 -16.507 1.00 0.00 N ATOM 449 CA GLY A 27 -3.121 9.078 -17.345 1.00 0.00 C ATOM 450 C GLY A 27 -1.914 8.434 -17.988 1.00 0.00 C ATOM 451 O GLY A 27 -2.017 7.845 -19.063 1.00 0.00 O ATOM 0 H GLY A 27 -2.915 10.059 -15.508 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.646 8.335 -16.745 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.811 9.403 -18.124 1.00 0.00 H new ATOM 455 N ASP A 28 -0.766 8.549 -17.347 1.00 0.00 N ATOM 456 CA ASP A 28 0.447 7.968 -17.890 1.00 0.00 C ATOM 457 C ASP A 28 0.596 6.534 -17.416 1.00 0.00 C ATOM 458 O ASP A 28 1.132 6.276 -16.339 1.00 0.00 O ATOM 459 CB ASP A 28 1.675 8.789 -17.501 1.00 0.00 C ATOM 460 CG ASP A 28 2.873 8.468 -18.369 1.00 0.00 C ATOM 461 OD1 ASP A 28 3.489 7.404 -18.176 1.00 0.00 O ATOM 462 OD2 ASP A 28 3.200 9.286 -19.254 1.00 0.00 O1- ATOM 0 H ASP A 28 -0.648 9.035 -16.458 1.00 0.00 H new ATOM 0 HA ASP A 28 0.371 7.976 -18.977 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.442 9.851 -17.584 1.00 0.00 H new ATOM 0 HB3 ASP A 28 1.923 8.598 -16.457 1.00 0.00 H new ATOM 467 N ASP A 29 0.088 5.610 -18.217 1.00 0.00 N ATOM 468 CA ASP A 29 0.102 4.184 -17.888 1.00 0.00 C ATOM 469 C ASP A 29 1.520 3.660 -17.734 1.00 0.00 C ATOM 470 O ASP A 29 1.799 2.856 -16.845 1.00 0.00 O ATOM 471 CB ASP A 29 -0.615 3.373 -18.972 1.00 0.00 C ATOM 472 CG ASP A 29 -2.053 3.794 -19.183 1.00 0.00 C ATOM 473 OD1 ASP A 29 -2.951 3.229 -18.517 1.00 0.00 O ATOM 474 OD2 ASP A 29 -2.294 4.685 -20.030 1.00 0.00 O1- ATOM 0 H ASP A 29 -0.347 5.823 -19.115 1.00 0.00 H new ATOM 0 HA ASP A 29 -0.419 4.069 -16.937 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -0.072 3.476 -19.912 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -0.589 2.317 -18.703 1.00 0.00 H new ATOM 479 N ASP A 30 2.413 4.129 -18.596 1.00 0.00 N ATOM 480 CA ASP A 30 3.803 3.673 -18.593 1.00 0.00 C ATOM 481 C ASP A 30 4.479 3.970 -17.269 1.00 0.00 C ATOM 482 O ASP A 30 5.051 3.081 -16.643 1.00 0.00 O ATOM 483 CB ASP A 30 4.591 4.326 -19.733 1.00 0.00 C ATOM 484 CG ASP A 30 4.168 3.831 -21.096 1.00 0.00 C ATOM 485 OD1 ASP A 30 4.846 2.938 -21.649 1.00 0.00 O ATOM 486 OD2 ASP A 30 3.151 4.335 -21.629 1.00 0.00 O1- ATOM 0 H ASP A 30 2.202 4.827 -19.309 1.00 0.00 H new ATOM 0 HA ASP A 30 3.791 2.593 -18.740 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.459 5.407 -19.687 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.654 4.128 -19.594 1.00 0.00 H new ATOM 491 N SER A 31 4.386 5.210 -16.829 1.00 0.00 N ATOM 492 CA SER A 31 4.991 5.615 -15.576 1.00 0.00 C ATOM 493 C SER A 31 4.246 5.002 -14.402 1.00 0.00 C ATOM 494 O SER A 31 4.845 4.659 -13.385 1.00 0.00 O ATOM 495 CB SER A 31 5.000 7.135 -15.461 1.00 0.00 C ATOM 496 OG SER A 31 5.580 7.724 -16.616 1.00 0.00 O ATOM 0 H SER A 31 3.896 5.956 -17.323 1.00 0.00 H new ATOM 0 HA SER A 31 6.020 5.256 -15.557 1.00 0.00 H new ATOM 0 HB2 SER A 31 3.981 7.501 -15.333 1.00 0.00 H new ATOM 0 HB3 SER A 31 5.560 7.434 -14.575 1.00 0.00 H new ATOM 0 HG SER A 31 4.994 7.576 -17.388 1.00 0.00 H new ATOM 502 N LEU A 32 2.937 4.843 -14.566 1.00 0.00 N ATOM 503 CA LEU A 32 2.093 4.288 -13.523 1.00 0.00 C ATOM 504 C LEU A 32 2.527 2.862 -13.193 1.00 0.00 C ATOM 505 O LEU A 32 2.706 2.518 -12.029 1.00 0.00 O ATOM 506 CB LEU A 32 0.631 4.293 -13.989 1.00 0.00 C ATOM 507 CG LEU A 32 -0.421 3.948 -12.935 1.00 0.00 C ATOM 508 CD1 LEU A 32 -0.550 5.071 -11.922 1.00 0.00 C ATOM 509 CD2 LEU A 32 -1.759 3.671 -13.596 1.00 0.00 C ATOM 0 H LEU A 32 2.438 5.094 -15.419 1.00 0.00 H new ATOM 0 HA LEU A 32 2.190 4.899 -12.626 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.403 5.282 -14.388 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.533 3.586 -14.813 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.101 3.048 -12.409 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.304 4.807 -11.180 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.408 5.226 -11.427 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.848 5.988 -12.431 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.498 3.427 -12.833 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.083 4.555 -14.146 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.658 2.832 -14.285 1.00 0.00 H new ATOM 521 N GLU A 33 2.732 2.053 -14.230 1.00 0.00 N ATOM 522 CA GLU A 33 3.144 0.672 -14.057 1.00 0.00 C ATOM 523 C GLU A 33 4.543 0.588 -13.446 1.00 0.00 C ATOM 524 O GLU A 33 4.803 -0.244 -12.572 1.00 0.00 O ATOM 525 CB GLU A 33 3.101 -0.062 -15.393 1.00 0.00 C ATOM 526 CG GLU A 33 3.330 -1.553 -15.272 1.00 0.00 C ATOM 527 CD GLU A 33 2.301 -2.226 -14.384 1.00 0.00 C ATOM 528 OE1 GLU A 33 2.570 -2.397 -13.178 1.00 0.00 O ATOM 529 OE2 GLU A 33 1.216 -2.579 -14.890 1.00 0.00 O1- ATOM 0 H GLU A 33 2.617 2.337 -15.203 1.00 0.00 H new ATOM 0 HA GLU A 33 2.448 0.193 -13.369 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.133 0.112 -15.863 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.857 0.361 -16.055 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.300 -2.004 -16.264 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.327 -1.733 -14.869 1.00 0.00 H new ATOM 536 N GLN A 34 5.440 1.460 -13.901 1.00 0.00 N ATOM 537 CA GLN A 34 6.802 1.483 -13.381 1.00 0.00 C ATOM 538 C GLN A 34 6.795 1.770 -11.889 1.00 0.00 C ATOM 539 O GLN A 34 7.519 1.137 -11.120 1.00 0.00 O ATOM 540 CB GLN A 34 7.660 2.517 -14.115 1.00 0.00 C ATOM 541 CG GLN A 34 7.796 2.259 -15.608 1.00 0.00 C ATOM 542 CD GLN A 34 8.336 0.876 -15.927 1.00 0.00 C ATOM 543 OE1 GLN A 34 9.110 0.300 -15.159 1.00 0.00 O ATOM 544 NE2 GLN A 34 7.932 0.335 -17.062 1.00 0.00 N ATOM 0 H GLN A 34 5.249 2.154 -14.623 1.00 0.00 H new ATOM 0 HA GLN A 34 7.241 0.500 -13.550 1.00 0.00 H new ATOM 0 HB2 GLN A 34 7.227 3.506 -13.965 1.00 0.00 H new ATOM 0 HB3 GLN A 34 8.654 2.533 -13.667 1.00 0.00 H new ATOM 0 HG2 GLN A 34 6.822 2.380 -16.082 1.00 0.00 H new ATOM 0 HG3 GLN A 34 8.457 3.009 -16.042 1.00 0.00 H new ATOM 0 HE21 GLN A 34 7.291 0.844 -17.670 1.00 0.00 H new ATOM 0 HE22 GLN A 34 8.261 -0.592 -17.331 1.00 0.00 H new ATOM 553 N VAL A 35 5.967 2.719 -11.479 1.00 0.00 N ATOM 554 CA VAL A 35 5.841 3.049 -10.075 1.00 0.00 C ATOM 555 C VAL A 35 5.144 1.922 -9.318 1.00 0.00 C ATOM 556 O VAL A 35 5.476 1.646 -8.178 1.00 0.00 O ATOM 557 CB VAL A 35 5.109 4.392 -9.851 1.00 0.00 C ATOM 558 CG1 VAL A 35 4.984 4.703 -8.363 1.00 0.00 C ATOM 559 CG2 VAL A 35 5.854 5.509 -10.557 1.00 0.00 C ATOM 0 H VAL A 35 5.375 3.271 -12.100 1.00 0.00 H new ATOM 0 HA VAL A 35 6.851 3.166 -9.681 1.00 0.00 H new ATOM 0 HB VAL A 35 4.105 4.311 -10.267 1.00 0.00 H new ATOM 0 HG11 VAL A 35 4.465 5.653 -8.232 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.419 3.911 -7.872 1.00 0.00 H new ATOM 0 HG13 VAL A 35 5.978 4.768 -7.920 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.333 6.453 -10.395 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.866 5.580 -10.158 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.899 5.298 -11.625 1.00 0.00 H new ATOM 569 N LEU A 36 4.186 1.257 -9.971 1.00 0.00 N ATOM 570 CA LEU A 36 3.490 0.126 -9.353 1.00 0.00 C ATOM 571 C LEU A 36 4.477 -0.974 -9.000 1.00 0.00 C ATOM 572 O LEU A 36 4.347 -1.624 -7.967 1.00 0.00 O ATOM 573 CB LEU A 36 2.398 -0.431 -10.274 1.00 0.00 C ATOM 574 CG LEU A 36 1.168 0.454 -10.469 1.00 0.00 C ATOM 575 CD1 LEU A 36 0.194 -0.198 -11.436 1.00 0.00 C ATOM 576 CD2 LEU A 36 0.490 0.726 -9.135 1.00 0.00 C ATOM 0 H LEU A 36 3.878 1.480 -10.917 1.00 0.00 H new ATOM 0 HA LEU A 36 3.014 0.489 -8.442 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.840 -0.625 -11.251 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.070 -1.391 -9.876 1.00 0.00 H new ATOM 0 HG LEU A 36 1.491 1.405 -10.891 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.677 0.445 -11.564 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.682 -0.345 -12.400 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.122 -1.162 -11.039 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.384 1.358 -9.293 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.179 -0.217 -8.686 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.188 1.233 -8.469 1.00 0.00 H new ATOM 588 N GLU A 37 5.473 -1.168 -9.856 1.00 0.00 N ATOM 589 CA GLU A 37 6.519 -2.140 -9.590 1.00 0.00 C ATOM 590 C GLU A 37 7.291 -1.729 -8.343 1.00 0.00 C ATOM 591 O GLU A 37 7.583 -2.552 -7.480 1.00 0.00 O ATOM 592 CB GLU A 37 7.473 -2.246 -10.777 1.00 0.00 C ATOM 593 CG GLU A 37 8.611 -3.225 -10.552 1.00 0.00 C ATOM 594 CD GLU A 37 9.608 -3.229 -11.681 1.00 0.00 C ATOM 595 OE1 GLU A 37 9.346 -3.891 -12.708 1.00 0.00 O ATOM 596 OE2 GLU A 37 10.663 -2.578 -11.552 1.00 0.00 O1- ATOM 0 H GLU A 37 5.576 -0.665 -10.737 1.00 0.00 H new ATOM 0 HA GLU A 37 6.058 -3.115 -9.431 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.910 -2.551 -11.659 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.888 -1.261 -10.989 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.122 -2.974 -9.623 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.203 -4.228 -10.430 1.00 0.00 H new ATOM 603 N GLU A 38 7.596 -0.445 -8.255 1.00 0.00 N ATOM 604 CA GLU A 38 8.286 0.105 -7.136 1.00 0.00 C ATOM 605 C GLU A 38 7.444 -0.047 -5.873 1.00 0.00 C ATOM 606 O GLU A 38 7.957 -0.391 -4.810 1.00 0.00 O ATOM 607 CB GLU A 38 8.576 1.562 -7.416 1.00 0.00 C ATOM 608 CG GLU A 38 9.340 2.236 -6.337 1.00 0.00 C ATOM 609 CD GLU A 38 9.600 3.683 -6.645 1.00 0.00 C ATOM 610 OE1 GLU A 38 10.584 3.979 -7.351 1.00 0.00 O ATOM 611 OE2 GLU A 38 8.816 4.541 -6.196 1.00 0.00 O1- ATOM 0 H GLU A 38 7.362 0.239 -8.974 1.00 0.00 H new ATOM 0 HA GLU A 38 9.224 -0.426 -6.978 1.00 0.00 H new ATOM 0 HB2 GLU A 38 9.136 1.639 -8.348 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.634 2.089 -7.565 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.788 2.159 -5.400 1.00 0.00 H new ATOM 0 HG3 GLU A 38 10.289 1.721 -6.190 1.00 0.00 H new ATOM 618 N ILE A 39 6.146 0.202 -6.007 1.00 0.00 N ATOM 619 CA ILE A 39 5.210 0.029 -4.908 1.00 0.00 C ATOM 620 C ILE A 39 5.240 -1.417 -4.448 1.00 0.00 C ATOM 621 O ILE A 39 5.232 -1.702 -3.256 1.00 0.00 O ATOM 622 CB ILE A 39 3.759 0.389 -5.330 1.00 0.00 C ATOM 623 CG1 ILE A 39 3.649 1.865 -5.739 1.00 0.00 C ATOM 624 CG2 ILE A 39 2.775 0.068 -4.215 1.00 0.00 C ATOM 625 CD1 ILE A 39 4.010 2.841 -4.642 1.00 0.00 C ATOM 0 H ILE A 39 5.718 0.527 -6.874 1.00 0.00 H new ATOM 0 HA ILE A 39 5.511 0.699 -4.102 1.00 0.00 H new ATOM 0 HB ILE A 39 3.506 -0.220 -6.198 1.00 0.00 H new ATOM 0 HG12 ILE A 39 4.299 2.042 -6.596 1.00 0.00 H new ATOM 0 HG13 ILE A 39 2.629 2.065 -6.066 1.00 0.00 H new ATOM 0 HG21 ILE A 39 1.766 0.329 -4.534 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.819 -0.997 -3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 39 3.034 0.642 -3.325 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.906 3.861 -5.013 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.344 2.695 -3.791 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.040 2.672 -4.329 1.00 0.00 H new ATOM 637 N GLU A 40 5.311 -2.319 -5.413 1.00 0.00 N ATOM 638 CA GLU A 40 5.354 -3.742 -5.145 1.00 0.00 C ATOM 639 C GLU A 40 6.600 -4.077 -4.324 1.00 0.00 C ATOM 640 O GLU A 40 6.544 -4.874 -3.385 1.00 0.00 O ATOM 641 CB GLU A 40 5.344 -4.511 -6.469 1.00 0.00 C ATOM 642 CG GLU A 40 5.198 -6.012 -6.333 1.00 0.00 C ATOM 643 CD GLU A 40 5.109 -6.694 -7.679 1.00 0.00 C ATOM 644 OE1 GLU A 40 3.980 -6.900 -8.175 1.00 0.00 O ATOM 645 OE2 GLU A 40 6.168 -7.021 -8.256 1.00 0.00 O1- ATOM 0 H GLU A 40 5.340 -2.082 -6.405 1.00 0.00 H new ATOM 0 HA GLU A 40 4.477 -4.036 -4.568 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.527 -4.135 -7.084 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.270 -4.297 -7.003 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.048 -6.411 -5.780 1.00 0.00 H new ATOM 0 HG3 GLU A 40 4.304 -6.239 -5.751 1.00 0.00 H new ATOM 652 N GLU A 41 7.715 -3.439 -4.674 1.00 0.00 N ATOM 653 CA GLU A 41 8.961 -3.610 -3.954 1.00 0.00 C ATOM 654 C GLU A 41 8.838 -3.041 -2.543 1.00 0.00 C ATOM 655 O GLU A 41 9.314 -3.640 -1.575 1.00 0.00 O ATOM 656 CB GLU A 41 10.094 -2.909 -4.693 1.00 0.00 C ATOM 657 CG GLU A 41 10.280 -3.371 -6.124 1.00 0.00 C ATOM 658 CD GLU A 41 11.446 -2.693 -6.797 1.00 0.00 C ATOM 659 OE1 GLU A 41 12.554 -3.259 -6.773 1.00 0.00 O ATOM 660 OE2 GLU A 41 11.270 -1.586 -7.344 1.00 0.00 O1- ATOM 0 H GLU A 41 7.773 -2.794 -5.462 1.00 0.00 H new ATOM 0 HA GLU A 41 9.181 -4.676 -3.890 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.905 -1.836 -4.691 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.024 -3.070 -4.147 1.00 0.00 H new ATOM 0 HG2 GLU A 41 10.433 -4.450 -6.138 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.370 -3.170 -6.689 1.00 0.00 H new ATOM 667 N LEU A 42 8.200 -1.879 -2.435 1.00 0.00 N ATOM 668 CA LEU A 42 7.982 -1.235 -1.145 1.00 0.00 C ATOM 669 C LEU A 42 7.127 -2.120 -0.250 1.00 0.00 C ATOM 670 O LEU A 42 7.374 -2.227 0.954 1.00 0.00 O ATOM 671 CB LEU A 42 7.323 0.137 -1.320 1.00 0.00 C ATOM 672 CG LEU A 42 8.109 1.155 -2.150 1.00 0.00 C ATOM 673 CD1 LEU A 42 7.359 2.474 -2.228 1.00 0.00 C ATOM 674 CD2 LEU A 42 9.502 1.365 -1.571 1.00 0.00 C ATOM 0 H LEU A 42 7.824 -1.363 -3.230 1.00 0.00 H new ATOM 0 HA LEU A 42 8.953 -1.088 -0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.348 -0.007 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 42 7.146 0.562 -0.332 1.00 0.00 H new ATOM 0 HG LEU A 42 8.216 0.760 -3.160 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.934 3.185 -2.822 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.387 2.313 -2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.217 2.872 -1.223 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.042 2.092 -2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.419 1.734 -0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.043 0.419 -1.572 1.00 0.00 H new ATOM 686 N ILE A 43 6.125 -2.758 -0.849 1.00 0.00 N ATOM 687 CA ILE A 43 5.254 -3.671 -0.124 1.00 0.00 C ATOM 688 C ILE A 43 6.067 -4.820 0.464 1.00 0.00 C ATOM 689 O ILE A 43 5.854 -5.215 1.604 1.00 0.00 O ATOM 690 CB ILE A 43 4.129 -4.243 -1.033 1.00 0.00 C ATOM 691 CG1 ILE A 43 3.213 -3.114 -1.523 1.00 0.00 C ATOM 692 CG2 ILE A 43 3.318 -5.305 -0.292 1.00 0.00 C ATOM 693 CD1 ILE A 43 2.120 -3.574 -2.470 1.00 0.00 C ATOM 0 H ILE A 43 5.898 -2.657 -1.838 1.00 0.00 H new ATOM 0 HA ILE A 43 4.784 -3.103 0.679 1.00 0.00 H new ATOM 0 HB ILE A 43 4.596 -4.714 -1.898 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.753 -2.633 -0.660 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.819 -2.359 -2.024 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.537 -5.690 -0.948 1.00 0.00 H new ATOM 0 HG22 ILE A 43 3.975 -6.121 0.008 1.00 0.00 H new ATOM 0 HG23 ILE A 43 2.862 -4.862 0.594 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.516 -2.718 -2.771 1.00 0.00 H new ATOM 0 HD12 ILE A 43 2.571 -4.028 -3.352 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.488 -4.306 -1.968 1.00 0.00 H new ATOM 705 N GLN A 44 7.023 -5.329 -0.311 1.00 0.00 N ATOM 706 CA GLN A 44 7.887 -6.415 0.153 1.00 0.00 C ATOM 707 C GLN A 44 8.703 -5.965 1.360 1.00 0.00 C ATOM 708 O GLN A 44 8.885 -6.716 2.319 1.00 0.00 O ATOM 709 CB GLN A 44 8.824 -6.881 -0.967 1.00 0.00 C ATOM 710 CG GLN A 44 8.102 -7.369 -2.212 1.00 0.00 C ATOM 711 CD GLN A 44 7.166 -8.529 -1.932 1.00 0.00 C ATOM 712 OE1 GLN A 44 7.411 -9.346 -1.038 1.00 0.00 O ATOM 713 NE2 GLN A 44 6.085 -8.603 -2.681 1.00 0.00 N ATOM 0 H GLN A 44 7.219 -5.009 -1.259 1.00 0.00 H new ATOM 0 HA GLN A 44 7.253 -7.252 0.445 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.484 -6.058 -1.241 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.456 -7.684 -0.588 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.533 -6.545 -2.643 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.837 -7.673 -2.957 1.00 0.00 H new ATOM 0 HE21 GLN A 44 5.920 -7.908 -3.409 1.00 0.00 H new ATOM 0 HE22 GLN A 44 5.413 -9.356 -2.533 1.00 0.00 H new ATOM 722 N LYS A 45 9.175 -4.725 1.311 1.00 0.00 N ATOM 723 CA LYS A 45 9.947 -4.153 2.405 1.00 0.00 C ATOM 724 C LYS A 45 9.072 -3.999 3.648 1.00 0.00 C ATOM 725 O LYS A 45 9.488 -4.331 4.757 1.00 0.00 O ATOM 726 CB LYS A 45 10.545 -2.798 1.987 1.00 0.00 C ATOM 727 CG LYS A 45 11.374 -2.112 3.071 1.00 0.00 C ATOM 728 CD LYS A 45 12.218 -0.972 2.499 1.00 0.00 C ATOM 729 CE LYS A 45 11.363 0.152 1.917 1.00 0.00 C ATOM 730 NZ LYS A 45 10.690 0.953 2.971 1.00 0.00 N ATOM 0 H LYS A 45 9.035 -4.095 0.521 1.00 0.00 H new ATOM 0 HA LYS A 45 10.768 -4.829 2.646 1.00 0.00 H new ATOM 0 HB2 LYS A 45 11.172 -2.947 1.108 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.734 -2.132 1.691 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.712 -1.722 3.844 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.026 -2.844 3.549 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.858 -0.569 3.284 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.875 -1.364 1.722 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.990 0.806 1.312 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.611 -0.274 1.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.747 1.240 2.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.594 0.381 3.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.257 1.800 3.178 1.00 0.00 H new ATOM 744 N HIS A 46 7.851 -3.518 3.449 1.00 0.00 N ATOM 745 CA HIS A 46 6.914 -3.333 4.549 1.00 0.00 C ATOM 746 C HIS A 46 6.498 -4.689 5.115 1.00 0.00 C ATOM 747 O HIS A 46 6.367 -4.851 6.320 1.00 0.00 O ATOM 748 CB HIS A 46 5.676 -2.543 4.078 1.00 0.00 C ATOM 749 CG HIS A 46 4.757 -2.103 5.192 1.00 0.00 C ATOM 750 ND1 HIS A 46 4.567 -0.786 5.559 1.00 0.00 N ATOM 751 CD2 HIS A 46 3.963 -2.832 6.015 1.00 0.00 C ATOM 752 CE1 HIS A 46 3.690 -0.761 6.569 1.00 0.00 C ATOM 753 NE2 HIS A 46 3.291 -1.977 6.883 1.00 0.00 N ATOM 0 H HIS A 46 7.487 -3.249 2.535 1.00 0.00 H new ATOM 0 HA HIS A 46 7.406 -2.760 5.335 1.00 0.00 H new ATOM 0 HB2 HIS A 46 6.009 -1.662 3.529 1.00 0.00 H new ATOM 0 HB3 HIS A 46 5.111 -3.160 3.379 1.00 0.00 H new ATOM 0 HD2 HIS A 46 3.867 -3.908 5.999 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.353 0.139 7.063 1.00 0.00 H new ATOM 0 HE2 HIS A 46 2.627 -2.238 7.612 1.00 0.00 H new ATOM 761 N ARG A 47 6.322 -5.661 4.228 1.00 0.00 N ATOM 762 CA ARG A 47 5.918 -7.008 4.615 1.00 0.00 C ATOM 763 C ARG A 47 6.944 -7.626 5.558 1.00 0.00 C ATOM 764 O ARG A 47 6.586 -8.195 6.584 1.00 0.00 O ATOM 765 CB ARG A 47 5.775 -7.877 3.352 1.00 0.00 C ATOM 766 CG ARG A 47 5.494 -9.361 3.598 1.00 0.00 C ATOM 767 CD ARG A 47 4.047 -9.628 4.010 1.00 0.00 C ATOM 768 NE ARG A 47 3.752 -9.187 5.375 1.00 0.00 N ATOM 769 CZ ARG A 47 3.879 -9.967 6.457 1.00 0.00 C ATOM 770 NH1 ARG A 47 4.328 -11.212 6.339 1.00 0.00 N ATOM 771 NH2 ARG A 47 3.562 -9.501 7.658 1.00 0.00 N ATOM 0 H ARG A 47 6.455 -5.539 3.224 1.00 0.00 H new ATOM 0 HA ARG A 47 4.962 -6.956 5.136 1.00 0.00 H new ATOM 0 HB2 ARG A 47 4.969 -7.469 2.742 1.00 0.00 H new ATOM 0 HB3 ARG A 47 6.691 -7.791 2.768 1.00 0.00 H new ATOM 0 HG2 ARG A 47 5.719 -9.924 2.692 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.163 -9.729 4.376 1.00 0.00 H new ATOM 0 HD2 ARG A 47 3.377 -9.119 3.317 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.842 -10.695 3.926 1.00 0.00 H new ATOM 0 HE ARG A 47 3.431 -8.228 5.510 1.00 0.00 H new ATOM 0 HH11 ARG A 47 4.578 -11.579 5.421 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.422 -11.801 7.167 1.00 0.00 H new ATOM 0 HH21 ARG A 47 3.220 -8.545 7.760 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.660 -10.098 8.479 1.00 0.00 H new ATOM 785 N GLN A 48 8.214 -7.473 5.228 1.00 0.00 N ATOM 786 CA GLN A 48 9.281 -8.025 6.047 1.00 0.00 C ATOM 787 C GLN A 48 9.413 -7.285 7.375 1.00 0.00 C ATOM 788 O GLN A 48 9.525 -7.905 8.426 1.00 0.00 O ATOM 789 CB GLN A 48 10.606 -8.004 5.289 1.00 0.00 C ATOM 790 CG GLN A 48 10.648 -8.955 4.102 1.00 0.00 C ATOM 791 CD GLN A 48 10.445 -10.403 4.510 1.00 0.00 C ATOM 792 OE1 GLN A 48 9.321 -10.906 4.532 1.00 0.00 O ATOM 793 NE2 GLN A 48 11.528 -11.080 4.836 1.00 0.00 N ATOM 0 H GLN A 48 8.533 -6.971 4.399 1.00 0.00 H new ATOM 0 HA GLN A 48 9.021 -9.060 6.270 1.00 0.00 H new ATOM 0 HB2 GLN A 48 10.797 -6.990 4.938 1.00 0.00 H new ATOM 0 HB3 GLN A 48 11.412 -8.260 5.977 1.00 0.00 H new ATOM 0 HG2 GLN A 48 9.877 -8.671 3.386 1.00 0.00 H new ATOM 0 HG3 GLN A 48 11.607 -8.855 3.594 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.441 -10.627 4.805 1.00 0.00 H new ATOM 0 HE22 GLN A 48 11.453 -12.057 5.119 1.00 0.00 H new ATOM 802 N LEU A 49 9.370 -5.962 7.325 1.00 0.00 N ATOM 803 CA LEU A 49 9.508 -5.151 8.533 1.00 0.00 C ATOM 804 C LEU A 49 8.327 -5.357 9.476 1.00 0.00 C ATOM 805 O LEU A 49 8.505 -5.502 10.689 1.00 0.00 O ATOM 806 CB LEU A 49 9.653 -3.669 8.179 1.00 0.00 C ATOM 807 CG LEU A 49 10.911 -3.294 7.388 1.00 0.00 C ATOM 808 CD1 LEU A 49 10.912 -1.813 7.059 1.00 0.00 C ATOM 809 CD2 LEU A 49 12.167 -3.668 8.165 1.00 0.00 C ATOM 0 H LEU A 49 9.241 -5.426 6.467 1.00 0.00 H new ATOM 0 HA LEU A 49 10.413 -5.476 9.047 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.780 -3.365 7.602 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.642 -3.091 9.103 1.00 0.00 H new ATOM 0 HG LEU A 49 10.906 -3.855 6.454 1.00 0.00 H new ATOM 0 HD11 LEU A 49 11.813 -1.566 6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 49 10.034 -1.573 6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 49 10.890 -1.235 7.983 1.00 0.00 H new ATOM 0 HD21 LEU A 49 13.049 -3.393 7.586 1.00 0.00 H new ATOM 0 HD22 LEU A 49 12.178 -3.136 9.117 1.00 0.00 H new ATOM 0 HD23 LEU A 49 12.174 -4.742 8.349 1.00 0.00 H new ATOM 821 N PHE A 50 7.129 -5.386 8.915 1.00 0.00 N ATOM 822 CA PHE A 50 5.920 -5.575 9.701 1.00 0.00 C ATOM 823 C PHE A 50 5.898 -6.971 10.313 1.00 0.00 C ATOM 824 O PHE A 50 5.456 -7.156 11.444 1.00 0.00 O ATOM 825 CB PHE A 50 4.678 -5.360 8.822 1.00 0.00 C ATOM 826 CG PHE A 50 3.368 -5.393 9.567 1.00 0.00 C ATOM 827 CD1 PHE A 50 2.896 -4.263 10.212 1.00 0.00 C ATOM 828 CD2 PHE A 50 2.607 -6.552 9.612 1.00 0.00 C ATOM 829 CE1 PHE A 50 1.692 -4.285 10.890 1.00 0.00 C ATOM 830 CE2 PHE A 50 1.403 -6.581 10.289 1.00 0.00 C ATOM 831 CZ PHE A 50 0.945 -5.446 10.928 1.00 0.00 C ATOM 0 H PHE A 50 6.967 -5.281 7.913 1.00 0.00 H new ATOM 0 HA PHE A 50 5.910 -4.842 10.508 1.00 0.00 H new ATOM 0 HB2 PHE A 50 4.769 -4.399 8.316 1.00 0.00 H new ATOM 0 HB3 PHE A 50 4.660 -6.127 8.048 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.476 -3.352 10.185 1.00 0.00 H new ATOM 0 HD2 PHE A 50 2.960 -7.442 9.112 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.336 -3.396 11.389 1.00 0.00 H new ATOM 0 HE2 PHE A 50 0.821 -7.490 10.318 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.004 -5.466 11.457 1.00 0.00 H new ATOM 841 N ASP A 51 6.390 -7.946 9.559 1.00 0.00 N ATOM 842 CA ASP A 51 6.406 -9.336 10.007 1.00 0.00 C ATOM 843 C ASP A 51 7.504 -9.566 11.040 1.00 0.00 C ATOM 844 O ASP A 51 7.346 -10.368 11.957 1.00 0.00 O ATOM 845 CB ASP A 51 6.604 -10.271 8.820 1.00 0.00 C ATOM 846 CG ASP A 51 6.111 -11.674 9.090 1.00 0.00 C ATOM 847 OD1 ASP A 51 4.880 -11.900 8.995 1.00 0.00 O ATOM 848 OD2 ASP A 51 6.943 -12.562 9.367 1.00 0.00 O1- ATOM 0 H ASP A 51 6.785 -7.800 8.630 1.00 0.00 H new ATOM 0 HA ASP A 51 5.445 -9.551 10.475 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.080 -9.867 7.954 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.663 -10.306 8.564 1.00 0.00 H new ATOM 853 N ASN A 52 8.616 -8.853 10.886 1.00 0.00 N ATOM 854 CA ASN A 52 9.741 -8.954 11.822 1.00 0.00 C ATOM 855 C ASN A 52 9.320 -8.495 13.213 1.00 0.00 C ATOM 856 O ASN A 52 9.767 -9.037 14.222 1.00 0.00 O ATOM 857 CB ASN A 52 10.932 -8.118 11.324 1.00 0.00 C ATOM 858 CG ASN A 52 12.148 -8.203 12.240 1.00 0.00 C ATOM 859 OD1 ASN A 52 12.978 -9.105 12.108 1.00 0.00 O ATOM 860 ND2 ASN A 52 12.270 -7.261 13.161 1.00 0.00 N ATOM 0 H ASN A 52 8.766 -8.196 10.121 1.00 0.00 H new ATOM 0 HA ASN A 52 10.048 -9.998 11.878 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.212 -8.455 10.326 1.00 0.00 H new ATOM 0 HB3 ASN A 52 10.624 -7.076 11.234 1.00 0.00 H new ATOM 0 HD21 ASN A 52 13.071 -7.265 13.792 1.00 0.00 H new ATOM 0 HD22 ASN A 52 11.563 -6.530 13.240 1.00 0.00 H new ATOM 867 N ARG A 53 8.450 -7.500 13.253 1.00 0.00 N ATOM 868 CA ARG A 53 7.933 -6.976 14.509 1.00 0.00 C ATOM 869 C ARG A 53 6.986 -7.965 15.180 1.00 0.00 C ATOM 870 O ARG A 53 6.777 -7.911 16.394 1.00 0.00 O ATOM 871 CB ARG A 53 7.203 -5.658 14.292 1.00 0.00 C ATOM 872 CG ARG A 53 7.997 -4.430 14.695 1.00 0.00 C ATOM 873 CD ARG A 53 7.059 -3.319 15.128 1.00 0.00 C ATOM 874 NE ARG A 53 6.166 -3.781 16.195 1.00 0.00 N ATOM 875 CZ ARG A 53 4.909 -3.377 16.375 1.00 0.00 C ATOM 876 NH1 ARG A 53 4.397 -2.405 15.626 1.00 0.00 N ATOM 877 NH2 ARG A 53 4.174 -3.934 17.328 1.00 0.00 N ATOM 0 H ARG A 53 8.083 -7.034 12.423 1.00 0.00 H new ATOM 0 HA ARG A 53 8.792 -6.812 15.160 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.936 -5.574 13.239 1.00 0.00 H new ATOM 0 HB3 ARG A 53 6.271 -5.675 14.857 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.678 -4.679 15.509 1.00 0.00 H new ATOM 0 HG3 ARG A 53 8.610 -4.093 13.859 1.00 0.00 H new ATOM 0 HD2 ARG A 53 7.637 -2.463 15.476 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.470 -2.980 14.275 1.00 0.00 H new ATOM 0 HE ARG A 53 6.537 -4.467 16.853 1.00 0.00 H new ATOM 0 HH11 ARG A 53 4.968 -1.962 14.906 1.00 0.00 H new ATOM 0 HH12 ARG A 53 3.434 -2.103 15.771 1.00 0.00 H new ATOM 0 HH21 ARG A 53 4.572 -4.666 17.917 1.00 0.00 H new ATOM 0 HH22 ARG A 53 3.211 -3.630 17.472 1.00 0.00 H new ATOM 891 N GLN A 54 6.396 -8.842 14.386 1.00 0.00 N ATOM 892 CA GLN A 54 5.418 -9.786 14.893 1.00 0.00 C ATOM 893 C GLN A 54 6.054 -10.898 15.712 1.00 0.00 C ATOM 894 O GLN A 54 6.397 -11.960 15.186 1.00 0.00 O ATOM 895 CB GLN A 54 4.587 -10.380 13.755 1.00 0.00 C ATOM 896 CG GLN A 54 3.878 -9.338 12.916 1.00 0.00 C ATOM 897 CD GLN A 54 2.976 -8.439 13.736 1.00 0.00 C ATOM 898 OE1 GLN A 54 2.407 -8.854 14.742 1.00 0.00 O ATOM 899 NE2 GLN A 54 2.856 -7.196 13.320 1.00 0.00 N ATOM 0 H GLN A 54 6.579 -8.919 13.385 1.00 0.00 H new ATOM 0 HA GLN A 54 4.761 -9.225 15.557 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.238 -10.972 13.111 1.00 0.00 H new ATOM 0 HB3 GLN A 54 3.847 -11.062 14.174 1.00 0.00 H new ATOM 0 HG2 GLN A 54 4.619 -8.728 12.400 1.00 0.00 H new ATOM 0 HG3 GLN A 54 3.286 -9.837 12.149 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.345 -6.890 12.479 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.274 -6.539 13.839 1.00 0.00 H new ATOM 908 N GLU A 55 6.246 -10.634 16.986 1.00 0.00 N ATOM 909 CA GLU A 55 6.718 -11.641 17.905 1.00 0.00 C ATOM 910 C GLU A 55 5.511 -12.392 18.451 1.00 0.00 C ATOM 911 O GLU A 55 4.775 -11.874 19.294 1.00 0.00 O ATOM 912 CB GLU A 55 7.564 -11.012 19.028 1.00 0.00 C ATOM 913 CG GLU A 55 6.926 -9.801 19.702 1.00 0.00 C ATOM 914 CD GLU A 55 7.840 -9.165 20.723 1.00 0.00 C ATOM 915 OE1 GLU A 55 7.900 -9.661 21.867 1.00 0.00 O ATOM 916 OE2 GLU A 55 8.511 -8.168 20.389 1.00 0.00 O1- ATOM 0 H GLU A 55 6.080 -9.721 17.410 1.00 0.00 H new ATOM 0 HA GLU A 55 7.372 -12.344 17.389 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.761 -11.771 19.785 1.00 0.00 H new ATOM 0 HB3 GLU A 55 8.528 -10.716 18.616 1.00 0.00 H new ATOM 0 HG2 GLU A 55 6.662 -9.063 18.944 1.00 0.00 H new ATOM 0 HG3 GLU A 55 5.998 -10.105 20.187 1.00 0.00 H new ATOM 923 N ALA A 56 5.301 -13.603 17.925 1.00 0.00 N ATOM 924 CA ALA A 56 4.115 -14.421 18.217 1.00 0.00 C ATOM 925 C ALA A 56 2.892 -13.829 17.522 1.00 0.00 C ATOM 926 O ALA A 56 2.863 -12.634 17.218 1.00 0.00 O ATOM 927 CB ALA A 56 3.874 -14.582 19.720 1.00 0.00 C ATOM 0 H ALA A 56 5.953 -14.048 17.279 1.00 0.00 H new ATOM 0 HA ALA A 56 4.296 -15.422 17.826 1.00 0.00 H new ATOM 0 HB1 ALA A 56 2.987 -15.194 19.883 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.737 -15.066 20.177 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.726 -13.601 20.172 1.00 0.00 H new ATOM 933 N ALA A 57 1.901 -14.676 17.239 1.00 0.00 N ATOM 934 CA ALA A 57 0.675 -14.253 16.546 1.00 0.00 C ATOM 935 C ALA A 57 0.975 -13.786 15.117 1.00 0.00 C ATOM 936 O ALA A 57 0.142 -13.151 14.471 1.00 0.00 O ATOM 937 CB ALA A 57 -0.052 -13.163 17.335 1.00 0.00 C ATOM 0 H ALA A 57 1.921 -15.667 17.480 1.00 0.00 H new ATOM 0 HA ALA A 57 0.017 -15.120 16.481 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.955 -12.868 16.801 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.321 -13.545 18.320 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.602 -12.298 17.448 1.00 0.00 H new ATOM 943 N ASP A 58 2.158 -14.148 14.614 1.00 0.00 N ATOM 944 CA ASP A 58 2.586 -13.755 13.267 1.00 0.00 C ATOM 945 C ASP A 58 1.676 -14.338 12.188 1.00 0.00 C ATOM 946 O ASP A 58 1.611 -13.813 11.073 1.00 0.00 O ATOM 947 CB ASP A 58 4.052 -14.147 13.007 1.00 0.00 C ATOM 948 CG ASP A 58 4.326 -15.625 13.201 1.00 0.00 C ATOM 949 OD1 ASP A 58 4.868 -15.994 14.264 1.00 0.00 O ATOM 950 OD2 ASP A 58 4.006 -16.426 12.297 1.00 0.00 O1- ATOM 0 H ASP A 58 2.839 -14.714 15.120 1.00 0.00 H new ATOM 0 HA ASP A 58 2.508 -12.669 13.216 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.320 -13.867 11.988 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.697 -13.575 13.675 1.00 0.00 H new ATOM 955 N THR A 59 0.966 -15.410 12.523 1.00 0.00 N ATOM 956 CA THR A 59 0.029 -16.026 11.594 1.00 0.00 C ATOM 957 C THR A 59 -1.097 -15.046 11.233 1.00 0.00 C ATOM 958 O THR A 59 -1.616 -15.060 10.117 1.00 0.00 O ATOM 959 CB THR A 59 -0.572 -17.337 12.175 1.00 0.00 C ATOM 960 OG1 THR A 59 -1.557 -17.874 11.282 1.00 0.00 O ATOM 961 CG2 THR A 59 -1.205 -17.096 13.543 1.00 0.00 C ATOM 0 H THR A 59 1.022 -15.870 13.432 1.00 0.00 H new ATOM 0 HA THR A 59 0.583 -16.280 10.690 1.00 0.00 H new ATOM 0 HB THR A 59 0.243 -18.051 12.289 1.00 0.00 H new ATOM 0 HG1 THR A 59 -1.926 -18.700 11.660 1.00 0.00 H new ATOM 0 HG21 THR A 59 -1.616 -18.031 13.923 1.00 0.00 H new ATOM 0 HG22 THR A 59 -0.448 -16.725 14.234 1.00 0.00 H new ATOM 0 HG23 THR A 59 -2.003 -16.360 13.450 1.00 0.00 H new ATOM 969 N GLU A 60 -1.439 -14.178 12.174 1.00 0.00 N ATOM 970 CA GLU A 60 -2.480 -13.193 11.961 1.00 0.00 C ATOM 971 C GLU A 60 -2.003 -12.129 10.986 1.00 0.00 C ATOM 972 O GLU A 60 -2.756 -11.672 10.125 1.00 0.00 O ATOM 973 CB GLU A 60 -2.882 -12.567 13.290 1.00 0.00 C ATOM 974 CG GLU A 60 -3.462 -13.569 14.274 1.00 0.00 C ATOM 975 CD GLU A 60 -3.712 -12.974 15.635 1.00 0.00 C ATOM 976 OE1 GLU A 60 -4.312 -11.884 15.708 1.00 0.00 O ATOM 977 OE2 GLU A 60 -3.329 -13.604 16.643 1.00 0.00 O1- ATOM 0 H GLU A 60 -1.006 -14.139 13.097 1.00 0.00 H new ATOM 0 HA GLU A 60 -3.354 -13.683 11.531 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.010 -12.091 13.738 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -3.615 -11.782 13.107 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -4.398 -13.961 13.877 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.779 -14.413 14.371 1.00 0.00 H new ATOM 984 N ALA A 61 -0.735 -11.759 11.110 1.00 0.00 N ATOM 985 CA ALA A 61 -0.131 -10.778 10.224 1.00 0.00 C ATOM 986 C ALA A 61 -0.051 -11.321 8.803 1.00 0.00 C ATOM 987 O ALA A 61 -0.183 -10.575 7.832 1.00 0.00 O ATOM 988 CB ALA A 61 1.251 -10.397 10.724 1.00 0.00 C ATOM 0 H ALA A 61 -0.103 -12.127 11.821 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.757 -9.885 10.217 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.692 -9.662 10.051 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.171 -9.971 11.724 1.00 0.00 H new ATOM 0 HB3 ALA A 61 1.884 -11.284 10.756 1.00 0.00 H new ATOM 994 N ALA A 62 0.158 -12.630 8.691 1.00 0.00 N ATOM 995 CA ALA A 62 0.220 -13.288 7.394 1.00 0.00 C ATOM 996 C ALA A 62 -1.140 -13.241 6.713 1.00 0.00 C ATOM 997 O ALA A 62 -1.235 -13.085 5.494 1.00 0.00 O ATOM 998 CB ALA A 62 0.688 -14.726 7.548 1.00 0.00 C ATOM 0 H ALA A 62 0.287 -13.255 9.486 1.00 0.00 H new ATOM 0 HA ALA A 62 0.940 -12.758 6.770 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.728 -15.202 6.568 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.680 -14.739 7.999 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.008 -15.269 8.187 1.00 0.00 H new ATOM 1004 N LYS A 63 -2.191 -13.374 7.510 1.00 0.00 N ATOM 1005 CA LYS A 63 -3.551 -13.315 7.000 1.00 0.00 C ATOM 1006 C LYS A 63 -3.916 -11.888 6.605 1.00 0.00 C ATOM 1007 O LYS A 63 -4.546 -11.662 5.578 1.00 0.00 O ATOM 1008 CB LYS A 63 -4.544 -13.829 8.045 1.00 0.00 C ATOM 1009 CG LYS A 63 -4.415 -15.308 8.367 1.00 0.00 C ATOM 1010 CD LYS A 63 -5.447 -15.725 9.402 1.00 0.00 C ATOM 1011 CE LYS A 63 -5.417 -17.222 9.659 1.00 0.00 C ATOM 1012 NZ LYS A 63 -6.420 -17.627 10.678 1.00 0.00 N ATOM 0 H LYS A 63 -2.126 -13.524 8.517 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.605 -13.952 6.117 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.412 -13.258 8.964 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -5.557 -13.635 7.691 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -4.546 -15.896 7.458 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -3.413 -15.518 8.741 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.262 -15.193 10.335 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.441 -15.435 9.061 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -5.610 -17.755 8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -4.421 -17.514 9.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -6.369 -18.655 10.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.221 -17.138 11.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -7.373 -17.372 10.348 1.00 0.00 H new ATOM 1026 N GLN A 64 -3.500 -10.931 7.429 1.00 0.00 N ATOM 1027 CA GLN A 64 -3.787 -9.517 7.190 1.00 0.00 C ATOM 1028 C GLN A 64 -3.123 -9.035 5.894 1.00 0.00 C ATOM 1029 O GLN A 64 -3.694 -8.236 5.149 1.00 0.00 O ATOM 1030 CB GLN A 64 -3.298 -8.679 8.380 1.00 0.00 C ATOM 1031 CG GLN A 64 -3.689 -7.210 8.313 1.00 0.00 C ATOM 1032 CD GLN A 64 -5.191 -7.002 8.365 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -5.862 -6.978 7.337 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -5.726 -6.857 9.561 1.00 0.00 N ATOM 0 H GLN A 64 -2.959 -11.109 8.275 1.00 0.00 H new ATOM 0 HA GLN A 64 -4.865 -9.395 7.084 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -3.697 -9.108 9.300 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.212 -8.752 8.439 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.223 -6.676 9.141 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.298 -6.775 7.393 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -5.134 -6.883 10.391 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -6.732 -6.719 9.656 1.00 0.00 H new ATOM 1043 N GLY A 65 -1.929 -9.547 5.630 1.00 0.00 N ATOM 1044 CA GLY A 65 -1.185 -9.172 4.438 1.00 0.00 C ATOM 1045 C GLY A 65 -1.912 -9.517 3.148 1.00 0.00 C ATOM 1046 O GLY A 65 -1.812 -8.789 2.158 1.00 0.00 O ATOM 0 H GLY A 65 -1.455 -10.224 6.227 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -0.989 -8.100 4.462 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.217 -9.674 4.448 1.00 0.00 H new ATOM 1050 N ASP A 66 -2.655 -10.618 3.167 1.00 0.00 N ATOM 1051 CA ASP A 66 -3.359 -11.105 1.976 1.00 0.00 C ATOM 1052 C ASP A 66 -4.365 -10.077 1.452 1.00 0.00 C ATOM 1053 O ASP A 66 -4.517 -9.911 0.241 1.00 0.00 O ATOM 1054 CB ASP A 66 -4.073 -12.423 2.285 1.00 0.00 C ATOM 1055 CG ASP A 66 -4.749 -13.021 1.067 1.00 0.00 C ATOM 1056 OD1 ASP A 66 -4.065 -13.717 0.286 1.00 0.00 O ATOM 1057 OD2 ASP A 66 -5.965 -12.816 0.890 1.00 0.00 O1- ATOM 0 H ASP A 66 -2.789 -11.196 3.997 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.613 -11.270 1.198 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.352 -13.137 2.683 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -4.818 -12.255 3.063 1.00 0.00 H new ATOM 1062 N GLN A 67 -5.028 -9.374 2.365 1.00 0.00 N ATOM 1063 CA GLN A 67 -6.014 -8.361 1.980 1.00 0.00 C ATOM 1064 C GLN A 67 -5.345 -7.213 1.244 1.00 0.00 C ATOM 1065 O GLN A 67 -5.887 -6.678 0.274 1.00 0.00 O ATOM 1066 CB GLN A 67 -6.758 -7.810 3.206 1.00 0.00 C ATOM 1067 CG GLN A 67 -7.800 -8.746 3.805 1.00 0.00 C ATOM 1068 CD GLN A 67 -7.202 -9.984 4.426 1.00 0.00 C ATOM 1069 OE1 GLN A 67 -7.067 -11.020 3.775 1.00 0.00 O ATOM 1070 NE2 GLN A 67 -6.828 -9.883 5.680 1.00 0.00 N ATOM 0 H GLN A 67 -4.904 -9.483 3.372 1.00 0.00 H new ATOM 0 HA GLN A 67 -6.734 -8.845 1.320 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -6.026 -7.566 3.976 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -7.248 -6.878 2.925 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -8.370 -8.207 4.562 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -8.503 -9.042 3.026 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -6.959 -9.005 6.182 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -6.407 -10.683 6.153 1.00 0.00 H new ATOM 1079 N TRP A 68 -4.165 -6.846 1.707 1.00 0.00 N ATOM 1080 CA TRP A 68 -3.416 -5.761 1.127 1.00 0.00 C ATOM 1081 C TRP A 68 -2.935 -6.124 -0.278 1.00 0.00 C ATOM 1082 O TRP A 68 -3.069 -5.333 -1.217 1.00 0.00 O ATOM 1083 CB TRP A 68 -2.247 -5.413 2.041 1.00 0.00 C ATOM 1084 CG TRP A 68 -1.339 -4.373 1.495 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -0.042 -4.543 1.150 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -1.657 -3.005 1.224 1.00 0.00 C ATOM 1087 NE1 TRP A 68 0.481 -3.363 0.687 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -0.493 -2.403 0.721 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -2.813 -2.232 1.361 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -0.448 -1.065 0.352 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -2.768 -0.903 0.995 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -1.592 -0.332 0.496 1.00 0.00 C ATOM 0 H TRP A 68 -3.703 -7.296 2.497 1.00 0.00 H new ATOM 0 HA TRP A 68 -4.060 -4.887 1.031 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -2.638 -5.072 2.999 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -1.671 -6.317 2.236 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.502 -5.473 1.228 1.00 0.00 H new ATOM 0 HE1 TRP A 68 1.440 -3.224 0.369 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -3.724 -2.667 1.746 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 0.457 -0.621 -0.034 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -3.654 -0.294 1.095 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -1.589 0.712 0.218 1.00 0.00 H new ATOM 1103 N VAL A 69 -2.393 -7.328 -0.419 1.00 0.00 N ATOM 1104 CA VAL A 69 -1.912 -7.808 -1.712 1.00 0.00 C ATOM 1105 C VAL A 69 -3.057 -7.889 -2.718 1.00 0.00 C ATOM 1106 O VAL A 69 -2.899 -7.531 -3.889 1.00 0.00 O ATOM 1107 CB VAL A 69 -1.238 -9.198 -1.589 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -0.749 -9.692 -2.946 1.00 0.00 C ATOM 1109 CG2 VAL A 69 -0.087 -9.143 -0.602 1.00 0.00 C ATOM 0 H VAL A 69 -2.275 -7.992 0.346 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.169 -7.092 -2.064 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.983 -9.903 -1.220 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -0.280 -10.669 -2.830 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.594 -9.774 -3.630 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -0.022 -8.987 -3.350 1.00 0.00 H new ATOM 0 HG21 VAL A 69 0.376 -10.127 -0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.653 -8.420 -0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.461 -8.843 0.377 1.00 0.00 H new ATOM 1119 N GLN A 70 -4.218 -8.331 -2.245 1.00 0.00 N ATOM 1120 CA GLN A 70 -5.386 -8.470 -3.090 1.00 0.00 C ATOM 1121 C GLN A 70 -5.820 -7.113 -3.649 1.00 0.00 C ATOM 1122 O GLN A 70 -6.268 -7.019 -4.792 1.00 0.00 O ATOM 1123 CB GLN A 70 -6.523 -9.114 -2.302 1.00 0.00 C ATOM 1124 CG GLN A 70 -7.712 -9.512 -3.150 1.00 0.00 C ATOM 1125 CD GLN A 70 -7.334 -10.458 -4.278 1.00 0.00 C ATOM 1126 OE1 GLN A 70 -6.381 -11.225 -4.169 1.00 0.00 O ATOM 1127 NE2 GLN A 70 -8.079 -10.412 -5.361 1.00 0.00 N ATOM 0 H GLN A 70 -4.369 -8.599 -1.273 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.131 -9.113 -3.932 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.142 -9.998 -1.791 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.856 -8.419 -1.531 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.462 -9.987 -2.518 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.170 -8.617 -3.570 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -8.862 -9.761 -5.414 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -7.873 -11.027 -6.148 1.00 0.00 H new ATOM 1136 N LEU A 71 -5.672 -6.065 -2.844 1.00 0.00 N ATOM 1137 CA LEU A 71 -6.016 -4.716 -3.280 1.00 0.00 C ATOM 1138 C LEU A 71 -5.110 -4.277 -4.424 1.00 0.00 C ATOM 1139 O LEU A 71 -5.572 -3.692 -5.406 1.00 0.00 O ATOM 1140 CB LEU A 71 -5.907 -3.720 -2.120 1.00 0.00 C ATOM 1141 CG LEU A 71 -6.903 -3.906 -0.972 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -6.630 -2.899 0.132 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -8.334 -3.767 -1.474 1.00 0.00 C ATOM 0 H LEU A 71 -5.317 -6.124 -1.889 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.048 -4.731 -3.629 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.898 -3.780 -1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.030 -2.714 -2.520 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.777 -4.910 -0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.346 -3.043 0.941 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -5.619 -3.042 0.512 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.729 -1.889 -0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.026 -3.903 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.474 -2.775 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.528 -4.523 -2.235 1.00 0.00 H new ATOM 1155 N PHE A 72 -3.825 -4.581 -4.297 1.00 0.00 N ATOM 1156 CA PHE A 72 -2.845 -4.217 -5.311 1.00 0.00 C ATOM 1157 C PHE A 72 -3.111 -4.969 -6.617 1.00 0.00 C ATOM 1158 O PHE A 72 -3.095 -4.377 -7.702 1.00 0.00 O ATOM 1159 CB PHE A 72 -1.424 -4.503 -4.805 1.00 0.00 C ATOM 1160 CG PHE A 72 -0.340 -4.083 -5.760 1.00 0.00 C ATOM 1161 CD1 PHE A 72 0.023 -2.750 -5.875 1.00 0.00 C ATOM 1162 CD2 PHE A 72 0.317 -5.020 -6.540 1.00 0.00 C ATOM 1163 CE1 PHE A 72 1.019 -2.363 -6.750 1.00 0.00 C ATOM 1164 CE2 PHE A 72 1.313 -4.639 -7.416 1.00 0.00 C ATOM 1165 CZ PHE A 72 1.664 -3.309 -7.521 1.00 0.00 C ATOM 0 H PHE A 72 -3.436 -5.081 -3.498 1.00 0.00 H new ATOM 0 HA PHE A 72 -2.936 -3.149 -5.509 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.277 -3.989 -3.855 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.327 -5.571 -4.608 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -0.479 -2.006 -5.274 1.00 0.00 H new ATOM 0 HD2 PHE A 72 0.046 -6.063 -6.462 1.00 0.00 H new ATOM 0 HE1 PHE A 72 1.293 -1.321 -6.831 1.00 0.00 H new ATOM 0 HE2 PHE A 72 1.817 -5.381 -8.018 1.00 0.00 H new ATOM 0 HZ PHE A 72 2.443 -3.008 -8.206 1.00 0.00 H new ATOM 1175 N GLN A 73 -3.371 -6.269 -6.506 1.00 0.00 N ATOM 1176 CA GLN A 73 -3.652 -7.095 -7.676 1.00 0.00 C ATOM 1177 C GLN A 73 -4.932 -6.637 -8.365 1.00 0.00 C ATOM 1178 O GLN A 73 -5.025 -6.640 -9.598 1.00 0.00 O ATOM 1179 CB GLN A 73 -3.761 -8.573 -7.286 1.00 0.00 C ATOM 1180 CG GLN A 73 -2.489 -9.150 -6.677 1.00 0.00 C ATOM 1181 CD GLN A 73 -1.276 -8.967 -7.570 1.00 0.00 C ATOM 1182 OE1 GLN A 73 -0.561 -7.970 -7.470 1.00 0.00 O ATOM 1183 NE2 GLN A 73 -1.039 -9.921 -8.446 1.00 0.00 N ATOM 0 H GLN A 73 -3.393 -6.772 -5.619 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.822 -6.982 -8.374 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -4.578 -8.691 -6.574 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.023 -9.153 -8.171 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -2.302 -8.672 -5.715 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.634 -10.213 -6.482 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -1.656 -10.732 -8.497 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -0.238 -9.850 -9.074 1.00 0.00 H new ATOM 1192 N ARG A 74 -5.915 -6.240 -7.564 1.00 0.00 N ATOM 1193 CA ARG A 74 -7.187 -5.749 -8.082 1.00 0.00 C ATOM 1194 C ARG A 74 -6.979 -4.455 -8.873 1.00 0.00 C ATOM 1195 O ARG A 74 -7.631 -4.227 -9.892 1.00 0.00 O ATOM 1196 CB ARG A 74 -8.188 -5.524 -6.930 1.00 0.00 C ATOM 1197 CG ARG A 74 -9.546 -4.983 -7.370 1.00 0.00 C ATOM 1198 CD ARG A 74 -10.491 -4.797 -6.182 1.00 0.00 C ATOM 1199 NE ARG A 74 -11.735 -4.111 -6.569 1.00 0.00 N ATOM 1200 CZ ARG A 74 -12.447 -3.301 -5.766 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -12.081 -3.109 -4.503 1.00 0.00 N ATOM 1202 NH2 ARG A 74 -13.534 -2.696 -6.230 1.00 0.00 N ATOM 0 H ARG A 74 -5.854 -6.249 -6.546 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.600 -6.501 -8.754 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.339 -6.468 -6.407 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.749 -4.830 -6.214 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.410 -4.029 -7.880 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.995 -5.668 -8.089 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.732 -5.770 -5.754 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.987 -4.223 -5.404 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.082 -4.261 -7.516 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.253 -3.578 -4.135 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.628 -2.493 -3.902 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.828 -2.846 -7.195 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -14.075 -2.081 -5.621 1.00 0.00 H new ATOM 1216 N PHE A 75 -6.054 -3.622 -8.403 1.00 0.00 N ATOM 1217 CA PHE A 75 -5.768 -2.349 -9.054 1.00 0.00 C ATOM 1218 C PHE A 75 -5.158 -2.569 -10.434 1.00 0.00 C ATOM 1219 O PHE A 75 -5.591 -1.962 -11.411 1.00 0.00 O ATOM 1220 CB PHE A 75 -4.847 -1.488 -8.175 1.00 0.00 C ATOM 1221 CG PHE A 75 -4.613 -0.096 -8.704 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -5.625 0.851 -8.662 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -3.385 0.268 -9.232 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -5.419 2.132 -9.137 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -3.173 1.549 -9.709 1.00 0.00 C ATOM 1226 CZ PHE A 75 -4.192 2.481 -9.662 1.00 0.00 C ATOM 0 H PHE A 75 -5.490 -3.807 -7.573 1.00 0.00 H new ATOM 0 HA PHE A 75 -6.708 -1.814 -9.187 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.278 -1.417 -7.176 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.886 -1.992 -8.072 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.588 0.584 -8.252 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -2.585 -0.456 -9.272 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.217 2.859 -9.097 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -2.211 1.821 -10.118 1.00 0.00 H new ATOM 0 HZ PHE A 75 -4.028 3.481 -10.036 1.00 0.00 H new ATOM 1236 N ARG A 76 -4.172 -3.456 -10.515 1.00 0.00 N ATOM 1237 CA ARG A 76 -3.533 -3.762 -11.794 1.00 0.00 C ATOM 1238 C ARG A 76 -4.525 -4.377 -12.771 1.00 0.00 C ATOM 1239 O ARG A 76 -4.519 -4.053 -13.960 1.00 0.00 O ATOM 1240 CB ARG A 76 -2.341 -4.692 -11.608 1.00 0.00 C ATOM 1241 CG ARG A 76 -1.008 -3.975 -11.492 1.00 0.00 C ATOM 1242 CD ARG A 76 0.135 -4.968 -11.453 1.00 0.00 C ATOM 1243 NE ARG A 76 1.436 -4.329 -11.622 1.00 0.00 N ATOM 1244 CZ ARG A 76 2.568 -4.784 -11.097 1.00 0.00 C ATOM 1245 NH1 ARG A 76 2.564 -5.882 -10.343 1.00 0.00 N ATOM 1246 NH2 ARG A 76 3.703 -4.149 -11.344 1.00 0.00 N ATOM 0 H ARG A 76 -3.799 -3.973 -9.719 1.00 0.00 H new ATOM 0 HA ARG A 76 -3.175 -2.820 -12.209 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -2.498 -5.292 -10.711 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -2.298 -5.383 -12.450 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -0.879 -3.298 -12.337 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -0.996 -3.364 -10.589 1.00 0.00 H new ATOM 0 HD2 ARG A 76 0.116 -5.501 -10.503 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -0.006 -5.711 -12.238 1.00 0.00 H new ATOM 0 HE ARG A 76 1.479 -3.476 -12.180 1.00 0.00 H new ATOM 0 HH11 ARG A 76 1.689 -6.377 -10.167 1.00 0.00 H new ATOM 0 HH12 ARG A 76 3.435 -6.228 -9.942 1.00 0.00 H new ATOM 0 HH21 ARG A 76 3.704 -3.317 -11.934 1.00 0.00 H new ATOM 0 HH22 ARG A 76 4.577 -4.492 -10.945 1.00 0.00 H new ATOM 1260 N GLU A 77 -5.382 -5.255 -12.264 1.00 0.00 N ATOM 1261 CA GLU A 77 -6.389 -5.905 -13.090 1.00 0.00 C ATOM 1262 C GLU A 77 -7.330 -4.873 -13.703 1.00 0.00 C ATOM 1263 O GLU A 77 -7.645 -4.934 -14.894 1.00 0.00 O ATOM 1264 CB GLU A 77 -7.174 -6.926 -12.268 1.00 0.00 C ATOM 1265 CG GLU A 77 -8.296 -7.603 -13.033 1.00 0.00 C ATOM 1266 CD GLU A 77 -8.901 -8.754 -12.272 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -8.429 -9.889 -12.448 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -9.854 -8.536 -11.500 1.00 0.00 O1- ATOM 0 H GLU A 77 -5.399 -5.533 -11.283 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.883 -6.429 -13.901 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -6.486 -7.688 -11.902 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.593 -6.428 -11.394 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.072 -6.871 -13.256 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.914 -7.964 -13.988 1.00 0.00 H new ATOM 1275 N ALA A 78 -7.754 -3.917 -12.890 1.00 0.00 N ATOM 1276 CA ALA A 78 -8.642 -2.859 -13.344 1.00 0.00 C ATOM 1277 C ALA A 78 -7.987 -2.041 -14.455 1.00 0.00 C ATOM 1278 O ALA A 78 -8.651 -1.621 -15.406 1.00 0.00 O ATOM 1279 CB ALA A 78 -9.029 -1.964 -12.181 1.00 0.00 C ATOM 0 H ALA A 78 -7.495 -3.853 -11.906 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.545 -3.317 -13.748 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.694 -1.176 -12.534 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.539 -2.556 -11.421 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.132 -1.517 -11.752 1.00 0.00 H new ATOM 1285 N ILE A 79 -6.680 -1.832 -14.334 1.00 0.00 N ATOM 1286 CA ILE A 79 -5.921 -1.089 -15.332 1.00 0.00 C ATOM 1287 C ILE A 79 -5.834 -1.884 -16.630 1.00 0.00 C ATOM 1288 O ILE A 79 -6.047 -1.346 -17.720 1.00 0.00 O ATOM 1289 CB ILE A 79 -4.486 -0.777 -14.841 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -4.523 0.060 -13.565 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -3.696 -0.052 -15.923 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -3.158 0.318 -12.970 1.00 0.00 C ATOM 0 H ILE A 79 -6.122 -2.169 -13.549 1.00 0.00 H new ATOM 0 HA ILE A 79 -6.446 -0.149 -15.502 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.989 -1.722 -14.621 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -5.002 1.015 -13.781 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.142 -0.448 -12.825 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.690 0.159 -15.560 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.636 -0.680 -16.812 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -4.195 0.884 -16.172 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.263 0.918 -12.066 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.684 -0.632 -12.722 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.542 0.854 -13.692 1.00 0.00 H new ATOM 1304 N ASP A 80 -5.532 -3.171 -16.502 1.00 0.00 N ATOM 1305 CA ASP A 80 -5.404 -4.061 -17.658 1.00 0.00 C ATOM 1306 C ASP A 80 -6.728 -4.197 -18.397 1.00 0.00 C ATOM 1307 O ASP A 80 -6.761 -4.265 -19.623 1.00 0.00 O ATOM 1308 CB ASP A 80 -4.906 -5.440 -17.221 1.00 0.00 C ATOM 1309 CG ASP A 80 -4.854 -6.435 -18.367 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -3.923 -6.351 -19.199 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -5.734 -7.316 -18.432 1.00 0.00 O1- ATOM 0 H ASP A 80 -5.370 -3.627 -15.604 1.00 0.00 H new ATOM 0 HA ASP A 80 -4.676 -3.619 -18.338 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.912 -5.341 -16.786 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.559 -5.827 -16.439 1.00 0.00 H new ATOM 1316 N LYS A 81 -7.819 -4.226 -17.649 1.00 0.00 N ATOM 1317 CA LYS A 81 -9.146 -4.327 -18.244 1.00 0.00 C ATOM 1318 C LYS A 81 -9.611 -2.967 -18.755 1.00 0.00 C ATOM 1319 O LYS A 81 -10.579 -2.875 -19.515 1.00 0.00 O ATOM 1320 CB LYS A 81 -10.156 -4.881 -17.228 1.00 0.00 C ATOM 1321 CG LYS A 81 -9.871 -6.309 -16.776 1.00 0.00 C ATOM 1322 CD LYS A 81 -10.020 -7.302 -17.920 1.00 0.00 C ATOM 1323 CE LYS A 81 -9.664 -8.713 -17.478 1.00 0.00 C ATOM 1324 NZ LYS A 81 -9.809 -9.697 -18.579 1.00 0.00 N ATOM 0 H LYS A 81 -7.814 -4.181 -16.630 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.086 -5.016 -19.087 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -10.168 -4.231 -16.353 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.153 -4.843 -17.667 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.860 -6.368 -16.372 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.553 -6.578 -15.969 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.045 -7.282 -18.290 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.377 -7.005 -18.748 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -8.638 -8.729 -17.111 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.305 -9.004 -16.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.556 -10.645 -18.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.794 -9.702 -18.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -9.179 -9.435 -19.364 1.00 0.00 H new ATOM 1338 N GLY A 82 -8.907 -1.917 -18.345 1.00 0.00 N ATOM 1339 CA GLY A 82 -9.257 -0.575 -18.760 1.00 0.00 C ATOM 1340 C GLY A 82 -10.567 -0.119 -18.159 1.00 0.00 C ATOM 1341 O GLY A 82 -11.301 0.659 -18.770 1.00 0.00 O ATOM 0 H GLY A 82 -8.096 -1.975 -17.729 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -8.465 0.113 -18.466 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.325 -0.538 -19.847 1.00 0.00 H new ATOM 1345 N ASP A 83 -10.857 -0.600 -16.964 1.00 0.00 N ATOM 1346 CA ASP A 83 -12.102 -0.273 -16.285 1.00 0.00 C ATOM 1347 C ASP A 83 -11.907 0.894 -15.331 1.00 0.00 C ATOM 1348 O ASP A 83 -11.426 0.721 -14.208 1.00 0.00 O ATOM 1349 CB ASP A 83 -12.649 -1.488 -15.536 1.00 0.00 C ATOM 1350 CG ASP A 83 -13.990 -1.209 -14.895 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -14.046 -1.063 -13.662 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -14.994 -1.133 -15.623 1.00 0.00 O1- ATOM 0 H ASP A 83 -10.244 -1.223 -16.439 1.00 0.00 H new ATOM 0 HA ASP A 83 -12.830 0.020 -17.042 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -12.746 -2.325 -16.227 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -11.937 -1.790 -14.768 1.00 0.00 H new ATOM 1357 N LYS A 84 -12.261 2.084 -15.796 1.00 0.00 N ATOM 1358 CA LYS A 84 -12.101 3.312 -15.013 1.00 0.00 C ATOM 1359 C LYS A 84 -12.898 3.245 -13.709 1.00 0.00 C ATOM 1360 O LYS A 84 -12.479 3.778 -12.688 1.00 0.00 O ATOM 1361 CB LYS A 84 -12.575 4.526 -15.826 1.00 0.00 C ATOM 1362 CG LYS A 84 -14.088 4.604 -15.963 1.00 0.00 C ATOM 1363 CD LYS A 84 -14.537 5.802 -16.767 1.00 0.00 C ATOM 1364 CE LYS A 84 -16.015 6.083 -16.533 1.00 0.00 C ATOM 1365 NZ LYS A 84 -16.857 4.872 -16.714 1.00 0.00 N ATOM 0 H LYS A 84 -12.665 2.230 -16.721 1.00 0.00 H new ATOM 0 HA LYS A 84 -11.042 3.415 -14.775 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -12.213 5.437 -15.350 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -12.129 4.486 -16.820 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -14.454 3.694 -16.439 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -14.537 4.648 -14.971 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -13.947 6.675 -16.488 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -14.359 5.622 -17.827 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.153 6.471 -15.524 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -16.348 6.860 -17.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -17.859 5.148 -16.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -16.599 4.400 -17.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -16.703 4.220 -15.919 1.00 0.00 H new ATOM 1379 N ASP A 85 -14.033 2.565 -13.755 1.00 0.00 N ATOM 1380 CA ASP A 85 -14.931 2.487 -12.618 1.00 0.00 C ATOM 1381 C ASP A 85 -14.252 1.880 -11.417 1.00 0.00 C ATOM 1382 O ASP A 85 -14.382 2.387 -10.299 1.00 0.00 O ATOM 1383 CB ASP A 85 -16.190 1.714 -12.986 1.00 0.00 C ATOM 1384 CG ASP A 85 -17.065 2.487 -13.947 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -16.748 2.526 -15.161 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -18.067 3.074 -13.495 1.00 0.00 O1- ATOM 0 H ASP A 85 -14.355 2.055 -14.578 1.00 0.00 H new ATOM 0 HA ASP A 85 -15.219 3.503 -12.347 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -15.912 0.760 -13.435 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -16.755 1.488 -12.082 1.00 0.00 H new ATOM 1391 N SER A 86 -13.525 0.808 -11.634 1.00 0.00 N ATOM 1392 CA SER A 86 -12.779 0.192 -10.569 1.00 0.00 C ATOM 1393 C SER A 86 -11.595 1.070 -10.169 1.00 0.00 C ATOM 1394 O SER A 86 -11.263 1.162 -9.001 1.00 0.00 O ATOM 1395 CB SER A 86 -12.298 -1.197 -10.982 1.00 0.00 C ATOM 1396 OG SER A 86 -13.391 -2.032 -11.322 1.00 0.00 O ATOM 0 H SER A 86 -13.436 0.347 -12.540 1.00 0.00 H new ATOM 0 HA SER A 86 -13.437 0.085 -9.707 1.00 0.00 H new ATOM 0 HB2 SER A 86 -11.621 -1.114 -11.832 1.00 0.00 H new ATOM 0 HB3 SER A 86 -11.732 -1.647 -10.167 1.00 0.00 H new ATOM 0 HG SER A 86 -13.842 -1.674 -12.115 1.00 0.00 H new ATOM 1402 N LEU A 87 -10.987 1.741 -11.150 1.00 0.00 N ATOM 1403 CA LEU A 87 -9.812 2.584 -10.897 1.00 0.00 C ATOM 1404 C LEU A 87 -10.131 3.730 -9.941 1.00 0.00 C ATOM 1405 O LEU A 87 -9.424 3.936 -8.953 1.00 0.00 O ATOM 1406 CB LEU A 87 -9.261 3.149 -12.210 1.00 0.00 C ATOM 1407 CG LEU A 87 -8.768 2.121 -13.224 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -8.277 2.806 -14.488 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -7.668 1.275 -12.623 1.00 0.00 C ATOM 0 H LEU A 87 -11.286 1.718 -12.125 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.058 1.951 -10.429 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.040 3.749 -12.680 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.437 3.823 -11.975 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.603 1.472 -13.488 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.930 2.055 -15.198 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.092 3.376 -14.933 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.456 3.479 -14.242 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.327 0.546 -13.358 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.835 1.915 -12.332 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.049 0.753 -11.745 1.00 0.00 H new ATOM 1421 N GLU A 88 -11.205 4.455 -10.223 1.00 0.00 N ATOM 1422 CA GLU A 88 -11.603 5.579 -9.380 1.00 0.00 C ATOM 1423 C GLU A 88 -12.021 5.114 -7.988 1.00 0.00 C ATOM 1424 O GLU A 88 -11.657 5.729 -6.983 1.00 0.00 O ATOM 1425 CB GLU A 88 -12.734 6.394 -10.025 1.00 0.00 C ATOM 1426 CG GLU A 88 -12.271 7.427 -11.051 1.00 0.00 C ATOM 1427 CD GLU A 88 -11.801 6.822 -12.355 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -12.642 6.623 -13.253 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -10.590 6.575 -12.504 1.00 0.00 O1- ATOM 0 H GLU A 88 -11.814 4.288 -11.024 1.00 0.00 H new ATOM 0 HA GLU A 88 -10.729 6.223 -9.279 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.428 5.707 -10.509 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.289 6.906 -9.239 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -13.091 8.116 -11.255 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.460 8.015 -10.621 1.00 0.00 H new ATOM 1436 N GLN A 89 -12.771 4.022 -7.932 1.00 0.00 N ATOM 1437 CA GLN A 89 -13.251 3.495 -6.674 1.00 0.00 C ATOM 1438 C GLN A 89 -12.103 2.927 -5.838 1.00 0.00 C ATOM 1439 O GLN A 89 -12.081 3.074 -4.613 1.00 0.00 O ATOM 1440 CB GLN A 89 -14.309 2.429 -6.932 1.00 0.00 C ATOM 1441 CG GLN A 89 -14.922 1.856 -5.678 1.00 0.00 C ATOM 1442 CD GLN A 89 -15.526 2.922 -4.775 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -16.011 3.958 -5.240 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -15.491 2.677 -3.483 1.00 0.00 N ATOM 0 H GLN A 89 -13.058 3.486 -8.751 1.00 0.00 H new ATOM 0 HA GLN A 89 -13.699 4.310 -6.105 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -15.100 2.858 -7.547 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -13.861 1.619 -7.508 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -15.695 1.138 -5.952 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -14.160 1.307 -5.125 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -15.081 1.808 -3.140 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.874 3.356 -2.825 1.00 0.00 H new ATOM 1453 N LEU A 90 -11.148 2.293 -6.503 1.00 0.00 N ATOM 1454 CA LEU A 90 -9.997 1.713 -5.826 1.00 0.00 C ATOM 1455 C LEU A 90 -9.178 2.758 -5.114 1.00 0.00 C ATOM 1456 O LEU A 90 -8.651 2.499 -4.045 1.00 0.00 O ATOM 1457 CB LEU A 90 -9.127 0.924 -6.789 1.00 0.00 C ATOM 1458 CG LEU A 90 -9.621 -0.480 -7.101 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -8.793 -1.095 -8.200 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -9.559 -1.341 -5.854 1.00 0.00 C ATOM 0 H LEU A 90 -11.148 2.167 -7.515 1.00 0.00 H new ATOM 0 HA LEU A 90 -10.388 1.027 -5.075 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.048 1.481 -7.723 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.122 0.855 -6.373 1.00 0.00 H new ATOM 0 HG LEU A 90 -10.656 -0.421 -7.438 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.159 -2.100 -8.412 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.870 -0.484 -9.099 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -7.751 -1.147 -7.885 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -9.915 -2.345 -6.087 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.530 -1.394 -5.499 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.188 -0.904 -5.078 1.00 0.00 H new ATOM 1472 N LEU A 91 -9.076 3.942 -5.699 1.00 0.00 N ATOM 1473 CA LEU A 91 -8.325 5.024 -5.080 1.00 0.00 C ATOM 1474 C LEU A 91 -8.909 5.350 -3.710 1.00 0.00 C ATOM 1475 O LEU A 91 -8.176 5.608 -2.755 1.00 0.00 O ATOM 1476 CB LEU A 91 -8.341 6.273 -5.969 1.00 0.00 C ATOM 1477 CG LEU A 91 -7.692 6.122 -7.348 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -7.833 7.409 -8.144 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -6.223 5.737 -7.215 1.00 0.00 C ATOM 0 H LEU A 91 -9.501 4.177 -6.596 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.291 4.700 -4.959 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -9.377 6.583 -6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.836 7.080 -5.438 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.207 5.324 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.367 7.285 -9.121 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.890 7.643 -8.273 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.344 8.223 -7.609 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.782 5.635 -8.207 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.693 6.511 -6.660 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.142 4.789 -6.683 1.00 0.00 H new ATOM 1491 N GLU A 92 -10.232 5.302 -3.617 1.00 0.00 N ATOM 1492 CA GLU A 92 -10.920 5.577 -2.369 1.00 0.00 C ATOM 1493 C GLU A 92 -10.686 4.450 -1.357 1.00 0.00 C ATOM 1494 O GLU A 92 -10.378 4.707 -0.194 1.00 0.00 O ATOM 1495 CB GLU A 92 -12.419 5.762 -2.624 1.00 0.00 C ATOM 1496 CG GLU A 92 -13.227 6.061 -1.373 1.00 0.00 C ATOM 1497 CD GLU A 92 -14.690 6.280 -1.670 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -15.073 7.432 -1.954 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -15.466 5.306 -1.622 1.00 0.00 O1- ATOM 0 H GLU A 92 -10.849 5.074 -4.396 1.00 0.00 H new ATOM 0 HA GLU A 92 -10.517 6.499 -1.949 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.558 6.575 -3.337 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -12.812 4.859 -3.090 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -13.122 5.235 -0.670 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -12.822 6.948 -0.886 1.00 0.00 H new ATOM 1506 N GLU A 93 -10.807 3.204 -1.812 1.00 0.00 N ATOM 1507 CA GLU A 93 -10.610 2.045 -0.936 1.00 0.00 C ATOM 1508 C GLU A 93 -9.160 1.938 -0.486 1.00 0.00 C ATOM 1509 O GLU A 93 -8.875 1.674 0.685 1.00 0.00 O ATOM 1510 CB GLU A 93 -11.019 0.749 -1.638 1.00 0.00 C ATOM 1511 CG GLU A 93 -12.506 0.621 -1.908 1.00 0.00 C ATOM 1512 CD GLU A 93 -12.873 -0.758 -2.408 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -12.688 -1.732 -1.653 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -13.351 -0.878 -3.551 1.00 0.00 O1- ATOM 0 H GLU A 93 -11.039 2.969 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 93 -11.244 2.191 -0.061 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -10.484 0.679 -2.585 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -10.699 -0.096 -1.028 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -13.060 0.835 -0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -12.806 1.366 -2.645 1.00 0.00 H new ATOM 1521 N LEU A 94 -8.255 2.156 -1.422 1.00 0.00 N ATOM 1522 CA LEU A 94 -6.832 2.064 -1.164 1.00 0.00 C ATOM 1523 C LEU A 94 -6.401 3.092 -0.129 1.00 0.00 C ATOM 1524 O LEU A 94 -5.668 2.772 0.804 1.00 0.00 O ATOM 1525 CB LEU A 94 -6.061 2.273 -2.468 1.00 0.00 C ATOM 1526 CG LEU A 94 -4.545 2.122 -2.396 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -4.161 0.698 -2.023 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -3.923 2.514 -3.724 1.00 0.00 C ATOM 0 H LEU A 94 -8.488 2.402 -2.384 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.612 1.073 -0.768 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.439 1.565 -3.205 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.287 3.272 -2.841 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.164 2.786 -1.620 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.075 0.614 -1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.585 0.450 -1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.547 0.009 -2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.840 2.404 -3.665 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.311 1.869 -4.512 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.170 3.551 -3.950 1.00 0.00 H new ATOM 1540 N GLU A 95 -6.873 4.323 -0.288 1.00 0.00 N ATOM 1541 CA GLU A 95 -6.534 5.387 0.640 1.00 0.00 C ATOM 1542 C GLU A 95 -7.092 5.087 2.033 1.00 0.00 C ATOM 1543 O GLU A 95 -6.442 5.359 3.046 1.00 0.00 O ATOM 1544 CB GLU A 95 -7.014 6.740 0.118 1.00 0.00 C ATOM 1545 CG GLU A 95 -6.459 7.924 0.889 1.00 0.00 C ATOM 1546 CD GLU A 95 -6.553 9.214 0.113 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -7.638 9.823 0.091 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -5.532 9.631 -0.480 1.00 0.00 O1- ATOM 0 H GLU A 95 -7.490 4.605 -1.050 1.00 0.00 H new ATOM 0 HA GLU A 95 -5.448 5.438 0.724 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.731 6.836 -0.930 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.103 6.770 0.159 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.002 8.028 1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.417 7.732 1.143 1.00 0.00 H new ATOM 1555 N GLN A 96 -8.293 4.507 2.078 1.00 0.00 N ATOM 1556 CA GLN A 96 -8.898 4.104 3.345 1.00 0.00 C ATOM 1557 C GLN A 96 -8.009 3.083 4.050 1.00 0.00 C ATOM 1558 O GLN A 96 -7.809 3.145 5.266 1.00 0.00 O ATOM 1559 CB GLN A 96 -10.289 3.505 3.122 1.00 0.00 C ATOM 1560 CG GLN A 96 -11.354 4.515 2.734 1.00 0.00 C ATOM 1561 CD GLN A 96 -12.692 3.860 2.446 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -13.473 4.472 1.582 1.00 0.00 O flip ATOM 1563 NE2 GLN A 96 -13.020 2.809 3.003 1.00 0.00 N flip ATOM 0 H GLN A 96 -8.862 4.307 1.255 1.00 0.00 H new ATOM 0 HA GLN A 96 -8.998 4.992 3.969 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -10.224 2.747 2.342 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -10.603 2.997 4.034 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -11.473 5.241 3.538 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -11.025 5.066 1.853 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -12.386 2.365 3.667 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -13.925 2.385 2.799 1.00 0.00 H new ATOM 1572 N ALA A 97 -7.480 2.144 3.278 1.00 0.00 N ATOM 1573 CA ALA A 97 -6.588 1.125 3.809 1.00 0.00 C ATOM 1574 C ALA A 97 -5.277 1.750 4.271 1.00 0.00 C ATOM 1575 O ALA A 97 -4.726 1.369 5.304 1.00 0.00 O ATOM 1576 CB ALA A 97 -6.327 0.050 2.764 1.00 0.00 C ATOM 0 H ALA A 97 -7.655 2.068 2.276 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.069 0.660 4.670 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.658 -0.705 3.178 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.270 -0.418 2.480 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -5.866 0.501 1.885 1.00 0.00 H new ATOM 1582 N LEU A 98 -4.802 2.733 3.513 1.00 0.00 N ATOM 1583 CA LEU A 98 -3.559 3.430 3.830 1.00 0.00 C ATOM 1584 C LEU A 98 -3.661 4.150 5.159 1.00 0.00 C ATOM 1585 O LEU A 98 -2.712 4.162 5.940 1.00 0.00 O ATOM 1586 CB LEU A 98 -3.213 4.433 2.729 1.00 0.00 C ATOM 1587 CG LEU A 98 -2.747 3.837 1.406 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -2.568 4.930 0.367 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -1.449 3.069 1.601 1.00 0.00 C ATOM 0 H LEU A 98 -5.264 3.068 2.667 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.768 2.683 3.898 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.091 5.050 2.538 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.432 5.096 3.101 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.509 3.144 1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -2.235 4.488 -0.572 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -3.517 5.442 0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.823 5.645 0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.128 2.649 0.648 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.680 3.744 1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.607 2.263 2.318 1.00 0.00 H new ATOM 1601 N GLN A 99 -4.817 4.736 5.417 1.00 0.00 N ATOM 1602 CA GLN A 99 -5.055 5.454 6.648 1.00 0.00 C ATOM 1603 C GLN A 99 -4.964 4.504 7.837 1.00 0.00 C ATOM 1604 O GLN A 99 -4.376 4.832 8.868 1.00 0.00 O ATOM 1605 CB GLN A 99 -6.432 6.111 6.599 1.00 0.00 C ATOM 1606 CG GLN A 99 -6.767 6.936 7.821 1.00 0.00 C ATOM 1607 CD GLN A 99 -8.170 7.502 7.767 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -9.067 6.907 7.176 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -8.370 8.648 8.378 1.00 0.00 N ATOM 0 H GLN A 99 -5.612 4.725 4.779 1.00 0.00 H new ATOM 0 HA GLN A 99 -4.295 6.227 6.765 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -6.487 6.749 5.717 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -7.189 5.336 6.479 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -6.661 6.319 8.713 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -6.051 7.753 7.912 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -7.599 9.111 8.858 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.297 9.074 8.372 1.00 0.00 H new ATOM 1618 N LYS A 100 -5.527 3.317 7.668 1.00 0.00 N ATOM 1619 CA LYS A 100 -5.527 2.309 8.715 1.00 0.00 C ATOM 1620 C LYS A 100 -4.120 1.771 8.953 1.00 0.00 C ATOM 1621 O LYS A 100 -3.667 1.675 10.096 1.00 0.00 O ATOM 1622 CB LYS A 100 -6.464 1.165 8.336 1.00 0.00 C ATOM 1623 CG LYS A 100 -7.902 1.598 8.123 1.00 0.00 C ATOM 1624 CD LYS A 100 -8.782 0.423 7.733 1.00 0.00 C ATOM 1625 CE LYS A 100 -10.208 0.868 7.457 1.00 0.00 C ATOM 1626 NZ LYS A 100 -10.291 1.778 6.288 1.00 0.00 N ATOM 0 H LYS A 100 -5.993 3.028 6.808 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.877 2.773 9.637 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.097 0.694 7.424 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.434 0.408 9.120 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.285 2.054 9.036 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.943 2.360 7.344 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -8.372 -0.062 6.847 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -8.778 -0.318 8.533 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -10.833 -0.007 7.280 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -10.607 1.372 8.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.718 2.680 6.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -9.336 1.951 5.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -10.878 1.341 5.549 1.00 0.00 H new ATOM 1640 N ILE A 101 -3.425 1.442 7.867 1.00 0.00 N ATOM 1641 CA ILE A 101 -2.066 0.917 7.957 1.00 0.00 C ATOM 1642 C ILE A 101 -1.134 1.951 8.574 1.00 0.00 C ATOM 1643 O ILE A 101 -0.249 1.614 9.360 1.00 0.00 O ATOM 1644 CB ILE A 101 -1.521 0.493 6.565 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -2.376 -0.635 5.978 1.00 0.00 C ATOM 1646 CG2 ILE A 101 -0.058 0.060 6.662 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -1.931 -1.088 4.603 1.00 0.00 C ATOM 0 H ILE A 101 -3.781 1.530 6.915 1.00 0.00 H new ATOM 0 HA ILE A 101 -2.103 0.033 8.594 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.577 1.355 5.900 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.351 -1.488 6.657 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.412 -0.301 5.923 1.00 0.00 H new ATOM 0 HG21 ILE A 101 0.301 -0.232 5.675 1.00 0.00 H new ATOM 0 HG22 ILE A 101 0.543 0.889 7.036 1.00 0.00 H new ATOM 0 HG23 ILE A 101 0.027 -0.786 7.344 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -2.584 -1.888 4.254 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -1.983 -0.249 3.909 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -0.905 -1.454 4.655 1.00 0.00 H new ATOM 1659 N ARG A 102 -1.363 3.211 8.237 1.00 0.00 N ATOM 1660 CA ARG A 102 -0.543 4.297 8.738 1.00 0.00 C ATOM 1661 C ARG A 102 -0.614 4.355 10.259 1.00 0.00 C ATOM 1662 O ARG A 102 0.407 4.429 10.924 1.00 0.00 O ATOM 1663 CB ARG A 102 -1.013 5.622 8.142 1.00 0.00 C ATOM 1664 CG ARG A 102 0.030 6.726 8.164 1.00 0.00 C ATOM 1665 CD ARG A 102 -0.527 8.001 7.558 1.00 0.00 C ATOM 1666 NE ARG A 102 0.524 8.924 7.140 1.00 0.00 N ATOM 1667 CZ ARG A 102 0.323 9.974 6.339 1.00 0.00 C ATOM 1668 NH1 ARG A 102 -0.908 10.289 5.944 1.00 0.00 N ATOM 1669 NH2 ARG A 102 1.349 10.716 5.951 1.00 0.00 N ATOM 0 H ARG A 102 -2.116 3.505 7.614 1.00 0.00 H new ATOM 0 HA ARG A 102 0.491 4.121 8.443 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -1.323 5.453 7.111 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -1.894 5.960 8.688 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.347 6.913 9.190 1.00 0.00 H new ATOM 0 HG3 ARG A 102 0.914 6.410 7.610 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -1.149 7.750 6.699 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -1.172 8.494 8.285 1.00 0.00 H new ATOM 0 HE ARG A 102 1.471 8.757 7.481 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -1.702 9.728 6.253 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -1.058 11.091 5.332 1.00 0.00 H new ATOM 0 HH21 ARG A 102 2.292 10.486 6.264 1.00 0.00 H new ATOM 0 HH22 ARG A 102 1.196 11.518 5.339 1.00 0.00 H new ATOM 1683 N GLU A 103 -1.827 4.276 10.800 1.00 0.00 N ATOM 1684 CA GLU A 103 -2.024 4.321 12.248 1.00 0.00 C ATOM 1685 C GLU A 103 -1.380 3.115 12.927 1.00 0.00 C ATOM 1686 O GLU A 103 -0.768 3.241 13.992 1.00 0.00 O ATOM 1687 CB GLU A 103 -3.513 4.380 12.590 1.00 0.00 C ATOM 1688 CG GLU A 103 -4.217 5.620 12.069 1.00 0.00 C ATOM 1689 CD GLU A 103 -5.676 5.662 12.463 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -6.512 5.124 11.718 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -5.993 6.234 13.531 1.00 0.00 O1- ATOM 0 H GLU A 103 -2.687 4.181 10.260 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.542 5.225 12.620 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -4.004 3.497 12.182 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.629 4.337 13.673 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.714 6.508 12.452 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -4.136 5.651 10.982 1.00 0.00 H new ATOM 1698 N LEU A 104 -1.511 1.952 12.300 1.00 0.00 N ATOM 1699 CA LEU A 104 -0.949 0.720 12.840 1.00 0.00 C ATOM 1700 C LEU A 104 0.578 0.757 12.829 1.00 0.00 C ATOM 1701 O LEU A 104 1.224 0.339 13.791 1.00 0.00 O ATOM 1702 CB LEU A 104 -1.450 -0.493 12.047 1.00 0.00 C ATOM 1703 CG LEU A 104 -2.965 -0.726 12.067 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -3.335 -1.906 11.183 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -3.457 -0.952 13.491 1.00 0.00 C ATOM 0 H LEU A 104 -2.003 1.836 11.414 1.00 0.00 H new ATOM 0 HA LEU A 104 -1.281 0.630 13.874 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.133 -0.381 11.010 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.959 -1.385 12.436 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.452 0.166 11.674 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.414 -2.056 11.210 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.022 -1.705 10.158 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.835 -2.804 11.546 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.535 -1.115 13.482 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.961 -1.826 13.913 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.228 -0.076 14.098 1.00 0.00 H new ATOM 1717 N ALA A 105 1.150 1.272 11.747 1.00 0.00 N ATOM 1718 CA ALA A 105 2.601 1.358 11.621 1.00 0.00 C ATOM 1719 C ALA A 105 3.163 2.426 12.547 1.00 0.00 C ATOM 1720 O ALA A 105 4.295 2.323 13.010 1.00 0.00 O ATOM 1721 CB ALA A 105 2.991 1.645 10.179 1.00 0.00 C ATOM 0 H ALA A 105 0.633 1.636 10.946 1.00 0.00 H new ATOM 0 HA ALA A 105 3.027 0.398 11.913 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.076 1.706 10.101 1.00 0.00 H new ATOM 0 HB2 ALA A 105 2.626 0.844 9.537 1.00 0.00 H new ATOM 0 HB3 ALA A 105 2.551 2.591 9.864 1.00 0.00 H new ATOM 1727 N GLU A 106 2.351 3.437 12.826 1.00 0.00 N ATOM 1728 CA GLU A 106 2.732 4.524 13.722 1.00 0.00 C ATOM 1729 C GLU A 106 2.673 4.082 15.171 1.00 0.00 C ATOM 1730 O GLU A 106 3.304 4.694 16.040 1.00 0.00 O ATOM 1731 CB GLU A 106 1.798 5.718 13.526 1.00 0.00 C ATOM 1732 CG GLU A 106 2.073 6.528 12.277 1.00 0.00 C ATOM 1733 CD GLU A 106 3.252 7.449 12.439 1.00 0.00 C ATOM 1734 OE1 GLU A 106 3.045 8.617 12.844 1.00 0.00 O ATOM 1735 OE2 GLU A 106 4.389 7.029 12.173 1.00 0.00 O1- ATOM 0 H GLU A 106 1.412 3.528 12.439 1.00 0.00 H new ATOM 0 HA GLU A 106 3.756 4.811 13.482 1.00 0.00 H new ATOM 0 HB2 GLU A 106 0.770 5.358 13.492 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.878 6.373 14.394 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.255 5.852 11.442 1.00 0.00 H new ATOM 0 HG3 GLU A 106 1.189 7.114 12.025 1.00 0.00 H new ATOM 1742 N LYS A 107 1.911 3.010 15.428 1.00 0.00 N ATOM 1743 CA LYS A 107 1.687 2.523 16.785 1.00 0.00 C ATOM 1744 C LYS A 107 1.022 3.641 17.592 1.00 0.00 C ATOM 1745 O LYS A 107 1.341 3.880 18.760 1.00 0.00 O ATOM 1746 CB LYS A 107 3.021 2.074 17.434 1.00 0.00 C ATOM 1747 CG LYS A 107 2.864 1.396 18.793 1.00 0.00 C ATOM 1748 CD LYS A 107 4.211 1.033 19.398 1.00 0.00 C ATOM 1749 CE LYS A 107 4.057 0.479 20.810 1.00 0.00 C ATOM 1750 NZ LYS A 107 3.244 -0.762 20.839 1.00 0.00 N ATOM 0 H LYS A 107 1.440 2.465 14.706 1.00 0.00 H new ATOM 0 HA LYS A 107 1.034 1.651 16.767 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.528 1.388 16.756 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.667 2.945 17.548 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.327 2.059 19.471 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.260 0.496 18.683 1.00 0.00 H new ATOM 0 HD2 LYS A 107 4.707 0.295 18.768 1.00 0.00 H new ATOM 0 HD3 LYS A 107 4.851 1.915 19.420 1.00 0.00 H new ATOM 0 HE2 LYS A 107 5.043 0.276 21.228 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.590 1.232 21.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 3.278 -1.177 21.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.259 -0.537 20.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 3.625 -1.443 20.151 1.00 0.00 H new ATOM 1764 N LYS A 108 0.092 4.330 16.940 1.00 0.00 N ATOM 1765 CA LYS A 108 -0.588 5.456 17.540 1.00 0.00 C ATOM 1766 C LYS A 108 -1.499 5.024 18.671 1.00 0.00 C ATOM 1767 O LYS A 108 -2.521 4.357 18.455 1.00 0.00 O ATOM 1768 CB LYS A 108 -1.381 6.248 16.488 1.00 0.00 C ATOM 1769 CG LYS A 108 -2.182 7.425 17.059 1.00 0.00 C ATOM 1770 CD LYS A 108 -1.287 8.408 17.809 1.00 0.00 C ATOM 1771 CE LYS A 108 -2.072 9.606 18.346 1.00 0.00 C ATOM 1772 NZ LYS A 108 -3.168 9.202 19.271 1.00 0.00 N ATOM 0 H LYS A 108 -0.205 4.120 15.987 1.00 0.00 H new ATOM 0 HA LYS A 108 0.179 6.107 17.959 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.688 6.625 15.736 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -2.066 5.570 15.979 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -2.693 7.944 16.248 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -2.952 7.048 17.732 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -0.799 7.894 18.637 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -0.499 8.760 17.144 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.391 10.279 18.867 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -2.494 10.164 17.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -3.351 9.969 19.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -4.031 9.011 18.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.888 8.343 19.787 1.00 0.00 H new ATOM 1786 N ASN A 109 -1.114 5.383 19.871 1.00 0.00 N ATOM 1787 CA ASN A 109 -1.923 5.132 21.033 1.00 0.00 C ATOM 1788 C ASN A 109 -2.997 6.188 21.119 1.00 0.00 C ATOM 1789 O ASN A 109 -4.185 5.836 21.025 1.00 0.00 O ATOM 1790 CB ASN A 109 -1.075 5.126 22.306 1.00 0.00 C ATOM 1791 CG ASN A 109 -1.923 5.097 23.566 1.00 0.00 C ATOM 1792 OD1 ASN A 109 -2.265 6.142 24.124 1.00 0.00 O ATOM 1793 ND2 ASN A 109 -2.263 3.910 24.023 1.00 0.00 N ATOM 1794 OXT ASN A 109 -2.640 7.387 21.217 1.00 0.00 O ATOM 0 H ASN A 109 -0.232 5.857 20.067 1.00 0.00 H new ATOM 0 HA ASN A 109 -2.381 4.147 20.941 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.415 4.259 22.296 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -0.439 6.011 22.320 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -2.829 3.832 24.868 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -1.960 3.069 23.532 1.00 0.00 H new TER 1801 ASN A 109