USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=10 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 59 THR OG1 : rot 180:sc= 0.26 USER MOD Set 1.2: A 63 LYS NZ :NH3+ -116:sc= 0.0307 (180deg=-0.0866) USER MOD Set 2.1: A 48 GLN : amide:sc= 0.574 K(o=-0.79,f=-1.5) USER MOD Set 2.2: A 52 ASN : amide:sc= -1.36! K(o=-0.79!,f=-1.5) USER MOD Set 3.1: A 5 LYS NZ :NH3+ 141:sc= 0.981 (180deg=-0.305) USER MOD Set 3.2: A 8 GLN : amide:sc= 0.886 K(o=1.9,f=-8.9!) USER MOD Single : A 1 SER N :NH3+ -141:sc= 0.139 (180deg=0) USER MOD Single : A 1 SER OG : rot 110:sc= 0.927 USER MOD Single : A 9 THR OG1 : rot 70:sc= 1.19 USER MOD Single : A 15 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.27) USER MOD Single : A 18 GLN : amide:sc= 1.72 K(o=1.7,f=-7!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 77:sc= 1.19 USER MOD Single : A 34 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.28) USER MOD Single : A 44 GLN : amide:sc= -1.23 X(o=-1.2,f=-0.81) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 64 GLN : amide:sc= -0.833 K(o=-0.83,f=-1.9) USER MOD Single : A 67 GLN : amide:sc= -0.291 K(o=-0.29,f=-1) USER MOD Single : A 70 GLN : amide:sc= -0.12 K(o=-0.12,f=-0.75) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot -88:sc= 1.26 USER MOD Single : A 89 GLN : amide:sc= -0.172 K(o=-0.17,f=-0.82) USER MOD Single : A 96 GLN : amide:sc= -0.0405 X(o=-0.041,f=-0.055) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -154:sc= 1.2 (180deg=0.326) USER MOD Single : A 108 LYS NZ :NH3+ -164:sc= -0.0713 (180deg=-0.363) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 12.418 -0.903 18.782 1.00 0.00 N ATOM 2 CA SER A 1 13.652 -0.383 18.187 1.00 0.00 C ATOM 3 C SER A 1 13.594 1.141 18.049 1.00 0.00 C ATOM 4 O SER A 1 13.998 1.868 18.957 1.00 0.00 O ATOM 5 CB SER A 1 13.892 -1.051 16.832 1.00 0.00 C ATOM 6 OG SER A 1 12.683 -1.113 16.082 1.00 0.00 O ATOM 0 H1 SER A 1 12.648 -1.674 19.441 1.00 0.00 H new ATOM 0 H2 SER A 1 11.933 -0.141 19.297 1.00 0.00 H new ATOM 0 H3 SER A 1 11.796 -1.264 18.031 1.00 0.00 H new ATOM 0 HA SER A 1 14.488 -0.618 18.846 1.00 0.00 H new ATOM 0 HB2 SER A 1 14.644 -0.493 16.274 1.00 0.00 H new ATOM 0 HB3 SER A 1 14.286 -2.056 16.981 1.00 0.00 H new ATOM 0 HG SER A 1 12.737 -0.495 15.323 1.00 0.00 H new ATOM 14 N GLU A 2 13.065 1.621 16.933 1.00 0.00 N ATOM 15 CA GLU A 2 12.965 3.052 16.690 1.00 0.00 C ATOM 16 C GLU A 2 11.552 3.466 16.270 1.00 0.00 C ATOM 17 O GLU A 2 11.097 4.560 16.612 1.00 0.00 O ATOM 18 CB GLU A 2 14.014 3.517 15.652 1.00 0.00 C ATOM 19 CG GLU A 2 14.357 2.492 14.566 1.00 0.00 C ATOM 20 CD GLU A 2 13.150 2.010 13.805 1.00 0.00 C ATOM 21 OE1 GLU A 2 12.725 2.695 12.865 1.00 0.00 O ATOM 22 OE2 GLU A 2 12.602 0.945 14.176 1.00 0.00 O1- ATOM 0 H GLU A 2 12.698 1.039 16.180 1.00 0.00 H new ATOM 0 HA GLU A 2 13.179 3.553 17.634 1.00 0.00 H new ATOM 0 HB2 GLU A 2 13.648 4.424 15.170 1.00 0.00 H new ATOM 0 HB3 GLU A 2 14.930 3.784 16.179 1.00 0.00 H new ATOM 0 HG2 GLU A 2 15.066 2.936 13.867 1.00 0.00 H new ATOM 0 HG3 GLU A 2 14.854 1.638 15.025 1.00 0.00 H new ATOM 29 N PHE A 3 10.879 2.587 15.510 1.00 0.00 N ATOM 30 CA PHE A 3 9.510 2.808 15.020 1.00 0.00 C ATOM 31 C PHE A 3 9.474 3.837 13.873 1.00 0.00 C ATOM 32 O PHE A 3 8.509 3.892 13.106 1.00 0.00 O ATOM 33 CB PHE A 3 8.564 3.221 16.172 1.00 0.00 C ATOM 34 CG PHE A 3 7.136 3.436 15.754 1.00 0.00 C ATOM 35 CD1 PHE A 3 6.309 2.358 15.482 1.00 0.00 C ATOM 36 CD2 PHE A 3 6.622 4.717 15.632 1.00 0.00 C ATOM 37 CE1 PHE A 3 4.998 2.554 15.098 1.00 0.00 C ATOM 38 CE2 PHE A 3 5.312 4.919 15.248 1.00 0.00 C ATOM 39 CZ PHE A 3 4.500 3.837 14.981 1.00 0.00 C ATOM 0 H PHE A 3 11.275 1.694 15.216 1.00 0.00 H new ATOM 0 HA PHE A 3 9.153 1.860 14.617 1.00 0.00 H new ATOM 0 HB2 PHE A 3 8.592 2.451 16.943 1.00 0.00 H new ATOM 0 HB3 PHE A 3 8.940 4.139 16.624 1.00 0.00 H new ATOM 0 HD1 PHE A 3 6.695 1.353 15.572 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.254 5.568 15.840 1.00 0.00 H new ATOM 0 HE1 PHE A 3 4.363 1.706 14.889 1.00 0.00 H new ATOM 0 HE2 PHE A 3 4.924 5.923 15.157 1.00 0.00 H new ATOM 0 HZ PHE A 3 3.474 3.993 14.680 1.00 0.00 H new ATOM 49 N GLU A 4 10.543 4.610 13.737 1.00 0.00 N ATOM 50 CA GLU A 4 10.619 5.654 12.726 1.00 0.00 C ATOM 51 C GLU A 4 10.555 5.089 11.315 1.00 0.00 C ATOM 52 O GLU A 4 9.806 5.585 10.485 1.00 0.00 O ATOM 53 CB GLU A 4 11.893 6.480 12.901 1.00 0.00 C ATOM 54 CG GLU A 4 11.916 7.301 14.176 1.00 0.00 C ATOM 55 CD GLU A 4 10.721 8.220 14.282 1.00 0.00 C ATOM 56 OE1 GLU A 4 10.599 9.143 13.452 1.00 0.00 O ATOM 57 OE2 GLU A 4 9.890 8.024 15.191 1.00 0.00 O1- ATOM 0 H GLU A 4 11.376 4.532 14.320 1.00 0.00 H new ATOM 0 HA GLU A 4 9.751 6.298 12.865 1.00 0.00 H new ATOM 0 HB2 GLU A 4 12.753 5.811 12.895 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.003 7.148 12.047 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.936 6.633 15.037 1.00 0.00 H new ATOM 0 HG3 GLU A 4 12.831 7.892 14.210 1.00 0.00 H new ATOM 64 N LYS A 5 11.312 4.035 11.056 1.00 0.00 N ATOM 65 CA LYS A 5 11.335 3.427 9.732 1.00 0.00 C ATOM 66 C LYS A 5 10.052 2.667 9.461 1.00 0.00 C ATOM 67 O LYS A 5 9.566 2.632 8.326 1.00 0.00 O ATOM 68 CB LYS A 5 12.551 2.512 9.561 1.00 0.00 C ATOM 69 CG LYS A 5 13.743 3.182 8.882 1.00 0.00 C ATOM 70 CD LYS A 5 14.230 4.403 9.647 1.00 0.00 C ATOM 71 CE LYS A 5 15.383 5.087 8.922 1.00 0.00 C ATOM 72 NZ LYS A 5 14.988 5.567 7.568 1.00 0.00 N ATOM 0 H LYS A 5 11.917 3.583 11.741 1.00 0.00 H new ATOM 0 HA LYS A 5 11.416 4.232 9.002 1.00 0.00 H new ATOM 0 HB2 LYS A 5 12.861 2.150 10.541 1.00 0.00 H new ATOM 0 HB3 LYS A 5 12.257 1.640 8.977 1.00 0.00 H new ATOM 0 HG2 LYS A 5 14.558 2.464 8.791 1.00 0.00 H new ATOM 0 HG3 LYS A 5 13.464 3.477 7.870 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.408 5.107 9.773 1.00 0.00 H new ATOM 0 HD3 LYS A 5 14.551 4.105 10.645 1.00 0.00 H new ATOM 0 HE2 LYS A 5 15.735 5.930 9.516 1.00 0.00 H new ATOM 0 HE3 LYS A 5 16.217 4.391 8.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 15.431 6.490 7.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 15.304 4.883 6.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.954 5.664 7.522 1.00 0.00 H new ATOM 86 N LEU A 6 9.496 2.072 10.502 1.00 0.00 N ATOM 87 CA LEU A 6 8.249 1.338 10.377 1.00 0.00 C ATOM 88 C LEU A 6 7.122 2.297 10.008 1.00 0.00 C ATOM 89 O LEU A 6 6.321 2.022 9.111 1.00 0.00 O ATOM 90 CB LEU A 6 7.924 0.606 11.685 1.00 0.00 C ATOM 91 CG LEU A 6 6.664 -0.268 11.669 1.00 0.00 C ATOM 92 CD1 LEU A 6 6.799 -1.394 10.653 1.00 0.00 C ATOM 93 CD2 LEU A 6 6.388 -0.830 13.056 1.00 0.00 C ATOM 0 H LEU A 6 9.888 2.083 11.443 1.00 0.00 H new ATOM 0 HA LEU A 6 8.354 0.594 9.587 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.775 -0.022 11.948 1.00 0.00 H new ATOM 0 HB3 LEU A 6 7.818 1.347 12.477 1.00 0.00 H new ATOM 0 HG LEU A 6 5.820 0.356 11.374 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.893 -2.001 10.660 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.946 -0.971 9.659 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.655 -2.017 10.912 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.490 -1.448 13.026 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.235 -1.436 13.378 1.00 0.00 H new ATOM 0 HD23 LEU A 6 6.241 -0.010 13.758 1.00 0.00 H new ATOM 105 N ARG A 7 7.086 3.434 10.692 1.00 0.00 N ATOM 106 CA ARG A 7 6.088 4.457 10.430 1.00 0.00 C ATOM 107 C ARG A 7 6.361 5.132 9.087 1.00 0.00 C ATOM 108 O ARG A 7 5.437 5.420 8.332 1.00 0.00 O ATOM 109 CB ARG A 7 6.098 5.503 11.539 1.00 0.00 C ATOM 110 CG ARG A 7 4.976 6.523 11.435 1.00 0.00 C ATOM 111 CD ARG A 7 5.452 7.896 11.862 1.00 0.00 C ATOM 112 NE ARG A 7 6.474 8.410 10.947 1.00 0.00 N ATOM 113 CZ ARG A 7 7.699 8.805 11.323 1.00 0.00 C ATOM 114 NH1 ARG A 7 8.046 8.781 12.607 1.00 0.00 N ATOM 115 NH2 ARG A 7 8.569 9.230 10.413 1.00 0.00 N ATOM 0 H ARG A 7 7.742 3.669 11.437 1.00 0.00 H new ATOM 0 HA ARG A 7 5.108 3.981 10.398 1.00 0.00 H new ATOM 0 HB2 ARG A 7 6.028 4.998 12.502 1.00 0.00 H new ATOM 0 HB3 ARG A 7 7.054 6.026 11.523 1.00 0.00 H new ATOM 0 HG2 ARG A 7 4.610 6.563 10.409 1.00 0.00 H new ATOM 0 HG3 ARG A 7 4.139 6.213 12.060 1.00 0.00 H new ATOM 0 HD2 ARG A 7 4.607 8.584 11.891 1.00 0.00 H new ATOM 0 HD3 ARG A 7 5.857 7.845 12.873 1.00 0.00 H new ATOM 0 HE ARG A 7 6.238 8.472 9.957 1.00 0.00 H new ATOM 0 HH11 ARG A 7 7.379 8.461 13.310 1.00 0.00 H new ATOM 0 HH12 ARG A 7 8.979 9.082 12.889 1.00 0.00 H new ATOM 0 HH21 ARG A 7 8.305 9.256 9.428 1.00 0.00 H new ATOM 0 HH22 ARG A 7 9.501 9.530 10.699 1.00 0.00 H new ATOM 129 N GLN A 8 7.645 5.354 8.792 1.00 0.00 N ATOM 130 CA GLN A 8 8.059 6.003 7.546 1.00 0.00 C ATOM 131 C GLN A 8 7.608 5.196 6.348 1.00 0.00 C ATOM 132 O GLN A 8 7.112 5.749 5.372 1.00 0.00 O ATOM 133 CB GLN A 8 9.579 6.174 7.505 1.00 0.00 C ATOM 134 CG GLN A 8 10.097 6.753 6.199 1.00 0.00 C ATOM 135 CD GLN A 8 11.606 6.861 6.157 1.00 0.00 C ATOM 136 OE1 GLN A 8 12.322 6.070 6.779 1.00 0.00 O ATOM 137 NE2 GLN A 8 12.101 7.838 5.422 1.00 0.00 N ATOM 0 H GLN A 8 8.419 5.092 9.403 1.00 0.00 H new ATOM 0 HA GLN A 8 7.590 6.986 7.509 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.884 6.823 8.326 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.049 5.205 7.673 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.760 6.128 5.372 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.663 7.742 6.049 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.474 8.470 4.924 1.00 0.00 H new ATOM 0 HE22 GLN A 8 13.111 7.962 5.352 1.00 0.00 H new ATOM 146 N THR A 9 7.775 3.886 6.427 1.00 0.00 N ATOM 147 CA THR A 9 7.346 3.010 5.360 1.00 0.00 C ATOM 148 C THR A 9 5.831 3.125 5.170 1.00 0.00 C ATOM 149 O THR A 9 5.329 3.076 4.050 1.00 0.00 O ATOM 150 CB THR A 9 7.732 1.547 5.649 1.00 0.00 C ATOM 151 OG1 THR A 9 9.136 1.466 5.941 1.00 0.00 O ATOM 152 CG2 THR A 9 7.419 0.662 4.453 1.00 0.00 C ATOM 0 H THR A 9 8.205 3.410 7.220 1.00 0.00 H new ATOM 0 HA THR A 9 7.851 3.317 4.444 1.00 0.00 H new ATOM 0 HB THR A 9 7.153 1.201 6.505 1.00 0.00 H new ATOM 0 HG1 THR A 9 9.315 1.888 6.807 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.699 -0.367 4.678 1.00 0.00 H new ATOM 0 HG22 THR A 9 6.352 0.708 4.236 1.00 0.00 H new ATOM 0 HG23 THR A 9 7.981 1.010 3.586 1.00 0.00 H new ATOM 160 N GLY A 10 5.118 3.307 6.281 1.00 0.00 N ATOM 161 CA GLY A 10 3.683 3.485 6.225 1.00 0.00 C ATOM 162 C GLY A 10 3.314 4.788 5.543 1.00 0.00 C ATOM 163 O GLY A 10 2.418 4.824 4.699 1.00 0.00 O ATOM 0 H GLY A 10 5.515 3.334 7.220 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.232 2.651 5.688 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.273 3.472 7.235 1.00 0.00 H new ATOM 167 N ASP A 11 4.016 5.863 5.910 1.00 0.00 N ATOM 168 CA ASP A 11 3.798 7.173 5.291 1.00 0.00 C ATOM 169 C ASP A 11 4.137 7.111 3.814 1.00 0.00 C ATOM 170 O ASP A 11 3.398 7.619 2.970 1.00 0.00 O ATOM 171 CB ASP A 11 4.659 8.262 5.960 1.00 0.00 C ATOM 172 CG ASP A 11 4.203 8.626 7.358 1.00 0.00 C ATOM 173 OD1 ASP A 11 3.064 9.124 7.507 1.00 0.00 O ATOM 174 OD2 ASP A 11 4.995 8.446 8.316 1.00 0.00 O1- ATOM 0 H ASP A 11 4.738 5.853 6.630 1.00 0.00 H new ATOM 0 HA ASP A 11 2.747 7.431 5.423 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.693 7.920 6.002 1.00 0.00 H new ATOM 0 HB3 ASP A 11 4.644 9.157 5.338 1.00 0.00 H new ATOM 179 N GLU A 12 5.259 6.467 3.511 1.00 0.00 N ATOM 180 CA GLU A 12 5.734 6.320 2.143 1.00 0.00 C ATOM 181 C GLU A 12 4.720 5.552 1.296 1.00 0.00 C ATOM 182 O GLU A 12 4.529 5.858 0.123 1.00 0.00 O ATOM 183 CB GLU A 12 7.088 5.610 2.125 1.00 0.00 C ATOM 184 CG GLU A 12 7.830 5.729 0.805 1.00 0.00 C ATOM 185 CD GLU A 12 8.228 7.154 0.486 1.00 0.00 C ATOM 186 OE1 GLU A 12 9.157 7.676 1.141 1.00 0.00 O ATOM 187 OE2 GLU A 12 7.632 7.755 -0.429 1.00 0.00 O1- ATOM 0 H GLU A 12 5.864 6.033 4.208 1.00 0.00 H new ATOM 0 HA GLU A 12 5.854 7.315 1.714 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.712 6.020 2.919 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.936 4.555 2.351 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.723 5.105 0.837 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.201 5.343 0.003 1.00 0.00 H new ATOM 194 N LEU A 13 4.067 4.556 1.900 1.00 0.00 N ATOM 195 CA LEU A 13 3.032 3.794 1.204 1.00 0.00 C ATOM 196 C LEU A 13 1.917 4.723 0.767 1.00 0.00 C ATOM 197 O LEU A 13 1.485 4.693 -0.386 1.00 0.00 O ATOM 198 CB LEU A 13 2.462 2.688 2.104 1.00 0.00 C ATOM 199 CG LEU A 13 3.343 1.453 2.300 1.00 0.00 C ATOM 200 CD1 LEU A 13 2.754 0.546 3.369 1.00 0.00 C ATOM 201 CD2 LEU A 13 3.488 0.694 0.990 1.00 0.00 C ATOM 0 H LEU A 13 4.236 4.261 2.862 1.00 0.00 H new ATOM 0 HA LEU A 13 3.483 3.326 0.329 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.253 3.118 3.084 1.00 0.00 H new ATOM 0 HB3 LEU A 13 1.508 2.365 1.687 1.00 0.00 H new ATOM 0 HG LEU A 13 4.330 1.781 2.626 1.00 0.00 H new ATOM 0 HD11 LEU A 13 3.392 -0.328 3.497 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.690 1.089 4.312 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.757 0.226 3.066 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.118 -0.182 1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.505 0.377 0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.946 1.342 0.243 1.00 0.00 H new ATOM 213 N VAL A 14 1.472 5.567 1.690 1.00 0.00 N ATOM 214 CA VAL A 14 0.432 6.536 1.398 1.00 0.00 C ATOM 215 C VAL A 14 0.893 7.468 0.284 1.00 0.00 C ATOM 216 O VAL A 14 0.166 7.712 -0.672 1.00 0.00 O ATOM 217 CB VAL A 14 0.070 7.378 2.650 1.00 0.00 C ATOM 218 CG1 VAL A 14 -1.073 8.340 2.346 1.00 0.00 C ATOM 219 CG2 VAL A 14 -0.288 6.475 3.823 1.00 0.00 C ATOM 0 H VAL A 14 1.819 5.597 2.649 1.00 0.00 H new ATOM 0 HA VAL A 14 -0.456 5.986 1.085 1.00 0.00 H new ATOM 0 HB VAL A 14 0.946 7.966 2.925 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -1.308 8.919 3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.776 9.015 1.543 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -1.952 7.774 2.038 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.538 7.087 4.690 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -1.144 5.855 3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 14 0.562 5.836 4.063 1.00 0.00 H new ATOM 229 N GLN A 15 2.133 7.936 0.396 1.00 0.00 N ATOM 230 CA GLN A 15 2.713 8.852 -0.582 1.00 0.00 C ATOM 231 C GLN A 15 2.781 8.218 -1.963 1.00 0.00 C ATOM 232 O GLN A 15 2.406 8.840 -2.955 1.00 0.00 O ATOM 233 CB GLN A 15 4.119 9.277 -0.148 1.00 0.00 C ATOM 234 CG GLN A 15 4.149 10.085 1.133 1.00 0.00 C ATOM 235 CD GLN A 15 3.393 11.385 1.005 1.00 0.00 C ATOM 236 OE1 GLN A 15 2.196 11.448 1.262 1.00 0.00 O ATOM 237 NE2 GLN A 15 4.085 12.426 0.610 1.00 0.00 N ATOM 0 H GLN A 15 2.761 7.693 1.162 1.00 0.00 H new ATOM 0 HA GLN A 15 2.067 9.728 -0.634 1.00 0.00 H new ATOM 0 HB2 GLN A 15 4.733 8.386 -0.018 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.573 9.864 -0.947 1.00 0.00 H new ATOM 0 HG2 GLN A 15 3.719 9.495 1.943 1.00 0.00 H new ATOM 0 HG3 GLN A 15 5.184 10.294 1.405 1.00 0.00 H new ATOM 0 HE21 GLN A 15 5.080 12.330 0.406 1.00 0.00 H new ATOM 0 HE22 GLN A 15 3.629 13.332 0.506 1.00 0.00 H new ATOM 246 N ALA A 16 3.245 6.979 -2.020 1.00 0.00 N ATOM 247 CA ALA A 16 3.384 6.272 -3.282 1.00 0.00 C ATOM 248 C ALA A 16 2.042 6.122 -3.986 1.00 0.00 C ATOM 249 O ALA A 16 1.937 6.358 -5.186 1.00 0.00 O ATOM 250 CB ALA A 16 4.027 4.915 -3.058 1.00 0.00 C ATOM 0 H ALA A 16 3.533 6.441 -1.202 1.00 0.00 H new ATOM 0 HA ALA A 16 4.031 6.864 -3.930 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.125 4.397 -4.012 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.014 5.049 -2.615 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.405 4.324 -2.386 1.00 0.00 H new ATOM 256 N PHE A 17 1.015 5.749 -3.235 1.00 0.00 N ATOM 257 CA PHE A 17 -0.320 5.600 -3.800 1.00 0.00 C ATOM 258 C PHE A 17 -0.903 6.945 -4.224 1.00 0.00 C ATOM 259 O PHE A 17 -1.568 7.042 -5.259 1.00 0.00 O ATOM 260 CB PHE A 17 -1.255 4.875 -2.839 1.00 0.00 C ATOM 261 CG PHE A 17 -1.021 3.389 -2.785 1.00 0.00 C ATOM 262 CD1 PHE A 17 -0.433 2.806 -1.682 1.00 0.00 C ATOM 263 CD2 PHE A 17 -1.397 2.578 -3.845 1.00 0.00 C ATOM 264 CE1 PHE A 17 -0.222 1.443 -1.629 1.00 0.00 C ATOM 265 CE2 PHE A 17 -1.189 1.214 -3.800 1.00 0.00 C ATOM 266 CZ PHE A 17 -0.603 0.646 -2.690 1.00 0.00 C ATOM 0 H PHE A 17 1.079 5.545 -2.238 1.00 0.00 H new ATOM 0 HA PHE A 17 -0.224 4.986 -4.695 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.131 5.292 -1.839 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.287 5.062 -3.137 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.134 3.424 -0.849 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -1.858 3.019 -4.716 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.240 1.001 -0.759 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -1.485 0.594 -4.633 1.00 0.00 H new ATOM 0 HZ PHE A 17 -0.442 -0.421 -2.650 1.00 0.00 H new ATOM 276 N GLN A 18 -0.654 7.983 -3.428 1.00 0.00 N ATOM 277 CA GLN A 18 -1.120 9.322 -3.766 1.00 0.00 C ATOM 278 C GLN A 18 -0.498 9.774 -5.081 1.00 0.00 C ATOM 279 O GLN A 18 -1.185 10.301 -5.959 1.00 0.00 O ATOM 280 CB GLN A 18 -0.762 10.314 -2.657 1.00 0.00 C ATOM 281 CG GLN A 18 -1.481 10.068 -1.343 1.00 0.00 C ATOM 282 CD GLN A 18 -2.984 10.137 -1.478 1.00 0.00 C ATOM 283 OE1 GLN A 18 -3.514 10.884 -2.303 1.00 0.00 O ATOM 284 NE2 GLN A 18 -3.676 9.359 -0.674 1.00 0.00 N ATOM 0 H GLN A 18 -0.136 7.922 -2.551 1.00 0.00 H new ATOM 0 HA GLN A 18 -2.205 9.292 -3.871 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.313 10.273 -2.483 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -0.991 11.323 -3.000 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -1.200 9.088 -0.958 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -1.152 10.805 -0.610 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -3.193 8.757 -0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -4.695 9.358 -0.718 1.00 0.00 H new ATOM 293 N ARG A 19 0.798 9.524 -5.216 1.00 0.00 N ATOM 294 CA ARG A 19 1.542 9.863 -6.425 1.00 0.00 C ATOM 295 C ARG A 19 1.052 9.032 -7.598 1.00 0.00 C ATOM 296 O ARG A 19 0.963 9.514 -8.726 1.00 0.00 O ATOM 297 CB ARG A 19 3.030 9.607 -6.203 1.00 0.00 C ATOM 298 CG ARG A 19 3.690 10.584 -5.248 1.00 0.00 C ATOM 299 CD ARG A 19 4.956 10.000 -4.641 1.00 0.00 C ATOM 300 NE ARG A 19 5.866 9.454 -5.651 1.00 0.00 N ATOM 301 CZ ARG A 19 6.592 8.341 -5.479 1.00 0.00 C ATOM 302 NH1 ARG A 19 6.494 7.652 -4.347 1.00 0.00 N ATOM 303 NH2 ARG A 19 7.413 7.921 -6.434 1.00 0.00 N ATOM 0 H ARG A 19 1.364 9.081 -4.492 1.00 0.00 H new ATOM 0 HA ARG A 19 1.383 10.918 -6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.160 8.595 -5.819 1.00 0.00 H new ATOM 0 HB3 ARG A 19 3.543 9.652 -7.164 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.931 11.506 -5.778 1.00 0.00 H new ATOM 0 HG3 ARG A 19 2.991 10.846 -4.453 1.00 0.00 H new ATOM 0 HD2 ARG A 19 5.472 10.774 -4.073 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.687 9.213 -3.936 1.00 0.00 H new ATOM 0 HE ARG A 19 5.952 9.951 -6.538 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.866 7.970 -3.609 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.047 6.805 -4.216 1.00 0.00 H new ATOM 0 HH21 ARG A 19 7.494 8.446 -7.305 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.963 7.073 -6.297 1.00 0.00 H new ATOM 317 N LEU A 20 0.717 7.787 -7.310 1.00 0.00 N ATOM 318 CA LEU A 20 0.242 6.857 -8.315 1.00 0.00 C ATOM 319 C LEU A 20 -1.041 7.376 -8.955 1.00 0.00 C ATOM 320 O LEU A 20 -1.192 7.351 -10.175 1.00 0.00 O ATOM 321 CB LEU A 20 -0.011 5.494 -7.669 1.00 0.00 C ATOM 322 CG LEU A 20 -0.249 4.332 -8.623 1.00 0.00 C ATOM 323 CD1 LEU A 20 1.031 3.979 -9.362 1.00 0.00 C ATOM 324 CD2 LEU A 20 -0.779 3.130 -7.866 1.00 0.00 C ATOM 0 H LEU A 20 0.767 7.393 -6.370 1.00 0.00 H new ATOM 0 HA LEU A 20 1.000 6.756 -9.092 1.00 0.00 H new ATOM 0 HB2 LEU A 20 0.844 5.250 -7.038 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.877 5.581 -7.013 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.995 4.633 -9.358 1.00 0.00 H new ATOM 0 HD11 LEU A 20 0.842 3.146 -10.040 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.371 4.842 -9.934 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.800 3.695 -8.643 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.945 2.307 -8.561 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -0.054 2.827 -7.111 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.720 3.391 -7.382 1.00 0.00 H new ATOM 336 N ARG A 21 -1.955 7.863 -8.123 1.00 0.00 N ATOM 337 CA ARG A 21 -3.220 8.402 -8.607 1.00 0.00 C ATOM 338 C ARG A 21 -2.994 9.651 -9.450 1.00 0.00 C ATOM 339 O ARG A 21 -3.630 9.832 -10.488 1.00 0.00 O ATOM 340 CB ARG A 21 -4.155 8.711 -7.441 1.00 0.00 C ATOM 341 CG ARG A 21 -5.500 9.293 -7.865 1.00 0.00 C ATOM 342 CD ARG A 21 -6.498 9.296 -6.719 1.00 0.00 C ATOM 343 NE ARG A 21 -5.978 9.966 -5.529 1.00 0.00 N ATOM 344 CZ ARG A 21 -6.663 10.120 -4.396 1.00 0.00 C ATOM 345 NH1 ARG A 21 -7.941 9.755 -4.329 1.00 0.00 N ATOM 346 NH2 ARG A 21 -6.081 10.662 -3.339 1.00 0.00 N ATOM 0 H ARG A 21 -1.843 7.895 -7.110 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.688 7.645 -9.237 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -4.328 7.796 -6.875 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -3.662 9.413 -6.769 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -5.358 10.311 -8.226 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.902 8.713 -8.696 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -7.414 9.791 -7.040 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -6.762 8.269 -6.468 1.00 0.00 H new ATOM 0 HE ARG A 21 -5.030 10.340 -5.568 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.401 9.355 -5.147 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.461 9.875 -3.460 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.108 10.962 -3.391 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -6.606 10.780 -2.472 1.00 0.00 H new ATOM 360 N GLU A 22 -2.074 10.495 -9.005 1.00 0.00 N ATOM 361 CA GLU A 22 -1.746 11.725 -9.728 1.00 0.00 C ATOM 362 C GLU A 22 -1.226 11.396 -11.124 1.00 0.00 C ATOM 363 O GLU A 22 -1.658 11.980 -12.118 1.00 0.00 O ATOM 364 CB GLU A 22 -0.698 12.540 -8.963 1.00 0.00 C ATOM 365 CG GLU A 22 -1.146 12.988 -7.583 1.00 0.00 C ATOM 366 CD GLU A 22 -0.072 13.754 -6.842 1.00 0.00 C ATOM 367 OE1 GLU A 22 0.775 13.120 -6.192 1.00 0.00 O ATOM 368 OE2 GLU A 22 -0.073 15.002 -6.901 1.00 0.00 O1- ATOM 0 H GLU A 22 -1.539 10.355 -8.148 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.655 12.320 -9.817 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.208 11.943 -8.863 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.437 13.419 -9.552 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.033 13.614 -7.679 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.434 12.115 -6.997 1.00 0.00 H new ATOM 375 N ILE A 23 -0.315 10.443 -11.187 1.00 0.00 N ATOM 376 CA ILE A 23 0.263 10.010 -12.446 1.00 0.00 C ATOM 377 C ILE A 23 -0.787 9.316 -13.325 1.00 0.00 C ATOM 378 O ILE A 23 -0.814 9.505 -14.548 1.00 0.00 O ATOM 379 CB ILE A 23 1.463 9.069 -12.207 1.00 0.00 C ATOM 380 CG1 ILE A 23 2.559 9.812 -11.436 1.00 0.00 C ATOM 381 CG2 ILE A 23 2.005 8.542 -13.524 1.00 0.00 C ATOM 382 CD1 ILE A 23 3.744 8.951 -11.076 1.00 0.00 C ATOM 0 H ILE A 23 0.044 9.949 -10.370 1.00 0.00 H new ATOM 0 HA ILE A 23 0.618 10.898 -12.969 1.00 0.00 H new ATOM 0 HB ILE A 23 1.127 8.217 -11.616 1.00 0.00 H new ATOM 0 HG12 ILE A 23 2.903 10.655 -12.035 1.00 0.00 H new ATOM 0 HG13 ILE A 23 2.131 10.224 -10.522 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.850 7.881 -13.331 1.00 0.00 H new ATOM 0 HG22 ILE A 23 1.223 7.989 -14.044 1.00 0.00 H new ATOM 0 HG23 ILE A 23 2.332 9.377 -14.143 1.00 0.00 H new ATOM 0 HD11 ILE A 23 4.476 9.548 -10.532 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.415 8.122 -10.449 1.00 0.00 H new ATOM 0 HD13 ILE A 23 4.199 8.559 -11.986 1.00 0.00 H new ATOM 394 N PHE A 24 -1.650 8.522 -12.695 1.00 0.00 N ATOM 395 CA PHE A 24 -2.722 7.822 -13.403 1.00 0.00 C ATOM 396 C PHE A 24 -3.680 8.810 -14.061 1.00 0.00 C ATOM 397 O PHE A 24 -4.107 8.610 -15.203 1.00 0.00 O ATOM 398 CB PHE A 24 -3.493 6.901 -12.445 1.00 0.00 C ATOM 399 CG PHE A 24 -4.742 6.317 -13.048 1.00 0.00 C ATOM 400 CD1 PHE A 24 -4.664 5.390 -14.075 1.00 0.00 C ATOM 401 CD2 PHE A 24 -5.993 6.704 -12.591 1.00 0.00 C ATOM 402 CE1 PHE A 24 -5.809 4.863 -14.635 1.00 0.00 C ATOM 403 CE2 PHE A 24 -7.142 6.178 -13.148 1.00 0.00 C ATOM 404 CZ PHE A 24 -7.050 5.257 -14.171 1.00 0.00 C ATOM 0 H PHE A 24 -1.628 8.346 -11.691 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.264 7.214 -14.183 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.838 6.089 -12.129 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.760 7.463 -11.550 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.697 5.077 -14.441 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -6.069 7.425 -11.790 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -5.736 4.142 -15.436 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -8.111 6.487 -12.784 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.947 4.844 -14.609 1.00 0.00 H new ATOM 414 N ASP A 25 -4.006 9.875 -13.341 1.00 0.00 N ATOM 415 CA ASP A 25 -4.912 10.902 -13.850 1.00 0.00 C ATOM 416 C ASP A 25 -4.316 11.581 -15.079 1.00 0.00 C ATOM 417 O ASP A 25 -5.037 11.985 -15.998 1.00 0.00 O ATOM 418 CB ASP A 25 -5.208 11.942 -12.765 1.00 0.00 C ATOM 419 CG ASP A 25 -6.242 12.960 -13.201 1.00 0.00 C ATOM 420 OD1 ASP A 25 -7.448 12.638 -13.171 1.00 0.00 O ATOM 421 OD2 ASP A 25 -5.859 14.094 -13.567 1.00 0.00 O1- ATOM 0 H ASP A 25 -3.656 10.053 -12.399 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.847 10.420 -14.137 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -5.559 11.435 -11.867 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.285 12.458 -12.500 1.00 0.00 H new ATOM 426 N LYS A 26 -2.993 11.689 -15.097 1.00 0.00 N ATOM 427 CA LYS A 26 -2.289 12.292 -16.219 1.00 0.00 C ATOM 428 C LYS A 26 -2.123 11.283 -17.353 1.00 0.00 C ATOM 429 O LYS A 26 -1.863 11.655 -18.499 1.00 0.00 O ATOM 430 CB LYS A 26 -0.927 12.819 -15.771 1.00 0.00 C ATOM 431 CG LYS A 26 -1.013 13.873 -14.680 1.00 0.00 C ATOM 432 CD LYS A 26 0.359 14.387 -14.295 1.00 0.00 C ATOM 433 CE LYS A 26 0.263 15.468 -13.228 1.00 0.00 C ATOM 434 NZ LYS A 26 1.584 16.069 -12.936 1.00 0.00 N ATOM 0 H LYS A 26 -2.386 11.365 -14.344 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.881 13.129 -16.588 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.324 11.985 -15.412 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.408 13.240 -16.632 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.631 14.703 -15.023 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.504 13.451 -13.803 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.969 13.562 -13.927 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.861 14.786 -15.176 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.425 16.246 -13.559 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.153 15.042 -12.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.478 16.801 -12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.234 15.331 -12.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.969 16.498 -13.802 1.00 0.00 H new ATOM 448 N GLY A 27 -2.285 10.009 -17.028 1.00 0.00 N ATOM 449 CA GLY A 27 -2.212 8.968 -18.029 1.00 0.00 C ATOM 450 C GLY A 27 -0.795 8.596 -18.417 1.00 0.00 C ATOM 451 O GLY A 27 -0.555 8.165 -19.543 1.00 0.00 O ATOM 0 H GLY A 27 -2.467 9.677 -16.081 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.722 8.080 -17.655 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.750 9.294 -18.919 1.00 0.00 H new ATOM 455 N ASP A 28 0.147 8.769 -17.507 1.00 0.00 N ATOM 456 CA ASP A 28 1.542 8.429 -17.797 1.00 0.00 C ATOM 457 C ASP A 28 1.828 6.985 -17.382 1.00 0.00 C ATOM 458 O ASP A 28 2.154 6.714 -16.227 1.00 0.00 O ATOM 459 CB ASP A 28 2.501 9.391 -17.088 1.00 0.00 C ATOM 460 CG ASP A 28 3.925 9.316 -17.623 1.00 0.00 C ATOM 461 OD1 ASP A 28 4.657 8.372 -17.271 1.00 0.00 O ATOM 462 OD2 ASP A 28 4.326 10.224 -18.382 1.00 0.00 O1- ATOM 0 H ASP A 28 -0.018 9.138 -16.570 1.00 0.00 H new ATOM 0 HA ASP A 28 1.703 8.526 -18.871 1.00 0.00 H new ATOM 0 HB2 ASP A 28 2.131 10.410 -17.198 1.00 0.00 H new ATOM 0 HB3 ASP A 28 2.508 9.168 -16.021 1.00 0.00 H new ATOM 467 N ASP A 29 1.678 6.067 -18.331 1.00 0.00 N ATOM 468 CA ASP A 29 1.864 4.627 -18.086 1.00 0.00 C ATOM 469 C ASP A 29 3.278 4.309 -17.612 1.00 0.00 C ATOM 470 O ASP A 29 3.472 3.482 -16.718 1.00 0.00 O ATOM 471 CB ASP A 29 1.549 3.825 -19.359 1.00 0.00 C ATOM 472 CG ASP A 29 1.853 2.337 -19.221 1.00 0.00 C ATOM 473 OD1 ASP A 29 1.028 1.607 -18.641 1.00 0.00 O ATOM 474 OD2 ASP A 29 2.914 1.890 -19.713 1.00 0.00 O1- ATOM 0 H ASP A 29 1.424 6.292 -19.293 1.00 0.00 H new ATOM 0 HA ASP A 29 1.173 4.340 -17.293 1.00 0.00 H new ATOM 0 HB2 ASP A 29 0.496 3.953 -19.610 1.00 0.00 H new ATOM 0 HB3 ASP A 29 2.126 4.232 -20.189 1.00 0.00 H new ATOM 479 N ASP A 30 4.256 4.981 -18.198 1.00 0.00 N ATOM 480 CA ASP A 30 5.657 4.744 -17.865 1.00 0.00 C ATOM 481 C ASP A 30 5.939 5.021 -16.390 1.00 0.00 C ATOM 482 O ASP A 30 6.502 4.173 -15.689 1.00 0.00 O ATOM 483 CB ASP A 30 6.571 5.596 -18.751 1.00 0.00 C ATOM 484 CG ASP A 30 8.024 5.521 -18.329 1.00 0.00 C ATOM 485 OD1 ASP A 30 8.624 4.439 -18.434 1.00 0.00 O ATOM 486 OD2 ASP A 30 8.573 6.552 -17.890 1.00 0.00 O1- ATOM 0 H ASP A 30 4.108 5.697 -18.909 1.00 0.00 H new ATOM 0 HA ASP A 30 5.866 3.691 -18.051 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.479 5.266 -19.786 1.00 0.00 H new ATOM 0 HB3 ASP A 30 6.240 6.634 -18.717 1.00 0.00 H new ATOM 491 N SER A 31 5.528 6.189 -15.916 1.00 0.00 N ATOM 492 CA SER A 31 5.734 6.553 -14.524 1.00 0.00 C ATOM 493 C SER A 31 4.821 5.741 -13.614 1.00 0.00 C ATOM 494 O SER A 31 5.202 5.378 -12.505 1.00 0.00 O ATOM 495 CB SER A 31 5.495 8.049 -14.315 1.00 0.00 C ATOM 496 OG SER A 31 6.266 8.818 -15.222 1.00 0.00 O ATOM 0 H SER A 31 5.052 6.898 -16.474 1.00 0.00 H new ATOM 0 HA SER A 31 6.769 6.328 -14.266 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.437 8.274 -14.450 1.00 0.00 H new ATOM 0 HB3 SER A 31 5.751 8.322 -13.291 1.00 0.00 H new ATOM 0 HG SER A 31 5.844 8.801 -16.106 1.00 0.00 H new ATOM 502 N LEU A 32 3.625 5.434 -14.106 1.00 0.00 N ATOM 503 CA LEU A 32 2.648 4.674 -13.338 1.00 0.00 C ATOM 504 C LEU A 32 3.206 3.298 -13.008 1.00 0.00 C ATOM 505 O LEU A 32 3.152 2.848 -11.864 1.00 0.00 O ATOM 506 CB LEU A 32 1.357 4.524 -14.151 1.00 0.00 C ATOM 507 CG LEU A 32 0.169 3.897 -13.424 1.00 0.00 C ATOM 508 CD1 LEU A 32 -0.404 4.863 -12.406 1.00 0.00 C ATOM 509 CD2 LEU A 32 -0.897 3.470 -14.417 1.00 0.00 C ATOM 0 H LEU A 32 3.309 5.702 -15.038 1.00 0.00 H new ATOM 0 HA LEU A 32 2.432 5.204 -12.411 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.059 5.511 -14.506 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.576 3.921 -15.032 1.00 0.00 H new ATOM 0 HG LEU A 32 0.519 3.011 -12.894 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.249 4.398 -11.899 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.363 5.118 -11.674 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.738 5.769 -12.912 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.736 3.025 -13.882 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.243 4.340 -14.976 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.479 2.738 -15.108 1.00 0.00 H new ATOM 521 N GLU A 33 3.767 2.655 -14.014 1.00 0.00 N ATOM 522 CA GLU A 33 4.358 1.345 -13.859 1.00 0.00 C ATOM 523 C GLU A 33 5.577 1.407 -12.939 1.00 0.00 C ATOM 524 O GLU A 33 5.780 0.534 -12.094 1.00 0.00 O ATOM 525 CB GLU A 33 4.759 0.804 -15.222 1.00 0.00 C ATOM 526 CG GLU A 33 5.219 -0.631 -15.201 1.00 0.00 C ATOM 527 CD GLU A 33 5.761 -1.068 -16.531 1.00 0.00 C ATOM 528 OE1 GLU A 33 6.997 -1.110 -16.685 1.00 0.00 O ATOM 529 OE2 GLU A 33 4.958 -1.355 -17.438 1.00 0.00 O1- ATOM 0 H GLU A 33 3.825 3.029 -14.961 1.00 0.00 H new ATOM 0 HA GLU A 33 3.623 0.679 -13.406 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.911 0.893 -15.901 1.00 0.00 H new ATOM 0 HB3 GLU A 33 5.558 1.425 -15.627 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.988 -0.754 -14.438 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.385 -1.275 -14.920 1.00 0.00 H new ATOM 536 N GLN A 34 6.374 2.456 -13.102 1.00 0.00 N ATOM 537 CA GLN A 34 7.587 2.637 -12.314 1.00 0.00 C ATOM 538 C GLN A 34 7.254 2.785 -10.826 1.00 0.00 C ATOM 539 O GLN A 34 7.955 2.245 -9.962 1.00 0.00 O ATOM 540 CB GLN A 34 8.360 3.861 -12.814 1.00 0.00 C ATOM 541 CG GLN A 34 9.770 3.979 -12.256 1.00 0.00 C ATOM 542 CD GLN A 34 10.647 2.796 -12.630 1.00 0.00 C ATOM 543 OE1 GLN A 34 10.716 1.803 -11.907 1.00 0.00 O ATOM 544 NE2 GLN A 34 11.312 2.889 -13.762 1.00 0.00 N ATOM 0 H GLN A 34 6.200 3.200 -13.778 1.00 0.00 H new ATOM 0 HA GLN A 34 8.212 1.752 -12.434 1.00 0.00 H new ATOM 0 HB2 GLN A 34 8.414 3.823 -13.902 1.00 0.00 H new ATOM 0 HB3 GLN A 34 7.802 4.760 -12.554 1.00 0.00 H new ATOM 0 HG2 GLN A 34 10.227 4.897 -12.625 1.00 0.00 H new ATOM 0 HG3 GLN A 34 9.721 4.062 -11.170 1.00 0.00 H new ATOM 0 HE21 GLN A 34 11.229 3.729 -14.335 1.00 0.00 H new ATOM 0 HE22 GLN A 34 11.910 2.121 -14.067 1.00 0.00 H new ATOM 553 N VAL A 35 6.181 3.509 -10.533 1.00 0.00 N ATOM 554 CA VAL A 35 5.739 3.702 -9.158 1.00 0.00 C ATOM 555 C VAL A 35 5.207 2.396 -8.568 1.00 0.00 C ATOM 556 O VAL A 35 5.393 2.127 -7.384 1.00 0.00 O ATOM 557 CB VAL A 35 4.675 4.825 -9.034 1.00 0.00 C ATOM 558 CG1 VAL A 35 4.171 4.946 -7.600 1.00 0.00 C ATOM 559 CG2 VAL A 35 5.260 6.149 -9.490 1.00 0.00 C ATOM 0 H VAL A 35 5.600 3.973 -11.231 1.00 0.00 H new ATOM 0 HA VAL A 35 6.612 4.017 -8.587 1.00 0.00 H new ATOM 0 HB VAL A 35 3.831 4.565 -9.673 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.427 5.740 -7.542 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.720 4.003 -7.292 1.00 0.00 H new ATOM 0 HG13 VAL A 35 5.006 5.182 -6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.506 6.931 -9.399 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.120 6.400 -8.869 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.576 6.068 -10.530 1.00 0.00 H new ATOM 569 N LEU A 36 4.570 1.571 -9.404 1.00 0.00 N ATOM 570 CA LEU A 36 4.040 0.283 -8.945 1.00 0.00 C ATOM 571 C LEU A 36 5.168 -0.576 -8.384 1.00 0.00 C ATOM 572 O LEU A 36 4.995 -1.272 -7.382 1.00 0.00 O ATOM 573 CB LEU A 36 3.347 -0.469 -10.093 1.00 0.00 C ATOM 574 CG LEU A 36 2.099 0.192 -10.686 1.00 0.00 C ATOM 575 CD1 LEU A 36 1.586 -0.610 -11.871 1.00 0.00 C ATOM 576 CD2 LEU A 36 1.010 0.329 -9.634 1.00 0.00 C ATOM 0 H LEU A 36 4.410 1.768 -10.392 1.00 0.00 H new ATOM 0 HA LEU A 36 3.306 0.480 -8.164 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.072 -0.611 -10.895 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.070 -1.460 -9.734 1.00 0.00 H new ATOM 0 HG LEU A 36 2.373 1.189 -11.030 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.699 -0.127 -12.281 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.359 -0.660 -12.638 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.332 -1.619 -11.545 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.133 0.801 -10.077 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.740 -0.658 -9.259 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.375 0.943 -8.810 1.00 0.00 H new ATOM 588 N GLU A 37 6.328 -0.506 -9.027 1.00 0.00 N ATOM 589 CA GLU A 37 7.501 -1.237 -8.574 1.00 0.00 C ATOM 590 C GLU A 37 7.939 -0.732 -7.200 1.00 0.00 C ATOM 591 O GLU A 37 8.263 -1.523 -6.306 1.00 0.00 O ATOM 592 CB GLU A 37 8.645 -1.079 -9.573 1.00 0.00 C ATOM 593 CG GLU A 37 9.875 -1.900 -9.226 1.00 0.00 C ATOM 594 CD GLU A 37 11.017 -1.662 -10.178 1.00 0.00 C ATOM 595 OE1 GLU A 37 10.887 -2.018 -11.371 1.00 0.00 O ATOM 596 OE2 GLU A 37 12.058 -1.129 -9.742 1.00 0.00 O1- ATOM 0 H GLU A 37 6.479 0.053 -9.867 1.00 0.00 H new ATOM 0 HA GLU A 37 7.242 -2.293 -8.499 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.293 -1.368 -10.563 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.925 -0.027 -9.628 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.195 -1.658 -8.213 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.615 -2.958 -9.234 1.00 0.00 H new ATOM 603 N GLU A 38 7.935 0.592 -7.041 1.00 0.00 N ATOM 604 CA GLU A 38 8.309 1.226 -5.813 1.00 0.00 C ATOM 605 C GLU A 38 7.366 0.806 -4.699 1.00 0.00 C ATOM 606 O GLU A 38 7.798 0.455 -3.599 1.00 0.00 O ATOM 607 CB GLU A 38 8.256 2.735 -5.997 1.00 0.00 C ATOM 608 CG GLU A 38 8.869 3.492 -4.868 1.00 0.00 C ATOM 609 CD GLU A 38 8.555 4.974 -4.912 1.00 0.00 C ATOM 610 OE1 GLU A 38 8.956 5.652 -5.885 1.00 0.00 O ATOM 611 OE2 GLU A 38 7.920 5.477 -3.967 1.00 0.00 O1- ATOM 0 H GLU A 38 7.667 1.245 -7.778 1.00 0.00 H new ATOM 0 HA GLU A 38 9.321 0.925 -5.542 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.769 2.999 -6.922 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.217 3.043 -6.109 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.513 3.078 -3.924 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.950 3.354 -4.889 1.00 0.00 H new ATOM 618 N ILE A 39 6.078 0.824 -5.003 1.00 0.00 N ATOM 619 CA ILE A 39 5.055 0.435 -4.052 1.00 0.00 C ATOM 620 C ILE A 39 5.268 -1.001 -3.606 1.00 0.00 C ATOM 621 O ILE A 39 5.119 -1.323 -2.429 1.00 0.00 O ATOM 622 CB ILE A 39 3.638 0.576 -4.660 1.00 0.00 C ATOM 623 CG1 ILE A 39 3.352 2.037 -5.007 1.00 0.00 C ATOM 624 CG2 ILE A 39 2.585 0.040 -3.701 1.00 0.00 C ATOM 625 CD1 ILE A 39 2.025 2.256 -5.699 1.00 0.00 C ATOM 0 H ILE A 39 5.716 1.108 -5.913 1.00 0.00 H new ATOM 0 HA ILE A 39 5.134 1.102 -3.193 1.00 0.00 H new ATOM 0 HB ILE A 39 3.596 -0.014 -5.576 1.00 0.00 H new ATOM 0 HG12 ILE A 39 3.375 2.628 -4.092 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.151 2.411 -5.648 1.00 0.00 H new ATOM 0 HG21 ILE A 39 1.597 0.149 -4.148 1.00 0.00 H new ATOM 0 HG22 ILE A 39 2.778 -1.014 -3.500 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.624 0.601 -2.767 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.896 3.317 -5.912 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.004 1.694 -6.633 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.217 1.915 -5.052 1.00 0.00 H new ATOM 637 N GLU A 40 5.655 -1.851 -4.544 1.00 0.00 N ATOM 638 CA GLU A 40 5.873 -3.253 -4.247 1.00 0.00 C ATOM 639 C GLU A 40 7.022 -3.417 -3.261 1.00 0.00 C ATOM 640 O GLU A 40 6.934 -4.209 -2.318 1.00 0.00 O ATOM 641 CB GLU A 40 6.138 -4.046 -5.524 1.00 0.00 C ATOM 642 CG GLU A 40 6.360 -5.526 -5.280 1.00 0.00 C ATOM 643 CD GLU A 40 6.509 -6.312 -6.554 1.00 0.00 C ATOM 644 OE1 GLU A 40 7.571 -6.212 -7.198 1.00 0.00 O ATOM 645 OE2 GLU A 40 5.571 -7.050 -6.911 1.00 0.00 O1- ATOM 0 H GLU A 40 5.824 -1.592 -5.516 1.00 0.00 H new ATOM 0 HA GLU A 40 4.967 -3.649 -3.788 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.294 -3.920 -6.203 1.00 0.00 H new ATOM 0 HB3 GLU A 40 7.014 -3.633 -6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.254 -5.659 -4.670 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.522 -5.925 -4.708 1.00 0.00 H new ATOM 652 N GLU A 41 8.092 -2.653 -3.471 1.00 0.00 N ATOM 653 CA GLU A 41 9.237 -2.691 -2.574 1.00 0.00 C ATOM 654 C GLU A 41 8.814 -2.258 -1.178 1.00 0.00 C ATOM 655 O GLU A 41 9.154 -2.899 -0.186 1.00 0.00 O ATOM 656 CB GLU A 41 10.359 -1.777 -3.080 1.00 0.00 C ATOM 657 CG GLU A 41 11.605 -1.809 -2.206 1.00 0.00 C ATOM 658 CD GLU A 41 12.646 -0.792 -2.617 1.00 0.00 C ATOM 659 OE1 GLU A 41 13.290 -0.982 -3.670 1.00 0.00 O ATOM 660 OE2 GLU A 41 12.847 0.193 -1.872 1.00 0.00 O1- ATOM 0 H GLU A 41 8.187 -2.004 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 41 9.613 -3.714 -2.541 1.00 0.00 H new ATOM 0 HB2 GLU A 41 10.628 -2.072 -4.094 1.00 0.00 H new ATOM 0 HB3 GLU A 41 9.988 -0.754 -3.133 1.00 0.00 H new ATOM 0 HG2 GLU A 41 11.319 -1.628 -1.170 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.044 -2.806 -2.246 1.00 0.00 H new ATOM 667 N LEU A 42 8.046 -1.178 -1.121 1.00 0.00 N ATOM 668 CA LEU A 42 7.562 -0.634 0.139 1.00 0.00 C ATOM 669 C LEU A 42 6.674 -1.640 0.864 1.00 0.00 C ATOM 670 O LEU A 42 6.787 -1.814 2.075 1.00 0.00 O ATOM 671 CB LEU A 42 6.793 0.662 -0.105 1.00 0.00 C ATOM 672 CG LEU A 42 7.573 1.780 -0.795 1.00 0.00 C ATOM 673 CD1 LEU A 42 6.664 2.962 -1.082 1.00 0.00 C ATOM 674 CD2 LEU A 42 8.762 2.211 0.056 1.00 0.00 C ATOM 0 H LEU A 42 7.743 -0.657 -1.944 1.00 0.00 H new ATOM 0 HA LEU A 42 8.425 -0.423 0.770 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.914 0.433 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.433 1.035 0.854 1.00 0.00 H new ATOM 0 HG LEU A 42 7.953 1.400 -1.743 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.235 3.749 -1.574 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.849 2.645 -1.733 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.254 3.341 -0.146 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.304 3.008 -0.453 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.407 2.573 1.021 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.427 1.361 0.210 1.00 0.00 H new ATOM 686 N ILE A 43 5.797 -2.305 0.115 1.00 0.00 N ATOM 687 CA ILE A 43 4.907 -3.309 0.691 1.00 0.00 C ATOM 688 C ILE A 43 5.709 -4.446 1.313 1.00 0.00 C ATOM 689 O ILE A 43 5.447 -4.858 2.449 1.00 0.00 O ATOM 690 CB ILE A 43 3.932 -3.888 -0.370 1.00 0.00 C ATOM 691 CG1 ILE A 43 2.961 -2.805 -0.852 1.00 0.00 C ATOM 692 CG2 ILE A 43 3.166 -5.086 0.191 1.00 0.00 C ATOM 693 CD1 ILE A 43 2.019 -3.271 -1.941 1.00 0.00 C ATOM 0 H ILE A 43 5.684 -2.167 -0.889 1.00 0.00 H new ATOM 0 HA ILE A 43 4.321 -2.811 1.464 1.00 0.00 H new ATOM 0 HB ILE A 43 4.519 -4.231 -1.222 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.375 -2.452 -0.004 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.534 -1.954 -1.220 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.490 -5.474 -0.570 1.00 0.00 H new ATOM 0 HG22 ILE A 43 3.871 -5.865 0.481 1.00 0.00 H new ATOM 0 HG23 ILE A 43 2.591 -4.774 1.063 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.363 -2.450 -2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 43 2.596 -3.597 -2.807 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.419 -4.102 -1.572 1.00 0.00 H new ATOM 705 N GLN A 44 6.700 -4.934 0.577 1.00 0.00 N ATOM 706 CA GLN A 44 7.540 -6.016 1.062 1.00 0.00 C ATOM 707 C GLN A 44 8.352 -5.564 2.264 1.00 0.00 C ATOM 708 O GLN A 44 8.438 -6.272 3.262 1.00 0.00 O ATOM 709 CB GLN A 44 8.470 -6.523 -0.040 1.00 0.00 C ATOM 710 CG GLN A 44 7.744 -7.101 -1.244 1.00 0.00 C ATOM 711 CD GLN A 44 8.693 -7.694 -2.264 1.00 0.00 C ATOM 712 OE1 GLN A 44 9.762 -8.195 -1.918 1.00 0.00 O ATOM 713 NE2 GLN A 44 8.312 -7.640 -3.523 1.00 0.00 N ATOM 0 H GLN A 44 6.939 -4.597 -0.355 1.00 0.00 H new ATOM 0 HA GLN A 44 6.889 -6.835 1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.105 -5.702 -0.372 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.127 -7.287 0.376 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.048 -7.870 -0.910 1.00 0.00 H new ATOM 0 HG3 GLN A 44 7.151 -6.318 -1.717 1.00 0.00 H new ATOM 0 HE21 GLN A 44 7.417 -7.216 -3.767 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.912 -8.023 -4.254 1.00 0.00 H new ATOM 722 N LYS A 45 8.921 -4.369 2.169 1.00 0.00 N ATOM 723 CA LYS A 45 9.736 -3.812 3.239 1.00 0.00 C ATOM 724 C LYS A 45 8.916 -3.626 4.516 1.00 0.00 C ATOM 725 O LYS A 45 9.362 -3.981 5.600 1.00 0.00 O ATOM 726 CB LYS A 45 10.346 -2.476 2.798 1.00 0.00 C ATOM 727 CG LYS A 45 11.291 -1.855 3.815 1.00 0.00 C ATOM 728 CD LYS A 45 11.908 -0.574 3.281 1.00 0.00 C ATOM 729 CE LYS A 45 12.886 0.026 4.275 1.00 0.00 C ATOM 730 NZ LYS A 45 13.558 1.235 3.734 1.00 0.00 N ATOM 0 H LYS A 45 8.831 -3.763 1.354 1.00 0.00 H new ATOM 0 HA LYS A 45 10.541 -4.515 3.455 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.885 -2.627 1.863 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.540 -1.772 2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.749 -1.644 4.737 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.079 -2.565 4.064 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.422 -0.780 2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.121 0.147 3.062 1.00 0.00 H new ATOM 0 HE2 LYS A 45 12.357 0.285 5.192 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.637 -0.719 4.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.217 1.613 4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 14.084 0.984 2.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.844 1.956 3.506 1.00 0.00 H new ATOM 744 N HIS A 46 7.711 -3.089 4.375 1.00 0.00 N ATOM 745 CA HIS A 46 6.833 -2.862 5.521 1.00 0.00 C ATOM 746 C HIS A 46 6.459 -4.185 6.178 1.00 0.00 C ATOM 747 O HIS A 46 6.534 -4.330 7.402 1.00 0.00 O ATOM 748 CB HIS A 46 5.570 -2.107 5.085 1.00 0.00 C ATOM 749 CG HIS A 46 4.700 -1.657 6.222 1.00 0.00 C ATOM 750 ND1 HIS A 46 5.039 -0.654 7.109 1.00 0.00 N ATOM 751 CD2 HIS A 46 3.481 -2.092 6.603 1.00 0.00 C ATOM 752 CE1 HIS A 46 4.034 -0.522 7.981 1.00 0.00 C ATOM 753 NE2 HIS A 46 3.061 -1.371 7.718 1.00 0.00 N ATOM 0 H HIS A 46 7.317 -2.802 3.479 1.00 0.00 H new ATOM 0 HA HIS A 46 7.368 -2.254 6.250 1.00 0.00 H new ATOM 0 HB2 HIS A 46 5.865 -1.235 4.501 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.985 -2.749 4.427 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.919 -2.877 6.119 1.00 0.00 H new ATOM 0 HE1 HIS A 46 4.021 0.188 8.795 1.00 0.00 H new ATOM 0 HE2 HIS A 46 2.183 -1.478 8.226 1.00 0.00 H new ATOM 761 N ARG A 47 6.074 -5.154 5.355 1.00 0.00 N ATOM 762 CA ARG A 47 5.697 -6.470 5.846 1.00 0.00 C ATOM 763 C ARG A 47 6.900 -7.151 6.492 1.00 0.00 C ATOM 764 O ARG A 47 6.760 -7.894 7.466 1.00 0.00 O ATOM 765 CB ARG A 47 5.148 -7.326 4.696 1.00 0.00 C ATOM 766 CG ARG A 47 4.442 -8.605 5.138 1.00 0.00 C ATOM 767 CD ARG A 47 5.181 -9.852 4.670 1.00 0.00 C ATOM 768 NE ARG A 47 6.431 -10.071 5.405 1.00 0.00 N ATOM 769 CZ ARG A 47 7.508 -10.679 4.897 1.00 0.00 C ATOM 770 NH1 ARG A 47 7.508 -11.097 3.635 1.00 0.00 N ATOM 771 NH2 ARG A 47 8.583 -10.869 5.653 1.00 0.00 N ATOM 0 H ARG A 47 6.015 -5.050 4.342 1.00 0.00 H new ATOM 0 HA ARG A 47 4.915 -6.358 6.597 1.00 0.00 H new ATOM 0 HB2 ARG A 47 4.451 -6.724 4.113 1.00 0.00 H new ATOM 0 HB3 ARG A 47 5.971 -7.591 4.033 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.360 -8.618 6.225 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.427 -8.615 4.742 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.534 -10.721 4.792 1.00 0.00 H new ATOM 0 HD3 ARG A 47 5.399 -9.763 3.606 1.00 0.00 H new ATOM 0 HE ARG A 47 6.482 -9.737 6.368 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.684 -10.954 3.050 1.00 0.00 H new ATOM 0 HH12 ARG A 47 8.332 -11.560 3.251 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.588 -10.551 6.622 1.00 0.00 H new ATOM 0 HH22 ARG A 47 9.404 -11.333 5.265 1.00 0.00 H new ATOM 785 N GLN A 48 8.079 -6.892 5.943 1.00 0.00 N ATOM 786 CA GLN A 48 9.308 -7.449 6.465 1.00 0.00 C ATOM 787 C GLN A 48 9.633 -6.833 7.823 1.00 0.00 C ATOM 788 O GLN A 48 9.942 -7.542 8.774 1.00 0.00 O ATOM 789 CB GLN A 48 10.451 -7.175 5.484 1.00 0.00 C ATOM 790 CG GLN A 48 11.782 -7.769 5.894 1.00 0.00 C ATOM 791 CD GLN A 48 11.816 -9.280 5.772 1.00 0.00 C ATOM 792 OE1 GLN A 48 11.167 -9.862 4.905 1.00 0.00 O ATOM 793 NE2 GLN A 48 12.559 -9.921 6.641 1.00 0.00 N ATOM 0 H GLN A 48 8.205 -6.292 5.128 1.00 0.00 H new ATOM 0 HA GLN A 48 9.186 -8.525 6.589 1.00 0.00 H new ATOM 0 HB2 GLN A 48 10.177 -7.570 4.506 1.00 0.00 H new ATOM 0 HB3 GLN A 48 10.567 -6.097 5.372 1.00 0.00 H new ATOM 0 HG2 GLN A 48 12.571 -7.342 5.275 1.00 0.00 H new ATOM 0 HG3 GLN A 48 11.998 -7.488 6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 48 13.083 -9.402 7.345 1.00 0.00 H new ATOM 0 HE22 GLN A 48 12.613 -10.939 6.613 1.00 0.00 H new ATOM 802 N LEU A 49 9.515 -5.511 7.912 1.00 0.00 N ATOM 803 CA LEU A 49 9.815 -4.792 9.146 1.00 0.00 C ATOM 804 C LEU A 49 8.878 -5.201 10.268 1.00 0.00 C ATOM 805 O LEU A 49 9.320 -5.470 11.383 1.00 0.00 O ATOM 806 CB LEU A 49 9.737 -3.276 8.930 1.00 0.00 C ATOM 807 CG LEU A 49 10.768 -2.679 7.969 1.00 0.00 C ATOM 808 CD1 LEU A 49 10.567 -1.179 7.837 1.00 0.00 C ATOM 809 CD2 LEU A 49 12.183 -2.989 8.437 1.00 0.00 C ATOM 0 H LEU A 49 9.213 -4.915 7.142 1.00 0.00 H new ATOM 0 HA LEU A 49 10.833 -5.056 9.434 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.741 -3.033 8.559 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.845 -2.786 9.897 1.00 0.00 H new ATOM 0 HG LEU A 49 10.625 -3.134 6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 49 11.309 -0.772 7.150 1.00 0.00 H new ATOM 0 HD12 LEU A 49 9.567 -0.978 7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 49 10.681 -0.709 8.814 1.00 0.00 H new ATOM 0 HD21 LEU A 49 12.900 -2.556 7.740 1.00 0.00 H new ATOM 0 HD22 LEU A 49 12.339 -2.565 9.429 1.00 0.00 H new ATOM 0 HD23 LEU A 49 12.324 -4.069 8.478 1.00 0.00 H new ATOM 821 N PHE A 50 7.590 -5.265 9.966 1.00 0.00 N ATOM 822 CA PHE A 50 6.595 -5.624 10.966 1.00 0.00 C ATOM 823 C PHE A 50 6.823 -7.044 11.473 1.00 0.00 C ATOM 824 O PHE A 50 6.862 -7.280 12.681 1.00 0.00 O ATOM 825 CB PHE A 50 5.180 -5.487 10.385 1.00 0.00 C ATOM 826 CG PHE A 50 4.084 -5.844 11.356 1.00 0.00 C ATOM 827 CD1 PHE A 50 3.698 -4.952 12.345 1.00 0.00 C ATOM 828 CD2 PHE A 50 3.440 -7.071 11.277 1.00 0.00 C ATOM 829 CE1 PHE A 50 2.692 -5.277 13.236 1.00 0.00 C ATOM 830 CE2 PHE A 50 2.435 -7.400 12.166 1.00 0.00 C ATOM 831 CZ PHE A 50 2.061 -6.502 13.147 1.00 0.00 C ATOM 0 H PHE A 50 7.210 -5.074 9.039 1.00 0.00 H new ATOM 0 HA PHE A 50 6.697 -4.940 11.808 1.00 0.00 H new ATOM 0 HB2 PHE A 50 5.034 -4.461 10.049 1.00 0.00 H new ATOM 0 HB3 PHE A 50 5.095 -6.126 9.506 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.189 -3.993 12.420 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.728 -7.777 10.512 1.00 0.00 H new ATOM 0 HE1 PHE A 50 2.400 -4.573 14.001 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.942 -8.358 12.094 1.00 0.00 H new ATOM 0 HZ PHE A 50 1.276 -6.758 13.843 1.00 0.00 H new ATOM 841 N ASP A 51 7.017 -7.972 10.544 1.00 0.00 N ATOM 842 CA ASP A 51 7.214 -9.379 10.890 1.00 0.00 C ATOM 843 C ASP A 51 8.531 -9.597 11.635 1.00 0.00 C ATOM 844 O ASP A 51 8.641 -10.493 12.474 1.00 0.00 O ATOM 845 CB ASP A 51 7.164 -10.255 9.635 1.00 0.00 C ATOM 846 CG ASP A 51 7.388 -11.721 9.944 1.00 0.00 C ATOM 847 OD1 ASP A 51 6.456 -12.376 10.459 1.00 0.00 O ATOM 848 OD2 ASP A 51 8.496 -12.224 9.677 1.00 0.00 O1- ATOM 0 H ASP A 51 7.043 -7.778 9.543 1.00 0.00 H new ATOM 0 HA ASP A 51 6.401 -9.669 11.556 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.196 -10.133 9.148 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.921 -9.916 8.928 1.00 0.00 H new ATOM 853 N ASN A 52 9.530 -8.785 11.330 1.00 0.00 N ATOM 854 CA ASN A 52 10.822 -8.899 11.997 1.00 0.00 C ATOM 855 C ASN A 52 10.763 -8.366 13.415 1.00 0.00 C ATOM 856 O ASN A 52 11.511 -8.816 14.280 1.00 0.00 O ATOM 857 CB ASN A 52 11.931 -8.191 11.214 1.00 0.00 C ATOM 858 CG ASN A 52 12.381 -8.959 9.979 1.00 0.00 C ATOM 859 OD1 ASN A 52 12.811 -8.365 8.991 1.00 0.00 O ATOM 860 ND2 ASN A 52 12.303 -10.278 10.027 1.00 0.00 N ATOM 0 H ASN A 52 9.475 -8.044 10.631 1.00 0.00 H new ATOM 0 HA ASN A 52 11.061 -9.962 12.037 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.580 -7.204 10.912 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.788 -8.037 11.870 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.605 -10.836 9.228 1.00 0.00 H new ATOM 0 HD22 ASN A 52 11.941 -10.737 10.863 1.00 0.00 H new ATOM 867 N ARG A 53 9.880 -7.408 13.659 1.00 0.00 N ATOM 868 CA ARG A 53 9.738 -6.855 14.995 1.00 0.00 C ATOM 869 C ARG A 53 8.990 -7.822 15.899 1.00 0.00 C ATOM 870 O ARG A 53 9.338 -7.981 17.072 1.00 0.00 O ATOM 871 CB ARG A 53 9.026 -5.496 14.968 1.00 0.00 C ATOM 872 CG ARG A 53 9.806 -4.388 14.264 1.00 0.00 C ATOM 873 CD ARG A 53 11.234 -4.285 14.788 1.00 0.00 C ATOM 874 NE ARG A 53 11.284 -4.214 16.250 1.00 0.00 N ATOM 875 CZ ARG A 53 12.328 -4.600 16.986 1.00 0.00 C ATOM 876 NH1 ARG A 53 13.447 -5.013 16.399 1.00 0.00 N ATOM 877 NH2 ARG A 53 12.255 -4.557 18.309 1.00 0.00 N ATOM 0 H ARG A 53 9.259 -7.003 12.958 1.00 0.00 H new ATOM 0 HA ARG A 53 10.740 -6.702 15.395 1.00 0.00 H new ATOM 0 HB2 ARG A 53 8.062 -5.615 14.474 1.00 0.00 H new ATOM 0 HB3 ARG A 53 8.823 -5.186 15.993 1.00 0.00 H new ATOM 0 HG2 ARG A 53 9.825 -4.581 13.191 1.00 0.00 H new ATOM 0 HG3 ARG A 53 9.296 -3.436 14.408 1.00 0.00 H new ATOM 0 HD2 ARG A 53 11.807 -5.148 14.448 1.00 0.00 H new ATOM 0 HD3 ARG A 53 11.711 -3.400 14.367 1.00 0.00 H new ATOM 0 HE ARG A 53 10.467 -3.845 16.738 1.00 0.00 H new ATOM 0 HH11 ARG A 53 13.511 -5.036 15.381 1.00 0.00 H new ATOM 0 HH12 ARG A 53 14.242 -5.307 16.966 1.00 0.00 H new ATOM 0 HH21 ARG A 53 11.402 -4.229 18.762 1.00 0.00 H new ATOM 0 HH22 ARG A 53 13.052 -4.852 18.874 1.00 0.00 H new ATOM 891 N GLN A 54 7.977 -8.480 15.346 1.00 0.00 N ATOM 892 CA GLN A 54 7.186 -9.453 16.086 1.00 0.00 C ATOM 893 C GLN A 54 6.192 -10.133 15.150 1.00 0.00 C ATOM 894 O GLN A 54 5.823 -9.570 14.123 1.00 0.00 O ATOM 895 CB GLN A 54 6.439 -8.776 17.246 1.00 0.00 C ATOM 896 CG GLN A 54 5.771 -9.753 18.196 1.00 0.00 C ATOM 897 CD GLN A 54 5.000 -9.072 19.300 1.00 0.00 C ATOM 898 OE1 GLN A 54 4.489 -7.966 19.128 1.00 0.00 O ATOM 899 NE2 GLN A 54 4.893 -9.734 20.435 1.00 0.00 N ATOM 0 H GLN A 54 7.683 -8.354 14.377 1.00 0.00 H new ATOM 0 HA GLN A 54 7.859 -10.203 16.501 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.141 -8.160 17.808 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.683 -8.106 16.837 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.095 -10.395 17.631 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.530 -10.399 18.636 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.333 -10.649 20.535 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.371 -9.331 21.213 1.00 0.00 H new ATOM 908 N GLU A 55 5.771 -11.342 15.497 1.00 0.00 N ATOM 909 CA GLU A 55 4.808 -12.065 14.681 1.00 0.00 C ATOM 910 C GLU A 55 3.399 -11.523 14.913 1.00 0.00 C ATOM 911 O GLU A 55 2.597 -11.449 13.981 1.00 0.00 O ATOM 912 CB GLU A 55 4.871 -13.597 14.938 1.00 0.00 C ATOM 913 CG GLU A 55 4.316 -14.071 16.286 1.00 0.00 C ATOM 914 CD GLU A 55 5.047 -13.493 17.474 1.00 0.00 C ATOM 915 OE1 GLU A 55 6.135 -13.994 17.814 1.00 0.00 O ATOM 916 OE2 GLU A 55 4.537 -12.532 18.069 1.00 0.00 O1- ATOM 0 H GLU A 55 6.079 -11.839 16.333 1.00 0.00 H new ATOM 0 HA GLU A 55 5.070 -11.906 13.635 1.00 0.00 H new ATOM 0 HB2 GLU A 55 4.323 -14.102 14.143 1.00 0.00 H new ATOM 0 HB3 GLU A 55 5.910 -13.917 14.862 1.00 0.00 H new ATOM 0 HG2 GLU A 55 3.262 -13.801 16.351 1.00 0.00 H new ATOM 0 HG3 GLU A 55 4.370 -15.159 16.330 1.00 0.00 H new ATOM 923 N ALA A 56 3.114 -11.144 16.176 1.00 0.00 N ATOM 924 CA ALA A 56 1.822 -10.571 16.567 1.00 0.00 C ATOM 925 C ALA A 56 0.677 -11.477 16.144 1.00 0.00 C ATOM 926 O ALA A 56 -0.324 -11.011 15.595 1.00 0.00 O ATOM 927 CB ALA A 56 1.657 -9.173 15.974 1.00 0.00 C ATOM 0 H ALA A 56 3.776 -11.229 16.948 1.00 0.00 H new ATOM 0 HA ALA A 56 1.799 -10.488 17.654 1.00 0.00 H new ATOM 0 HB1 ALA A 56 0.693 -8.762 16.274 1.00 0.00 H new ATOM 0 HB2 ALA A 56 2.456 -8.527 16.338 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.704 -9.231 14.887 1.00 0.00 H new ATOM 933 N ALA A 57 0.826 -12.773 16.448 1.00 0.00 N ATOM 934 CA ALA A 57 -0.129 -13.810 16.050 1.00 0.00 C ATOM 935 C ALA A 57 -0.058 -14.033 14.548 1.00 0.00 C ATOM 936 O ALA A 57 -0.463 -13.177 13.755 1.00 0.00 O ATOM 937 CB ALA A 57 -1.555 -13.484 16.499 1.00 0.00 C ATOM 0 H ALA A 57 1.619 -13.131 16.981 1.00 0.00 H new ATOM 0 HA ALA A 57 0.150 -14.735 16.555 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.228 -14.281 16.182 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.583 -13.396 17.585 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.871 -12.542 16.051 1.00 0.00 H new ATOM 943 N ASP A 58 0.434 -15.199 14.168 1.00 0.00 N ATOM 944 CA ASP A 58 0.661 -15.532 12.765 1.00 0.00 C ATOM 945 C ASP A 58 -0.631 -15.469 11.977 1.00 0.00 C ATOM 946 O ASP A 58 -0.664 -14.936 10.871 1.00 0.00 O ATOM 947 CB ASP A 58 1.256 -16.939 12.640 1.00 0.00 C ATOM 948 CG ASP A 58 2.544 -17.122 13.415 1.00 0.00 C ATOM 949 OD1 ASP A 58 2.476 -17.315 14.651 1.00 0.00 O ATOM 950 OD2 ASP A 58 3.628 -17.099 12.795 1.00 0.00 O1- ATOM 0 H ASP A 58 0.688 -15.943 14.818 1.00 0.00 H new ATOM 0 HA ASP A 58 1.361 -14.801 12.360 1.00 0.00 H new ATOM 0 HB2 ASP A 58 0.524 -17.667 12.990 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.441 -17.154 11.588 1.00 0.00 H new ATOM 955 N THR A 59 -1.696 -15.991 12.559 1.00 0.00 N ATOM 956 CA THR A 59 -2.985 -15.994 11.905 1.00 0.00 C ATOM 957 C THR A 59 -3.507 -14.564 11.687 1.00 0.00 C ATOM 958 O THR A 59 -4.048 -14.257 10.632 1.00 0.00 O ATOM 959 CB THR A 59 -4.026 -16.843 12.690 1.00 0.00 C ATOM 960 OG1 THR A 59 -5.273 -16.876 11.986 1.00 0.00 O ATOM 961 CG2 THR A 59 -4.245 -16.300 14.098 1.00 0.00 C ATOM 0 H THR A 59 -1.690 -16.418 13.485 1.00 0.00 H new ATOM 0 HA THR A 59 -2.845 -16.457 10.928 1.00 0.00 H new ATOM 0 HB THR A 59 -3.629 -17.855 12.774 1.00 0.00 H new ATOM 0 HG1 THR A 59 -5.919 -17.414 12.489 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.978 -16.918 14.616 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.303 -16.318 14.646 1.00 0.00 H new ATOM 0 HG23 THR A 59 -4.611 -15.275 14.040 1.00 0.00 H new ATOM 969 N GLU A 60 -3.296 -13.687 12.670 1.00 0.00 N ATOM 970 CA GLU A 60 -3.771 -12.311 12.576 1.00 0.00 C ATOM 971 C GLU A 60 -3.003 -11.545 11.507 1.00 0.00 C ATOM 972 O GLU A 60 -3.598 -10.828 10.690 1.00 0.00 O ATOM 973 CB GLU A 60 -3.649 -11.604 13.928 1.00 0.00 C ATOM 974 CG GLU A 60 -4.124 -10.160 13.909 1.00 0.00 C ATOM 975 CD GLU A 60 -4.074 -9.512 15.270 1.00 0.00 C ATOM 976 OE1 GLU A 60 -5.103 -9.521 15.975 1.00 0.00 O ATOM 977 OE2 GLU A 60 -3.010 -8.991 15.649 1.00 0.00 O1- ATOM 0 H GLU A 60 -2.802 -13.906 13.535 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.823 -12.336 12.292 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.225 -12.157 14.670 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.608 -11.630 14.249 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.507 -9.588 13.216 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -5.146 -10.123 13.531 1.00 0.00 H new ATOM 984 N ALA A 61 -1.685 -11.711 11.505 1.00 0.00 N ATOM 985 CA ALA A 61 -0.831 -11.055 10.528 1.00 0.00 C ATOM 986 C ALA A 61 -1.140 -11.559 9.124 1.00 0.00 C ATOM 987 O ALA A 61 -1.125 -10.794 8.158 1.00 0.00 O ATOM 988 CB ALA A 61 0.635 -11.285 10.867 1.00 0.00 C ATOM 0 H ALA A 61 -1.185 -12.298 12.173 1.00 0.00 H new ATOM 0 HA ALA A 61 -1.030 -9.984 10.559 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.262 -10.788 10.127 1.00 0.00 H new ATOM 0 HB2 ALA A 61 0.848 -10.878 11.855 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.846 -12.354 10.862 1.00 0.00 H new ATOM 994 N ALA A 62 -1.441 -12.850 9.023 1.00 0.00 N ATOM 995 CA ALA A 62 -1.774 -13.464 7.750 1.00 0.00 C ATOM 996 C ALA A 62 -3.034 -12.849 7.158 1.00 0.00 C ATOM 997 O ALA A 62 -3.127 -12.659 5.955 1.00 0.00 O ATOM 998 CB ALA A 62 -1.947 -14.968 7.913 1.00 0.00 C ATOM 0 H ALA A 62 -1.460 -13.492 9.816 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.950 -13.278 7.062 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -2.196 -15.412 6.949 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.019 -15.403 8.284 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.750 -15.167 8.623 1.00 0.00 H new ATOM 1004 N LYS A 63 -3.997 -12.519 8.014 1.00 0.00 N ATOM 1005 CA LYS A 63 -5.252 -11.934 7.548 1.00 0.00 C ATOM 1006 C LYS A 63 -5.011 -10.555 6.960 1.00 0.00 C ATOM 1007 O LYS A 63 -5.533 -10.225 5.898 1.00 0.00 O ATOM 1008 CB LYS A 63 -6.269 -11.838 8.690 1.00 0.00 C ATOM 1009 CG LYS A 63 -6.480 -13.137 9.440 1.00 0.00 C ATOM 1010 CD LYS A 63 -6.977 -14.245 8.530 1.00 0.00 C ATOM 1011 CE LYS A 63 -6.888 -15.598 9.216 1.00 0.00 C ATOM 1012 NZ LYS A 63 -7.620 -15.626 10.509 1.00 0.00 N ATOM 0 H LYS A 63 -3.935 -12.645 9.024 1.00 0.00 H new ATOM 0 HA LYS A 63 -5.657 -12.586 6.774 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.938 -11.074 9.394 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.225 -11.506 8.284 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -5.543 -13.443 9.905 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -7.199 -12.979 10.244 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.009 -14.047 8.242 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.387 -14.259 7.613 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -7.293 -16.365 8.555 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -5.841 -15.847 9.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -6.947 -15.782 11.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.108 -14.719 10.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.318 -16.396 10.496 1.00 0.00 H new ATOM 1026 N GLN A 64 -4.195 -9.765 7.644 1.00 0.00 N ATOM 1027 CA GLN A 64 -3.885 -8.415 7.196 1.00 0.00 C ATOM 1028 C GLN A 64 -3.104 -8.464 5.890 1.00 0.00 C ATOM 1029 O GLN A 64 -3.390 -7.716 4.952 1.00 0.00 O ATOM 1030 CB GLN A 64 -3.092 -7.668 8.291 1.00 0.00 C ATOM 1031 CG GLN A 64 -2.795 -6.196 7.989 1.00 0.00 C ATOM 1032 CD GLN A 64 -1.598 -5.995 7.072 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -0.654 -6.781 7.079 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -1.636 -4.943 6.277 1.00 0.00 N ATOM 0 H GLN A 64 -3.735 -10.037 8.513 1.00 0.00 H new ATOM 0 HA GLN A 64 -4.813 -7.872 7.015 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -3.651 -7.725 9.225 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.147 -8.187 8.452 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.674 -5.743 7.531 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -2.617 -5.670 8.927 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.439 -4.314 6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -0.863 -4.759 5.638 1.00 0.00 H new ATOM 1043 N GLY A 65 -2.141 -9.369 5.828 1.00 0.00 N ATOM 1044 CA GLY A 65 -1.326 -9.499 4.646 1.00 0.00 C ATOM 1045 C GLY A 65 -2.101 -10.027 3.459 1.00 0.00 C ATOM 1046 O GLY A 65 -2.009 -9.480 2.363 1.00 0.00 O ATOM 0 H GLY A 65 -1.910 -10.018 6.581 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -0.900 -8.528 4.394 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.491 -10.168 4.857 1.00 0.00 H new ATOM 1050 N ASP A 66 -2.891 -11.071 3.684 1.00 0.00 N ATOM 1051 CA ASP A 66 -3.649 -11.715 2.609 1.00 0.00 C ATOM 1052 C ASP A 66 -4.633 -10.751 1.964 1.00 0.00 C ATOM 1053 O ASP A 66 -4.766 -10.715 0.739 1.00 0.00 O ATOM 1054 CB ASP A 66 -4.402 -12.935 3.142 1.00 0.00 C ATOM 1055 CG ASP A 66 -5.028 -13.763 2.040 1.00 0.00 C ATOM 1056 OD1 ASP A 66 -4.392 -14.742 1.601 1.00 0.00 O ATOM 1057 OD2 ASP A 66 -6.155 -13.445 1.609 1.00 0.00 O1- ATOM 0 H ASP A 66 -3.026 -11.493 4.603 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.933 -12.033 1.851 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.716 -13.559 3.714 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -5.181 -12.604 3.829 1.00 0.00 H new ATOM 1062 N GLN A 67 -5.301 -9.952 2.783 1.00 0.00 N ATOM 1063 CA GLN A 67 -6.275 -9.000 2.274 1.00 0.00 C ATOM 1064 C GLN A 67 -5.592 -7.867 1.519 1.00 0.00 C ATOM 1065 O GLN A 67 -6.082 -7.413 0.485 1.00 0.00 O ATOM 1066 CB GLN A 67 -7.140 -8.438 3.407 1.00 0.00 C ATOM 1067 CG GLN A 67 -7.953 -9.491 4.149 1.00 0.00 C ATOM 1068 CD GLN A 67 -8.816 -10.328 3.227 1.00 0.00 C ATOM 1069 OE1 GLN A 67 -9.260 -9.868 2.179 1.00 0.00 O ATOM 1070 NE2 GLN A 67 -9.055 -11.563 3.607 1.00 0.00 N ATOM 0 H GLN A 67 -5.187 -9.944 3.797 1.00 0.00 H new ATOM 0 HA GLN A 67 -6.923 -9.534 1.579 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -6.496 -7.922 4.120 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -7.820 -7.693 2.995 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -7.276 -10.145 4.698 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -8.588 -9.000 4.886 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -8.669 -11.910 4.485 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -9.627 -12.174 3.024 1.00 0.00 H new ATOM 1079 N TRP A 68 -4.455 -7.419 2.032 1.00 0.00 N ATOM 1080 CA TRP A 68 -3.715 -6.346 1.412 1.00 0.00 C ATOM 1081 C TRP A 68 -3.125 -6.790 0.069 1.00 0.00 C ATOM 1082 O TRP A 68 -3.235 -6.079 -0.932 1.00 0.00 O ATOM 1083 CB TRP A 68 -2.627 -5.850 2.361 1.00 0.00 C ATOM 1084 CG TRP A 68 -1.742 -4.808 1.774 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -0.422 -4.937 1.508 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -2.112 -3.483 1.370 1.00 0.00 C ATOM 1087 NE1 TRP A 68 0.068 -3.772 0.970 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -0.952 -2.864 0.873 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -3.310 -2.760 1.383 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -0.951 -1.559 0.392 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -3.308 -1.464 0.904 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -2.136 -0.875 0.415 1.00 0.00 C ATOM 0 H TRP A 68 -4.029 -7.789 2.881 1.00 0.00 H new ATOM 0 HA TRP A 68 -4.397 -5.520 1.208 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -3.097 -5.449 3.259 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -2.016 -6.698 2.672 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.162 -5.827 1.692 1.00 0.00 H new ATOM 0 HE1 TRP A 68 1.035 -3.610 0.688 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -4.218 -3.206 1.760 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -0.048 -1.102 0.014 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -4.226 -0.896 0.907 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -2.168 0.140 0.048 1.00 0.00 H new ATOM 1103 N VAL A 69 -2.516 -7.973 0.051 1.00 0.00 N ATOM 1104 CA VAL A 69 -1.936 -8.517 -1.174 1.00 0.00 C ATOM 1105 C VAL A 69 -3.019 -8.742 -2.229 1.00 0.00 C ATOM 1106 O VAL A 69 -2.825 -8.435 -3.409 1.00 0.00 O ATOM 1107 CB VAL A 69 -1.179 -9.848 -0.912 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -0.706 -10.472 -2.219 1.00 0.00 C ATOM 1109 CG2 VAL A 69 0.005 -9.613 0.016 1.00 0.00 C ATOM 0 H VAL A 69 -2.411 -8.573 0.870 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.218 -7.784 -1.542 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.871 -10.540 -0.432 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -0.179 -11.403 -2.008 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.566 -10.678 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -0.034 -9.782 -2.729 1.00 0.00 H new ATOM 0 HG21 VAL A 69 0.524 -10.556 0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.690 -8.900 -0.442 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.351 -9.215 0.966 1.00 0.00 H new ATOM 1119 N GLN A 70 -4.165 -9.254 -1.794 1.00 0.00 N ATOM 1120 CA GLN A 70 -5.276 -9.506 -2.689 1.00 0.00 C ATOM 1121 C GLN A 70 -5.783 -8.198 -3.296 1.00 0.00 C ATOM 1122 O GLN A 70 -6.068 -8.125 -4.495 1.00 0.00 O ATOM 1123 CB GLN A 70 -6.401 -10.211 -1.941 1.00 0.00 C ATOM 1124 CG GLN A 70 -7.530 -10.670 -2.833 1.00 0.00 C ATOM 1125 CD GLN A 70 -7.084 -11.705 -3.849 1.00 0.00 C ATOM 1126 OE1 GLN A 70 -6.177 -12.497 -3.593 1.00 0.00 O ATOM 1127 NE2 GLN A 70 -7.705 -11.697 -5.005 1.00 0.00 N ATOM 0 H GLN A 70 -4.344 -9.502 -0.821 1.00 0.00 H new ATOM 0 HA GLN A 70 -4.932 -10.151 -3.498 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -5.991 -11.074 -1.416 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.800 -9.537 -1.183 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.327 -11.089 -2.218 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.949 -9.810 -3.355 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -8.452 -11.024 -5.178 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -7.441 -12.364 -5.730 1.00 0.00 H new ATOM 1136 N LEU A 71 -5.877 -7.164 -2.466 1.00 0.00 N ATOM 1137 CA LEU A 71 -6.319 -5.870 -2.908 1.00 0.00 C ATOM 1138 C LEU A 71 -5.325 -5.285 -3.909 1.00 0.00 C ATOM 1139 O LEU A 71 -5.719 -4.696 -4.919 1.00 0.00 O ATOM 1140 CB LEU A 71 -6.486 -4.943 -1.706 1.00 0.00 C ATOM 1141 CG LEU A 71 -6.816 -3.500 -2.034 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -8.179 -3.390 -2.707 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -6.753 -2.635 -0.786 1.00 0.00 C ATOM 0 H LEU A 71 -5.647 -7.211 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.283 -5.972 -3.407 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.275 -5.342 -1.069 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.565 -4.963 -1.123 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.067 -3.134 -2.737 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.391 -2.345 -2.931 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.175 -3.966 -3.632 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.947 -3.781 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.993 -1.604 -1.045 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.471 -3.002 -0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.749 -2.678 -0.364 1.00 0.00 H new ATOM 1155 N PHE A 72 -4.037 -5.467 -3.631 1.00 0.00 N ATOM 1156 CA PHE A 72 -2.990 -4.993 -4.521 1.00 0.00 C ATOM 1157 C PHE A 72 -3.089 -5.699 -5.871 1.00 0.00 C ATOM 1158 O PHE A 72 -2.973 -5.065 -6.923 1.00 0.00 O ATOM 1159 CB PHE A 72 -1.605 -5.214 -3.899 1.00 0.00 C ATOM 1160 CG PHE A 72 -0.469 -4.696 -4.742 1.00 0.00 C ATOM 1161 CD1 PHE A 72 -0.248 -3.333 -4.869 1.00 0.00 C ATOM 1162 CD2 PHE A 72 0.378 -5.573 -5.406 1.00 0.00 C ATOM 1163 CE1 PHE A 72 0.794 -2.854 -5.640 1.00 0.00 C ATOM 1164 CE2 PHE A 72 1.422 -5.098 -6.179 1.00 0.00 C ATOM 1165 CZ PHE A 72 1.630 -3.737 -6.296 1.00 0.00 C ATOM 0 H PHE A 72 -3.696 -5.940 -2.794 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.125 -3.922 -4.674 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.573 -4.727 -2.924 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.460 -6.281 -3.727 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -0.898 -2.637 -4.359 1.00 0.00 H new ATOM 0 HD2 PHE A 72 0.220 -6.638 -5.318 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.955 -1.790 -5.730 1.00 0.00 H new ATOM 0 HE2 PHE A 72 2.074 -5.790 -6.691 1.00 0.00 H new ATOM 0 HZ PHE A 72 2.445 -3.364 -6.899 1.00 0.00 H new ATOM 1175 N GLN A 73 -3.319 -7.015 -5.834 1.00 0.00 N ATOM 1176 CA GLN A 73 -3.476 -7.796 -7.053 1.00 0.00 C ATOM 1177 C GLN A 73 -4.666 -7.289 -7.854 1.00 0.00 C ATOM 1178 O GLN A 73 -4.578 -7.113 -9.063 1.00 0.00 O ATOM 1179 CB GLN A 73 -3.661 -9.282 -6.742 1.00 0.00 C ATOM 1180 CG GLN A 73 -3.821 -10.144 -7.991 1.00 0.00 C ATOM 1181 CD GLN A 73 -4.118 -11.593 -7.677 1.00 0.00 C ATOM 1182 OE1 GLN A 73 -3.696 -12.118 -6.651 1.00 0.00 O ATOM 1183 NE2 GLN A 73 -4.844 -12.248 -8.561 1.00 0.00 N ATOM 0 H GLN A 73 -3.400 -7.556 -4.973 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.566 -7.679 -7.641 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.802 -9.637 -6.172 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.539 -9.407 -6.108 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.626 -9.739 -8.604 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.908 -10.087 -8.584 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -5.175 -11.774 -9.401 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -5.075 -13.229 -8.405 1.00 0.00 H new ATOM 1192 N ARG A 74 -5.770 -7.045 -7.164 1.00 0.00 N ATOM 1193 CA ARG A 74 -6.978 -6.536 -7.798 1.00 0.00 C ATOM 1194 C ARG A 74 -6.713 -5.187 -8.470 1.00 0.00 C ATOM 1195 O ARG A 74 -7.158 -4.943 -9.595 1.00 0.00 O ATOM 1196 CB ARG A 74 -8.106 -6.403 -6.765 1.00 0.00 C ATOM 1197 CG ARG A 74 -9.353 -5.710 -7.293 1.00 0.00 C ATOM 1198 CD ARG A 74 -10.395 -5.530 -6.202 1.00 0.00 C ATOM 1199 NE ARG A 74 -11.438 -4.583 -6.598 1.00 0.00 N ATOM 1200 CZ ARG A 74 -12.040 -3.728 -5.761 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -11.797 -3.784 -4.451 1.00 0.00 N ATOM 1202 NH2 ARG A 74 -12.904 -2.840 -6.231 1.00 0.00 N ATOM 0 H ARG A 74 -5.855 -7.192 -6.158 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.286 -7.246 -8.566 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.378 -7.397 -6.410 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.732 -5.849 -5.904 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.083 -4.737 -7.704 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.777 -6.294 -8.110 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.848 -6.494 -5.970 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.911 -5.178 -5.291 1.00 0.00 H new ATOM 0 HE ARG A 74 -11.726 -4.573 -7.577 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.150 -4.480 -4.082 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.258 -3.130 -3.818 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.110 -2.808 -7.229 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -13.363 -2.189 -5.594 1.00 0.00 H new ATOM 1216 N PHE A 75 -5.971 -4.324 -7.783 1.00 0.00 N ATOM 1217 CA PHE A 75 -5.668 -3.003 -8.308 1.00 0.00 C ATOM 1218 C PHE A 75 -4.769 -3.099 -9.543 1.00 0.00 C ATOM 1219 O PHE A 75 -5.051 -2.485 -10.573 1.00 0.00 O ATOM 1220 CB PHE A 75 -5.005 -2.133 -7.230 1.00 0.00 C ATOM 1221 CG PHE A 75 -4.780 -0.705 -7.654 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -5.742 0.260 -7.406 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -3.614 -0.329 -8.303 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -5.548 1.571 -7.795 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -3.415 0.979 -8.694 1.00 0.00 C ATOM 1226 CZ PHE A 75 -4.383 1.931 -8.440 1.00 0.00 C ATOM 0 H PHE A 75 -5.571 -4.517 -6.865 1.00 0.00 H new ATOM 0 HA PHE A 75 -6.606 -2.534 -8.605 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.627 -2.143 -6.335 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -4.047 -2.576 -6.957 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.656 -0.016 -6.902 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -2.853 -1.068 -8.505 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.307 2.313 -7.595 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -2.502 1.259 -9.199 1.00 0.00 H new ATOM 0 HZ PHE A 75 -4.228 2.955 -8.746 1.00 0.00 H new ATOM 1236 N ARG A 76 -3.699 -3.888 -9.445 1.00 0.00 N ATOM 1237 CA ARG A 76 -2.779 -4.052 -10.566 1.00 0.00 C ATOM 1238 C ARG A 76 -3.454 -4.749 -11.737 1.00 0.00 C ATOM 1239 O ARG A 76 -3.150 -4.469 -12.887 1.00 0.00 O ATOM 1240 CB ARG A 76 -1.446 -4.745 -10.157 1.00 0.00 C ATOM 1241 CG ARG A 76 -1.566 -6.148 -9.555 1.00 0.00 C ATOM 1242 CD ARG A 76 -1.857 -7.216 -10.607 1.00 0.00 C ATOM 1243 NE ARG A 76 -0.846 -7.252 -11.663 1.00 0.00 N ATOM 1244 CZ ARG A 76 -0.949 -7.982 -12.778 1.00 0.00 C ATOM 1245 NH1 ARG A 76 -2.035 -8.716 -13.002 1.00 0.00 N ATOM 1246 NH2 ARG A 76 0.031 -7.970 -13.667 1.00 0.00 N ATOM 0 H ARG A 76 -3.451 -4.418 -8.609 1.00 0.00 H new ATOM 0 HA ARG A 76 -2.503 -3.051 -10.896 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -0.807 -4.805 -11.038 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -0.936 -4.106 -9.436 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -0.640 -6.397 -9.036 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -2.361 -6.152 -8.809 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -1.909 -8.192 -10.125 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -2.835 -7.028 -11.051 1.00 0.00 H new ATOM 0 HE ARG A 76 -0.008 -6.683 -11.541 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -2.795 -8.724 -12.321 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -2.108 -9.271 -13.855 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.863 -7.404 -13.501 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.046 -8.526 -14.518 1.00 0.00 H new ATOM 1260 N GLU A 77 -4.368 -5.665 -11.429 1.00 0.00 N ATOM 1261 CA GLU A 77 -5.083 -6.412 -12.449 1.00 0.00 C ATOM 1262 C GLU A 77 -5.860 -5.456 -13.343 1.00 0.00 C ATOM 1263 O GLU A 77 -5.809 -5.552 -14.567 1.00 0.00 O ATOM 1264 CB GLU A 77 -6.040 -7.409 -11.794 1.00 0.00 C ATOM 1265 CG GLU A 77 -6.507 -8.514 -12.717 1.00 0.00 C ATOM 1266 CD GLU A 77 -5.366 -9.392 -13.171 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -4.892 -9.220 -14.308 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -4.929 -10.256 -12.387 1.00 0.00 O1- ATOM 0 H GLU A 77 -4.629 -5.906 -10.473 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.363 -6.960 -13.056 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.547 -7.855 -10.930 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.911 -6.869 -11.421 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.252 -9.123 -12.205 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -6.996 -8.077 -13.587 1.00 0.00 H new ATOM 1275 N ALA A 78 -6.555 -4.516 -12.720 1.00 0.00 N ATOM 1276 CA ALA A 78 -7.319 -3.524 -13.452 1.00 0.00 C ATOM 1277 C ALA A 78 -6.389 -2.616 -14.257 1.00 0.00 C ATOM 1278 O ALA A 78 -6.718 -2.208 -15.372 1.00 0.00 O ATOM 1279 CB ALA A 78 -8.179 -2.716 -12.500 1.00 0.00 C ATOM 0 H ALA A 78 -6.604 -4.422 -11.706 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.977 -4.037 -14.154 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.747 -1.975 -13.063 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.867 -3.381 -11.978 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.542 -2.210 -11.774 1.00 0.00 H new ATOM 1285 N ILE A 79 -5.222 -2.315 -13.685 1.00 0.00 N ATOM 1286 CA ILE A 79 -4.208 -1.501 -14.361 1.00 0.00 C ATOM 1287 C ILE A 79 -3.689 -2.232 -15.602 1.00 0.00 C ATOM 1288 O ILE A 79 -3.616 -1.663 -16.694 1.00 0.00 O ATOM 1289 CB ILE A 79 -3.001 -1.205 -13.416 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -3.415 -0.299 -12.249 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -1.838 -0.585 -14.185 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -3.737 1.125 -12.656 1.00 0.00 C ATOM 0 H ILE A 79 -4.954 -2.624 -12.751 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.677 -0.560 -14.647 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.669 -2.158 -13.004 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.287 -0.732 -11.759 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.611 -0.282 -11.513 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -1.012 -0.390 -13.501 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.509 -1.273 -14.964 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.161 0.351 -14.640 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.020 1.700 -11.775 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.860 1.578 -13.119 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.562 1.122 -13.368 1.00 0.00 H new ATOM 1304 N ASP A 80 -3.368 -3.507 -15.424 1.00 0.00 N ATOM 1305 CA ASP A 80 -2.822 -4.334 -16.495 1.00 0.00 C ATOM 1306 C ASP A 80 -3.857 -4.582 -17.587 1.00 0.00 C ATOM 1307 O ASP A 80 -3.520 -4.661 -18.771 1.00 0.00 O ATOM 1308 CB ASP A 80 -2.314 -5.664 -15.929 1.00 0.00 C ATOM 1309 CG ASP A 80 -1.694 -6.551 -16.986 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -2.357 -7.516 -17.421 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -0.541 -6.291 -17.390 1.00 0.00 O1- ATOM 0 H ASP A 80 -3.478 -3.997 -14.536 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.986 -3.797 -16.944 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -1.578 -5.465 -15.150 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -3.142 -6.193 -15.457 1.00 0.00 H new ATOM 1316 N LYS A 81 -5.114 -4.702 -17.192 1.00 0.00 N ATOM 1317 CA LYS A 81 -6.192 -4.914 -18.149 1.00 0.00 C ATOM 1318 C LYS A 81 -6.632 -3.600 -18.783 1.00 0.00 C ATOM 1319 O LYS A 81 -7.388 -3.593 -19.755 1.00 0.00 O ATOM 1320 CB LYS A 81 -7.384 -5.601 -17.489 1.00 0.00 C ATOM 1321 CG LYS A 81 -7.107 -7.025 -17.050 1.00 0.00 C ATOM 1322 CD LYS A 81 -8.358 -7.679 -16.499 1.00 0.00 C ATOM 1323 CE LYS A 81 -8.113 -9.132 -16.142 1.00 0.00 C ATOM 1324 NZ LYS A 81 -9.341 -9.788 -15.636 1.00 0.00 N ATOM 0 H LYS A 81 -5.414 -4.657 -16.218 1.00 0.00 H new ATOM 0 HA LYS A 81 -5.807 -5.564 -18.934 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.693 -5.017 -16.622 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.222 -5.603 -18.186 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.733 -7.603 -17.895 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.326 -7.029 -16.290 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.694 -7.137 -15.615 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.159 -7.614 -17.236 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.751 -9.666 -17.020 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -7.330 -9.194 -15.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.134 -10.780 -15.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -9.672 -9.294 -14.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -10.080 -9.752 -16.367 1.00 0.00 H new ATOM 1338 N GLY A 82 -6.164 -2.493 -18.223 1.00 0.00 N ATOM 1339 CA GLY A 82 -6.499 -1.187 -18.757 1.00 0.00 C ATOM 1340 C GLY A 82 -7.945 -0.814 -18.521 1.00 0.00 C ATOM 1341 O GLY A 82 -8.551 -0.111 -19.329 1.00 0.00 O ATOM 0 H GLY A 82 -5.555 -2.476 -17.405 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.855 -0.436 -18.300 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.294 -1.173 -19.828 1.00 0.00 H new ATOM 1345 N ASP A 83 -8.504 -1.281 -17.417 1.00 0.00 N ATOM 1346 CA ASP A 83 -9.895 -1.000 -17.103 1.00 0.00 C ATOM 1347 C ASP A 83 -10.003 0.165 -16.141 1.00 0.00 C ATOM 1348 O ASP A 83 -9.878 -0.003 -14.931 1.00 0.00 O ATOM 1349 CB ASP A 83 -10.591 -2.226 -16.520 1.00 0.00 C ATOM 1350 CG ASP A 83 -12.076 -1.996 -16.319 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -12.475 -1.562 -15.221 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -12.849 -2.257 -17.257 1.00 0.00 O1- ATOM 0 H ASP A 83 -8.019 -1.854 -16.726 1.00 0.00 H new ATOM 0 HA ASP A 83 -10.395 -0.735 -18.035 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -10.443 -3.077 -17.185 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.132 -2.484 -15.566 1.00 0.00 H new ATOM 1357 N LYS A 84 -10.225 1.345 -16.683 1.00 0.00 N ATOM 1358 CA LYS A 84 -10.323 2.555 -15.880 1.00 0.00 C ATOM 1359 C LYS A 84 -11.603 2.576 -15.057 1.00 0.00 C ATOM 1360 O LYS A 84 -11.662 3.217 -14.008 1.00 0.00 O ATOM 1361 CB LYS A 84 -10.235 3.802 -16.760 1.00 0.00 C ATOM 1362 CG LYS A 84 -8.926 3.925 -17.524 1.00 0.00 C ATOM 1363 CD LYS A 84 -8.843 5.246 -18.270 1.00 0.00 C ATOM 1364 CE LYS A 84 -7.536 5.370 -19.036 1.00 0.00 C ATOM 1365 NZ LYS A 84 -7.398 6.698 -19.681 1.00 0.00 N ATOM 0 H LYS A 84 -10.342 1.496 -17.685 1.00 0.00 H new ATOM 0 HA LYS A 84 -9.480 2.557 -15.189 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -11.060 3.791 -17.472 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -10.364 4.686 -16.135 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -8.089 3.844 -16.831 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.836 3.100 -18.231 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -9.681 5.328 -18.962 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -8.932 6.071 -17.563 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -6.700 5.208 -18.356 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -7.485 4.590 -19.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -6.494 6.743 -20.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -8.182 6.843 -20.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -7.421 7.441 -18.954 1.00 0.00 H new ATOM 1379 N ASP A 85 -12.619 1.859 -15.527 1.00 0.00 N ATOM 1380 CA ASP A 85 -13.916 1.828 -14.851 1.00 0.00 C ATOM 1381 C ASP A 85 -13.766 1.330 -13.414 1.00 0.00 C ATOM 1382 O ASP A 85 -14.244 1.974 -12.474 1.00 0.00 O ATOM 1383 CB ASP A 85 -14.892 0.929 -15.622 1.00 0.00 C ATOM 1384 CG ASP A 85 -16.251 0.811 -14.952 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -17.162 1.593 -15.297 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -16.423 -0.082 -14.090 1.00 0.00 O1- ATOM 0 H ASP A 85 -12.571 1.291 -16.373 1.00 0.00 H new ATOM 0 HA ASP A 85 -14.313 2.843 -14.823 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -15.023 1.325 -16.629 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -14.457 -0.065 -15.725 1.00 0.00 H new ATOM 1391 N SER A 86 -13.083 0.208 -13.245 1.00 0.00 N ATOM 1392 CA SER A 86 -12.838 -0.334 -11.919 1.00 0.00 C ATOM 1393 C SER A 86 -11.810 0.510 -11.164 1.00 0.00 C ATOM 1394 O SER A 86 -11.910 0.684 -9.951 1.00 0.00 O ATOM 1395 CB SER A 86 -12.395 -1.802 -11.998 1.00 0.00 C ATOM 1396 OG SER A 86 -11.333 -1.976 -12.919 1.00 0.00 O ATOM 0 H SER A 86 -12.690 -0.343 -14.008 1.00 0.00 H new ATOM 0 HA SER A 86 -13.775 -0.297 -11.363 1.00 0.00 H new ATOM 0 HB2 SER A 86 -12.081 -2.142 -11.011 1.00 0.00 H new ATOM 0 HB3 SER A 86 -13.240 -2.423 -12.295 1.00 0.00 H new ATOM 0 HG SER A 86 -11.699 -2.127 -13.816 1.00 0.00 H new ATOM 1402 N LEU A 87 -10.841 1.057 -11.900 1.00 0.00 N ATOM 1403 CA LEU A 87 -9.770 1.863 -11.310 1.00 0.00 C ATOM 1404 C LEU A 87 -10.311 3.078 -10.569 1.00 0.00 C ATOM 1405 O LEU A 87 -9.832 3.408 -9.487 1.00 0.00 O ATOM 1406 CB LEU A 87 -8.767 2.298 -12.381 1.00 0.00 C ATOM 1407 CG LEU A 87 -7.926 1.175 -12.985 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -7.035 1.698 -14.098 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -7.090 0.512 -11.912 1.00 0.00 C ATOM 0 H LEU A 87 -10.776 0.955 -12.913 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.260 1.234 -10.581 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.311 2.794 -13.185 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.096 3.039 -11.947 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.604 0.436 -13.413 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.448 0.877 -14.510 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.652 2.133 -14.884 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.365 2.460 -13.700 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.495 -0.287 -12.356 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.427 1.250 -11.460 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.745 0.095 -11.147 1.00 0.00 H new ATOM 1421 N GLU A 88 -11.310 3.732 -11.139 1.00 0.00 N ATOM 1422 CA GLU A 88 -11.902 4.902 -10.503 1.00 0.00 C ATOM 1423 C GLU A 88 -12.543 4.535 -9.167 1.00 0.00 C ATOM 1424 O GLU A 88 -12.453 5.289 -8.198 1.00 0.00 O ATOM 1425 CB GLU A 88 -12.919 5.553 -11.421 1.00 0.00 C ATOM 1426 CG GLU A 88 -12.319 6.068 -12.713 1.00 0.00 C ATOM 1427 CD GLU A 88 -13.318 6.810 -13.554 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -14.015 6.168 -14.365 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -13.415 8.044 -13.408 1.00 0.00 O1- ATOM 0 H GLU A 88 -11.727 3.477 -12.034 1.00 0.00 H new ATOM 0 HA GLU A 88 -11.104 5.618 -10.309 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.701 4.831 -11.655 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.395 6.380 -10.895 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.481 6.726 -12.484 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.919 5.230 -13.284 1.00 0.00 H new ATOM 1436 N GLN A 89 -13.189 3.378 -9.124 1.00 0.00 N ATOM 1437 CA GLN A 89 -13.787 2.882 -7.889 1.00 0.00 C ATOM 1438 C GLN A 89 -12.693 2.472 -6.908 1.00 0.00 C ATOM 1439 O GLN A 89 -12.804 2.691 -5.697 1.00 0.00 O ATOM 1440 CB GLN A 89 -14.716 1.698 -8.178 1.00 0.00 C ATOM 1441 CG GLN A 89 -15.954 2.070 -8.980 1.00 0.00 C ATOM 1442 CD GLN A 89 -16.842 3.063 -8.249 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -16.892 3.082 -7.020 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -17.544 3.890 -8.996 1.00 0.00 N ATOM 0 H GLN A 89 -13.313 2.764 -9.929 1.00 0.00 H new ATOM 0 HA GLN A 89 -14.380 3.680 -7.443 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -14.158 0.935 -8.721 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -15.027 1.253 -7.233 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -15.650 2.495 -9.937 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -16.526 1.168 -9.199 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -17.475 3.843 -10.013 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -18.157 4.578 -8.558 1.00 0.00 H new ATOM 1453 N LEU A 90 -11.632 1.888 -7.452 1.00 0.00 N ATOM 1454 CA LEU A 90 -10.482 1.456 -6.672 1.00 0.00 C ATOM 1455 C LEU A 90 -9.811 2.623 -5.969 1.00 0.00 C ATOM 1456 O LEU A 90 -9.331 2.479 -4.859 1.00 0.00 O ATOM 1457 CB LEU A 90 -9.474 0.732 -7.563 1.00 0.00 C ATOM 1458 CG LEU A 90 -9.779 -0.736 -7.857 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -8.918 -1.238 -9.001 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -9.543 -1.577 -6.614 1.00 0.00 C ATOM 0 H LEU A 90 -11.546 1.701 -8.451 1.00 0.00 H new ATOM 0 HA LEU A 90 -10.844 0.768 -5.908 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.406 1.266 -8.511 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.493 0.792 -7.092 1.00 0.00 H new ATOM 0 HG LEU A 90 -10.826 -0.823 -8.148 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.148 -2.285 -9.197 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.121 -0.648 -9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -7.866 -1.142 -8.734 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -9.763 -2.622 -6.834 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.502 -1.483 -6.303 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.194 -1.230 -5.811 1.00 0.00 H new ATOM 1472 N LEU A 91 -9.785 3.779 -6.623 1.00 0.00 N ATOM 1473 CA LEU A 91 -9.157 4.970 -6.053 1.00 0.00 C ATOM 1474 C LEU A 91 -9.808 5.354 -4.724 1.00 0.00 C ATOM 1475 O LEU A 91 -9.122 5.721 -3.773 1.00 0.00 O ATOM 1476 CB LEU A 91 -9.237 6.146 -7.034 1.00 0.00 C ATOM 1477 CG LEU A 91 -8.545 5.940 -8.386 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -8.738 7.158 -9.275 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -7.062 5.645 -8.197 1.00 0.00 C ATOM 0 H LEU A 91 -10.191 3.919 -7.548 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.109 4.735 -5.868 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.288 6.371 -7.216 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -8.802 7.023 -6.555 1.00 0.00 H new ATOM 0 HG LEU A 91 -9.003 5.080 -8.874 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.240 6.994 -10.231 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -9.803 7.320 -9.444 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -8.310 8.035 -8.789 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -6.592 5.503 -9.170 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -6.587 6.481 -7.684 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.944 4.740 -7.601 1.00 0.00 H new ATOM 1491 N GLU A 92 -11.126 5.246 -4.660 1.00 0.00 N ATOM 1492 CA GLU A 92 -11.854 5.572 -3.442 1.00 0.00 C ATOM 1493 C GLU A 92 -11.578 4.536 -2.352 1.00 0.00 C ATOM 1494 O GLU A 92 -11.381 4.882 -1.186 1.00 0.00 O ATOM 1495 CB GLU A 92 -13.350 5.672 -3.724 1.00 0.00 C ATOM 1496 CG GLU A 92 -13.726 6.831 -4.637 1.00 0.00 C ATOM 1497 CD GLU A 92 -13.324 8.177 -4.067 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -13.866 8.565 -3.005 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -12.478 8.859 -4.676 1.00 0.00 O1- ATOM 0 H GLU A 92 -11.713 4.936 -5.435 1.00 0.00 H new ATOM 0 HA GLU A 92 -11.506 6.541 -3.084 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -13.688 4.740 -4.177 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -13.882 5.778 -2.779 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -13.248 6.694 -5.607 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -14.803 6.820 -4.808 1.00 0.00 H new ATOM 1506 N GLU A 93 -11.552 3.266 -2.745 1.00 0.00 N ATOM 1507 CA GLU A 93 -11.258 2.178 -1.815 1.00 0.00 C ATOM 1508 C GLU A 93 -9.813 2.266 -1.331 1.00 0.00 C ATOM 1509 O GLU A 93 -9.505 1.949 -0.180 1.00 0.00 O ATOM 1510 CB GLU A 93 -11.499 0.821 -2.479 1.00 0.00 C ATOM 1511 CG GLU A 93 -12.954 0.539 -2.813 1.00 0.00 C ATOM 1512 CD GLU A 93 -13.149 -0.833 -3.424 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -12.826 -1.841 -2.754 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -13.637 -0.919 -4.566 1.00 0.00 O1- ATOM 0 H GLU A 93 -11.731 2.964 -3.703 1.00 0.00 H new ATOM 0 HA GLU A 93 -11.926 2.274 -0.959 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -10.911 0.768 -3.395 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -11.131 0.036 -1.819 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -13.554 0.619 -1.907 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -13.319 1.298 -3.505 1.00 0.00 H new ATOM 1521 N LEU A 94 -8.941 2.708 -2.223 1.00 0.00 N ATOM 1522 CA LEU A 94 -7.522 2.839 -1.941 1.00 0.00 C ATOM 1523 C LEU A 94 -7.292 3.827 -0.805 1.00 0.00 C ATOM 1524 O LEU A 94 -6.518 3.561 0.114 1.00 0.00 O ATOM 1525 CB LEU A 94 -6.795 3.309 -3.204 1.00 0.00 C ATOM 1526 CG LEU A 94 -5.273 3.299 -3.153 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -4.755 1.876 -3.008 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -4.703 3.956 -4.401 1.00 0.00 C ATOM 0 H LEU A 94 -9.200 2.988 -3.169 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.129 1.870 -1.635 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.113 2.680 -4.035 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.123 4.324 -3.429 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.947 3.869 -2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.666 1.887 -2.973 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.143 1.440 -2.088 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.085 1.280 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.614 3.943 -4.354 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.034 3.409 -5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.052 4.987 -4.461 1.00 0.00 H new ATOM 1540 N GLU A 95 -7.983 4.958 -0.869 1.00 0.00 N ATOM 1541 CA GLU A 95 -7.888 5.985 0.162 1.00 0.00 C ATOM 1542 C GLU A 95 -8.197 5.409 1.535 1.00 0.00 C ATOM 1543 O GLU A 95 -7.461 5.643 2.498 1.00 0.00 O ATOM 1544 CB GLU A 95 -8.848 7.131 -0.150 1.00 0.00 C ATOM 1545 CG GLU A 95 -8.418 7.980 -1.329 1.00 0.00 C ATOM 1546 CD GLU A 95 -7.271 8.907 -0.988 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -7.456 10.141 -1.081 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -6.193 8.418 -0.614 1.00 0.00 O1- ATOM 0 H GLU A 95 -8.621 5.189 -1.631 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.866 6.364 0.172 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.837 6.720 -0.351 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.939 7.767 0.731 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.123 7.330 -2.152 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.266 8.570 -1.677 1.00 0.00 H new ATOM 1555 N GLN A 96 -9.269 4.635 1.607 1.00 0.00 N ATOM 1556 CA GLN A 96 -9.705 4.024 2.854 1.00 0.00 C ATOM 1557 C GLN A 96 -8.660 3.047 3.385 1.00 0.00 C ATOM 1558 O GLN A 96 -8.373 3.021 4.585 1.00 0.00 O ATOM 1559 CB GLN A 96 -11.036 3.296 2.649 1.00 0.00 C ATOM 1560 CG GLN A 96 -12.153 4.188 2.131 1.00 0.00 C ATOM 1561 CD GLN A 96 -12.498 5.308 3.091 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -11.929 6.398 3.026 1.00 0.00 O ATOM 1563 NE2 GLN A 96 -13.436 5.056 3.974 1.00 0.00 N ATOM 0 H GLN A 96 -9.860 4.413 0.806 1.00 0.00 H new ATOM 0 HA GLN A 96 -9.836 4.819 3.588 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -10.886 2.475 1.948 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -11.347 2.854 3.596 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -11.857 4.614 1.172 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -13.042 3.583 1.950 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -13.883 4.140 3.995 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -13.717 5.777 4.639 1.00 0.00 H new ATOM 1572 N ALA A 97 -8.083 2.261 2.485 1.00 0.00 N ATOM 1573 CA ALA A 97 -7.102 1.255 2.864 1.00 0.00 C ATOM 1574 C ALA A 97 -5.839 1.883 3.449 1.00 0.00 C ATOM 1575 O ALA A 97 -5.346 1.442 4.488 1.00 0.00 O ATOM 1576 CB ALA A 97 -6.756 0.380 1.668 1.00 0.00 C ATOM 0 H ALA A 97 -8.279 2.302 1.485 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.548 0.636 3.642 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -6.021 -0.368 1.965 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.657 -0.118 1.309 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.342 0.999 0.872 1.00 0.00 H new ATOM 1582 N LEU A 98 -5.330 2.924 2.800 1.00 0.00 N ATOM 1583 CA LEU A 98 -4.118 3.590 3.274 1.00 0.00 C ATOM 1584 C LEU A 98 -4.341 4.317 4.586 1.00 0.00 C ATOM 1585 O LEU A 98 -3.472 4.304 5.462 1.00 0.00 O ATOM 1586 CB LEU A 98 -3.535 4.534 2.215 1.00 0.00 C ATOM 1587 CG LEU A 98 -2.712 3.871 1.096 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -1.484 3.183 1.675 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -3.544 2.882 0.298 1.00 0.00 C ATOM 0 H LEU A 98 -5.732 3.324 1.952 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.385 2.804 3.458 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.357 5.084 1.756 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.903 5.266 2.718 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.389 4.658 0.415 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.913 2.719 0.870 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.861 3.918 2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.797 2.418 2.385 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.928 2.435 -0.482 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.914 2.100 0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.387 3.401 -0.158 1.00 0.00 H new ATOM 1601 N GLN A 99 -5.499 4.945 4.731 1.00 0.00 N ATOM 1602 CA GLN A 99 -5.827 5.633 5.972 1.00 0.00 C ATOM 1603 C GLN A 99 -5.909 4.636 7.113 1.00 0.00 C ATOM 1604 O GLN A 99 -5.417 4.890 8.208 1.00 0.00 O ATOM 1605 CB GLN A 99 -7.141 6.403 5.839 1.00 0.00 C ATOM 1606 CG GLN A 99 -7.058 7.584 4.891 1.00 0.00 C ATOM 1607 CD GLN A 99 -8.396 8.257 4.665 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -9.262 8.260 5.538 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -8.570 8.837 3.493 1.00 0.00 N ATOM 0 H GLN A 99 -6.221 4.993 4.012 1.00 0.00 H new ATOM 0 HA GLN A 99 -5.036 6.352 6.187 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -7.918 5.722 5.491 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -7.446 6.758 6.823 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -6.353 8.314 5.289 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -6.661 7.247 3.934 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -7.826 8.812 2.796 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.449 9.311 3.284 1.00 0.00 H new ATOM 1618 N LYS A 100 -6.496 3.482 6.830 1.00 0.00 N ATOM 1619 CA LYS A 100 -6.643 2.427 7.820 1.00 0.00 C ATOM 1620 C LYS A 100 -5.279 1.940 8.300 1.00 0.00 C ATOM 1621 O LYS A 100 -5.036 1.832 9.500 1.00 0.00 O ATOM 1622 CB LYS A 100 -7.430 1.261 7.215 1.00 0.00 C ATOM 1623 CG LYS A 100 -7.537 0.042 8.116 1.00 0.00 C ATOM 1624 CD LYS A 100 -8.270 -1.087 7.418 1.00 0.00 C ATOM 1625 CE LYS A 100 -8.323 -2.332 8.281 1.00 0.00 C ATOM 1626 NZ LYS A 100 -9.121 -3.405 7.646 1.00 0.00 N ATOM 0 H LYS A 100 -6.881 3.252 5.914 1.00 0.00 H new ATOM 0 HA LYS A 100 -7.185 2.827 8.677 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -8.435 1.605 6.969 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.956 0.965 6.279 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -6.540 -0.290 8.404 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -8.062 0.308 9.034 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -9.284 -0.768 7.174 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -7.773 -1.317 6.476 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -7.310 -2.691 8.464 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.753 -2.084 9.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -9.135 -4.240 8.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -10.094 -3.071 7.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -8.696 -3.659 6.732 1.00 0.00 H new ATOM 1640 N ILE A 101 -4.381 1.684 7.356 1.00 0.00 N ATOM 1641 CA ILE A 101 -3.044 1.199 7.683 1.00 0.00 C ATOM 1642 C ILE A 101 -2.273 2.242 8.484 1.00 0.00 C ATOM 1643 O ILE A 101 -1.613 1.920 9.478 1.00 0.00 O ATOM 1644 CB ILE A 101 -2.242 0.838 6.405 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -2.947 -0.283 5.634 1.00 0.00 C ATOM 1646 CG2 ILE A 101 -0.815 0.424 6.761 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -2.269 -0.645 4.329 1.00 0.00 C ATOM 0 H ILE A 101 -4.554 1.804 6.358 1.00 0.00 H new ATOM 0 HA ILE A 101 -3.167 0.298 8.284 1.00 0.00 H new ATOM 0 HB ILE A 101 -2.193 1.722 5.769 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.997 -1.170 6.265 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.974 0.020 5.428 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -0.270 0.175 5.850 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -0.314 1.247 7.270 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -0.842 -0.446 7.417 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -2.825 -1.445 3.840 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -2.243 0.229 3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -1.251 -0.980 4.528 1.00 0.00 H new ATOM 1659 N ARG A 102 -2.382 3.494 8.066 1.00 0.00 N ATOM 1660 CA ARG A 102 -1.671 4.578 8.719 1.00 0.00 C ATOM 1661 C ARG A 102 -2.144 4.761 10.162 1.00 0.00 C ATOM 1662 O ARG A 102 -1.334 5.012 11.059 1.00 0.00 O ATOM 1663 CB ARG A 102 -1.826 5.882 7.926 1.00 0.00 C ATOM 1664 CG ARG A 102 -0.946 7.017 8.430 1.00 0.00 C ATOM 1665 CD ARG A 102 0.516 6.591 8.490 1.00 0.00 C ATOM 1666 NE ARG A 102 1.391 7.671 8.926 1.00 0.00 N ATOM 1667 CZ ARG A 102 1.676 7.950 10.196 1.00 0.00 C ATOM 1668 NH1 ARG A 102 1.128 7.242 11.182 1.00 0.00 N ATOM 1669 NH2 ARG A 102 2.515 8.936 10.477 1.00 0.00 N ATOM 0 H ARG A 102 -2.958 3.783 7.275 1.00 0.00 H new ATOM 0 HA ARG A 102 -0.613 4.316 8.746 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -1.590 5.690 6.879 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -2.868 6.198 7.965 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -1.050 7.881 7.774 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -1.279 7.327 9.420 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.618 5.747 9.172 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.832 6.246 7.506 1.00 0.00 H new ATOM 0 HE ARG A 102 1.816 8.256 8.206 1.00 0.00 H new ATOM 0 HH11 ARG A 102 0.485 6.480 10.966 1.00 0.00 H new ATOM 0 HH12 ARG A 102 1.351 7.462 12.153 1.00 0.00 H new ATOM 0 HH21 ARG A 102 2.938 9.476 9.722 1.00 0.00 H new ATOM 0 HH22 ARG A 102 2.738 9.155 11.448 1.00 0.00 H new ATOM 1683 N GLU A 103 -3.446 4.618 10.381 1.00 0.00 N ATOM 1684 CA GLU A 103 -4.014 4.753 11.717 1.00 0.00 C ATOM 1685 C GLU A 103 -3.639 3.564 12.598 1.00 0.00 C ATOM 1686 O GLU A 103 -3.438 3.715 13.804 1.00 0.00 O ATOM 1687 CB GLU A 103 -5.534 4.910 11.649 1.00 0.00 C ATOM 1688 CG GLU A 103 -5.989 6.192 10.969 1.00 0.00 C ATOM 1689 CD GLU A 103 -5.438 7.435 11.636 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -4.427 7.982 11.149 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -6.017 7.877 12.651 1.00 0.00 O1- ATOM 0 H GLU A 103 -4.128 4.409 9.651 1.00 0.00 H new ATOM 0 HA GLU A 103 -3.594 5.653 12.166 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.954 4.058 11.115 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -5.938 4.883 12.661 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.676 6.176 9.925 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.078 6.234 10.974 1.00 0.00 H new ATOM 1698 N LEU A 104 -3.540 2.381 11.989 1.00 0.00 N ATOM 1699 CA LEU A 104 -3.152 1.172 12.719 1.00 0.00 C ATOM 1700 C LEU A 104 -1.718 1.287 13.222 1.00 0.00 C ATOM 1701 O LEU A 104 -1.373 0.753 14.276 1.00 0.00 O ATOM 1702 CB LEU A 104 -3.300 -0.076 11.838 1.00 0.00 C ATOM 1703 CG LEU A 104 -4.730 -0.455 11.441 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -4.726 -1.671 10.528 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -5.581 -0.719 12.676 1.00 0.00 C ATOM 0 H LEU A 104 -3.722 2.234 10.996 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.820 1.071 13.574 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.720 0.076 10.928 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.854 -0.921 12.363 1.00 0.00 H new ATOM 0 HG LEU A 104 -5.166 0.384 10.898 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.751 -1.925 10.256 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.156 -1.447 9.626 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.268 -2.514 11.046 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.593 -0.986 12.370 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.146 -1.538 13.249 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.614 0.178 13.294 1.00 0.00 H new ATOM 1717 N ALA A 105 -0.889 1.995 12.466 1.00 0.00 N ATOM 1718 CA ALA A 105 0.498 2.215 12.852 1.00 0.00 C ATOM 1719 C ALA A 105 0.573 3.120 14.077 1.00 0.00 C ATOM 1720 O ALA A 105 1.520 3.060 14.851 1.00 0.00 O ATOM 1721 CB ALA A 105 1.281 2.820 11.695 1.00 0.00 C ATOM 0 H ALA A 105 -1.154 2.427 11.581 1.00 0.00 H new ATOM 0 HA ALA A 105 0.943 1.253 13.106 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.316 2.978 11.999 1.00 0.00 H new ATOM 0 HB2 ALA A 105 1.253 2.141 10.843 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.835 3.774 11.414 1.00 0.00 H new ATOM 1727 N GLU A 106 -0.451 3.941 14.252 1.00 0.00 N ATOM 1728 CA GLU A 106 -0.520 4.858 15.374 1.00 0.00 C ATOM 1729 C GLU A 106 -1.096 4.180 16.610 1.00 0.00 C ATOM 1730 O GLU A 106 -1.194 4.792 17.671 1.00 0.00 O ATOM 1731 CB GLU A 106 -1.355 6.084 15.016 1.00 0.00 C ATOM 1732 CG GLU A 106 -0.694 7.007 14.011 1.00 0.00 C ATOM 1733 CD GLU A 106 0.623 7.559 14.512 1.00 0.00 C ATOM 1734 OE1 GLU A 106 0.648 8.137 15.621 1.00 0.00 O ATOM 1735 OE2 GLU A 106 1.639 7.431 13.796 1.00 0.00 O1- ATOM 0 H GLU A 106 -1.252 3.989 13.623 1.00 0.00 H new ATOM 0 HA GLU A 106 0.498 5.175 15.602 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.314 5.754 14.615 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.566 6.646 15.926 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.527 6.466 13.080 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -1.368 7.833 13.783 1.00 0.00 H new ATOM 1742 N LYS A 107 -1.484 2.925 16.472 1.00 0.00 N ATOM 1743 CA LYS A 107 -2.032 2.177 17.587 1.00 0.00 C ATOM 1744 C LYS A 107 -0.913 1.628 18.463 1.00 0.00 C ATOM 1745 O LYS A 107 -0.335 0.585 18.167 1.00 0.00 O ATOM 1746 CB LYS A 107 -2.932 1.034 17.088 1.00 0.00 C ATOM 1747 CG LYS A 107 -3.489 0.143 18.196 1.00 0.00 C ATOM 1748 CD LYS A 107 -4.400 -0.937 17.630 1.00 0.00 C ATOM 1749 CE LYS A 107 -4.903 -1.882 18.716 1.00 0.00 C ATOM 1750 NZ LYS A 107 -3.815 -2.728 19.282 1.00 0.00 N ATOM 0 H LYS A 107 -1.429 2.403 15.598 1.00 0.00 H new ATOM 0 HA LYS A 107 -2.640 2.855 18.185 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.764 1.461 16.528 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.363 0.417 16.393 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.667 -0.320 18.741 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.043 0.751 18.911 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.250 -0.471 17.132 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -3.861 -1.507 16.874 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -5.361 -1.300 19.516 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.681 -2.524 18.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.220 -3.609 19.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.127 -2.953 18.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.338 -2.213 20.049 1.00 0.00 H new ATOM 1764 N LYS A 108 -0.584 2.355 19.517 1.00 0.00 N ATOM 1765 CA LYS A 108 0.437 1.911 20.452 1.00 0.00 C ATOM 1766 C LYS A 108 -0.190 1.037 21.516 1.00 0.00 C ATOM 1767 O LYS A 108 -0.974 1.524 22.335 1.00 0.00 O ATOM 1768 CB LYS A 108 1.162 3.100 21.115 1.00 0.00 C ATOM 1769 CG LYS A 108 2.205 3.794 20.237 1.00 0.00 C ATOM 1770 CD LYS A 108 1.572 4.581 19.104 1.00 0.00 C ATOM 1771 CE LYS A 108 2.619 5.310 18.276 1.00 0.00 C ATOM 1772 NZ LYS A 108 3.401 6.275 19.092 1.00 0.00 N ATOM 0 H LYS A 108 -1.008 3.254 19.747 1.00 0.00 H new ATOM 0 HA LYS A 108 1.177 1.340 19.891 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.418 3.836 21.419 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.651 2.747 22.023 1.00 0.00 H new ATOM 0 HG2 LYS A 108 2.805 4.465 20.851 1.00 0.00 H new ATOM 0 HG3 LYS A 108 2.883 3.048 19.823 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.006 3.905 18.463 1.00 0.00 H new ATOM 0 HD3 LYS A 108 0.863 5.302 19.512 1.00 0.00 H new ATOM 0 HE2 LYS A 108 3.296 4.584 17.826 1.00 0.00 H new ATOM 0 HE3 LYS A 108 2.130 5.839 17.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 3.903 6.934 18.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 2.757 6.809 19.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 4.091 5.758 19.674 1.00 0.00 H new ATOM 1786 N ASN A 109 0.143 -0.254 21.485 1.00 0.00 N ATOM 1787 CA ASN A 109 -0.382 -1.235 22.443 1.00 0.00 C ATOM 1788 C ASN A 109 -1.875 -1.451 22.240 1.00 0.00 C ATOM 1789 O ASN A 109 -2.243 -2.342 21.449 1.00 0.00 O ATOM 1790 CB ASN A 109 -0.088 -0.818 23.896 1.00 0.00 C ATOM 1791 CG ASN A 109 1.390 -0.860 24.233 1.00 0.00 C ATOM 1792 OD1 ASN A 109 2.120 0.121 24.041 1.00 0.00 O ATOM 1793 ND2 ASN A 109 1.846 -1.990 24.734 1.00 0.00 N ATOM 1794 OXT ASN A 109 -2.678 -0.727 22.857 1.00 0.00 O ATOM 0 H ASN A 109 0.783 -0.651 20.797 1.00 0.00 H new ATOM 0 HA ASN A 109 0.130 -2.179 22.256 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.465 0.191 24.063 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -0.629 -1.477 24.575 1.00 0.00 H new ATOM 0 HD21 ASN A 109 2.832 -2.078 24.978 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.213 -2.777 24.878 1.00 0.00 H new TER 1801 ASN A 109