USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 960 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 86 THR OG1 : rot -157:sc= -0.917! USER MOD Set 1.2: A 88 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 62 ASN : amide:sc= -2.51 K(o=-3.4,f=-4.6!) USER MOD Set 2.2: A 68 SER OG : rot -169:sc= -0.933! USER MOD Single : A 1 GLY N :NH3+ 175:sc= 0 (180deg=-0.0322) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.255 X(o=-0.26,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 71:sc= -0.648 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl -150:sc= 0 (180deg=-0.00456) USER MOD Single : A 27 THR OG1 : rot 59:sc= -1.15! USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -6.25! C(o=-6.2!,f=-3.2!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 47:sc= 1.06 USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 69 TYR OH : rot 15:sc= -1.51 USER MOD Single : A 79 ASN : amide:sc= -11.1! C(o=-11!,f=-16!) USER MOD Single : A 90 SER OG : rot 160:sc= -1.35! USER MOD Single : A 91 LYS NZ :NH3+ 151:sc= -0.295 (180deg=-1.69!) USER MOD Single : A 95 THR OG1 : rot -146:sc= -0.355 USER MOD Single : A 97 TYR OH : rot 30:sc= -0.105 USER MOD Single : A 98 SER OG : rot 77:sc= 0.892 USER MOD Single : A 99 ASN : amide:sc= -4.61! K(o=-4.6!,f=-0.88) USER MOD Single : A 104 THR OG1 : rot 18:sc= 0.865! USER MOD Single : A 105 LYS NZ :NH3+ 169:sc= 1.48 (180deg=1.03!) USER MOD Single : A 110 SER OG : rot 65:sc= -11.7! USER MOD Single : A 118 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.032) USER MOD Single : A 120 SER OG : rot -85:sc= -0.821! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.876 10.806 7.559 1.00 0.00 N ATOM 2 CA GLY A 1 10.943 11.795 7.237 1.00 0.00 C ATOM 3 C GLY A 1 11.517 12.370 8.533 1.00 0.00 C ATOM 4 O GLY A 1 12.108 11.666 9.328 1.00 0.00 O ATOM 0 H1 GLY A 1 9.429 10.479 6.679 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.294 9.994 8.057 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.160 11.253 8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.733 11.317 6.658 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.536 12.596 6.620 1.00 0.00 H new ATOM 10 N SER A 2 11.350 13.647 8.752 1.00 0.00 N ATOM 11 CA SER A 2 11.889 14.268 9.997 1.00 0.00 C ATOM 12 C SER A 2 10.856 14.182 11.125 1.00 0.00 C ATOM 13 O SER A 2 11.185 13.902 12.260 1.00 0.00 O ATOM 14 CB SER A 2 12.158 15.727 9.630 1.00 0.00 C ATOM 15 OG SER A 2 13.553 15.985 9.725 1.00 0.00 O ATOM 0 H SER A 2 10.864 14.287 8.123 1.00 0.00 H new ATOM 0 HA SER A 2 12.788 13.763 10.351 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.807 15.930 8.618 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.607 16.390 10.298 1.00 0.00 H new ATOM 0 HG SER A 2 13.730 16.920 9.489 1.00 0.00 H new ATOM 21 N HIS A 3 9.609 14.426 10.822 1.00 0.00 N ATOM 22 CA HIS A 3 8.560 14.362 11.882 1.00 0.00 C ATOM 23 C HIS A 3 7.757 13.063 11.762 1.00 0.00 C ATOM 24 O HIS A 3 8.179 12.116 11.127 1.00 0.00 O ATOM 25 CB HIS A 3 7.670 15.578 11.625 1.00 0.00 C ATOM 26 CG HIS A 3 8.386 16.821 12.077 1.00 0.00 C ATOM 27 ND1 HIS A 3 7.763 18.059 12.129 1.00 0.00 N ATOM 28 CD2 HIS A 3 9.675 17.031 12.497 1.00 0.00 C ATOM 29 CE1 HIS A 3 8.672 18.950 12.568 1.00 0.00 C ATOM 30 NE2 HIS A 3 9.854 18.376 12.807 1.00 0.00 N ATOM 0 H HIS A 3 9.272 14.666 9.890 1.00 0.00 H new ATOM 0 HA HIS A 3 8.984 14.372 12.886 1.00 0.00 H new ATOM 0 HB2 HIS A 3 7.428 15.649 10.564 1.00 0.00 H new ATOM 0 HB3 HIS A 3 6.727 15.473 12.161 1.00 0.00 H new ATOM 0 HD2 HIS A 3 10.436 16.268 12.575 1.00 0.00 H new ATOM 0 HE1 HIS A 3 8.470 20.001 12.710 1.00 0.00 H new ATOM 0 HE2 HIS A 3 10.705 18.826 13.144 1.00 0.00 H new ATOM 38 N MET A 4 6.602 13.012 12.369 1.00 0.00 N ATOM 39 CA MET A 4 5.770 11.776 12.296 1.00 0.00 C ATOM 40 C MET A 4 4.948 11.765 11.004 1.00 0.00 C ATOM 41 O MET A 4 4.302 12.735 10.658 1.00 0.00 O ATOM 42 CB MET A 4 4.851 11.845 13.516 1.00 0.00 C ATOM 43 CG MET A 4 4.396 10.434 13.891 1.00 0.00 C ATOM 44 SD MET A 4 2.636 10.248 13.509 1.00 0.00 S ATOM 45 CE MET A 4 2.043 10.143 15.216 1.00 0.00 C ATOM 0 H MET A 4 6.198 13.774 12.913 1.00 0.00 H new ATOM 0 HA MET A 4 6.376 10.870 12.293 1.00 0.00 H new ATOM 0 HB2 MET A 4 5.375 12.305 14.354 1.00 0.00 H new ATOM 0 HB3 MET A 4 3.986 12.472 13.298 1.00 0.00 H new ATOM 0 HG2 MET A 4 4.979 9.694 13.342 1.00 0.00 H new ATOM 0 HG3 MET A 4 4.570 10.254 14.952 1.00 0.00 H new ATOM 0 HE1 MET A 4 0.960 10.023 15.218 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.504 9.287 15.709 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.308 11.056 15.750 1.00 0.00 H new ATOM 55 N THR A 5 4.967 10.674 10.288 1.00 0.00 N ATOM 56 CA THR A 5 4.188 10.598 9.017 1.00 0.00 C ATOM 57 C THR A 5 3.274 9.371 9.044 1.00 0.00 C ATOM 58 O THR A 5 3.471 8.462 9.825 1.00 0.00 O ATOM 59 CB THR A 5 5.239 10.467 7.912 1.00 0.00 C ATOM 60 OG1 THR A 5 5.737 9.137 7.889 1.00 0.00 O ATOM 61 CG2 THR A 5 6.390 11.443 8.176 1.00 0.00 C ATOM 0 H THR A 5 5.488 9.831 10.528 1.00 0.00 H new ATOM 0 HA THR A 5 3.551 11.469 8.864 1.00 0.00 H new ATOM 0 HB THR A 5 4.784 10.701 6.950 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.044 8.534 7.548 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.136 11.347 7.388 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.006 12.463 8.190 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.848 11.214 9.138 1.00 0.00 H new ATOM 69 N GLU A 6 2.269 9.333 8.211 1.00 0.00 N ATOM 70 CA GLU A 6 1.358 8.151 8.230 1.00 0.00 C ATOM 71 C GLU A 6 0.748 7.861 6.848 1.00 0.00 C ATOM 72 O GLU A 6 0.015 6.906 6.690 1.00 0.00 O ATOM 73 CB GLU A 6 0.263 8.521 9.230 1.00 0.00 C ATOM 74 CG GLU A 6 -0.691 9.532 8.598 1.00 0.00 C ATOM 75 CD GLU A 6 -1.284 10.424 9.690 1.00 0.00 C ATOM 76 OE1 GLU A 6 -1.826 9.882 10.638 1.00 0.00 O ATOM 77 OE2 GLU A 6 -1.184 11.633 9.559 1.00 0.00 O ATOM 0 H GLU A 6 2.041 10.056 7.529 1.00 0.00 H new ATOM 0 HA GLU A 6 1.897 7.244 8.505 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.285 7.628 9.531 1.00 0.00 H new ATOM 0 HB3 GLU A 6 0.708 8.941 10.132 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -0.161 10.140 7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -1.488 9.013 8.065 1.00 0.00 H new ATOM 84 N ARG A 7 1.032 8.654 5.846 1.00 0.00 N ATOM 85 CA ARG A 7 0.443 8.372 4.498 1.00 0.00 C ATOM 86 C ARG A 7 0.831 9.454 3.486 1.00 0.00 C ATOM 87 O ARG A 7 0.926 9.199 2.302 1.00 0.00 O ATOM 88 CB ARG A 7 -1.074 8.376 4.713 1.00 0.00 C ATOM 89 CG ARG A 7 -1.482 9.605 5.528 1.00 0.00 C ATOM 90 CD ARG A 7 -2.268 10.574 4.641 1.00 0.00 C ATOM 91 NE ARG A 7 -2.920 11.518 5.592 1.00 0.00 N ATOM 92 CZ ARG A 7 -3.772 12.407 5.156 1.00 0.00 C ATOM 93 NH1 ARG A 7 -4.050 12.483 3.882 1.00 0.00 N ATOM 94 NH2 ARG A 7 -4.343 13.225 5.998 1.00 0.00 N ATOM 0 H ARG A 7 1.637 9.473 5.899 1.00 0.00 H new ATOM 0 HA ARG A 7 0.805 7.425 4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.586 8.381 3.751 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -1.379 7.467 5.232 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -2.090 9.303 6.381 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -0.596 10.099 5.927 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -1.609 11.101 3.950 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -3.007 10.047 4.038 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.700 11.470 6.587 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -3.601 11.847 3.223 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -4.716 13.179 3.546 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -4.123 13.169 6.992 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -5.009 13.921 5.661 1.00 0.00 H new ATOM 108 N ARG A 8 1.037 10.659 3.935 1.00 0.00 N ATOM 109 CA ARG A 8 1.396 11.757 2.989 1.00 0.00 C ATOM 110 C ARG A 8 2.876 11.684 2.589 1.00 0.00 C ATOM 111 O ARG A 8 3.344 12.478 1.798 1.00 0.00 O ATOM 112 CB ARG A 8 1.113 13.049 3.770 1.00 0.00 C ATOM 113 CG ARG A 8 2.018 14.182 3.265 1.00 0.00 C ATOM 114 CD ARG A 8 1.754 15.454 4.070 1.00 0.00 C ATOM 115 NE ARG A 8 0.875 16.279 3.199 1.00 0.00 N ATOM 116 CZ ARG A 8 -0.420 16.163 3.289 1.00 0.00 C ATOM 117 NH1 ARG A 8 -1.002 16.253 4.453 1.00 0.00 N ATOM 118 NH2 ARG A 8 -1.134 15.954 2.217 1.00 0.00 N ATOM 0 H ARG A 8 0.973 10.934 4.915 1.00 0.00 H new ATOM 0 HA ARG A 8 0.828 11.696 2.061 1.00 0.00 H new ATOM 0 HB2 ARG A 8 0.066 13.331 3.655 1.00 0.00 H new ATOM 0 HB3 ARG A 8 1.283 12.884 4.834 1.00 0.00 H new ATOM 0 HG2 ARG A 8 3.065 13.893 3.358 1.00 0.00 H new ATOM 0 HG3 ARG A 8 1.831 14.365 2.207 1.00 0.00 H new ATOM 0 HD2 ARG A 8 1.270 15.228 5.020 1.00 0.00 H new ATOM 0 HD3 ARG A 8 2.683 15.975 4.302 1.00 0.00 H new ATOM 0 HE ARG A 8 1.285 16.934 2.533 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -0.444 16.414 5.291 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -2.015 16.162 4.525 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -0.679 15.881 1.307 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.147 15.863 2.289 1.00 0.00 H new ATOM 132 N LEU A 9 3.627 10.774 3.140 1.00 0.00 N ATOM 133 CA LEU A 9 5.069 10.723 2.785 1.00 0.00 C ATOM 134 C LEU A 9 5.354 9.759 1.632 1.00 0.00 C ATOM 135 O LEU A 9 5.963 10.135 0.649 1.00 0.00 O ATOM 136 CB LEU A 9 5.784 10.253 4.044 1.00 0.00 C ATOM 137 CG LEU A 9 6.356 11.465 4.779 1.00 0.00 C ATOM 138 CD1 LEU A 9 7.375 12.167 3.882 1.00 0.00 C ATOM 139 CD2 LEU A 9 5.225 12.439 5.115 1.00 0.00 C ATOM 0 H LEU A 9 3.311 10.074 3.811 1.00 0.00 H new ATOM 0 HA LEU A 9 5.409 11.702 2.447 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.091 9.714 4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.584 9.559 3.785 1.00 0.00 H new ATOM 0 HG LEU A 9 6.840 11.136 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.784 13.032 4.404 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.181 11.476 3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.887 12.495 2.964 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.633 13.303 5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.742 12.767 4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.493 11.941 5.751 1.00 0.00 H new ATOM 151 N ARG A 10 4.974 8.513 1.740 1.00 0.00 N ATOM 152 CA ARG A 10 5.308 7.579 0.628 1.00 0.00 C ATOM 153 C ARG A 10 4.335 6.390 0.519 1.00 0.00 C ATOM 154 O ARG A 10 3.422 6.214 1.307 1.00 0.00 O ATOM 155 CB ARG A 10 6.719 7.091 0.965 1.00 0.00 C ATOM 156 CG ARG A 10 7.684 7.410 -0.190 1.00 0.00 C ATOM 157 CD ARG A 10 7.062 7.047 -1.550 1.00 0.00 C ATOM 158 NE ARG A 10 7.753 7.910 -2.544 1.00 0.00 N ATOM 159 CZ ARG A 10 7.555 7.724 -3.821 1.00 0.00 C ATOM 160 NH1 ARG A 10 6.386 7.324 -4.246 1.00 0.00 N ATOM 161 NH2 ARG A 10 8.524 7.934 -4.670 1.00 0.00 N ATOM 0 H ARG A 10 4.462 8.111 2.525 1.00 0.00 H new ATOM 0 HA ARG A 10 5.237 8.079 -0.338 1.00 0.00 H new ATOM 0 HB2 ARG A 10 7.067 7.568 1.881 1.00 0.00 H new ATOM 0 HB3 ARG A 10 6.705 6.017 1.150 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.937 8.470 -0.174 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.614 6.858 -0.053 1.00 0.00 H new ATOM 0 HD2 ARG A 10 7.207 5.991 -1.779 1.00 0.00 H new ATOM 0 HD3 ARG A 10 5.987 7.229 -1.552 1.00 0.00 H new ATOM 0 HE ARG A 10 8.382 8.648 -2.228 1.00 0.00 H new ATOM 0 HH11 ARG A 10 5.631 7.158 -3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 10 6.228 7.178 -5.243 1.00 0.00 H new ATOM 0 HH21 ARG A 10 9.437 8.244 -4.336 1.00 0.00 H new ATOM 0 HH22 ARG A 10 8.369 7.788 -5.668 1.00 0.00 H new ATOM 175 N VAL A 11 4.535 5.570 -0.478 1.00 0.00 N ATOM 176 CA VAL A 11 3.658 4.388 -0.672 1.00 0.00 C ATOM 177 C VAL A 11 4.498 3.182 -1.119 1.00 0.00 C ATOM 178 O VAL A 11 4.830 3.019 -2.280 1.00 0.00 O ATOM 179 CB VAL A 11 2.653 4.812 -1.746 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.110 6.200 -1.403 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.338 4.867 -3.113 1.00 0.00 C ATOM 0 H VAL A 11 5.277 5.673 -1.171 1.00 0.00 H new ATOM 0 HA VAL A 11 3.148 4.083 0.242 1.00 0.00 H new ATOM 0 HB VAL A 11 1.839 4.088 -1.781 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.393 6.509 -2.164 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.617 6.168 -0.432 1.00 0.00 H new ATOM 0 HG13 VAL A 11 2.933 6.914 -1.369 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.615 5.170 -3.870 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.154 5.588 -3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.733 3.882 -3.362 1.00 0.00 H new ATOM 191 N LEU A 12 4.860 2.334 -0.199 1.00 0.00 N ATOM 192 CA LEU A 12 5.678 1.152 -0.572 1.00 0.00 C ATOM 193 C LEU A 12 4.767 0.033 -1.084 1.00 0.00 C ATOM 194 O LEU A 12 4.236 -0.755 -0.329 1.00 0.00 O ATOM 195 CB LEU A 12 6.407 0.774 0.714 1.00 0.00 C ATOM 196 CG LEU A 12 7.155 2.012 1.218 1.00 0.00 C ATOM 197 CD1 LEU A 12 8.002 1.659 2.439 1.00 0.00 C ATOM 198 CD2 LEU A 12 8.069 2.532 0.106 1.00 0.00 C ATOM 0 H LEU A 12 4.625 2.409 0.791 1.00 0.00 H new ATOM 0 HA LEU A 12 6.386 1.346 -1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 12 5.698 0.426 1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.104 -0.043 0.530 1.00 0.00 H new ATOM 0 HG LEU A 12 6.430 2.776 1.498 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.528 2.548 2.786 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.357 1.285 3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 12 8.727 0.891 2.169 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.605 3.414 0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 12 8.785 1.757 -0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.469 2.796 -0.765 1.00 0.00 H new ATOM 210 N VAL A 13 4.586 -0.029 -2.375 1.00 0.00 N ATOM 211 CA VAL A 13 3.709 -1.077 -2.973 1.00 0.00 C ATOM 212 C VAL A 13 4.583 -2.185 -3.538 1.00 0.00 C ATOM 213 O VAL A 13 5.572 -1.927 -4.193 1.00 0.00 O ATOM 214 CB VAL A 13 2.933 -0.378 -4.100 1.00 0.00 C ATOM 215 CG1 VAL A 13 1.634 -1.139 -4.377 1.00 0.00 C ATOM 216 CG2 VAL A 13 2.598 1.061 -3.691 1.00 0.00 C ATOM 0 H VAL A 13 5.012 0.608 -3.048 1.00 0.00 H new ATOM 0 HA VAL A 13 3.029 -1.520 -2.245 1.00 0.00 H new ATOM 0 HB VAL A 13 3.550 -0.363 -4.999 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.085 -0.642 -5.177 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.868 -2.160 -4.678 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.023 -1.157 -3.474 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.048 1.549 -4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.987 1.050 -2.788 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.521 1.608 -3.498 1.00 0.00 H new ATOM 226 N VAL A 14 4.258 -3.415 -3.281 1.00 0.00 N ATOM 227 CA VAL A 14 5.121 -4.503 -3.804 1.00 0.00 C ATOM 228 C VAL A 14 4.298 -5.735 -4.200 1.00 0.00 C ATOM 229 O VAL A 14 3.453 -6.211 -3.461 1.00 0.00 O ATOM 230 CB VAL A 14 6.061 -4.826 -2.643 1.00 0.00 C ATOM 231 CG1 VAL A 14 7.044 -3.671 -2.432 1.00 0.00 C ATOM 232 CG2 VAL A 14 5.240 -5.036 -1.373 1.00 0.00 C ATOM 0 H VAL A 14 3.446 -3.713 -2.740 1.00 0.00 H new ATOM 0 HA VAL A 14 5.653 -4.205 -4.707 1.00 0.00 H new ATOM 0 HB VAL A 14 6.620 -5.733 -2.873 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.711 -3.908 -1.603 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.631 -3.522 -3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.491 -2.760 -2.204 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.907 -5.267 -0.542 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.680 -4.128 -1.147 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.546 -5.863 -1.521 1.00 0.00 H new ATOM 242 N GLU A 15 4.560 -6.251 -5.372 1.00 0.00 N ATOM 243 CA GLU A 15 3.843 -7.460 -5.862 1.00 0.00 C ATOM 244 C GLU A 15 4.671 -8.106 -6.998 1.00 0.00 C ATOM 245 O GLU A 15 5.256 -7.433 -7.815 1.00 0.00 O ATOM 246 CB GLU A 15 2.462 -6.949 -6.323 1.00 0.00 C ATOM 247 CG GLU A 15 2.117 -7.496 -7.706 1.00 0.00 C ATOM 248 CD GLU A 15 2.171 -9.022 -7.660 1.00 0.00 C ATOM 249 OE1 GLU A 15 2.151 -9.553 -6.566 1.00 0.00 O ATOM 250 OE2 GLU A 15 2.248 -9.631 -8.710 1.00 0.00 O ATOM 0 H GLU A 15 5.253 -5.877 -6.020 1.00 0.00 H new ATOM 0 HA GLU A 15 3.713 -8.237 -5.109 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.699 -7.252 -5.606 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.462 -5.859 -6.347 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.124 -7.163 -8.007 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.819 -7.116 -8.448 1.00 0.00 H new ATOM 257 N ASP A 16 4.736 -9.412 -7.007 1.00 0.00 N ATOM 258 CA ASP A 16 5.544 -10.178 -8.020 1.00 0.00 C ATOM 259 C ASP A 16 5.330 -9.744 -9.480 1.00 0.00 C ATOM 260 O ASP A 16 4.828 -10.500 -10.284 1.00 0.00 O ATOM 261 CB ASP A 16 5.087 -11.627 -7.849 1.00 0.00 C ATOM 262 CG ASP A 16 3.594 -11.746 -8.188 1.00 0.00 C ATOM 263 OD1 ASP A 16 3.280 -11.937 -9.352 1.00 0.00 O ATOM 264 OD2 ASP A 16 2.790 -11.649 -7.276 1.00 0.00 O ATOM 0 H ASP A 16 4.248 -10.003 -6.334 1.00 0.00 H new ATOM 0 HA ASP A 16 6.606 -10.007 -7.841 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.670 -12.281 -8.498 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.264 -11.955 -6.825 1.00 0.00 H new ATOM 269 N GLU A 17 5.760 -8.571 -9.846 1.00 0.00 N ATOM 270 CA GLU A 17 5.628 -8.139 -11.279 1.00 0.00 C ATOM 271 C GLU A 17 6.013 -6.668 -11.447 1.00 0.00 C ATOM 272 O GLU A 17 6.012 -5.899 -10.508 1.00 0.00 O ATOM 273 CB GLU A 17 4.162 -8.361 -11.671 1.00 0.00 C ATOM 274 CG GLU A 17 3.247 -7.844 -10.568 1.00 0.00 C ATOM 275 CD GLU A 17 1.814 -8.319 -10.823 1.00 0.00 C ATOM 276 OE1 GLU A 17 1.609 -9.035 -11.789 1.00 0.00 O ATOM 277 OE2 GLU A 17 0.947 -7.970 -10.038 1.00 0.00 O ATOM 0 H GLU A 17 6.196 -7.890 -9.225 1.00 0.00 H new ATOM 0 HA GLU A 17 6.298 -8.714 -11.918 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.945 -7.846 -12.607 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.978 -9.422 -11.841 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.592 -8.202 -9.598 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.279 -6.755 -10.536 1.00 0.00 H new ATOM 284 N SER A 18 6.347 -6.280 -12.648 1.00 0.00 N ATOM 285 CA SER A 18 6.736 -4.864 -12.903 1.00 0.00 C ATOM 286 C SER A 18 5.487 -3.997 -13.076 1.00 0.00 C ATOM 287 O SER A 18 5.556 -2.785 -13.075 1.00 0.00 O ATOM 288 CB SER A 18 7.538 -4.905 -14.201 1.00 0.00 C ATOM 289 OG SER A 18 8.510 -5.937 -14.118 1.00 0.00 O ATOM 0 H SER A 18 6.367 -6.887 -13.468 1.00 0.00 H new ATOM 0 HA SER A 18 7.309 -4.438 -12.080 1.00 0.00 H new ATOM 0 HB2 SER A 18 6.874 -5.082 -15.047 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.024 -3.945 -14.373 1.00 0.00 H new ATOM 0 HG SER A 18 9.026 -5.968 -14.950 1.00 0.00 H new ATOM 295 N MET A 19 4.343 -4.610 -13.221 1.00 0.00 N ATOM 296 CA MET A 19 3.093 -3.820 -13.389 1.00 0.00 C ATOM 297 C MET A 19 2.931 -2.867 -12.210 1.00 0.00 C ATOM 298 O MET A 19 2.191 -1.905 -12.267 1.00 0.00 O ATOM 299 CB MET A 19 1.968 -4.853 -13.405 1.00 0.00 C ATOM 300 CG MET A 19 0.949 -4.476 -14.480 1.00 0.00 C ATOM 301 SD MET A 19 0.824 -5.822 -15.683 1.00 0.00 S ATOM 302 CE MET A 19 -0.181 -4.943 -16.906 1.00 0.00 C ATOM 0 H MET A 19 4.222 -5.623 -13.230 1.00 0.00 H new ATOM 0 HA MET A 19 3.096 -3.217 -14.297 1.00 0.00 H new ATOM 0 HB2 MET A 19 2.373 -5.845 -13.604 1.00 0.00 H new ATOM 0 HB3 MET A 19 1.485 -4.896 -12.429 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.024 -4.288 -14.025 1.00 0.00 H new ATOM 0 HG3 MET A 19 1.252 -3.555 -14.978 1.00 0.00 H new ATOM 0 HE1 MET A 19 -0.382 -5.600 -17.752 1.00 0.00 H new ATOM 0 HE2 MET A 19 -1.124 -4.638 -16.451 1.00 0.00 H new ATOM 0 HE3 MET A 19 0.357 -4.060 -17.252 1.00 0.00 H new ATOM 312 N ILE A 20 3.626 -3.129 -11.140 1.00 0.00 N ATOM 313 CA ILE A 20 3.528 -2.245 -9.950 1.00 0.00 C ATOM 314 C ILE A 20 4.767 -1.354 -9.860 1.00 0.00 C ATOM 315 O ILE A 20 4.821 -0.421 -9.085 1.00 0.00 O ATOM 316 CB ILE A 20 3.476 -3.204 -8.767 1.00 0.00 C ATOM 317 CG1 ILE A 20 3.498 -2.403 -7.462 1.00 0.00 C ATOM 318 CG2 ILE A 20 4.681 -4.142 -8.820 1.00 0.00 C ATOM 319 CD1 ILE A 20 3.235 -3.336 -6.278 1.00 0.00 C ATOM 0 H ILE A 20 4.260 -3.921 -11.039 1.00 0.00 H new ATOM 0 HA ILE A 20 2.661 -1.585 -9.985 1.00 0.00 H new ATOM 0 HB ILE A 20 2.560 -3.793 -8.812 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.463 -1.911 -7.342 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.742 -1.618 -7.493 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.645 -4.829 -7.974 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.659 -4.710 -9.750 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.600 -3.557 -8.774 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.252 -2.762 -5.352 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.259 -3.807 -6.396 1.00 0.00 H new ATOM 0 HD13 ILE A 20 4.007 -4.105 -6.242 1.00 0.00 H new ATOM 331 N ALA A 21 5.764 -1.642 -10.648 1.00 0.00 N ATOM 332 CA ALA A 21 7.006 -0.823 -10.619 1.00 0.00 C ATOM 333 C ALA A 21 6.827 0.440 -11.457 1.00 0.00 C ATOM 334 O ALA A 21 6.558 1.505 -10.936 1.00 0.00 O ATOM 335 CB ALA A 21 8.070 -1.728 -11.223 1.00 0.00 C ATOM 0 H ALA A 21 5.772 -2.414 -11.315 1.00 0.00 H new ATOM 0 HA ALA A 21 7.269 -0.492 -9.614 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.025 -1.204 -11.242 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.164 -2.632 -10.621 1.00 0.00 H new ATOM 0 HB3 ALA A 21 7.784 -1.998 -12.240 1.00 0.00 H new ATOM 341 N MET A 22 6.971 0.341 -12.747 1.00 0.00 N ATOM 342 CA MET A 22 6.798 1.555 -13.587 1.00 0.00 C ATOM 343 C MET A 22 5.446 2.188 -13.270 1.00 0.00 C ATOM 344 O MET A 22 5.230 3.366 -13.474 1.00 0.00 O ATOM 345 CB MET A 22 6.856 1.065 -15.035 1.00 0.00 C ATOM 346 CG MET A 22 6.366 2.173 -15.970 1.00 0.00 C ATOM 347 SD MET A 22 6.020 1.477 -17.604 1.00 0.00 S ATOM 348 CE MET A 22 4.320 0.956 -17.267 1.00 0.00 C ATOM 0 H MET A 22 7.198 -0.516 -13.251 1.00 0.00 H new ATOM 0 HA MET A 22 7.563 2.310 -13.405 1.00 0.00 H new ATOM 0 HB2 MET A 22 7.876 0.782 -15.293 1.00 0.00 H new ATOM 0 HB3 MET A 22 6.238 0.175 -15.154 1.00 0.00 H new ATOM 0 HG2 MET A 22 5.467 2.636 -15.563 1.00 0.00 H new ATOM 0 HG3 MET A 22 7.120 2.956 -16.049 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.081 0.080 -17.871 1.00 0.00 H new ATOM 0 HE2 MET A 22 4.218 0.707 -16.211 1.00 0.00 H new ATOM 0 HE3 MET A 22 3.635 1.766 -17.516 1.00 0.00 H new ATOM 358 N LEU A 23 4.546 1.410 -12.741 1.00 0.00 N ATOM 359 CA LEU A 23 3.213 1.948 -12.367 1.00 0.00 C ATOM 360 C LEU A 23 3.371 2.845 -11.130 1.00 0.00 C ATOM 361 O LEU A 23 2.436 3.474 -10.677 1.00 0.00 O ATOM 362 CB LEU A 23 2.385 0.690 -12.058 1.00 0.00 C ATOM 363 CG LEU A 23 1.022 1.055 -11.459 1.00 0.00 C ATOM 364 CD1 LEU A 23 1.186 1.384 -9.974 1.00 0.00 C ATOM 365 CD2 LEU A 23 0.429 2.260 -12.195 1.00 0.00 C ATOM 0 H LEU A 23 4.679 0.417 -12.551 1.00 0.00 H new ATOM 0 HA LEU A 23 2.741 2.557 -13.138 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.241 0.113 -12.972 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.932 0.054 -11.362 1.00 0.00 H new ATOM 0 HG LEU A 23 0.346 0.207 -11.569 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.216 1.643 -9.550 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.591 0.517 -9.452 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.868 2.226 -9.861 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.539 2.511 -11.761 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.102 3.112 -12.098 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.302 2.016 -13.250 1.00 0.00 H new ATOM 377 N ILE A 24 4.563 2.901 -10.583 1.00 0.00 N ATOM 378 CA ILE A 24 4.808 3.735 -9.372 1.00 0.00 C ATOM 379 C ILE A 24 5.591 5.009 -9.727 1.00 0.00 C ATOM 380 O ILE A 24 5.227 6.100 -9.333 1.00 0.00 O ATOM 381 CB ILE A 24 5.618 2.809 -8.444 1.00 0.00 C ATOM 382 CG1 ILE A 24 5.180 3.030 -6.993 1.00 0.00 C ATOM 383 CG2 ILE A 24 7.124 3.075 -8.559 1.00 0.00 C ATOM 384 CD1 ILE A 24 4.567 1.741 -6.439 1.00 0.00 C ATOM 0 H ILE A 24 5.380 2.399 -10.930 1.00 0.00 H new ATOM 0 HA ILE A 24 3.887 4.085 -8.906 1.00 0.00 H new ATOM 0 HB ILE A 24 5.427 1.779 -8.747 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.035 3.328 -6.386 1.00 0.00 H new ATOM 0 HG13 ILE A 24 4.454 3.841 -6.941 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.664 2.404 -7.891 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.447 2.902 -9.586 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.333 4.108 -8.282 1.00 0.00 H new ATOM 0 HD11 ILE A 24 4.256 1.900 -5.407 1.00 0.00 H new ATOM 0 HD12 ILE A 24 3.701 1.462 -7.040 1.00 0.00 H new ATOM 0 HD13 ILE A 24 5.307 0.941 -6.476 1.00 0.00 H new ATOM 396 N GLU A 25 6.666 4.882 -10.457 1.00 0.00 N ATOM 397 CA GLU A 25 7.463 6.090 -10.813 1.00 0.00 C ATOM 398 C GLU A 25 6.558 7.142 -11.452 1.00 0.00 C ATOM 399 O GLU A 25 6.825 8.327 -11.392 1.00 0.00 O ATOM 400 CB GLU A 25 8.517 5.600 -11.806 1.00 0.00 C ATOM 401 CG GLU A 25 9.780 5.193 -11.045 1.00 0.00 C ATOM 402 CD GLU A 25 10.873 6.235 -11.280 1.00 0.00 C ATOM 403 OE1 GLU A 25 10.814 6.907 -12.296 1.00 0.00 O ATOM 404 OE2 GLU A 25 11.752 6.344 -10.440 1.00 0.00 O ATOM 0 H GLU A 25 7.025 3.999 -10.820 1.00 0.00 H new ATOM 0 HA GLU A 25 7.923 6.555 -9.941 1.00 0.00 H new ATOM 0 HB2 GLU A 25 8.132 4.753 -12.374 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.749 6.386 -12.525 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.565 5.110 -9.980 1.00 0.00 H new ATOM 0 HG3 GLU A 25 10.119 4.213 -11.379 1.00 0.00 H new ATOM 411 N ASP A 26 5.483 6.721 -12.057 1.00 0.00 N ATOM 412 CA ASP A 26 4.557 7.700 -12.690 1.00 0.00 C ATOM 413 C ASP A 26 3.704 8.372 -11.611 1.00 0.00 C ATOM 414 O ASP A 26 3.473 9.565 -11.644 1.00 0.00 O ATOM 415 CB ASP A 26 3.698 6.864 -13.645 1.00 0.00 C ATOM 416 CG ASP A 26 2.627 6.109 -12.852 1.00 0.00 C ATOM 417 OD1 ASP A 26 2.978 5.489 -11.862 1.00 0.00 O ATOM 418 OD2 ASP A 26 1.476 6.164 -13.251 1.00 0.00 O ATOM 0 H ASP A 26 5.206 5.743 -12.140 1.00 0.00 H new ATOM 0 HA ASP A 26 5.075 8.499 -13.220 1.00 0.00 H new ATOM 0 HB2 ASP A 26 3.227 7.510 -14.386 1.00 0.00 H new ATOM 0 HB3 ASP A 26 4.325 6.159 -14.190 1.00 0.00 H new ATOM 423 N THR A 27 3.247 7.620 -10.644 1.00 0.00 N ATOM 424 CA THR A 27 2.426 8.228 -9.559 1.00 0.00 C ATOM 425 C THR A 27 3.268 9.268 -8.814 1.00 0.00 C ATOM 426 O THR A 27 2.871 10.404 -8.656 1.00 0.00 O ATOM 427 CB THR A 27 2.042 7.068 -8.635 1.00 0.00 C ATOM 428 OG1 THR A 27 2.984 6.017 -8.773 1.00 0.00 O ATOM 429 CG2 THR A 27 0.652 6.556 -9.010 1.00 0.00 C ATOM 0 H THR A 27 3.406 6.616 -10.560 1.00 0.00 H new ATOM 0 HA THR A 27 1.538 8.736 -9.937 1.00 0.00 H new ATOM 0 HB THR A 27 2.036 7.416 -7.602 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.878 6.347 -8.546 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.379 5.731 -8.353 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.074 7.362 -8.902 1.00 0.00 H new ATOM 0 HG23 THR A 27 0.658 6.210 -10.044 1.00 0.00 H new ATOM 437 N LEU A 28 4.441 8.892 -8.377 1.00 0.00 N ATOM 438 CA LEU A 28 5.317 9.866 -7.667 1.00 0.00 C ATOM 439 C LEU A 28 5.467 11.123 -8.539 1.00 0.00 C ATOM 440 O LEU A 28 5.543 12.230 -8.048 1.00 0.00 O ATOM 441 CB LEU A 28 6.657 9.122 -7.476 1.00 0.00 C ATOM 442 CG LEU A 28 7.779 9.784 -8.290 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.154 11.124 -7.653 1.00 0.00 C ATOM 444 CD2 LEU A 28 9.003 8.870 -8.306 1.00 0.00 C ATOM 0 H LEU A 28 4.829 7.954 -8.481 1.00 0.00 H new ATOM 0 HA LEU A 28 4.923 10.198 -6.706 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.925 9.116 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.546 8.082 -7.783 1.00 0.00 H new ATOM 0 HG LEU A 28 7.435 9.952 -9.310 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.950 11.592 -8.232 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.282 11.778 -7.641 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.497 10.958 -6.632 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.800 9.339 -8.883 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.345 8.702 -7.285 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.738 7.916 -8.761 1.00 0.00 H new ATOM 456 N CYS A 29 5.504 10.951 -9.835 1.00 0.00 N ATOM 457 CA CYS A 29 5.642 12.125 -10.740 1.00 0.00 C ATOM 458 C CYS A 29 4.598 13.187 -10.381 1.00 0.00 C ATOM 459 O CYS A 29 4.825 14.372 -10.527 1.00 0.00 O ATOM 460 CB CYS A 29 5.389 11.577 -12.147 1.00 0.00 C ATOM 461 SG CYS A 29 5.958 12.780 -13.375 1.00 0.00 S ATOM 0 H CYS A 29 5.444 10.047 -10.304 1.00 0.00 H new ATOM 0 HA CYS A 29 6.621 12.597 -10.660 1.00 0.00 H new ATOM 0 HB2 CYS A 29 5.913 10.630 -12.280 1.00 0.00 H new ATOM 0 HB3 CYS A 29 4.327 11.375 -12.285 1.00 0.00 H new ATOM 0 HG CYS A 29 5.745 12.314 -14.570 1.00 0.00 H new ATOM 467 N GLU A 30 3.450 12.767 -9.921 1.00 0.00 N ATOM 468 CA GLU A 30 2.382 13.738 -9.563 1.00 0.00 C ATOM 469 C GLU A 30 2.450 14.106 -8.076 1.00 0.00 C ATOM 470 O GLU A 30 2.240 15.241 -7.699 1.00 0.00 O ATOM 471 CB GLU A 30 1.075 13.005 -9.863 1.00 0.00 C ATOM 472 CG GLU A 30 -0.095 13.774 -9.248 1.00 0.00 C ATOM 473 CD GLU A 30 -1.412 13.156 -9.719 1.00 0.00 C ATOM 474 OE1 GLU A 30 -1.546 12.937 -10.911 1.00 0.00 O ATOM 475 OE2 GLU A 30 -2.263 12.913 -8.879 1.00 0.00 O ATOM 0 H GLU A 30 3.207 11.787 -9.778 1.00 0.00 H new ATOM 0 HA GLU A 30 2.479 14.670 -10.119 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.937 12.912 -10.940 1.00 0.00 H new ATOM 0 HB3 GLU A 30 1.112 11.994 -9.458 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.034 13.742 -8.160 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.048 14.823 -9.539 1.00 0.00 H new ATOM 482 N LEU A 31 2.729 13.154 -7.229 1.00 0.00 N ATOM 483 CA LEU A 31 2.794 13.455 -5.769 1.00 0.00 C ATOM 484 C LEU A 31 4.185 13.964 -5.386 1.00 0.00 C ATOM 485 O LEU A 31 4.331 14.821 -4.537 1.00 0.00 O ATOM 486 CB LEU A 31 2.513 12.122 -5.075 1.00 0.00 C ATOM 487 CG LEU A 31 1.026 11.784 -5.191 1.00 0.00 C ATOM 488 CD1 LEU A 31 0.712 11.330 -6.616 1.00 0.00 C ATOM 489 CD2 LEU A 31 0.686 10.661 -4.212 1.00 0.00 C ATOM 0 H LEU A 31 2.914 12.184 -7.482 1.00 0.00 H new ATOM 0 HA LEU A 31 2.082 14.229 -5.483 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.112 11.332 -5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.802 12.179 -4.026 1.00 0.00 H new ATOM 0 HG LEU A 31 0.433 12.668 -4.956 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.348 11.090 -6.696 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.957 12.130 -7.315 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.303 10.446 -6.855 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.373 10.417 -4.292 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.280 9.779 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 31 0.908 10.985 -3.195 1.00 0.00 H new ATOM 501 N GLY A 32 5.208 13.433 -5.992 1.00 0.00 N ATOM 502 CA GLY A 32 6.586 13.878 -5.648 1.00 0.00 C ATOM 503 C GLY A 32 6.941 13.347 -4.261 1.00 0.00 C ATOM 504 O GLY A 32 7.701 13.948 -3.528 1.00 0.00 O ATOM 0 H GLY A 32 5.150 12.711 -6.710 1.00 0.00 H new ATOM 0 HA2 GLY A 32 7.297 13.509 -6.387 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.646 14.966 -5.663 1.00 0.00 H new ATOM 508 N HIS A 33 6.388 12.222 -3.893 1.00 0.00 N ATOM 509 CA HIS A 33 6.683 11.647 -2.550 1.00 0.00 C ATOM 510 C HIS A 33 8.195 11.453 -2.377 1.00 0.00 C ATOM 511 O HIS A 33 8.992 12.070 -3.057 1.00 0.00 O ATOM 512 CB HIS A 33 5.949 10.305 -2.525 1.00 0.00 C ATOM 513 CG HIS A 33 4.557 10.513 -2.001 1.00 0.00 C ATOM 514 ND1 HIS A 33 3.472 9.807 -2.493 1.00 0.00 N ATOM 515 CD2 HIS A 33 4.057 11.343 -1.029 1.00 0.00 C ATOM 516 CE1 HIS A 33 2.382 10.221 -1.823 1.00 0.00 C ATOM 517 NE2 HIS A 33 2.683 11.157 -0.917 1.00 0.00 N ATOM 0 H HIS A 33 5.744 11.676 -4.466 1.00 0.00 H new ATOM 0 HA HIS A 33 6.359 12.297 -1.737 1.00 0.00 H new ATOM 0 HB2 HIS A 33 5.913 9.878 -3.527 1.00 0.00 H new ATOM 0 HB3 HIS A 33 6.485 9.595 -1.895 1.00 0.00 H new ATOM 0 HD2 HIS A 33 4.641 12.035 -0.441 1.00 0.00 H new ATOM 0 HE1 HIS A 33 1.385 9.843 -1.996 1.00 0.00 H new ATOM 0 HE2 HIS A 33 2.043 11.632 -0.281 1.00 0.00 H new ATOM 525 N GLU A 34 8.598 10.609 -1.471 1.00 0.00 N ATOM 526 CA GLU A 34 10.060 10.389 -1.256 1.00 0.00 C ATOM 527 C GLU A 34 10.569 9.237 -2.131 1.00 0.00 C ATOM 528 O GLU A 34 11.153 9.448 -3.175 1.00 0.00 O ATOM 529 CB GLU A 34 10.182 10.034 0.224 1.00 0.00 C ATOM 530 CG GLU A 34 10.753 11.231 0.984 1.00 0.00 C ATOM 531 CD GLU A 34 10.612 10.998 2.487 1.00 0.00 C ATOM 532 OE1 GLU A 34 9.692 10.295 2.874 1.00 0.00 O ATOM 533 OE2 GLU A 34 11.425 11.527 3.227 1.00 0.00 O ATOM 0 H GLU A 34 7.983 10.061 -0.870 1.00 0.00 H new ATOM 0 HA GLU A 34 10.653 11.264 -1.523 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.206 9.765 0.627 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.829 9.166 0.350 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.802 11.373 0.725 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.228 12.142 0.696 1.00 0.00 H new ATOM 540 N VAL A 35 10.343 8.021 -1.713 1.00 0.00 N ATOM 541 CA VAL A 35 10.800 6.850 -2.515 1.00 0.00 C ATOM 542 C VAL A 35 9.867 5.665 -2.268 1.00 0.00 C ATOM 543 O VAL A 35 9.896 5.045 -1.224 1.00 0.00 O ATOM 544 CB VAL A 35 12.209 6.544 -2.010 1.00 0.00 C ATOM 545 CG1 VAL A 35 13.182 7.588 -2.559 1.00 0.00 C ATOM 546 CG2 VAL A 35 12.226 6.586 -0.480 1.00 0.00 C ATOM 0 H VAL A 35 9.859 7.787 -0.846 1.00 0.00 H new ATOM 0 HA VAL A 35 10.794 7.048 -3.587 1.00 0.00 H new ATOM 0 HB VAL A 35 12.508 5.552 -2.348 1.00 0.00 H new ATOM 0 HG11 VAL A 35 14.188 7.372 -2.200 1.00 0.00 H new ATOM 0 HG12 VAL A 35 13.171 7.558 -3.649 1.00 0.00 H new ATOM 0 HG13 VAL A 35 12.881 8.579 -2.220 1.00 0.00 H new ATOM 0 HG21 VAL A 35 13.232 6.367 -0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 35 11.927 7.577 -0.140 1.00 0.00 H new ATOM 0 HG23 VAL A 35 11.532 5.843 -0.088 1.00 0.00 H new ATOM 556 N ALA A 36 9.027 5.358 -3.215 1.00 0.00 N ATOM 557 CA ALA A 36 8.077 4.231 -3.032 1.00 0.00 C ATOM 558 C ALA A 36 8.758 2.891 -3.297 1.00 0.00 C ATOM 559 O ALA A 36 9.927 2.823 -3.618 1.00 0.00 O ATOM 560 CB ALA A 36 6.970 4.484 -4.054 1.00 0.00 C ATOM 0 H ALA A 36 8.958 5.842 -4.110 1.00 0.00 H new ATOM 0 HA ALA A 36 7.696 4.182 -2.012 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.223 3.693 -3.985 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.500 5.446 -3.850 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.396 4.494 -5.057 1.00 0.00 H new ATOM 566 N ALA A 37 8.021 1.825 -3.172 1.00 0.00 N ATOM 567 CA ALA A 37 8.602 0.478 -3.423 1.00 0.00 C ATOM 568 C ALA A 37 7.772 -0.242 -4.484 1.00 0.00 C ATOM 569 O ALA A 37 6.618 0.070 -4.695 1.00 0.00 O ATOM 570 CB ALA A 37 8.521 -0.258 -2.085 1.00 0.00 C ATOM 0 H ALA A 37 7.036 1.828 -2.906 1.00 0.00 H new ATOM 0 HA ALA A 37 9.629 0.528 -3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.933 -1.261 -2.196 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.092 0.288 -1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.480 -0.326 -1.770 1.00 0.00 H new ATOM 576 N THR A 38 8.349 -1.191 -5.159 1.00 0.00 N ATOM 577 CA THR A 38 7.591 -1.917 -6.209 1.00 0.00 C ATOM 578 C THR A 38 7.954 -3.398 -6.217 1.00 0.00 C ATOM 579 O THR A 38 8.857 -3.835 -5.533 1.00 0.00 O ATOM 580 CB THR A 38 8.011 -1.261 -7.516 1.00 0.00 C ATOM 581 OG1 THR A 38 9.420 -1.385 -7.685 1.00 0.00 O ATOM 582 CG2 THR A 38 7.625 0.220 -7.488 1.00 0.00 C ATOM 0 H THR A 38 9.314 -1.496 -5.029 1.00 0.00 H new ATOM 0 HA THR A 38 6.515 -1.863 -6.044 1.00 0.00 H new ATOM 0 HB THR A 38 7.506 -1.753 -8.347 1.00 0.00 H new ATOM 0 HG1 THR A 38 9.687 -0.963 -8.528 1.00 0.00 H new ATOM 0 HG21 THR A 38 7.925 0.692 -8.424 1.00 0.00 H new ATOM 0 HG22 THR A 38 6.546 0.312 -7.365 1.00 0.00 H new ATOM 0 HG23 THR A 38 8.129 0.712 -6.656 1.00 0.00 H new ATOM 590 N ALA A 39 7.238 -4.169 -6.984 1.00 0.00 N ATOM 591 CA ALA A 39 7.501 -5.630 -7.043 1.00 0.00 C ATOM 592 C ALA A 39 7.432 -6.201 -5.637 1.00 0.00 C ATOM 593 O ALA A 39 7.490 -5.476 -4.674 1.00 0.00 O ATOM 594 CB ALA A 39 8.909 -5.784 -7.601 1.00 0.00 C ATOM 0 H ALA A 39 6.475 -3.845 -7.578 1.00 0.00 H new ATOM 0 HA ALA A 39 6.774 -6.154 -7.663 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.160 -6.843 -7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.958 -5.336 -8.593 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.618 -5.284 -6.942 1.00 0.00 H new ATOM 600 N SER A 40 7.299 -7.481 -5.501 1.00 0.00 N ATOM 601 CA SER A 40 7.227 -8.056 -4.137 1.00 0.00 C ATOM 602 C SER A 40 8.638 -8.313 -3.610 1.00 0.00 C ATOM 603 O SER A 40 9.331 -9.202 -4.061 1.00 0.00 O ATOM 604 CB SER A 40 6.445 -9.349 -4.290 1.00 0.00 C ATOM 605 OG SER A 40 7.203 -10.272 -5.060 1.00 0.00 O ATOM 0 H SER A 40 7.237 -8.152 -6.267 1.00 0.00 H new ATOM 0 HA SER A 40 6.744 -7.389 -3.423 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.224 -9.771 -3.310 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.489 -9.153 -4.775 1.00 0.00 H new ATOM 0 HG SER A 40 8.126 -10.292 -4.731 1.00 0.00 H new ATOM 611 N ARG A 41 9.072 -7.521 -2.668 1.00 0.00 N ATOM 612 CA ARG A 41 10.437 -7.694 -2.120 1.00 0.00 C ATOM 613 C ARG A 41 10.382 -7.812 -0.595 1.00 0.00 C ATOM 614 O ARG A 41 9.954 -6.905 0.091 1.00 0.00 O ATOM 615 CB ARG A 41 11.179 -6.423 -2.535 1.00 0.00 C ATOM 616 CG ARG A 41 12.651 -6.745 -2.770 1.00 0.00 C ATOM 617 CD ARG A 41 12.944 -6.642 -4.268 1.00 0.00 C ATOM 618 NE ARG A 41 14.389 -6.970 -4.400 1.00 0.00 N ATOM 619 CZ ARG A 41 14.920 -7.113 -5.583 1.00 0.00 C ATOM 620 NH1 ARG A 41 14.964 -6.103 -6.406 1.00 0.00 N ATOM 621 NH2 ARG A 41 15.408 -8.269 -5.941 1.00 0.00 N ATOM 0 H ARG A 41 8.533 -6.759 -2.256 1.00 0.00 H new ATOM 0 HA ARG A 41 10.926 -8.596 -2.488 1.00 0.00 H new ATOM 0 HB2 ARG A 41 10.737 -6.011 -3.442 1.00 0.00 H new ATOM 0 HB3 ARG A 41 11.082 -5.663 -1.760 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.283 -6.053 -2.213 1.00 0.00 H new ATOM 0 HG3 ARG A 41 12.881 -7.747 -2.408 1.00 0.00 H new ATOM 0 HD2 ARG A 41 12.328 -7.336 -4.840 1.00 0.00 H new ATOM 0 HD3 ARG A 41 12.730 -5.642 -4.644 1.00 0.00 H new ATOM 0 HE ARG A 41 14.965 -7.083 -3.566 1.00 0.00 H new ATOM 0 HH11 ARG A 41 14.583 -5.199 -6.125 1.00 0.00 H new ATOM 0 HH12 ARG A 41 15.379 -6.216 -7.331 1.00 0.00 H new ATOM 0 HH21 ARG A 41 15.374 -9.059 -5.296 1.00 0.00 H new ATOM 0 HH22 ARG A 41 15.824 -8.383 -6.866 1.00 0.00 H new ATOM 635 N MET A 42 10.813 -8.921 -0.059 1.00 0.00 N ATOM 636 CA MET A 42 10.783 -9.090 1.421 1.00 0.00 C ATOM 637 C MET A 42 11.588 -7.976 2.096 1.00 0.00 C ATOM 638 O MET A 42 11.367 -7.647 3.242 1.00 0.00 O ATOM 639 CB MET A 42 11.428 -10.449 1.675 1.00 0.00 C ATOM 640 CG MET A 42 10.498 -11.553 1.174 1.00 0.00 C ATOM 641 SD MET A 42 11.478 -12.999 0.699 1.00 0.00 S ATOM 642 CE MET A 42 10.155 -13.907 -0.138 1.00 0.00 C ATOM 0 H MET A 42 11.184 -9.715 -0.581 1.00 0.00 H new ATOM 0 HA MET A 42 9.772 -9.038 1.824 1.00 0.00 H new ATOM 0 HB2 MET A 42 12.389 -10.509 1.165 1.00 0.00 H new ATOM 0 HB3 MET A 42 11.623 -10.578 2.740 1.00 0.00 H new ATOM 0 HG2 MET A 42 9.785 -11.824 1.953 1.00 0.00 H new ATOM 0 HG3 MET A 42 9.919 -11.197 0.322 1.00 0.00 H new ATOM 0 HE1 MET A 42 10.545 -14.851 -0.518 1.00 0.00 H new ATOM 0 HE2 MET A 42 9.347 -14.105 0.567 1.00 0.00 H new ATOM 0 HE3 MET A 42 9.774 -13.312 -0.968 1.00 0.00 H new ATOM 652 N GLN A 43 12.518 -7.391 1.391 1.00 0.00 N ATOM 653 CA GLN A 43 13.336 -6.296 1.987 1.00 0.00 C ATOM 654 C GLN A 43 12.563 -4.974 1.932 1.00 0.00 C ATOM 655 O GLN A 43 12.097 -4.478 2.937 1.00 0.00 O ATOM 656 CB GLN A 43 14.593 -6.226 1.117 1.00 0.00 C ATOM 657 CG GLN A 43 15.812 -5.949 1.998 1.00 0.00 C ATOM 658 CD GLN A 43 16.374 -7.271 2.528 1.00 0.00 C ATOM 659 OE1 GLN A 43 15.940 -7.763 3.550 1.00 0.00 O ATOM 660 NE2 GLN A 43 17.328 -7.871 1.871 1.00 0.00 N ATOM 0 H GLN A 43 12.747 -7.625 0.425 1.00 0.00 H new ATOM 0 HA GLN A 43 13.578 -6.478 3.034 1.00 0.00 H new ATOM 0 HB2 GLN A 43 14.727 -7.164 0.578 1.00 0.00 H new ATOM 0 HB3 GLN A 43 14.486 -5.441 0.369 1.00 0.00 H new ATOM 0 HG2 GLN A 43 16.575 -5.422 1.425 1.00 0.00 H new ATOM 0 HG3 GLN A 43 15.533 -5.302 2.829 1.00 0.00 H new ATOM 0 HE21 GLN A 43 17.693 -7.459 1.012 1.00 0.00 H new ATOM 0 HE22 GLN A 43 17.709 -8.752 2.216 1.00 0.00 H new ATOM 669 N GLU A 44 12.415 -4.400 0.767 1.00 0.00 N ATOM 670 CA GLU A 44 11.662 -3.117 0.670 1.00 0.00 C ATOM 671 C GLU A 44 10.320 -3.263 1.384 1.00 0.00 C ATOM 672 O GLU A 44 9.855 -2.363 2.062 1.00 0.00 O ATOM 673 CB GLU A 44 11.449 -2.884 -0.827 1.00 0.00 C ATOM 674 CG GLU A 44 12.763 -2.438 -1.471 1.00 0.00 C ATOM 675 CD GLU A 44 12.475 -1.788 -2.827 1.00 0.00 C ATOM 676 OE1 GLU A 44 12.059 -0.642 -2.838 1.00 0.00 O ATOM 677 OE2 GLU A 44 12.671 -2.452 -3.832 1.00 0.00 O ATOM 0 H GLU A 44 12.780 -4.761 -0.114 1.00 0.00 H new ATOM 0 HA GLU A 44 12.193 -2.285 1.132 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.093 -3.799 -1.300 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.681 -2.126 -0.981 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.278 -1.732 -0.820 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.426 -3.294 -1.600 1.00 0.00 H new ATOM 684 N ALA A 45 9.702 -4.405 1.256 1.00 0.00 N ATOM 685 CA ALA A 45 8.403 -4.617 1.946 1.00 0.00 C ATOM 686 C ALA A 45 8.620 -4.443 3.442 1.00 0.00 C ATOM 687 O ALA A 45 7.822 -3.857 4.142 1.00 0.00 O ATOM 688 CB ALA A 45 8.002 -6.057 1.625 1.00 0.00 C ATOM 0 H ALA A 45 10.040 -5.195 0.706 1.00 0.00 H new ATOM 0 HA ALA A 45 7.631 -3.916 1.630 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.049 -6.285 2.103 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.904 -6.175 0.546 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.767 -6.739 1.997 1.00 0.00 H new ATOM 694 N LEU A 46 9.717 -4.944 3.928 1.00 0.00 N ATOM 695 CA LEU A 46 10.030 -4.814 5.370 1.00 0.00 C ATOM 696 C LEU A 46 10.079 -3.335 5.763 1.00 0.00 C ATOM 697 O LEU A 46 9.658 -2.951 6.834 1.00 0.00 O ATOM 698 CB LEU A 46 11.407 -5.454 5.502 1.00 0.00 C ATOM 699 CG LEU A 46 11.548 -6.068 6.888 1.00 0.00 C ATOM 700 CD1 LEU A 46 11.267 -5.000 7.941 1.00 0.00 C ATOM 701 CD2 LEU A 46 10.549 -7.219 7.033 1.00 0.00 C ATOM 0 H LEU A 46 10.417 -5.443 3.379 1.00 0.00 H new ATOM 0 HA LEU A 46 9.288 -5.284 6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 46 11.539 -6.220 4.738 1.00 0.00 H new ATOM 0 HB3 LEU A 46 12.184 -4.707 5.342 1.00 0.00 H new ATOM 0 HG LEU A 46 12.560 -6.450 7.025 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.367 -5.435 8.936 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.979 -4.183 7.829 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.254 -4.619 7.811 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.646 -7.662 8.024 1.00 0.00 H new ATOM 0 HD22 LEU A 46 9.535 -6.840 6.903 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.753 -7.976 6.276 1.00 0.00 H new ATOM 713 N ASP A 47 10.589 -2.504 4.897 1.00 0.00 N ATOM 714 CA ASP A 47 10.664 -1.051 5.211 1.00 0.00 C ATOM 715 C ASP A 47 9.255 -0.473 5.336 1.00 0.00 C ATOM 716 O ASP A 47 9.037 0.531 5.984 1.00 0.00 O ATOM 717 CB ASP A 47 11.395 -0.429 4.022 1.00 0.00 C ATOM 718 CG ASP A 47 12.607 0.361 4.517 1.00 0.00 C ATOM 719 OD1 ASP A 47 13.147 -0.005 5.550 1.00 0.00 O ATOM 720 OD2 ASP A 47 12.976 1.317 3.855 1.00 0.00 O ATOM 0 H ASP A 47 10.958 -2.770 3.984 1.00 0.00 H new ATOM 0 HA ASP A 47 11.177 -0.853 6.152 1.00 0.00 H new ATOM 0 HB2 ASP A 47 11.715 -1.209 3.331 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.721 0.228 3.472 1.00 0.00 H new ATOM 725 N ILE A 48 8.296 -1.101 4.717 1.00 0.00 N ATOM 726 CA ILE A 48 6.898 -0.591 4.796 1.00 0.00 C ATOM 727 C ILE A 48 6.240 -1.085 6.089 1.00 0.00 C ATOM 728 O ILE A 48 5.348 -0.458 6.627 1.00 0.00 O ATOM 729 CB ILE A 48 6.153 -1.138 3.548 1.00 0.00 C ATOM 730 CG1 ILE A 48 5.375 -2.426 3.895 1.00 0.00 C ATOM 731 CG2 ILE A 48 7.140 -1.434 2.418 1.00 0.00 C ATOM 732 CD1 ILE A 48 5.051 -3.218 2.615 1.00 0.00 C ATOM 0 H ILE A 48 8.419 -1.946 4.159 1.00 0.00 H new ATOM 0 HA ILE A 48 6.867 0.498 4.810 1.00 0.00 H new ATOM 0 HB ILE A 48 5.449 -0.373 3.220 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.965 -3.043 4.573 1.00 0.00 H new ATOM 0 HG13 ILE A 48 4.452 -2.172 4.417 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.598 -1.816 1.553 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.663 -0.518 2.143 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.863 -2.179 2.752 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.503 -4.123 2.876 1.00 0.00 H new ATOM 0 HD12 ILE A 48 4.442 -2.604 1.951 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.978 -3.489 2.110 1.00 0.00 H new ATOM 744 N ALA A 49 6.659 -2.221 6.572 1.00 0.00 N ATOM 745 CA ALA A 49 6.047 -2.779 7.803 1.00 0.00 C ATOM 746 C ALA A 49 6.813 -2.353 9.063 1.00 0.00 C ATOM 747 O ALA A 49 6.317 -1.600 9.879 1.00 0.00 O ATOM 748 CB ALA A 49 6.148 -4.294 7.619 1.00 0.00 C ATOM 0 H ALA A 49 7.402 -2.787 6.163 1.00 0.00 H new ATOM 0 HA ALA A 49 5.024 -2.427 7.938 1.00 0.00 H new ATOM 0 HB1 ALA A 49 5.718 -4.795 8.486 1.00 0.00 H new ATOM 0 HB2 ALA A 49 5.603 -4.589 6.722 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.195 -4.579 7.518 1.00 0.00 H new ATOM 754 N ARG A 50 8.007 -2.852 9.240 1.00 0.00 N ATOM 755 CA ARG A 50 8.793 -2.504 10.460 1.00 0.00 C ATOM 756 C ARG A 50 8.931 -0.987 10.621 1.00 0.00 C ATOM 757 O ARG A 50 9.045 -0.485 11.722 1.00 0.00 O ATOM 758 CB ARG A 50 10.162 -3.148 10.252 1.00 0.00 C ATOM 759 CG ARG A 50 10.209 -4.494 10.982 1.00 0.00 C ATOM 760 CD ARG A 50 9.237 -5.475 10.321 1.00 0.00 C ATOM 761 NE ARG A 50 9.145 -6.622 11.267 1.00 0.00 N ATOM 762 CZ ARG A 50 8.369 -6.544 12.315 1.00 0.00 C ATOM 763 NH1 ARG A 50 7.101 -6.275 12.168 1.00 0.00 N ATOM 764 NH2 ARG A 50 8.861 -6.731 13.509 1.00 0.00 N ATOM 0 H ARG A 50 8.473 -3.487 8.592 1.00 0.00 H new ATOM 0 HA ARG A 50 8.302 -2.862 11.365 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.350 -3.292 9.188 1.00 0.00 H new ATOM 0 HB3 ARG A 50 10.946 -2.491 10.628 1.00 0.00 H new ATOM 0 HG2 ARG A 50 11.221 -4.897 10.956 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.947 -4.359 12.031 1.00 0.00 H new ATOM 0 HD2 ARG A 50 8.261 -5.016 10.161 1.00 0.00 H new ATOM 0 HD3 ARG A 50 9.602 -5.796 9.346 1.00 0.00 H new ATOM 0 HE ARG A 50 9.688 -7.468 11.096 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.716 -6.126 11.235 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.494 -6.214 12.986 1.00 0.00 H new ATOM 0 HH21 ARG A 50 9.853 -6.938 13.625 1.00 0.00 H new ATOM 0 HH22 ARG A 50 8.254 -6.670 14.326 1.00 0.00 H new ATOM 778 N LYS A 51 8.927 -0.248 9.546 1.00 0.00 N ATOM 779 CA LYS A 51 9.066 1.228 9.679 1.00 0.00 C ATOM 780 C LYS A 51 7.990 1.767 10.620 1.00 0.00 C ATOM 781 O LYS A 51 8.262 2.552 11.507 1.00 0.00 O ATOM 782 CB LYS A 51 8.876 1.789 8.270 1.00 0.00 C ATOM 783 CG LYS A 51 8.739 3.312 8.347 1.00 0.00 C ATOM 784 CD LYS A 51 10.116 3.941 8.566 1.00 0.00 C ATOM 785 CE LYS A 51 10.692 4.384 7.220 1.00 0.00 C ATOM 786 NZ LYS A 51 11.930 5.138 7.561 1.00 0.00 N ATOM 0 H LYS A 51 8.835 -0.598 8.592 1.00 0.00 H new ATOM 0 HA LYS A 51 10.033 1.513 10.094 1.00 0.00 H new ATOM 0 HB2 LYS A 51 9.725 1.520 7.641 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.988 1.355 7.810 1.00 0.00 H new ATOM 0 HG2 LYS A 51 8.296 3.694 7.428 1.00 0.00 H new ATOM 0 HG3 LYS A 51 8.069 3.586 9.162 1.00 0.00 H new ATOM 0 HD2 LYS A 51 10.035 4.795 9.238 1.00 0.00 H new ATOM 0 HD3 LYS A 51 10.784 3.223 9.042 1.00 0.00 H new ATOM 0 HE2 LYS A 51 10.914 3.527 6.584 1.00 0.00 H new ATOM 0 HE3 LYS A 51 9.986 5.010 6.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 12.383 5.475 6.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 11.687 5.952 8.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 12.586 4.514 8.073 1.00 0.00 H new ATOM 800 N GLY A 52 6.768 1.349 10.438 1.00 0.00 N ATOM 801 CA GLY A 52 5.676 1.834 11.328 1.00 0.00 C ATOM 802 C GLY A 52 5.214 3.220 10.875 1.00 0.00 C ATOM 803 O GLY A 52 4.034 3.484 10.766 1.00 0.00 O ATOM 0 H GLY A 52 6.479 0.693 9.712 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.839 1.136 11.305 1.00 0.00 H new ATOM 0 HA3 GLY A 52 6.027 1.877 12.359 1.00 0.00 H new ATOM 807 N GLN A 53 6.130 4.116 10.625 1.00 0.00 N ATOM 808 CA GLN A 53 5.725 5.486 10.197 1.00 0.00 C ATOM 809 C GLN A 53 5.824 5.645 8.676 1.00 0.00 C ATOM 810 O GLN A 53 5.571 6.711 8.153 1.00 0.00 O ATOM 811 CB GLN A 53 6.707 6.441 10.887 1.00 0.00 C ATOM 812 CG GLN A 53 7.011 5.951 12.305 1.00 0.00 C ATOM 813 CD GLN A 53 5.750 6.059 13.164 1.00 0.00 C ATOM 814 OE1 GLN A 53 5.013 7.020 13.063 1.00 0.00 O ATOM 815 NE2 GLN A 53 5.468 5.109 14.012 1.00 0.00 N ATOM 0 H GLN A 53 7.135 3.960 10.698 1.00 0.00 H new ATOM 0 HA GLN A 53 4.689 5.690 10.468 1.00 0.00 H new ATOM 0 HB2 GLN A 53 7.630 6.505 10.310 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.284 7.445 10.924 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.358 4.918 12.278 1.00 0.00 H new ATOM 0 HG3 GLN A 53 7.814 6.545 12.742 1.00 0.00 H new ATOM 0 HE21 GLN A 53 6.086 4.302 14.098 1.00 0.00 H new ATOM 0 HE22 GLN A 53 4.630 5.173 14.589 1.00 0.00 H new ATOM 824 N PHE A 54 6.205 4.613 7.960 1.00 0.00 N ATOM 825 CA PHE A 54 6.327 4.754 6.476 1.00 0.00 C ATOM 826 C PHE A 54 5.189 5.621 5.912 1.00 0.00 C ATOM 827 O PHE A 54 5.372 6.805 5.711 1.00 0.00 O ATOM 828 CB PHE A 54 6.396 3.320 5.870 1.00 0.00 C ATOM 829 CG PHE A 54 5.159 2.476 6.123 1.00 0.00 C ATOM 830 CD1 PHE A 54 4.794 2.088 7.422 1.00 0.00 C ATOM 831 CD2 PHE A 54 4.381 2.056 5.032 1.00 0.00 C ATOM 832 CE1 PHE A 54 3.660 1.294 7.621 1.00 0.00 C ATOM 833 CE2 PHE A 54 3.250 1.267 5.239 1.00 0.00 C ATOM 834 CZ PHE A 54 2.888 0.884 6.530 1.00 0.00 C ATOM 0 H PHE A 54 6.434 3.692 8.334 1.00 0.00 H new ATOM 0 HA PHE A 54 7.239 5.283 6.198 1.00 0.00 H new ATOM 0 HB2 PHE A 54 6.554 3.400 4.794 1.00 0.00 H new ATOM 0 HB3 PHE A 54 7.264 2.805 6.282 1.00 0.00 H new ATOM 0 HD1 PHE A 54 5.389 2.402 8.267 1.00 0.00 H new ATOM 0 HD2 PHE A 54 4.660 2.345 4.029 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.380 0.997 8.621 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.652 0.951 4.397 1.00 0.00 H new ATOM 0 HZ PHE A 54 2.012 0.271 6.687 1.00 0.00 H new ATOM 844 N ASP A 55 4.040 5.075 5.633 1.00 0.00 N ATOM 845 CA ASP A 55 2.923 5.879 5.062 1.00 0.00 C ATOM 846 C ASP A 55 1.901 4.913 4.475 1.00 0.00 C ATOM 847 O ASP A 55 0.773 4.830 4.920 1.00 0.00 O ATOM 848 CB ASP A 55 3.542 6.741 3.954 1.00 0.00 C ATOM 849 CG ASP A 55 4.753 6.030 3.327 1.00 0.00 C ATOM 850 OD1 ASP A 55 4.583 4.920 2.848 1.00 0.00 O ATOM 851 OD2 ASP A 55 5.829 6.606 3.348 1.00 0.00 O ATOM 0 H ASP A 55 3.823 4.089 5.779 1.00 0.00 H new ATOM 0 HA ASP A 55 2.429 6.506 5.804 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.796 6.946 3.186 1.00 0.00 H new ATOM 0 HB3 ASP A 55 3.850 7.703 4.364 1.00 0.00 H new ATOM 856 N ILE A 56 2.300 4.166 3.483 1.00 0.00 N ATOM 857 CA ILE A 56 1.357 3.179 2.871 1.00 0.00 C ATOM 858 C ILE A 56 2.122 1.932 2.404 1.00 0.00 C ATOM 859 O ILE A 56 3.307 1.997 2.138 1.00 0.00 O ATOM 860 CB ILE A 56 0.726 3.921 1.694 1.00 0.00 C ATOM 861 CG1 ILE A 56 -0.003 5.164 2.216 1.00 0.00 C ATOM 862 CG2 ILE A 56 -0.263 3.004 0.976 1.00 0.00 C ATOM 863 CD1 ILE A 56 -0.847 5.769 1.095 1.00 0.00 C ATOM 0 H ILE A 56 3.232 4.193 3.069 1.00 0.00 H new ATOM 0 HA ILE A 56 0.602 2.827 3.574 1.00 0.00 H new ATOM 0 HB ILE A 56 1.504 4.222 0.992 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.638 4.898 3.061 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.718 5.896 2.578 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.711 3.537 0.137 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.260 2.122 0.607 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.045 2.698 1.670 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.365 6.653 1.466 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.200 6.050 0.264 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.578 5.036 0.754 1.00 0.00 H new ATOM 875 N ALA A 57 1.477 0.784 2.326 1.00 0.00 N ATOM 876 CA ALA A 57 2.230 -0.439 1.900 1.00 0.00 C ATOM 877 C ALA A 57 1.302 -1.472 1.264 1.00 0.00 C ATOM 878 O ALA A 57 0.270 -1.797 1.805 1.00 0.00 O ATOM 879 CB ALA A 57 2.819 -0.995 3.192 1.00 0.00 C ATOM 0 H ALA A 57 0.488 0.646 2.534 1.00 0.00 H new ATOM 0 HA ALA A 57 2.987 -0.204 1.152 1.00 0.00 H new ATOM 0 HB1 ALA A 57 3.390 -1.897 2.973 1.00 0.00 H new ATOM 0 HB2 ALA A 57 3.475 -0.250 3.643 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.013 -1.235 3.885 1.00 0.00 H new ATOM 885 N ILE A 58 1.653 -2.004 0.125 1.00 0.00 N ATOM 886 CA ILE A 58 0.751 -3.008 -0.506 1.00 0.00 C ATOM 887 C ILE A 58 1.505 -4.240 -1.025 1.00 0.00 C ATOM 888 O ILE A 58 1.967 -4.273 -2.148 1.00 0.00 O ATOM 889 CB ILE A 58 0.100 -2.265 -1.672 1.00 0.00 C ATOM 890 CG1 ILE A 58 -0.793 -1.143 -1.133 1.00 0.00 C ATOM 891 CG2 ILE A 58 -0.749 -3.244 -2.488 1.00 0.00 C ATOM 892 CD1 ILE A 58 0.064 0.071 -0.769 1.00 0.00 C ATOM 0 H ILE A 58 2.509 -1.792 -0.388 1.00 0.00 H new ATOM 0 HA ILE A 58 0.033 -3.391 0.219 1.00 0.00 H new ATOM 0 HB ILE A 58 0.876 -1.836 -2.307 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.535 -0.865 -1.882 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.340 -1.490 -0.256 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.214 -2.716 -3.320 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.114 -4.042 -2.874 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.523 -3.672 -1.852 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.576 0.866 -0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.789 -0.211 -0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.590 0.424 -1.656 1.00 0.00 H new ATOM 904 N ILE A 59 1.566 -5.279 -0.235 1.00 0.00 N ATOM 905 CA ILE A 59 2.210 -6.544 -0.695 1.00 0.00 C ATOM 906 C ILE A 59 1.114 -7.354 -1.379 1.00 0.00 C ATOM 907 O ILE A 59 0.694 -8.394 -0.915 1.00 0.00 O ATOM 908 CB ILE A 59 2.715 -7.231 0.577 1.00 0.00 C ATOM 909 CG1 ILE A 59 4.058 -6.614 0.971 1.00 0.00 C ATOM 910 CG2 ILE A 59 2.904 -8.726 0.316 1.00 0.00 C ATOM 911 CD1 ILE A 59 4.165 -6.526 2.494 1.00 0.00 C ATOM 0 H ILE A 59 1.195 -5.306 0.715 1.00 0.00 H new ATOM 0 HA ILE A 59 3.038 -6.411 -1.391 1.00 0.00 H new ATOM 0 HB ILE A 59 1.990 -7.096 1.380 1.00 0.00 H new ATOM 0 HG12 ILE A 59 4.875 -7.217 0.575 1.00 0.00 H new ATOM 0 HG13 ILE A 59 4.154 -5.620 0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.263 -9.211 1.223 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.952 -9.167 0.021 1.00 0.00 H new ATOM 0 HG23 ILE A 59 3.632 -8.867 -0.483 1.00 0.00 H new ATOM 0 HD11 ILE A 59 5.124 -6.086 2.767 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.357 -5.904 2.880 1.00 0.00 H new ATOM 0 HD13 ILE A 59 4.090 -7.525 2.922 1.00 0.00 H new ATOM 923 N ASP A 60 0.611 -6.828 -2.458 1.00 0.00 N ATOM 924 CA ASP A 60 -0.510 -7.488 -3.177 1.00 0.00 C ATOM 925 C ASP A 60 -0.083 -8.808 -3.816 1.00 0.00 C ATOM 926 O ASP A 60 0.876 -8.859 -4.554 1.00 0.00 O ATOM 927 CB ASP A 60 -0.947 -6.448 -4.229 1.00 0.00 C ATOM 928 CG ASP A 60 -1.063 -7.086 -5.616 1.00 0.00 C ATOM 929 OD1 ASP A 60 -1.993 -7.848 -5.821 1.00 0.00 O ATOM 930 OD2 ASP A 60 -0.211 -6.810 -6.443 1.00 0.00 O ATOM 0 H ASP A 60 0.934 -5.956 -2.878 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.325 -7.764 -2.508 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.906 -6.016 -3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -0.226 -5.631 -4.260 1.00 0.00 H new ATOM 935 N VAL A 61 -0.848 -9.845 -3.526 1.00 0.00 N ATOM 936 CA VAL A 61 -0.638 -11.241 -4.064 1.00 0.00 C ATOM 937 C VAL A 61 -0.633 -12.240 -2.902 1.00 0.00 C ATOM 938 O VAL A 61 0.404 -12.712 -2.479 1.00 0.00 O ATOM 939 CB VAL A 61 0.696 -11.289 -4.798 1.00 0.00 C ATOM 940 CG1 VAL A 61 1.839 -11.054 -3.807 1.00 0.00 C ATOM 941 CG2 VAL A 61 0.865 -12.667 -5.443 1.00 0.00 C ATOM 0 H VAL A 61 -1.653 -9.774 -2.904 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.442 -11.503 -4.752 1.00 0.00 H new ATOM 0 HB VAL A 61 0.716 -10.514 -5.565 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.792 -11.089 -4.335 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.719 -10.077 -3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.821 -11.828 -3.040 1.00 0.00 H new ATOM 0 HG21 VAL A 61 1.818 -12.708 -5.970 1.00 0.00 H new ATOM 0 HG22 VAL A 61 0.845 -13.435 -4.670 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.053 -12.841 -6.149 1.00 0.00 H new ATOM 951 N ASN A 62 -1.783 -12.558 -2.377 1.00 0.00 N ATOM 952 CA ASN A 62 -1.844 -13.516 -1.235 1.00 0.00 C ATOM 953 C ASN A 62 -2.692 -14.736 -1.607 1.00 0.00 C ATOM 954 O ASN A 62 -3.815 -14.879 -1.167 1.00 0.00 O ATOM 955 CB ASN A 62 -2.503 -12.730 -0.101 1.00 0.00 C ATOM 956 CG ASN A 62 -1.434 -11.959 0.677 1.00 0.00 C ATOM 957 OD1 ASN A 62 -1.310 -12.112 1.876 1.00 0.00 O ATOM 958 ND2 ASN A 62 -0.649 -11.131 0.043 1.00 0.00 N ATOM 0 H ASN A 62 -2.684 -12.197 -2.689 1.00 0.00 H new ATOM 0 HA ASN A 62 -0.859 -13.891 -0.957 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.242 -12.039 -0.506 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.033 -13.410 0.566 1.00 0.00 H new ATOM 0 HD21 ASN A 62 0.067 -10.614 0.554 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -0.751 -11.001 -0.963 1.00 0.00 H new ATOM 965 N LEU A 63 -2.165 -15.614 -2.414 1.00 0.00 N ATOM 966 CA LEU A 63 -2.946 -16.819 -2.810 1.00 0.00 C ATOM 967 C LEU A 63 -2.018 -18.018 -3.004 1.00 0.00 C ATOM 968 O LEU A 63 -0.834 -17.869 -3.233 1.00 0.00 O ATOM 969 CB LEU A 63 -3.608 -16.442 -4.135 1.00 0.00 C ATOM 970 CG LEU A 63 -5.109 -16.727 -4.053 1.00 0.00 C ATOM 971 CD1 LEU A 63 -5.843 -15.480 -3.558 1.00 0.00 C ATOM 972 CD2 LEU A 63 -5.633 -17.106 -5.438 1.00 0.00 C ATOM 0 H LEU A 63 -1.230 -15.550 -2.816 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.675 -17.102 -2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.438 -15.387 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.163 -17.011 -4.951 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.282 -17.550 -3.359 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.912 -15.686 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.472 -15.208 -2.570 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.669 -14.656 -4.250 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.702 -17.309 -5.379 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -5.457 -16.283 -6.131 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.114 -17.996 -5.792 1.00 0.00 H new ATOM 984 N ASP A 64 -2.548 -19.208 -2.918 1.00 0.00 N ATOM 985 CA ASP A 64 -1.699 -20.418 -3.103 1.00 0.00 C ATOM 986 C ASP A 64 -0.604 -20.467 -2.033 1.00 0.00 C ATOM 987 O ASP A 64 0.357 -21.203 -2.150 1.00 0.00 O ATOM 988 CB ASP A 64 -1.086 -20.260 -4.495 1.00 0.00 C ATOM 989 CG ASP A 64 -1.838 -21.148 -5.488 1.00 0.00 C ATOM 990 OD1 ASP A 64 -3.057 -21.118 -5.476 1.00 0.00 O ATOM 991 OD2 ASP A 64 -1.180 -21.845 -6.244 1.00 0.00 O ATOM 0 H ASP A 64 -3.533 -19.394 -2.728 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.270 -21.342 -3.011 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -1.138 -19.218 -4.811 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.031 -20.534 -4.473 1.00 0.00 H new ATOM 996 N GLY A 65 -0.740 -19.694 -0.991 1.00 0.00 N ATOM 997 CA GLY A 65 0.297 -19.704 0.080 1.00 0.00 C ATOM 998 C GLY A 65 0.319 -18.356 0.795 1.00 0.00 C ATOM 999 O GLY A 65 0.790 -18.240 1.909 1.00 0.00 O ATOM 0 H GLY A 65 -1.522 -19.058 -0.835 1.00 0.00 H new ATOM 0 HA2 GLY A 65 0.087 -20.501 0.794 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.276 -19.912 -0.352 1.00 0.00 H new ATOM 1003 N GLU A 66 -0.186 -17.335 0.167 1.00 0.00 N ATOM 1004 CA GLU A 66 -0.192 -15.996 0.815 1.00 0.00 C ATOM 1005 C GLU A 66 1.242 -15.509 1.038 1.00 0.00 C ATOM 1006 O GLU A 66 1.679 -15.370 2.163 1.00 0.00 O ATOM 1007 CB GLU A 66 -0.896 -16.211 2.156 1.00 0.00 C ATOM 1008 CG GLU A 66 -2.161 -15.354 2.217 1.00 0.00 C ATOM 1009 CD GLU A 66 -2.823 -15.524 3.585 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -2.249 -15.066 4.559 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -3.892 -16.110 3.636 1.00 0.00 O ATOM 0 H GLU A 66 -0.595 -17.369 -0.767 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.692 -15.244 0.205 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -1.152 -17.263 2.279 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.227 -15.948 2.975 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -1.912 -14.306 2.049 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -2.852 -15.649 1.427 1.00 0.00 H new ATOM 1018 N PRO A 67 1.929 -15.266 -0.045 1.00 0.00 N ATOM 1019 CA PRO A 67 3.333 -14.792 0.035 1.00 0.00 C ATOM 1020 C PRO A 67 3.387 -13.352 0.554 1.00 0.00 C ATOM 1021 O PRO A 67 3.876 -12.459 -0.109 1.00 0.00 O ATOM 1022 CB PRO A 67 3.821 -14.870 -1.408 1.00 0.00 C ATOM 1023 CG PRO A 67 2.580 -14.773 -2.235 1.00 0.00 C ATOM 1024 CD PRO A 67 1.474 -15.406 -1.432 1.00 0.00 C ATOM 0 HA PRO A 67 3.944 -15.381 0.719 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.513 -14.059 -1.636 1.00 0.00 H new ATOM 0 HB3 PRO A 67 4.351 -15.804 -1.597 1.00 0.00 H new ATOM 0 HG2 PRO A 67 2.347 -13.733 -2.462 1.00 0.00 H new ATOM 0 HG3 PRO A 67 2.709 -15.286 -3.188 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.522 -14.901 -1.594 1.00 0.00 H new ATOM 0 HD3 PRO A 67 1.330 -16.452 -1.703 1.00 0.00 H new ATOM 1032 N SER A 68 2.892 -13.122 1.738 1.00 0.00 N ATOM 1033 CA SER A 68 2.919 -11.744 2.307 1.00 0.00 C ATOM 1034 C SER A 68 3.901 -11.685 3.480 1.00 0.00 C ATOM 1035 O SER A 68 3.979 -10.700 4.186 1.00 0.00 O ATOM 1036 CB SER A 68 1.495 -11.490 2.798 1.00 0.00 C ATOM 1037 OG SER A 68 0.834 -10.612 1.898 1.00 0.00 O ATOM 0 H SER A 68 2.469 -13.830 2.338 1.00 0.00 H new ATOM 0 HA SER A 68 3.238 -11.000 1.577 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.950 -12.431 2.870 1.00 0.00 H new ATOM 0 HB3 SER A 68 1.515 -11.056 3.798 1.00 0.00 H new ATOM 0 HG SER A 68 -0.010 -10.311 2.295 1.00 0.00 H new ATOM 1043 N TYR A 69 4.645 -12.742 3.690 1.00 0.00 N ATOM 1044 CA TYR A 69 5.620 -12.785 4.821 1.00 0.00 C ATOM 1045 C TYR A 69 4.946 -12.285 6.100 1.00 0.00 C ATOM 1046 O TYR A 69 3.791 -11.913 6.093 1.00 0.00 O ATOM 1047 CB TYR A 69 6.821 -11.888 4.448 1.00 0.00 C ATOM 1048 CG TYR A 69 6.580 -11.119 3.165 1.00 0.00 C ATOM 1049 CD1 TYR A 69 6.445 -11.798 1.950 1.00 0.00 C ATOM 1050 CD2 TYR A 69 6.490 -9.724 3.198 1.00 0.00 C ATOM 1051 CE1 TYR A 69 6.227 -11.080 0.768 1.00 0.00 C ATOM 1052 CE2 TYR A 69 6.274 -9.005 2.018 1.00 0.00 C ATOM 1053 CZ TYR A 69 6.139 -9.684 0.803 1.00 0.00 C ATOM 1054 OH TYR A 69 5.926 -8.978 -0.363 1.00 0.00 O ATOM 0 H TYR A 69 4.617 -13.587 3.119 1.00 0.00 H new ATOM 0 HA TYR A 69 5.964 -13.804 4.998 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.015 -11.187 5.260 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.713 -12.504 4.339 1.00 0.00 H new ATOM 0 HD1 TYR A 69 6.509 -12.876 1.923 1.00 0.00 H new ATOM 0 HD2 TYR A 69 6.588 -9.200 4.137 1.00 0.00 H new ATOM 0 HE1 TYR A 69 6.127 -11.604 -0.171 1.00 0.00 H new ATOM 0 HE2 TYR A 69 6.212 -7.927 2.045 1.00 0.00 H new ATOM 0 HH TYR A 69 5.626 -9.591 -1.066 1.00 0.00 H new ATOM 1064 N PRO A 70 5.687 -12.307 7.167 1.00 0.00 N ATOM 1065 CA PRO A 70 5.144 -11.857 8.463 1.00 0.00 C ATOM 1066 C PRO A 70 5.116 -10.332 8.540 1.00 0.00 C ATOM 1067 O PRO A 70 4.683 -9.766 9.522 1.00 0.00 O ATOM 1068 CB PRO A 70 6.122 -12.428 9.478 1.00 0.00 C ATOM 1069 CG PRO A 70 7.411 -12.608 8.736 1.00 0.00 C ATOM 1070 CD PRO A 70 7.079 -12.754 7.270 1.00 0.00 C ATOM 0 HA PRO A 70 4.118 -12.186 8.629 1.00 0.00 H new ATOM 0 HB2 PRO A 70 6.248 -11.753 10.324 1.00 0.00 H new ATOM 0 HB3 PRO A 70 5.764 -13.377 9.877 1.00 0.00 H new ATOM 0 HG2 PRO A 70 8.067 -11.753 8.896 1.00 0.00 H new ATOM 0 HG3 PRO A 70 7.941 -13.489 9.098 1.00 0.00 H new ATOM 0 HD2 PRO A 70 7.739 -12.146 6.650 1.00 0.00 H new ATOM 0 HD3 PRO A 70 7.191 -13.786 6.938 1.00 0.00 H new ATOM 1078 N VAL A 71 5.564 -9.655 7.518 1.00 0.00 N ATOM 1079 CA VAL A 71 5.543 -8.165 7.574 1.00 0.00 C ATOM 1080 C VAL A 71 4.203 -7.655 7.038 1.00 0.00 C ATOM 1081 O VAL A 71 3.565 -6.821 7.643 1.00 0.00 O ATOM 1082 CB VAL A 71 6.747 -7.647 6.742 1.00 0.00 C ATOM 1083 CG1 VAL A 71 7.767 -8.764 6.503 1.00 0.00 C ATOM 1084 CG2 VAL A 71 6.285 -7.089 5.389 1.00 0.00 C ATOM 0 H VAL A 71 5.938 -10.060 6.660 1.00 0.00 H new ATOM 0 HA VAL A 71 5.638 -7.797 8.596 1.00 0.00 H new ATOM 0 HB VAL A 71 7.216 -6.848 7.315 1.00 0.00 H new ATOM 0 HG11 VAL A 71 8.601 -8.376 5.918 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.135 -9.131 7.461 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.292 -9.581 5.960 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.149 -6.733 4.828 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.783 -7.874 4.824 1.00 0.00 H new ATOM 0 HG23 VAL A 71 5.594 -6.262 5.553 1.00 0.00 H new ATOM 1094 N ALA A 72 3.762 -8.164 5.922 1.00 0.00 N ATOM 1095 CA ALA A 72 2.455 -7.721 5.371 1.00 0.00 C ATOM 1096 C ALA A 72 1.337 -8.265 6.244 1.00 0.00 C ATOM 1097 O ALA A 72 0.470 -7.540 6.691 1.00 0.00 O ATOM 1098 CB ALA A 72 2.372 -8.342 3.983 1.00 0.00 C ATOM 0 H ALA A 72 4.251 -8.868 5.369 1.00 0.00 H new ATOM 0 HA ALA A 72 2.364 -6.635 5.336 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.430 -8.058 3.513 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.203 -7.986 3.375 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.423 -9.428 4.066 1.00 0.00 H new ATOM 1104 N ASP A 73 1.361 -9.541 6.506 1.00 0.00 N ATOM 1105 CA ASP A 73 0.311 -10.129 7.368 1.00 0.00 C ATOM 1106 C ASP A 73 0.246 -9.344 8.671 1.00 0.00 C ATOM 1107 O ASP A 73 -0.792 -8.852 9.068 1.00 0.00 O ATOM 1108 CB ASP A 73 0.767 -11.557 7.629 1.00 0.00 C ATOM 1109 CG ASP A 73 0.172 -12.497 6.579 1.00 0.00 C ATOM 1110 OD1 ASP A 73 -0.941 -12.954 6.784 1.00 0.00 O ATOM 1111 OD2 ASP A 73 0.840 -12.746 5.588 1.00 0.00 O ATOM 0 H ASP A 73 2.061 -10.197 6.160 1.00 0.00 H new ATOM 0 HA ASP A 73 -0.679 -10.103 6.912 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.855 -11.611 7.602 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.457 -11.870 8.626 1.00 0.00 H new ATOM 1116 N ILE A 74 1.363 -9.204 9.329 1.00 0.00 N ATOM 1117 CA ILE A 74 1.380 -8.425 10.600 1.00 0.00 C ATOM 1118 C ILE A 74 0.783 -7.048 10.324 1.00 0.00 C ATOM 1119 O ILE A 74 -0.082 -6.573 11.031 1.00 0.00 O ATOM 1120 CB ILE A 74 2.859 -8.313 10.984 1.00 0.00 C ATOM 1121 CG1 ILE A 74 3.292 -9.596 11.698 1.00 0.00 C ATOM 1122 CG2 ILE A 74 3.063 -7.118 11.918 1.00 0.00 C ATOM 1123 CD1 ILE A 74 4.739 -9.455 12.176 1.00 0.00 C ATOM 0 H ILE A 74 2.262 -9.593 9.044 1.00 0.00 H new ATOM 0 HA ILE A 74 0.804 -8.888 11.401 1.00 0.00 H new ATOM 0 HB ILE A 74 3.457 -8.171 10.084 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.636 -9.791 12.546 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.203 -10.447 11.023 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.116 -7.043 12.188 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.752 -6.204 11.412 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.466 -7.255 12.820 1.00 0.00 H new ATOM 0 HD11 ILE A 74 5.045 -10.370 12.684 1.00 0.00 H new ATOM 0 HD12 ILE A 74 5.390 -9.281 11.319 1.00 0.00 H new ATOM 0 HD13 ILE A 74 4.814 -8.614 12.866 1.00 0.00 H new ATOM 1135 N LEU A 75 1.231 -6.421 9.276 1.00 0.00 N ATOM 1136 CA LEU A 75 0.695 -5.089 8.906 1.00 0.00 C ATOM 1137 C LEU A 75 -0.781 -5.237 8.519 1.00 0.00 C ATOM 1138 O LEU A 75 -1.533 -4.281 8.495 1.00 0.00 O ATOM 1139 CB LEU A 75 1.548 -4.678 7.701 1.00 0.00 C ATOM 1140 CG LEU A 75 1.599 -3.156 7.576 1.00 0.00 C ATOM 1141 CD1 LEU A 75 2.691 -2.606 8.498 1.00 0.00 C ATOM 1142 CD2 LEU A 75 1.918 -2.782 6.128 1.00 0.00 C ATOM 0 H LEU A 75 1.955 -6.781 8.654 1.00 0.00 H new ATOM 0 HA LEU A 75 0.740 -4.351 9.707 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.558 -5.074 7.811 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.133 -5.110 6.790 1.00 0.00 H new ATOM 0 HG LEU A 75 0.637 -2.731 7.861 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.729 -1.520 8.410 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.468 -2.879 9.529 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.655 -3.027 8.212 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.956 -1.697 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.883 -3.205 5.847 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.143 -3.177 5.471 1.00 0.00 H new ATOM 1154 N ALA A 76 -1.192 -6.441 8.207 1.00 0.00 N ATOM 1155 CA ALA A 76 -2.605 -6.682 7.809 1.00 0.00 C ATOM 1156 C ALA A 76 -3.458 -7.141 9.002 1.00 0.00 C ATOM 1157 O ALA A 76 -4.653 -6.918 9.041 1.00 0.00 O ATOM 1158 CB ALA A 76 -2.527 -7.791 6.761 1.00 0.00 C ATOM 0 H ALA A 76 -0.600 -7.272 8.212 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.075 -5.773 7.432 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.531 -8.032 6.411 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.921 -7.455 5.920 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -2.074 -8.678 7.203 1.00 0.00 H new ATOM 1164 N GLU A 77 -2.868 -7.805 9.962 1.00 0.00 N ATOM 1165 CA GLU A 77 -3.663 -8.294 11.128 1.00 0.00 C ATOM 1166 C GLU A 77 -4.087 -7.125 12.032 1.00 0.00 C ATOM 1167 O GLU A 77 -5.166 -7.120 12.589 1.00 0.00 O ATOM 1168 CB GLU A 77 -2.735 -9.287 11.853 1.00 0.00 C ATOM 1169 CG GLU A 77 -2.090 -8.642 13.087 1.00 0.00 C ATOM 1170 CD GLU A 77 -3.081 -8.673 14.253 1.00 0.00 C ATOM 1171 OE1 GLU A 77 -3.681 -9.713 14.466 1.00 0.00 O ATOM 1172 OE2 GLU A 77 -3.221 -7.656 14.912 1.00 0.00 O ATOM 0 H GLU A 77 -1.873 -8.029 9.989 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.594 -8.774 10.827 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.303 -10.167 12.154 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -1.958 -9.628 11.169 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -1.179 -9.176 13.356 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -1.804 -7.614 12.866 1.00 0.00 H new ATOM 1179 N ARG A 78 -3.251 -6.133 12.176 1.00 0.00 N ATOM 1180 CA ARG A 78 -3.615 -4.973 13.031 1.00 0.00 C ATOM 1181 C ARG A 78 -3.751 -3.722 12.163 1.00 0.00 C ATOM 1182 O ARG A 78 -4.568 -2.867 12.421 1.00 0.00 O ATOM 1183 CB ARG A 78 -2.477 -4.830 14.048 1.00 0.00 C ATOM 1184 CG ARG A 78 -1.144 -4.613 13.326 1.00 0.00 C ATOM 1185 CD ARG A 78 -0.127 -4.013 14.303 1.00 0.00 C ATOM 1186 NE ARG A 78 -0.103 -4.949 15.462 1.00 0.00 N ATOM 1187 CZ ARG A 78 -0.969 -4.817 16.432 1.00 0.00 C ATOM 1188 NH1 ARG A 78 -1.313 -3.626 16.843 1.00 0.00 N ATOM 1189 NH2 ARG A 78 -1.490 -5.876 16.991 1.00 0.00 N ATOM 0 H ARG A 78 -2.332 -6.078 11.737 1.00 0.00 H new ATOM 0 HA ARG A 78 -4.569 -5.112 13.540 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -2.679 -3.991 14.714 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.421 -5.724 14.669 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.773 -5.559 12.933 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.283 -3.947 12.474 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.858 -3.929 13.844 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.422 -3.010 14.612 1.00 0.00 H new ATOM 0 HE ARG A 78 0.591 -5.695 15.499 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.906 -2.799 16.407 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.989 -3.523 17.600 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -1.221 -6.806 16.671 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -2.166 -5.773 17.748 1.00 0.00 H new ATOM 1203 N ASN A 79 -2.968 -3.643 11.120 1.00 0.00 N ATOM 1204 CA ASN A 79 -3.029 -2.486 10.169 1.00 0.00 C ATOM 1205 C ASN A 79 -3.025 -1.119 10.870 1.00 0.00 C ATOM 1206 O ASN A 79 -3.735 -0.872 11.822 1.00 0.00 O ATOM 1207 CB ASN A 79 -4.339 -2.654 9.390 1.00 0.00 C ATOM 1208 CG ASN A 79 -4.665 -4.137 9.189 1.00 0.00 C ATOM 1209 OD1 ASN A 79 -4.855 -4.864 10.144 1.00 0.00 O ATOM 1210 ND2 ASN A 79 -4.748 -4.615 7.976 1.00 0.00 N ATOM 0 H ASN A 79 -2.271 -4.348 10.879 1.00 0.00 H new ATOM 0 HA ASN A 79 -2.144 -2.495 9.533 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -5.153 -2.168 9.928 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -4.258 -2.160 8.422 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -4.972 -5.599 7.830 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -4.588 -4.004 7.175 1.00 0.00 H new ATOM 1217 N VAL A 80 -2.252 -0.214 10.348 1.00 0.00 N ATOM 1218 CA VAL A 80 -2.195 1.172 10.896 1.00 0.00 C ATOM 1219 C VAL A 80 -2.617 2.112 9.749 1.00 0.00 C ATOM 1220 O VAL A 80 -3.299 1.660 8.850 1.00 0.00 O ATOM 1221 CB VAL A 80 -0.728 1.345 11.313 1.00 0.00 C ATOM 1222 CG1 VAL A 80 -0.277 0.111 12.097 1.00 0.00 C ATOM 1223 CG2 VAL A 80 0.156 1.498 10.069 1.00 0.00 C ATOM 0 H VAL A 80 -1.642 -0.377 9.547 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.846 1.381 11.745 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.636 2.236 11.933 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.765 0.230 12.395 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.898 -0.003 12.986 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.376 -0.775 11.470 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.195 1.620 10.374 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.063 0.609 9.445 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.161 2.374 9.503 1.00 0.00 H new ATOM 1233 N PRO A 81 -2.214 3.364 9.746 1.00 0.00 N ATOM 1234 CA PRO A 81 -2.610 4.221 8.605 1.00 0.00 C ATOM 1235 C PRO A 81 -1.871 3.703 7.376 1.00 0.00 C ATOM 1236 O PRO A 81 -0.664 3.574 7.385 1.00 0.00 O ATOM 1237 CB PRO A 81 -2.174 5.620 9.018 1.00 0.00 C ATOM 1238 CG PRO A 81 -1.090 5.402 10.023 1.00 0.00 C ATOM 1239 CD PRO A 81 -1.387 4.094 10.719 1.00 0.00 C ATOM 0 HA PRO A 81 -3.673 4.220 8.364 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -1.811 6.190 8.162 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -3.004 6.182 9.447 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.115 5.367 9.537 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.059 6.222 10.740 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.473 3.550 10.956 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -1.918 4.251 11.658 1.00 0.00 H new ATOM 1247 N PHE A 82 -2.581 3.344 6.340 1.00 0.00 N ATOM 1248 CA PHE A 82 -1.898 2.756 5.155 1.00 0.00 C ATOM 1249 C PHE A 82 -2.915 2.355 4.086 1.00 0.00 C ATOM 1250 O PHE A 82 -3.976 2.930 3.953 1.00 0.00 O ATOM 1251 CB PHE A 82 -1.236 1.480 5.707 1.00 0.00 C ATOM 1252 CG PHE A 82 -2.271 0.368 5.855 1.00 0.00 C ATOM 1253 CD1 PHE A 82 -3.533 0.638 6.416 1.00 0.00 C ATOM 1254 CD2 PHE A 82 -1.966 -0.935 5.433 1.00 0.00 C ATOM 1255 CE1 PHE A 82 -4.477 -0.389 6.556 1.00 0.00 C ATOM 1256 CE2 PHE A 82 -2.918 -1.959 5.576 1.00 0.00 C ATOM 1257 CZ PHE A 82 -4.168 -1.683 6.137 1.00 0.00 C ATOM 0 H PHE A 82 -3.594 3.432 6.264 1.00 0.00 H new ATOM 0 HA PHE A 82 -1.200 3.456 4.697 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -0.439 1.157 5.038 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -0.776 1.689 6.673 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.775 1.640 6.740 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -1.001 -1.151 4.999 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -5.444 -0.178 6.988 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.683 -2.962 5.251 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.896 -2.473 6.246 1.00 0.00 H new ATOM 1267 N ILE A 83 -2.580 1.324 3.367 1.00 0.00 N ATOM 1268 CA ILE A 83 -3.462 0.762 2.315 1.00 0.00 C ATOM 1269 C ILE A 83 -2.902 -0.612 1.980 1.00 0.00 C ATOM 1270 O ILE A 83 -1.708 -0.828 2.083 1.00 0.00 O ATOM 1271 CB ILE A 83 -3.343 1.689 1.113 1.00 0.00 C ATOM 1272 CG1 ILE A 83 -4.422 2.774 1.162 1.00 0.00 C ATOM 1273 CG2 ILE A 83 -3.502 0.892 -0.194 1.00 0.00 C ATOM 1274 CD1 ILE A 83 -3.780 4.136 0.891 1.00 0.00 C ATOM 0 H ILE A 83 -1.694 0.830 3.472 1.00 0.00 H new ATOM 0 HA ILE A 83 -4.506 0.677 2.616 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.358 2.154 1.144 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.194 2.569 0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.909 2.776 2.137 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.415 1.568 -1.045 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.724 0.131 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.480 0.412 -0.211 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.545 4.912 0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.023 4.339 1.649 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.314 4.129 -0.094 1.00 0.00 H new ATOM 1286 N PHE A 84 -3.735 -1.525 1.582 1.00 0.00 N ATOM 1287 CA PHE A 84 -3.243 -2.886 1.237 1.00 0.00 C ATOM 1288 C PHE A 84 -4.218 -3.569 0.286 1.00 0.00 C ATOM 1289 O PHE A 84 -5.359 -3.169 0.144 1.00 0.00 O ATOM 1290 CB PHE A 84 -3.187 -3.640 2.565 1.00 0.00 C ATOM 1291 CG PHE A 84 -2.167 -4.755 2.481 1.00 0.00 C ATOM 1292 CD1 PHE A 84 -0.819 -4.495 2.761 1.00 0.00 C ATOM 1293 CD2 PHE A 84 -2.571 -6.051 2.129 1.00 0.00 C ATOM 1294 CE1 PHE A 84 0.123 -5.530 2.687 1.00 0.00 C ATOM 1295 CE2 PHE A 84 -1.627 -7.084 2.053 1.00 0.00 C ATOM 1296 CZ PHE A 84 -0.282 -6.823 2.332 1.00 0.00 C ATOM 0 H PHE A 84 -4.741 -1.389 1.479 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.272 -2.858 0.742 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -2.925 -2.955 3.371 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.169 -4.050 2.802 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.506 -3.498 3.034 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.610 -6.253 1.916 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.162 -5.330 2.904 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.938 -8.081 1.779 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.445 -7.619 2.274 1.00 0.00 H new ATOM 1306 N ALA A 85 -3.786 -4.607 -0.355 1.00 0.00 N ATOM 1307 CA ALA A 85 -4.691 -5.328 -1.281 1.00 0.00 C ATOM 1308 C ALA A 85 -3.971 -6.548 -1.837 1.00 0.00 C ATOM 1309 O ALA A 85 -2.808 -6.477 -2.143 1.00 0.00 O ATOM 1310 CB ALA A 85 -5.000 -4.341 -2.402 1.00 0.00 C ATOM 0 H ALA A 85 -2.844 -4.990 -0.279 1.00 0.00 H new ATOM 0 HA ALA A 85 -5.602 -5.671 -0.790 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -5.667 -4.809 -3.126 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -5.481 -3.456 -1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -4.073 -4.051 -2.897 1.00 0.00 H new ATOM 1316 N THR A 86 -4.636 -7.663 -1.972 1.00 0.00 N ATOM 1317 CA THR A 86 -3.934 -8.862 -2.513 1.00 0.00 C ATOM 1318 C THR A 86 -4.855 -9.675 -3.434 1.00 0.00 C ATOM 1319 O THR A 86 -5.206 -9.235 -4.510 1.00 0.00 O ATOM 1320 CB THR A 86 -3.535 -9.673 -1.282 1.00 0.00 C ATOM 1321 OG1 THR A 86 -4.701 -10.219 -0.685 1.00 0.00 O ATOM 1322 CG2 THR A 86 -2.819 -8.771 -0.280 1.00 0.00 C ATOM 0 H THR A 86 -5.619 -7.796 -1.736 1.00 0.00 H new ATOM 0 HA THR A 86 -3.071 -8.589 -3.120 1.00 0.00 H new ATOM 0 HB THR A 86 -2.864 -10.479 -1.578 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.524 -10.415 0.259 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.536 -9.354 0.597 1.00 0.00 H new ATOM 0 HG22 THR A 86 -1.925 -8.352 -0.742 1.00 0.00 H new ATOM 0 HG23 THR A 86 -3.484 -7.962 0.021 1.00 0.00 H new ATOM 1330 N GLY A 87 -5.237 -10.863 -3.035 1.00 0.00 N ATOM 1331 CA GLY A 87 -6.119 -11.692 -3.904 1.00 0.00 C ATOM 1332 C GLY A 87 -7.518 -11.773 -3.293 1.00 0.00 C ATOM 1333 O GLY A 87 -8.511 -11.599 -3.971 1.00 0.00 O ATOM 0 H GLY A 87 -4.975 -11.291 -2.147 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.173 -11.258 -4.903 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.701 -12.693 -4.013 1.00 0.00 H new ATOM 1337 N TYR A 88 -7.608 -12.037 -2.016 1.00 0.00 N ATOM 1338 CA TYR A 88 -8.950 -12.127 -1.374 1.00 0.00 C ATOM 1339 C TYR A 88 -9.615 -10.751 -1.359 1.00 0.00 C ATOM 1340 O TYR A 88 -10.817 -10.632 -1.503 1.00 0.00 O ATOM 1341 CB TYR A 88 -8.691 -12.622 0.050 1.00 0.00 C ATOM 1342 CG TYR A 88 -7.610 -11.791 0.700 1.00 0.00 C ATOM 1343 CD1 TYR A 88 -7.911 -10.522 1.207 1.00 0.00 C ATOM 1344 CD2 TYR A 88 -6.308 -12.296 0.805 1.00 0.00 C ATOM 1345 CE1 TYR A 88 -6.909 -9.757 1.817 1.00 0.00 C ATOM 1346 CE2 TYR A 88 -5.308 -11.531 1.417 1.00 0.00 C ATOM 1347 CZ TYR A 88 -5.609 -10.261 1.922 1.00 0.00 C ATOM 1348 OH TYR A 88 -4.624 -9.505 2.526 1.00 0.00 O ATOM 0 H TYR A 88 -6.815 -12.193 -1.394 1.00 0.00 H new ATOM 0 HA TYR A 88 -9.619 -12.799 -1.912 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.608 -12.563 0.636 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.392 -13.670 0.030 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.915 -10.133 1.128 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.075 -13.275 0.414 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.141 -8.777 2.207 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.304 -11.921 1.499 1.00 0.00 H new ATOM 0 HH TYR A 88 -3.779 -10.001 2.517 1.00 0.00 H new ATOM 1358 N GLY A 89 -8.847 -9.708 -1.197 1.00 0.00 N ATOM 1359 CA GLY A 89 -9.447 -8.346 -1.187 1.00 0.00 C ATOM 1360 C GLY A 89 -9.695 -7.883 0.249 1.00 0.00 C ATOM 1361 O GLY A 89 -10.820 -7.679 0.662 1.00 0.00 O ATOM 0 H GLY A 89 -7.835 -9.741 -1.072 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -8.782 -7.645 -1.692 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.385 -8.351 -1.741 1.00 0.00 H new ATOM 1365 N SER A 90 -8.653 -7.696 1.009 1.00 0.00 N ATOM 1366 CA SER A 90 -8.830 -7.223 2.413 1.00 0.00 C ATOM 1367 C SER A 90 -9.802 -8.126 3.174 1.00 0.00 C ATOM 1368 O SER A 90 -10.330 -9.081 2.644 1.00 0.00 O ATOM 1369 CB SER A 90 -9.396 -5.807 2.289 1.00 0.00 C ATOM 1370 OG SER A 90 -9.458 -5.433 0.917 1.00 0.00 O ATOM 0 H SER A 90 -7.687 -7.850 0.721 1.00 0.00 H new ATOM 0 HA SER A 90 -7.892 -7.242 2.968 1.00 0.00 H new ATOM 0 HB2 SER A 90 -10.390 -5.762 2.733 1.00 0.00 H new ATOM 0 HB3 SER A 90 -8.769 -5.105 2.839 1.00 0.00 H new ATOM 0 HG SER A 90 -10.093 -4.695 0.808 1.00 0.00 H new ATOM 1376 N LYS A 91 -10.038 -7.820 4.420 1.00 0.00 N ATOM 1377 CA LYS A 91 -10.971 -8.640 5.238 1.00 0.00 C ATOM 1378 C LYS A 91 -11.586 -7.772 6.339 1.00 0.00 C ATOM 1379 O LYS A 91 -12.096 -8.267 7.325 1.00 0.00 O ATOM 1380 CB LYS A 91 -10.100 -9.746 5.849 1.00 0.00 C ATOM 1381 CG LYS A 91 -9.251 -9.169 6.993 1.00 0.00 C ATOM 1382 CD LYS A 91 -7.765 -9.374 6.694 1.00 0.00 C ATOM 1383 CE LYS A 91 -6.931 -8.805 7.848 1.00 0.00 C ATOM 1384 NZ LYS A 91 -7.445 -9.490 9.067 1.00 0.00 N ATOM 0 H LYS A 91 -9.620 -7.029 4.910 1.00 0.00 H new ATOM 0 HA LYS A 91 -11.792 -9.052 4.651 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.730 -10.553 6.223 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.453 -10.176 5.085 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.463 -8.107 7.115 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.512 -9.656 7.933 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -7.552 -10.435 6.565 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -7.499 -8.879 5.760 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.869 -9.002 7.702 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -7.047 -7.724 7.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -6.684 -9.562 9.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.235 -8.943 9.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -7.776 -10.444 8.816 1.00 0.00 H new ATOM 1398 N GLY A 92 -11.514 -6.480 6.186 1.00 0.00 N ATOM 1399 CA GLY A 92 -12.062 -5.569 7.229 1.00 0.00 C ATOM 1400 C GLY A 92 -10.897 -5.067 8.084 1.00 0.00 C ATOM 1401 O GLY A 92 -10.872 -5.244 9.286 1.00 0.00 O ATOM 0 H GLY A 92 -11.098 -6.014 5.380 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -12.583 -4.731 6.766 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -12.790 -6.094 7.848 1.00 0.00 H new ATOM 1405 N LEU A 93 -9.921 -4.454 7.463 1.00 0.00 N ATOM 1406 CA LEU A 93 -8.744 -3.953 8.233 1.00 0.00 C ATOM 1407 C LEU A 93 -9.048 -2.601 8.878 1.00 0.00 C ATOM 1408 O LEU A 93 -10.039 -1.964 8.580 1.00 0.00 O ATOM 1409 CB LEU A 93 -7.561 -3.854 7.243 1.00 0.00 C ATOM 1410 CG LEU A 93 -7.916 -3.106 5.941 1.00 0.00 C ATOM 1411 CD1 LEU A 93 -8.397 -4.106 4.885 1.00 0.00 C ATOM 1412 CD2 LEU A 93 -8.992 -2.036 6.184 1.00 0.00 C ATOM 0 H LEU A 93 -9.889 -4.280 6.459 1.00 0.00 H new ATOM 0 HA LEU A 93 -8.498 -4.634 9.048 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.730 -3.345 7.731 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.219 -4.859 6.995 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.019 -2.601 5.583 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.647 -3.574 3.967 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -7.607 -4.829 4.682 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.280 -4.628 5.254 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.218 -1.528 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.896 -2.509 6.568 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.626 -1.310 6.910 1.00 0.00 H new ATOM 1424 N ASP A 94 -8.199 -2.163 9.764 1.00 0.00 N ATOM 1425 CA ASP A 94 -8.430 -0.854 10.440 1.00 0.00 C ATOM 1426 C ASP A 94 -7.391 0.167 9.978 1.00 0.00 C ATOM 1427 O ASP A 94 -6.292 -0.186 9.601 1.00 0.00 O ATOM 1428 CB ASP A 94 -8.316 -1.132 11.947 1.00 0.00 C ATOM 1429 CG ASP A 94 -7.044 -1.928 12.259 1.00 0.00 C ATOM 1430 OD1 ASP A 94 -6.579 -2.638 11.385 1.00 0.00 O ATOM 1431 OD2 ASP A 94 -6.564 -1.819 13.375 1.00 0.00 O ATOM 0 H ASP A 94 -7.353 -2.655 10.051 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.407 -0.434 10.198 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.305 -0.190 12.495 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -9.190 -1.688 12.286 1.00 0.00 H new ATOM 1436 N THR A 95 -7.726 1.429 10.003 1.00 0.00 N ATOM 1437 CA THR A 95 -6.746 2.462 9.559 1.00 0.00 C ATOM 1438 C THR A 95 -7.350 3.860 9.646 1.00 0.00 C ATOM 1439 O THR A 95 -8.511 4.031 9.960 1.00 0.00 O ATOM 1440 CB THR A 95 -6.450 2.123 8.101 1.00 0.00 C ATOM 1441 OG1 THR A 95 -5.604 3.121 7.550 1.00 0.00 O ATOM 1442 CG2 THR A 95 -7.758 2.058 7.307 1.00 0.00 C ATOM 0 H THR A 95 -8.630 1.788 10.310 1.00 0.00 H new ATOM 0 HA THR A 95 -5.853 2.460 10.184 1.00 0.00 H new ATOM 0 HB THR A 95 -5.954 1.154 8.047 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.825 3.251 6.604 1.00 0.00 H new ATOM 0 HG21 THR A 95 -7.541 1.816 6.267 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.403 1.289 7.731 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.262 3.023 7.357 1.00 0.00 H new ATOM 1450 N ARG A 96 -6.570 4.861 9.342 1.00 0.00 N ATOM 1451 CA ARG A 96 -7.095 6.254 9.377 1.00 0.00 C ATOM 1452 C ARG A 96 -7.891 6.530 8.109 1.00 0.00 C ATOM 1453 O ARG A 96 -8.319 7.639 7.859 1.00 0.00 O ATOM 1454 CB ARG A 96 -5.858 7.153 9.417 1.00 0.00 C ATOM 1455 CG ARG A 96 -5.411 7.359 10.866 1.00 0.00 C ATOM 1456 CD ARG A 96 -5.572 8.835 11.247 1.00 0.00 C ATOM 1457 NE ARG A 96 -4.890 9.592 10.159 1.00 0.00 N ATOM 1458 CZ ARG A 96 -5.433 10.680 9.681 1.00 0.00 C ATOM 1459 NH1 ARG A 96 -5.499 11.758 10.418 1.00 0.00 N ATOM 1460 NH2 ARG A 96 -5.917 10.688 8.467 1.00 0.00 N ATOM 0 H ARG A 96 -5.591 4.773 9.071 1.00 0.00 H new ATOM 0 HA ARG A 96 -7.751 6.425 10.230 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -5.051 6.702 8.839 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -6.082 8.115 8.956 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -6.004 6.734 11.533 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -4.371 7.054 10.984 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -6.624 9.111 11.320 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.120 9.044 12.216 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.000 9.261 9.788 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.126 11.750 11.367 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -5.923 12.607 10.043 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -5.871 9.846 7.894 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -6.341 11.537 8.093 1.00 0.00 H new ATOM 1474 N TYR A 97 -8.081 5.531 7.301 1.00 0.00 N ATOM 1475 CA TYR A 97 -8.835 5.728 6.045 1.00 0.00 C ATOM 1476 C TYR A 97 -10.336 5.612 6.309 1.00 0.00 C ATOM 1477 O TYR A 97 -11.050 6.593 6.255 1.00 0.00 O ATOM 1478 CB TYR A 97 -8.323 4.610 5.139 1.00 0.00 C ATOM 1479 CG TYR A 97 -6.926 4.969 4.687 1.00 0.00 C ATOM 1480 CD1 TYR A 97 -5.891 5.096 5.627 1.00 0.00 C ATOM 1481 CD2 TYR A 97 -6.666 5.195 3.334 1.00 0.00 C ATOM 1482 CE1 TYR A 97 -4.603 5.449 5.210 1.00 0.00 C ATOM 1483 CE2 TYR A 97 -5.377 5.547 2.916 1.00 0.00 C ATOM 1484 CZ TYR A 97 -4.346 5.675 3.853 1.00 0.00 C ATOM 1485 OH TYR A 97 -3.078 6.023 3.439 1.00 0.00 O ATOM 0 H TYR A 97 -7.743 4.582 7.460 1.00 0.00 H new ATOM 0 HA TYR A 97 -8.692 6.711 5.597 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -8.317 3.660 5.674 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -8.981 4.487 4.279 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -6.089 4.921 6.674 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -7.460 5.098 2.609 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -3.808 5.547 5.934 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -5.178 5.720 1.869 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.416 5.628 4.044 1.00 0.00 H new ATOM 1495 N SER A 98 -10.802 4.422 6.612 1.00 0.00 N ATOM 1496 CA SER A 98 -12.265 4.188 6.903 1.00 0.00 C ATOM 1497 C SER A 98 -12.667 2.769 6.488 1.00 0.00 C ATOM 1498 O SER A 98 -13.793 2.528 6.099 1.00 0.00 O ATOM 1499 CB SER A 98 -13.053 5.199 6.061 1.00 0.00 C ATOM 1500 OG SER A 98 -13.315 6.355 6.844 1.00 0.00 O ATOM 0 H SER A 98 -10.223 3.584 6.672 1.00 0.00 H new ATOM 0 HA SER A 98 -12.468 4.306 7.968 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.486 5.469 5.170 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.989 4.756 5.721 1.00 0.00 H new ATOM 0 HG SER A 98 -12.501 6.897 6.910 1.00 0.00 H new ATOM 1506 N ASN A 99 -11.765 1.826 6.550 1.00 0.00 N ATOM 1507 CA ASN A 99 -12.122 0.441 6.138 1.00 0.00 C ATOM 1508 C ASN A 99 -12.877 0.493 4.818 1.00 0.00 C ATOM 1509 O ASN A 99 -14.081 0.352 4.774 1.00 0.00 O ATOM 1510 CB ASN A 99 -13.017 -0.085 7.252 1.00 0.00 C ATOM 1511 CG ASN A 99 -12.363 0.211 8.600 1.00 0.00 C ATOM 1512 OD1 ASN A 99 -13.020 0.210 9.621 1.00 0.00 O ATOM 1513 ND2 ASN A 99 -11.083 0.466 8.646 1.00 0.00 N ATOM 0 H ASN A 99 -10.804 1.955 6.866 1.00 0.00 H new ATOM 0 HA ASN A 99 -11.251 -0.198 5.993 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -13.999 0.385 7.199 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.171 -1.158 7.136 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -10.634 0.665 9.540 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -10.532 0.467 7.788 1.00 0.00 H new ATOM 1520 N ILE A 100 -12.173 0.700 3.743 1.00 0.00 N ATOM 1521 CA ILE A 100 -12.846 0.772 2.415 1.00 0.00 C ATOM 1522 C ILE A 100 -11.858 0.887 1.225 1.00 0.00 C ATOM 1523 O ILE A 100 -12.114 0.296 0.195 1.00 0.00 O ATOM 1524 CB ILE A 100 -13.782 2.000 2.451 1.00 0.00 C ATOM 1525 CG1 ILE A 100 -13.306 3.077 3.444 1.00 0.00 C ATOM 1526 CG2 ILE A 100 -15.186 1.551 2.854 1.00 0.00 C ATOM 1527 CD1 ILE A 100 -12.999 4.370 2.684 1.00 0.00 C ATOM 0 H ILE A 100 -11.161 0.823 3.724 1.00 0.00 H new ATOM 0 HA ILE A 100 -13.392 -0.157 2.249 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.778 2.439 1.453 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -14.074 3.258 4.196 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.417 2.733 3.972 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -15.850 2.415 2.881 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.559 0.828 2.128 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.151 1.089 3.841 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.662 5.133 3.386 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -12.217 4.183 1.948 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -13.899 4.716 2.176 1.00 0.00 H new ATOM 1539 N PRO A 101 -10.778 1.643 1.354 1.00 0.00 N ATOM 1540 CA PRO A 101 -9.843 1.782 0.210 1.00 0.00 C ATOM 1541 C PRO A 101 -8.891 0.587 0.109 1.00 0.00 C ATOM 1542 O PRO A 101 -7.688 0.744 0.165 1.00 0.00 O ATOM 1543 CB PRO A 101 -9.065 3.052 0.534 1.00 0.00 C ATOM 1544 CG PRO A 101 -9.132 3.205 2.017 1.00 0.00 C ATOM 1545 CD PRO A 101 -10.316 2.418 2.518 1.00 0.00 C ATOM 0 HA PRO A 101 -10.366 1.825 -0.745 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.032 2.974 0.196 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -9.501 3.916 0.032 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.213 2.844 2.478 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -9.233 4.256 2.287 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -10.034 1.763 3.342 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -11.100 3.078 2.889 1.00 0.00 H new ATOM 1553 N LEU A 102 -9.405 -0.603 -0.048 1.00 0.00 N ATOM 1554 CA LEU A 102 -8.493 -1.779 -0.159 1.00 0.00 C ATOM 1555 C LEU A 102 -9.131 -2.895 -0.992 1.00 0.00 C ATOM 1556 O LEU A 102 -10.335 -2.953 -1.143 1.00 0.00 O ATOM 1557 CB LEU A 102 -8.277 -2.247 1.281 1.00 0.00 C ATOM 1558 CG LEU A 102 -7.069 -1.529 1.880 1.00 0.00 C ATOM 1559 CD1 LEU A 102 -7.544 -0.385 2.777 1.00 0.00 C ATOM 1560 CD2 LEU A 102 -6.257 -2.525 2.712 1.00 0.00 C ATOM 0 H LEU A 102 -10.402 -0.811 -0.104 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.559 -1.519 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.166 -2.043 1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.119 -3.325 1.303 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.450 -1.125 1.079 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -6.681 0.126 3.203 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -8.129 0.321 2.187 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -8.162 -0.785 3.581 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -5.393 -2.020 3.143 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.880 -2.924 3.512 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -5.919 -3.342 2.074 1.00 0.00 H new ATOM 1572 N LEU A 103 -8.332 -3.795 -1.522 1.00 0.00 N ATOM 1573 CA LEU A 103 -8.913 -4.911 -2.332 1.00 0.00 C ATOM 1574 C LEU A 103 -7.829 -5.891 -2.828 1.00 0.00 C ATOM 1575 O LEU A 103 -7.024 -6.371 -2.057 1.00 0.00 O ATOM 1576 CB LEU A 103 -9.635 -4.242 -3.504 1.00 0.00 C ATOM 1577 CG LEU A 103 -8.643 -3.482 -4.382 1.00 0.00 C ATOM 1578 CD1 LEU A 103 -9.356 -3.047 -5.659 1.00 0.00 C ATOM 1579 CD2 LEU A 103 -8.136 -2.245 -3.640 1.00 0.00 C ATOM 0 H LEU A 103 -7.316 -3.804 -1.429 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.594 -5.514 -1.731 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.152 -4.996 -4.098 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.395 -3.557 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.796 -4.125 -4.623 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -8.660 -2.502 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.722 -3.926 -6.189 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.196 -2.401 -5.405 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -7.429 -1.707 -4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.977 -1.594 -3.401 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -7.640 -2.551 -2.719 1.00 0.00 H new ATOM 1591 N THR A 104 -7.832 -6.234 -4.097 1.00 0.00 N ATOM 1592 CA THR A 104 -6.834 -7.226 -4.607 1.00 0.00 C ATOM 1593 C THR A 104 -5.942 -6.659 -5.717 1.00 0.00 C ATOM 1594 O THR A 104 -5.482 -7.383 -6.578 1.00 0.00 O ATOM 1595 CB THR A 104 -7.679 -8.407 -5.121 1.00 0.00 C ATOM 1596 OG1 THR A 104 -6.929 -9.153 -6.067 1.00 0.00 O ATOM 1597 CG2 THR A 104 -8.968 -7.903 -5.784 1.00 0.00 C ATOM 0 H THR A 104 -8.480 -5.871 -4.796 1.00 0.00 H new ATOM 0 HA THR A 104 -6.139 -7.518 -3.820 1.00 0.00 H new ATOM 0 HB THR A 104 -7.942 -9.039 -4.272 1.00 0.00 H new ATOM 0 HG1 THR A 104 -5.977 -8.939 -5.972 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.550 -8.753 -6.140 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.554 -7.340 -5.058 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.716 -7.258 -6.626 1.00 0.00 H new ATOM 1605 N LYS A 105 -5.664 -5.384 -5.694 1.00 0.00 N ATOM 1606 CA LYS A 105 -4.766 -4.806 -6.739 1.00 0.00 C ATOM 1607 C LYS A 105 -5.325 -5.044 -8.173 1.00 0.00 C ATOM 1608 O LYS A 105 -4.584 -5.167 -9.122 1.00 0.00 O ATOM 1609 CB LYS A 105 -3.430 -5.538 -6.473 1.00 0.00 C ATOM 1610 CG LYS A 105 -2.604 -5.663 -7.741 1.00 0.00 C ATOM 1611 CD LYS A 105 -2.977 -6.989 -8.409 1.00 0.00 C ATOM 1612 CE LYS A 105 -2.390 -7.056 -9.821 1.00 0.00 C ATOM 1613 NZ LYS A 105 -2.612 -8.467 -10.259 1.00 0.00 N ATOM 0 H LYS A 105 -6.016 -4.721 -5.004 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.663 -3.722 -6.686 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -2.861 -4.996 -5.718 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -3.631 -6.530 -6.069 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -2.804 -4.827 -8.412 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.539 -5.638 -7.508 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -2.604 -7.822 -7.813 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -4.061 -7.089 -8.453 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -2.885 -6.352 -10.489 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -1.330 -6.804 -9.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -2.410 -8.551 -11.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -1.980 -9.099 -9.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -3.601 -8.735 -10.079 1.00 0.00 H new ATOM 1627 N PRO A 106 -6.628 -5.050 -8.324 1.00 0.00 N ATOM 1628 CA PRO A 106 -7.197 -5.228 -9.685 1.00 0.00 C ATOM 1629 C PRO A 106 -6.893 -3.993 -10.548 1.00 0.00 C ATOM 1630 O PRO A 106 -7.220 -3.944 -11.716 1.00 0.00 O ATOM 1631 CB PRO A 106 -8.695 -5.383 -9.436 1.00 0.00 C ATOM 1632 CG PRO A 106 -8.937 -4.715 -8.122 1.00 0.00 C ATOM 1633 CD PRO A 106 -7.679 -4.895 -7.308 1.00 0.00 C ATOM 0 HA PRO A 106 -6.781 -6.081 -10.222 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -9.278 -4.916 -10.230 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.984 -6.434 -9.404 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -9.161 -3.657 -8.261 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -9.794 -5.158 -7.614 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.491 -4.035 -6.665 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -7.742 -5.769 -6.660 1.00 0.00 H new ATOM 1641 N PHE A 107 -6.267 -2.999 -9.972 1.00 0.00 N ATOM 1642 CA PHE A 107 -5.931 -1.765 -10.732 1.00 0.00 C ATOM 1643 C PHE A 107 -7.203 -1.112 -11.274 1.00 0.00 C ATOM 1644 O PHE A 107 -8.273 -1.356 -10.763 1.00 0.00 O ATOM 1645 CB PHE A 107 -4.995 -2.234 -11.842 1.00 0.00 C ATOM 1646 CG PHE A 107 -3.602 -2.288 -11.266 1.00 0.00 C ATOM 1647 CD1 PHE A 107 -3.020 -1.118 -10.765 1.00 0.00 C ATOM 1648 CD2 PHE A 107 -2.905 -3.501 -11.200 1.00 0.00 C ATOM 1649 CE1 PHE A 107 -1.742 -1.156 -10.202 1.00 0.00 C ATOM 1650 CE2 PHE A 107 -1.622 -3.539 -10.637 1.00 0.00 C ATOM 1651 CZ PHE A 107 -1.041 -2.365 -10.137 1.00 0.00 C ATOM 0 H PHE A 107 -5.972 -2.993 -8.996 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.453 -1.002 -10.118 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -5.297 -3.215 -12.209 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -5.033 -1.551 -12.690 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -3.560 -0.184 -10.814 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -3.355 -4.405 -11.582 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -1.295 -0.252 -9.817 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.081 -4.472 -10.588 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.053 -2.394 -9.702 1.00 0.00 H new ATOM 1661 N LEU A 108 -7.078 -0.275 -12.286 1.00 0.00 N ATOM 1662 CA LEU A 108 -8.260 0.442 -12.884 1.00 0.00 C ATOM 1663 C LEU A 108 -9.410 0.582 -11.874 1.00 0.00 C ATOM 1664 O LEU A 108 -10.567 0.475 -12.200 1.00 0.00 O ATOM 1665 CB LEU A 108 -8.611 -0.335 -14.185 1.00 0.00 C ATOM 1666 CG LEU A 108 -9.702 -1.428 -14.039 1.00 0.00 C ATOM 1667 CD1 LEU A 108 -9.603 -2.185 -12.714 1.00 0.00 C ATOM 1668 CD2 LEU A 108 -11.093 -0.804 -14.188 1.00 0.00 C ATOM 0 H LEU A 108 -6.187 -0.055 -12.731 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.038 1.478 -13.139 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.939 0.382 -14.938 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.702 -0.802 -14.564 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.537 -2.155 -14.834 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -10.390 -2.937 -12.665 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -8.630 -2.672 -12.645 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.718 -1.486 -11.886 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -11.852 -1.579 -14.084 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -11.237 -0.048 -13.416 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -11.180 -0.340 -15.170 1.00 0.00 H new ATOM 1680 N ASP A 109 -9.061 0.856 -10.639 1.00 0.00 N ATOM 1681 CA ASP A 109 -10.071 1.037 -9.543 1.00 0.00 C ATOM 1682 C ASP A 109 -9.409 0.708 -8.197 1.00 0.00 C ATOM 1683 O ASP A 109 -9.907 1.050 -7.146 1.00 0.00 O ATOM 1684 CB ASP A 109 -11.211 0.044 -9.825 1.00 0.00 C ATOM 1685 CG ASP A 109 -12.006 -0.224 -8.541 1.00 0.00 C ATOM 1686 OD1 ASP A 109 -12.448 0.735 -7.928 1.00 0.00 O ATOM 1687 OD2 ASP A 109 -12.159 -1.384 -8.194 1.00 0.00 O ATOM 0 H ASP A 109 -8.093 0.965 -10.336 1.00 0.00 H new ATOM 0 HA ASP A 109 -10.449 2.059 -9.505 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.871 0.445 -10.594 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -10.803 -0.890 -10.211 1.00 0.00 H new ATOM 1692 N SER A 110 -8.295 0.026 -8.239 1.00 0.00 N ATOM 1693 CA SER A 110 -7.582 -0.366 -6.987 1.00 0.00 C ATOM 1694 C SER A 110 -6.759 0.797 -6.422 1.00 0.00 C ATOM 1695 O SER A 110 -7.283 1.643 -5.723 1.00 0.00 O ATOM 1696 CB SER A 110 -6.682 -1.503 -7.442 1.00 0.00 C ATOM 1697 OG SER A 110 -7.489 -2.494 -8.042 1.00 0.00 O ATOM 0 H SER A 110 -7.842 -0.280 -9.100 1.00 0.00 H new ATOM 0 HA SER A 110 -8.262 -0.651 -6.184 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.938 -1.138 -8.151 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.137 -1.919 -6.594 1.00 0.00 H new ATOM 0 HG SER A 110 -7.895 -2.135 -8.858 1.00 0.00 H new ATOM 1703 N GLU A 111 -5.475 0.844 -6.708 1.00 0.00 N ATOM 1704 CA GLU A 111 -4.623 1.956 -6.184 1.00 0.00 C ATOM 1705 C GLU A 111 -5.411 3.276 -6.187 1.00 0.00 C ATOM 1706 O GLU A 111 -5.187 4.150 -5.374 1.00 0.00 O ATOM 1707 CB GLU A 111 -3.410 1.990 -7.140 1.00 0.00 C ATOM 1708 CG GLU A 111 -3.297 3.342 -7.858 1.00 0.00 C ATOM 1709 CD GLU A 111 -2.743 4.386 -6.889 1.00 0.00 C ATOM 1710 OE1 GLU A 111 -1.930 4.020 -6.056 1.00 0.00 O ATOM 1711 OE2 GLU A 111 -3.144 5.534 -6.994 1.00 0.00 O ATOM 0 H GLU A 111 -4.984 0.158 -7.282 1.00 0.00 H new ATOM 0 HA GLU A 111 -4.307 1.810 -5.151 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -2.496 1.798 -6.577 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -3.504 1.192 -7.877 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -2.643 3.252 -8.726 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -4.274 3.654 -8.226 1.00 0.00 H new ATOM 1718 N LEU A 112 -6.342 3.410 -7.087 1.00 0.00 N ATOM 1719 CA LEU A 112 -7.160 4.658 -7.137 1.00 0.00 C ATOM 1720 C LEU A 112 -8.023 4.732 -5.882 1.00 0.00 C ATOM 1721 O LEU A 112 -7.849 5.596 -5.045 1.00 0.00 O ATOM 1722 CB LEU A 112 -8.051 4.545 -8.385 1.00 0.00 C ATOM 1723 CG LEU A 112 -7.314 3.822 -9.516 1.00 0.00 C ATOM 1724 CD1 LEU A 112 -8.129 3.931 -10.806 1.00 0.00 C ATOM 1725 CD2 LEU A 112 -5.937 4.458 -9.727 1.00 0.00 C ATOM 0 H LEU A 112 -6.574 2.711 -7.792 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.539 5.553 -7.184 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.965 4.005 -8.137 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.348 5.540 -8.716 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.188 2.772 -9.251 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.605 3.417 -11.612 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.107 3.473 -10.658 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.256 4.981 -11.068 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.417 3.940 -10.533 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.058 5.509 -9.990 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -5.355 4.378 -8.809 1.00 0.00 H new ATOM 1737 N GLU A 113 -8.941 3.817 -5.733 1.00 0.00 N ATOM 1738 CA GLU A 113 -9.796 3.827 -4.519 1.00 0.00 C ATOM 1739 C GLU A 113 -8.903 3.977 -3.292 1.00 0.00 C ATOM 1740 O GLU A 113 -9.244 4.634 -2.329 1.00 0.00 O ATOM 1741 CB GLU A 113 -10.518 2.461 -4.517 1.00 0.00 C ATOM 1742 CG GLU A 113 -9.718 1.415 -3.726 1.00 0.00 C ATOM 1743 CD GLU A 113 -10.540 0.130 -3.602 1.00 0.00 C ATOM 1744 OE1 GLU A 113 -10.968 -0.378 -4.625 1.00 0.00 O ATOM 1745 OE2 GLU A 113 -10.725 -0.324 -2.486 1.00 0.00 O ATOM 0 H GLU A 113 -9.133 3.067 -6.397 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.514 4.647 -4.507 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.511 2.571 -4.080 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -10.657 2.118 -5.542 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -8.773 1.208 -4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.474 1.800 -2.736 1.00 0.00 H new ATOM 1752 N ALA A 114 -7.761 3.357 -3.320 1.00 0.00 N ATOM 1753 CA ALA A 114 -6.855 3.447 -2.148 1.00 0.00 C ATOM 1754 C ALA A 114 -6.680 4.909 -1.728 1.00 0.00 C ATOM 1755 O ALA A 114 -6.757 5.244 -0.563 1.00 0.00 O ATOM 1756 CB ALA A 114 -5.530 2.844 -2.617 1.00 0.00 C ATOM 0 H ALA A 114 -7.417 2.795 -4.099 1.00 0.00 H new ATOM 0 HA ALA A 114 -7.246 2.918 -1.279 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.807 2.875 -1.802 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.689 1.810 -2.922 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.149 3.417 -3.462 1.00 0.00 H new ATOM 1762 N VAL A 115 -6.454 5.780 -2.669 1.00 0.00 N ATOM 1763 CA VAL A 115 -6.282 7.221 -2.327 1.00 0.00 C ATOM 1764 C VAL A 115 -7.586 7.980 -2.586 1.00 0.00 C ATOM 1765 O VAL A 115 -7.751 9.112 -2.175 1.00 0.00 O ATOM 1766 CB VAL A 115 -5.180 7.722 -3.258 1.00 0.00 C ATOM 1767 CG1 VAL A 115 -4.801 9.152 -2.870 1.00 0.00 C ATOM 1768 CG2 VAL A 115 -3.954 6.816 -3.126 1.00 0.00 C ATOM 0 H VAL A 115 -6.381 5.558 -3.662 1.00 0.00 H new ATOM 0 HA VAL A 115 -6.026 7.369 -1.278 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.535 7.706 -4.288 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.014 9.513 -3.533 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.675 9.797 -2.960 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -4.443 9.167 -1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.166 7.171 -3.790 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.597 6.834 -2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.225 5.796 -3.398 1.00 0.00 H new ATOM 1778 N LEU A 116 -8.502 7.372 -3.287 1.00 0.00 N ATOM 1779 CA LEU A 116 -9.788 8.058 -3.600 1.00 0.00 C ATOM 1780 C LEU A 116 -10.855 7.757 -2.541 1.00 0.00 C ATOM 1781 O LEU A 116 -11.641 8.612 -2.183 1.00 0.00 O ATOM 1782 CB LEU A 116 -10.206 7.483 -4.951 1.00 0.00 C ATOM 1783 CG LEU A 116 -10.703 8.606 -5.858 1.00 0.00 C ATOM 1784 CD1 LEU A 116 -10.668 8.137 -7.314 1.00 0.00 C ATOM 1785 CD2 LEU A 116 -12.138 8.968 -5.476 1.00 0.00 C ATOM 0 H LEU A 116 -8.415 6.426 -3.658 1.00 0.00 H new ATOM 0 HA LEU A 116 -9.676 9.142 -3.617 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -9.363 6.973 -5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -10.991 6.740 -4.813 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.062 9.480 -5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -11.023 8.938 -7.963 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -9.646 7.874 -7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -11.310 7.264 -7.431 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -12.495 9.770 -6.122 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.778 8.094 -5.595 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -12.166 9.299 -4.438 1.00 0.00 H new ATOM 1797 N VAL A 117 -10.897 6.552 -2.041 1.00 0.00 N ATOM 1798 CA VAL A 117 -11.927 6.212 -1.012 1.00 0.00 C ATOM 1799 C VAL A 117 -11.502 6.756 0.354 1.00 0.00 C ATOM 1800 O VAL A 117 -12.228 6.665 1.325 1.00 0.00 O ATOM 1801 CB VAL A 117 -12.014 4.682 -0.965 1.00 0.00 C ATOM 1802 CG1 VAL A 117 -13.410 4.272 -0.528 1.00 0.00 C ATOM 1803 CG2 VAL A 117 -11.749 4.057 -2.338 1.00 0.00 C ATOM 0 H VAL A 117 -10.268 5.791 -2.297 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.892 6.652 -1.261 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.258 4.331 -0.263 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.476 3.185 -0.493 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.616 4.680 0.462 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.141 4.657 -1.238 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.820 2.972 -2.264 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.488 4.421 -3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.751 4.333 -2.677 1.00 0.00 H new ATOM 1813 N GLN A 118 -10.322 7.306 0.440 1.00 0.00 N ATOM 1814 CA GLN A 118 -9.833 7.840 1.744 1.00 0.00 C ATOM 1815 C GLN A 118 -10.492 9.187 2.076 1.00 0.00 C ATOM 1816 O GLN A 118 -10.932 9.410 3.187 1.00 0.00 O ATOM 1817 CB GLN A 118 -8.324 8.007 1.541 1.00 0.00 C ATOM 1818 CG GLN A 118 -7.718 8.823 2.686 1.00 0.00 C ATOM 1819 CD GLN A 118 -6.455 9.527 2.189 1.00 0.00 C ATOM 1820 OE1 GLN A 118 -5.390 9.355 2.747 1.00 0.00 O ATOM 1821 NE2 GLN A 118 -6.530 10.318 1.152 1.00 0.00 N ATOM 0 H GLN A 118 -9.672 7.409 -0.340 1.00 0.00 H new ATOM 0 HA GLN A 118 -10.073 7.179 2.576 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -7.847 7.028 1.491 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -8.131 8.504 0.590 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -8.439 9.556 3.047 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -7.479 8.171 3.526 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -7.425 10.462 0.684 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -5.694 10.792 0.810 1.00 0.00 H new ATOM 1830 N ILE A 119 -10.542 10.094 1.139 1.00 0.00 N ATOM 1831 CA ILE A 119 -11.151 11.428 1.428 1.00 0.00 C ATOM 1832 C ILE A 119 -12.680 11.371 1.367 1.00 0.00 C ATOM 1833 O ILE A 119 -13.357 12.042 2.121 1.00 0.00 O ATOM 1834 CB ILE A 119 -10.611 12.352 0.340 1.00 0.00 C ATOM 1835 CG1 ILE A 119 -11.075 13.786 0.624 1.00 0.00 C ATOM 1836 CG2 ILE A 119 -11.142 11.893 -1.022 1.00 0.00 C ATOM 1837 CD1 ILE A 119 -10.935 14.637 -0.637 1.00 0.00 C ATOM 0 H ILE A 119 -10.190 9.972 0.189 1.00 0.00 H new ATOM 0 HA ILE A 119 -10.899 11.772 2.431 1.00 0.00 H new ATOM 0 HB ILE A 119 -9.522 12.319 0.330 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -12.113 13.782 0.957 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -10.482 14.216 1.431 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -10.759 12.550 -1.802 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -10.814 10.871 -1.215 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -12.231 11.930 -1.019 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -11.266 15.654 -0.428 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -9.891 14.653 -0.951 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -11.547 14.212 -1.432 1.00 0.00 H new ATOM 1849 N SER A 120 -13.230 10.589 0.474 1.00 0.00 N ATOM 1850 CA SER A 120 -14.720 10.503 0.366 1.00 0.00 C ATOM 1851 C SER A 120 -15.354 10.534 1.759 1.00 0.00 C ATOM 1852 O SER A 120 -15.212 9.612 2.538 1.00 0.00 O ATOM 1853 CB SER A 120 -14.999 9.166 -0.321 1.00 0.00 C ATOM 1854 OG SER A 120 -13.779 8.458 -0.499 1.00 0.00 O ATOM 0 H SER A 120 -12.714 10.006 -0.185 1.00 0.00 H new ATOM 0 HA SER A 120 -15.139 11.339 -0.193 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.690 8.574 0.279 1.00 0.00 H new ATOM 0 HB3 SER A 120 -15.478 9.334 -1.286 1.00 0.00 H new ATOM 0 HG SER A 120 -13.348 8.753 -1.328 1.00 0.00 H new ATOM 1860 N LYS A 121 -16.043 11.593 2.083 1.00 0.00 N ATOM 1861 CA LYS A 121 -16.674 11.685 3.429 1.00 0.00 C ATOM 1862 C LYS A 121 -17.743 12.782 3.446 1.00 0.00 C ATOM 1863 O LYS A 121 -17.595 13.790 4.104 1.00 0.00 O ATOM 1864 CB LYS A 121 -15.525 12.044 4.374 1.00 0.00 C ATOM 1865 CG LYS A 121 -15.323 10.907 5.377 1.00 0.00 C ATOM 1866 CD LYS A 121 -14.088 11.193 6.236 1.00 0.00 C ATOM 1867 CE LYS A 121 -14.480 12.085 7.420 1.00 0.00 C ATOM 1868 NZ LYS A 121 -13.703 11.558 8.577 1.00 0.00 N ATOM 0 H LYS A 121 -16.196 12.397 1.475 1.00 0.00 H new ATOM 0 HA LYS A 121 -17.171 10.758 3.716 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -14.610 12.210 3.806 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.747 12.973 4.899 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -16.204 10.807 6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -15.201 9.961 4.850 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -13.660 10.258 6.598 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -13.321 11.684 5.636 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -14.236 13.129 7.224 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -15.552 12.038 7.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -13.920 12.119 9.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -13.961 10.564 8.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -12.686 11.622 8.370 1.00 0.00 H new ATOM 1882 N GLU A 122 -18.808 12.594 2.711 1.00 0.00 N ATOM 1883 CA GLU A 122 -19.893 13.618 2.658 1.00 0.00 C ATOM 1884 C GLU A 122 -19.276 15.002 2.520 1.00 0.00 C ATOM 1885 O GLU A 122 -19.752 15.967 3.086 1.00 0.00 O ATOM 1886 CB GLU A 122 -20.678 13.478 3.973 1.00 0.00 C ATOM 1887 CG GLU A 122 -19.893 14.081 5.144 1.00 0.00 C ATOM 1888 CD GLU A 122 -20.870 14.665 6.166 1.00 0.00 C ATOM 1889 OE1 GLU A 122 -21.917 15.135 5.754 1.00 0.00 O ATOM 1890 OE2 GLU A 122 -20.551 14.636 7.343 1.00 0.00 O ATOM 0 H GLU A 122 -18.974 11.766 2.139 1.00 0.00 H new ATOM 0 HA GLU A 122 -20.556 13.477 1.805 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -21.642 13.977 3.881 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -20.882 12.425 4.170 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -19.274 13.316 5.613 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -19.220 14.859 4.783 1.00 0.00 H new ATOM 1897 N VAL A 123 -18.208 15.088 1.776 1.00 0.00 N ATOM 1898 CA VAL A 123 -17.516 16.391 1.581 1.00 0.00 C ATOM 1899 C VAL A 123 -18.519 17.551 1.566 1.00 0.00 C ATOM 1900 O VAL A 123 -19.125 17.771 0.531 1.00 0.00 O ATOM 1901 CB VAL A 123 -16.822 16.269 0.224 1.00 0.00 C ATOM 1902 CG1 VAL A 123 -15.771 15.160 0.285 1.00 0.00 C ATOM 1903 CG2 VAL A 123 -17.858 15.924 -0.850 1.00 0.00 C ATOM 0 H VAL A 123 -17.781 14.300 1.289 1.00 0.00 H new ATOM 0 HA VAL A 123 -16.815 16.601 2.389 1.00 0.00 H new ATOM 0 HB VAL A 123 -16.340 17.215 -0.022 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -15.277 15.074 -0.683 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -15.032 15.400 1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -16.254 14.214 0.532 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -17.364 15.837 -1.818 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.338 14.978 -0.601 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -18.610 16.712 -0.896 1.00 0.00 H new TER 1913 VAL A 123 HETATM 1914 CA CA A 201 0.865 -10.760 -9.538 1.00 0.00 CA HETATM 1915 BE BEF A 202 -0.739 -8.592 -7.412 1.00 0.00 BE HETATM 1916 F1 BEF A 202 -0.706 -8.339 -8.883 1.00 0.00 F HETATM 1917 F2 BEF A 202 -1.282 -10.024 -8.379 1.00 0.00 F HETATM 1918 F3 BEF A 202 0.075 -9.643 -7.097 1.00 0.00 F