USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 828 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 31 CYS SG : rot 171:sc= -6.06! USER MOD Set 1.2: A 52 SER OG : rot 180:sc= 0.086 USER MOD Set 1.3: A 54 SER OG : rot -136:sc= 0.224 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 54:sc= 0.0794 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -54:sc=0.000701 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc=-0.00515 X(o=-0.0051,f=-0.053) USER MOD Single : A 14 ASN : amide:sc= -0.214 K(o=-0.21,f=-2.3!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= -2.74! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.116 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 170:sc= -0.993 USER MOD Single : A 47 HIS : no HD1:sc= -1.1 K(o=-1.1,f=-2.8!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -0.735 K(o=-0.73,f=-3.2!) USER MOD Single : A 69 ASN : amide:sc= -6.82! C(o=-6.8!,f=-7.5!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc=-0.00174 X(o=-0.0017,f=0) USER MOD Single : A 78 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-2.8!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.353 K(o=-0.35,f=-2.9!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0.00398 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 71:sc= -1.13 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0749 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.601 -13.383 -33.118 1.00 0.00 N ATOM 2 CA GLY A 1 -11.715 -13.068 -34.226 1.00 0.00 C ATOM 3 C GLY A 1 -10.337 -12.637 -33.720 1.00 0.00 C ATOM 4 O GLY A 1 -10.146 -11.485 -33.334 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.529 -13.673 -33.487 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.194 -14.159 -32.558 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.715 -12.543 -32.515 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.613 -13.939 -34.873 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.150 -12.272 -34.829 1.00 0.00 H new ATOM 8 N SER A 2 -9.412 -13.586 -33.737 1.00 0.00 N ATOM 9 CA SER A 2 -8.057 -13.319 -33.285 1.00 0.00 C ATOM 10 C SER A 2 -7.262 -12.629 -34.395 1.00 0.00 C ATOM 11 O SER A 2 -6.783 -13.284 -35.320 1.00 0.00 O ATOM 12 CB SER A 2 -7.357 -14.608 -32.852 1.00 0.00 C ATOM 13 OG SER A 2 -6.422 -14.381 -31.802 1.00 0.00 O ATOM 0 H SER A 2 -9.574 -14.541 -34.057 1.00 0.00 H new ATOM 0 HA SER A 2 -8.109 -12.658 -32.420 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.102 -15.332 -32.523 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.842 -15.046 -33.707 1.00 0.00 H new ATOM 0 HG SER A 2 -5.998 -15.229 -31.553 1.00 0.00 H new ATOM 19 N SER A 3 -7.145 -11.316 -34.267 1.00 0.00 N ATOM 20 CA SER A 3 -6.415 -10.530 -35.248 1.00 0.00 C ATOM 21 C SER A 3 -6.197 -9.110 -34.723 1.00 0.00 C ATOM 22 O SER A 3 -5.059 -8.658 -34.599 1.00 0.00 O ATOM 23 CB SER A 3 -7.156 -10.494 -36.586 1.00 0.00 C ATOM 24 OG SER A 3 -6.505 -11.282 -37.578 1.00 0.00 O ATOM 0 H SER A 3 -7.543 -10.776 -33.499 1.00 0.00 H new ATOM 0 HA SER A 3 -5.446 -11.002 -35.413 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.175 -10.856 -36.446 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.229 -9.463 -36.932 1.00 0.00 H new ATOM 0 HG SER A 3 -6.371 -12.191 -37.237 1.00 0.00 H new ATOM 30 N GLY A 4 -7.304 -8.445 -34.428 1.00 0.00 N ATOM 31 CA GLY A 4 -7.249 -7.085 -33.920 1.00 0.00 C ATOM 32 C GLY A 4 -6.277 -6.233 -34.739 1.00 0.00 C ATOM 33 O GLY A 4 -5.143 -6.003 -34.321 1.00 0.00 O ATOM 0 H GLY A 4 -8.246 -8.823 -34.531 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.244 -6.640 -33.952 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.938 -7.095 -32.875 1.00 0.00 H new ATOM 37 N SER A 5 -6.757 -5.788 -35.890 1.00 0.00 N ATOM 38 CA SER A 5 -5.945 -4.966 -36.772 1.00 0.00 C ATOM 39 C SER A 5 -6.588 -3.588 -36.942 1.00 0.00 C ATOM 40 O SER A 5 -7.295 -3.345 -37.919 1.00 0.00 O ATOM 41 CB SER A 5 -5.759 -5.637 -38.134 1.00 0.00 C ATOM 42 OG SER A 5 -5.123 -4.773 -39.072 1.00 0.00 O ATOM 0 H SER A 5 -7.698 -5.981 -36.233 1.00 0.00 H new ATOM 0 HA SER A 5 -4.961 -4.847 -36.319 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.164 -6.542 -38.014 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.730 -5.943 -38.523 1.00 0.00 H new ATOM 0 HG SER A 5 -5.021 -5.238 -39.928 1.00 0.00 H new ATOM 48 N SER A 6 -6.319 -2.721 -35.976 1.00 0.00 N ATOM 49 CA SER A 6 -6.863 -1.374 -36.007 1.00 0.00 C ATOM 50 C SER A 6 -5.762 -0.374 -36.366 1.00 0.00 C ATOM 51 O SER A 6 -5.812 0.784 -35.954 1.00 0.00 O ATOM 52 CB SER A 6 -7.498 -1.006 -34.665 1.00 0.00 C ATOM 53 OG SER A 6 -8.490 0.008 -34.804 1.00 0.00 O ATOM 0 H SER A 6 -5.732 -2.925 -35.168 1.00 0.00 H new ATOM 0 HA SER A 6 -7.642 -1.336 -36.769 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.947 -1.894 -34.221 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.723 -0.664 -33.979 1.00 0.00 H new ATOM 0 HG SER A 6 -8.106 0.779 -35.272 1.00 0.00 H new ATOM 59 N GLY A 7 -4.794 -0.857 -37.130 1.00 0.00 N ATOM 60 CA GLY A 7 -3.682 -0.020 -37.549 1.00 0.00 C ATOM 61 C GLY A 7 -2.344 -0.648 -37.156 1.00 0.00 C ATOM 62 O GLY A 7 -1.617 -1.155 -38.009 1.00 0.00 O ATOM 0 H GLY A 7 -4.756 -1.818 -37.470 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.717 0.123 -38.629 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.773 0.966 -37.093 1.00 0.00 H new ATOM 66 N SER A 8 -2.058 -0.594 -35.863 1.00 0.00 N ATOM 67 CA SER A 8 -0.820 -1.152 -35.347 1.00 0.00 C ATOM 68 C SER A 8 -1.117 -2.095 -34.179 1.00 0.00 C ATOM 69 O SER A 8 -2.120 -1.932 -33.486 1.00 0.00 O ATOM 70 CB SER A 8 0.140 -0.045 -34.904 1.00 0.00 C ATOM 71 OG SER A 8 0.344 0.925 -35.927 1.00 0.00 O ATOM 0 H SER A 8 -2.663 -0.172 -35.158 1.00 0.00 H new ATOM 0 HA SER A 8 -0.339 -1.715 -36.147 1.00 0.00 H new ATOM 0 HB2 SER A 8 -0.257 0.444 -34.014 1.00 0.00 H new ATOM 0 HB3 SER A 8 1.097 -0.485 -34.626 1.00 0.00 H new ATOM 0 HG SER A 8 0.961 1.615 -35.605 1.00 0.00 H new ATOM 77 N PRO A 9 -0.204 -3.085 -33.993 1.00 0.00 N ATOM 78 CA PRO A 9 -0.358 -4.054 -32.921 1.00 0.00 C ATOM 79 C PRO A 9 -0.012 -3.433 -31.567 1.00 0.00 C ATOM 80 O PRO A 9 1.063 -2.859 -31.399 1.00 0.00 O ATOM 81 CB PRO A 9 0.558 -5.206 -33.298 1.00 0.00 C ATOM 82 CG PRO A 9 1.537 -4.645 -34.317 1.00 0.00 C ATOM 83 CD PRO A 9 0.996 -3.307 -34.795 1.00 0.00 C ATOM 0 HA PRO A 9 -1.386 -4.400 -32.811 1.00 0.00 H new ATOM 0 HB2 PRO A 9 1.082 -5.590 -32.423 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.011 -6.035 -33.718 1.00 0.00 H new ATOM 0 HG2 PRO A 9 2.523 -4.520 -33.870 1.00 0.00 H new ATOM 0 HG3 PRO A 9 1.651 -5.332 -35.155 1.00 0.00 H new ATOM 0 HD2 PRO A 9 1.724 -2.510 -34.647 1.00 0.00 H new ATOM 0 HD3 PRO A 9 0.762 -3.332 -35.859 1.00 0.00 H new ATOM 91 N GLY A 10 -0.944 -3.569 -30.634 1.00 0.00 N ATOM 92 CA GLY A 10 -0.751 -3.028 -29.299 1.00 0.00 C ATOM 93 C GLY A 10 -2.093 -2.695 -28.644 1.00 0.00 C ATOM 94 O GLY A 10 -2.611 -1.592 -28.807 1.00 0.00 O ATOM 0 H GLY A 10 -1.834 -4.046 -30.776 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.211 -3.749 -28.685 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.135 -2.130 -29.352 1.00 0.00 H new ATOM 98 N ASN A 11 -2.617 -3.670 -27.915 1.00 0.00 N ATOM 99 CA ASN A 11 -3.888 -3.495 -27.234 1.00 0.00 C ATOM 100 C ASN A 11 -3.978 -4.482 -26.069 1.00 0.00 C ATOM 101 O ASN A 11 -4.109 -5.686 -26.280 1.00 0.00 O ATOM 102 CB ASN A 11 -5.061 -3.769 -28.177 1.00 0.00 C ATOM 103 CG ASN A 11 -6.286 -2.939 -27.785 1.00 0.00 C ATOM 104 OD1 ASN A 11 -6.849 -3.085 -26.713 1.00 0.00 O ATOM 105 ND2 ASN A 11 -6.665 -2.064 -28.712 1.00 0.00 N ATOM 0 H ASN A 11 -2.184 -4.584 -27.781 1.00 0.00 H new ATOM 0 HA ASN A 11 -3.942 -2.465 -26.881 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -4.771 -3.535 -29.201 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -5.313 -4.829 -28.152 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.473 -1.463 -28.546 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -6.148 -1.994 -29.588 1.00 0.00 H new ATOM 112 N ARG A 12 -3.905 -3.934 -24.864 1.00 0.00 N ATOM 113 CA ARG A 12 -3.976 -4.752 -23.665 1.00 0.00 C ATOM 114 C ARG A 12 -3.965 -3.866 -22.418 1.00 0.00 C ATOM 115 O ARG A 12 -2.940 -3.278 -22.079 1.00 0.00 O ATOM 116 CB ARG A 12 -2.804 -5.732 -23.596 1.00 0.00 C ATOM 117 CG ARG A 12 -3.013 -6.760 -22.482 1.00 0.00 C ATOM 118 CD ARG A 12 -1.681 -7.145 -21.835 1.00 0.00 C ATOM 119 NE ARG A 12 -1.387 -8.573 -22.094 1.00 0.00 N ATOM 120 CZ ARG A 12 -0.808 -9.029 -23.212 1.00 0.00 C ATOM 121 NH1 ARG A 12 -0.457 -8.174 -24.182 1.00 0.00 N ATOM 122 NH2 ARG A 12 -0.579 -10.341 -23.361 1.00 0.00 N ATOM 0 H ARG A 12 -3.797 -2.934 -24.693 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.906 -5.319 -23.705 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -2.697 -6.244 -24.552 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -1.878 -5.185 -23.422 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -3.684 -6.351 -21.726 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -3.495 -7.649 -22.888 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -0.880 -6.522 -22.233 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -1.723 -6.963 -20.761 1.00 0.00 H new ATOM 0 HE ARG A 12 -1.641 -9.252 -21.376 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.631 -7.175 -24.069 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.016 -8.522 -25.033 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.846 -10.992 -22.623 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.138 -10.688 -24.213 1.00 0.00 H new ATOM 136 N GLU A 13 -5.118 -3.800 -21.768 1.00 0.00 N ATOM 137 CA GLU A 13 -5.254 -2.996 -20.565 1.00 0.00 C ATOM 138 C GLU A 13 -6.626 -3.223 -19.927 1.00 0.00 C ATOM 139 O GLU A 13 -7.654 -3.036 -20.575 1.00 0.00 O ATOM 140 CB GLU A 13 -5.029 -1.513 -20.868 1.00 0.00 C ATOM 141 CG GLU A 13 -5.195 -0.664 -19.606 1.00 0.00 C ATOM 142 CD GLU A 13 -4.831 0.797 -19.877 1.00 0.00 C ATOM 143 OE1 GLU A 13 -5.530 1.411 -20.712 1.00 0.00 O ATOM 144 OE2 GLU A 13 -3.863 1.268 -19.242 1.00 0.00 O ATOM 0 H GLU A 13 -5.966 -4.290 -22.052 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.488 -3.308 -19.855 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.029 -1.370 -21.278 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -5.736 -1.182 -21.629 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -6.225 -0.727 -19.254 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.562 -1.059 -18.812 1.00 0.00 H new ATOM 151 N ASN A 14 -6.597 -3.623 -18.664 1.00 0.00 N ATOM 152 CA ASN A 14 -7.825 -3.877 -17.931 1.00 0.00 C ATOM 153 C ASN A 14 -7.483 -4.291 -16.498 1.00 0.00 C ATOM 154 O ASN A 14 -7.858 -3.610 -15.545 1.00 0.00 O ATOM 155 CB ASN A 14 -8.624 -5.013 -18.573 1.00 0.00 C ATOM 156 CG ASN A 14 -10.110 -4.658 -18.659 1.00 0.00 C ATOM 157 OD1 ASN A 14 -10.569 -3.664 -18.123 1.00 0.00 O ATOM 158 ND2 ASN A 14 -10.833 -5.525 -19.363 1.00 0.00 N ATOM 0 H ASN A 14 -5.742 -3.777 -18.130 1.00 0.00 H new ATOM 0 HA ASN A 14 -8.420 -2.964 -17.944 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.237 -5.216 -19.571 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.498 -5.926 -17.991 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.835 -5.377 -19.480 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -10.385 -6.338 -19.786 1.00 0.00 H new ATOM 165 N LYS A 15 -6.774 -5.405 -16.391 1.00 0.00 N ATOM 166 CA LYS A 15 -6.377 -5.918 -15.091 1.00 0.00 C ATOM 167 C LYS A 15 -4.930 -5.509 -14.807 1.00 0.00 C ATOM 168 O LYS A 15 -4.243 -4.992 -15.687 1.00 0.00 O ATOM 169 CB LYS A 15 -6.616 -7.427 -15.014 1.00 0.00 C ATOM 170 CG LYS A 15 -8.095 -7.736 -14.773 1.00 0.00 C ATOM 171 CD LYS A 15 -8.847 -7.888 -16.097 1.00 0.00 C ATOM 172 CE LYS A 15 -9.833 -9.056 -16.037 1.00 0.00 C ATOM 173 NZ LYS A 15 -9.214 -10.285 -16.582 1.00 0.00 N ATOM 0 H LYS A 15 -6.464 -5.967 -17.184 1.00 0.00 H new ATOM 0 HA LYS A 15 -6.993 -5.481 -14.305 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.289 -7.898 -15.941 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -6.016 -7.853 -14.210 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -8.188 -8.653 -14.191 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -8.546 -6.937 -14.184 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -9.383 -6.966 -16.323 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -8.136 -8.049 -16.907 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -10.144 -9.225 -15.006 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -10.731 -8.811 -16.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.897 -11.068 -16.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -8.939 -10.126 -17.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -8.371 -10.526 -16.023 1.00 0.00 H new ATOM 187 N GLU A 16 -4.510 -5.757 -13.575 1.00 0.00 N ATOM 188 CA GLU A 16 -3.157 -5.421 -13.164 1.00 0.00 C ATOM 189 C GLU A 16 -2.799 -4.006 -13.623 1.00 0.00 C ATOM 190 O GLU A 16 -2.297 -3.818 -14.730 1.00 0.00 O ATOM 191 CB GLU A 16 -2.152 -6.443 -13.700 1.00 0.00 C ATOM 192 CG GLU A 16 -2.101 -7.683 -12.805 1.00 0.00 C ATOM 193 CD GLU A 16 -1.472 -8.866 -13.543 1.00 0.00 C ATOM 194 OE1 GLU A 16 -2.192 -9.468 -14.369 1.00 0.00 O ATOM 195 OE2 GLU A 16 -0.285 -9.142 -13.266 1.00 0.00 O ATOM 0 H GLU A 16 -5.082 -6.186 -12.848 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.110 -5.451 -12.075 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.428 -6.733 -14.714 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.162 -5.990 -13.757 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.526 -7.463 -11.906 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.109 -7.945 -12.483 1.00 0.00 H new ATOM 202 N LYS A 17 -3.069 -3.049 -12.749 1.00 0.00 N ATOM 203 CA LYS A 17 -2.781 -1.657 -13.050 1.00 0.00 C ATOM 204 C LYS A 17 -1.657 -1.164 -12.137 1.00 0.00 C ATOM 205 O LYS A 17 -1.458 -1.698 -11.047 1.00 0.00 O ATOM 206 CB LYS A 17 -4.056 -0.815 -12.965 1.00 0.00 C ATOM 207 CG LYS A 17 -4.461 -0.579 -11.509 1.00 0.00 C ATOM 208 CD LYS A 17 -5.483 0.555 -11.401 1.00 0.00 C ATOM 209 CE LYS A 17 -6.908 0.002 -11.321 1.00 0.00 C ATOM 210 NZ LYS A 17 -7.821 0.801 -12.169 1.00 0.00 N ATOM 0 H LYS A 17 -3.484 -3.210 -11.831 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.427 -1.555 -14.076 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.898 0.142 -13.462 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -4.865 -1.319 -13.494 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.882 -1.494 -11.092 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.579 -0.336 -10.917 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.272 1.157 -10.517 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.393 1.214 -12.264 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.919 -1.039 -11.644 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.254 0.019 -10.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.784 0.413 -12.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.823 1.788 -11.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.499 0.764 -13.157 1.00 0.00 H new ATOM 224 N LYS A 18 -0.951 -0.150 -12.616 1.00 0.00 N ATOM 225 CA LYS A 18 0.149 0.421 -11.857 1.00 0.00 C ATOM 226 C LYS A 18 -0.286 1.766 -11.272 1.00 0.00 C ATOM 227 O LYS A 18 -0.619 2.691 -12.011 1.00 0.00 O ATOM 228 CB LYS A 18 1.410 0.505 -12.719 1.00 0.00 C ATOM 229 CG LYS A 18 2.565 1.137 -11.941 1.00 0.00 C ATOM 230 CD LYS A 18 3.115 2.362 -12.676 1.00 0.00 C ATOM 231 CE LYS A 18 4.439 2.036 -13.370 1.00 0.00 C ATOM 232 NZ LYS A 18 4.633 2.907 -14.551 1.00 0.00 N ATOM 0 H LYS A 18 -1.119 0.291 -13.520 1.00 0.00 H new ATOM 0 HA LYS A 18 0.408 -0.225 -11.018 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.694 -0.493 -13.052 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.205 1.093 -13.614 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.223 1.427 -10.948 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.360 0.404 -11.803 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.389 2.705 -13.413 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.262 3.179 -11.969 1.00 0.00 H new ATOM 0 HE2 LYS A 18 5.265 2.171 -12.672 1.00 0.00 H new ATOM 0 HE3 LYS A 18 4.448 0.990 -13.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.536 2.673 -15.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.854 2.759 -15.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.646 3.902 -14.250 1.00 0.00 H new ATOM 246 N VAL A 19 -0.269 1.833 -9.948 1.00 0.00 N ATOM 247 CA VAL A 19 -0.658 3.050 -9.255 1.00 0.00 C ATOM 248 C VAL A 19 0.518 3.549 -8.413 1.00 0.00 C ATOM 249 O VAL A 19 1.047 2.813 -7.581 1.00 0.00 O ATOM 250 CB VAL A 19 -1.922 2.801 -8.430 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.178 3.123 -9.242 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.961 1.364 -7.906 1.00 0.00 C ATOM 0 H VAL A 19 0.008 1.064 -9.337 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.903 3.836 -9.970 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.898 3.470 -7.570 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -4.063 2.938 -8.633 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.158 4.170 -9.543 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.210 2.491 -10.129 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.870 1.214 -7.323 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.950 0.670 -8.746 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -1.091 1.183 -7.275 1.00 0.00 H new ATOM 262 N PHE A 20 0.892 4.796 -8.656 1.00 0.00 N ATOM 263 CA PHE A 20 1.994 5.402 -7.930 1.00 0.00 C ATOM 264 C PHE A 20 1.481 6.335 -6.831 1.00 0.00 C ATOM 265 O PHE A 20 0.900 7.380 -7.120 1.00 0.00 O ATOM 266 CB PHE A 20 2.800 6.221 -8.941 1.00 0.00 C ATOM 267 CG PHE A 20 4.316 6.082 -8.787 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.891 6.230 -7.563 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.088 5.813 -9.874 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.298 6.101 -7.420 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.495 5.685 -9.730 1.00 0.00 C ATOM 272 CZ PHE A 20 7.070 5.832 -8.507 1.00 0.00 C ATOM 0 H PHE A 20 0.451 5.404 -9.346 1.00 0.00 H new ATOM 0 HA PHE A 20 2.599 4.627 -7.459 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.518 5.915 -9.948 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.530 7.272 -8.840 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.278 6.445 -6.700 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.631 5.697 -10.846 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.755 6.216 -6.448 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.109 5.471 -10.593 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.140 5.735 -8.398 1.00 0.00 H new ATOM 282 N ILE A 21 1.713 5.923 -5.594 1.00 0.00 N ATOM 283 CA ILE A 21 1.282 6.708 -4.450 1.00 0.00 C ATOM 284 C ILE A 21 2.466 7.515 -3.914 1.00 0.00 C ATOM 285 O ILE A 21 3.492 6.947 -3.543 1.00 0.00 O ATOM 286 CB ILE A 21 0.625 5.809 -3.400 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.719 5.275 -3.899 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.491 6.538 -2.061 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.766 6.389 -3.953 1.00 0.00 C ATOM 0 H ILE A 21 2.194 5.055 -5.358 1.00 0.00 H new ATOM 0 HA ILE A 21 0.516 7.425 -4.747 1.00 0.00 H new ATOM 0 HB ILE A 21 1.272 4.948 -3.234 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.596 4.839 -4.890 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.065 4.478 -3.241 1.00 0.00 H new ATOM 0 HG21 ILE A 21 0.021 5.877 -1.332 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.479 6.828 -1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.123 7.429 -2.192 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.712 5.982 -4.311 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.905 6.807 -2.956 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.428 7.173 -4.631 1.00 0.00 H new ATOM 301 N SER A 22 2.285 8.828 -3.892 1.00 0.00 N ATOM 302 CA SER A 22 3.326 9.719 -3.408 1.00 0.00 C ATOM 303 C SER A 22 2.897 10.354 -2.084 1.00 0.00 C ATOM 304 O SER A 22 1.732 10.711 -1.911 1.00 0.00 O ATOM 305 CB SER A 22 3.645 10.804 -4.439 1.00 0.00 C ATOM 306 OG SER A 22 4.416 11.863 -3.877 1.00 0.00 O ATOM 0 H SER A 22 1.433 9.296 -4.202 1.00 0.00 H new ATOM 0 HA SER A 22 4.231 9.133 -3.246 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.189 10.362 -5.274 1.00 0.00 H new ATOM 0 HB3 SER A 22 2.715 11.206 -4.842 1.00 0.00 H new ATOM 0 HG SER A 22 4.601 12.535 -4.566 1.00 0.00 H new ATOM 312 N LEU A 23 3.861 10.476 -1.183 1.00 0.00 N ATOM 313 CA LEU A 23 3.597 11.062 0.120 1.00 0.00 C ATOM 314 C LEU A 23 4.348 12.390 0.238 1.00 0.00 C ATOM 315 O LEU A 23 5.070 12.614 1.209 1.00 0.00 O ATOM 316 CB LEU A 23 3.931 10.066 1.233 1.00 0.00 C ATOM 317 CG LEU A 23 2.884 8.982 1.499 1.00 0.00 C ATOM 318 CD1 LEU A 23 1.541 9.602 1.891 1.00 0.00 C ATOM 319 CD2 LEU A 23 2.752 8.041 0.300 1.00 0.00 C ATOM 0 H LEU A 23 4.826 10.179 -1.330 1.00 0.00 H new ATOM 0 HA LEU A 23 2.536 11.284 0.230 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.875 9.579 0.987 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.091 10.623 2.156 1.00 0.00 H new ATOM 0 HG LEU A 23 3.221 8.382 2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.815 8.810 2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.665 10.197 2.796 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.185 10.241 1.082 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.002 7.280 0.515 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.449 8.611 -0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.711 7.560 0.107 1.00 0.00 H new ATOM 331 N VAL A 24 4.152 13.235 -0.763 1.00 0.00 N ATOM 332 CA VAL A 24 4.801 14.534 -0.783 1.00 0.00 C ATOM 333 C VAL A 24 3.759 15.625 -0.526 1.00 0.00 C ATOM 334 O VAL A 24 2.581 15.447 -0.833 1.00 0.00 O ATOM 335 CB VAL A 24 5.551 14.724 -2.104 1.00 0.00 C ATOM 336 CG1 VAL A 24 6.363 13.476 -2.457 1.00 0.00 C ATOM 337 CG2 VAL A 24 4.587 15.090 -3.234 1.00 0.00 C ATOM 0 H VAL A 24 3.553 13.045 -1.566 1.00 0.00 H new ATOM 0 HA VAL A 24 5.545 14.601 0.011 1.00 0.00 H new ATOM 0 HB VAL A 24 6.248 15.552 -1.978 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.886 13.637 -3.400 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.089 13.279 -1.668 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.693 12.622 -2.555 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.145 15.219 -4.161 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.854 14.293 -3.360 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.073 16.019 -2.987 1.00 0.00 H new ATOM 347 N GLY A 25 4.231 16.728 0.036 1.00 0.00 N ATOM 348 CA GLY A 25 3.354 17.847 0.339 1.00 0.00 C ATOM 349 C GLY A 25 2.395 17.499 1.479 1.00 0.00 C ATOM 350 O GLY A 25 2.575 16.492 2.161 1.00 0.00 O ATOM 0 H GLY A 25 5.209 16.871 0.289 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.950 18.717 0.614 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.785 18.118 -0.550 1.00 0.00 H new ATOM 354 N SER A 26 1.396 18.353 1.650 1.00 0.00 N ATOM 355 CA SER A 26 0.408 18.148 2.696 1.00 0.00 C ATOM 356 C SER A 26 -0.595 17.076 2.266 1.00 0.00 C ATOM 357 O SER A 26 -1.786 17.352 2.133 1.00 0.00 O ATOM 358 CB SER A 26 -0.320 19.452 3.028 1.00 0.00 C ATOM 359 OG SER A 26 -0.978 19.389 4.291 1.00 0.00 O ATOM 0 H SER A 26 1.250 19.188 1.082 1.00 0.00 H new ATOM 0 HA SER A 26 0.926 17.813 3.595 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.394 20.275 3.032 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.051 19.668 2.249 1.00 0.00 H new ATOM 0 HG SER A 26 -1.430 20.241 4.467 1.00 0.00 H new ATOM 365 N ARG A 27 -0.076 15.874 2.060 1.00 0.00 N ATOM 366 CA ARG A 27 -0.911 14.759 1.648 1.00 0.00 C ATOM 367 C ARG A 27 -0.526 13.494 2.419 1.00 0.00 C ATOM 368 O ARG A 27 0.656 13.200 2.584 1.00 0.00 O ATOM 369 CB ARG A 27 -0.775 14.494 0.147 1.00 0.00 C ATOM 370 CG ARG A 27 -1.947 15.104 -0.625 1.00 0.00 C ATOM 371 CD ARG A 27 -1.799 14.859 -2.128 1.00 0.00 C ATOM 372 NE ARG A 27 -2.395 15.983 -2.885 1.00 0.00 N ATOM 373 CZ ARG A 27 -2.654 15.949 -4.199 1.00 0.00 C ATOM 374 NH1 ARG A 27 -2.370 14.850 -4.911 1.00 0.00 N ATOM 375 NH2 ARG A 27 -3.197 17.016 -4.803 1.00 0.00 N ATOM 0 H ARG A 27 0.913 15.648 2.171 1.00 0.00 H new ATOM 0 HA ARG A 27 -1.946 15.021 1.867 1.00 0.00 H new ATOM 0 HB2 ARG A 27 0.163 14.914 -0.217 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.735 13.420 -0.034 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.884 14.672 -0.273 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -1.997 16.175 -0.431 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -0.745 14.754 -2.386 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -2.289 13.925 -2.403 1.00 0.00 H new ATOM 0 HE ARG A 27 -2.623 16.836 -2.374 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -1.956 14.038 -4.453 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -2.568 14.825 -5.911 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -3.413 17.853 -4.262 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -3.394 16.990 -5.803 1.00 0.00 H new ATOM 389 N GLY A 28 -1.548 12.781 2.870 1.00 0.00 N ATOM 390 CA GLY A 28 -1.331 11.555 3.619 1.00 0.00 C ATOM 391 C GLY A 28 -2.351 10.484 3.225 1.00 0.00 C ATOM 392 O GLY A 28 -3.549 10.754 3.169 1.00 0.00 O ATOM 0 H GLY A 28 -2.528 13.029 2.731 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.322 11.186 3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -1.407 11.759 4.687 1.00 0.00 H new ATOM 396 N LEU A 29 -1.837 9.291 2.963 1.00 0.00 N ATOM 397 CA LEU A 29 -2.688 8.179 2.576 1.00 0.00 C ATOM 398 C LEU A 29 -3.964 8.201 3.420 1.00 0.00 C ATOM 399 O LEU A 29 -3.900 8.263 4.646 1.00 0.00 O ATOM 400 CB LEU A 29 -1.917 6.860 2.660 1.00 0.00 C ATOM 401 CG LEU A 29 -2.621 5.633 2.078 1.00 0.00 C ATOM 402 CD1 LEU A 29 -2.102 5.318 0.674 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.498 4.432 3.018 1.00 0.00 C ATOM 0 H LEU A 29 -0.842 9.071 3.011 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.993 8.277 1.534 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.964 6.986 2.145 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.690 6.661 3.707 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.683 5.861 1.985 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.619 4.441 0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.285 6.170 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.031 5.118 0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.007 3.574 2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.445 4.193 3.166 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.954 4.673 3.978 1.00 0.00 H new ATOM 415 N GLY A 30 -5.093 8.148 2.729 1.00 0.00 N ATOM 416 CA GLY A 30 -6.382 8.161 3.399 1.00 0.00 C ATOM 417 C GLY A 30 -7.166 6.881 3.105 1.00 0.00 C ATOM 418 O GLY A 30 -8.396 6.886 3.114 1.00 0.00 O ATOM 0 H GLY A 30 -5.142 8.096 1.711 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.236 8.263 4.474 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.957 9.027 3.072 1.00 0.00 H new ATOM 422 N CYS A 31 -6.422 5.814 2.853 1.00 0.00 N ATOM 423 CA CYS A 31 -7.032 4.529 2.557 1.00 0.00 C ATOM 424 C CYS A 31 -6.538 3.513 3.589 1.00 0.00 C ATOM 425 O CYS A 31 -5.406 3.604 4.061 1.00 0.00 O ATOM 426 CB CYS A 31 -6.735 4.078 1.125 1.00 0.00 C ATOM 427 SG CYS A 31 -4.931 3.872 0.895 1.00 0.00 S ATOM 0 H CYS A 31 -5.402 5.813 2.848 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.117 4.615 2.624 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.246 3.138 0.918 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.119 4.812 0.417 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.702 3.308 -0.254 1.00 0.00 H new ATOM 433 N SER A 32 -7.411 2.570 3.908 1.00 0.00 N ATOM 434 CA SER A 32 -7.077 1.538 4.876 1.00 0.00 C ATOM 435 C SER A 32 -6.953 0.184 4.175 1.00 0.00 C ATOM 436 O SER A 32 -7.724 -0.123 3.267 1.00 0.00 O ATOM 437 CB SER A 32 -8.126 1.466 5.987 1.00 0.00 C ATOM 438 OG SER A 32 -7.544 1.608 7.280 1.00 0.00 O ATOM 0 H SER A 32 -8.349 2.498 3.514 1.00 0.00 H new ATOM 0 HA SER A 32 -6.120 1.793 5.332 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.869 2.249 5.836 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.651 0.513 5.928 1.00 0.00 H new ATOM 0 HG SER A 32 -8.246 1.558 7.962 1.00 0.00 H new ATOM 444 N ILE A 33 -5.976 -0.591 4.623 1.00 0.00 N ATOM 445 CA ILE A 33 -5.740 -1.905 4.050 1.00 0.00 C ATOM 446 C ILE A 33 -6.145 -2.978 5.063 1.00 0.00 C ATOM 447 O ILE A 33 -5.981 -2.793 6.268 1.00 0.00 O ATOM 448 CB ILE A 33 -4.293 -2.028 3.569 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.311 -1.774 4.715 1.00 0.00 C ATOM 450 CG2 ILE A 33 -4.031 -1.108 2.375 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.971 -2.464 4.452 1.00 0.00 C ATOM 0 H ILE A 33 -5.339 -0.334 5.377 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.359 -2.052 3.165 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.133 -3.051 3.228 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.155 -0.702 4.834 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.735 -2.140 5.650 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.995 -1.215 2.053 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.696 -1.379 1.555 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.215 -0.074 2.665 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.292 -2.268 5.281 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.127 -3.539 4.358 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.538 -2.078 3.529 1.00 0.00 H new ATOM 463 N SER A 34 -6.667 -4.076 4.536 1.00 0.00 N ATOM 464 CA SER A 34 -7.097 -5.179 5.379 1.00 0.00 C ATOM 465 C SER A 34 -6.445 -6.481 4.910 1.00 0.00 C ATOM 466 O SER A 34 -6.115 -6.626 3.734 1.00 0.00 O ATOM 467 CB SER A 34 -8.621 -5.316 5.373 1.00 0.00 C ATOM 468 OG SER A 34 -9.256 -4.247 6.070 1.00 0.00 O ATOM 0 H SER A 34 -6.802 -4.225 3.536 1.00 0.00 H new ATOM 0 HA SER A 34 -6.782 -4.970 6.402 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.979 -5.341 4.344 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.902 -6.265 5.831 1.00 0.00 H new ATOM 0 HG SER A 34 -10.228 -4.370 6.042 1.00 0.00 H new ATOM 474 N SER A 35 -6.280 -7.396 5.854 1.00 0.00 N ATOM 475 CA SER A 35 -5.673 -8.681 5.552 1.00 0.00 C ATOM 476 C SER A 35 -6.708 -9.611 4.914 1.00 0.00 C ATOM 477 O SER A 35 -7.901 -9.503 5.193 1.00 0.00 O ATOM 478 CB SER A 35 -5.089 -9.324 6.812 1.00 0.00 C ATOM 479 OG SER A 35 -6.078 -10.021 7.564 1.00 0.00 O ATOM 0 H SER A 35 -6.556 -7.273 6.828 1.00 0.00 H new ATOM 0 HA SER A 35 -4.857 -8.517 4.848 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.294 -10.015 6.531 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.636 -8.553 7.436 1.00 0.00 H new ATOM 0 HG SER A 35 -5.665 -10.418 8.359 1.00 0.00 H new ATOM 485 N GLY A 36 -6.212 -10.502 4.068 1.00 0.00 N ATOM 486 CA GLY A 36 -7.079 -11.450 3.387 1.00 0.00 C ATOM 487 C GLY A 36 -6.982 -12.837 4.025 1.00 0.00 C ATOM 488 O GLY A 36 -6.041 -13.120 4.766 1.00 0.00 O ATOM 0 H GLY A 36 -5.222 -10.588 3.838 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.110 -11.099 3.427 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.803 -11.510 2.334 1.00 0.00 H new ATOM 492 N PRO A 37 -7.993 -13.689 3.705 1.00 0.00 N ATOM 493 CA PRO A 37 -8.030 -15.040 4.238 1.00 0.00 C ATOM 494 C PRO A 37 -7.008 -15.935 3.535 1.00 0.00 C ATOM 495 O PRO A 37 -6.170 -15.450 2.777 1.00 0.00 O ATOM 496 CB PRO A 37 -9.464 -15.503 4.036 1.00 0.00 C ATOM 497 CG PRO A 37 -10.056 -14.579 2.984 1.00 0.00 C ATOM 498 CD PRO A 37 -9.123 -13.389 2.831 1.00 0.00 C ATOM 0 HA PRO A 37 -7.756 -15.084 5.292 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.496 -16.541 3.706 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -10.028 -15.446 4.967 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.166 -15.103 2.034 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.051 -14.248 3.283 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.802 -13.268 1.796 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.614 -12.461 3.123 1.00 0.00 H new ATOM 506 N ILE A 38 -7.110 -17.227 3.812 1.00 0.00 N ATOM 507 CA ILE A 38 -6.205 -18.194 3.216 1.00 0.00 C ATOM 508 C ILE A 38 -6.579 -18.398 1.746 1.00 0.00 C ATOM 509 O ILE A 38 -5.719 -18.698 0.919 1.00 0.00 O ATOM 510 CB ILE A 38 -6.191 -19.489 4.032 1.00 0.00 C ATOM 511 CG1 ILE A 38 -5.346 -20.562 3.342 1.00 0.00 C ATOM 512 CG2 ILE A 38 -7.614 -19.974 4.315 1.00 0.00 C ATOM 513 CD1 ILE A 38 -4.801 -21.567 4.359 1.00 0.00 C ATOM 0 H ILE A 38 -7.806 -17.626 4.442 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.181 -17.820 3.236 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.724 -19.281 4.995 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.949 -21.082 2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.519 -20.092 2.810 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.576 -20.895 4.896 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.153 -19.212 4.878 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -8.129 -20.161 3.373 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.204 -22.319 3.843 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.179 -21.047 5.087 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.631 -22.052 4.872 1.00 0.00 H new ATOM 525 N GLN A 39 -7.863 -18.227 1.466 1.00 0.00 N ATOM 526 CA GLN A 39 -8.361 -18.388 0.111 1.00 0.00 C ATOM 527 C GLN A 39 -8.061 -17.136 -0.717 1.00 0.00 C ATOM 528 O GLN A 39 -7.900 -17.217 -1.934 1.00 0.00 O ATOM 529 CB GLN A 39 -9.858 -18.700 0.110 1.00 0.00 C ATOM 530 CG GLN A 39 -10.666 -17.511 0.635 1.00 0.00 C ATOM 531 CD GLN A 39 -12.099 -17.928 0.972 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.941 -18.105 0.107 1.00 0.00 O ATOM 533 NE2 GLN A 39 -12.329 -18.074 2.274 1.00 0.00 N ATOM 0 H GLN A 39 -8.573 -17.979 2.155 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.847 -19.234 -0.346 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.181 -18.946 -0.902 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.051 -19.577 0.728 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.184 -17.103 1.523 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.680 -16.718 -0.113 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.579 -17.910 2.946 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.255 -18.350 2.601 1.00 0.00 H new ATOM 542 N LYS A 40 -7.995 -16.009 -0.024 1.00 0.00 N ATOM 543 CA LYS A 40 -7.717 -14.743 -0.680 1.00 0.00 C ATOM 544 C LYS A 40 -6.704 -13.954 0.152 1.00 0.00 C ATOM 545 O LYS A 40 -7.003 -12.859 0.626 1.00 0.00 O ATOM 546 CB LYS A 40 -9.018 -13.982 -0.949 1.00 0.00 C ATOM 547 CG LYS A 40 -8.745 -12.679 -1.702 1.00 0.00 C ATOM 548 CD LYS A 40 -9.635 -12.564 -2.941 1.00 0.00 C ATOM 549 CE LYS A 40 -8.836 -12.834 -4.217 1.00 0.00 C ATOM 550 NZ LYS A 40 -9.649 -13.604 -5.185 1.00 0.00 N ATOM 0 H LYS A 40 -8.129 -15.946 0.985 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.265 -14.911 -1.657 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.696 -14.607 -1.531 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.517 -13.763 -0.005 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.923 -11.830 -1.042 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.697 -12.639 -1.998 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.460 -13.273 -2.868 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.074 -11.567 -2.987 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -8.524 -11.890 -4.664 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.928 -13.387 -3.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.091 -13.779 -6.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.925 -14.513 -4.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.503 -13.063 -5.430 1.00 0.00 H new ATOM 564 N PRO A 41 -5.495 -14.556 0.308 1.00 0.00 N ATOM 565 CA PRO A 41 -4.436 -13.922 1.074 1.00 0.00 C ATOM 566 C PRO A 41 -3.801 -12.774 0.286 1.00 0.00 C ATOM 567 O PRO A 41 -3.705 -12.836 -0.939 1.00 0.00 O ATOM 568 CB PRO A 41 -3.455 -15.039 1.390 1.00 0.00 C ATOM 569 CG PRO A 41 -3.760 -16.153 0.401 1.00 0.00 C ATOM 570 CD PRO A 41 -5.105 -15.853 -0.239 1.00 0.00 C ATOM 0 HA PRO A 41 -4.800 -13.459 1.991 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.426 -14.696 1.287 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.574 -15.385 2.417 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.981 -16.213 -0.359 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.785 -17.117 0.908 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.027 -15.817 -1.326 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.839 -16.622 0.003 1.00 0.00 H new ATOM 578 N GLY A 42 -3.384 -11.754 1.021 1.00 0.00 N ATOM 579 CA GLY A 42 -2.761 -10.594 0.407 1.00 0.00 C ATOM 580 C GLY A 42 -3.251 -9.299 1.058 1.00 0.00 C ATOM 581 O GLY A 42 -3.836 -9.327 2.139 1.00 0.00 O ATOM 0 H GLY A 42 -3.465 -11.707 2.037 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.678 -10.666 0.502 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.987 -10.577 -0.659 1.00 0.00 H new ATOM 585 N ILE A 43 -2.993 -8.195 0.372 1.00 0.00 N ATOM 586 CA ILE A 43 -3.401 -6.892 0.870 1.00 0.00 C ATOM 587 C ILE A 43 -4.570 -6.373 0.030 1.00 0.00 C ATOM 588 O ILE A 43 -4.475 -6.301 -1.194 1.00 0.00 O ATOM 589 CB ILE A 43 -2.205 -5.939 0.916 1.00 0.00 C ATOM 590 CG1 ILE A 43 -1.084 -6.506 1.789 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.635 -4.543 1.371 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.497 -6.533 3.262 1.00 0.00 C ATOM 0 H ILE A 43 -2.507 -8.176 -0.524 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.757 -6.970 1.897 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.807 -5.841 -0.094 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.836 -7.515 1.459 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.185 -5.901 1.671 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.767 -3.885 1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.373 -4.145 0.675 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.072 -4.604 2.368 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.682 -6.940 3.861 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.721 -5.520 3.596 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.382 -7.158 3.380 1.00 0.00 H new ATOM 604 N PHE A 44 -5.645 -6.026 0.721 1.00 0.00 N ATOM 605 CA PHE A 44 -6.831 -5.515 0.055 1.00 0.00 C ATOM 606 C PHE A 44 -7.361 -4.266 0.760 1.00 0.00 C ATOM 607 O PHE A 44 -7.563 -4.272 1.974 1.00 0.00 O ATOM 608 CB PHE A 44 -7.892 -6.615 0.125 1.00 0.00 C ATOM 609 CG PHE A 44 -7.395 -7.989 -0.331 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.632 -8.747 0.502 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.716 -8.452 -1.569 1.00 0.00 C ATOM 612 CE1 PHE A 44 -6.171 -10.021 0.079 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.255 -9.726 -1.992 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.492 -10.484 -1.159 1.00 0.00 C ATOM 0 H PHE A 44 -5.720 -6.089 1.736 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.592 -5.245 -0.974 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.253 -6.693 1.151 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.743 -6.325 -0.491 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.377 -8.379 1.485 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.322 -7.850 -2.230 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.565 -10.623 0.740 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.510 -10.094 -2.975 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.141 -11.453 -1.481 1.00 0.00 H new ATOM 624 N ILE A 45 -7.573 -3.224 -0.030 1.00 0.00 N ATOM 625 CA ILE A 45 -8.076 -1.969 0.504 1.00 0.00 C ATOM 626 C ILE A 45 -9.412 -2.219 1.206 1.00 0.00 C ATOM 627 O ILE A 45 -10.141 -3.144 0.852 1.00 0.00 O ATOM 628 CB ILE A 45 -8.149 -0.909 -0.597 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.758 -0.361 -0.923 1.00 0.00 C ATOM 630 CG2 ILE A 45 -9.131 0.203 -0.223 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.855 0.926 -1.744 1.00 0.00 C ATOM 0 H ILE A 45 -7.406 -3.223 -1.036 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.391 -1.571 1.252 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.529 -1.382 -1.503 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.214 -0.167 0.001 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.189 -1.108 -1.477 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.164 0.943 -1.022 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -10.125 -0.222 -0.081 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.805 0.681 0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.853 1.295 -1.962 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.378 0.723 -2.678 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.403 1.679 -1.177 1.00 0.00 H new ATOM 643 N SER A 46 -9.693 -1.377 2.190 1.00 0.00 N ATOM 644 CA SER A 46 -10.929 -1.494 2.945 1.00 0.00 C ATOM 645 C SER A 46 -11.746 -0.207 2.816 1.00 0.00 C ATOM 646 O SER A 46 -12.967 -0.255 2.670 1.00 0.00 O ATOM 647 CB SER A 46 -10.647 -1.798 4.418 1.00 0.00 C ATOM 648 OG SER A 46 -10.448 -0.610 5.180 1.00 0.00 O ATOM 0 H SER A 46 -9.086 -0.611 2.482 1.00 0.00 H new ATOM 0 HA SER A 46 -11.504 -2.324 2.533 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.480 -2.362 4.838 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.762 -2.430 4.495 1.00 0.00 H new ATOM 0 HG SER A 46 -10.432 -0.832 6.134 1.00 0.00 H new ATOM 654 N HIS A 47 -11.040 0.913 2.873 1.00 0.00 N ATOM 655 CA HIS A 47 -11.685 2.210 2.764 1.00 0.00 C ATOM 656 C HIS A 47 -10.748 3.190 2.055 1.00 0.00 C ATOM 657 O HIS A 47 -9.534 2.995 2.041 1.00 0.00 O ATOM 658 CB HIS A 47 -12.136 2.710 4.138 1.00 0.00 C ATOM 659 CG HIS A 47 -13.033 3.924 4.085 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.561 5.192 3.793 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.376 4.050 4.290 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.583 6.035 3.824 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.706 5.326 4.133 1.00 0.00 N ATOM 0 H HIS A 47 -10.028 0.949 2.993 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.588 2.122 2.160 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.661 1.905 4.652 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.255 2.947 4.734 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.055 3.248 4.538 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.535 7.098 3.637 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.645 5.713 4.228 1.00 0.00 H new ATOM 671 N VAL A 48 -11.348 4.224 1.483 1.00 0.00 N ATOM 672 CA VAL A 48 -10.583 5.236 0.774 1.00 0.00 C ATOM 673 C VAL A 48 -11.215 6.608 1.014 1.00 0.00 C ATOM 674 O VAL A 48 -12.378 6.827 0.678 1.00 0.00 O ATOM 675 CB VAL A 48 -10.485 4.873 -0.709 1.00 0.00 C ATOM 676 CG1 VAL A 48 -10.006 6.069 -1.535 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.574 3.662 -0.918 1.00 0.00 C ATOM 0 H VAL A 48 -12.355 4.383 1.496 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.562 5.279 1.153 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.483 4.605 -1.055 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -9.945 5.785 -2.585 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.710 6.894 -1.423 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -9.022 6.382 -1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.522 3.425 -1.981 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.575 3.890 -0.548 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -9.976 2.807 -0.375 1.00 0.00 H new ATOM 687 N LYS A 49 -10.421 7.497 1.593 1.00 0.00 N ATOM 688 CA LYS A 49 -10.888 8.842 1.881 1.00 0.00 C ATOM 689 C LYS A 49 -11.115 9.591 0.567 1.00 0.00 C ATOM 690 O LYS A 49 -10.527 9.248 -0.457 1.00 0.00 O ATOM 691 CB LYS A 49 -9.924 9.551 2.835 1.00 0.00 C ATOM 692 CG LYS A 49 -10.383 9.405 4.287 1.00 0.00 C ATOM 693 CD LYS A 49 -10.040 10.655 5.099 1.00 0.00 C ATOM 694 CE LYS A 49 -10.292 10.426 6.591 1.00 0.00 C ATOM 695 NZ LYS A 49 -10.226 11.707 7.330 1.00 0.00 N ATOM 0 H LYS A 49 -9.457 7.312 1.870 1.00 0.00 H new ATOM 0 HA LYS A 49 -11.846 8.810 2.399 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.923 9.134 2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.860 10.607 2.574 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.459 9.232 4.316 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.907 8.533 4.736 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.995 10.921 4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.640 11.496 4.750 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -11.270 9.966 6.734 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.552 9.731 6.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.399 11.534 8.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.284 12.130 7.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -10.949 12.358 6.961 1.00 0.00 H new ATOM 709 N PRO A 50 -11.991 10.629 0.640 1.00 0.00 N ATOM 710 CA PRO A 50 -12.303 11.429 -0.532 1.00 0.00 C ATOM 711 C PRO A 50 -11.152 12.380 -0.868 1.00 0.00 C ATOM 712 O PRO A 50 -10.782 13.224 -0.053 1.00 0.00 O ATOM 713 CB PRO A 50 -13.591 12.156 -0.180 1.00 0.00 C ATOM 714 CG PRO A 50 -13.703 12.098 1.334 1.00 0.00 C ATOM 715 CD PRO A 50 -12.707 11.065 1.836 1.00 0.00 C ATOM 0 HA PRO A 50 -12.434 10.826 -1.431 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.565 13.188 -0.530 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.450 11.680 -0.653 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -13.493 13.075 1.770 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.716 11.828 1.632 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.026 11.495 2.570 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -13.213 10.230 2.321 1.00 0.00 H new ATOM 723 N GLY A 51 -10.620 12.213 -2.069 1.00 0.00 N ATOM 724 CA GLY A 51 -9.519 13.045 -2.523 1.00 0.00 C ATOM 725 C GLY A 51 -8.214 12.657 -1.825 1.00 0.00 C ATOM 726 O GLY A 51 -7.276 13.451 -1.769 1.00 0.00 O ATOM 0 H GLY A 51 -10.931 11.513 -2.743 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.403 12.943 -3.602 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.744 14.093 -2.324 1.00 0.00 H new ATOM 730 N SER A 52 -8.196 11.436 -1.311 1.00 0.00 N ATOM 731 CA SER A 52 -7.021 10.933 -0.619 1.00 0.00 C ATOM 732 C SER A 52 -5.888 10.692 -1.619 1.00 0.00 C ATOM 733 O SER A 52 -5.878 11.275 -2.702 1.00 0.00 O ATOM 734 CB SER A 52 -7.340 9.645 0.142 1.00 0.00 C ATOM 735 OG SER A 52 -7.022 8.482 -0.618 1.00 0.00 O ATOM 0 H SER A 52 -8.976 10.780 -1.360 1.00 0.00 H new ATOM 0 HA SER A 52 -6.704 11.683 0.106 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.782 9.630 1.078 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.399 9.630 0.401 1.00 0.00 H new ATOM 0 HG SER A 52 -7.239 7.681 -0.096 1.00 0.00 H new ATOM 741 N LEU A 53 -4.962 9.833 -1.219 1.00 0.00 N ATOM 742 CA LEU A 53 -3.828 9.508 -2.067 1.00 0.00 C ATOM 743 C LEU A 53 -4.239 8.429 -3.071 1.00 0.00 C ATOM 744 O LEU A 53 -3.672 8.340 -4.159 1.00 0.00 O ATOM 745 CB LEU A 53 -2.615 9.126 -1.215 1.00 0.00 C ATOM 746 CG LEU A 53 -1.297 9.811 -1.580 1.00 0.00 C ATOM 747 CD1 LEU A 53 -1.228 10.103 -3.080 1.00 0.00 C ATOM 748 CD2 LEU A 53 -1.083 11.071 -0.740 1.00 0.00 C ATOM 0 H LEU A 53 -4.974 9.352 -0.319 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.522 10.380 -2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.842 9.351 -0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.472 8.048 -1.284 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.481 9.127 -1.348 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.281 10.590 -3.313 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.302 9.169 -3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.052 10.759 -3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.139 11.539 -1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.901 11.770 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.057 10.804 0.316 1.00 0.00 H new ATOM 760 N SER A 54 -5.221 7.636 -2.669 1.00 0.00 N ATOM 761 CA SER A 54 -5.715 6.567 -3.520 1.00 0.00 C ATOM 762 C SER A 54 -6.929 7.050 -4.317 1.00 0.00 C ATOM 763 O SER A 54 -7.182 6.571 -5.421 1.00 0.00 O ATOM 764 CB SER A 54 -6.079 5.330 -2.696 1.00 0.00 C ATOM 765 OG SER A 54 -5.826 5.521 -1.307 1.00 0.00 O ATOM 0 H SER A 54 -5.688 7.712 -1.765 1.00 0.00 H new ATOM 0 HA SER A 54 -4.921 6.288 -4.213 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.133 5.093 -2.843 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.507 4.474 -3.054 1.00 0.00 H new ATOM 0 HG SER A 54 -5.393 4.722 -0.940 1.00 0.00 H new ATOM 771 N ALA A 55 -7.647 7.994 -3.726 1.00 0.00 N ATOM 772 CA ALA A 55 -8.828 8.547 -4.367 1.00 0.00 C ATOM 773 C ALA A 55 -8.398 9.470 -5.509 1.00 0.00 C ATOM 774 O ALA A 55 -9.225 9.892 -6.315 1.00 0.00 O ATOM 775 CB ALA A 55 -9.684 9.269 -3.324 1.00 0.00 C ATOM 0 H ALA A 55 -7.434 8.390 -2.810 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.439 7.753 -4.797 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.570 9.684 -3.805 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.988 8.563 -2.551 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.105 10.075 -2.873 1.00 0.00 H new ATOM 781 N GLU A 56 -7.104 9.756 -5.541 1.00 0.00 N ATOM 782 CA GLU A 56 -6.555 10.621 -6.571 1.00 0.00 C ATOM 783 C GLU A 56 -6.109 9.792 -7.778 1.00 0.00 C ATOM 784 O GLU A 56 -6.215 10.242 -8.917 1.00 0.00 O ATOM 785 CB GLU A 56 -5.398 11.458 -6.023 1.00 0.00 C ATOM 786 CG GLU A 56 -4.341 10.570 -5.364 1.00 0.00 C ATOM 787 CD GLU A 56 -2.948 11.188 -5.490 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.854 12.420 -5.302 1.00 0.00 O ATOM 789 OE2 GLU A 56 -2.007 10.415 -5.773 1.00 0.00 O ATOM 0 H GLU A 56 -6.421 9.404 -4.870 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.336 11.309 -6.896 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.944 12.030 -6.832 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.777 12.177 -5.297 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.586 10.428 -4.311 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.348 9.584 -5.829 1.00 0.00 H new ATOM 796 N VAL A 57 -5.618 8.597 -7.486 1.00 0.00 N ATOM 797 CA VAL A 57 -5.155 7.701 -8.532 1.00 0.00 C ATOM 798 C VAL A 57 -6.344 6.913 -9.085 1.00 0.00 C ATOM 799 O VAL A 57 -6.305 6.438 -10.219 1.00 0.00 O ATOM 800 CB VAL A 57 -4.039 6.803 -7.997 1.00 0.00 C ATOM 801 CG1 VAL A 57 -3.083 7.592 -7.099 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.615 5.595 -7.256 1.00 0.00 C ATOM 0 H VAL A 57 -5.531 8.228 -6.539 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.728 8.268 -9.359 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.469 6.433 -8.850 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.299 6.930 -6.732 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.634 8.404 -7.671 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.635 8.005 -6.254 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.800 4.973 -6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -5.220 5.938 -6.417 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.236 5.013 -7.937 1.00 0.00 H new ATOM 812 N GLY A 58 -7.372 6.797 -8.258 1.00 0.00 N ATOM 813 CA GLY A 58 -8.570 6.074 -8.650 1.00 0.00 C ATOM 814 C GLY A 58 -8.657 4.726 -7.931 1.00 0.00 C ATOM 815 O GLY A 58 -9.309 3.802 -8.414 1.00 0.00 O ATOM 0 H GLY A 58 -7.400 7.192 -7.318 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.452 6.671 -8.418 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.567 5.915 -9.728 1.00 0.00 H new ATOM 819 N LEU A 59 -7.990 4.657 -6.788 1.00 0.00 N ATOM 820 CA LEU A 59 -7.984 3.438 -5.997 1.00 0.00 C ATOM 821 C LEU A 59 -9.270 3.364 -5.171 1.00 0.00 C ATOM 822 O LEU A 59 -9.705 4.365 -4.604 1.00 0.00 O ATOM 823 CB LEU A 59 -6.708 3.350 -5.158 1.00 0.00 C ATOM 824 CG LEU A 59 -5.504 2.691 -5.835 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.278 2.718 -4.920 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.844 1.273 -6.297 1.00 0.00 C ATOM 0 H LEU A 59 -7.450 5.426 -6.391 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.972 2.563 -6.647 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.424 4.359 -4.858 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.934 2.798 -4.246 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.254 3.268 -6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.437 2.244 -5.425 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.023 3.751 -4.683 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.499 2.179 -3.999 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.972 0.827 -6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.135 0.670 -5.437 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.668 1.310 -7.009 1.00 0.00 H new ATOM 838 N GLU A 60 -9.841 2.170 -5.130 1.00 0.00 N ATOM 839 CA GLU A 60 -11.068 1.952 -4.382 1.00 0.00 C ATOM 840 C GLU A 60 -11.023 0.599 -3.670 1.00 0.00 C ATOM 841 O GLU A 60 -10.099 -0.186 -3.879 1.00 0.00 O ATOM 842 CB GLU A 60 -12.291 2.052 -5.296 1.00 0.00 C ATOM 843 CG GLU A 60 -12.359 3.421 -5.975 1.00 0.00 C ATOM 844 CD GLU A 60 -13.792 3.757 -6.390 1.00 0.00 C ATOM 845 OE1 GLU A 60 -14.611 3.980 -5.472 1.00 0.00 O ATOM 846 OE2 GLU A 60 -14.038 3.783 -7.615 1.00 0.00 O ATOM 0 H GLU A 60 -9.477 1.343 -5.603 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.155 2.733 -3.627 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.249 1.269 -6.053 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.198 1.885 -4.715 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.984 4.187 -5.296 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.712 3.428 -6.852 1.00 0.00 H new ATOM 853 N ILE A 61 -12.033 0.367 -2.845 1.00 0.00 N ATOM 854 CA ILE A 61 -12.121 -0.879 -2.101 1.00 0.00 C ATOM 855 C ILE A 61 -12.093 -2.055 -3.079 1.00 0.00 C ATOM 856 O ILE A 61 -12.834 -2.068 -4.061 1.00 0.00 O ATOM 857 CB ILE A 61 -13.345 -0.870 -1.184 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.294 0.310 -0.212 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.494 -2.207 -0.455 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.654 0.532 0.453 1.00 0.00 C ATOM 0 H ILE A 61 -12.798 1.020 -2.675 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.260 -0.991 -1.443 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.233 -0.739 -1.802 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.538 0.125 0.551 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.994 1.212 -0.745 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.372 -2.174 0.190 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.610 -3.008 -1.185 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.606 -2.393 0.149 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.590 1.377 1.139 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.403 0.741 -0.311 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -14.939 -0.363 1.005 1.00 0.00 H new ATOM 872 N GLY A 62 -11.230 -3.014 -2.777 1.00 0.00 N ATOM 873 CA GLY A 62 -11.096 -4.192 -3.618 1.00 0.00 C ATOM 874 C GLY A 62 -9.698 -4.269 -4.234 1.00 0.00 C ATOM 875 O GLY A 62 -9.141 -5.355 -4.385 1.00 0.00 O ATOM 0 H GLY A 62 -10.617 -3.000 -1.962 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.287 -5.088 -3.028 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.845 -4.166 -4.409 1.00 0.00 H new ATOM 879 N ASP A 63 -9.171 -3.102 -4.574 1.00 0.00 N ATOM 880 CA ASP A 63 -7.848 -3.024 -5.171 1.00 0.00 C ATOM 881 C ASP A 63 -6.834 -3.699 -4.245 1.00 0.00 C ATOM 882 O ASP A 63 -6.372 -3.093 -3.279 1.00 0.00 O ATOM 883 CB ASP A 63 -7.416 -1.569 -5.365 1.00 0.00 C ATOM 884 CG ASP A 63 -8.219 -0.789 -6.407 1.00 0.00 C ATOM 885 OD1 ASP A 63 -8.653 -1.433 -7.387 1.00 0.00 O ATOM 886 OD2 ASP A 63 -8.382 0.433 -6.201 1.00 0.00 O ATOM 0 H ASP A 63 -9.636 -2.203 -4.448 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.886 -3.521 -6.140 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.493 -1.052 -4.408 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.365 -1.553 -5.652 1.00 0.00 H new ATOM 891 N GLN A 64 -6.519 -4.943 -4.571 1.00 0.00 N ATOM 892 CA GLN A 64 -5.569 -5.707 -3.781 1.00 0.00 C ATOM 893 C GLN A 64 -4.137 -5.376 -4.206 1.00 0.00 C ATOM 894 O GLN A 64 -3.837 -5.321 -5.398 1.00 0.00 O ATOM 895 CB GLN A 64 -5.841 -7.208 -3.895 1.00 0.00 C ATOM 896 CG GLN A 64 -4.779 -8.016 -3.148 1.00 0.00 C ATOM 897 CD GLN A 64 -4.403 -9.279 -3.926 1.00 0.00 C ATOM 898 OE1 GLN A 64 -4.943 -9.574 -4.980 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.449 -10.005 -3.351 1.00 0.00 N ATOM 0 H GLN A 64 -6.905 -5.442 -5.373 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.691 -5.428 -2.734 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.827 -7.434 -3.489 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.853 -7.500 -4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.892 -7.402 -2.994 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -5.153 -8.290 -2.161 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.039 -9.701 -2.468 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.127 -10.866 -3.793 1.00 0.00 H new ATOM 908 N ILE A 65 -3.291 -5.163 -3.209 1.00 0.00 N ATOM 909 CA ILE A 65 -1.898 -4.839 -3.465 1.00 0.00 C ATOM 910 C ILE A 65 -1.095 -6.134 -3.606 1.00 0.00 C ATOM 911 O ILE A 65 -0.901 -6.858 -2.631 1.00 0.00 O ATOM 912 CB ILE A 65 -1.360 -3.897 -2.386 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.276 -2.684 -2.212 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.083 -3.487 -2.686 1.00 0.00 C ATOM 915 CD1 ILE A 65 -2.026 -1.996 -0.868 1.00 0.00 C ATOM 0 H ILE A 65 -3.544 -5.209 -2.222 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.800 -4.298 -4.406 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.351 -4.433 -1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.107 -1.977 -3.024 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.318 -2.998 -2.275 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.441 -2.818 -1.904 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.714 -4.375 -2.720 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.124 -2.976 -3.648 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.690 -1.137 -0.770 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.220 -2.699 -0.058 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.990 -1.661 -0.818 1.00 0.00 H new ATOM 927 N VAL A 66 -0.651 -6.387 -4.829 1.00 0.00 N ATOM 928 CA VAL A 66 0.127 -7.581 -5.110 1.00 0.00 C ATOM 929 C VAL A 66 1.607 -7.209 -5.213 1.00 0.00 C ATOM 930 O VAL A 66 2.478 -8.060 -5.040 1.00 0.00 O ATOM 931 CB VAL A 66 -0.406 -8.268 -6.369 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.901 -8.565 -6.241 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.120 -7.427 -7.615 1.00 0.00 C ATOM 0 H VAL A 66 -0.815 -5.785 -5.636 1.00 0.00 H new ATOM 0 HA VAL A 66 0.029 -8.300 -4.297 1.00 0.00 H new ATOM 0 HB VAL A 66 0.116 -9.218 -6.478 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.254 -9.053 -7.149 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.070 -9.221 -5.387 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.446 -7.632 -6.095 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.509 -7.938 -8.496 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.603 -6.455 -7.516 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.956 -7.289 -7.721 1.00 0.00 H new ATOM 943 N GLU A 67 1.846 -5.936 -5.494 1.00 0.00 N ATOM 944 CA GLU A 67 3.206 -5.441 -5.622 1.00 0.00 C ATOM 945 C GLU A 67 3.262 -3.950 -5.282 1.00 0.00 C ATOM 946 O GLU A 67 2.310 -3.215 -5.538 1.00 0.00 O ATOM 947 CB GLU A 67 3.756 -5.704 -7.025 1.00 0.00 C ATOM 948 CG GLU A 67 5.092 -4.989 -7.234 1.00 0.00 C ATOM 949 CD GLU A 67 5.493 -4.996 -8.710 1.00 0.00 C ATOM 950 OE1 GLU A 67 5.629 -6.112 -9.257 1.00 0.00 O ATOM 951 OE2 GLU A 67 5.654 -3.884 -9.260 1.00 0.00 O ATOM 0 H GLU A 67 1.121 -5.233 -5.637 1.00 0.00 H new ATOM 0 HA GLU A 67 3.836 -5.980 -4.914 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.886 -6.776 -7.173 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.037 -5.364 -7.771 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.018 -3.961 -6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.866 -5.476 -6.641 1.00 0.00 H new ATOM 958 N VAL A 68 4.388 -3.548 -4.710 1.00 0.00 N ATOM 959 CA VAL A 68 4.580 -2.159 -4.332 1.00 0.00 C ATOM 960 C VAL A 68 6.052 -1.783 -4.519 1.00 0.00 C ATOM 961 O VAL A 68 6.941 -2.482 -4.036 1.00 0.00 O ATOM 962 CB VAL A 68 4.082 -1.931 -2.903 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.356 -0.496 -2.450 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.595 -2.271 -2.780 1.00 0.00 C ATOM 0 H VAL A 68 5.176 -4.160 -4.499 1.00 0.00 H new ATOM 0 HA VAL A 68 3.992 -1.504 -4.975 1.00 0.00 H new ATOM 0 HB VAL A 68 4.634 -2.601 -2.244 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.992 -0.360 -1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.428 -0.303 -2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.843 0.199 -3.114 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.266 -2.100 -1.755 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.020 -1.638 -3.456 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.438 -3.317 -3.042 1.00 0.00 H new ATOM 974 N ASN A 69 6.263 -0.680 -5.222 1.00 0.00 N ATOM 975 CA ASN A 69 7.611 -0.203 -5.478 1.00 0.00 C ATOM 976 C ASN A 69 8.499 -1.384 -5.875 1.00 0.00 C ATOM 977 O ASN A 69 9.694 -1.392 -5.585 1.00 0.00 O ATOM 978 CB ASN A 69 8.214 0.443 -4.230 1.00 0.00 C ATOM 979 CG ASN A 69 8.669 1.875 -4.518 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.639 2.349 -5.642 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.091 2.536 -3.444 1.00 0.00 N ATOM 0 H ASN A 69 5.523 -0.103 -5.622 1.00 0.00 H new ATOM 0 HA ASN A 69 7.560 0.536 -6.277 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.478 0.447 -3.426 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.061 -0.149 -3.883 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.415 3.499 -3.533 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.090 2.080 -2.532 1.00 0.00 H new ATOM 988 N GLY A 70 7.879 -2.355 -6.531 1.00 0.00 N ATOM 989 CA GLY A 70 8.598 -3.539 -6.969 1.00 0.00 C ATOM 990 C GLY A 70 8.830 -4.503 -5.804 1.00 0.00 C ATOM 991 O GLY A 70 9.906 -5.085 -5.680 1.00 0.00 O ATOM 0 H GLY A 70 6.887 -2.345 -6.769 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.034 -4.042 -7.754 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.556 -3.248 -7.401 1.00 0.00 H new ATOM 995 N VAL A 71 7.802 -4.642 -4.979 1.00 0.00 N ATOM 996 CA VAL A 71 7.880 -5.525 -3.829 1.00 0.00 C ATOM 997 C VAL A 71 6.876 -6.667 -3.999 1.00 0.00 C ATOM 998 O VAL A 71 5.903 -6.538 -4.740 1.00 0.00 O ATOM 999 CB VAL A 71 7.665 -4.727 -2.541 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.739 -5.637 -1.313 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.670 -3.579 -2.433 1.00 0.00 C ATOM 0 H VAL A 71 6.911 -4.157 -5.085 1.00 0.00 H new ATOM 0 HA VAL A 71 8.872 -5.972 -3.757 1.00 0.00 H new ATOM 0 HB VAL A 71 6.665 -4.295 -2.578 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.583 -5.045 -0.411 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.968 -6.404 -1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.719 -6.111 -1.270 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.495 -3.028 -1.509 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.683 -3.981 -2.430 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.549 -2.908 -3.284 1.00 0.00 H new ATOM 1011 N ASP A 72 7.148 -7.760 -3.300 1.00 0.00 N ATOM 1012 CA ASP A 72 6.280 -8.924 -3.364 1.00 0.00 C ATOM 1013 C ASP A 72 5.229 -8.833 -2.257 1.00 0.00 C ATOM 1014 O ASP A 72 5.438 -9.336 -1.154 1.00 0.00 O ATOM 1015 CB ASP A 72 7.075 -10.215 -3.157 1.00 0.00 C ATOM 1016 CG ASP A 72 6.587 -11.413 -3.974 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.364 -11.666 -3.935 1.00 0.00 O ATOM 1018 OD2 ASP A 72 7.449 -12.048 -4.620 1.00 0.00 O ATOM 0 H ASP A 72 7.957 -7.864 -2.687 1.00 0.00 H new ATOM 0 HA ASP A 72 5.812 -8.942 -4.348 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.119 -10.025 -3.407 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.043 -10.478 -2.100 1.00 0.00 H new ATOM 1023 N PHE A 73 4.120 -8.187 -2.589 1.00 0.00 N ATOM 1024 CA PHE A 73 3.036 -8.023 -1.636 1.00 0.00 C ATOM 1025 C PHE A 73 2.037 -9.178 -1.739 1.00 0.00 C ATOM 1026 O PHE A 73 0.884 -9.044 -1.331 1.00 0.00 O ATOM 1027 CB PHE A 73 2.324 -6.716 -1.989 1.00 0.00 C ATOM 1028 CG PHE A 73 2.842 -5.498 -1.222 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.176 -5.239 -1.178 1.00 0.00 C ATOM 1030 CD2 PHE A 73 1.968 -4.674 -0.583 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.657 -4.109 -0.465 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.449 -3.544 0.130 1.00 0.00 C ATOM 1033 CZ PHE A 73 3.783 -3.285 0.174 1.00 0.00 C ATOM 0 H PHE A 73 3.949 -7.771 -3.505 1.00 0.00 H new ATOM 0 HA PHE A 73 3.432 -8.009 -0.621 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.433 -6.532 -3.058 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.258 -6.830 -1.792 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.870 -5.893 -1.685 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.908 -4.879 -0.618 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.717 -3.904 -0.430 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.755 -2.890 0.637 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.149 -2.425 0.716 1.00 0.00 H new ATOM 1043 N SER A 74 2.516 -10.285 -2.286 1.00 0.00 N ATOM 1044 CA SER A 74 1.679 -11.462 -2.448 1.00 0.00 C ATOM 1045 C SER A 74 1.479 -12.151 -1.097 1.00 0.00 C ATOM 1046 O SER A 74 0.350 -12.446 -0.707 1.00 0.00 O ATOM 1047 CB SER A 74 2.290 -12.438 -3.456 1.00 0.00 C ATOM 1048 OG SER A 74 1.299 -13.036 -4.287 1.00 0.00 O ATOM 0 H SER A 74 3.473 -10.392 -2.623 1.00 0.00 H new ATOM 0 HA SER A 74 0.711 -11.143 -2.833 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.015 -11.912 -4.077 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.834 -13.217 -2.922 1.00 0.00 H new ATOM 0 HG SER A 74 1.729 -13.651 -4.918 1.00 0.00 H new ATOM 1054 N ASN A 75 2.593 -12.389 -0.419 1.00 0.00 N ATOM 1055 CA ASN A 75 2.554 -13.038 0.881 1.00 0.00 C ATOM 1056 C ASN A 75 3.153 -12.101 1.932 1.00 0.00 C ATOM 1057 O ASN A 75 4.022 -12.503 2.704 1.00 0.00 O ATOM 1058 CB ASN A 75 3.375 -14.329 0.876 1.00 0.00 C ATOM 1059 CG ASN A 75 2.660 -15.430 0.088 1.00 0.00 C ATOM 1060 OD1 ASN A 75 1.623 -15.937 0.482 1.00 0.00 O ATOM 1061 ND2 ASN A 75 3.272 -15.768 -1.043 1.00 0.00 N ATOM 0 H ASN A 75 3.528 -12.144 -0.746 1.00 0.00 H new ATOM 0 HA ASN A 75 1.514 -13.272 1.110 1.00 0.00 H new ATOM 0 HB2 ASN A 75 4.354 -14.140 0.437 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.544 -14.661 1.900 1.00 0.00 H new ATOM 0 HD21 ASN A 75 2.875 -16.493 -1.641 1.00 0.00 H new ATOM 0 HD22 ASN A 75 4.138 -15.302 -1.313 1.00 0.00 H new ATOM 1068 N LEU A 76 2.664 -10.870 1.928 1.00 0.00 N ATOM 1069 CA LEU A 76 3.140 -9.873 2.872 1.00 0.00 C ATOM 1070 C LEU A 76 2.246 -9.884 4.113 1.00 0.00 C ATOM 1071 O LEU A 76 1.448 -10.801 4.299 1.00 0.00 O ATOM 1072 CB LEU A 76 3.240 -8.502 2.198 1.00 0.00 C ATOM 1073 CG LEU A 76 4.630 -8.097 1.705 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.631 -6.656 1.190 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.683 -8.317 2.793 1.00 0.00 C ATOM 0 H LEU A 76 1.943 -10.540 1.286 1.00 0.00 H new ATOM 0 HA LEU A 76 4.150 -10.114 3.204 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.556 -8.486 1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.892 -7.747 2.902 1.00 0.00 H new ATOM 0 HG LEU A 76 4.895 -8.739 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.631 -6.393 0.846 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.927 -6.565 0.363 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.336 -5.982 1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.662 -8.021 2.417 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.434 -7.716 3.668 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.704 -9.371 3.071 1.00 0.00 H new ATOM 1087 N ASP A 77 2.410 -8.854 4.931 1.00 0.00 N ATOM 1088 CA ASP A 77 1.627 -8.734 6.149 1.00 0.00 C ATOM 1089 C ASP A 77 1.096 -7.305 6.271 1.00 0.00 C ATOM 1090 O ASP A 77 1.488 -6.426 5.504 1.00 0.00 O ATOM 1091 CB ASP A 77 2.482 -9.028 7.384 1.00 0.00 C ATOM 1092 CG ASP A 77 1.717 -9.057 8.708 1.00 0.00 C ATOM 1093 OD1 ASP A 77 1.041 -10.080 8.951 1.00 0.00 O ATOM 1094 OD2 ASP A 77 1.825 -8.055 9.448 1.00 0.00 O ATOM 0 H ASP A 77 3.073 -8.095 4.774 1.00 0.00 H new ATOM 0 HA ASP A 77 0.809 -9.453 6.096 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.975 -9.990 7.245 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.267 -8.275 7.452 1.00 0.00 H new ATOM 1099 N HIS A 78 0.213 -7.116 7.240 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.376 -5.808 7.471 1.00 0.00 C ATOM 1101 C HIS A 78 0.681 -4.865 8.050 1.00 0.00 C ATOM 1102 O HIS A 78 0.436 -3.669 8.199 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.618 -5.920 8.357 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.256 -4.593 8.692 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.733 -3.728 9.639 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.376 -3.992 8.198 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.513 -2.659 9.703 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.530 -2.824 8.810 1.00 0.00 N ATOM 0 H HIS A 78 -0.109 -7.847 7.874 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.713 -5.385 6.525 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.354 -6.549 7.856 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.346 -6.425 9.284 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.027 -4.397 7.438 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.369 -1.806 10.349 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -4.285 -2.159 8.640 1.00 0.00 H new ATOM 1116 N LYS A 79 1.834 -5.439 8.360 1.00 0.00 N ATOM 1117 CA LYS A 79 2.929 -4.664 8.919 1.00 0.00 C ATOM 1118 C LYS A 79 4.025 -4.503 7.863 1.00 0.00 C ATOM 1119 O LYS A 79 4.630 -3.438 7.749 1.00 0.00 O ATOM 1120 CB LYS A 79 3.421 -5.295 10.223 1.00 0.00 C ATOM 1121 CG LYS A 79 2.334 -5.245 11.300 1.00 0.00 C ATOM 1122 CD LYS A 79 2.909 -4.775 12.637 1.00 0.00 C ATOM 1123 CE LYS A 79 2.302 -3.434 13.054 1.00 0.00 C ATOM 1124 NZ LYS A 79 1.972 -3.440 14.497 1.00 0.00 N ATOM 0 H LYS A 79 2.034 -6.431 8.235 1.00 0.00 H new ATOM 0 HA LYS A 79 2.590 -3.662 9.184 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.713 -6.330 10.043 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.309 -4.770 10.573 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.537 -4.571 10.986 1.00 0.00 H new ATOM 0 HG3 LYS A 79 1.889 -6.233 11.419 1.00 0.00 H new ATOM 0 HD2 LYS A 79 2.711 -5.523 13.405 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.992 -4.679 12.558 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.004 -2.628 12.839 1.00 0.00 H new ATOM 0 HE3 LYS A 79 1.403 -3.238 12.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.561 -2.522 14.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 1.286 -4.197 14.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 2.837 -3.605 15.050 1.00 0.00 H new ATOM 1138 N GLU A 80 4.245 -5.575 7.117 1.00 0.00 N ATOM 1139 CA GLU A 80 5.257 -5.566 6.074 1.00 0.00 C ATOM 1140 C GLU A 80 4.756 -4.789 4.855 1.00 0.00 C ATOM 1141 O GLU A 80 5.509 -4.030 4.245 1.00 0.00 O ATOM 1142 CB GLU A 80 5.660 -6.990 5.688 1.00 0.00 C ATOM 1143 CG GLU A 80 6.306 -7.717 6.870 1.00 0.00 C ATOM 1144 CD GLU A 80 7.535 -8.510 6.421 1.00 0.00 C ATOM 1145 OE1 GLU A 80 7.372 -9.331 5.493 1.00 0.00 O ATOM 1146 OE2 GLU A 80 8.609 -8.277 7.017 1.00 0.00 O ATOM 0 H GLU A 80 3.740 -6.456 7.214 1.00 0.00 H new ATOM 0 HA GLU A 80 6.144 -5.065 6.461 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.782 -7.542 5.353 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.357 -6.960 4.850 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.594 -6.994 7.633 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.581 -8.391 7.327 1.00 0.00 H new ATOM 1153 N ALA A 81 3.488 -5.004 4.536 1.00 0.00 N ATOM 1154 CA ALA A 81 2.878 -4.333 3.401 1.00 0.00 C ATOM 1155 C ALA A 81 2.805 -2.830 3.680 1.00 0.00 C ATOM 1156 O ALA A 81 2.752 -2.025 2.753 1.00 0.00 O ATOM 1157 CB ALA A 81 1.501 -4.942 3.128 1.00 0.00 C ATOM 0 H ALA A 81 2.867 -5.633 5.044 1.00 0.00 H new ATOM 0 HA ALA A 81 3.481 -4.473 2.504 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.043 -4.439 2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.610 -6.004 2.906 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.868 -4.818 4.006 1.00 0.00 H new ATOM 1163 N VAL A 82 2.805 -2.499 4.963 1.00 0.00 N ATOM 1164 CA VAL A 82 2.740 -1.107 5.377 1.00 0.00 C ATOM 1165 C VAL A 82 4.160 -0.550 5.500 1.00 0.00 C ATOM 1166 O VAL A 82 4.464 0.510 4.953 1.00 0.00 O ATOM 1167 CB VAL A 82 1.935 -0.983 6.671 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.148 0.386 7.320 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.449 -1.245 6.420 1.00 0.00 C ATOM 0 H VAL A 82 2.849 -3.170 5.730 1.00 0.00 H new ATOM 0 HA VAL A 82 2.220 -0.509 4.628 1.00 0.00 H new ATOM 0 HB VAL A 82 2.297 -1.743 7.364 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.564 0.448 8.238 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.205 0.518 7.552 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.827 1.169 6.633 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.100 -1.150 7.357 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.068 -0.520 5.701 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.319 -2.252 6.023 1.00 0.00 H new ATOM 1179 N ASN A 83 4.991 -1.288 6.221 1.00 0.00 N ATOM 1180 CA ASN A 83 6.371 -0.880 6.423 1.00 0.00 C ATOM 1181 C ASN A 83 6.998 -0.533 5.071 1.00 0.00 C ATOM 1182 O ASN A 83 7.735 0.446 4.958 1.00 0.00 O ATOM 1183 CB ASN A 83 7.192 -2.008 7.050 1.00 0.00 C ATOM 1184 CG ASN A 83 7.537 -1.692 8.506 1.00 0.00 C ATOM 1185 OD1 ASN A 83 7.346 -0.588 8.991 1.00 0.00 O ATOM 1186 ND2 ASN A 83 8.053 -2.719 9.175 1.00 0.00 N ATOM 0 H ASN A 83 4.735 -2.166 6.673 1.00 0.00 H new ATOM 0 HA ASN A 83 6.374 -0.018 7.090 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.631 -2.941 7.000 1.00 0.00 H new ATOM 0 HB3 ASN A 83 8.109 -2.156 6.479 1.00 0.00 H new ATOM 0 HD21 ASN A 83 8.315 -2.609 10.155 1.00 0.00 H new ATOM 0 HD22 ASN A 83 8.186 -3.616 8.709 1.00 0.00 H new ATOM 1193 N VAL A 84 6.683 -1.353 4.080 1.00 0.00 N ATOM 1194 CA VAL A 84 7.207 -1.145 2.741 1.00 0.00 C ATOM 1195 C VAL A 84 6.638 0.156 2.172 1.00 0.00 C ATOM 1196 O VAL A 84 7.245 0.773 1.298 1.00 0.00 O ATOM 1197 CB VAL A 84 6.905 -2.364 1.866 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.432 -2.161 0.444 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.477 -3.640 2.486 1.00 0.00 C ATOM 0 H VAL A 84 6.071 -2.163 4.177 1.00 0.00 H new ATOM 0 HA VAL A 84 8.292 -1.041 2.767 1.00 0.00 H new ATOM 0 HB VAL A 84 5.822 -2.476 1.810 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.205 -3.041 -0.157 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.956 -1.286 0.001 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.511 -2.011 0.474 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.248 -4.491 1.844 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.558 -3.542 2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.033 -3.797 3.469 1.00 0.00 H new ATOM 1209 N LEU A 85 5.478 0.533 2.690 1.00 0.00 N ATOM 1210 CA LEU A 85 4.820 1.749 2.244 1.00 0.00 C ATOM 1211 C LEU A 85 5.454 2.953 2.944 1.00 0.00 C ATOM 1212 O LEU A 85 5.566 4.028 2.357 1.00 0.00 O ATOM 1213 CB LEU A 85 3.307 1.646 2.448 1.00 0.00 C ATOM 1214 CG LEU A 85 2.561 0.725 1.481 1.00 0.00 C ATOM 1215 CD1 LEU A 85 1.157 0.408 1.999 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.531 1.319 0.071 1.00 0.00 C ATOM 0 H LEU A 85 4.977 0.018 3.414 1.00 0.00 H new ATOM 0 HA LEU A 85 4.965 1.889 1.173 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.120 1.300 3.465 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.881 2.646 2.368 1.00 0.00 H new ATOM 0 HG LEU A 85 3.103 -0.219 1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.648 -0.248 1.293 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.230 -0.087 2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.591 1.333 2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.995 0.645 -0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.026 2.285 0.094 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.551 1.452 -0.290 1.00 0.00 H new ATOM 1228 N LYS A 86 5.852 2.732 4.188 1.00 0.00 N ATOM 1229 CA LYS A 86 6.472 3.785 4.974 1.00 0.00 C ATOM 1230 C LYS A 86 7.900 4.015 4.475 1.00 0.00 C ATOM 1231 O LYS A 86 8.453 5.100 4.643 1.00 0.00 O ATOM 1232 CB LYS A 86 6.386 3.461 6.467 1.00 0.00 C ATOM 1233 CG LYS A 86 5.124 2.655 6.781 1.00 0.00 C ATOM 1234 CD LYS A 86 4.704 2.842 8.241 1.00 0.00 C ATOM 1235 CE LYS A 86 3.180 2.889 8.370 1.00 0.00 C ATOM 1236 NZ LYS A 86 2.745 4.203 8.896 1.00 0.00 N ATOM 0 H LYS A 86 5.757 1.839 4.671 1.00 0.00 H new ATOM 0 HA LYS A 86 5.934 4.724 4.844 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.267 2.897 6.772 1.00 0.00 H new ATOM 0 HB3 LYS A 86 6.384 4.386 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 86 4.314 2.969 6.123 1.00 0.00 H new ATOM 0 HG3 LYS A 86 5.304 1.598 6.583 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.099 2.025 8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.135 3.764 8.632 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.721 2.710 7.398 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.841 2.094 9.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.708 4.218 8.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 3.168 4.359 9.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 3.052 4.956 8.247 1.00 0.00 H new ATOM 1250 N SER A 87 8.456 2.974 3.872 1.00 0.00 N ATOM 1251 CA SER A 87 9.809 3.049 3.347 1.00 0.00 C ATOM 1252 C SER A 87 10.080 4.450 2.797 1.00 0.00 C ATOM 1253 O SER A 87 10.847 5.213 3.382 1.00 0.00 O ATOM 1254 CB SER A 87 10.036 1.998 2.259 1.00 0.00 C ATOM 1255 OG SER A 87 11.410 1.898 1.892 1.00 0.00 O ATOM 0 H SER A 87 7.994 2.075 3.735 1.00 0.00 H new ATOM 0 HA SER A 87 10.504 2.845 4.162 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.683 1.029 2.612 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.443 2.252 1.380 1.00 0.00 H new ATOM 0 HG SER A 87 11.514 1.216 1.196 1.00 0.00 H new ATOM 1261 N SER A 88 9.436 4.747 1.677 1.00 0.00 N ATOM 1262 CA SER A 88 9.599 6.043 1.041 1.00 0.00 C ATOM 1263 C SER A 88 8.232 6.696 0.828 1.00 0.00 C ATOM 1264 O SER A 88 7.219 6.198 1.316 1.00 0.00 O ATOM 1265 CB SER A 88 10.339 5.913 -0.292 1.00 0.00 C ATOM 1266 OG SER A 88 11.138 7.059 -0.572 1.00 0.00 O ATOM 0 H SER A 88 8.800 4.112 1.194 1.00 0.00 H new ATOM 0 HA SER A 88 10.198 6.674 1.698 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.972 5.026 -0.270 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.617 5.769 -1.095 1.00 0.00 H new ATOM 0 HG SER A 88 11.596 6.937 -1.430 1.00 0.00 H new ATOM 1272 N ARG A 89 8.247 7.802 0.099 1.00 0.00 N ATOM 1273 CA ARG A 89 7.022 8.529 -0.185 1.00 0.00 C ATOM 1274 C ARG A 89 6.438 8.082 -1.526 1.00 0.00 C ATOM 1275 O ARG A 89 5.266 7.716 -1.607 1.00 0.00 O ATOM 1276 CB ARG A 89 7.272 10.038 -0.223 1.00 0.00 C ATOM 1277 CG ARG A 89 8.308 10.448 0.825 1.00 0.00 C ATOM 1278 CD ARG A 89 7.804 10.153 2.240 1.00 0.00 C ATOM 1279 NE ARG A 89 8.916 9.656 3.080 1.00 0.00 N ATOM 1280 CZ ARG A 89 8.773 9.239 4.345 1.00 0.00 C ATOM 1281 NH1 ARG A 89 7.565 9.257 4.924 1.00 0.00 N ATOM 1282 NH2 ARG A 89 9.838 8.803 5.032 1.00 0.00 N ATOM 0 H ARG A 89 9.089 8.213 -0.304 1.00 0.00 H new ATOM 0 HA ARG A 89 6.314 8.310 0.615 1.00 0.00 H new ATOM 0 HB2 ARG A 89 7.618 10.328 -1.215 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.338 10.570 -0.043 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.241 9.912 0.648 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.528 11.511 0.728 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.381 11.056 2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 89 7.006 9.412 2.203 1.00 0.00 H new ATOM 0 HE ARG A 89 9.850 9.629 2.670 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.754 9.588 4.402 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.456 8.939 5.887 1.00 0.00 H new ATOM 0 HH21 ARG A 89 10.758 8.789 4.592 1.00 0.00 H new ATOM 0 HH22 ARG A 89 9.729 8.486 5.995 1.00 0.00 H new ATOM 1296 N SER A 90 7.282 8.125 -2.547 1.00 0.00 N ATOM 1297 CA SER A 90 6.864 7.729 -3.881 1.00 0.00 C ATOM 1298 C SER A 90 7.038 6.219 -4.057 1.00 0.00 C ATOM 1299 O SER A 90 8.162 5.724 -4.128 1.00 0.00 O ATOM 1300 CB SER A 90 7.655 8.483 -4.952 1.00 0.00 C ATOM 1301 OG SER A 90 8.203 9.700 -4.454 1.00 0.00 O ATOM 0 H SER A 90 8.253 8.428 -2.477 1.00 0.00 H new ATOM 0 HA SER A 90 5.811 7.983 -3.999 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.460 7.848 -5.322 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.004 8.699 -5.799 1.00 0.00 H new ATOM 0 HG SER A 90 8.702 10.150 -5.167 1.00 0.00 H new ATOM 1307 N LEU A 91 5.909 5.529 -4.122 1.00 0.00 N ATOM 1308 CA LEU A 91 5.922 4.086 -4.289 1.00 0.00 C ATOM 1309 C LEU A 91 5.013 3.703 -5.458 1.00 0.00 C ATOM 1310 O LEU A 91 4.072 4.427 -5.780 1.00 0.00 O ATOM 1311 CB LEU A 91 5.558 3.392 -2.975 1.00 0.00 C ATOM 1312 CG LEU A 91 6.396 3.783 -1.755 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.525 4.432 -0.678 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.174 2.581 -1.216 1.00 0.00 C ATOM 0 H LEU A 91 4.979 5.943 -4.062 1.00 0.00 H new ATOM 0 HA LEU A 91 6.925 3.741 -4.539 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.511 3.601 -2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.644 2.315 -3.120 1.00 0.00 H new ATOM 0 HG LEU A 91 7.129 4.526 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.144 4.700 0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.055 5.329 -1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.754 3.730 -0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.761 2.886 -0.350 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.476 1.797 -0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 91 7.841 2.202 -1.991 1.00 0.00 H new ATOM 1326 N THR A 92 5.326 2.566 -6.062 1.00 0.00 N ATOM 1327 CA THR A 92 4.549 2.079 -7.189 1.00 0.00 C ATOM 1328 C THR A 92 3.756 0.833 -6.791 1.00 0.00 C ATOM 1329 O THR A 92 4.302 -0.268 -6.749 1.00 0.00 O ATOM 1330 CB THR A 92 5.508 1.841 -8.357 1.00 0.00 C ATOM 1331 OG1 THR A 92 5.774 3.148 -8.860 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.837 1.120 -9.528 1.00 0.00 C ATOM 0 H THR A 92 6.107 1.968 -5.792 1.00 0.00 H new ATOM 0 HA THR A 92 3.806 2.812 -7.504 1.00 0.00 H new ATOM 0 HB THR A 92 6.361 1.257 -8.013 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.335 3.636 -8.222 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.561 0.976 -10.330 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.467 0.150 -9.195 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.004 1.719 -9.895 1.00 0.00 H new ATOM 1340 N ILE A 93 2.479 1.048 -6.508 1.00 0.00 N ATOM 1341 CA ILE A 93 1.605 -0.044 -6.115 1.00 0.00 C ATOM 1342 C ILE A 93 0.965 -0.654 -7.363 1.00 0.00 C ATOM 1343 O ILE A 93 0.453 0.067 -8.218 1.00 0.00 O ATOM 1344 CB ILE A 93 0.590 0.431 -5.073 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.293 1.085 -3.882 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.327 -0.714 -4.639 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.421 2.181 -3.265 1.00 0.00 C ATOM 0 H ILE A 93 2.029 1.963 -6.543 1.00 0.00 H new ATOM 0 HA ILE A 93 2.178 -0.835 -5.631 1.00 0.00 H new ATOM 0 HB ILE A 93 -0.041 1.192 -5.533 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.520 0.330 -3.130 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.243 1.510 -4.205 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.039 -0.349 -3.898 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.868 -1.095 -5.505 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.271 -1.514 -4.204 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.944 2.630 -2.420 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.216 2.947 -4.013 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.519 1.748 -2.921 1.00 0.00 H new ATOM 1359 N SER A 94 1.015 -1.976 -7.429 1.00 0.00 N ATOM 1360 CA SER A 94 0.447 -2.692 -8.558 1.00 0.00 C ATOM 1361 C SER A 94 -0.781 -3.488 -8.109 1.00 0.00 C ATOM 1362 O SER A 94 -0.648 -4.558 -7.518 1.00 0.00 O ATOM 1363 CB SER A 94 1.479 -3.623 -9.196 1.00 0.00 C ATOM 1364 OG SER A 94 1.845 -3.198 -10.506 1.00 0.00 O ATOM 0 H SER A 94 1.441 -2.571 -6.718 1.00 0.00 H new ATOM 0 HA SER A 94 0.144 -1.962 -9.308 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.368 -3.664 -8.567 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.075 -4.634 -9.243 1.00 0.00 H new ATOM 0 HG SER A 94 2.507 -3.818 -10.878 1.00 0.00 H new ATOM 1370 N ILE A 95 -1.947 -2.934 -8.408 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.197 -3.579 -8.042 1.00 0.00 C ATOM 1372 C ILE A 95 -3.775 -4.291 -9.267 1.00 0.00 C ATOM 1373 O ILE A 95 -3.330 -4.061 -10.390 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.155 -2.569 -7.408 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.374 -1.367 -8.329 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.667 -2.146 -6.021 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.866 -1.119 -8.561 1.00 0.00 C ATOM 0 H ILE A 95 -2.053 -2.046 -8.899 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.025 -4.341 -7.281 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.122 -3.054 -7.275 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.918 -0.480 -7.890 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -3.878 -1.541 -9.284 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.366 -1.428 -5.593 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.605 -3.021 -5.375 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.682 -1.687 -6.106 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.994 -0.259 -9.219 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.314 -1.999 -9.023 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.355 -0.922 -7.607 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.758 -5.140 -9.008 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.402 -5.887 -10.075 1.00 0.00 C ATOM 1391 C VAL A 96 -6.812 -5.336 -10.298 1.00 0.00 C ATOM 1392 O VAL A 96 -7.725 -6.081 -10.652 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.390 -7.382 -9.749 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.191 -8.175 -10.783 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -3.957 -7.908 -9.644 1.00 0.00 C ATOM 0 H VAL A 96 -5.124 -5.327 -8.075 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.854 -5.767 -11.009 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.869 -7.518 -8.779 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.166 -9.234 -10.528 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.224 -7.827 -10.788 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.754 -8.030 -11.771 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.976 -8.973 -9.412 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.442 -7.753 -10.592 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.430 -7.374 -8.853 1.00 0.00 H new ATOM 1405 N ALA A 97 -6.945 -4.035 -10.083 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.228 -3.376 -10.257 1.00 0.00 C ATOM 1407 C ALA A 97 -9.320 -4.208 -9.583 1.00 0.00 C ATOM 1408 O ALA A 97 -9.866 -5.130 -10.189 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.495 -3.162 -11.748 1.00 0.00 C ATOM 0 H ALA A 97 -6.186 -3.420 -9.790 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.222 -2.394 -9.783 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.458 -2.668 -11.878 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.707 -2.540 -12.173 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.511 -4.126 -12.257 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.607 -3.854 -8.339 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.625 -4.557 -7.576 1.00 0.00 C ATOM 1417 C ALA A 98 -10.390 -6.065 -7.691 1.00 0.00 C ATOM 1418 O ALA A 98 -11.276 -6.804 -8.119 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.012 -4.143 -8.072 1.00 0.00 C ATOM 0 H ALA A 98 -9.152 -3.089 -7.840 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.565 -4.293 -6.520 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.775 -4.670 -7.500 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.139 -3.068 -7.942 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.111 -4.395 -9.128 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.193 -6.477 -7.301 1.00 0.00 N ATOM 1426 CA ALA A 99 -8.832 -7.883 -7.354 1.00 0.00 C ATOM 1427 C ALA A 99 -9.787 -8.685 -6.468 1.00 0.00 C ATOM 1428 O ALA A 99 -10.669 -9.380 -6.970 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.369 -8.051 -6.937 1.00 0.00 C ATOM 0 H ALA A 99 -8.461 -5.862 -6.947 1.00 0.00 H new ATOM 0 HA ALA A 99 -8.927 -8.265 -8.370 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.098 -9.106 -6.977 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.730 -7.486 -7.616 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.235 -7.680 -5.921 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.578 -8.563 -5.165 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.410 -9.267 -4.205 1.00 0.00 C ATOM 1437 C GLY A 100 -11.509 -8.355 -3.657 1.00 0.00 C ATOM 1438 O GLY A 100 -11.630 -8.180 -2.445 1.00 0.00 O ATOM 0 H GLY A 100 -8.844 -7.987 -4.752 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.860 -10.139 -4.679 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.794 -9.633 -3.384 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.282 -7.796 -4.576 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.367 -6.905 -4.201 1.00 0.00 C ATOM 1444 C ARG A 101 -14.419 -7.663 -3.389 1.00 0.00 C ATOM 1445 O ARG A 101 -14.927 -7.151 -2.392 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.030 -6.294 -5.437 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.049 -4.766 -5.349 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.339 -4.199 -5.945 1.00 0.00 C ATOM 1449 NE ARG A 101 -15.047 -2.958 -6.696 1.00 0.00 N ATOM 1450 CZ ARG A 101 -15.968 -2.040 -7.019 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -17.246 -2.218 -6.658 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -15.612 -0.944 -7.702 1.00 0.00 N ATOM 0 H ARG A 101 -12.179 -7.943 -5.580 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.944 -6.103 -3.596 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.492 -6.604 -6.333 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.049 -6.669 -5.531 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.959 -4.457 -4.308 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.189 -4.357 -5.879 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.798 -4.934 -6.606 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -16.056 -3.993 -5.151 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.084 -2.791 -6.986 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.517 -3.052 -6.137 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -17.947 -1.519 -6.904 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -14.639 -0.808 -7.977 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -16.314 -0.246 -7.947 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.714 -8.872 -3.844 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.697 -9.705 -3.172 1.00 0.00 C ATOM 1468 C GLU A 102 -15.512 -9.625 -1.655 1.00 0.00 C ATOM 1469 O GLU A 102 -16.487 -9.659 -0.905 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.612 -11.153 -3.659 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.193 -11.704 -3.498 1.00 0.00 C ATOM 1472 CD GLU A 102 -13.984 -12.944 -4.370 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -13.971 -12.771 -5.607 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -13.842 -14.036 -3.778 1.00 0.00 O ATOM 0 H GLU A 102 -14.290 -9.295 -4.670 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.691 -9.331 -3.417 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.312 -11.771 -3.097 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -15.910 -11.206 -4.706 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.468 -10.937 -3.771 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.013 -11.956 -2.453 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.256 -9.519 -1.249 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.931 -9.434 0.165 1.00 0.00 C ATOM 1483 C LEU A 103 -14.860 -8.420 0.836 1.00 0.00 C ATOM 1484 O LEU A 103 -15.373 -8.670 1.926 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.445 -9.127 0.356 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.468 -10.150 -0.228 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -10.021 -9.775 0.099 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.813 -11.565 0.238 1.00 0.00 C ATOM 0 H LEU A 103 -13.451 -9.490 -1.874 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.099 -10.394 0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.234 -8.156 -0.092 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.248 -9.034 1.424 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.566 -10.136 -1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.347 -10.518 -0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.795 -8.796 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.889 -9.744 1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.104 -12.273 -0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.760 -11.613 1.326 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.822 -11.820 -0.088 1.00 0.00 H new ATOM 1500 N PHE A 104 -15.048 -7.298 0.158 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.906 -6.246 0.675 1.00 0.00 C ATOM 1502 C PHE A 104 -17.154 -6.079 -0.194 1.00 0.00 C ATOM 1503 O PHE A 104 -17.374 -5.017 -0.774 1.00 0.00 O ATOM 1504 CB PHE A 104 -15.095 -4.948 0.637 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.627 -5.121 1.029 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -13.274 -5.164 2.342 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.674 -5.230 0.065 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.911 -5.324 2.706 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.311 -5.390 0.429 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.958 -5.434 1.741 1.00 0.00 C ATOM 0 H PHE A 104 -14.621 -7.094 -0.745 1.00 0.00 H new ATOM 0 HA PHE A 104 -16.230 -6.494 1.686 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.145 -4.529 -0.368 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.557 -4.223 1.308 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.031 -5.076 3.108 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.954 -5.195 -0.977 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.631 -5.358 3.748 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.554 -5.477 -0.337 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.921 -5.556 2.017 1.00 0.00 H new ATOM 1520 N MET A 105 -17.939 -7.144 -0.256 1.00 0.00 N ATOM 1521 CA MET A 105 -19.160 -7.129 -1.044 1.00 0.00 C ATOM 1522 C MET A 105 -20.392 -7.014 -0.145 1.00 0.00 C ATOM 1523 O MET A 105 -21.333 -7.797 -0.271 1.00 0.00 O ATOM 1524 CB MET A 105 -19.249 -8.413 -1.871 1.00 0.00 C ATOM 1525 CG MET A 105 -19.373 -9.641 -0.966 1.00 0.00 C ATOM 1526 SD MET A 105 -20.946 -10.440 -1.233 1.00 0.00 S ATOM 1527 CE MET A 105 -20.741 -11.881 -0.200 1.00 0.00 C ATOM 0 H MET A 105 -17.754 -8.023 0.227 1.00 0.00 H new ATOM 0 HA MET A 105 -19.134 -6.262 -1.704 1.00 0.00 H new ATOM 0 HB2 MET A 105 -20.109 -8.361 -2.539 1.00 0.00 H new ATOM 0 HB3 MET A 105 -18.363 -8.508 -2.499 1.00 0.00 H new ATOM 0 HG2 MET A 105 -18.562 -10.339 -1.173 1.00 0.00 H new ATOM 0 HG3 MET A 105 -19.279 -9.344 0.079 1.00 0.00 H new ATOM 0 HE1 MET A 105 -21.640 -12.496 -0.250 1.00 0.00 H new ATOM 0 HE2 MET A 105 -19.886 -12.460 -0.548 1.00 0.00 H new ATOM 0 HE3 MET A 105 -20.572 -11.569 0.831 1.00 0.00 H new ATOM 1537 N THR A 106 -20.348 -6.032 0.743 1.00 0.00 N ATOM 1538 CA THR A 106 -21.449 -5.804 1.663 1.00 0.00 C ATOM 1539 C THR A 106 -21.804 -4.317 1.712 1.00 0.00 C ATOM 1540 O THR A 106 -20.994 -3.469 1.340 1.00 0.00 O ATOM 1541 CB THR A 106 -21.054 -6.379 3.025 1.00 0.00 C ATOM 1542 OG1 THR A 106 -22.233 -6.246 3.813 1.00 0.00 O ATOM 1543 CG2 THR A 106 -20.021 -5.513 3.749 1.00 0.00 C ATOM 0 H THR A 106 -19.566 -5.385 0.845 1.00 0.00 H new ATOM 0 HA THR A 106 -22.354 -6.311 1.329 1.00 0.00 H new ATOM 0 HB THR A 106 -20.655 -7.385 2.893 1.00 0.00 H new ATOM 0 HG1 THR A 106 -22.066 -6.597 4.713 1.00 0.00 H new ATOM 0 HG21 THR A 106 -19.776 -5.966 4.710 1.00 0.00 H new ATOM 0 HG22 THR A 106 -19.119 -5.439 3.142 1.00 0.00 H new ATOM 0 HG23 THR A 106 -20.432 -4.517 3.912 1.00 0.00 H new ATOM 1551 N ASP A 107 -23.016 -4.045 2.173 1.00 0.00 N ATOM 1552 CA ASP A 107 -23.489 -2.675 2.276 1.00 0.00 C ATOM 1553 C ASP A 107 -23.415 -2.222 3.735 1.00 0.00 C ATOM 1554 O ASP A 107 -22.864 -1.164 4.034 1.00 0.00 O ATOM 1555 CB ASP A 107 -24.944 -2.559 1.817 1.00 0.00 C ATOM 1556 CG ASP A 107 -25.207 -1.476 0.769 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -24.329 -1.308 -0.106 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -26.279 -0.841 0.866 1.00 0.00 O ATOM 0 H ASP A 107 -23.685 -4.751 2.480 1.00 0.00 H new ATOM 0 HA ASP A 107 -22.860 -2.052 1.640 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.259 -3.520 1.411 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.569 -2.360 2.688 1.00 0.00 H new ATOM 1563 N ARG A 108 -23.979 -3.046 4.606 1.00 0.00 N ATOM 1564 CA ARG A 108 -23.985 -2.744 6.027 1.00 0.00 C ATOM 1565 C ARG A 108 -22.599 -2.276 6.476 1.00 0.00 C ATOM 1566 O ARG A 108 -21.585 -2.768 5.983 1.00 0.00 O ATOM 1567 CB ARG A 108 -24.393 -3.968 6.849 1.00 0.00 C ATOM 1568 CG ARG A 108 -25.854 -3.869 7.292 1.00 0.00 C ATOM 1569 CD ARG A 108 -25.959 -3.319 8.716 1.00 0.00 C ATOM 1570 NE ARG A 108 -27.364 -2.965 9.019 1.00 0.00 N ATOM 1571 CZ ARG A 108 -28.306 -3.856 9.358 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -27.999 -5.158 9.440 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -29.555 -3.445 9.617 1.00 0.00 N ATOM 0 H ARG A 108 -24.435 -3.923 4.355 1.00 0.00 H new ATOM 0 HA ARG A 108 -24.713 -1.950 6.194 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -24.249 -4.872 6.257 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -23.749 -4.054 7.724 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -26.402 -3.222 6.607 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -26.320 -4.853 7.243 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -25.600 -4.061 9.429 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -25.323 -2.441 8.823 1.00 0.00 H new ATOM 0 HE ARG A 108 -27.632 -1.982 8.967 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -27.048 -5.471 9.244 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -28.716 -5.836 9.698 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -29.789 -2.454 9.556 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -30.272 -4.123 9.875 1.00 0.00 H new ATOM 1587 N SER A 109 -22.600 -1.331 7.405 1.00 0.00 N ATOM 1588 CA SER A 109 -21.356 -0.791 7.925 1.00 0.00 C ATOM 1589 C SER A 109 -21.603 -0.113 9.274 1.00 0.00 C ATOM 1590 O SER A 109 -20.982 -0.468 10.274 1.00 0.00 O ATOM 1591 CB SER A 109 -20.730 0.198 6.940 1.00 0.00 C ATOM 1592 OG SER A 109 -19.331 0.359 7.160 1.00 0.00 O ATOM 0 H SER A 109 -23.443 -0.926 7.811 1.00 0.00 H new ATOM 0 HA SER A 109 -20.657 -1.616 8.063 1.00 0.00 H new ATOM 0 HB2 SER A 109 -20.899 -0.150 5.921 1.00 0.00 H new ATOM 0 HB3 SER A 109 -21.225 1.165 7.033 1.00 0.00 H new ATOM 0 HG SER A 109 -18.969 0.997 6.510 1.00 0.00 H new ATOM 1598 N GLY A 110 -22.511 0.852 9.257 1.00 0.00 N ATOM 1599 CA GLY A 110 -22.848 1.583 10.467 1.00 0.00 C ATOM 1600 C GLY A 110 -23.441 2.953 10.132 1.00 0.00 C ATOM 1601 O GLY A 110 -23.042 3.584 9.154 1.00 0.00 O ATOM 0 H GLY A 110 -23.023 1.144 8.425 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -23.562 1.008 11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -21.956 1.709 11.081 1.00 0.00 H new ATOM 1605 N PRO A 111 -24.409 3.385 10.984 1.00 0.00 N ATOM 1606 CA PRO A 111 -25.060 4.669 10.788 1.00 0.00 C ATOM 1607 C PRO A 111 -24.138 5.819 11.197 1.00 0.00 C ATOM 1608 O PRO A 111 -24.496 6.635 12.046 1.00 0.00 O ATOM 1609 CB PRO A 111 -26.328 4.598 11.623 1.00 0.00 C ATOM 1610 CG PRO A 111 -26.110 3.468 12.617 1.00 0.00 C ATOM 1611 CD PRO A 111 -24.906 2.665 12.152 1.00 0.00 C ATOM 0 HA PRO A 111 -25.298 4.865 9.743 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -26.510 5.541 12.138 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -27.198 4.404 10.996 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -25.940 3.867 13.617 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -26.994 2.833 12.673 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -24.147 2.603 12.931 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -25.186 1.643 11.897 1.00 0.00 H new ATOM 1619 N SER A 112 -22.969 5.848 10.575 1.00 0.00 N ATOM 1620 CA SER A 112 -21.993 6.885 10.864 1.00 0.00 C ATOM 1621 C SER A 112 -21.938 7.147 12.370 1.00 0.00 C ATOM 1622 O SER A 112 -22.522 8.114 12.858 1.00 0.00 O ATOM 1623 CB SER A 112 -22.323 8.177 10.112 1.00 0.00 C ATOM 1624 OG SER A 112 -21.194 8.687 9.407 1.00 0.00 O ATOM 0 H SER A 112 -22.675 5.170 9.872 1.00 0.00 H new ATOM 0 HA SER A 112 -21.016 6.539 10.526 1.00 0.00 H new ATOM 0 HB2 SER A 112 -23.135 7.990 9.409 1.00 0.00 H new ATOM 0 HB3 SER A 112 -22.679 8.927 10.818 1.00 0.00 H new ATOM 0 HG SER A 112 -21.445 9.510 8.939 1.00 0.00 H new ATOM 1630 N SER A 113 -21.230 6.269 13.066 1.00 0.00 N ATOM 1631 CA SER A 113 -21.092 6.394 14.507 1.00 0.00 C ATOM 1632 C SER A 113 -20.892 7.862 14.889 1.00 0.00 C ATOM 1633 O SER A 113 -21.736 8.453 15.560 1.00 0.00 O ATOM 1634 CB SER A 113 -19.926 5.548 15.023 1.00 0.00 C ATOM 1635 OG SER A 113 -20.257 4.163 15.083 1.00 0.00 O ATOM 0 H SER A 113 -20.746 5.469 12.659 1.00 0.00 H new ATOM 0 HA SER A 113 -22.007 6.026 14.971 1.00 0.00 H new ATOM 0 HB2 SER A 113 -19.062 5.686 14.373 1.00 0.00 H new ATOM 0 HB3 SER A 113 -19.637 5.895 16.015 1.00 0.00 H new ATOM 0 HG SER A 113 -19.487 3.657 15.415 1.00 0.00 H new ATOM 1641 N GLY A 114 -19.770 8.408 14.444 1.00 0.00 N ATOM 1642 CA GLY A 114 -19.448 9.796 14.731 1.00 0.00 C ATOM 1643 C GLY A 114 -20.686 10.685 14.594 1.00 0.00 C ATOM 1644 O GLY A 114 -20.739 11.773 15.165 1.00 0.00 O ATOM 0 H GLY A 114 -19.072 7.915 13.887 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -19.046 9.879 15.741 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -18.671 10.141 14.049 1.00 0.00 H new TER 1648 GLY A 114