USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 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 20:sc= 0.82 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -178:sc= -2.04 (180deg=-2.05) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HE2:sc= -2.6! C(o=-2.6!,f=-3.1!) USER MOD Single : A 23 THR OG1 : rot -90:sc= -0.326 USER MOD Single : A 38 HIS : no HD1:sc=-0.00971 X(o=-0.0097,f=-0.002) USER MOD Single : A 41 MET CE :methyl 156:sc= -0.0796 (180deg=-0.757) USER MOD Single : A 44 GLN : amide:sc= -0.982 K(o=-0.98,f=-4.7!) USER MOD Single : A 45 GLN : amide:sc= -0.176 K(o=-0.18,f=-2.3!) USER MOD Single : A 49 HIS : no HD1:sc=-0.00562 X(o=-0.0056,f=-0.028) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN : amide:sc= -6.6! C(o=-6.6!,f=-6.3!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -2.74 K(o=-2.7,f=-2) USER MOD Single : A 75 ASN : amide:sc= -2.82! C(o=-2.8!,f=-4.5!) USER MOD Single : A 77 SER OG : rot 180:sc= -0.297 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -138:sc= -0.32 (180deg=-1.84!) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.487 -17.062 -14.629 1.00 0.00 N ATOM 2 CA GLY A 1 8.135 -16.809 -14.166 1.00 0.00 C ATOM 3 C GLY A 1 7.187 -16.477 -15.301 1.00 0.00 C ATOM 4 O GLY A 1 6.746 -15.336 -15.437 1.00 0.00 O ATOM 0 H1 GLY A 1 10.096 -17.284 -13.816 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.483 -17.866 -15.289 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.852 -16.217 -15.114 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.766 -17.686 -13.633 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.147 -15.984 -13.453 1.00 0.00 H new ATOM 8 N SER A 2 6.873 -17.476 -16.119 1.00 0.00 N ATOM 9 CA SER A 2 5.975 -17.284 -17.252 1.00 0.00 C ATOM 10 C SER A 2 4.559 -17.735 -16.906 1.00 0.00 C ATOM 11 O SER A 2 4.177 -18.874 -17.170 1.00 0.00 O ATOM 12 CB SER A 2 6.484 -18.055 -18.471 1.00 0.00 C ATOM 13 OG SER A 2 7.419 -17.286 -19.208 1.00 0.00 O ATOM 0 H SER A 2 7.227 -18.427 -16.018 1.00 0.00 H new ATOM 0 HA SER A 2 5.952 -16.220 -17.488 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.949 -18.986 -18.148 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.644 -18.324 -19.112 1.00 0.00 H new ATOM 0 HG SER A 2 7.730 -17.802 -19.981 1.00 0.00 H new ATOM 19 N SER A 3 3.786 -16.831 -16.312 1.00 0.00 N ATOM 20 CA SER A 3 2.413 -17.136 -15.925 1.00 0.00 C ATOM 21 C SER A 3 1.596 -15.857 -15.768 1.00 0.00 C ATOM 22 O SER A 3 2.125 -14.812 -15.391 1.00 0.00 O ATOM 23 CB SER A 3 2.394 -17.931 -14.618 1.00 0.00 C ATOM 24 OG SER A 3 2.677 -19.300 -14.850 1.00 0.00 O ATOM 0 H SER A 3 4.087 -15.882 -16.088 1.00 0.00 H new ATOM 0 HA SER A 3 1.964 -17.738 -16.715 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.127 -17.517 -13.926 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.418 -17.834 -14.143 1.00 0.00 H new ATOM 0 HG SER A 3 3.124 -19.399 -15.716 1.00 0.00 H new ATOM 30 N GLY A 4 0.302 -15.949 -16.059 1.00 0.00 N ATOM 31 CA GLY A 4 -0.568 -14.793 -15.944 1.00 0.00 C ATOM 32 C GLY A 4 -1.147 -14.639 -14.552 1.00 0.00 C ATOM 33 O GLY A 4 -2.331 -14.894 -14.333 1.00 0.00 O ATOM 0 H GLY A 4 -0.159 -16.803 -16.372 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.009 -13.894 -16.203 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.381 -14.881 -16.665 1.00 0.00 H new ATOM 37 N SER A 5 -0.310 -14.223 -13.607 1.00 0.00 N ATOM 38 CA SER A 5 -0.744 -14.042 -12.227 1.00 0.00 C ATOM 39 C SER A 5 -1.352 -12.657 -12.026 1.00 0.00 C ATOM 40 O SER A 5 -0.921 -11.682 -12.642 1.00 0.00 O ATOM 41 CB SER A 5 0.433 -14.238 -11.269 1.00 0.00 C ATOM 42 OG SER A 5 0.671 -15.614 -11.028 1.00 0.00 O ATOM 0 H SER A 5 0.673 -14.005 -13.772 1.00 0.00 H new ATOM 0 HA SER A 5 -1.507 -14.790 -12.012 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.328 -13.779 -11.689 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.227 -13.731 -10.326 1.00 0.00 H new ATOM 0 HG SER A 5 1.429 -15.712 -10.414 1.00 0.00 H new ATOM 48 N SER A 6 -2.357 -12.578 -11.160 1.00 0.00 N ATOM 49 CA SER A 6 -3.028 -11.314 -10.880 1.00 0.00 C ATOM 50 C SER A 6 -2.194 -10.453 -9.937 1.00 0.00 C ATOM 51 O SER A 6 -1.249 -10.934 -9.312 1.00 0.00 O ATOM 52 CB SER A 6 -4.408 -11.569 -10.271 1.00 0.00 C ATOM 53 OG SER A 6 -4.297 -12.080 -8.953 1.00 0.00 O ATOM 0 H SER A 6 -2.725 -13.375 -10.640 1.00 0.00 H new ATOM 0 HA SER A 6 -3.148 -10.778 -11.822 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.980 -10.641 -10.258 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.959 -12.275 -10.893 1.00 0.00 H new ATOM 0 HG SER A 6 -5.192 -12.233 -8.585 1.00 0.00 H new ATOM 59 N GLY A 7 -2.551 -9.176 -9.840 1.00 0.00 N ATOM 60 CA GLY A 7 -1.825 -8.267 -8.971 1.00 0.00 C ATOM 61 C GLY A 7 -1.560 -6.927 -9.627 1.00 0.00 C ATOM 62 O GLY A 7 -1.820 -6.748 -10.817 1.00 0.00 O ATOM 0 H GLY A 7 -3.329 -8.755 -10.347 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.394 -8.113 -8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.877 -8.722 -8.685 1.00 0.00 H new ATOM 66 N ARG A 8 -1.042 -5.982 -8.849 1.00 0.00 N ATOM 67 CA ARG A 8 -0.745 -4.649 -9.361 1.00 0.00 C ATOM 68 C ARG A 8 0.653 -4.205 -8.941 1.00 0.00 C ATOM 69 O ARG A 8 0.992 -4.226 -7.758 1.00 0.00 O ATOM 70 CB ARG A 8 -1.783 -3.643 -8.860 1.00 0.00 C ATOM 71 CG ARG A 8 -1.428 -2.198 -9.166 1.00 0.00 C ATOM 72 CD ARG A 8 -2.339 -1.231 -8.426 1.00 0.00 C ATOM 73 NE ARG A 8 -3.726 -1.335 -8.873 1.00 0.00 N ATOM 74 CZ ARG A 8 -4.155 -0.883 -10.046 1.00 0.00 C ATOM 75 NH1 ARG A 8 -3.311 -0.300 -10.885 1.00 0.00 N ATOM 76 NH2 ARG A 8 -5.432 -1.015 -10.382 1.00 0.00 N ATOM 0 H ARG A 8 -0.819 -6.114 -7.862 1.00 0.00 H new ATOM 0 HA ARG A 8 -0.784 -4.689 -10.450 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -2.748 -3.874 -9.311 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -1.899 -3.759 -7.782 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -0.392 -2.010 -8.886 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -1.505 -2.023 -10.239 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -2.287 -1.431 -7.356 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -1.985 -0.211 -8.577 1.00 0.00 H new ATOM 0 HE ARG A 8 -4.401 -1.779 -8.251 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -2.329 -0.197 -10.631 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -3.644 0.046 -11.785 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -6.085 -1.464 -9.739 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -5.761 -0.668 -11.283 1.00 0.00 H new ATOM 90 N MET A 9 1.460 -3.805 -9.918 1.00 0.00 N ATOM 91 CA MET A 9 2.821 -3.356 -9.649 1.00 0.00 C ATOM 92 C MET A 9 2.905 -1.833 -9.671 1.00 0.00 C ATOM 93 O MET A 9 2.618 -1.200 -10.687 1.00 0.00 O ATOM 94 CB MET A 9 3.788 -3.946 -10.677 1.00 0.00 C ATOM 95 CG MET A 9 3.852 -5.465 -10.649 1.00 0.00 C ATOM 96 SD MET A 9 5.190 -6.123 -11.662 1.00 0.00 S ATOM 97 CE MET A 9 5.942 -7.280 -10.520 1.00 0.00 C ATOM 0 H MET A 9 1.195 -3.783 -10.903 1.00 0.00 H new ATOM 0 HA MET A 9 3.102 -3.704 -8.655 1.00 0.00 H new ATOM 0 HB2 MET A 9 3.489 -3.621 -11.674 1.00 0.00 H new ATOM 0 HB3 MET A 9 4.786 -3.545 -10.497 1.00 0.00 H new ATOM 0 HG2 MET A 9 3.982 -5.800 -9.620 1.00 0.00 H new ATOM 0 HG3 MET A 9 2.903 -5.871 -10.999 1.00 0.00 H new ATOM 0 HE1 MET A 9 6.788 -7.769 -11.002 1.00 0.00 H new ATOM 0 HE2 MET A 9 6.288 -6.745 -9.635 1.00 0.00 H new ATOM 0 HE3 MET A 9 5.208 -8.031 -10.227 1.00 0.00 H new ATOM 107 N VAL A 10 3.300 -1.250 -8.543 1.00 0.00 N ATOM 108 CA VAL A 10 3.422 0.199 -8.434 1.00 0.00 C ATOM 109 C VAL A 10 4.883 0.619 -8.311 1.00 0.00 C ATOM 110 O VAL A 10 5.535 0.347 -7.305 1.00 0.00 O ATOM 111 CB VAL A 10 2.641 0.738 -7.221 1.00 0.00 C ATOM 112 CG1 VAL A 10 2.928 2.218 -7.016 1.00 0.00 C ATOM 113 CG2 VAL A 10 1.149 0.495 -7.398 1.00 0.00 C ATOM 0 H VAL A 10 3.541 -1.759 -7.692 1.00 0.00 H new ATOM 0 HA VAL A 10 3.000 0.622 -9.346 1.00 0.00 H new ATOM 0 HB VAL A 10 2.970 0.202 -6.331 1.00 0.00 H new ATOM 0 HG11 VAL A 10 2.368 2.581 -6.155 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.994 2.361 -6.842 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.628 2.773 -7.905 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.612 0.882 -6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.802 1.004 -8.297 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.963 -0.575 -7.492 1.00 0.00 H new ATOM 123 N GLY A 11 5.390 1.286 -9.344 1.00 0.00 N ATOM 124 CA GLY A 11 6.770 1.734 -9.332 1.00 0.00 C ATOM 125 C GLY A 11 6.920 3.134 -8.772 1.00 0.00 C ATOM 126 O GLY A 11 6.085 4.003 -9.023 1.00 0.00 O ATOM 0 H GLY A 11 4.869 1.524 -10.188 1.00 0.00 H new ATOM 0 HA2 GLY A 11 7.368 1.043 -8.738 1.00 0.00 H new ATOM 0 HA3 GLY A 11 7.166 1.708 -10.347 1.00 0.00 H new ATOM 130 N ILE A 12 7.986 3.353 -8.009 1.00 0.00 N ATOM 131 CA ILE A 12 8.242 4.658 -7.411 1.00 0.00 C ATOM 132 C ILE A 12 9.734 4.972 -7.395 1.00 0.00 C ATOM 133 O ILE A 12 10.556 4.112 -7.081 1.00 0.00 O ATOM 134 CB ILE A 12 7.697 4.734 -5.973 1.00 0.00 C ATOM 135 CG1 ILE A 12 6.224 4.321 -5.940 1.00 0.00 C ATOM 136 CG2 ILE A 12 7.871 6.139 -5.414 1.00 0.00 C ATOM 137 CD1 ILE A 12 5.726 3.969 -4.555 1.00 0.00 C ATOM 0 H ILE A 12 8.686 2.644 -7.790 1.00 0.00 H new ATOM 0 HA ILE A 12 7.725 5.394 -8.026 1.00 0.00 H new ATOM 0 HB ILE A 12 8.263 4.043 -5.349 1.00 0.00 H new ATOM 0 HG12 ILE A 12 5.618 5.134 -6.339 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.081 3.464 -6.598 1.00 0.00 H new ATOM 0 HG21 ILE A 12 7.481 6.177 -4.397 1.00 0.00 H new ATOM 0 HG22 ILE A 12 8.929 6.399 -5.407 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.327 6.849 -6.038 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.675 3.686 -4.607 1.00 0.00 H new ATOM 0 HD12 ILE A 12 6.307 3.135 -4.160 1.00 0.00 H new ATOM 0 HD13 ILE A 12 5.837 4.832 -3.898 1.00 0.00 H new ATOM 149 N ARG A 13 10.075 6.211 -7.733 1.00 0.00 N ATOM 150 CA ARG A 13 11.469 6.640 -7.757 1.00 0.00 C ATOM 151 C ARG A 13 11.814 7.436 -6.502 1.00 0.00 C ATOM 152 O ARG A 13 12.588 8.392 -6.553 1.00 0.00 O ATOM 153 CB ARG A 13 11.743 7.486 -9.002 1.00 0.00 C ATOM 154 CG ARG A 13 10.996 8.809 -9.016 1.00 0.00 C ATOM 155 CD ARG A 13 10.898 9.378 -10.423 1.00 0.00 C ATOM 156 NE ARG A 13 10.016 10.541 -10.483 1.00 0.00 N ATOM 157 CZ ARG A 13 9.931 11.345 -11.536 1.00 0.00 C ATOM 158 NH1 ARG A 13 10.670 11.114 -12.613 1.00 0.00 N ATOM 159 NH2 ARG A 13 9.105 12.383 -11.515 1.00 0.00 N ATOM 0 H ARG A 13 9.406 6.935 -7.994 1.00 0.00 H new ATOM 0 HA ARG A 13 12.097 5.749 -7.786 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.813 7.682 -9.069 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.467 6.914 -9.888 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.995 8.667 -8.609 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.505 9.523 -8.368 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.892 9.659 -10.771 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.529 8.608 -11.101 1.00 0.00 H new ATOM 0 HE ARG A 13 9.434 10.747 -9.671 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.306 10.317 -12.634 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.602 11.734 -13.420 1.00 0.00 H new ATOM 0 HH21 ARG A 13 8.534 12.564 -10.689 1.00 0.00 H new ATOM 0 HH22 ARG A 13 9.041 13.000 -12.325 1.00 0.00 H new ATOM 173 N LYS A 14 11.234 7.036 -5.375 1.00 0.00 N ATOM 174 CA LYS A 14 11.480 7.710 -4.106 1.00 0.00 C ATOM 175 C LYS A 14 12.970 7.734 -3.782 1.00 0.00 C ATOM 176 O LYS A 14 13.752 6.970 -4.350 1.00 0.00 O ATOM 177 CB LYS A 14 10.712 7.015 -2.979 1.00 0.00 C ATOM 178 CG LYS A 14 11.067 5.548 -2.816 1.00 0.00 C ATOM 179 CD LYS A 14 9.902 4.751 -2.255 1.00 0.00 C ATOM 180 CE LYS A 14 9.636 5.102 -0.799 1.00 0.00 C ATOM 181 NZ LYS A 14 9.029 3.963 -0.056 1.00 0.00 N ATOM 0 H LYS A 14 10.590 6.248 -5.315 1.00 0.00 H new ATOM 0 HA LYS A 14 11.130 8.738 -4.195 1.00 0.00 H new ATOM 0 HB2 LYS A 14 10.910 7.534 -2.041 1.00 0.00 H new ATOM 0 HB3 LYS A 14 9.643 7.102 -3.172 1.00 0.00 H new ATOM 0 HG2 LYS A 14 11.361 5.135 -3.781 1.00 0.00 H new ATOM 0 HG3 LYS A 14 11.927 5.452 -2.153 1.00 0.00 H new ATOM 0 HD2 LYS A 14 9.008 4.946 -2.847 1.00 0.00 H new ATOM 0 HD3 LYS A 14 10.114 3.685 -2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 14 10.571 5.392 -0.319 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.971 5.964 -0.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 8.832 4.253 0.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 8.142 3.680 -0.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.689 3.159 -0.053 1.00 0.00 H new ATOM 195 N THR A 15 13.358 8.614 -2.864 1.00 0.00 N ATOM 196 CA THR A 15 14.754 8.736 -2.464 1.00 0.00 C ATOM 197 C THR A 15 14.981 8.152 -1.074 1.00 0.00 C ATOM 198 O THR A 15 14.085 8.168 -0.230 1.00 0.00 O ATOM 199 CB THR A 15 15.214 10.206 -2.472 1.00 0.00 C ATOM 200 OG1 THR A 15 14.937 10.799 -3.746 1.00 0.00 O ATOM 201 CG2 THR A 15 16.701 10.309 -2.171 1.00 0.00 C ATOM 0 H THR A 15 12.724 9.253 -2.384 1.00 0.00 H new ATOM 0 HA THR A 15 15.341 8.175 -3.191 1.00 0.00 H new ATOM 0 HB THR A 15 14.665 10.740 -1.696 1.00 0.00 H new ATOM 0 HG1 THR A 15 15.231 11.734 -3.742 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.003 11.356 -2.182 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.904 9.883 -1.188 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.264 9.761 -2.927 1.00 0.00 H new ATOM 209 N ALA A 16 16.184 7.637 -0.843 1.00 0.00 N ATOM 210 CA ALA A 16 16.529 7.050 0.446 1.00 0.00 C ATOM 211 C ALA A 16 16.306 8.045 1.580 1.00 0.00 C ATOM 212 O ALA A 16 16.958 9.086 1.642 1.00 0.00 O ATOM 213 CB ALA A 16 17.973 6.571 0.438 1.00 0.00 C ATOM 0 H ALA A 16 16.936 7.614 -1.532 1.00 0.00 H new ATOM 0 HA ALA A 16 15.875 6.195 0.615 1.00 0.00 H new ATOM 0 HB1 ALA A 16 18.217 6.135 1.407 1.00 0.00 H new ATOM 0 HB2 ALA A 16 18.103 5.820 -0.341 1.00 0.00 H new ATOM 0 HB3 ALA A 16 18.635 7.415 0.243 1.00 0.00 H new ATOM 219 N GLY A 17 15.378 7.718 2.474 1.00 0.00 N ATOM 220 CA GLY A 17 15.085 8.594 3.593 1.00 0.00 C ATOM 221 C GLY A 17 13.751 9.298 3.444 1.00 0.00 C ATOM 222 O GLY A 17 13.666 10.516 3.596 1.00 0.00 O ATOM 0 H GLY A 17 14.824 6.862 2.443 1.00 0.00 H new ATOM 0 HA2 GLY A 17 15.085 8.013 4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.877 9.338 3.685 1.00 0.00 H new ATOM 226 N GLU A 18 12.708 8.531 3.144 1.00 0.00 N ATOM 227 CA GLU A 18 11.373 9.090 2.971 1.00 0.00 C ATOM 228 C GLU A 18 10.338 8.279 3.746 1.00 0.00 C ATOM 229 O GLU A 18 10.659 7.250 4.342 1.00 0.00 O ATOM 230 CB GLU A 18 11.000 9.130 1.488 1.00 0.00 C ATOM 231 CG GLU A 18 11.400 10.420 0.794 1.00 0.00 C ATOM 232 CD GLU A 18 10.430 11.554 1.063 1.00 0.00 C ATOM 233 OE1 GLU A 18 9.290 11.492 0.557 1.00 0.00 O ATOM 234 OE2 GLU A 18 10.810 12.502 1.781 1.00 0.00 O ATOM 0 H GLU A 18 12.762 7.521 3.016 1.00 0.00 H new ATOM 0 HA GLU A 18 11.380 10.107 3.363 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.476 8.291 0.980 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.923 8.993 1.389 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.396 10.713 1.126 1.00 0.00 H new ATOM 0 HG3 GLU A 18 11.461 10.246 -0.280 1.00 0.00 H new ATOM 241 N HIS A 19 9.095 8.749 3.733 1.00 0.00 N ATOM 242 CA HIS A 19 8.012 8.068 4.434 1.00 0.00 C ATOM 243 C HIS A 19 6.688 8.254 3.700 1.00 0.00 C ATOM 244 O HIS A 19 6.373 9.350 3.234 1.00 0.00 O ATOM 245 CB HIS A 19 7.894 8.592 5.865 1.00 0.00 C ATOM 246 CG HIS A 19 8.884 7.985 6.810 1.00 0.00 C ATOM 247 ND1 HIS A 19 8.762 6.705 7.308 1.00 0.00 N ATOM 248 CD2 HIS A 19 10.020 8.488 7.346 1.00 0.00 C ATOM 249 CE1 HIS A 19 9.778 6.448 8.112 1.00 0.00 C ATOM 250 NE2 HIS A 19 10.557 7.514 8.151 1.00 0.00 N ATOM 0 H HIS A 19 8.812 9.599 3.245 1.00 0.00 H new ATOM 0 HA HIS A 19 8.244 7.003 4.463 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.027 9.674 5.859 1.00 0.00 H new ATOM 0 HB3 HIS A 19 6.887 8.396 6.233 1.00 0.00 H new ATOM 0 HD1 HIS A 19 8.005 6.057 7.090 1.00 0.00 H new ATOM 0 HD2 HIS A 19 10.428 9.473 7.173 1.00 0.00 H new ATOM 0 HE1 HIS A 19 9.944 5.524 8.646 1.00 0.00 H new ATOM 259 N LEU A 20 5.917 7.177 3.598 1.00 0.00 N ATOM 260 CA LEU A 20 4.626 7.221 2.920 1.00 0.00 C ATOM 261 C LEU A 20 3.520 7.645 3.881 1.00 0.00 C ATOM 262 O LEU A 20 2.821 8.629 3.642 1.00 0.00 O ATOM 263 CB LEU A 20 4.298 5.853 2.318 1.00 0.00 C ATOM 264 CG LEU A 20 5.013 5.506 1.011 1.00 0.00 C ATOM 265 CD1 LEU A 20 6.516 5.428 1.230 1.00 0.00 C ATOM 266 CD2 LEU A 20 4.485 4.195 0.447 1.00 0.00 C ATOM 0 H LEU A 20 6.163 6.262 3.976 1.00 0.00 H new ATOM 0 HA LEU A 20 4.688 7.958 2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.539 5.087 3.055 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.223 5.803 2.145 1.00 0.00 H new ATOM 0 HG LEU A 20 4.813 6.296 0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.008 5.180 0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.882 6.390 1.589 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.737 4.658 1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 20 5.005 3.963 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 20 4.655 3.394 1.167 1.00 0.00 H new ATOM 0 HD23 LEU A 20 3.416 4.287 0.252 1.00 0.00 H new ATOM 278 N GLY A 21 3.369 6.897 4.969 1.00 0.00 N ATOM 279 CA GLY A 21 2.348 7.213 5.951 1.00 0.00 C ATOM 280 C GLY A 21 1.143 6.299 5.848 1.00 0.00 C ATOM 281 O GLY A 21 0.073 6.718 5.406 1.00 0.00 O ATOM 0 H GLY A 21 3.935 6.078 5.188 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.774 7.136 6.951 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.029 8.247 5.819 1.00 0.00 H new ATOM 285 N VAL A 22 1.316 5.046 6.256 1.00 0.00 N ATOM 286 CA VAL A 22 0.234 4.070 6.207 1.00 0.00 C ATOM 287 C VAL A 22 0.330 3.084 7.366 1.00 0.00 C ATOM 288 O VAL A 22 1.401 2.887 7.942 1.00 0.00 O ATOM 289 CB VAL A 22 0.243 3.287 4.881 1.00 0.00 C ATOM 290 CG1 VAL A 22 -0.114 4.202 3.719 1.00 0.00 C ATOM 291 CG2 VAL A 22 1.598 2.633 4.658 1.00 0.00 C ATOM 0 H VAL A 22 2.195 4.683 6.624 1.00 0.00 H new ATOM 0 HA VAL A 22 -0.699 4.629 6.284 1.00 0.00 H new ATOM 0 HB VAL A 22 -0.509 2.500 4.938 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -0.103 3.632 2.790 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.109 4.619 3.877 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.613 5.012 3.657 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.586 2.084 3.716 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.371 3.401 4.621 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.809 1.945 5.477 1.00 0.00 H new ATOM 301 N THR A 23 -0.797 2.465 7.705 1.00 0.00 N ATOM 302 CA THR A 23 -0.840 1.500 8.796 1.00 0.00 C ATOM 303 C THR A 23 -1.387 0.159 8.322 1.00 0.00 C ATOM 304 O THR A 23 -2.540 0.060 7.902 1.00 0.00 O ATOM 305 CB THR A 23 -1.706 2.011 9.964 1.00 0.00 C ATOM 306 OG1 THR A 23 -2.995 2.406 9.482 1.00 0.00 O ATOM 307 CG2 THR A 23 -1.037 3.186 10.660 1.00 0.00 C ATOM 0 H THR A 23 -1.692 2.615 7.239 1.00 0.00 H new ATOM 0 HA THR A 23 0.185 1.369 9.143 1.00 0.00 H new ATOM 0 HB THR A 23 -1.821 1.201 10.684 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.975 3.353 9.232 1.00 0.00 H new ATOM 0 HG21 THR A 23 -1.667 3.529 11.481 1.00 0.00 H new ATOM 0 HG22 THR A 23 -0.069 2.874 11.052 1.00 0.00 H new ATOM 0 HG23 THR A 23 -0.895 3.998 9.947 1.00 0.00 H new ATOM 315 N PHE A 24 -0.553 -0.873 8.393 1.00 0.00 N ATOM 316 CA PHE A 24 -0.953 -2.210 7.970 1.00 0.00 C ATOM 317 C PHE A 24 -1.367 -3.059 9.169 1.00 0.00 C ATOM 318 O PHE A 24 -0.852 -2.885 10.273 1.00 0.00 O ATOM 319 CB PHE A 24 0.191 -2.894 7.218 1.00 0.00 C ATOM 320 CG PHE A 24 0.733 -2.078 6.080 1.00 0.00 C ATOM 321 CD1 PHE A 24 0.161 -2.156 4.820 1.00 0.00 C ATOM 322 CD2 PHE A 24 1.814 -1.232 6.269 1.00 0.00 C ATOM 323 CE1 PHE A 24 0.658 -1.406 3.771 1.00 0.00 C ATOM 324 CE2 PHE A 24 2.315 -0.480 5.224 1.00 0.00 C ATOM 325 CZ PHE A 24 1.736 -0.566 3.973 1.00 0.00 C ATOM 0 H PHE A 24 0.404 -0.809 8.740 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.810 -2.111 7.303 1.00 0.00 H new ATOM 0 HB2 PHE A 24 0.999 -3.108 7.918 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -0.159 -3.852 6.833 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -0.683 -2.810 4.656 1.00 0.00 H new ATOM 0 HD2 PHE A 24 2.270 -1.160 7.245 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.204 -1.477 2.794 1.00 0.00 H new ATOM 0 HE2 PHE A 24 3.159 0.175 5.385 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.125 0.022 3.155 1.00 0.00 H new ATOM 335 N ARG A 25 -2.302 -3.976 8.942 1.00 0.00 N ATOM 336 CA ARG A 25 -2.788 -4.850 10.003 1.00 0.00 C ATOM 337 C ARG A 25 -2.682 -6.315 9.591 1.00 0.00 C ATOM 338 O ARG A 25 -3.208 -6.719 8.554 1.00 0.00 O ATOM 339 CB ARG A 25 -4.239 -4.510 10.349 1.00 0.00 C ATOM 340 CG ARG A 25 -5.253 -5.143 9.412 1.00 0.00 C ATOM 341 CD ARG A 25 -6.580 -4.400 9.442 1.00 0.00 C ATOM 342 NE ARG A 25 -7.325 -4.660 10.670 1.00 0.00 N ATOM 343 CZ ARG A 25 -8.625 -4.421 10.806 1.00 0.00 C ATOM 344 NH1 ARG A 25 -9.319 -3.919 9.794 1.00 0.00 N ATOM 345 NH2 ARG A 25 -9.233 -4.684 11.955 1.00 0.00 N ATOM 0 H ARG A 25 -2.738 -4.133 8.033 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.165 -4.692 10.884 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.446 -4.836 11.368 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.364 -3.427 10.328 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -4.859 -5.145 8.396 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.411 -6.184 9.695 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -6.398 -3.329 9.348 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -7.182 -4.698 8.583 1.00 0.00 H new ATOM 0 HE ARG A 25 -6.820 -5.046 11.468 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -8.855 -3.715 8.909 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -10.317 -3.736 9.901 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -8.703 -5.070 12.736 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -10.231 -4.500 12.058 1.00 0.00 H new ATOM 359 N VAL A 26 -1.998 -7.107 10.411 1.00 0.00 N ATOM 360 CA VAL A 26 -1.824 -8.528 10.132 1.00 0.00 C ATOM 361 C VAL A 26 -2.904 -9.358 10.816 1.00 0.00 C ATOM 362 O VAL A 26 -2.812 -9.654 12.007 1.00 0.00 O ATOM 363 CB VAL A 26 -0.441 -9.024 10.594 1.00 0.00 C ATOM 364 CG1 VAL A 26 -0.167 -8.589 12.025 1.00 0.00 C ATOM 365 CG2 VAL A 26 -0.347 -10.537 10.461 1.00 0.00 C ATOM 0 H VAL A 26 -1.556 -6.789 11.273 1.00 0.00 H new ATOM 0 HA VAL A 26 -1.905 -8.652 9.052 1.00 0.00 H new ATOM 0 HB VAL A 26 0.319 -8.577 9.953 1.00 0.00 H new ATOM 0 HG11 VAL A 26 0.815 -8.949 12.333 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.190 -7.501 12.085 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.929 -9.005 12.684 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.637 -10.871 10.792 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -1.115 -11.005 11.077 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.495 -10.821 9.419 1.00 0.00 H new ATOM 375 N GLU A 27 -3.927 -9.732 10.053 1.00 0.00 N ATOM 376 CA GLU A 27 -5.025 -10.529 10.586 1.00 0.00 C ATOM 377 C GLU A 27 -4.627 -11.998 10.698 1.00 0.00 C ATOM 378 O GLU A 27 -4.624 -12.571 11.787 1.00 0.00 O ATOM 379 CB GLU A 27 -6.263 -10.391 9.698 1.00 0.00 C ATOM 380 CG GLU A 27 -6.649 -8.950 9.412 1.00 0.00 C ATOM 381 CD GLU A 27 -8.112 -8.800 9.043 1.00 0.00 C ATOM 382 OE1 GLU A 27 -8.438 -8.920 7.844 1.00 0.00 O ATOM 383 OE2 GLU A 27 -8.932 -8.562 9.955 1.00 0.00 O ATOM 0 H GLU A 27 -4.018 -9.496 9.065 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.259 -10.157 11.583 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.081 -10.904 8.754 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -7.102 -10.895 10.178 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -6.435 -8.340 10.289 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -6.032 -8.567 8.599 1.00 0.00 H new ATOM 390 N GLY A 28 -4.292 -12.603 9.562 1.00 0.00 N ATOM 391 CA GLY A 28 -3.898 -14.000 9.553 1.00 0.00 C ATOM 392 C GLY A 28 -2.479 -14.198 9.060 1.00 0.00 C ATOM 393 O GLY A 28 -1.551 -14.336 9.856 1.00 0.00 O ATOM 0 H GLY A 28 -4.286 -12.150 8.648 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -3.990 -14.407 10.560 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -4.582 -14.563 8.918 1.00 0.00 H new ATOM 397 N GLY A 29 -2.309 -14.216 7.741 1.00 0.00 N ATOM 398 CA GLY A 29 -0.990 -14.402 7.166 1.00 0.00 C ATOM 399 C GLY A 29 -0.699 -13.416 6.051 1.00 0.00 C ATOM 400 O GLY A 29 0.188 -13.644 5.229 1.00 0.00 O ATOM 0 H GLY A 29 -3.061 -14.105 7.061 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -0.238 -14.294 7.948 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -0.905 -15.418 6.780 1.00 0.00 H new ATOM 404 N GLU A 30 -1.450 -12.320 6.022 1.00 0.00 N ATOM 405 CA GLU A 30 -1.270 -11.298 4.997 1.00 0.00 C ATOM 406 C GLU A 30 -1.262 -9.903 5.615 1.00 0.00 C ATOM 407 O GLU A 30 -1.692 -9.713 6.754 1.00 0.00 O ATOM 408 CB GLU A 30 -2.378 -11.396 3.947 1.00 0.00 C ATOM 409 CG GLU A 30 -3.772 -11.183 4.511 1.00 0.00 C ATOM 410 CD GLU A 30 -4.797 -10.879 3.436 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.224 -11.822 2.739 1.00 0.00 O ATOM 412 OE2 GLU A 30 -5.171 -9.696 3.291 1.00 0.00 O ATOM 0 H GLU A 30 -2.188 -12.117 6.696 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.307 -11.469 4.516 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.194 -10.657 3.167 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -2.333 -12.377 3.474 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.079 -12.075 5.058 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.748 -10.362 5.227 1.00 0.00 H new ATOM 419 N LEU A 31 -0.769 -8.929 4.857 1.00 0.00 N ATOM 420 CA LEU A 31 -0.704 -7.551 5.329 1.00 0.00 C ATOM 421 C LEU A 31 -1.634 -6.653 4.519 1.00 0.00 C ATOM 422 O LEU A 31 -1.369 -6.360 3.353 1.00 0.00 O ATOM 423 CB LEU A 31 0.731 -7.029 5.243 1.00 0.00 C ATOM 424 CG LEU A 31 1.614 -7.287 6.465 1.00 0.00 C ATOM 425 CD1 LEU A 31 3.001 -6.700 6.255 1.00 0.00 C ATOM 426 CD2 LEU A 31 0.972 -6.710 7.718 1.00 0.00 C ATOM 0 H LEU A 31 -0.409 -9.069 3.913 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.028 -7.534 6.369 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.209 -7.480 4.373 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.695 -5.954 5.066 1.00 0.00 H new ATOM 0 HG LEU A 31 1.715 -8.364 6.596 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.615 -6.893 7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.463 -7.161 5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.921 -5.624 6.098 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.614 -6.903 8.578 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.841 -5.635 7.597 1.00 0.00 H new ATOM 0 HD23 LEU A 31 0.001 -7.179 7.878 1.00 0.00 H new ATOM 438 N VAL A 32 -2.722 -6.218 5.145 1.00 0.00 N ATOM 439 CA VAL A 32 -3.690 -5.350 4.483 1.00 0.00 C ATOM 440 C VAL A 32 -3.607 -3.926 5.019 1.00 0.00 C ATOM 441 O VAL A 32 -3.553 -3.709 6.230 1.00 0.00 O ATOM 442 CB VAL A 32 -5.127 -5.872 4.664 1.00 0.00 C ATOM 443 CG1 VAL A 32 -6.056 -5.246 3.635 1.00 0.00 C ATOM 444 CG2 VAL A 32 -5.158 -7.390 4.568 1.00 0.00 C ATOM 0 H VAL A 32 -2.956 -6.452 6.110 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.442 -5.351 3.422 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.477 -5.586 5.656 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -7.067 -5.627 3.778 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -6.056 -4.163 3.756 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.712 -5.499 2.632 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.181 -7.742 4.698 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.789 -7.700 3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -4.526 -7.817 5.347 1.00 0.00 H new ATOM 454 N ILE A 33 -3.598 -2.957 4.110 1.00 0.00 N ATOM 455 CA ILE A 33 -3.523 -1.552 4.492 1.00 0.00 C ATOM 456 C ILE A 33 -4.698 -1.161 5.382 1.00 0.00 C ATOM 457 O ILE A 33 -5.819 -0.985 4.906 1.00 0.00 O ATOM 458 CB ILE A 33 -3.503 -0.633 3.256 1.00 0.00 C ATOM 459 CG1 ILE A 33 -2.140 -0.703 2.564 1.00 0.00 C ATOM 460 CG2 ILE A 33 -3.828 0.799 3.655 1.00 0.00 C ATOM 461 CD1 ILE A 33 -2.076 0.084 1.274 1.00 0.00 C ATOM 0 H ILE A 33 -3.642 -3.119 3.104 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.592 -1.425 5.045 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.264 -0.975 2.554 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -1.376 -0.330 3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -1.900 -1.746 2.356 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -3.810 1.436 2.771 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.819 0.835 4.108 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -3.088 1.154 4.373 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.081 -0.011 0.839 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.817 -0.303 0.574 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.284 1.134 1.478 1.00 0.00 H new ATOM 473 N ALA A 34 -4.433 -1.026 6.677 1.00 0.00 N ATOM 474 CA ALA A 34 -5.467 -0.652 7.634 1.00 0.00 C ATOM 475 C ALA A 34 -5.964 0.767 7.379 1.00 0.00 C ATOM 476 O ALA A 34 -7.147 0.983 7.118 1.00 0.00 O ATOM 477 CB ALA A 34 -4.942 -0.782 9.056 1.00 0.00 C ATOM 0 H ALA A 34 -3.511 -1.170 7.088 1.00 0.00 H new ATOM 0 HA ALA A 34 -6.309 -1.332 7.506 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -5.725 -0.500 9.760 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.643 -1.814 9.241 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -4.082 -0.126 9.188 1.00 0.00 H new ATOM 483 N ARG A 35 -5.052 1.731 7.458 1.00 0.00 N ATOM 484 CA ARG A 35 -5.399 3.130 7.237 1.00 0.00 C ATOM 485 C ARG A 35 -4.258 3.870 6.546 1.00 0.00 C ATOM 486 O ARG A 35 -3.121 3.397 6.525 1.00 0.00 O ATOM 487 CB ARG A 35 -5.732 3.810 8.567 1.00 0.00 C ATOM 488 CG ARG A 35 -5.439 5.302 8.577 1.00 0.00 C ATOM 489 CD ARG A 35 -5.771 5.925 9.924 1.00 0.00 C ATOM 490 NE ARG A 35 -7.193 6.235 10.048 1.00 0.00 N ATOM 491 CZ ARG A 35 -7.800 7.189 9.352 1.00 0.00 C ATOM 492 NH1 ARG A 35 -7.113 7.923 8.486 1.00 0.00 N ATOM 493 NH2 ARG A 35 -9.097 7.411 9.520 1.00 0.00 N ATOM 0 H ARG A 35 -4.068 1.569 7.673 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.275 3.164 6.590 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -6.787 3.654 8.791 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -5.162 3.331 9.363 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -4.387 5.469 8.347 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -6.018 5.793 7.795 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -5.478 5.242 10.721 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -5.188 6.837 10.055 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.750 5.689 10.705 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -6.116 7.755 8.353 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.582 8.655 7.953 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -9.629 6.849 10.184 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -9.562 8.144 8.985 1.00 0.00 H new ATOM 507 N ILE A 36 -4.569 5.033 5.983 1.00 0.00 N ATOM 508 CA ILE A 36 -3.570 5.838 5.292 1.00 0.00 C ATOM 509 C ILE A 36 -3.559 7.270 5.816 1.00 0.00 C ATOM 510 O ILE A 36 -4.443 8.066 5.496 1.00 0.00 O ATOM 511 CB ILE A 36 -3.819 5.861 3.772 1.00 0.00 C ATOM 512 CG1 ILE A 36 -3.718 4.448 3.195 1.00 0.00 C ATOM 513 CG2 ILE A 36 -2.827 6.791 3.087 1.00 0.00 C ATOM 514 CD1 ILE A 36 -4.369 4.302 1.837 1.00 0.00 C ATOM 0 H ILE A 36 -5.505 5.438 5.992 1.00 0.00 H new ATOM 0 HA ILE A 36 -2.602 5.375 5.487 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.826 6.236 3.589 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.667 4.170 3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.182 3.747 3.889 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.015 6.797 2.013 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -2.943 7.801 3.481 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.812 6.442 3.275 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -4.259 3.275 1.489 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.428 4.548 1.913 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.889 4.978 1.129 1.00 0.00 H new ATOM 526 N LEU A 37 -2.554 7.592 6.622 1.00 0.00 N ATOM 527 CA LEU A 37 -2.426 8.929 7.190 1.00 0.00 C ATOM 528 C LEU A 37 -2.457 9.991 6.095 1.00 0.00 C ATOM 529 O LEU A 37 -1.742 9.890 5.098 1.00 0.00 O ATOM 530 CB LEU A 37 -1.127 9.043 7.990 1.00 0.00 C ATOM 531 CG LEU A 37 -1.217 8.673 9.471 1.00 0.00 C ATOM 532 CD1 LEU A 37 -1.294 7.164 9.640 1.00 0.00 C ATOM 533 CD2 LEU A 37 -0.028 9.237 10.235 1.00 0.00 C ATOM 0 H LEU A 37 -1.815 6.945 6.897 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.272 9.096 7.857 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.378 8.405 7.521 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.765 10.068 7.913 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.127 9.111 9.881 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.357 6.919 10.700 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.178 6.785 9.127 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.402 6.704 9.214 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.109 8.964 11.287 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.895 8.829 9.824 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.018 10.323 10.142 1.00 0.00 H new ATOM 545 N HIS A 38 -3.289 11.010 6.289 1.00 0.00 N ATOM 546 CA HIS A 38 -3.410 12.092 5.319 1.00 0.00 C ATOM 547 C HIS A 38 -2.113 12.889 5.229 1.00 0.00 C ATOM 548 O HIS A 38 -1.496 13.207 6.244 1.00 0.00 O ATOM 549 CB HIS A 38 -4.566 13.018 5.700 1.00 0.00 C ATOM 550 CG HIS A 38 -4.703 14.207 4.798 1.00 0.00 C ATOM 551 ND1 HIS A 38 -4.885 15.490 5.268 1.00 0.00 N ATOM 552 CD2 HIS A 38 -4.681 14.301 3.448 1.00 0.00 C ATOM 553 CE1 HIS A 38 -4.972 16.323 4.246 1.00 0.00 C ATOM 554 NE2 HIS A 38 -4.850 15.626 3.130 1.00 0.00 N ATOM 0 H HIS A 38 -3.889 11.109 7.108 1.00 0.00 H new ATOM 0 HA HIS A 38 -3.613 11.651 4.343 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -5.496 12.450 5.683 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -4.422 13.363 6.724 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -4.554 13.486 2.751 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -5.118 17.391 4.312 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -4.877 16.010 2.185 1.00 0.00 H new ATOM 563 N GLY A 39 -1.704 13.208 4.004 1.00 0.00 N ATOM 564 CA GLY A 39 -0.481 13.965 3.804 1.00 0.00 C ATOM 565 C GLY A 39 0.721 13.072 3.569 1.00 0.00 C ATOM 566 O GLY A 39 1.735 13.191 4.254 1.00 0.00 O ATOM 0 H GLY A 39 -2.197 12.956 3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.606 14.633 2.952 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.299 14.592 4.677 1.00 0.00 H new ATOM 570 N GLY A 40 0.607 12.172 2.596 1.00 0.00 N ATOM 571 CA GLY A 40 1.699 11.267 2.291 1.00 0.00 C ATOM 572 C GLY A 40 1.697 10.823 0.841 1.00 0.00 C ATOM 573 O GLY A 40 0.713 11.018 0.128 1.00 0.00 O ATOM 0 H GLY A 40 -0.222 12.054 2.014 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.646 11.757 2.516 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.632 10.391 2.936 1.00 0.00 H new ATOM 577 N MET A 41 2.801 10.227 0.405 1.00 0.00 N ATOM 578 CA MET A 41 2.922 9.755 -0.970 1.00 0.00 C ATOM 579 C MET A 41 1.619 9.118 -1.442 1.00 0.00 C ATOM 580 O MET A 41 0.881 9.704 -2.234 1.00 0.00 O ATOM 581 CB MET A 41 4.068 8.748 -1.087 1.00 0.00 C ATOM 582 CG MET A 41 4.121 8.042 -2.432 1.00 0.00 C ATOM 583 SD MET A 41 5.032 8.981 -3.673 1.00 0.00 S ATOM 584 CE MET A 41 6.704 8.837 -3.047 1.00 0.00 C ATOM 0 H MET A 41 3.625 10.059 0.983 1.00 0.00 H new ATOM 0 HA MET A 41 3.137 10.614 -1.606 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.013 9.264 -0.919 1.00 0.00 H new ATOM 0 HB3 MET A 41 3.968 8.002 -0.298 1.00 0.00 H new ATOM 0 HG2 MET A 41 4.587 7.065 -2.307 1.00 0.00 H new ATOM 0 HG3 MET A 41 3.105 7.868 -2.787 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.412 8.972 -3.865 1.00 0.00 H new ATOM 0 HE2 MET A 41 6.876 9.601 -2.289 1.00 0.00 H new ATOM 0 HE3 MET A 41 6.843 7.850 -2.605 1.00 0.00 H new ATOM 594 N VAL A 42 1.342 7.914 -0.952 1.00 0.00 N ATOM 595 CA VAL A 42 0.128 7.197 -1.323 1.00 0.00 C ATOM 596 C VAL A 42 -1.095 8.102 -1.226 1.00 0.00 C ATOM 597 O VAL A 42 -1.910 8.162 -2.147 1.00 0.00 O ATOM 598 CB VAL A 42 -0.090 5.961 -0.431 1.00 0.00 C ATOM 599 CG1 VAL A 42 -0.010 6.343 1.039 1.00 0.00 C ATOM 600 CG2 VAL A 42 -1.424 5.304 -0.749 1.00 0.00 C ATOM 0 H VAL A 42 1.943 7.414 -0.296 1.00 0.00 H new ATOM 0 HA VAL A 42 0.256 6.872 -2.355 1.00 0.00 H new ATOM 0 HB VAL A 42 0.701 5.241 -0.637 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -0.166 5.457 1.654 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.972 6.764 1.253 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -0.779 7.082 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.562 4.432 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.231 6.015 -0.572 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -1.437 4.993 -1.794 1.00 0.00 H new ATOM 610 N ALA A 43 -1.217 8.805 -0.105 1.00 0.00 N ATOM 611 CA ALA A 43 -2.340 9.709 0.111 1.00 0.00 C ATOM 612 C ALA A 43 -2.548 10.624 -1.091 1.00 0.00 C ATOM 613 O ALA A 43 -3.672 11.028 -1.387 1.00 0.00 O ATOM 614 CB ALA A 43 -2.118 10.533 1.371 1.00 0.00 C ATOM 0 H ALA A 43 -0.552 8.766 0.668 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.240 9.107 0.236 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -2.964 11.204 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.026 9.868 2.229 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.205 11.119 1.267 1.00 0.00 H new ATOM 620 N GLN A 44 -1.457 10.947 -1.779 1.00 0.00 N ATOM 621 CA GLN A 44 -1.522 11.815 -2.949 1.00 0.00 C ATOM 622 C GLN A 44 -2.009 11.045 -4.172 1.00 0.00 C ATOM 623 O GLN A 44 -2.801 11.557 -4.963 1.00 0.00 O ATOM 624 CB GLN A 44 -0.149 12.429 -3.231 1.00 0.00 C ATOM 625 CG GLN A 44 0.302 13.422 -2.172 1.00 0.00 C ATOM 626 CD GLN A 44 1.811 13.524 -2.073 1.00 0.00 C ATOM 627 OE1 GLN A 44 2.453 12.743 -1.370 1.00 0.00 O ATOM 628 NE2 GLN A 44 2.387 14.490 -2.779 1.00 0.00 N ATOM 0 H GLN A 44 -0.519 10.621 -1.547 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.233 12.614 -2.739 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.589 11.630 -3.306 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.176 12.930 -4.199 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -0.110 14.404 -2.401 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -0.103 13.124 -1.205 1.00 0.00 H new ATOM 0 HE21 GLN A 44 1.817 15.115 -3.348 1.00 0.00 H new ATOM 0 HE22 GLN A 44 3.400 14.607 -2.752 1.00 0.00 H new ATOM 637 N GLN A 45 -1.530 9.814 -4.320 1.00 0.00 N ATOM 638 CA GLN A 45 -1.917 8.975 -5.448 1.00 0.00 C ATOM 639 C GLN A 45 -3.218 8.235 -5.155 1.00 0.00 C ATOM 640 O GLN A 45 -3.513 7.908 -4.006 1.00 0.00 O ATOM 641 CB GLN A 45 -0.807 7.973 -5.769 1.00 0.00 C ATOM 642 CG GLN A 45 0.396 8.597 -6.457 1.00 0.00 C ATOM 643 CD GLN A 45 1.689 7.867 -6.149 1.00 0.00 C ATOM 644 OE1 GLN A 45 1.732 6.999 -5.276 1.00 0.00 O ATOM 645 NE2 GLN A 45 2.751 8.214 -6.865 1.00 0.00 N ATOM 0 H GLN A 45 -0.874 9.376 -3.674 1.00 0.00 H new ATOM 0 HA GLN A 45 -2.075 9.621 -6.312 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.480 7.497 -4.844 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -1.212 7.187 -6.406 1.00 0.00 H new ATOM 0 HG2 GLN A 45 0.233 8.599 -7.535 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.488 9.638 -6.146 1.00 0.00 H new ATOM 0 HE21 GLN A 45 2.670 8.938 -7.578 1.00 0.00 H new ATOM 0 HE22 GLN A 45 3.648 7.756 -6.702 1.00 0.00 H new ATOM 654 N GLY A 46 -3.994 7.975 -6.203 1.00 0.00 N ATOM 655 CA GLY A 46 -5.255 7.276 -6.037 1.00 0.00 C ATOM 656 C GLY A 46 -5.174 5.824 -6.467 1.00 0.00 C ATOM 657 O GLY A 46 -6.170 5.238 -6.891 1.00 0.00 O ATOM 0 H GLY A 46 -3.772 8.236 -7.164 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -5.560 7.326 -4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -6.026 7.781 -6.618 1.00 0.00 H new ATOM 661 N LEU A 47 -3.984 5.243 -6.358 1.00 0.00 N ATOM 662 CA LEU A 47 -3.776 3.850 -6.740 1.00 0.00 C ATOM 663 C LEU A 47 -4.058 2.916 -5.568 1.00 0.00 C ATOM 664 O LEU A 47 -4.831 1.964 -5.691 1.00 0.00 O ATOM 665 CB LEU A 47 -2.344 3.646 -7.237 1.00 0.00 C ATOM 666 CG LEU A 47 -1.871 4.601 -8.333 1.00 0.00 C ATOM 667 CD1 LEU A 47 -0.355 4.564 -8.456 1.00 0.00 C ATOM 668 CD2 LEU A 47 -2.524 4.252 -9.663 1.00 0.00 C ATOM 0 H LEU A 47 -3.149 5.714 -6.009 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.471 3.612 -7.545 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.669 3.739 -6.386 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.251 2.625 -7.608 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.168 5.613 -8.059 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.037 5.250 -9.241 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.094 4.863 -7.509 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -0.035 3.553 -8.706 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.176 4.942 -10.431 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.258 3.233 -9.943 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.607 4.331 -9.568 1.00 0.00 H new ATOM 680 N LEU A 48 -3.429 3.194 -4.432 1.00 0.00 N ATOM 681 CA LEU A 48 -3.614 2.380 -3.236 1.00 0.00 C ATOM 682 C LEU A 48 -4.737 2.936 -2.366 1.00 0.00 C ATOM 683 O LEU A 48 -5.042 4.128 -2.416 1.00 0.00 O ATOM 684 CB LEU A 48 -2.314 2.318 -2.431 1.00 0.00 C ATOM 685 CG LEU A 48 -1.027 2.184 -3.245 1.00 0.00 C ATOM 686 CD1 LEU A 48 0.162 2.706 -2.454 1.00 0.00 C ATOM 687 CD2 LEU A 48 -0.803 0.735 -3.654 1.00 0.00 C ATOM 0 H LEU A 48 -2.786 3.977 -4.314 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.888 1.373 -3.551 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.243 3.220 -1.823 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.375 1.474 -1.744 1.00 0.00 H new ATOM 0 HG LEU A 48 -1.128 2.785 -4.149 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.069 2.602 -3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.005 3.757 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.266 2.133 -1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.118 0.658 -4.233 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.724 0.113 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -1.642 0.394 -4.260 1.00 0.00 H new ATOM 699 N HIS A 49 -5.348 2.066 -1.569 1.00 0.00 N ATOM 700 CA HIS A 49 -6.436 2.471 -0.686 1.00 0.00 C ATOM 701 C HIS A 49 -6.686 1.416 0.387 1.00 0.00 C ATOM 702 O HIS A 49 -6.212 0.284 0.282 1.00 0.00 O ATOM 703 CB HIS A 49 -7.713 2.709 -1.491 1.00 0.00 C ATOM 704 CG HIS A 49 -8.257 1.468 -2.131 1.00 0.00 C ATOM 705 ND1 HIS A 49 -9.277 0.722 -1.579 1.00 0.00 N ATOM 706 CD2 HIS A 49 -7.919 0.846 -3.284 1.00 0.00 C ATOM 707 CE1 HIS A 49 -9.541 -0.308 -2.363 1.00 0.00 C ATOM 708 NE2 HIS A 49 -8.731 -0.255 -3.406 1.00 0.00 N ATOM 0 H HIS A 49 -5.108 1.076 -1.516 1.00 0.00 H new ATOM 0 HA HIS A 49 -6.146 3.401 -0.196 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.473 3.133 -0.835 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.512 3.449 -2.265 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -7.153 1.157 -3.979 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -10.291 -1.064 -2.182 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -8.712 -0.923 -4.176 1.00 0.00 H new ATOM 717 N VAL A 50 -7.432 1.794 1.420 1.00 0.00 N ATOM 718 CA VAL A 50 -7.746 0.881 2.512 1.00 0.00 C ATOM 719 C VAL A 50 -8.234 -0.463 1.982 1.00 0.00 C ATOM 720 O VAL A 50 -9.203 -0.529 1.228 1.00 0.00 O ATOM 721 CB VAL A 50 -8.818 1.471 3.448 1.00 0.00 C ATOM 722 CG1 VAL A 50 -9.194 0.469 4.529 1.00 0.00 C ATOM 723 CG2 VAL A 50 -8.328 2.773 4.064 1.00 0.00 C ATOM 0 H VAL A 50 -7.830 2.727 1.523 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.824 0.734 3.075 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.710 1.686 2.860 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.952 0.904 5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -9.589 -0.435 4.066 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -8.311 0.219 5.117 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.097 3.176 4.722 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.421 2.585 4.638 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.114 3.492 3.273 1.00 0.00 H new ATOM 733 N GLY A 51 -7.555 -1.533 2.384 1.00 0.00 N ATOM 734 CA GLY A 51 -7.934 -2.862 1.940 1.00 0.00 C ATOM 735 C GLY A 51 -6.892 -3.491 1.037 1.00 0.00 C ATOM 736 O GLY A 51 -6.914 -4.699 0.799 1.00 0.00 O ATOM 0 H GLY A 51 -6.749 -1.503 3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.091 -3.501 2.809 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -8.885 -2.807 1.409 1.00 0.00 H new ATOM 740 N ASP A 52 -5.977 -2.671 0.531 1.00 0.00 N ATOM 741 CA ASP A 52 -4.921 -3.154 -0.351 1.00 0.00 C ATOM 742 C ASP A 52 -4.089 -4.232 0.336 1.00 0.00 C ATOM 743 O ASP A 52 -3.710 -4.089 1.499 1.00 0.00 O ATOM 744 CB ASP A 52 -4.022 -1.997 -0.787 1.00 0.00 C ATOM 745 CG ASP A 52 -4.646 -1.160 -1.886 1.00 0.00 C ATOM 746 OD1 ASP A 52 -5.880 -0.974 -1.861 1.00 0.00 O ATOM 747 OD2 ASP A 52 -3.900 -0.691 -2.771 1.00 0.00 O ATOM 0 H ASP A 52 -5.945 -1.669 0.717 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.390 -3.591 -1.233 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -3.810 -1.362 0.073 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -3.068 -2.393 -1.134 1.00 0.00 H new ATOM 752 N ILE A 53 -3.808 -5.309 -0.390 1.00 0.00 N ATOM 753 CA ILE A 53 -3.020 -6.409 0.151 1.00 0.00 C ATOM 754 C ILE A 53 -1.670 -6.515 -0.550 1.00 0.00 C ATOM 755 O ILE A 53 -1.601 -6.600 -1.776 1.00 0.00 O ATOM 756 CB ILE A 53 -3.762 -7.752 0.016 1.00 0.00 C ATOM 757 CG1 ILE A 53 -5.215 -7.605 0.472 1.00 0.00 C ATOM 758 CG2 ILE A 53 -3.055 -8.832 0.821 1.00 0.00 C ATOM 759 CD1 ILE A 53 -6.020 -8.880 0.345 1.00 0.00 C ATOM 0 H ILE A 53 -4.114 -5.443 -1.354 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.862 -6.194 1.208 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.758 -8.048 -1.033 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -5.230 -7.278 1.512 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -5.694 -6.822 -0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.592 -9.775 0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.036 -8.951 0.453 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.030 -8.545 1.872 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -7.040 -8.702 0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -6.036 -9.198 -0.698 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -5.565 -9.660 0.955 1.00 0.00 H new ATOM 771 N ILE A 54 -0.599 -6.511 0.238 1.00 0.00 N ATOM 772 CA ILE A 54 0.749 -6.609 -0.307 1.00 0.00 C ATOM 773 C ILE A 54 1.242 -8.052 -0.299 1.00 0.00 C ATOM 774 O ILE A 54 1.014 -8.792 0.659 1.00 0.00 O ATOM 775 CB ILE A 54 1.741 -5.735 0.484 1.00 0.00 C ATOM 776 CG1 ILE A 54 1.192 -4.316 0.640 1.00 0.00 C ATOM 777 CG2 ILE A 54 3.095 -5.712 -0.208 1.00 0.00 C ATOM 778 CD1 ILE A 54 2.017 -3.446 1.562 1.00 0.00 C ATOM 0 H ILE A 54 -0.639 -6.441 1.255 1.00 0.00 H new ATOM 0 HA ILE A 54 0.700 -6.250 -1.335 1.00 0.00 H new ATOM 0 HB ILE A 54 1.870 -6.165 1.477 1.00 0.00 H new ATOM 0 HG12 ILE A 54 1.141 -3.845 -0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.172 -4.370 1.021 1.00 0.00 H new ATOM 0 HG21 ILE A 54 3.785 -5.090 0.363 1.00 0.00 H new ATOM 0 HG22 ILE A 54 3.488 -6.727 -0.272 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.984 -5.302 -1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.568 -2.455 1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.047 -3.894 2.555 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.031 -3.361 1.172 1.00 0.00 H new ATOM 790 N LYS A 55 1.919 -8.446 -1.372 1.00 0.00 N ATOM 791 CA LYS A 55 2.448 -9.800 -1.488 1.00 0.00 C ATOM 792 C LYS A 55 3.973 -9.791 -1.484 1.00 0.00 C ATOM 793 O LYS A 55 4.603 -10.398 -0.619 1.00 0.00 O ATOM 794 CB LYS A 55 1.935 -10.461 -2.770 1.00 0.00 C ATOM 795 CG LYS A 55 2.643 -11.762 -3.108 1.00 0.00 C ATOM 796 CD LYS A 55 2.089 -12.924 -2.300 1.00 0.00 C ATOM 797 CE LYS A 55 0.893 -13.561 -2.989 1.00 0.00 C ATOM 798 NZ LYS A 55 0.538 -14.874 -2.382 1.00 0.00 N ATOM 0 H LYS A 55 2.114 -7.847 -2.174 1.00 0.00 H new ATOM 0 HA LYS A 55 2.104 -10.373 -0.627 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.867 -10.654 -2.667 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.055 -9.765 -3.601 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.532 -11.972 -4.172 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.710 -11.658 -2.913 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.868 -13.672 -2.155 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.796 -12.574 -1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.037 -12.889 -2.927 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.114 -13.698 -4.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.282 -15.276 -2.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.346 -15.524 -2.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.302 -14.740 -1.378 1.00 0.00 H new ATOM 812 N GLU A 56 4.560 -9.096 -2.454 1.00 0.00 N ATOM 813 CA GLU A 56 6.011 -9.008 -2.559 1.00 0.00 C ATOM 814 C GLU A 56 6.445 -7.594 -2.934 1.00 0.00 C ATOM 815 O GLU A 56 5.735 -6.883 -3.645 1.00 0.00 O ATOM 816 CB GLU A 56 6.531 -10.005 -3.598 1.00 0.00 C ATOM 817 CG GLU A 56 7.860 -9.603 -4.215 1.00 0.00 C ATOM 818 CD GLU A 56 7.696 -8.660 -5.390 1.00 0.00 C ATOM 819 OE1 GLU A 56 7.567 -9.151 -6.532 1.00 0.00 O ATOM 820 OE2 GLU A 56 7.697 -7.430 -5.170 1.00 0.00 O ATOM 0 H GLU A 56 4.053 -8.586 -3.177 1.00 0.00 H new ATOM 0 HA GLU A 56 6.435 -9.254 -1.585 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.639 -10.983 -3.129 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.790 -10.111 -4.390 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.480 -9.126 -3.455 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.389 -10.498 -4.543 1.00 0.00 H new ATOM 827 N VAL A 57 7.615 -7.192 -2.449 1.00 0.00 N ATOM 828 CA VAL A 57 8.145 -5.864 -2.733 1.00 0.00 C ATOM 829 C VAL A 57 9.515 -5.948 -3.398 1.00 0.00 C ATOM 830 O VAL A 57 10.430 -6.584 -2.877 1.00 0.00 O ATOM 831 CB VAL A 57 8.261 -5.020 -1.450 1.00 0.00 C ATOM 832 CG1 VAL A 57 8.724 -3.609 -1.778 1.00 0.00 C ATOM 833 CG2 VAL A 57 6.933 -4.995 -0.708 1.00 0.00 C ATOM 0 H VAL A 57 8.214 -7.767 -1.857 1.00 0.00 H new ATOM 0 HA VAL A 57 7.443 -5.383 -3.414 1.00 0.00 H new ATOM 0 HB VAL A 57 9.006 -5.479 -0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.800 -3.028 -0.859 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.699 -3.650 -2.263 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.005 -3.137 -2.447 1.00 0.00 H new ATOM 0 HG21 VAL A 57 7.033 -4.394 0.196 1.00 0.00 H new ATOM 0 HG22 VAL A 57 6.166 -4.561 -1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.648 -6.012 -0.438 1.00 0.00 H new ATOM 843 N ASN A 58 9.647 -5.303 -4.552 1.00 0.00 N ATOM 844 CA ASN A 58 10.906 -5.305 -5.288 1.00 0.00 C ATOM 845 C ASN A 58 11.595 -6.662 -5.185 1.00 0.00 C ATOM 846 O ASN A 58 12.808 -6.742 -5.000 1.00 0.00 O ATOM 847 CB ASN A 58 11.833 -4.209 -4.759 1.00 0.00 C ATOM 848 CG ASN A 58 12.075 -4.327 -3.266 1.00 0.00 C ATOM 849 OD1 ASN A 58 12.624 -5.322 -2.792 1.00 0.00 O ATOM 850 ND2 ASN A 58 11.664 -3.310 -2.518 1.00 0.00 N ATOM 0 H ASN A 58 8.898 -4.773 -4.998 1.00 0.00 H new ATOM 0 HA ASN A 58 10.684 -5.109 -6.337 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.787 -4.259 -5.284 1.00 0.00 H new ATOM 0 HB3 ASN A 58 11.399 -3.233 -4.978 1.00 0.00 H new ATOM 0 HD21 ASN A 58 11.799 -3.333 -1.507 1.00 0.00 H new ATOM 0 HD22 ASN A 58 11.214 -2.505 -2.954 1.00 0.00 H new ATOM 857 N GLY A 59 10.810 -7.729 -5.307 1.00 0.00 N ATOM 858 CA GLY A 59 11.361 -9.069 -5.225 1.00 0.00 C ATOM 859 C GLY A 59 11.830 -9.418 -3.826 1.00 0.00 C ATOM 860 O GLY A 59 12.863 -10.064 -3.655 1.00 0.00 O ATOM 0 H GLY A 59 9.803 -7.689 -5.461 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.607 -9.789 -5.542 1.00 0.00 H new ATOM 0 HA3 GLY A 59 12.198 -9.158 -5.918 1.00 0.00 H new ATOM 864 N GLN A 60 11.069 -8.990 -2.824 1.00 0.00 N ATOM 865 CA GLN A 60 11.414 -9.260 -1.434 1.00 0.00 C ATOM 866 C GLN A 60 10.160 -9.478 -0.594 1.00 0.00 C ATOM 867 O GLN A 60 9.154 -8.783 -0.744 1.00 0.00 O ATOM 868 CB GLN A 60 12.234 -8.105 -0.856 1.00 0.00 C ATOM 869 CG GLN A 60 12.028 -7.899 0.636 1.00 0.00 C ATOM 870 CD GLN A 60 13.245 -7.302 1.315 1.00 0.00 C ATOM 871 OE1 GLN A 60 14.278 -7.957 1.454 1.00 0.00 O ATOM 872 NE2 GLN A 60 13.129 -6.050 1.745 1.00 0.00 N ATOM 0 H GLN A 60 10.210 -8.455 -2.949 1.00 0.00 H new ATOM 0 HA GLN A 60 12.012 -10.171 -1.405 1.00 0.00 H new ATOM 0 HB2 GLN A 60 13.291 -8.290 -1.046 1.00 0.00 H new ATOM 0 HB3 GLN A 60 11.972 -7.186 -1.381 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.171 -7.245 0.794 1.00 0.00 H new ATOM 0 HG3 GLN A 60 11.789 -8.855 1.102 1.00 0.00 H new ATOM 0 HE21 GLN A 60 12.254 -5.543 1.609 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.915 -5.596 2.211 1.00 0.00 H new ATOM 881 N PRO A 61 10.218 -10.465 0.312 1.00 0.00 N ATOM 882 CA PRO A 61 9.095 -10.797 1.194 1.00 0.00 C ATOM 883 C PRO A 61 8.842 -9.719 2.242 1.00 0.00 C ATOM 884 O PRO A 61 9.775 -9.220 2.872 1.00 0.00 O ATOM 885 CB PRO A 61 9.543 -12.099 1.864 1.00 0.00 C ATOM 886 CG PRO A 61 11.031 -12.057 1.816 1.00 0.00 C ATOM 887 CD PRO A 61 11.384 -11.333 0.545 1.00 0.00 C ATOM 0 HA PRO A 61 8.158 -10.884 0.645 1.00 0.00 H new ATOM 0 HB2 PRO A 61 9.182 -12.161 2.890 1.00 0.00 H new ATOM 0 HB3 PRO A 61 9.154 -12.970 1.336 1.00 0.00 H new ATOM 0 HG2 PRO A 61 11.435 -11.539 2.686 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.450 -13.063 1.821 1.00 0.00 H new ATOM 0 HD2 PRO A 61 12.301 -10.754 0.654 1.00 0.00 H new ATOM 0 HD3 PRO A 61 11.541 -12.026 -0.282 1.00 0.00 H new ATOM 895 N VAL A 62 7.574 -9.363 2.424 1.00 0.00 N ATOM 896 CA VAL A 62 7.198 -8.344 3.397 1.00 0.00 C ATOM 897 C VAL A 62 7.054 -8.942 4.791 1.00 0.00 C ATOM 898 O VAL A 62 7.257 -8.260 5.795 1.00 0.00 O ATOM 899 CB VAL A 62 5.877 -7.655 3.007 1.00 0.00 C ATOM 900 CG1 VAL A 62 5.972 -7.073 1.605 1.00 0.00 C ATOM 901 CG2 VAL A 62 4.717 -8.634 3.109 1.00 0.00 C ATOM 0 H VAL A 62 6.790 -9.765 1.910 1.00 0.00 H new ATOM 0 HA VAL A 62 7.997 -7.603 3.403 1.00 0.00 H new ATOM 0 HB VAL A 62 5.695 -6.836 3.703 1.00 0.00 H new ATOM 0 HG11 VAL A 62 5.029 -6.590 1.347 1.00 0.00 H new ATOM 0 HG12 VAL A 62 6.777 -6.339 1.569 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.178 -7.872 0.893 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.791 -8.131 2.830 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.890 -9.475 2.437 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.638 -8.999 4.133 1.00 0.00 H new ATOM 911 N GLY A 63 6.703 -10.224 4.846 1.00 0.00 N ATOM 912 CA GLY A 63 6.538 -10.893 6.123 1.00 0.00 C ATOM 913 C GLY A 63 5.195 -10.601 6.762 1.00 0.00 C ATOM 914 O GLY A 63 4.252 -10.195 6.083 1.00 0.00 O ATOM 0 H GLY A 63 6.530 -10.810 4.029 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.644 -11.969 5.982 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.334 -10.580 6.799 1.00 0.00 H new ATOM 918 N SER A 64 5.107 -10.809 8.072 1.00 0.00 N ATOM 919 CA SER A 64 3.868 -10.570 8.802 1.00 0.00 C ATOM 920 C SER A 64 3.951 -9.276 9.606 1.00 0.00 C ATOM 921 O SER A 64 3.021 -8.469 9.602 1.00 0.00 O ATOM 922 CB SER A 64 3.566 -11.745 9.735 1.00 0.00 C ATOM 923 OG SER A 64 3.496 -12.963 9.015 1.00 0.00 O ATOM 0 H SER A 64 5.879 -11.142 8.649 1.00 0.00 H new ATOM 0 HA SER A 64 3.061 -10.475 8.076 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.340 -11.815 10.499 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.622 -11.570 10.252 1.00 0.00 H new ATOM 0 HG SER A 64 3.304 -13.698 9.634 1.00 0.00 H new ATOM 929 N ASP A 65 5.072 -9.086 10.294 1.00 0.00 N ATOM 930 CA ASP A 65 5.279 -7.890 11.102 1.00 0.00 C ATOM 931 C ASP A 65 5.070 -6.629 10.270 1.00 0.00 C ATOM 932 O ASP A 65 5.880 -6.281 9.410 1.00 0.00 O ATOM 933 CB ASP A 65 6.685 -7.892 11.703 1.00 0.00 C ATOM 934 CG ASP A 65 6.757 -7.128 13.010 1.00 0.00 C ATOM 935 OD1 ASP A 65 6.490 -7.736 14.068 1.00 0.00 O ATOM 936 OD2 ASP A 65 7.081 -5.922 12.976 1.00 0.00 O ATOM 0 H ASP A 65 5.851 -9.745 10.308 1.00 0.00 H new ATOM 0 HA ASP A 65 4.547 -7.896 11.910 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.005 -8.921 11.869 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.382 -7.453 10.990 1.00 0.00 H new ATOM 941 N PRO A 66 3.957 -5.926 10.529 1.00 0.00 N ATOM 942 CA PRO A 66 3.615 -4.693 9.814 1.00 0.00 C ATOM 943 C PRO A 66 4.545 -3.538 10.172 1.00 0.00 C ATOM 944 O PRO A 66 4.956 -2.768 9.304 1.00 0.00 O ATOM 945 CB PRO A 66 2.188 -4.395 10.282 1.00 0.00 C ATOM 946 CG PRO A 66 2.082 -5.054 11.615 1.00 0.00 C ATOM 947 CD PRO A 66 2.947 -6.281 11.540 1.00 0.00 C ATOM 0 HA PRO A 66 3.709 -4.809 8.734 1.00 0.00 H new ATOM 0 HB2 PRO A 66 2.011 -3.322 10.355 1.00 0.00 H new ATOM 0 HB3 PRO A 66 1.451 -4.792 9.584 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.419 -4.387 12.408 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.048 -5.318 11.839 1.00 0.00 H new ATOM 0 HD2 PRO A 66 3.405 -6.509 12.502 1.00 0.00 H new ATOM 0 HD3 PRO A 66 2.374 -7.159 11.244 1.00 0.00 H new ATOM 955 N ARG A 67 4.873 -3.425 11.455 1.00 0.00 N ATOM 956 CA ARG A 67 5.754 -2.364 11.927 1.00 0.00 C ATOM 957 C ARG A 67 7.122 -2.454 11.258 1.00 0.00 C ATOM 958 O ARG A 67 7.785 -1.441 11.038 1.00 0.00 O ATOM 959 CB ARG A 67 5.912 -2.442 13.447 1.00 0.00 C ATOM 960 CG ARG A 67 4.597 -2.625 14.188 1.00 0.00 C ATOM 961 CD ARG A 67 4.644 -1.995 15.571 1.00 0.00 C ATOM 962 NE ARG A 67 5.650 -2.622 16.424 1.00 0.00 N ATOM 963 CZ ARG A 67 5.851 -2.284 17.693 1.00 0.00 C ATOM 964 NH1 ARG A 67 5.119 -1.331 18.253 1.00 0.00 N ATOM 965 NH2 ARG A 67 6.786 -2.901 18.405 1.00 0.00 N ATOM 0 H ARG A 67 4.542 -4.055 12.186 1.00 0.00 H new ATOM 0 HA ARG A 67 5.302 -1.408 11.663 1.00 0.00 H new ATOM 0 HB2 ARG A 67 6.576 -3.271 13.693 1.00 0.00 H new ATOM 0 HB3 ARG A 67 6.395 -1.531 13.801 1.00 0.00 H new ATOM 0 HG2 ARG A 67 3.788 -2.178 13.611 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.374 -3.688 14.279 1.00 0.00 H new ATOM 0 HD2 ARG A 67 4.860 -0.931 15.477 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.665 -2.081 16.042 1.00 0.00 H new ATOM 0 HE ARG A 67 6.230 -3.360 16.024 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.399 -0.855 17.709 1.00 0.00 H new ATOM 0 HH12 ARG A 67 5.276 -1.074 19.228 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.351 -3.635 17.978 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.940 -2.641 19.379 1.00 0.00 H new ATOM 979 N ALA A 68 7.538 -3.675 10.937 1.00 0.00 N ATOM 980 CA ALA A 68 8.826 -3.898 10.291 1.00 0.00 C ATOM 981 C ALA A 68 8.750 -3.599 8.798 1.00 0.00 C ATOM 982 O ALA A 68 9.770 -3.363 8.149 1.00 0.00 O ATOM 983 CB ALA A 68 9.291 -5.328 10.522 1.00 0.00 C ATOM 0 H ALA A 68 7.002 -4.525 11.114 1.00 0.00 H new ATOM 0 HA ALA A 68 9.551 -3.216 10.735 1.00 0.00 H new ATOM 0 HB1 ALA A 68 10.254 -5.481 10.034 1.00 0.00 H new ATOM 0 HB2 ALA A 68 9.393 -5.509 11.592 1.00 0.00 H new ATOM 0 HB3 ALA A 68 8.559 -6.020 10.105 1.00 0.00 H new ATOM 989 N LEU A 69 7.537 -3.610 8.258 1.00 0.00 N ATOM 990 CA LEU A 69 7.328 -3.341 6.839 1.00 0.00 C ATOM 991 C LEU A 69 7.403 -1.845 6.552 1.00 0.00 C ATOM 992 O LEU A 69 8.185 -1.404 5.710 1.00 0.00 O ATOM 993 CB LEU A 69 5.973 -3.890 6.389 1.00 0.00 C ATOM 994 CG LEU A 69 5.296 -3.147 5.237 1.00 0.00 C ATOM 995 CD1 LEU A 69 6.100 -3.304 3.956 1.00 0.00 C ATOM 996 CD2 LEU A 69 3.873 -3.649 5.041 1.00 0.00 C ATOM 0 H LEU A 69 6.683 -3.802 8.781 1.00 0.00 H new ATOM 0 HA LEU A 69 8.119 -3.840 6.280 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.105 -4.931 6.095 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.298 -3.883 7.245 1.00 0.00 H new ATOM 0 HG LEU A 69 5.254 -2.087 5.488 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.603 -2.769 3.147 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.100 -2.895 4.102 1.00 0.00 H new ATOM 0 HD13 LEU A 69 6.174 -4.361 3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.407 -3.109 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.891 -4.715 4.812 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.300 -3.484 5.953 1.00 0.00 H new ATOM 1008 N GLN A 70 6.588 -1.070 7.260 1.00 0.00 N ATOM 1009 CA GLN A 70 6.564 0.377 7.082 1.00 0.00 C ATOM 1010 C GLN A 70 7.974 0.956 7.141 1.00 0.00 C ATOM 1011 O GLN A 70 8.227 2.050 6.638 1.00 0.00 O ATOM 1012 CB GLN A 70 5.687 1.030 8.152 1.00 0.00 C ATOM 1013 CG GLN A 70 4.199 0.803 7.940 1.00 0.00 C ATOM 1014 CD GLN A 70 3.358 1.340 9.081 1.00 0.00 C ATOM 1015 OE1 GLN A 70 3.597 2.440 9.579 1.00 0.00 O ATOM 1016 NE2 GLN A 70 2.366 0.563 9.502 1.00 0.00 N ATOM 0 H GLN A 70 5.936 -1.420 7.962 1.00 0.00 H new ATOM 0 HA GLN A 70 6.144 0.590 6.099 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.970 0.640 9.130 1.00 0.00 H new ATOM 0 HB3 GLN A 70 5.884 2.102 8.167 1.00 0.00 H new ATOM 0 HG2 GLN A 70 3.891 1.282 7.010 1.00 0.00 H new ATOM 0 HG3 GLN A 70 4.011 -0.265 7.826 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.204 -0.342 9.060 1.00 0.00 H new ATOM 0 HE22 GLN A 70 1.766 0.871 10.267 1.00 0.00 H new ATOM 1025 N GLU A 71 8.888 0.214 7.759 1.00 0.00 N ATOM 1026 CA GLU A 71 10.272 0.656 7.885 1.00 0.00 C ATOM 1027 C GLU A 71 11.079 0.273 6.648 1.00 0.00 C ATOM 1028 O GLU A 71 11.989 0.995 6.238 1.00 0.00 O ATOM 1029 CB GLU A 71 10.913 0.049 9.134 1.00 0.00 C ATOM 1030 CG GLU A 71 12.415 0.262 9.212 1.00 0.00 C ATOM 1031 CD GLU A 71 12.784 1.616 9.786 1.00 0.00 C ATOM 1032 OE1 GLU A 71 12.596 2.630 9.082 1.00 0.00 O ATOM 1033 OE2 GLU A 71 13.259 1.661 10.940 1.00 0.00 O ATOM 0 H GLU A 71 8.695 -0.695 8.180 1.00 0.00 H new ATOM 0 HA GLU A 71 10.273 1.742 7.977 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.447 0.483 10.019 1.00 0.00 H new ATOM 0 HB3 GLU A 71 10.705 -1.021 9.156 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.858 -0.522 9.827 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.844 0.165 8.215 1.00 0.00 H new ATOM 1040 N LEU A 72 10.741 -0.868 6.058 1.00 0.00 N ATOM 1041 CA LEU A 72 11.434 -1.349 4.868 1.00 0.00 C ATOM 1042 C LEU A 72 11.352 -0.326 3.739 1.00 0.00 C ATOM 1043 O LEU A 72 12.319 -0.116 3.007 1.00 0.00 O ATOM 1044 CB LEU A 72 10.836 -2.680 4.409 1.00 0.00 C ATOM 1045 CG LEU A 72 9.686 -2.590 3.405 1.00 0.00 C ATOM 1046 CD1 LEU A 72 10.212 -2.245 2.020 1.00 0.00 C ATOM 1047 CD2 LEU A 72 8.904 -3.894 3.371 1.00 0.00 C ATOM 0 H LEU A 72 9.991 -1.478 6.384 1.00 0.00 H new ATOM 0 HA LEU A 72 12.483 -1.497 5.124 1.00 0.00 H new ATOM 0 HB2 LEU A 72 11.632 -3.279 3.966 1.00 0.00 H new ATOM 0 HB3 LEU A 72 10.483 -3.219 5.288 1.00 0.00 H new ATOM 0 HG LEU A 72 9.013 -1.794 3.724 1.00 0.00 H new ATOM 0 HD11 LEU A 72 9.379 -2.185 1.319 1.00 0.00 H new ATOM 0 HD12 LEU A 72 10.726 -1.285 2.055 1.00 0.00 H new ATOM 0 HD13 LEU A 72 10.908 -3.017 1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.090 -3.811 2.651 1.00 0.00 H new ATOM 0 HD22 LEU A 72 9.567 -4.708 3.077 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.494 -4.098 4.360 1.00 0.00 H new ATOM 1059 N LEU A 73 10.193 0.309 3.606 1.00 0.00 N ATOM 1060 CA LEU A 73 9.985 1.313 2.568 1.00 0.00 C ATOM 1061 C LEU A 73 10.882 2.525 2.796 1.00 0.00 C ATOM 1062 O LEU A 73 11.489 3.045 1.860 1.00 0.00 O ATOM 1063 CB LEU A 73 8.519 1.747 2.538 1.00 0.00 C ATOM 1064 CG LEU A 73 7.510 0.677 2.117 1.00 0.00 C ATOM 1065 CD1 LEU A 73 6.167 0.917 2.788 1.00 0.00 C ATOM 1066 CD2 LEU A 73 7.356 0.655 0.603 1.00 0.00 C ATOM 0 H LEU A 73 9.383 0.147 4.204 1.00 0.00 H new ATOM 0 HA LEU A 73 10.245 0.867 1.608 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.246 2.104 3.531 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.425 2.594 1.858 1.00 0.00 H new ATOM 0 HG LEU A 73 7.885 -0.295 2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 73 5.462 0.146 2.477 1.00 0.00 H new ATOM 0 HD12 LEU A 73 6.290 0.881 3.870 1.00 0.00 H new ATOM 0 HD13 LEU A 73 5.785 1.896 2.498 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.634 -0.112 0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 73 7.004 1.628 0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.319 0.434 0.143 1.00 0.00 H new ATOM 1078 N ARG A 74 10.962 2.969 4.046 1.00 0.00 N ATOM 1079 CA ARG A 74 11.785 4.120 4.397 1.00 0.00 C ATOM 1080 C ARG A 74 13.193 3.974 3.827 1.00 0.00 C ATOM 1081 O ARG A 74 13.686 4.860 3.130 1.00 0.00 O ATOM 1082 CB ARG A 74 11.853 4.281 5.917 1.00 0.00 C ATOM 1083 CG ARG A 74 12.617 5.516 6.365 1.00 0.00 C ATOM 1084 CD ARG A 74 12.922 5.473 7.854 1.00 0.00 C ATOM 1085 NE ARG A 74 13.930 6.458 8.235 1.00 0.00 N ATOM 1086 CZ ARG A 74 15.224 6.329 7.965 1.00 0.00 C ATOM 1087 NH1 ARG A 74 15.665 5.261 7.314 1.00 0.00 N ATOM 1088 NH2 ARG A 74 16.080 7.269 8.344 1.00 0.00 N ATOM 0 H ARG A 74 10.467 2.549 4.833 1.00 0.00 H new ATOM 0 HA ARG A 74 11.326 5.009 3.965 1.00 0.00 H new ATOM 0 HB2 ARG A 74 10.839 4.327 6.315 1.00 0.00 H new ATOM 0 HB3 ARG A 74 12.324 3.397 6.347 1.00 0.00 H new ATOM 0 HG2 ARG A 74 13.548 5.592 5.804 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.034 6.408 6.138 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.006 5.655 8.417 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.269 4.476 8.124 1.00 0.00 H new ATOM 0 HE ARG A 74 13.623 7.292 8.736 1.00 0.00 H new ATOM 0 HH11 ARG A 74 15.010 4.537 7.020 1.00 0.00 H new ATOM 0 HH12 ARG A 74 16.659 5.164 7.108 1.00 0.00 H new ATOM 0 HH21 ARG A 74 15.745 8.093 8.844 1.00 0.00 H new ATOM 0 HH22 ARG A 74 17.073 7.168 8.136 1.00 0.00 H new ATOM 1102 N ASN A 75 13.836 2.851 4.130 1.00 0.00 N ATOM 1103 CA ASN A 75 15.187 2.589 3.649 1.00 0.00 C ATOM 1104 C ASN A 75 15.187 2.308 2.150 1.00 0.00 C ATOM 1105 O ASN A 75 16.044 2.798 1.415 1.00 0.00 O ATOM 1106 CB ASN A 75 15.799 1.406 4.401 1.00 0.00 C ATOM 1107 CG ASN A 75 15.490 0.077 3.737 1.00 0.00 C ATOM 1108 OD1 ASN A 75 15.970 -0.207 2.640 1.00 0.00 O ATOM 1109 ND2 ASN A 75 14.685 -0.743 4.402 1.00 0.00 N ATOM 0 H ASN A 75 13.443 2.107 4.707 1.00 0.00 H new ATOM 0 HA ASN A 75 15.789 3.479 3.833 1.00 0.00 H new ATOM 0 HB2 ASN A 75 16.879 1.537 4.461 1.00 0.00 H new ATOM 0 HB3 ASN A 75 15.422 1.395 5.424 1.00 0.00 H new ATOM 0 HD21 ASN A 75 14.441 -1.651 4.006 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.310 -0.465 5.309 1.00 0.00 H new ATOM 1116 N ALA A 76 14.218 1.516 1.702 1.00 0.00 N ATOM 1117 CA ALA A 76 14.103 1.172 0.291 1.00 0.00 C ATOM 1118 C ALA A 76 14.332 2.393 -0.593 1.00 0.00 C ATOM 1119 O ALA A 76 13.577 3.363 -0.535 1.00 0.00 O ATOM 1120 CB ALA A 76 12.740 0.560 0.005 1.00 0.00 C ATOM 0 H ALA A 76 13.501 1.101 2.297 1.00 0.00 H new ATOM 0 HA ALA A 76 14.874 0.438 0.059 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.669 0.308 -1.053 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.614 -0.343 0.602 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.959 1.276 0.261 1.00 0.00 H new ATOM 1126 N SER A 77 15.380 2.339 -1.410 1.00 0.00 N ATOM 1127 CA SER A 77 15.711 3.444 -2.302 1.00 0.00 C ATOM 1128 C SER A 77 15.592 3.017 -3.762 1.00 0.00 C ATOM 1129 O SER A 77 15.320 1.854 -4.061 1.00 0.00 O ATOM 1130 CB SER A 77 17.127 3.948 -2.020 1.00 0.00 C ATOM 1131 OG SER A 77 17.451 5.050 -2.851 1.00 0.00 O ATOM 0 H SER A 77 16.014 1.542 -1.472 1.00 0.00 H new ATOM 0 HA SER A 77 15.003 4.252 -2.119 1.00 0.00 H new ATOM 0 HB2 SER A 77 17.211 4.241 -0.973 1.00 0.00 H new ATOM 0 HB3 SER A 77 17.843 3.142 -2.184 1.00 0.00 H new ATOM 0 HG SER A 77 18.360 5.355 -2.650 1.00 0.00 H new ATOM 1137 N GLY A 78 15.799 3.967 -4.669 1.00 0.00 N ATOM 1138 CA GLY A 78 15.710 3.671 -6.087 1.00 0.00 C ATOM 1139 C GLY A 78 14.305 3.299 -6.515 1.00 0.00 C ATOM 1140 O GLY A 78 13.334 3.617 -5.828 1.00 0.00 O ATOM 0 H GLY A 78 16.027 4.936 -4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 78 16.042 4.538 -6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 78 16.388 2.852 -6.327 1.00 0.00 H new ATOM 1144 N SER A 79 14.194 2.624 -7.655 1.00 0.00 N ATOM 1145 CA SER A 79 12.896 2.213 -8.177 1.00 0.00 C ATOM 1146 C SER A 79 12.269 1.141 -7.291 1.00 0.00 C ATOM 1147 O SER A 79 12.639 -0.032 -7.359 1.00 0.00 O ATOM 1148 CB SER A 79 13.040 1.689 -9.607 1.00 0.00 C ATOM 1149 OG SER A 79 13.089 2.756 -10.539 1.00 0.00 O ATOM 0 H SER A 79 14.987 2.350 -8.235 1.00 0.00 H new ATOM 0 HA SER A 79 12.241 3.085 -8.182 1.00 0.00 H new ATOM 0 HB2 SER A 79 13.946 1.089 -9.688 1.00 0.00 H new ATOM 0 HB3 SER A 79 12.202 1.034 -9.844 1.00 0.00 H new ATOM 0 HG SER A 79 13.183 2.395 -11.445 1.00 0.00 H new ATOM 1155 N VAL A 80 11.316 1.551 -6.460 1.00 0.00 N ATOM 1156 CA VAL A 80 10.636 0.627 -5.561 1.00 0.00 C ATOM 1157 C VAL A 80 9.370 0.068 -6.201 1.00 0.00 C ATOM 1158 O VAL A 80 8.614 0.797 -6.844 1.00 0.00 O ATOM 1159 CB VAL A 80 10.266 1.309 -4.230 1.00 0.00 C ATOM 1160 CG1 VAL A 80 9.512 0.344 -3.327 1.00 0.00 C ATOM 1161 CG2 VAL A 80 11.513 1.836 -3.537 1.00 0.00 C ATOM 0 H VAL A 80 10.998 2.518 -6.391 1.00 0.00 H new ATOM 0 HA VAL A 80 11.330 -0.189 -5.363 1.00 0.00 H new ATOM 0 HB VAL A 80 9.612 2.155 -4.444 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.259 0.843 -2.392 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.598 0.020 -3.824 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.138 -0.523 -3.118 1.00 0.00 H new ATOM 0 HG21 VAL A 80 11.233 2.315 -2.599 1.00 0.00 H new ATOM 0 HG22 VAL A 80 12.193 1.009 -3.334 1.00 0.00 H new ATOM 0 HG23 VAL A 80 12.008 2.563 -4.181 1.00 0.00 H new ATOM 1171 N ILE A 81 9.146 -1.229 -6.021 1.00 0.00 N ATOM 1172 CA ILE A 81 7.971 -1.886 -6.581 1.00 0.00 C ATOM 1173 C ILE A 81 7.069 -2.431 -5.479 1.00 0.00 C ATOM 1174 O ILE A 81 7.547 -2.876 -4.434 1.00 0.00 O ATOM 1175 CB ILE A 81 8.366 -3.038 -7.523 1.00 0.00 C ATOM 1176 CG1 ILE A 81 9.063 -2.490 -8.770 1.00 0.00 C ATOM 1177 CG2 ILE A 81 7.138 -3.850 -7.910 1.00 0.00 C ATOM 1178 CD1 ILE A 81 10.297 -1.672 -8.462 1.00 0.00 C ATOM 0 H ILE A 81 9.762 -1.846 -5.492 1.00 0.00 H new ATOM 0 HA ILE A 81 7.429 -1.132 -7.151 1.00 0.00 H new ATOM 0 HB ILE A 81 9.062 -3.694 -6.999 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.341 -3.322 -9.416 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.359 -1.874 -9.329 1.00 0.00 H new ATOM 0 HG21 ILE A 81 7.433 -4.661 -8.576 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.679 -4.266 -7.013 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.421 -3.205 -8.418 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.739 -1.316 -9.393 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.023 -0.819 -7.841 1.00 0.00 H new ATOM 0 HD13 ILE A 81 11.020 -2.290 -7.930 1.00 0.00 H new ATOM 1190 N LEU A 82 5.763 -2.396 -5.720 1.00 0.00 N ATOM 1191 CA LEU A 82 4.793 -2.889 -4.748 1.00 0.00 C ATOM 1192 C LEU A 82 3.724 -3.738 -5.429 1.00 0.00 C ATOM 1193 O LEU A 82 2.907 -3.229 -6.197 1.00 0.00 O ATOM 1194 CB LEU A 82 4.138 -1.718 -4.013 1.00 0.00 C ATOM 1195 CG LEU A 82 5.045 -0.524 -3.710 1.00 0.00 C ATOM 1196 CD1 LEU A 82 4.221 0.742 -3.540 1.00 0.00 C ATOM 1197 CD2 LEU A 82 5.880 -0.791 -2.465 1.00 0.00 C ATOM 0 H LEU A 82 5.351 -2.032 -6.579 1.00 0.00 H new ATOM 0 HA LEU A 82 5.322 -3.512 -4.027 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.295 -1.367 -4.609 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.731 -2.088 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 82 5.721 -0.382 -4.553 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.883 1.581 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.668 0.942 -4.458 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.520 0.612 -2.715 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.519 0.069 -2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.220 -0.959 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.499 -1.674 -2.624 1.00 0.00 H new ATOM 1209 N LYS A 83 3.734 -5.035 -5.141 1.00 0.00 N ATOM 1210 CA LYS A 83 2.764 -5.955 -5.721 1.00 0.00 C ATOM 1211 C LYS A 83 1.521 -6.062 -4.843 1.00 0.00 C ATOM 1212 O LYS A 83 1.545 -6.707 -3.794 1.00 0.00 O ATOM 1213 CB LYS A 83 3.391 -7.339 -5.907 1.00 0.00 C ATOM 1214 CG LYS A 83 2.567 -8.268 -6.782 1.00 0.00 C ATOM 1215 CD LYS A 83 3.325 -9.543 -7.110 1.00 0.00 C ATOM 1216 CE LYS A 83 2.643 -10.327 -8.221 1.00 0.00 C ATOM 1217 NZ LYS A 83 1.412 -11.014 -7.740 1.00 0.00 N ATOM 0 H LYS A 83 4.404 -5.473 -4.509 1.00 0.00 H new ATOM 0 HA LYS A 83 2.467 -5.563 -6.694 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.382 -7.224 -6.346 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.528 -7.801 -4.929 1.00 0.00 H new ATOM 0 HG2 LYS A 83 1.636 -8.518 -6.273 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.298 -7.756 -7.706 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.343 -9.295 -7.410 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.398 -10.164 -6.217 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.387 -9.652 -9.037 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.337 -11.065 -8.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.371 -11.973 -8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.431 -11.073 -6.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.574 -10.476 -8.041 1.00 0.00 H new ATOM 1231 N ILE A 84 0.438 -5.427 -5.279 1.00 0.00 N ATOM 1232 CA ILE A 84 -0.814 -5.454 -4.533 1.00 0.00 C ATOM 1233 C ILE A 84 -1.763 -6.510 -5.089 1.00 0.00 C ATOM 1234 O ILE A 84 -1.617 -6.952 -6.229 1.00 0.00 O ATOM 1235 CB ILE A 84 -1.515 -4.083 -4.562 1.00 0.00 C ATOM 1236 CG1 ILE A 84 -0.485 -2.956 -4.462 1.00 0.00 C ATOM 1237 CG2 ILE A 84 -2.530 -3.983 -3.433 1.00 0.00 C ATOM 1238 CD1 ILE A 84 0.189 -2.872 -3.110 1.00 0.00 C ATOM 0 H ILE A 84 0.402 -4.888 -6.144 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.562 -5.703 -3.502 1.00 0.00 H new ATOM 0 HB ILE A 84 -2.044 -3.982 -5.510 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.275 -3.100 -5.230 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.976 -2.006 -4.674 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.017 -3.008 -3.467 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.279 -4.767 -3.546 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -2.022 -4.102 -2.476 1.00 0.00 H new ATOM 0 HD11 ILE A 84 0.906 -2.051 -3.111 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -0.562 -2.697 -2.339 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.709 -3.808 -2.904 1.00 0.00 H new ATOM 1250 N LEU A 85 -2.735 -6.909 -4.277 1.00 0.00 N ATOM 1251 CA LEU A 85 -3.711 -7.913 -4.687 1.00 0.00 C ATOM 1252 C LEU A 85 -5.052 -7.683 -3.998 1.00 0.00 C ATOM 1253 O LEU A 85 -5.106 -7.186 -2.874 1.00 0.00 O ATOM 1254 CB LEU A 85 -3.194 -9.317 -4.366 1.00 0.00 C ATOM 1255 CG LEU A 85 -2.401 -10.010 -5.475 1.00 0.00 C ATOM 1256 CD1 LEU A 85 -0.918 -9.696 -5.347 1.00 0.00 C ATOM 1257 CD2 LEU A 85 -2.635 -11.513 -5.438 1.00 0.00 C ATOM 0 H LEU A 85 -2.869 -6.553 -3.331 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.857 -7.823 -5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.563 -9.256 -3.479 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.046 -9.946 -4.108 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.750 -9.632 -6.436 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.370 -10.198 -6.144 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.766 -8.619 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.554 -10.046 -4.381 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.063 -11.990 -6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.314 -11.908 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.696 -11.720 -5.580 1.00 0.00 H new ATOM 1269 N SER A 86 -6.132 -8.050 -4.680 1.00 0.00 N ATOM 1270 CA SER A 86 -7.474 -7.882 -4.134 1.00 0.00 C ATOM 1271 C SER A 86 -7.763 -8.935 -3.069 1.00 0.00 C ATOM 1272 O SER A 86 -8.602 -8.733 -2.192 1.00 0.00 O ATOM 1273 CB SER A 86 -8.517 -7.970 -5.251 1.00 0.00 C ATOM 1274 OG SER A 86 -8.621 -9.293 -5.748 1.00 0.00 O ATOM 0 H SER A 86 -6.104 -8.465 -5.611 1.00 0.00 H new ATOM 0 HA SER A 86 -7.530 -6.897 -3.671 1.00 0.00 H new ATOM 0 HB2 SER A 86 -9.486 -7.642 -4.875 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.245 -7.294 -6.061 1.00 0.00 H new ATOM 0 HG SER A 86 -9.295 -9.323 -6.459 1.00 0.00 H new ATOM 1280 N GLY A 87 -7.061 -10.061 -3.153 1.00 0.00 N ATOM 1281 CA GLY A 87 -7.256 -11.130 -2.191 1.00 0.00 C ATOM 1282 C GLY A 87 -8.531 -11.909 -2.441 1.00 0.00 C ATOM 1283 O GLY A 87 -9.077 -11.910 -3.545 1.00 0.00 O ATOM 0 H GLY A 87 -6.361 -10.252 -3.870 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.405 -11.810 -2.230 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.282 -10.710 -1.186 1.00 0.00 H new ATOM 1287 N PRO A 88 -9.025 -12.594 -1.399 1.00 0.00 N ATOM 1288 CA PRO A 88 -10.250 -13.395 -1.486 1.00 0.00 C ATOM 1289 C PRO A 88 -11.498 -12.531 -1.636 1.00 0.00 C ATOM 1290 O PRO A 88 -11.439 -11.309 -1.501 1.00 0.00 O ATOM 1291 CB PRO A 88 -10.277 -14.147 -0.154 1.00 0.00 C ATOM 1292 CG PRO A 88 -9.492 -13.292 0.780 1.00 0.00 C ATOM 1293 CD PRO A 88 -8.427 -12.638 -0.054 1.00 0.00 C ATOM 0 HA PRO A 88 -10.250 -14.047 -2.359 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -11.298 -14.287 0.201 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -9.834 -15.138 -0.250 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -10.129 -12.546 1.255 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -9.051 -13.889 1.578 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -8.187 -11.640 0.312 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -7.501 -13.212 -0.045 1.00 0.00 H new ATOM 1301 N SER A 89 -12.627 -13.174 -1.917 1.00 0.00 N ATOM 1302 CA SER A 89 -13.889 -12.464 -2.089 1.00 0.00 C ATOM 1303 C SER A 89 -14.273 -11.723 -0.812 1.00 0.00 C ATOM 1304 O SER A 89 -14.529 -10.519 -0.834 1.00 0.00 O ATOM 1305 CB SER A 89 -14.999 -13.442 -2.478 1.00 0.00 C ATOM 1306 OG SER A 89 -16.079 -12.766 -3.098 1.00 0.00 O ATOM 0 H SER A 89 -12.693 -14.185 -2.030 1.00 0.00 H new ATOM 0 HA SER A 89 -13.761 -11.734 -2.888 1.00 0.00 H new ATOM 0 HB2 SER A 89 -14.601 -14.198 -3.156 1.00 0.00 H new ATOM 0 HB3 SER A 89 -15.355 -13.965 -1.590 1.00 0.00 H new ATOM 0 HG SER A 89 -16.775 -13.413 -3.339 1.00 0.00 H new ATOM 1312 N SER A 90 -14.310 -12.451 0.299 1.00 0.00 N ATOM 1313 CA SER A 90 -14.667 -11.864 1.586 1.00 0.00 C ATOM 1314 C SER A 90 -14.402 -12.846 2.723 1.00 0.00 C ATOM 1315 O SER A 90 -14.684 -14.038 2.607 1.00 0.00 O ATOM 1316 CB SER A 90 -16.139 -11.447 1.590 1.00 0.00 C ATOM 1317 OG SER A 90 -16.417 -10.568 2.666 1.00 0.00 O ATOM 0 H SER A 90 -14.097 -13.448 0.334 1.00 0.00 H new ATOM 0 HA SER A 90 -14.046 -10.981 1.739 1.00 0.00 H new ATOM 0 HB2 SER A 90 -16.385 -10.961 0.646 1.00 0.00 H new ATOM 0 HB3 SER A 90 -16.771 -12.332 1.667 1.00 0.00 H new ATOM 0 HG SER A 90 -17.364 -10.315 2.645 1.00 0.00 H new ATOM 1323 N GLY A 91 -13.858 -12.336 3.823 1.00 0.00 N ATOM 1324 CA GLY A 91 -13.563 -13.180 4.966 1.00 0.00 C ATOM 1325 C GLY A 91 -13.948 -12.531 6.281 1.00 0.00 C ATOM 1326 O GLY A 91 -13.214 -11.693 6.805 1.00 0.00 O ATOM 0 H GLY A 91 -13.616 -11.352 3.943 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.094 -14.126 4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.498 -13.412 4.977 1.00 0.00 H new TER 1330 GLY A 91