USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 675 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 14 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 61 LYS NZ :NH3+ -142:sc= -2.55! (180deg=-3.56!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0.218 K(o=0.22,f=-4.9!) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 8:sc= 0.655 USER MOD Single : A -5 SER OG : rot -56:sc= 0.377 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 158:sc= -0.0458 (180deg=-0.302) USER MOD Single : A 38 SER OG : rot 180:sc= -0.928 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 149:sc= -0.469 (180deg=-1.63!) USER MOD Single : A 50 THR OG1 : rot -13:sc= -0.313 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot -150:sc= -1.9! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 66 ASN : amide:sc= -0.0487 K(o=-0.049,f=-1.8!) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 76 SER OG : rot 54:sc= 0.423 USER MOD Single : A 78 SER OG : rot 19:sc= 0.427 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 11.772 -23.957 -40.997 1.00 0.00 N ATOM 2 CA GLY A -6 11.918 -23.882 -39.555 1.00 0.00 C ATOM 3 C GLY A -6 11.957 -25.250 -38.904 1.00 0.00 C ATOM 4 O GLY A -6 12.909 -26.008 -39.093 1.00 0.00 O ATOM 0 H1 GLY A -6 11.751 -22.996 -41.394 1.00 0.00 H new ATOM 0 H2 GLY A -6 12.575 -24.481 -41.400 1.00 0.00 H new ATOM 0 H3 GLY A -6 10.886 -24.448 -41.231 1.00 0.00 H new ATOM 0 HA2 GLY A -6 12.833 -23.342 -39.313 1.00 0.00 H new ATOM 0 HA3 GLY A -6 11.090 -23.308 -39.138 1.00 0.00 H new ATOM 8 N SER A -5 10.922 -25.568 -38.134 1.00 0.00 N ATOM 9 CA SER A -5 10.844 -26.852 -37.448 1.00 0.00 C ATOM 10 C SER A -5 11.916 -26.957 -36.367 1.00 0.00 C ATOM 11 O SER A -5 12.602 -27.972 -36.254 1.00 0.00 O ATOM 12 CB SER A -5 11.000 -27.999 -38.449 1.00 0.00 C ATOM 13 OG SER A -5 10.747 -29.251 -37.834 1.00 0.00 O ATOM 0 H SER A -5 10.125 -24.953 -37.969 1.00 0.00 H new ATOM 0 HA SER A -5 9.865 -26.923 -36.973 1.00 0.00 H new ATOM 0 HB2 SER A -5 10.313 -27.854 -39.283 1.00 0.00 H new ATOM 0 HB3 SER A -5 12.009 -27.991 -38.862 1.00 0.00 H new ATOM 0 HG SER A -5 11.336 -29.360 -37.059 1.00 0.00 H new ATOM 19 N SER A -4 12.054 -25.898 -35.575 1.00 0.00 N ATOM 20 CA SER A -4 13.044 -25.867 -34.505 1.00 0.00 C ATOM 21 C SER A -4 12.376 -26.019 -33.142 1.00 0.00 C ATOM 22 O SER A -4 11.528 -25.214 -32.761 1.00 0.00 O ATOM 23 CB SER A -4 13.838 -24.561 -34.554 1.00 0.00 C ATOM 24 OG SER A -4 13.065 -23.476 -34.071 1.00 0.00 O ATOM 0 H SER A -4 11.492 -25.050 -35.654 1.00 0.00 H new ATOM 0 HA SER A -4 13.727 -26.704 -34.651 1.00 0.00 H new ATOM 0 HB2 SER A -4 14.744 -24.660 -33.957 1.00 0.00 H new ATOM 0 HB3 SER A -4 14.152 -24.361 -35.578 1.00 0.00 H new ATOM 0 HG SER A -4 12.226 -23.814 -33.693 1.00 0.00 H new ATOM 30 N GLY A -3 12.766 -27.060 -32.411 1.00 0.00 N ATOM 31 CA GLY A -3 12.196 -27.300 -31.099 1.00 0.00 C ATOM 32 C GLY A -3 12.528 -26.198 -30.112 1.00 0.00 C ATOM 33 O GLY A -3 13.680 -26.047 -29.706 1.00 0.00 O ATOM 0 H GLY A -3 13.466 -27.741 -32.705 1.00 0.00 H new ATOM 0 HA2 GLY A -3 11.113 -27.390 -31.188 1.00 0.00 H new ATOM 0 HA3 GLY A -3 12.565 -28.251 -30.715 1.00 0.00 H new ATOM 37 N SER A -2 11.518 -25.426 -29.727 1.00 0.00 N ATOM 38 CA SER A -2 11.709 -24.329 -28.785 1.00 0.00 C ATOM 39 C SER A -2 10.368 -23.782 -28.308 1.00 0.00 C ATOM 40 O SER A -2 9.412 -23.690 -29.078 1.00 0.00 O ATOM 41 CB SER A -2 12.528 -23.210 -29.433 1.00 0.00 C ATOM 42 OG SER A -2 13.254 -22.480 -28.460 1.00 0.00 O ATOM 0 H SER A -2 10.558 -25.539 -30.053 1.00 0.00 H new ATOM 0 HA SER A -2 12.252 -24.714 -27.922 1.00 0.00 H new ATOM 0 HB2 SER A -2 13.218 -23.635 -30.162 1.00 0.00 H new ATOM 0 HB3 SER A -2 11.864 -22.537 -29.976 1.00 0.00 H new ATOM 0 HG SER A -2 13.770 -21.772 -28.900 1.00 0.00 H new ATOM 48 N SER A -1 10.304 -23.420 -27.030 1.00 0.00 N ATOM 49 CA SER A -1 9.079 -22.886 -26.447 1.00 0.00 C ATOM 50 C SER A -1 8.880 -21.426 -26.845 1.00 0.00 C ATOM 51 O SER A -1 9.809 -20.765 -27.306 1.00 0.00 O ATOM 52 CB SER A -1 9.119 -23.010 -24.923 1.00 0.00 C ATOM 53 OG SER A -1 7.810 -23.035 -24.379 1.00 0.00 O ATOM 0 H SER A -1 11.086 -23.487 -26.379 1.00 0.00 H new ATOM 0 HA SER A -1 8.240 -23.467 -26.830 1.00 0.00 H new ATOM 0 HB2 SER A -1 9.650 -23.920 -24.643 1.00 0.00 H new ATOM 0 HB3 SER A -1 9.676 -22.173 -24.501 1.00 0.00 H new ATOM 0 HG SER A -1 7.863 -23.116 -23.404 1.00 0.00 H new ATOM 59 N GLY A 1 7.660 -20.931 -26.662 1.00 0.00 N ATOM 60 CA GLY A 1 7.359 -19.553 -27.006 1.00 0.00 C ATOM 61 C GLY A 1 6.893 -18.745 -25.812 1.00 0.00 C ATOM 62 O GLY A 1 7.694 -18.190 -25.060 1.00 0.00 O ATOM 0 H GLY A 1 6.875 -21.459 -26.282 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.247 -19.086 -27.432 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.588 -19.534 -27.776 1.00 0.00 H new ATOM 66 N PRO A 2 5.567 -18.671 -25.624 1.00 0.00 N ATOM 67 CA PRO A 2 4.965 -17.926 -24.514 1.00 0.00 C ATOM 68 C PRO A 2 5.218 -18.591 -23.165 1.00 0.00 C ATOM 69 O PRO A 2 5.322 -19.813 -23.058 1.00 0.00 O ATOM 70 CB PRO A 2 3.471 -17.940 -24.846 1.00 0.00 C ATOM 71 CG PRO A 2 3.282 -19.152 -25.691 1.00 0.00 C ATOM 72 CD PRO A 2 4.553 -19.309 -26.480 1.00 0.00 C ATOM 0 HA PRO A 2 5.385 -16.925 -24.420 1.00 0.00 H new ATOM 0 HB2 PRO A 2 2.865 -17.990 -23.941 1.00 0.00 H new ATOM 0 HB3 PRO A 2 3.175 -17.036 -25.379 1.00 0.00 H new ATOM 0 HG2 PRO A 2 3.094 -20.032 -25.075 1.00 0.00 H new ATOM 0 HG3 PRO A 2 2.424 -19.036 -26.353 1.00 0.00 H new ATOM 0 HD2 PRO A 2 4.785 -20.358 -26.664 1.00 0.00 H new ATOM 0 HD3 PRO A 2 4.485 -18.822 -27.453 1.00 0.00 H new ATOM 80 N PRO A 3 5.318 -17.770 -22.109 1.00 0.00 N ATOM 81 CA PRO A 3 5.558 -18.257 -20.747 1.00 0.00 C ATOM 82 C PRO A 3 4.356 -19.003 -20.178 1.00 0.00 C ATOM 83 O PRO A 3 3.375 -19.250 -20.880 1.00 0.00 O ATOM 84 CB PRO A 3 5.817 -16.975 -19.953 1.00 0.00 C ATOM 85 CG PRO A 3 5.112 -15.907 -20.715 1.00 0.00 C ATOM 86 CD PRO A 3 5.203 -16.303 -22.163 1.00 0.00 C ATOM 0 HA PRO A 3 6.380 -18.972 -20.708 1.00 0.00 H new ATOM 0 HB2 PRO A 3 5.433 -17.055 -18.936 1.00 0.00 H new ATOM 0 HB3 PRO A 3 6.884 -16.767 -19.875 1.00 0.00 H new ATOM 0 HG2 PRO A 3 4.073 -15.823 -20.398 1.00 0.00 H new ATOM 0 HG3 PRO A 3 5.577 -14.936 -20.546 1.00 0.00 H new ATOM 0 HD2 PRO A 3 4.321 -15.989 -22.722 1.00 0.00 H new ATOM 0 HD3 PRO A 3 6.066 -15.850 -22.650 1.00 0.00 H new ATOM 94 N LYS A 4 4.437 -19.359 -18.901 1.00 0.00 N ATOM 95 CA LYS A 4 3.356 -20.075 -18.235 1.00 0.00 C ATOM 96 C LYS A 4 3.111 -19.514 -16.837 1.00 0.00 C ATOM 97 O LYS A 4 3.950 -18.799 -16.289 1.00 0.00 O ATOM 98 CB LYS A 4 3.682 -21.567 -18.147 1.00 0.00 C ATOM 99 CG LYS A 4 3.316 -22.345 -19.399 1.00 0.00 C ATOM 100 CD LYS A 4 1.826 -22.637 -19.458 1.00 0.00 C ATOM 101 CE LYS A 4 1.510 -23.720 -20.478 1.00 0.00 C ATOM 102 NZ LYS A 4 1.626 -25.085 -19.892 1.00 0.00 N ATOM 0 H LYS A 4 5.242 -19.163 -18.306 1.00 0.00 H new ATOM 0 HA LYS A 4 2.449 -19.942 -18.825 1.00 0.00 H new ATOM 0 HB2 LYS A 4 4.748 -21.686 -17.954 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.154 -21.996 -17.296 1.00 0.00 H new ATOM 0 HG2 LYS A 4 3.612 -21.777 -20.281 1.00 0.00 H new ATOM 0 HG3 LYS A 4 3.873 -23.282 -19.422 1.00 0.00 H new ATOM 0 HD2 LYS A 4 1.476 -22.949 -18.474 1.00 0.00 H new ATOM 0 HD3 LYS A 4 1.285 -21.726 -19.714 1.00 0.00 H new ATOM 0 HE2 LYS A 4 0.500 -23.574 -20.862 1.00 0.00 H new ATOM 0 HE3 LYS A 4 2.189 -23.630 -21.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 1.403 -25.795 -20.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 2.596 -25.234 -19.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.960 -25.180 -19.099 1.00 0.00 H new ATOM 116 N PHE A 5 1.957 -19.845 -16.266 1.00 0.00 N ATOM 117 CA PHE A 5 1.603 -19.374 -14.932 1.00 0.00 C ATOM 118 C PHE A 5 1.357 -20.548 -13.989 1.00 0.00 C ATOM 119 O PHE A 5 0.913 -21.616 -14.412 1.00 0.00 O ATOM 120 CB PHE A 5 0.358 -18.487 -14.995 1.00 0.00 C ATOM 121 CG PHE A 5 0.638 -17.095 -15.484 1.00 0.00 C ATOM 122 CD1 PHE A 5 1.450 -16.241 -14.755 1.00 0.00 C ATOM 123 CD2 PHE A 5 0.090 -16.640 -16.672 1.00 0.00 C ATOM 124 CE1 PHE A 5 1.709 -14.959 -15.202 1.00 0.00 C ATOM 125 CE2 PHE A 5 0.346 -15.360 -17.125 1.00 0.00 C ATOM 126 CZ PHE A 5 1.157 -14.518 -16.389 1.00 0.00 C ATOM 0 H PHE A 5 1.252 -20.437 -16.706 1.00 0.00 H new ATOM 0 HA PHE A 5 2.438 -18.789 -14.547 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -0.377 -18.953 -15.651 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -0.090 -18.432 -14.003 1.00 0.00 H new ATOM 0 HD1 PHE A 5 1.885 -16.581 -13.827 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -0.545 -17.294 -17.251 1.00 0.00 H new ATOM 0 HE1 PHE A 5 2.342 -14.303 -14.624 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -0.087 -15.018 -18.053 1.00 0.00 H new ATOM 0 HZ PHE A 5 1.359 -13.517 -16.741 1.00 0.00 H new ATOM 136 N ASP A 6 1.651 -20.343 -12.710 1.00 0.00 N ATOM 137 CA ASP A 6 1.462 -21.384 -11.705 1.00 0.00 C ATOM 138 C ASP A 6 1.209 -20.773 -10.331 1.00 0.00 C ATOM 139 O ASP A 6 1.771 -19.738 -9.971 1.00 0.00 O ATOM 140 CB ASP A 6 2.686 -22.300 -11.653 1.00 0.00 C ATOM 141 CG ASP A 6 2.854 -23.114 -12.920 1.00 0.00 C ATOM 142 OD1 ASP A 6 3.471 -22.602 -13.877 1.00 0.00 O ATOM 143 OD2 ASP A 6 2.368 -24.264 -12.956 1.00 0.00 O ATOM 0 H ASP A 6 2.021 -19.466 -12.344 1.00 0.00 H new ATOM 0 HA ASP A 6 0.589 -21.973 -11.987 1.00 0.00 H new ATOM 0 HB2 ASP A 6 3.580 -21.698 -11.490 1.00 0.00 H new ATOM 0 HB3 ASP A 6 2.596 -22.974 -10.801 1.00 0.00 H new ATOM 148 N PRO A 7 0.343 -21.426 -9.542 1.00 0.00 N ATOM 149 CA PRO A 7 -0.005 -20.965 -8.195 1.00 0.00 C ATOM 150 C PRO A 7 1.153 -21.116 -7.214 1.00 0.00 C ATOM 151 O PRO A 7 1.134 -20.544 -6.125 1.00 0.00 O ATOM 152 CB PRO A 7 -1.167 -21.878 -7.796 1.00 0.00 C ATOM 153 CG PRO A 7 -0.973 -23.113 -8.606 1.00 0.00 C ATOM 154 CD PRO A 7 -0.364 -22.665 -9.906 1.00 0.00 C ATOM 0 HA PRO A 7 -0.255 -19.904 -8.179 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -1.149 -22.098 -6.729 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -2.129 -21.411 -8.010 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -0.320 -23.818 -8.092 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -1.922 -23.622 -8.775 1.00 0.00 H new ATOM 0 HD2 PRO A 7 0.318 -23.413 -10.309 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -1.125 -22.485 -10.665 1.00 0.00 H new ATOM 162 N ASN A 8 2.159 -21.890 -7.608 1.00 0.00 N ATOM 163 CA ASN A 8 3.326 -22.116 -6.763 1.00 0.00 C ATOM 164 C ASN A 8 4.314 -20.960 -6.878 1.00 0.00 C ATOM 165 O ASN A 8 4.482 -20.179 -5.942 1.00 0.00 O ATOM 166 CB ASN A 8 4.012 -23.429 -7.146 1.00 0.00 C ATOM 167 CG ASN A 8 3.023 -24.491 -7.587 1.00 0.00 C ATOM 168 OD1 ASN A 8 2.364 -24.351 -8.617 1.00 0.00 O ATOM 169 ND2 ASN A 8 2.917 -25.561 -6.808 1.00 0.00 N ATOM 0 H ASN A 8 2.190 -22.371 -8.507 1.00 0.00 H new ATOM 0 HA ASN A 8 2.988 -22.179 -5.729 1.00 0.00 H new ATOM 0 HB2 ASN A 8 4.724 -23.243 -7.950 1.00 0.00 H new ATOM 0 HB3 ASN A 8 4.583 -23.799 -6.295 1.00 0.00 H new ATOM 0 HD21 ASN A 8 2.269 -26.309 -7.055 1.00 0.00 H new ATOM 0 HD22 ASN A 8 3.483 -25.635 -5.963 1.00 0.00 H new ATOM 176 N GLU A 9 4.964 -20.858 -8.033 1.00 0.00 N ATOM 177 CA GLU A 9 5.936 -19.797 -8.271 1.00 0.00 C ATOM 178 C GLU A 9 5.405 -18.453 -7.780 1.00 0.00 C ATOM 179 O GLU A 9 4.209 -18.299 -7.531 1.00 0.00 O ATOM 180 CB GLU A 9 6.277 -19.710 -9.760 1.00 0.00 C ATOM 181 CG GLU A 9 5.168 -19.104 -10.603 1.00 0.00 C ATOM 182 CD GLU A 9 4.958 -17.629 -10.317 1.00 0.00 C ATOM 183 OE1 GLU A 9 5.962 -16.912 -10.126 1.00 0.00 O ATOM 184 OE2 GLU A 9 3.788 -17.193 -10.285 1.00 0.00 O ATOM 0 H GLU A 9 4.835 -21.496 -8.818 1.00 0.00 H new ATOM 0 HA GLU A 9 6.841 -20.037 -7.713 1.00 0.00 H new ATOM 0 HB2 GLU A 9 7.182 -19.115 -9.883 1.00 0.00 H new ATOM 0 HB3 GLU A 9 6.500 -20.710 -10.132 1.00 0.00 H new ATOM 0 HG2 GLU A 9 5.406 -19.235 -11.659 1.00 0.00 H new ATOM 0 HG3 GLU A 9 4.239 -19.643 -10.416 1.00 0.00 H new ATOM 191 N VAL A 10 6.303 -17.482 -7.644 1.00 0.00 N ATOM 192 CA VAL A 10 5.926 -16.151 -7.185 1.00 0.00 C ATOM 193 C VAL A 10 6.281 -15.091 -8.221 1.00 0.00 C ATOM 194 O VAL A 10 7.338 -15.150 -8.850 1.00 0.00 O ATOM 195 CB VAL A 10 6.614 -15.801 -5.852 1.00 0.00 C ATOM 196 CG1 VAL A 10 8.127 -15.851 -6.003 1.00 0.00 C ATOM 197 CG2 VAL A 10 6.164 -14.433 -5.362 1.00 0.00 C ATOM 0 H VAL A 10 7.297 -17.593 -7.845 1.00 0.00 H new ATOM 0 HA VAL A 10 4.846 -16.162 -7.036 1.00 0.00 H new ATOM 0 HB VAL A 10 6.322 -16.542 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.596 -15.601 -5.051 1.00 0.00 H new ATOM 0 HG12 VAL A 10 8.430 -16.854 -6.304 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.441 -15.134 -6.762 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.660 -14.203 -4.419 1.00 0.00 H new ATOM 0 HG22 VAL A 10 6.424 -13.677 -6.103 1.00 0.00 H new ATOM 0 HG23 VAL A 10 5.084 -14.437 -5.212 1.00 0.00 H new ATOM 207 N LYS A 11 5.392 -14.119 -8.394 1.00 0.00 N ATOM 208 CA LYS A 11 5.611 -13.043 -9.353 1.00 0.00 C ATOM 209 C LYS A 11 5.409 -11.680 -8.697 1.00 0.00 C ATOM 210 O LYS A 11 4.508 -11.502 -7.877 1.00 0.00 O ATOM 211 CB LYS A 11 4.662 -13.192 -10.544 1.00 0.00 C ATOM 212 CG LYS A 11 4.912 -12.184 -11.652 1.00 0.00 C ATOM 213 CD LYS A 11 3.836 -12.252 -12.722 1.00 0.00 C ATOM 214 CE LYS A 11 4.219 -11.439 -13.950 1.00 0.00 C ATOM 215 NZ LYS A 11 4.123 -9.975 -13.697 1.00 0.00 N ATOM 0 H LYS A 11 4.512 -14.054 -7.882 1.00 0.00 H new ATOM 0 HA LYS A 11 6.640 -13.109 -9.706 1.00 0.00 H new ATOM 0 HB2 LYS A 11 4.759 -14.198 -10.951 1.00 0.00 H new ATOM 0 HB3 LYS A 11 3.635 -13.088 -10.194 1.00 0.00 H new ATOM 0 HG2 LYS A 11 4.944 -11.179 -11.230 1.00 0.00 H new ATOM 0 HG3 LYS A 11 5.887 -12.372 -12.103 1.00 0.00 H new ATOM 0 HD2 LYS A 11 3.672 -13.291 -13.009 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.895 -11.880 -12.317 1.00 0.00 H new ATOM 0 HE2 LYS A 11 5.237 -11.690 -14.249 1.00 0.00 H new ATOM 0 HE3 LYS A 11 3.567 -11.708 -14.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 4.392 -9.456 -14.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 3.146 -9.731 -13.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 4.764 -9.714 -12.921 1.00 0.00 H new ATOM 229 N VAL A 12 6.253 -10.721 -9.064 1.00 0.00 N ATOM 230 CA VAL A 12 6.166 -9.374 -8.513 1.00 0.00 C ATOM 231 C VAL A 12 5.668 -8.383 -9.560 1.00 0.00 C ATOM 232 O VAL A 12 6.104 -8.408 -10.711 1.00 0.00 O ATOM 233 CB VAL A 12 7.529 -8.897 -7.978 1.00 0.00 C ATOM 234 CG1 VAL A 12 7.448 -7.447 -7.527 1.00 0.00 C ATOM 235 CG2 VAL A 12 7.997 -9.792 -6.841 1.00 0.00 C ATOM 0 H VAL A 12 7.005 -10.852 -9.741 1.00 0.00 H new ATOM 0 HA VAL A 12 5.455 -9.415 -7.688 1.00 0.00 H new ATOM 0 HB VAL A 12 8.259 -8.961 -8.785 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.420 -7.128 -7.152 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.160 -6.819 -8.370 1.00 0.00 H new ATOM 0 HG13 VAL A 12 6.705 -7.353 -6.735 1.00 0.00 H new ATOM 0 HG21 VAL A 12 8.962 -9.441 -6.475 1.00 0.00 H new ATOM 0 HG22 VAL A 12 7.268 -9.762 -6.031 1.00 0.00 H new ATOM 0 HG23 VAL A 12 8.097 -10.816 -7.201 1.00 0.00 H new ATOM 245 N VAL A 13 4.752 -7.510 -9.152 1.00 0.00 N ATOM 246 CA VAL A 13 4.196 -6.509 -10.054 1.00 0.00 C ATOM 247 C VAL A 13 4.385 -5.102 -9.497 1.00 0.00 C ATOM 248 O VAL A 13 4.163 -4.858 -8.311 1.00 0.00 O ATOM 249 CB VAL A 13 2.696 -6.752 -10.306 1.00 0.00 C ATOM 250 CG1 VAL A 13 2.126 -5.677 -11.218 1.00 0.00 C ATOM 251 CG2 VAL A 13 2.473 -8.136 -10.897 1.00 0.00 C ATOM 0 H VAL A 13 4.380 -7.476 -8.203 1.00 0.00 H new ATOM 0 HA VAL A 13 4.735 -6.599 -10.997 1.00 0.00 H new ATOM 0 HB VAL A 13 2.172 -6.700 -9.351 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.065 -5.866 -11.384 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.252 -4.700 -10.752 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.652 -5.694 -12.173 1.00 0.00 H new ATOM 0 HG21 VAL A 13 1.408 -8.291 -11.069 1.00 0.00 H new ATOM 0 HG22 VAL A 13 3.009 -8.218 -11.843 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.842 -8.892 -10.204 1.00 0.00 H new ATOM 261 N TYR A 14 4.794 -4.180 -10.362 1.00 0.00 N ATOM 262 CA TYR A 14 5.015 -2.797 -9.956 1.00 0.00 C ATOM 263 C TYR A 14 3.950 -1.880 -10.548 1.00 0.00 C ATOM 264 O TYR A 14 3.556 -2.030 -11.705 1.00 0.00 O ATOM 265 CB TYR A 14 6.405 -2.331 -10.393 1.00 0.00 C ATOM 266 CG TYR A 14 7.534 -3.083 -9.724 1.00 0.00 C ATOM 267 CD1 TYR A 14 7.656 -4.460 -9.865 1.00 0.00 C ATOM 268 CD2 TYR A 14 8.476 -2.418 -8.951 1.00 0.00 C ATOM 269 CE1 TYR A 14 8.685 -5.152 -9.256 1.00 0.00 C ATOM 270 CE2 TYR A 14 9.510 -3.101 -8.339 1.00 0.00 C ATOM 271 CZ TYR A 14 9.610 -4.468 -8.494 1.00 0.00 C ATOM 272 OH TYR A 14 10.637 -5.152 -7.885 1.00 0.00 O ATOM 0 H TYR A 14 4.979 -4.365 -11.348 1.00 0.00 H new ATOM 0 HA TYR A 14 4.948 -2.749 -8.869 1.00 0.00 H new ATOM 0 HB2 TYR A 14 6.494 -2.445 -11.473 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.508 -1.268 -10.175 1.00 0.00 H new ATOM 0 HD1 TYR A 14 6.934 -4.999 -10.461 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.400 -1.348 -8.826 1.00 0.00 H new ATOM 0 HE1 TYR A 14 8.765 -6.222 -9.376 1.00 0.00 H new ATOM 0 HE2 TYR A 14 10.236 -2.567 -7.743 1.00 0.00 H new ATOM 0 HH TYR A 14 11.200 -4.522 -7.388 1.00 0.00 H new ATOM 282 N LEU A 15 3.486 -0.928 -9.745 1.00 0.00 N ATOM 283 CA LEU A 15 2.466 0.017 -10.187 1.00 0.00 C ATOM 284 C LEU A 15 2.679 1.386 -9.549 1.00 0.00 C ATOM 285 O LEU A 15 3.184 1.489 -8.431 1.00 0.00 O ATOM 286 CB LEU A 15 1.072 -0.509 -9.841 1.00 0.00 C ATOM 287 CG LEU A 15 0.733 -1.906 -10.363 1.00 0.00 C ATOM 288 CD1 LEU A 15 -0.416 -2.508 -9.569 1.00 0.00 C ATOM 289 CD2 LEU A 15 0.390 -1.853 -11.845 1.00 0.00 C ATOM 0 H LEU A 15 3.800 -0.790 -8.784 1.00 0.00 H new ATOM 0 HA LEU A 15 2.549 0.124 -11.269 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.966 -0.513 -8.756 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.334 0.192 -10.231 1.00 0.00 H new ATOM 0 HG LEU A 15 1.608 -2.543 -10.236 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.643 -3.502 -9.955 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.133 -2.582 -8.519 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.296 -1.872 -9.664 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.152 -2.856 -12.199 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.470 -1.201 -11.996 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.243 -1.465 -12.402 1.00 0.00 H new ATOM 301 N ARG A 16 2.288 2.434 -10.266 1.00 0.00 N ATOM 302 CA ARG A 16 2.434 3.797 -9.770 1.00 0.00 C ATOM 303 C ARG A 16 1.075 4.402 -9.431 1.00 0.00 C ATOM 304 O ARG A 16 0.203 4.516 -10.294 1.00 0.00 O ATOM 305 CB ARG A 16 3.147 4.667 -10.807 1.00 0.00 C ATOM 306 CG ARG A 16 4.652 4.455 -10.849 1.00 0.00 C ATOM 307 CD ARG A 16 5.017 3.203 -11.631 1.00 0.00 C ATOM 308 NE ARG A 16 6.401 3.233 -12.096 1.00 0.00 N ATOM 309 CZ ARG A 16 6.796 3.880 -13.187 1.00 0.00 C ATOM 310 NH1 ARG A 16 5.916 4.548 -13.920 1.00 0.00 N ATOM 311 NH2 ARG A 16 8.073 3.860 -13.545 1.00 0.00 N ATOM 0 H ARG A 16 1.867 2.365 -11.193 1.00 0.00 H new ATOM 0 HA ARG A 16 3.034 3.762 -8.861 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.731 4.457 -11.793 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.942 5.716 -10.592 1.00 0.00 H new ATOM 0 HG2 ARG A 16 5.130 5.322 -11.305 1.00 0.00 H new ATOM 0 HG3 ARG A 16 5.038 4.376 -9.833 1.00 0.00 H new ATOM 0 HD2 ARG A 16 4.865 2.326 -11.002 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.349 3.102 -12.486 1.00 0.00 H new ATOM 0 HE ARG A 16 7.103 2.730 -11.553 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.933 4.566 -13.647 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.222 5.044 -14.757 1.00 0.00 H new ATOM 0 HH21 ARG A 16 8.752 3.348 -12.983 1.00 0.00 H new ATOM 0 HH22 ARG A 16 8.376 4.357 -14.383 1.00 0.00 H new ATOM 325 N CYS A 17 0.901 4.786 -8.172 1.00 0.00 N ATOM 326 CA CYS A 17 -0.353 5.378 -7.719 1.00 0.00 C ATOM 327 C CYS A 17 -0.138 6.208 -6.458 1.00 0.00 C ATOM 328 O CYS A 17 0.826 5.999 -5.720 1.00 0.00 O ATOM 329 CB CYS A 17 -1.390 4.285 -7.454 1.00 0.00 C ATOM 330 SG CYS A 17 -0.911 3.109 -6.167 1.00 0.00 S ATOM 0 H CYS A 17 1.612 4.698 -7.446 1.00 0.00 H new ATOM 0 HA CYS A 17 -0.721 6.036 -8.506 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -2.332 4.754 -7.170 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -1.572 3.740 -8.380 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.852 2.226 -6.014 1.00 0.00 H new ATOM 336 N THR A 18 -1.042 7.153 -6.216 1.00 0.00 N ATOM 337 CA THR A 18 -0.950 8.017 -5.047 1.00 0.00 C ATOM 338 C THR A 18 -1.363 7.275 -3.781 1.00 0.00 C ATOM 339 O THR A 18 -2.327 6.510 -3.785 1.00 0.00 O ATOM 340 CB THR A 18 -1.830 9.271 -5.204 1.00 0.00 C ATOM 341 OG1 THR A 18 -1.595 9.879 -6.479 1.00 0.00 O ATOM 342 CG2 THR A 18 -1.545 10.275 -4.098 1.00 0.00 C ATOM 0 H THR A 18 -1.846 7.339 -6.815 1.00 0.00 H new ATOM 0 HA THR A 18 0.093 8.323 -4.962 1.00 0.00 H new ATOM 0 HB THR A 18 -2.874 8.965 -5.135 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.160 10.675 -6.571 1.00 0.00 H new ATOM 0 HG21 THR A 18 -2.179 11.152 -4.231 1.00 0.00 H new ATOM 0 HG22 THR A 18 -1.754 9.819 -3.130 1.00 0.00 H new ATOM 0 HG23 THR A 18 -0.498 10.574 -4.139 1.00 0.00 H new ATOM 350 N GLY A 19 -0.629 7.507 -2.697 1.00 0.00 N ATOM 351 CA GLY A 19 -0.936 6.853 -1.439 1.00 0.00 C ATOM 352 C GLY A 19 -2.329 7.181 -0.940 1.00 0.00 C ATOM 353 O GLY A 19 -2.786 8.318 -1.056 1.00 0.00 O ATOM 0 H GLY A 19 0.173 8.137 -2.668 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -0.842 5.774 -1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -0.205 7.153 -0.689 1.00 0.00 H new ATOM 357 N GLY A 20 -3.008 6.182 -0.383 1.00 0.00 N ATOM 358 CA GLY A 20 -4.351 6.390 0.125 1.00 0.00 C ATOM 359 C GLY A 20 -5.248 7.091 -0.876 1.00 0.00 C ATOM 360 O GLY A 20 -5.832 8.131 -0.574 1.00 0.00 O ATOM 0 H GLY A 20 -2.651 5.233 -0.275 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.789 5.428 0.389 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.303 6.980 1.040 1.00 0.00 H new ATOM 364 N GLU A 21 -5.355 6.521 -2.072 1.00 0.00 N ATOM 365 CA GLU A 21 -6.186 7.100 -3.122 1.00 0.00 C ATOM 366 C GLU A 21 -7.591 6.505 -3.094 1.00 0.00 C ATOM 367 O GLU A 21 -8.149 6.155 -4.134 1.00 0.00 O ATOM 368 CB GLU A 21 -5.548 6.868 -4.493 1.00 0.00 C ATOM 369 CG GLU A 21 -6.111 7.762 -5.585 1.00 0.00 C ATOM 370 CD GLU A 21 -5.681 9.208 -5.434 1.00 0.00 C ATOM 371 OE1 GLU A 21 -6.268 9.916 -4.589 1.00 0.00 O ATOM 372 OE2 GLU A 21 -4.758 9.632 -6.161 1.00 0.00 O ATOM 0 H GLU A 21 -4.877 5.660 -2.338 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.261 8.172 -2.941 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.473 7.034 -4.417 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.690 5.826 -4.779 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.787 7.390 -6.557 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.199 7.707 -5.569 1.00 0.00 H new ATOM 379 N VAL A 22 -8.156 6.393 -1.897 1.00 0.00 N ATOM 380 CA VAL A 22 -9.496 5.841 -1.732 1.00 0.00 C ATOM 381 C VAL A 22 -10.412 6.275 -2.871 1.00 0.00 C ATOM 382 O VAL A 22 -10.226 7.338 -3.461 1.00 0.00 O ATOM 383 CB VAL A 22 -10.120 6.273 -0.392 1.00 0.00 C ATOM 384 CG1 VAL A 22 -9.959 7.772 -0.186 1.00 0.00 C ATOM 385 CG2 VAL A 22 -11.587 5.874 -0.335 1.00 0.00 C ATOM 0 H VAL A 22 -7.707 6.677 -1.026 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.396 4.756 -1.743 1.00 0.00 H new ATOM 0 HB VAL A 22 -9.596 5.761 0.415 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -10.406 8.059 0.766 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -8.899 8.027 -0.181 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.456 8.306 -0.996 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.012 6.187 0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -12.127 6.357 -1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -11.674 4.792 -0.433 1.00 0.00 H new ATOM 395 N GLY A 23 -11.404 5.443 -3.174 1.00 0.00 N ATOM 396 CA GLY A 23 -12.336 5.758 -4.242 1.00 0.00 C ATOM 397 C GLY A 23 -11.648 5.926 -5.582 1.00 0.00 C ATOM 398 O GLY A 23 -10.906 6.885 -5.790 1.00 0.00 O ATOM 0 H GLY A 23 -11.579 4.557 -2.700 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.080 4.965 -4.316 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -12.871 6.675 -3.994 1.00 0.00 H new ATOM 402 N ALA A 24 -11.893 4.989 -6.492 1.00 0.00 N ATOM 403 CA ALA A 24 -11.291 5.038 -7.819 1.00 0.00 C ATOM 404 C ALA A 24 -11.917 4.000 -8.744 1.00 0.00 C ATOM 405 O ALA A 24 -12.163 2.862 -8.343 1.00 0.00 O ATOM 406 CB ALA A 24 -9.787 4.825 -7.725 1.00 0.00 C ATOM 0 H ALA A 24 -12.504 4.187 -6.335 1.00 0.00 H new ATOM 0 HA ALA A 24 -11.481 6.025 -8.241 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -9.351 4.864 -8.723 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.347 5.607 -7.106 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -9.585 3.851 -7.279 1.00 0.00 H new ATOM 412 N THR A 25 -12.175 4.400 -9.986 1.00 0.00 N ATOM 413 CA THR A 25 -12.774 3.505 -10.968 1.00 0.00 C ATOM 414 C THR A 25 -12.187 2.102 -10.864 1.00 0.00 C ATOM 415 O THR A 25 -10.999 1.935 -10.590 1.00 0.00 O ATOM 416 CB THR A 25 -12.572 4.029 -12.402 1.00 0.00 C ATOM 417 OG1 THR A 25 -12.852 2.990 -13.347 1.00 0.00 O ATOM 418 CG2 THR A 25 -11.150 4.532 -12.600 1.00 0.00 C ATOM 0 H THR A 25 -11.978 5.338 -10.335 1.00 0.00 H new ATOM 0 HA THR A 25 -13.841 3.466 -10.750 1.00 0.00 H new ATOM 0 HB THR A 25 -13.259 4.860 -12.562 1.00 0.00 H new ATOM 0 HG1 THR A 25 -12.723 3.332 -14.256 1.00 0.00 H new ATOM 0 HG21 THR A 25 -11.032 4.897 -13.620 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.950 5.343 -11.899 1.00 0.00 H new ATOM 0 HG23 THR A 25 -10.448 3.717 -12.422 1.00 0.00 H new ATOM 426 N SER A 26 -13.027 1.097 -11.086 1.00 0.00 N ATOM 427 CA SER A 26 -12.592 -0.293 -11.014 1.00 0.00 C ATOM 428 C SER A 26 -11.395 -0.536 -11.929 1.00 0.00 C ATOM 429 O SER A 26 -11.550 -0.715 -13.137 1.00 0.00 O ATOM 430 CB SER A 26 -13.739 -1.230 -11.397 1.00 0.00 C ATOM 431 OG SER A 26 -14.759 -1.215 -10.414 1.00 0.00 O ATOM 0 H SER A 26 -14.013 1.219 -11.317 1.00 0.00 H new ATOM 0 HA SER A 26 -12.291 -0.500 -9.987 1.00 0.00 H new ATOM 0 HB2 SER A 26 -14.153 -0.929 -12.360 1.00 0.00 H new ATOM 0 HB3 SER A 26 -13.359 -2.245 -11.516 1.00 0.00 H new ATOM 0 HG SER A 26 -15.481 -1.820 -10.683 1.00 0.00 H new ATOM 437 N ALA A 27 -10.202 -0.539 -11.344 1.00 0.00 N ATOM 438 CA ALA A 27 -8.979 -0.761 -12.105 1.00 0.00 C ATOM 439 C ALA A 27 -8.281 -2.042 -11.661 1.00 0.00 C ATOM 440 O ALA A 27 -7.664 -2.737 -12.469 1.00 0.00 O ATOM 441 CB ALA A 27 -8.043 0.430 -11.960 1.00 0.00 C ATOM 0 H ALA A 27 -10.056 -0.390 -10.345 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.249 -0.871 -13.155 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.134 0.250 -12.534 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.536 1.328 -12.333 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -7.788 0.566 -10.909 1.00 0.00 H new ATOM 447 N LEU A 28 -8.381 -2.348 -10.372 1.00 0.00 N ATOM 448 CA LEU A 28 -7.758 -3.546 -9.820 1.00 0.00 C ATOM 449 C LEU A 28 -8.700 -4.742 -9.914 1.00 0.00 C ATOM 450 O LEU A 28 -8.264 -5.893 -9.879 1.00 0.00 O ATOM 451 CB LEU A 28 -7.358 -3.311 -8.362 1.00 0.00 C ATOM 452 CG LEU A 28 -6.244 -2.291 -8.128 1.00 0.00 C ATOM 453 CD1 LEU A 28 -6.139 -1.944 -6.651 1.00 0.00 C ATOM 454 CD2 LEU A 28 -4.916 -2.822 -8.649 1.00 0.00 C ATOM 0 H LEU A 28 -8.887 -1.783 -9.690 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.864 -3.764 -10.405 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.241 -2.987 -7.812 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.047 -4.264 -7.933 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.489 -1.382 -8.677 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.341 -1.217 -6.504 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.083 -1.521 -6.309 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.918 -2.846 -6.080 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.135 -2.083 -8.474 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.664 -3.746 -8.129 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.997 -3.018 -9.718 1.00 0.00 H new ATOM 466 N ALA A 29 -9.994 -4.462 -10.035 1.00 0.00 N ATOM 467 CA ALA A 29 -10.997 -5.515 -10.139 1.00 0.00 C ATOM 468 C ALA A 29 -10.634 -6.513 -11.234 1.00 0.00 C ATOM 469 O ALA A 29 -10.501 -7.713 -10.994 1.00 0.00 O ATOM 470 CB ALA A 29 -12.368 -4.912 -10.404 1.00 0.00 C ATOM 0 H ALA A 29 -10.372 -3.515 -10.063 1.00 0.00 H new ATOM 0 HA ALA A 29 -11.025 -6.052 -9.191 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -13.108 -5.709 -10.479 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -12.636 -4.244 -9.585 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -12.344 -4.350 -11.338 1.00 0.00 H new ATOM 476 N PRO A 30 -10.472 -6.007 -12.466 1.00 0.00 N ATOM 477 CA PRO A 30 -10.123 -6.838 -13.622 1.00 0.00 C ATOM 478 C PRO A 30 -8.696 -7.369 -13.545 1.00 0.00 C ATOM 479 O PRO A 30 -8.376 -8.407 -14.125 1.00 0.00 O ATOM 480 CB PRO A 30 -10.274 -5.879 -14.806 1.00 0.00 C ATOM 481 CG PRO A 30 -10.069 -4.523 -14.224 1.00 0.00 C ATOM 482 CD PRO A 30 -10.615 -4.586 -12.824 1.00 0.00 C ATOM 0 HA PRO A 30 -10.752 -7.725 -13.691 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -9.540 -6.091 -15.583 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -11.259 -5.968 -15.265 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -9.012 -4.256 -14.219 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -10.587 -3.764 -14.811 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -10.056 -3.942 -12.145 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -11.656 -4.264 -12.784 1.00 0.00 H new ATOM 490 N LYS A 31 -7.840 -6.650 -12.826 1.00 0.00 N ATOM 491 CA LYS A 31 -6.446 -7.049 -12.672 1.00 0.00 C ATOM 492 C LYS A 31 -6.332 -8.304 -11.812 1.00 0.00 C ATOM 493 O LYS A 31 -5.618 -9.244 -12.162 1.00 0.00 O ATOM 494 CB LYS A 31 -5.635 -5.912 -12.045 1.00 0.00 C ATOM 495 CG LYS A 31 -5.267 -4.814 -13.027 1.00 0.00 C ATOM 496 CD LYS A 31 -4.338 -3.790 -12.396 1.00 0.00 C ATOM 497 CE LYS A 31 -2.879 -4.182 -12.567 1.00 0.00 C ATOM 498 NZ LYS A 31 -2.439 -4.080 -13.986 1.00 0.00 N ATOM 0 H LYS A 31 -8.088 -5.788 -12.341 1.00 0.00 H new ATOM 0 HA LYS A 31 -6.045 -7.270 -13.661 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -6.207 -5.478 -11.225 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.722 -6.323 -11.614 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.786 -5.253 -13.901 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.173 -4.318 -13.376 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.509 -2.814 -12.849 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.568 -3.693 -11.335 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.255 -3.539 -11.946 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.734 -5.203 -12.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -1.404 -3.985 -14.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.727 -4.937 -14.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.879 -3.247 -14.427 1.00 0.00 H new ATOM 512 N ILE A 32 -7.040 -8.311 -10.687 1.00 0.00 N ATOM 513 CA ILE A 32 -7.019 -9.452 -9.780 1.00 0.00 C ATOM 514 C ILE A 32 -8.159 -10.418 -10.084 1.00 0.00 C ATOM 515 O ILE A 32 -8.329 -11.428 -9.403 1.00 0.00 O ATOM 516 CB ILE A 32 -7.120 -9.003 -8.310 1.00 0.00 C ATOM 517 CG1 ILE A 32 -6.227 -7.785 -8.063 1.00 0.00 C ATOM 518 CG2 ILE A 32 -6.736 -10.145 -7.380 1.00 0.00 C ATOM 519 CD1 ILE A 32 -6.475 -7.115 -6.729 1.00 0.00 C ATOM 0 H ILE A 32 -7.635 -7.540 -10.382 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.066 -9.959 -9.933 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.152 -8.721 -8.102 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.183 -8.093 -8.117 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -6.387 -7.059 -8.860 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.812 -9.812 -6.345 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.409 -10.987 -7.541 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.712 -10.454 -7.587 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.807 -6.260 -6.622 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -7.510 -6.776 -6.679 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.287 -7.826 -5.924 1.00 0.00 H new ATOM 531 N GLY A 33 -8.937 -10.100 -11.115 1.00 0.00 N ATOM 532 CA GLY A 33 -10.050 -10.951 -11.493 1.00 0.00 C ATOM 533 C GLY A 33 -9.636 -12.396 -11.685 1.00 0.00 C ATOM 534 O GLY A 33 -10.072 -13.291 -10.960 1.00 0.00 O ATOM 0 H GLY A 33 -8.816 -9.269 -11.694 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.822 -10.896 -10.725 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.492 -10.577 -12.417 1.00 0.00 H new ATOM 538 N PRO A 34 -8.776 -12.642 -12.685 1.00 0.00 N ATOM 539 CA PRO A 34 -8.285 -13.988 -12.994 1.00 0.00 C ATOM 540 C PRO A 34 -7.343 -14.523 -11.921 1.00 0.00 C ATOM 541 O PRO A 34 -7.182 -15.734 -11.769 1.00 0.00 O ATOM 542 CB PRO A 34 -7.537 -13.798 -14.316 1.00 0.00 C ATOM 543 CG PRO A 34 -7.128 -12.365 -14.317 1.00 0.00 C ATOM 544 CD PRO A 34 -8.215 -11.624 -13.589 1.00 0.00 C ATOM 0 HA PRO A 34 -9.096 -14.715 -13.048 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.671 -14.457 -14.379 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.176 -14.028 -15.169 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.166 -12.233 -13.821 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.016 -11.992 -15.335 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -7.820 -10.771 -13.037 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -8.968 -11.238 -14.276 1.00 0.00 H new ATOM 552 N LEU A 35 -6.724 -13.613 -11.177 1.00 0.00 N ATOM 553 CA LEU A 35 -5.797 -13.993 -10.116 1.00 0.00 C ATOM 554 C LEU A 35 -6.517 -14.767 -9.017 1.00 0.00 C ATOM 555 O LEU A 35 -6.205 -15.927 -8.754 1.00 0.00 O ATOM 556 CB LEU A 35 -5.128 -12.750 -9.527 1.00 0.00 C ATOM 557 CG LEU A 35 -3.822 -12.312 -10.191 1.00 0.00 C ATOM 558 CD1 LEU A 35 -4.088 -11.776 -11.589 1.00 0.00 C ATOM 559 CD2 LEU A 35 -3.116 -11.265 -9.342 1.00 0.00 C ATOM 0 H LEU A 35 -6.847 -12.607 -11.289 1.00 0.00 H new ATOM 0 HA LEU A 35 -5.032 -14.638 -10.548 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.835 -11.922 -9.580 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.931 -12.934 -8.471 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.170 -13.182 -10.275 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -3.147 -11.469 -12.046 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -4.549 -12.555 -12.196 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.759 -10.919 -11.529 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.189 -10.965 -9.830 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.762 -10.395 -9.225 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.891 -11.684 -8.361 1.00 0.00 H new ATOM 571 N GLY A 36 -7.484 -14.115 -8.377 1.00 0.00 N ATOM 572 CA GLY A 36 -8.234 -14.758 -7.315 1.00 0.00 C ATOM 573 C GLY A 36 -8.509 -13.825 -6.152 1.00 0.00 C ATOM 574 O GLY A 36 -9.660 -13.636 -5.756 1.00 0.00 O ATOM 0 H GLY A 36 -7.761 -13.153 -8.576 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.180 -15.125 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.680 -15.626 -6.957 1.00 0.00 H new ATOM 578 N LEU A 37 -7.450 -13.242 -5.602 1.00 0.00 N ATOM 579 CA LEU A 37 -7.582 -12.324 -4.475 1.00 0.00 C ATOM 580 C LEU A 37 -8.619 -11.245 -4.770 1.00 0.00 C ATOM 581 O LEU A 37 -9.153 -11.170 -5.876 1.00 0.00 O ATOM 582 CB LEU A 37 -6.232 -11.676 -4.159 1.00 0.00 C ATOM 583 CG LEU A 37 -5.256 -12.524 -3.341 1.00 0.00 C ATOM 584 CD1 LEU A 37 -4.717 -13.673 -4.178 1.00 0.00 C ATOM 585 CD2 LEU A 37 -4.117 -11.665 -2.814 1.00 0.00 C ATOM 0 H LEU A 37 -6.491 -13.388 -5.917 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.916 -12.896 -3.609 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.750 -11.409 -5.100 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.415 -10.747 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.793 -12.943 -2.490 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.024 -14.265 -3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.544 -14.303 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.196 -13.276 -5.049 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.432 -12.284 -2.234 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.581 -11.217 -3.651 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.520 -10.877 -2.178 1.00 0.00 H new ATOM 597 N SER A 38 -8.898 -10.411 -3.773 1.00 0.00 N ATOM 598 CA SER A 38 -9.872 -9.337 -3.925 1.00 0.00 C ATOM 599 C SER A 38 -9.187 -7.974 -3.899 1.00 0.00 C ATOM 600 O SER A 38 -8.235 -7.744 -3.153 1.00 0.00 O ATOM 601 CB SER A 38 -10.924 -9.414 -2.816 1.00 0.00 C ATOM 602 OG SER A 38 -12.016 -8.553 -3.089 1.00 0.00 O ATOM 0 H SER A 38 -8.463 -10.459 -2.852 1.00 0.00 H new ATOM 0 HA SER A 38 -10.363 -9.458 -4.891 1.00 0.00 H new ATOM 0 HB2 SER A 38 -11.281 -10.439 -2.719 1.00 0.00 H new ATOM 0 HB3 SER A 38 -10.472 -9.142 -1.862 1.00 0.00 H new ATOM 0 HG SER A 38 -12.675 -8.622 -2.367 1.00 0.00 H new ATOM 608 N PRO A 39 -9.683 -7.047 -4.732 1.00 0.00 N ATOM 609 CA PRO A 39 -9.135 -5.691 -4.823 1.00 0.00 C ATOM 610 C PRO A 39 -9.423 -4.864 -3.575 1.00 0.00 C ATOM 611 O PRO A 39 -8.706 -3.911 -3.270 1.00 0.00 O ATOM 612 CB PRO A 39 -9.857 -5.098 -6.036 1.00 0.00 C ATOM 613 CG PRO A 39 -11.132 -5.863 -6.129 1.00 0.00 C ATOM 614 CD PRO A 39 -10.817 -7.252 -5.648 1.00 0.00 C ATOM 0 HA PRO A 39 -8.049 -5.696 -4.916 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.043 -4.032 -5.904 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.263 -5.207 -6.943 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.908 -5.404 -5.516 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -11.503 -5.880 -7.154 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -11.668 -7.704 -5.139 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -10.552 -7.913 -6.474 1.00 0.00 H new ATOM 622 N LYS A 40 -10.478 -5.234 -2.856 1.00 0.00 N ATOM 623 CA LYS A 40 -10.860 -4.528 -1.639 1.00 0.00 C ATOM 624 C LYS A 40 -9.834 -4.754 -0.533 1.00 0.00 C ATOM 625 O LYS A 40 -9.313 -3.803 0.048 1.00 0.00 O ATOM 626 CB LYS A 40 -12.242 -4.991 -1.170 1.00 0.00 C ATOM 627 CG LYS A 40 -12.732 -4.274 0.077 1.00 0.00 C ATOM 628 CD LYS A 40 -13.794 -5.082 0.803 1.00 0.00 C ATOM 629 CE LYS A 40 -13.181 -6.225 1.596 1.00 0.00 C ATOM 630 NZ LYS A 40 -14.155 -7.328 1.826 1.00 0.00 N ATOM 0 H LYS A 40 -11.084 -6.019 -3.096 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.896 -3.462 -1.863 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.961 -4.835 -1.975 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -12.210 -6.063 -0.974 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.892 -4.091 0.747 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -13.138 -3.301 -0.198 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -14.352 -4.430 1.475 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -14.506 -5.480 0.081 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -12.313 -6.613 1.062 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -12.824 -5.850 2.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -13.698 -8.087 2.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -14.972 -6.965 2.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.477 -7.703 0.911 1.00 0.00 H new ATOM 644 N LYS A 41 -9.548 -6.020 -0.248 1.00 0.00 N ATOM 645 CA LYS A 41 -8.582 -6.372 0.786 1.00 0.00 C ATOM 646 C LYS A 41 -7.192 -5.853 0.432 1.00 0.00 C ATOM 647 O LYS A 41 -6.509 -5.257 1.265 1.00 0.00 O ATOM 648 CB LYS A 41 -8.538 -7.890 0.976 1.00 0.00 C ATOM 649 CG LYS A 41 -8.114 -8.316 2.371 1.00 0.00 C ATOM 650 CD LYS A 41 -8.493 -9.760 2.652 1.00 0.00 C ATOM 651 CE LYS A 41 -9.928 -9.874 3.145 1.00 0.00 C ATOM 652 NZ LYS A 41 -10.352 -11.294 3.295 1.00 0.00 N ATOM 0 H LYS A 41 -9.972 -6.820 -0.719 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.899 -5.904 1.718 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.524 -8.303 0.763 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -7.849 -8.319 0.249 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.036 -8.194 2.478 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.583 -7.665 3.109 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.371 -10.352 1.745 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.817 -10.176 3.399 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -10.025 -9.363 4.103 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -10.594 -9.368 2.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.335 -11.329 3.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.284 -11.775 2.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.733 -11.770 3.982 1.00 0.00 H new ATOM 666 N VAL A 42 -6.778 -6.082 -0.811 1.00 0.00 N ATOM 667 CA VAL A 42 -5.471 -5.635 -1.276 1.00 0.00 C ATOM 668 C VAL A 42 -5.415 -4.116 -1.381 1.00 0.00 C ATOM 669 O VAL A 42 -4.432 -3.491 -0.983 1.00 0.00 O ATOM 670 CB VAL A 42 -5.124 -6.246 -2.647 1.00 0.00 C ATOM 671 CG1 VAL A 42 -3.761 -5.763 -3.118 1.00 0.00 C ATOM 672 CG2 VAL A 42 -5.165 -7.766 -2.579 1.00 0.00 C ATOM 0 H VAL A 42 -7.330 -6.575 -1.513 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.741 -5.973 -0.540 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.870 -5.917 -3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.533 -6.205 -4.088 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -3.771 -4.677 -3.208 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.000 -6.060 -2.396 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.917 -8.181 -3.556 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.442 -8.117 -1.842 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.165 -8.090 -2.290 1.00 0.00 H new ATOM 682 N GLY A 43 -6.477 -3.525 -1.919 1.00 0.00 N ATOM 683 CA GLY A 43 -6.529 -2.082 -2.066 1.00 0.00 C ATOM 684 C GLY A 43 -6.547 -1.364 -0.731 1.00 0.00 C ATOM 685 O GLY A 43 -5.840 -0.374 -0.541 1.00 0.00 O ATOM 0 H GLY A 43 -7.303 -4.020 -2.256 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.667 -1.747 -2.644 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.419 -1.809 -2.634 1.00 0.00 H new ATOM 689 N ASP A 44 -7.359 -1.861 0.196 1.00 0.00 N ATOM 690 CA ASP A 44 -7.466 -1.260 1.520 1.00 0.00 C ATOM 691 C ASP A 44 -6.141 -1.355 2.270 1.00 0.00 C ATOM 692 O ASP A 44 -5.781 -0.456 3.030 1.00 0.00 O ATOM 693 CB ASP A 44 -8.572 -1.943 2.326 1.00 0.00 C ATOM 694 CG ASP A 44 -8.688 -1.393 3.733 1.00 0.00 C ATOM 695 OD1 ASP A 44 -7.673 -1.406 4.461 1.00 0.00 O ATOM 696 OD2 ASP A 44 -9.793 -0.948 4.107 1.00 0.00 O ATOM 0 H ASP A 44 -7.953 -2.678 0.055 1.00 0.00 H new ATOM 0 HA ASP A 44 -7.716 -0.207 1.394 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -9.524 -1.817 1.810 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -8.375 -3.014 2.373 1.00 0.00 H new ATOM 701 N ASP A 45 -5.421 -2.449 2.051 1.00 0.00 N ATOM 702 CA ASP A 45 -4.135 -2.662 2.706 1.00 0.00 C ATOM 703 C ASP A 45 -3.113 -1.628 2.245 1.00 0.00 C ATOM 704 O ASP A 45 -2.271 -1.183 3.025 1.00 0.00 O ATOM 705 CB ASP A 45 -3.619 -4.073 2.417 1.00 0.00 C ATOM 706 CG ASP A 45 -4.085 -5.082 3.447 1.00 0.00 C ATOM 707 OD1 ASP A 45 -5.221 -5.582 3.316 1.00 0.00 O ATOM 708 OD2 ASP A 45 -3.313 -5.371 4.386 1.00 0.00 O ATOM 0 H ASP A 45 -5.705 -3.202 1.425 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.279 -2.550 3.781 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.957 -4.385 1.429 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -2.529 -4.060 2.392 1.00 0.00 H new ATOM 713 N ILE A 46 -3.192 -1.252 0.973 1.00 0.00 N ATOM 714 CA ILE A 46 -2.274 -0.271 0.408 1.00 0.00 C ATOM 715 C ILE A 46 -2.538 1.119 0.976 1.00 0.00 C ATOM 716 O ILE A 46 -1.607 1.847 1.321 1.00 0.00 O ATOM 717 CB ILE A 46 -2.383 -0.216 -1.127 1.00 0.00 C ATOM 718 CG1 ILE A 46 -1.991 -1.563 -1.737 1.00 0.00 C ATOM 719 CG2 ILE A 46 -1.505 0.897 -1.681 1.00 0.00 C ATOM 720 CD1 ILE A 46 -2.356 -1.694 -3.199 1.00 0.00 C ATOM 0 H ILE A 46 -3.882 -1.612 0.314 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.267 -0.587 0.681 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.418 -0.004 -1.395 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.916 -1.704 -1.625 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.477 -2.362 -1.177 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.593 0.923 -2.767 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.826 1.853 -1.268 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.467 0.713 -1.405 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.048 -2.674 -3.564 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.434 -1.585 -3.316 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.849 -0.918 -3.772 1.00 0.00 H new ATOM 732 N ALA A 47 -3.813 1.481 1.071 1.00 0.00 N ATOM 733 CA ALA A 47 -4.200 2.783 1.601 1.00 0.00 C ATOM 734 C ALA A 47 -3.659 2.985 3.012 1.00 0.00 C ATOM 735 O ALA A 47 -3.092 4.031 3.327 1.00 0.00 O ATOM 736 CB ALA A 47 -5.714 2.929 1.588 1.00 0.00 C ATOM 0 H ALA A 47 -4.596 0.891 0.788 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.766 3.551 0.961 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -5.989 3.906 1.986 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -6.079 2.838 0.565 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -6.160 2.148 2.203 1.00 0.00 H new ATOM 742 N LYS A 48 -3.838 1.977 3.859 1.00 0.00 N ATOM 743 CA LYS A 48 -3.367 2.042 5.237 1.00 0.00 C ATOM 744 C LYS A 48 -1.844 2.105 5.290 1.00 0.00 C ATOM 745 O LYS A 48 -1.271 2.804 6.125 1.00 0.00 O ATOM 746 CB LYS A 48 -3.866 0.829 6.026 1.00 0.00 C ATOM 747 CG LYS A 48 -3.308 -0.492 5.527 1.00 0.00 C ATOM 748 CD LYS A 48 -3.531 -1.608 6.534 1.00 0.00 C ATOM 749 CE LYS A 48 -2.391 -1.688 7.538 1.00 0.00 C ATOM 750 NZ LYS A 48 -2.545 -0.689 8.632 1.00 0.00 N ATOM 0 H LYS A 48 -4.306 1.104 3.615 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.766 2.951 5.688 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -3.599 0.954 7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.954 0.796 5.976 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.782 -0.754 4.581 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.241 -0.386 5.330 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.471 -1.442 7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.623 -2.559 6.010 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.352 -2.690 7.964 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.443 -1.522 7.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.129 -1.066 9.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -2.058 0.192 8.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.555 -0.494 8.784 1.00 0.00 H new ATOM 764 N ALA A 49 -1.195 1.371 4.392 1.00 0.00 N ATOM 765 CA ALA A 49 0.261 1.346 4.335 1.00 0.00 C ATOM 766 C ALA A 49 0.821 2.725 4.002 1.00 0.00 C ATOM 767 O ALA A 49 1.947 3.057 4.374 1.00 0.00 O ATOM 768 CB ALA A 49 0.732 0.323 3.312 1.00 0.00 C ATOM 0 H ALA A 49 -1.655 0.786 3.694 1.00 0.00 H new ATOM 0 HA ALA A 49 0.633 1.059 5.318 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.822 0.315 3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 49 0.370 -0.666 3.593 1.00 0.00 H new ATOM 0 HB3 ALA A 49 0.342 0.586 2.329 1.00 0.00 H new ATOM 774 N THR A 50 0.027 3.526 3.297 1.00 0.00 N ATOM 775 CA THR A 50 0.444 4.869 2.912 1.00 0.00 C ATOM 776 C THR A 50 -0.143 5.917 3.850 1.00 0.00 C ATOM 777 O THR A 50 -0.278 7.084 3.486 1.00 0.00 O ATOM 778 CB THR A 50 0.022 5.195 1.467 1.00 0.00 C ATOM 779 OG1 THR A 50 -1.406 5.192 1.361 1.00 0.00 O ATOM 780 CG2 THR A 50 0.610 4.188 0.491 1.00 0.00 C ATOM 0 H THR A 50 -0.908 3.268 2.981 1.00 0.00 H new ATOM 0 HA THR A 50 1.532 4.894 2.979 1.00 0.00 H new ATOM 0 HB THR A 50 0.402 6.185 1.216 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.793 4.785 2.164 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.298 4.439 -0.523 1.00 0.00 H new ATOM 0 HG22 THR A 50 1.698 4.214 0.553 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.256 3.188 0.742 1.00 0.00 H new ATOM 788 N GLY A 51 -0.492 5.493 5.061 1.00 0.00 N ATOM 789 CA GLY A 51 -1.060 6.408 6.033 1.00 0.00 C ATOM 790 C GLY A 51 -0.087 7.495 6.444 1.00 0.00 C ATOM 791 O GLY A 51 -0.467 8.657 6.584 1.00 0.00 O ATOM 0 H GLY A 51 -0.391 4.531 5.386 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.957 6.866 5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.370 5.849 6.916 1.00 0.00 H new ATOM 795 N ASP A 52 1.171 7.116 6.641 1.00 0.00 N ATOM 796 CA ASP A 52 2.202 8.067 7.040 1.00 0.00 C ATOM 797 C ASP A 52 2.481 9.067 5.923 1.00 0.00 C ATOM 798 O ASP A 52 2.857 10.211 6.180 1.00 0.00 O ATOM 799 CB ASP A 52 3.489 7.329 7.415 1.00 0.00 C ATOM 800 CG ASP A 52 3.394 6.649 8.767 1.00 0.00 C ATOM 801 OD1 ASP A 52 3.032 7.330 9.749 1.00 0.00 O ATOM 802 OD2 ASP A 52 3.682 5.436 8.843 1.00 0.00 O ATOM 0 H ASP A 52 1.501 6.157 6.531 1.00 0.00 H new ATOM 0 HA ASP A 52 1.840 8.614 7.910 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.712 6.584 6.652 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.320 8.035 7.424 1.00 0.00 H new ATOM 807 N TRP A 53 2.296 8.627 4.683 1.00 0.00 N ATOM 808 CA TRP A 53 2.530 9.484 3.526 1.00 0.00 C ATOM 809 C TRP A 53 1.313 9.501 2.608 1.00 0.00 C ATOM 810 O TRP A 53 1.436 9.334 1.394 1.00 0.00 O ATOM 811 CB TRP A 53 3.761 9.008 2.753 1.00 0.00 C ATOM 812 CG TRP A 53 3.896 7.516 2.713 1.00 0.00 C ATOM 813 CD1 TRP A 53 3.418 6.676 1.748 1.00 0.00 C ATOM 814 CD2 TRP A 53 4.553 6.689 3.679 1.00 0.00 C ATOM 815 NE1 TRP A 53 3.737 5.376 2.058 1.00 0.00 N ATOM 816 CE2 TRP A 53 4.434 5.357 3.237 1.00 0.00 C ATOM 817 CE3 TRP A 53 5.231 6.943 4.874 1.00 0.00 C ATOM 818 CZ2 TRP A 53 4.967 4.286 3.949 1.00 0.00 C ATOM 819 CZ3 TRP A 53 5.759 5.879 5.580 1.00 0.00 C ATOM 820 CH2 TRP A 53 5.626 4.564 5.115 1.00 0.00 C ATOM 0 H TRP A 53 1.985 7.683 4.453 1.00 0.00 H new ATOM 0 HA TRP A 53 2.706 10.498 3.885 1.00 0.00 H new ATOM 0 HB2 TRP A 53 3.710 9.389 1.733 1.00 0.00 H new ATOM 0 HB3 TRP A 53 4.655 9.435 3.208 1.00 0.00 H new ATOM 0 HD1 TRP A 53 2.870 6.988 0.871 1.00 0.00 H new ATOM 0 HE1 TRP A 53 3.494 4.557 1.500 1.00 0.00 H new ATOM 0 HE3 TRP A 53 5.340 7.953 5.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 4.864 3.271 3.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 6.283 6.064 6.506 1.00 0.00 H new ATOM 0 HH2 TRP A 53 6.052 3.754 5.688 1.00 0.00 H new ATOM 831 N LYS A 54 0.137 9.705 3.193 1.00 0.00 N ATOM 832 CA LYS A 54 -1.103 9.746 2.427 1.00 0.00 C ATOM 833 C LYS A 54 -1.172 11.006 1.571 1.00 0.00 C ATOM 834 O LYS A 54 -1.554 12.073 2.049 1.00 0.00 O ATOM 835 CB LYS A 54 -2.309 9.688 3.367 1.00 0.00 C ATOM 836 CG LYS A 54 -3.645 9.707 2.645 1.00 0.00 C ATOM 837 CD LYS A 54 -4.804 9.541 3.612 1.00 0.00 C ATOM 838 CE LYS A 54 -5.298 10.884 4.128 1.00 0.00 C ATOM 839 NZ LYS A 54 -6.370 11.450 3.264 1.00 0.00 N ATOM 0 H LYS A 54 0.017 9.845 4.196 1.00 0.00 H new ATOM 0 HA LYS A 54 -1.122 8.879 1.767 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -2.245 8.783 3.971 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -2.265 10.533 4.054 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.754 10.647 2.104 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -3.671 8.908 1.904 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -5.621 9.018 3.115 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -4.492 8.920 4.452 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.675 10.766 5.144 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -4.464 11.584 4.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -6.680 12.365 3.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.003 11.586 2.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -7.177 10.795 3.238 1.00 0.00 H new ATOM 853 N GLY A 55 -0.801 10.874 0.301 1.00 0.00 N ATOM 854 CA GLY A 55 -0.830 12.010 -0.602 1.00 0.00 C ATOM 855 C GLY A 55 0.292 11.971 -1.620 1.00 0.00 C ATOM 856 O GLY A 55 0.097 12.321 -2.784 1.00 0.00 O ATOM 0 H GLY A 55 -0.481 10.001 -0.118 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.788 12.032 -1.122 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.760 12.931 -0.024 1.00 0.00 H new ATOM 860 N LEU A 56 1.472 11.546 -1.181 1.00 0.00 N ATOM 861 CA LEU A 56 2.632 11.463 -2.061 1.00 0.00 C ATOM 862 C LEU A 56 2.621 10.162 -2.857 1.00 0.00 C ATOM 863 O LEU A 56 2.218 9.116 -2.348 1.00 0.00 O ATOM 864 CB LEU A 56 3.923 11.566 -1.248 1.00 0.00 C ATOM 865 CG LEU A 56 3.979 12.695 -0.217 1.00 0.00 C ATOM 866 CD1 LEU A 56 4.869 12.305 0.953 1.00 0.00 C ATOM 867 CD2 LEU A 56 4.475 13.981 -0.861 1.00 0.00 C ATOM 0 H LEU A 56 1.650 11.253 -0.220 1.00 0.00 H new ATOM 0 HA LEU A 56 2.584 12.296 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.079 10.620 -0.730 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.756 11.691 -1.940 1.00 0.00 H new ATOM 0 HG LEU A 56 2.971 12.867 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.897 13.120 1.676 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.471 11.410 1.430 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.878 12.106 0.592 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.508 14.773 -0.113 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.474 13.823 -1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.798 14.270 -1.665 1.00 0.00 H new ATOM 879 N ARG A 57 3.067 10.234 -4.106 1.00 0.00 N ATOM 880 CA ARG A 57 3.109 9.061 -4.971 1.00 0.00 C ATOM 881 C ARG A 57 4.399 8.275 -4.758 1.00 0.00 C ATOM 882 O ARG A 57 5.493 8.840 -4.779 1.00 0.00 O ATOM 883 CB ARG A 57 2.990 9.479 -6.438 1.00 0.00 C ATOM 884 CG ARG A 57 4.270 10.066 -7.010 1.00 0.00 C ATOM 885 CD ARG A 57 5.160 8.988 -7.609 1.00 0.00 C ATOM 886 NE ARG A 57 4.789 8.675 -8.986 1.00 0.00 N ATOM 887 CZ ARG A 57 5.202 9.377 -10.036 1.00 0.00 C ATOM 888 NH1 ARG A 57 5.995 10.426 -9.865 1.00 0.00 N ATOM 889 NH2 ARG A 57 4.822 9.030 -11.259 1.00 0.00 N ATOM 0 H ARG A 57 3.405 11.092 -4.542 1.00 0.00 H new ATOM 0 HA ARG A 57 2.266 8.420 -4.713 1.00 0.00 H new ATOM 0 HB2 ARG A 57 2.701 8.612 -7.032 1.00 0.00 H new ATOM 0 HB3 ARG A 57 2.189 10.212 -6.534 1.00 0.00 H new ATOM 0 HG2 ARG A 57 4.023 10.802 -7.775 1.00 0.00 H new ATOM 0 HG3 ARG A 57 4.813 10.592 -6.225 1.00 0.00 H new ATOM 0 HD2 ARG A 57 6.199 9.318 -7.579 1.00 0.00 H new ATOM 0 HD3 ARG A 57 5.095 8.085 -7.002 1.00 0.00 H new ATOM 0 HE ARG A 57 4.180 7.874 -9.151 1.00 0.00 H new ATOM 0 HH11 ARG A 57 6.289 10.695 -8.926 1.00 0.00 H new ATOM 0 HH12 ARG A 57 6.311 10.963 -10.672 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.212 8.224 -11.394 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.140 9.570 -12.064 1.00 0.00 H new ATOM 903 N ILE A 58 4.263 6.969 -4.553 1.00 0.00 N ATOM 904 CA ILE A 58 5.417 6.105 -4.337 1.00 0.00 C ATOM 905 C ILE A 58 5.261 4.783 -5.080 1.00 0.00 C ATOM 906 O ILE A 58 4.151 4.385 -5.437 1.00 0.00 O ATOM 907 CB ILE A 58 5.632 5.818 -2.839 1.00 0.00 C ATOM 908 CG1 ILE A 58 4.465 4.999 -2.282 1.00 0.00 C ATOM 909 CG2 ILE A 58 5.789 7.119 -2.067 1.00 0.00 C ATOM 910 CD1 ILE A 58 3.244 5.831 -1.958 1.00 0.00 C ATOM 0 H ILE A 58 3.365 6.486 -4.532 1.00 0.00 H new ATOM 0 HA ILE A 58 6.286 6.636 -4.725 1.00 0.00 H new ATOM 0 HB ILE A 58 6.547 5.237 -2.723 1.00 0.00 H new ATOM 0 HG12 ILE A 58 4.191 4.233 -3.007 1.00 0.00 H new ATOM 0 HG13 ILE A 58 4.792 4.482 -1.380 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.940 6.899 -1.010 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.649 7.668 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 58 4.890 7.724 -2.187 1.00 0.00 H new ATOM 0 HD11 ILE A 58 2.457 5.186 -1.568 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.502 6.581 -1.210 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.892 6.327 -2.862 1.00 0.00 H new ATOM 922 N THR A 59 6.380 4.103 -5.309 1.00 0.00 N ATOM 923 CA THR A 59 6.369 2.825 -6.009 1.00 0.00 C ATOM 924 C THR A 59 6.207 1.665 -5.033 1.00 0.00 C ATOM 925 O THR A 59 6.970 1.536 -4.075 1.00 0.00 O ATOM 926 CB THR A 59 7.660 2.619 -6.824 1.00 0.00 C ATOM 927 OG1 THR A 59 8.006 3.829 -7.507 1.00 0.00 O ATOM 928 CG2 THR A 59 7.489 1.492 -7.832 1.00 0.00 C ATOM 0 H THR A 59 7.306 4.417 -5.019 1.00 0.00 H new ATOM 0 HA THR A 59 5.518 2.845 -6.690 1.00 0.00 H new ATOM 0 HB THR A 59 8.460 2.350 -6.135 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.829 3.691 -8.021 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.413 1.365 -8.396 1.00 0.00 H new ATOM 0 HG22 THR A 59 7.254 0.566 -7.306 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.677 1.736 -8.517 1.00 0.00 H new ATOM 936 N VAL A 60 5.209 0.823 -5.282 1.00 0.00 N ATOM 937 CA VAL A 60 4.949 -0.328 -4.425 1.00 0.00 C ATOM 938 C VAL A 60 5.057 -1.631 -5.208 1.00 0.00 C ATOM 939 O VAL A 60 4.615 -1.719 -6.354 1.00 0.00 O ATOM 940 CB VAL A 60 3.552 -0.243 -3.781 1.00 0.00 C ATOM 941 CG1 VAL A 60 3.292 -1.461 -2.908 1.00 0.00 C ATOM 942 CG2 VAL A 60 3.414 1.040 -2.976 1.00 0.00 C ATOM 0 H VAL A 60 4.568 0.916 -6.070 1.00 0.00 H new ATOM 0 HA VAL A 60 5.705 -0.316 -3.640 1.00 0.00 H new ATOM 0 HB VAL A 60 2.805 -0.229 -4.575 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.301 -1.384 -2.461 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.346 -2.363 -3.517 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.043 -1.510 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.421 1.084 -2.528 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.168 1.059 -2.189 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.554 1.899 -3.633 1.00 0.00 H new ATOM 952 N LYS A 61 5.649 -2.643 -4.583 1.00 0.00 N ATOM 953 CA LYS A 61 5.815 -3.945 -5.219 1.00 0.00 C ATOM 954 C LYS A 61 4.828 -4.959 -4.650 1.00 0.00 C ATOM 955 O LYS A 61 4.811 -5.216 -3.445 1.00 0.00 O ATOM 956 CB LYS A 61 7.247 -4.449 -5.029 1.00 0.00 C ATOM 957 CG LYS A 61 7.632 -4.654 -3.574 1.00 0.00 C ATOM 958 CD LYS A 61 9.116 -4.945 -3.425 1.00 0.00 C ATOM 959 CE LYS A 61 9.450 -6.366 -3.855 1.00 0.00 C ATOM 960 NZ LYS A 61 9.722 -6.454 -5.316 1.00 0.00 N ATOM 0 H LYS A 61 6.022 -2.587 -3.635 1.00 0.00 H new ATOM 0 HA LYS A 61 5.615 -3.829 -6.284 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.365 -5.391 -5.564 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.937 -3.737 -5.482 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.376 -3.764 -3.000 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.055 -5.479 -3.157 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.689 -4.238 -4.025 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.415 -4.798 -2.387 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.321 -6.718 -3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.622 -7.027 -3.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.326 -7.340 -5.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.281 -5.646 -5.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.749 -6.437 -5.480 1.00 0.00 H new ATOM 974 N LEU A 62 4.007 -5.533 -5.522 1.00 0.00 N ATOM 975 CA LEU A 62 3.018 -6.521 -5.107 1.00 0.00 C ATOM 976 C LEU A 62 3.519 -7.937 -5.369 1.00 0.00 C ATOM 977 O LEU A 62 3.734 -8.329 -6.517 1.00 0.00 O ATOM 978 CB LEU A 62 1.697 -6.290 -5.843 1.00 0.00 C ATOM 979 CG LEU A 62 0.940 -5.013 -5.478 1.00 0.00 C ATOM 980 CD1 LEU A 62 -0.086 -4.676 -6.549 1.00 0.00 C ATOM 981 CD2 LEU A 62 0.267 -5.161 -4.121 1.00 0.00 C ATOM 0 H LEU A 62 4.007 -5.331 -6.522 1.00 0.00 H new ATOM 0 HA LEU A 62 2.854 -6.407 -4.035 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.899 -6.275 -6.914 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.044 -7.142 -5.653 1.00 0.00 H new ATOM 0 HG LEU A 62 1.656 -4.194 -5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.615 -3.764 -6.272 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.420 -4.527 -7.503 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.799 -5.495 -6.641 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.267 -4.242 -3.878 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.437 -5.993 -4.153 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.022 -5.354 -3.359 1.00 0.00 H new ATOM 993 N THR A 63 3.701 -8.704 -4.298 1.00 0.00 N ATOM 994 CA THR A 63 4.175 -10.077 -4.413 1.00 0.00 C ATOM 995 C THR A 63 3.156 -11.059 -3.848 1.00 0.00 C ATOM 996 O THR A 63 2.847 -11.031 -2.656 1.00 0.00 O ATOM 997 CB THR A 63 5.517 -10.270 -3.682 1.00 0.00 C ATOM 998 OG1 THR A 63 6.472 -9.310 -4.148 1.00 0.00 O ATOM 999 CG2 THR A 63 6.055 -11.676 -3.902 1.00 0.00 C ATOM 0 H THR A 63 3.527 -8.397 -3.341 1.00 0.00 H new ATOM 0 HA THR A 63 4.316 -10.275 -5.475 1.00 0.00 H new ATOM 0 HB THR A 63 5.348 -10.125 -2.615 1.00 0.00 H new ATOM 0 HG1 THR A 63 7.374 -9.687 -4.082 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.003 -11.789 -3.377 1.00 0.00 H new ATOM 0 HG22 THR A 63 5.339 -12.403 -3.519 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.209 -11.844 -4.968 1.00 0.00 H new ATOM 1007 N ILE A 64 2.637 -11.928 -4.709 1.00 0.00 N ATOM 1008 CA ILE A 64 1.654 -12.920 -4.295 1.00 0.00 C ATOM 1009 C ILE A 64 2.293 -14.296 -4.140 1.00 0.00 C ATOM 1010 O ILE A 64 2.904 -14.815 -5.074 1.00 0.00 O ATOM 1011 CB ILE A 64 0.492 -13.016 -5.301 1.00 0.00 C ATOM 1012 CG1 ILE A 64 -0.141 -11.639 -5.515 1.00 0.00 C ATOM 1013 CG2 ILE A 64 -0.549 -14.013 -4.814 1.00 0.00 C ATOM 1014 CD1 ILE A 64 -1.220 -11.307 -4.509 1.00 0.00 C ATOM 0 H ILE A 64 2.882 -11.965 -5.699 1.00 0.00 H new ATOM 0 HA ILE A 64 1.263 -12.593 -3.332 1.00 0.00 H new ATOM 0 HB ILE A 64 0.885 -13.367 -6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 64 0.638 -10.878 -5.464 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.565 -11.595 -6.518 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.364 -14.070 -5.536 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.090 -14.996 -4.707 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.940 -13.689 -3.850 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.624 -10.317 -4.722 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.018 -12.046 -4.575 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.797 -11.318 -3.505 1.00 0.00 H new ATOM 1026 N GLN A 65 2.145 -14.882 -2.956 1.00 0.00 N ATOM 1027 CA GLN A 65 2.707 -16.199 -2.681 1.00 0.00 C ATOM 1028 C GLN A 65 1.813 -16.983 -1.727 1.00 0.00 C ATOM 1029 O GLN A 65 1.408 -16.476 -0.682 1.00 0.00 O ATOM 1030 CB GLN A 65 4.111 -16.063 -2.088 1.00 0.00 C ATOM 1031 CG GLN A 65 4.972 -17.302 -2.275 1.00 0.00 C ATOM 1032 CD GLN A 65 6.317 -17.187 -1.585 1.00 0.00 C ATOM 1033 OE1 GLN A 65 6.392 -16.908 -0.388 1.00 0.00 O ATOM 1034 NE2 GLN A 65 7.389 -17.403 -2.338 1.00 0.00 N ATOM 0 H GLN A 65 1.641 -14.466 -2.173 1.00 0.00 H new ATOM 0 HA GLN A 65 2.769 -16.745 -3.623 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.610 -15.211 -2.549 1.00 0.00 H new ATOM 0 HB3 GLN A 65 4.027 -15.846 -1.023 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.441 -18.171 -1.886 1.00 0.00 H new ATOM 0 HG3 GLN A 65 5.128 -17.474 -3.340 1.00 0.00 H new ATOM 0 HE21 GLN A 65 7.281 -17.632 -3.326 1.00 0.00 H new ATOM 0 HE22 GLN A 65 8.321 -17.340 -1.928 1.00 0.00 H new ATOM 1043 N ASN A 66 1.508 -18.224 -2.094 1.00 0.00 N ATOM 1044 CA ASN A 66 0.661 -19.079 -1.271 1.00 0.00 C ATOM 1045 C ASN A 66 -0.674 -18.400 -0.977 1.00 0.00 C ATOM 1046 O ASN A 66 -1.100 -18.318 0.175 1.00 0.00 O ATOM 1047 CB ASN A 66 1.370 -19.424 0.040 1.00 0.00 C ATOM 1048 CG ASN A 66 0.809 -20.675 0.688 1.00 0.00 C ATOM 1049 OD1 ASN A 66 -0.352 -21.028 0.481 1.00 0.00 O ATOM 1050 ND2 ASN A 66 1.635 -21.353 1.478 1.00 0.00 N ATOM 0 H ASN A 66 1.835 -18.660 -2.956 1.00 0.00 H new ATOM 0 HA ASN A 66 0.467 -19.998 -1.824 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.434 -19.563 -0.151 1.00 0.00 H new ATOM 0 HB3 ASN A 66 1.277 -18.587 0.732 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.314 -22.203 1.941 1.00 0.00 H new ATOM 0 HD22 ASN A 66 2.590 -21.023 1.621 1.00 0.00 H new ATOM 1057 N ARG A 67 -1.329 -17.916 -2.027 1.00 0.00 N ATOM 1058 CA ARG A 67 -2.615 -17.245 -1.882 1.00 0.00 C ATOM 1059 C ARG A 67 -2.520 -16.099 -0.879 1.00 0.00 C ATOM 1060 O ARG A 67 -3.510 -15.733 -0.246 1.00 0.00 O ATOM 1061 CB ARG A 67 -3.687 -18.241 -1.435 1.00 0.00 C ATOM 1062 CG ARG A 67 -3.961 -19.337 -2.452 1.00 0.00 C ATOM 1063 CD ARG A 67 -5.391 -19.846 -2.350 1.00 0.00 C ATOM 1064 NE ARG A 67 -5.744 -20.714 -3.470 1.00 0.00 N ATOM 1065 CZ ARG A 67 -6.995 -20.987 -3.822 1.00 0.00 C ATOM 1066 NH1 ARG A 67 -8.007 -20.464 -3.143 1.00 0.00 N ATOM 1067 NH2 ARG A 67 -7.236 -21.786 -4.854 1.00 0.00 N ATOM 0 H ARG A 67 -0.990 -17.976 -2.987 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.893 -16.834 -2.852 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -3.377 -18.698 -0.495 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.613 -17.701 -1.237 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -3.780 -18.956 -3.457 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -3.267 -20.163 -2.294 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.516 -20.392 -1.415 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -6.076 -18.999 -2.318 1.00 0.00 H new ATOM 0 HE ARG A 67 -4.988 -21.134 -4.012 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.825 -19.851 -2.349 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -8.967 -20.675 -3.415 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -6.460 -22.191 -5.378 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -8.197 -21.995 -5.124 1.00 0.00 H new ATOM 1081 N GLN A 68 -1.323 -15.539 -0.739 1.00 0.00 N ATOM 1082 CA GLN A 68 -1.099 -14.437 0.188 1.00 0.00 C ATOM 1083 C GLN A 68 -0.649 -13.183 -0.556 1.00 0.00 C ATOM 1084 O GLN A 68 -0.145 -13.261 -1.675 1.00 0.00 O ATOM 1085 CB GLN A 68 -0.053 -14.826 1.234 1.00 0.00 C ATOM 1086 CG GLN A 68 -0.026 -13.902 2.441 1.00 0.00 C ATOM 1087 CD GLN A 68 0.552 -14.569 3.673 1.00 0.00 C ATOM 1088 OE1 GLN A 68 0.033 -15.579 4.148 1.00 0.00 O ATOM 1089 NE2 GLN A 68 1.634 -14.005 4.199 1.00 0.00 N ATOM 0 H GLN A 68 -0.493 -15.831 -1.256 1.00 0.00 H new ATOM 0 HA GLN A 68 -2.042 -14.221 0.691 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.249 -15.844 1.571 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.932 -14.829 0.767 1.00 0.00 H new ATOM 0 HG2 GLN A 68 0.562 -13.016 2.202 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -1.039 -13.563 2.657 1.00 0.00 H new ATOM 0 HE21 GLN A 68 2.031 -13.168 3.773 1.00 0.00 H new ATOM 0 HE22 GLN A 68 2.067 -14.409 5.029 1.00 0.00 H new ATOM 1098 N ALA A 69 -0.836 -12.028 0.075 1.00 0.00 N ATOM 1099 CA ALA A 69 -0.448 -10.758 -0.526 1.00 0.00 C ATOM 1100 C ALA A 69 0.399 -9.932 0.435 1.00 0.00 C ATOM 1101 O ALA A 69 0.124 -9.884 1.634 1.00 0.00 O ATOM 1102 CB ALA A 69 -1.682 -9.977 -0.951 1.00 0.00 C ATOM 0 H ALA A 69 -1.254 -11.946 1.002 1.00 0.00 H new ATOM 0 HA ALA A 69 0.155 -10.971 -1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.378 -9.031 -1.398 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.247 -10.558 -1.680 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.307 -9.782 -0.080 1.00 0.00 H new ATOM 1108 N GLN A 70 1.429 -9.283 -0.098 1.00 0.00 N ATOM 1109 CA GLN A 70 2.316 -8.459 0.715 1.00 0.00 C ATOM 1110 C GLN A 70 2.599 -7.126 0.031 1.00 0.00 C ATOM 1111 O GLN A 70 2.734 -7.060 -1.191 1.00 0.00 O ATOM 1112 CB GLN A 70 3.629 -9.198 0.982 1.00 0.00 C ATOM 1113 CG GLN A 70 4.431 -8.616 2.135 1.00 0.00 C ATOM 1114 CD GLN A 70 4.075 -9.244 3.468 1.00 0.00 C ATOM 1115 OE1 GLN A 70 2.901 -9.335 3.831 1.00 0.00 O ATOM 1116 NE2 GLN A 70 5.088 -9.682 4.206 1.00 0.00 N ATOM 0 H GLN A 70 1.670 -9.312 -1.089 1.00 0.00 H new ATOM 0 HA GLN A 70 1.819 -8.261 1.664 1.00 0.00 H new ATOM 0 HB2 GLN A 70 3.411 -10.245 1.194 1.00 0.00 H new ATOM 0 HB3 GLN A 70 4.239 -9.176 0.079 1.00 0.00 H new ATOM 0 HG2 GLN A 70 5.494 -8.760 1.942 1.00 0.00 H new ATOM 0 HG3 GLN A 70 4.259 -7.541 2.186 1.00 0.00 H new ATOM 0 HE21 GLN A 70 6.045 -9.586 3.866 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.909 -10.114 5.112 1.00 0.00 H new ATOM 1125 N ILE A 71 2.687 -6.066 0.827 1.00 0.00 N ATOM 1126 CA ILE A 71 2.954 -4.734 0.299 1.00 0.00 C ATOM 1127 C ILE A 71 4.157 -4.099 0.989 1.00 0.00 C ATOM 1128 O ILE A 71 4.201 -4.002 2.215 1.00 0.00 O ATOM 1129 CB ILE A 71 1.735 -3.808 0.463 1.00 0.00 C ATOM 1130 CG1 ILE A 71 1.168 -3.920 1.880 1.00 0.00 C ATOM 1131 CG2 ILE A 71 0.669 -4.148 -0.568 1.00 0.00 C ATOM 1132 CD1 ILE A 71 0.115 -2.881 2.194 1.00 0.00 C ATOM 0 H ILE A 71 2.577 -6.104 1.840 1.00 0.00 H new ATOM 0 HA ILE A 71 3.169 -4.854 -0.763 1.00 0.00 H new ATOM 0 HB ILE A 71 2.055 -2.779 0.301 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.738 -4.913 2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 71 1.984 -3.827 2.597 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.186 -3.485 -0.439 1.00 0.00 H new ATOM 0 HG22 ILE A 71 1.079 -4.021 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.350 -5.182 -0.434 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.242 -3.021 3.214 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.546 -1.885 2.094 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.719 -2.987 1.500 1.00 0.00 H new ATOM 1144 N GLU A 72 5.130 -3.667 0.193 1.00 0.00 N ATOM 1145 CA GLU A 72 6.333 -3.041 0.728 1.00 0.00 C ATOM 1146 C GLU A 72 6.733 -1.829 -0.108 1.00 0.00 C ATOM 1147 O GLU A 72 6.820 -1.907 -1.333 1.00 0.00 O ATOM 1148 CB GLU A 72 7.484 -4.048 0.770 1.00 0.00 C ATOM 1149 CG GLU A 72 8.785 -3.464 1.294 1.00 0.00 C ATOM 1150 CD GLU A 72 10.003 -4.231 0.817 1.00 0.00 C ATOM 1151 OE1 GLU A 72 10.163 -5.401 1.223 1.00 0.00 O ATOM 1152 OE2 GLU A 72 10.795 -3.662 0.037 1.00 0.00 O ATOM 0 H GLU A 72 5.109 -3.739 -0.824 1.00 0.00 H new ATOM 0 HA GLU A 72 6.117 -2.706 1.742 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.195 -4.891 1.398 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.650 -4.440 -0.234 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.867 -2.425 0.975 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.765 -3.462 2.384 1.00 0.00 H new ATOM 1159 N VAL A 73 6.975 -0.708 0.564 1.00 0.00 N ATOM 1160 CA VAL A 73 7.367 0.522 -0.116 1.00 0.00 C ATOM 1161 C VAL A 73 8.867 0.547 -0.384 1.00 0.00 C ATOM 1162 O VAL A 73 9.671 0.230 0.493 1.00 0.00 O ATOM 1163 CB VAL A 73 6.982 1.765 0.708 1.00 0.00 C ATOM 1164 CG1 VAL A 73 7.475 3.031 0.024 1.00 0.00 C ATOM 1165 CG2 VAL A 73 5.477 1.817 0.922 1.00 0.00 C ATOM 0 H VAL A 73 6.907 -0.626 1.578 1.00 0.00 H new ATOM 0 HA VAL A 73 6.831 0.544 -1.065 1.00 0.00 H new ATOM 0 HB VAL A 73 7.462 1.696 1.684 1.00 0.00 H new ATOM 0 HG11 VAL A 73 7.194 3.899 0.620 1.00 0.00 H new ATOM 0 HG12 VAL A 73 8.560 2.993 -0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.025 3.109 -0.965 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.223 2.702 1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.974 1.863 -0.044 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.155 0.924 1.457 1.00 0.00 H new ATOM 1175 N VAL A 74 9.239 0.927 -1.602 1.00 0.00 N ATOM 1176 CA VAL A 74 10.644 0.996 -1.987 1.00 0.00 C ATOM 1177 C VAL A 74 11.176 2.420 -1.871 1.00 0.00 C ATOM 1178 O VAL A 74 10.469 3.395 -2.122 1.00 0.00 O ATOM 1179 CB VAL A 74 10.857 0.495 -3.427 1.00 0.00 C ATOM 1180 CG1 VAL A 74 10.261 -0.894 -3.604 1.00 0.00 C ATOM 1181 CG2 VAL A 74 10.255 1.473 -4.425 1.00 0.00 C ATOM 0 H VAL A 74 8.587 1.192 -2.340 1.00 0.00 H new ATOM 0 HA VAL A 74 11.192 0.350 -1.302 1.00 0.00 H new ATOM 0 HB VAL A 74 11.929 0.431 -3.616 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.421 -1.231 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 74 10.743 -1.587 -2.914 1.00 0.00 H new ATOM 0 HG13 VAL A 74 9.191 -0.860 -3.397 1.00 0.00 H new ATOM 0 HG21 VAL A 74 10.415 1.104 -5.438 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.186 1.571 -4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.733 2.446 -4.314 1.00 0.00 H new ATOM 1191 N PRO A 75 12.453 2.544 -1.482 1.00 0.00 N ATOM 1192 CA PRO A 75 13.110 3.845 -1.325 1.00 0.00 C ATOM 1193 C PRO A 75 13.347 4.540 -2.662 1.00 0.00 C ATOM 1194 O PRO A 75 12.798 4.137 -3.687 1.00 0.00 O ATOM 1195 CB PRO A 75 14.444 3.492 -0.662 1.00 0.00 C ATOM 1196 CG PRO A 75 14.704 2.081 -1.063 1.00 0.00 C ATOM 1197 CD PRO A 75 13.355 1.424 -1.165 1.00 0.00 C ATOM 0 HA PRO A 75 12.502 4.541 -0.747 1.00 0.00 H new ATOM 0 HB2 PRO A 75 15.242 4.153 -1.001 1.00 0.00 H new ATOM 0 HB3 PRO A 75 14.386 3.591 0.422 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.232 2.037 -2.015 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.330 1.575 -0.328 1.00 0.00 H new ATOM 0 HD2 PRO A 75 13.337 0.661 -1.943 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.075 0.934 -0.232 1.00 0.00 H new ATOM 1205 N SER A 76 14.169 5.584 -2.643 1.00 0.00 N ATOM 1206 CA SER A 76 14.476 6.337 -3.854 1.00 0.00 C ATOM 1207 C SER A 76 15.811 5.894 -4.444 1.00 0.00 C ATOM 1208 O SER A 76 16.828 6.570 -4.284 1.00 0.00 O ATOM 1209 CB SER A 76 14.511 7.836 -3.552 1.00 0.00 C ATOM 1210 OG SER A 76 15.418 8.125 -2.503 1.00 0.00 O ATOM 0 H SER A 76 14.634 5.928 -1.803 1.00 0.00 H new ATOM 0 HA SER A 76 13.692 6.139 -4.585 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.801 8.384 -4.449 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.513 8.178 -3.278 1.00 0.00 H new ATOM 0 HG SER A 76 16.299 7.755 -2.721 1.00 0.00 H new ATOM 1216 N ALA A 77 15.800 4.755 -5.128 1.00 0.00 N ATOM 1217 CA ALA A 77 17.009 4.222 -5.745 1.00 0.00 C ATOM 1218 C ALA A 77 16.680 3.079 -6.699 1.00 0.00 C ATOM 1219 O ALA A 77 15.588 2.513 -6.652 1.00 0.00 O ATOM 1220 CB ALA A 77 17.985 3.756 -4.675 1.00 0.00 C ATOM 0 H ALA A 77 14.967 4.183 -5.269 1.00 0.00 H new ATOM 0 HA ALA A 77 17.475 5.020 -6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 77 18.883 3.360 -5.149 1.00 0.00 H new ATOM 0 HB2 ALA A 77 18.253 4.597 -4.036 1.00 0.00 H new ATOM 0 HB3 ALA A 77 17.519 2.976 -4.073 1.00 0.00 H new ATOM 1226 N SER A 78 17.632 2.745 -7.564 1.00 0.00 N ATOM 1227 CA SER A 78 17.442 1.671 -8.533 1.00 0.00 C ATOM 1228 C SER A 78 18.776 1.034 -8.908 1.00 0.00 C ATOM 1229 O SER A 78 19.840 1.563 -8.586 1.00 0.00 O ATOM 1230 CB SER A 78 16.748 2.205 -9.788 1.00 0.00 C ATOM 1231 OG SER A 78 15.350 2.320 -9.589 1.00 0.00 O ATOM 0 H SER A 78 18.542 3.202 -7.614 1.00 0.00 H new ATOM 0 HA SER A 78 16.812 0.909 -8.074 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.162 3.179 -10.050 1.00 0.00 H new ATOM 0 HB3 SER A 78 16.945 1.538 -10.628 1.00 0.00 H new ATOM 0 HG SER A 78 15.155 2.320 -8.629 1.00 0.00 H new ATOM 1237 N ALA A 79 18.711 -0.105 -9.589 1.00 0.00 N ATOM 1238 CA ALA A 79 19.913 -0.814 -10.010 1.00 0.00 C ATOM 1239 C ALA A 79 20.807 0.080 -10.863 1.00 0.00 C ATOM 1240 O ALA A 79 20.637 0.163 -12.080 1.00 0.00 O ATOM 1241 CB ALA A 79 19.541 -2.076 -10.774 1.00 0.00 C ATOM 0 H ALA A 79 17.838 -0.557 -9.861 1.00 0.00 H new ATOM 0 HA ALA A 79 20.471 -1.095 -9.117 1.00 0.00 H new ATOM 0 HB1 ALA A 79 20.448 -2.595 -11.082 1.00 0.00 H new ATOM 0 HB2 ALA A 79 18.949 -2.729 -10.132 1.00 0.00 H new ATOM 0 HB3 ALA A 79 18.958 -1.809 -11.656 1.00 0.00 H new ATOM 1247 N LEU A 80 21.757 0.747 -10.218 1.00 0.00 N ATOM 1248 CA LEU A 80 22.678 1.635 -10.919 1.00 0.00 C ATOM 1249 C LEU A 80 24.024 0.954 -11.148 1.00 0.00 C ATOM 1250 O LEU A 80 24.922 1.035 -10.311 1.00 0.00 O ATOM 1251 CB LEU A 80 22.876 2.926 -10.123 1.00 0.00 C ATOM 1252 CG LEU A 80 21.889 4.056 -10.419 1.00 0.00 C ATOM 1253 CD1 LEU A 80 22.017 5.162 -9.383 1.00 0.00 C ATOM 1254 CD2 LEU A 80 22.112 4.606 -11.820 1.00 0.00 C ATOM 0 H LEU A 80 21.910 0.690 -9.211 1.00 0.00 H new ATOM 0 HA LEU A 80 22.244 1.876 -11.890 1.00 0.00 H new ATOM 0 HB2 LEU A 80 22.816 2.687 -9.061 1.00 0.00 H new ATOM 0 HB3 LEU A 80 23.885 3.294 -10.310 1.00 0.00 H new ATOM 0 HG LEU A 80 20.878 3.652 -10.366 1.00 0.00 H new ATOM 0 HD11 LEU A 80 21.307 5.957 -9.610 1.00 0.00 H new ATOM 0 HD12 LEU A 80 21.806 4.759 -8.393 1.00 0.00 H new ATOM 0 HD13 LEU A 80 23.030 5.564 -9.403 1.00 0.00 H new ATOM 0 HD21 LEU A 80 21.401 5.409 -12.013 1.00 0.00 H new ATOM 0 HD22 LEU A 80 23.128 4.993 -11.901 1.00 0.00 H new ATOM 0 HD23 LEU A 80 21.968 3.810 -12.551 1.00 0.00 H new ATOM 1266 N SER A 81 24.155 0.284 -12.289 1.00 0.00 N ATOM 1267 CA SER A 81 25.390 -0.412 -12.628 1.00 0.00 C ATOM 1268 C SER A 81 26.042 0.206 -13.861 1.00 0.00 C ATOM 1269 O SER A 81 27.207 0.601 -13.830 1.00 0.00 O ATOM 1270 CB SER A 81 25.113 -1.897 -12.874 1.00 0.00 C ATOM 1271 OG SER A 81 24.854 -2.575 -11.657 1.00 0.00 O ATOM 0 H SER A 81 23.421 0.209 -12.993 1.00 0.00 H new ATOM 0 HA SER A 81 26.076 -0.312 -11.787 1.00 0.00 H new ATOM 0 HB2 SER A 81 24.259 -2.005 -13.543 1.00 0.00 H new ATOM 0 HB3 SER A 81 25.969 -2.352 -13.373 1.00 0.00 H new ATOM 0 HG SER A 81 24.678 -3.521 -11.841 1.00 0.00 H new ATOM 1277 N GLY A 82 25.280 0.286 -14.948 1.00 0.00 N ATOM 1278 CA GLY A 82 25.799 0.857 -16.177 1.00 0.00 C ATOM 1279 C GLY A 82 24.701 1.379 -17.082 1.00 0.00 C ATOM 1280 O GLY A 82 23.514 1.302 -16.763 1.00 0.00 O ATOM 0 H GLY A 82 24.313 -0.034 -14.999 1.00 0.00 H new ATOM 0 HA2 GLY A 82 26.484 1.670 -15.936 1.00 0.00 H new ATOM 0 HA3 GLY A 82 26.376 0.101 -16.710 1.00 0.00 H new ATOM 1284 N PRO A 83 25.095 1.927 -18.241 1.00 0.00 N ATOM 1285 CA PRO A 83 24.151 2.477 -19.219 1.00 0.00 C ATOM 1286 C PRO A 83 23.324 1.391 -19.900 1.00 0.00 C ATOM 1287 O PRO A 83 23.849 0.596 -20.680 1.00 0.00 O ATOM 1288 CB PRO A 83 25.058 3.175 -20.235 1.00 0.00 C ATOM 1289 CG PRO A 83 26.363 2.466 -20.127 1.00 0.00 C ATOM 1290 CD PRO A 83 26.493 2.052 -18.687 1.00 0.00 C ATOM 0 HA PRO A 83 23.422 3.140 -18.753 1.00 0.00 H new ATOM 0 HB2 PRO A 83 24.651 3.104 -21.244 1.00 0.00 H new ATOM 0 HB3 PRO A 83 25.164 4.236 -20.008 1.00 0.00 H new ATOM 0 HG2 PRO A 83 26.391 1.598 -20.786 1.00 0.00 H new ATOM 0 HG3 PRO A 83 27.186 3.117 -20.421 1.00 0.00 H new ATOM 0 HD2 PRO A 83 27.033 1.110 -18.587 1.00 0.00 H new ATOM 0 HD3 PRO A 83 27.036 2.795 -18.103 1.00 0.00 H new ATOM 1298 N SER A 84 22.030 1.364 -19.601 1.00 0.00 N ATOM 1299 CA SER A 84 21.132 0.373 -20.182 1.00 0.00 C ATOM 1300 C SER A 84 20.668 0.808 -21.569 1.00 0.00 C ATOM 1301 O SER A 84 19.907 1.766 -21.709 1.00 0.00 O ATOM 1302 CB SER A 84 19.921 0.154 -19.272 1.00 0.00 C ATOM 1303 OG SER A 84 20.189 -0.838 -18.297 1.00 0.00 O ATOM 0 H SER A 84 21.580 2.017 -18.960 1.00 0.00 H new ATOM 0 HA SER A 84 21.679 -0.565 -20.278 1.00 0.00 H new ATOM 0 HB2 SER A 84 19.658 1.090 -18.780 1.00 0.00 H new ATOM 0 HB3 SER A 84 19.061 -0.144 -19.871 1.00 0.00 H new ATOM 0 HG SER A 84 19.401 -0.958 -17.727 1.00 0.00 H new ATOM 1309 N SER A 85 21.131 0.096 -22.591 1.00 0.00 N ATOM 1310 CA SER A 85 20.768 0.410 -23.968 1.00 0.00 C ATOM 1311 C SER A 85 19.393 -0.158 -24.310 1.00 0.00 C ATOM 1312 O SER A 85 18.885 -1.041 -23.621 1.00 0.00 O ATOM 1313 CB SER A 85 21.816 -0.146 -24.934 1.00 0.00 C ATOM 1314 OG SER A 85 21.886 -1.559 -24.853 1.00 0.00 O ATOM 0 H SER A 85 21.758 -0.702 -22.492 1.00 0.00 H new ATOM 0 HA SER A 85 20.730 1.495 -24.069 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.569 0.151 -25.953 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.791 0.283 -24.704 1.00 0.00 H new ATOM 0 HG SER A 85 22.562 -1.890 -25.481 1.00 0.00 H new ATOM 1320 N GLY A 86 18.797 0.358 -25.381 1.00 0.00 N ATOM 1321 CA GLY A 86 17.487 -0.109 -25.797 1.00 0.00 C ATOM 1322 C GLY A 86 17.458 -1.602 -26.055 1.00 0.00 C ATOM 1323 O GLY A 86 17.976 -2.074 -27.067 1.00 0.00 O ATOM 0 H GLY A 86 19.197 1.090 -25.967 1.00 0.00 H new ATOM 0 HA2 GLY A 86 16.756 0.138 -25.027 1.00 0.00 H new ATOM 0 HA3 GLY A 86 17.187 0.419 -26.702 1.00 0.00 H new TER 1327 GLY A 86