USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=19 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 Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -0.0912 K(o=-0.091,f=-4.4!) USER MOD Single : A -1 SER OG : rot 5:sc= 0.205 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= -0.0711 USER MOD Single : A -5 SER OG : rot 180:sc= 0 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 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 32:sc= 0.549 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= -0.948 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -70:sc= 1.24 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 61 LYS NZ :NH3+ 136:sc= -0.0301 (180deg=-1.04) USER MOD Single : A 63 THR OG1 : rot 39:sc= 0.251 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 ASN : amide:sc= -1.13 X(o=-1.1,f=-1!) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.35) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 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 61:sc= 0.324 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 38.004 -14.629 -20.193 1.00 0.00 N ATOM 2 CA GLY A -6 36.610 -14.445 -20.551 1.00 0.00 C ATOM 3 C GLY A -6 36.249 -15.137 -21.851 1.00 0.00 C ATOM 4 O GLY A -6 36.830 -14.850 -22.897 1.00 0.00 O ATOM 0 H1 GLY A -6 38.200 -14.137 -19.298 1.00 0.00 H new ATOM 0 H2 GLY A -6 38.203 -15.644 -20.082 1.00 0.00 H new ATOM 0 H3 GLY A -6 38.609 -14.238 -20.943 1.00 0.00 H new ATOM 0 HA2 GLY A -6 35.979 -14.830 -19.750 1.00 0.00 H new ATOM 0 HA3 GLY A -6 36.398 -13.379 -20.639 1.00 0.00 H new ATOM 8 N SER A -5 35.289 -16.054 -21.785 1.00 0.00 N ATOM 9 CA SER A -5 34.856 -16.793 -22.964 1.00 0.00 C ATOM 10 C SER A -5 33.404 -16.471 -23.305 1.00 0.00 C ATOM 11 O SER A -5 32.609 -16.134 -22.427 1.00 0.00 O ATOM 12 CB SER A -5 35.016 -18.298 -22.737 1.00 0.00 C ATOM 13 OG SER A -5 34.050 -18.780 -21.819 1.00 0.00 O ATOM 0 H SER A -5 34.797 -16.303 -20.927 1.00 0.00 H new ATOM 0 HA SER A -5 35.484 -16.490 -23.802 1.00 0.00 H new ATOM 0 HB2 SER A -5 34.915 -18.825 -23.686 1.00 0.00 H new ATOM 0 HB3 SER A -5 36.017 -18.508 -22.360 1.00 0.00 H new ATOM 0 HG SER A -5 34.172 -19.744 -21.692 1.00 0.00 H new ATOM 19 N SER A -4 33.065 -16.576 -24.586 1.00 0.00 N ATOM 20 CA SER A -4 31.710 -16.292 -25.044 1.00 0.00 C ATOM 21 C SER A -4 31.450 -16.938 -26.402 1.00 0.00 C ATOM 22 O SER A -4 32.382 -17.273 -27.132 1.00 0.00 O ATOM 23 CB SER A -4 31.486 -14.781 -25.134 1.00 0.00 C ATOM 24 OG SER A -4 30.200 -14.487 -25.652 1.00 0.00 O ATOM 0 H SER A -4 33.710 -16.856 -25.325 1.00 0.00 H new ATOM 0 HA SER A -4 31.012 -16.713 -24.321 1.00 0.00 H new ATOM 0 HB2 SER A -4 31.594 -14.334 -24.146 1.00 0.00 H new ATOM 0 HB3 SER A -4 32.249 -14.334 -25.771 1.00 0.00 H new ATOM 0 HG SER A -4 30.080 -13.515 -25.698 1.00 0.00 H new ATOM 30 N GLY A -3 30.174 -17.109 -26.734 1.00 0.00 N ATOM 31 CA GLY A -3 29.812 -17.714 -28.002 1.00 0.00 C ATOM 32 C GLY A -3 28.342 -18.078 -28.073 1.00 0.00 C ATOM 33 O GLY A -3 27.636 -17.662 -28.991 1.00 0.00 O ATOM 0 H GLY A -3 29.385 -16.839 -26.147 1.00 0.00 H new ATOM 0 HA2 GLY A -3 30.052 -17.024 -28.811 1.00 0.00 H new ATOM 0 HA3 GLY A -3 30.413 -18.610 -28.158 1.00 0.00 H new ATOM 37 N SER A -2 27.880 -18.858 -27.101 1.00 0.00 N ATOM 38 CA SER A -2 26.486 -19.283 -27.059 1.00 0.00 C ATOM 39 C SER A -2 25.940 -19.219 -25.636 1.00 0.00 C ATOM 40 O SER A -2 26.659 -19.480 -24.671 1.00 0.00 O ATOM 41 CB SER A -2 26.348 -20.706 -27.606 1.00 0.00 C ATOM 42 OG SER A -2 27.153 -21.614 -26.874 1.00 0.00 O ATOM 0 H SER A -2 28.451 -19.208 -26.332 1.00 0.00 H new ATOM 0 HA SER A -2 25.906 -18.603 -27.683 1.00 0.00 H new ATOM 0 HB2 SER A -2 25.305 -21.018 -27.557 1.00 0.00 H new ATOM 0 HB3 SER A -2 26.637 -20.725 -28.657 1.00 0.00 H new ATOM 0 HG SER A -2 27.046 -22.516 -27.242 1.00 0.00 H new ATOM 48 N SER A -1 24.664 -18.868 -25.513 1.00 0.00 N ATOM 49 CA SER A -1 24.022 -18.764 -24.209 1.00 0.00 C ATOM 50 C SER A -1 22.536 -19.095 -24.307 1.00 0.00 C ATOM 51 O SER A -1 21.754 -18.329 -24.869 1.00 0.00 O ATOM 52 CB SER A -1 24.206 -17.357 -23.636 1.00 0.00 C ATOM 53 OG SER A -1 25.550 -17.139 -23.242 1.00 0.00 O ATOM 0 H SER A -1 24.054 -18.651 -26.301 1.00 0.00 H new ATOM 0 HA SER A -1 24.494 -19.485 -23.541 1.00 0.00 H new ATOM 0 HB2 SER A -1 23.918 -16.616 -24.382 1.00 0.00 H new ATOM 0 HB3 SER A -1 23.546 -17.220 -22.780 1.00 0.00 H new ATOM 0 HG SER A -1 26.096 -17.911 -23.500 1.00 0.00 H new ATOM 59 N GLY A 1 22.153 -20.243 -23.756 1.00 0.00 N ATOM 60 CA GLY A 1 20.763 -20.656 -23.792 1.00 0.00 C ATOM 61 C GLY A 1 19.827 -19.590 -23.256 1.00 0.00 C ATOM 62 O GLY A 1 20.170 -18.831 -22.349 1.00 0.00 O ATOM 0 H GLY A 1 22.781 -20.894 -23.285 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.485 -20.896 -24.818 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.643 -21.568 -23.207 1.00 0.00 H new ATOM 66 N PRO A 2 18.614 -19.523 -23.824 1.00 0.00 N ATOM 67 CA PRO A 2 17.602 -18.545 -23.414 1.00 0.00 C ATOM 68 C PRO A 2 17.043 -18.836 -22.026 1.00 0.00 C ATOM 69 O PRO A 2 16.995 -19.981 -21.577 1.00 0.00 O ATOM 70 CB PRO A 2 16.508 -18.701 -24.474 1.00 0.00 C ATOM 71 CG PRO A 2 16.665 -20.094 -24.978 1.00 0.00 C ATOM 72 CD PRO A 2 18.137 -20.396 -24.909 1.00 0.00 C ATOM 0 HA PRO A 2 18.012 -17.537 -23.350 1.00 0.00 H new ATOM 0 HB2 PRO A 2 15.518 -18.544 -24.047 1.00 0.00 H new ATOM 0 HB3 PRO A 2 16.628 -17.974 -25.277 1.00 0.00 H new ATOM 0 HG2 PRO A 2 16.094 -20.796 -24.370 1.00 0.00 H new ATOM 0 HG3 PRO A 2 16.296 -20.183 -26.000 1.00 0.00 H new ATOM 0 HD2 PRO A 2 18.322 -21.448 -24.689 1.00 0.00 H new ATOM 0 HD3 PRO A 2 18.637 -20.175 -25.852 1.00 0.00 H new ATOM 80 N PRO A 3 16.610 -17.776 -21.327 1.00 0.00 N ATOM 81 CA PRO A 3 16.046 -17.893 -19.979 1.00 0.00 C ATOM 82 C PRO A 3 14.682 -18.573 -19.979 1.00 0.00 C ATOM 83 O PRO A 3 13.894 -18.410 -20.911 1.00 0.00 O ATOM 84 CB PRO A 3 15.918 -16.438 -19.520 1.00 0.00 C ATOM 85 CG PRO A 3 15.805 -15.652 -20.781 1.00 0.00 C ATOM 86 CD PRO A 3 16.638 -16.381 -21.799 1.00 0.00 C ATOM 0 HA PRO A 3 16.669 -18.506 -19.328 1.00 0.00 H new ATOM 0 HB2 PRO A 3 15.042 -16.298 -18.886 1.00 0.00 H new ATOM 0 HB3 PRO A 3 16.786 -16.129 -18.937 1.00 0.00 H new ATOM 0 HG2 PRO A 3 14.767 -15.581 -21.105 1.00 0.00 H new ATOM 0 HG3 PRO A 3 16.165 -14.633 -20.639 1.00 0.00 H new ATOM 0 HD2 PRO A 3 16.220 -16.287 -22.801 1.00 0.00 H new ATOM 0 HD3 PRO A 3 17.655 -15.991 -21.840 1.00 0.00 H new ATOM 94 N LYS A 4 14.407 -19.338 -18.927 1.00 0.00 N ATOM 95 CA LYS A 4 13.137 -20.043 -18.803 1.00 0.00 C ATOM 96 C LYS A 4 12.456 -19.710 -17.480 1.00 0.00 C ATOM 97 O LYS A 4 13.091 -19.714 -16.425 1.00 0.00 O ATOM 98 CB LYS A 4 13.356 -21.553 -18.910 1.00 0.00 C ATOM 99 CG LYS A 4 14.117 -22.142 -17.735 1.00 0.00 C ATOM 100 CD LYS A 4 14.416 -23.617 -17.947 1.00 0.00 C ATOM 101 CE LYS A 4 14.481 -24.368 -16.626 1.00 0.00 C ATOM 102 NZ LYS A 4 14.061 -25.789 -16.775 1.00 0.00 N ATOM 0 H LYS A 4 15.048 -19.485 -18.147 1.00 0.00 H new ATOM 0 HA LYS A 4 12.489 -19.717 -19.617 1.00 0.00 H new ATOM 0 HB2 LYS A 4 12.388 -22.047 -18.990 1.00 0.00 H new ATOM 0 HB3 LYS A 4 13.900 -21.768 -19.829 1.00 0.00 H new ATOM 0 HG2 LYS A 4 15.051 -21.597 -17.595 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.534 -22.015 -16.823 1.00 0.00 H new ATOM 0 HD2 LYS A 4 13.646 -24.058 -18.580 1.00 0.00 H new ATOM 0 HD3 LYS A 4 15.363 -23.725 -18.475 1.00 0.00 H new ATOM 0 HE2 LYS A 4 15.498 -24.329 -16.236 1.00 0.00 H new ATOM 0 HE3 LYS A 4 13.840 -23.874 -15.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 14.119 -26.267 -15.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 13.082 -25.827 -17.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 14.688 -26.267 -17.453 1.00 0.00 H new ATOM 116 N PHE A 5 11.160 -19.422 -17.542 1.00 0.00 N ATOM 117 CA PHE A 5 10.393 -19.087 -16.348 1.00 0.00 C ATOM 118 C PHE A 5 10.268 -20.296 -15.425 1.00 0.00 C ATOM 119 O PHE A 5 10.728 -21.390 -15.752 1.00 0.00 O ATOM 120 CB PHE A 5 9.002 -18.580 -16.734 1.00 0.00 C ATOM 121 CG PHE A 5 8.090 -19.661 -17.241 1.00 0.00 C ATOM 122 CD1 PHE A 5 8.138 -20.061 -18.567 1.00 0.00 C ATOM 123 CD2 PHE A 5 7.186 -20.277 -16.392 1.00 0.00 C ATOM 124 CE1 PHE A 5 7.300 -21.054 -19.036 1.00 0.00 C ATOM 125 CE2 PHE A 5 6.345 -21.271 -16.855 1.00 0.00 C ATOM 126 CZ PHE A 5 6.403 -21.661 -18.178 1.00 0.00 C ATOM 0 H PHE A 5 10.619 -19.414 -18.407 1.00 0.00 H new ATOM 0 HA PHE A 5 10.924 -18.298 -15.815 1.00 0.00 H new ATOM 0 HB2 PHE A 5 8.543 -18.106 -15.867 1.00 0.00 H new ATOM 0 HB3 PHE A 5 9.104 -17.812 -17.501 1.00 0.00 H new ATOM 0 HD1 PHE A 5 8.839 -19.591 -19.241 1.00 0.00 H new ATOM 0 HD2 PHE A 5 7.138 -19.977 -15.356 1.00 0.00 H new ATOM 0 HE1 PHE A 5 7.346 -21.356 -20.072 1.00 0.00 H new ATOM 0 HE2 PHE A 5 5.643 -21.742 -16.183 1.00 0.00 H new ATOM 0 HZ PHE A 5 5.748 -22.439 -18.542 1.00 0.00 H new ATOM 136 N ASP A 6 9.644 -20.089 -14.271 1.00 0.00 N ATOM 137 CA ASP A 6 9.458 -21.161 -13.300 1.00 0.00 C ATOM 138 C ASP A 6 8.373 -20.797 -12.290 1.00 0.00 C ATOM 139 O ASP A 6 8.233 -19.644 -11.881 1.00 0.00 O ATOM 140 CB ASP A 6 10.771 -21.453 -12.572 1.00 0.00 C ATOM 141 CG ASP A 6 10.588 -22.407 -11.408 1.00 0.00 C ATOM 142 OD1 ASP A 6 10.216 -21.941 -10.311 1.00 0.00 O ATOM 143 OD2 ASP A 6 10.816 -23.621 -11.595 1.00 0.00 O ATOM 0 H ASP A 6 9.258 -19.189 -13.985 1.00 0.00 H new ATOM 0 HA ASP A 6 9.144 -22.055 -13.839 1.00 0.00 H new ATOM 0 HB2 ASP A 6 11.487 -21.877 -13.276 1.00 0.00 H new ATOM 0 HB3 ASP A 6 11.197 -20.518 -12.208 1.00 0.00 H new ATOM 148 N PRO A 7 7.586 -21.802 -11.879 1.00 0.00 N ATOM 149 CA PRO A 7 6.500 -21.612 -10.913 1.00 0.00 C ATOM 150 C PRO A 7 7.017 -21.313 -9.510 1.00 0.00 C ATOM 151 O PRO A 7 6.538 -20.396 -8.844 1.00 0.00 O ATOM 152 CB PRO A 7 5.766 -22.955 -10.936 1.00 0.00 C ATOM 153 CG PRO A 7 6.792 -23.941 -11.377 1.00 0.00 C ATOM 154 CD PRO A 7 7.696 -23.201 -12.324 1.00 0.00 C ATOM 0 HA PRO A 7 5.870 -20.761 -11.171 1.00 0.00 H new ATOM 0 HB2 PRO A 7 5.372 -23.207 -9.952 1.00 0.00 H new ATOM 0 HB3 PRO A 7 4.919 -22.931 -11.622 1.00 0.00 H new ATOM 0 HG2 PRO A 7 7.352 -24.329 -10.526 1.00 0.00 H new ATOM 0 HG3 PRO A 7 6.327 -24.795 -11.869 1.00 0.00 H new ATOM 0 HD2 PRO A 7 8.723 -23.562 -12.264 1.00 0.00 H new ATOM 0 HD3 PRO A 7 7.377 -23.319 -13.359 1.00 0.00 H new ATOM 162 N ASN A 8 7.999 -22.092 -9.067 1.00 0.00 N ATOM 163 CA ASN A 8 8.581 -21.910 -7.743 1.00 0.00 C ATOM 164 C ASN A 8 9.123 -20.493 -7.577 1.00 0.00 C ATOM 165 O ASN A 8 9.081 -19.926 -6.486 1.00 0.00 O ATOM 166 CB ASN A 8 9.701 -22.926 -7.511 1.00 0.00 C ATOM 167 CG ASN A 8 9.186 -24.351 -7.454 1.00 0.00 C ATOM 168 OD1 ASN A 8 8.521 -24.820 -8.378 1.00 0.00 O ATOM 169 ND2 ASN A 8 9.490 -25.047 -6.364 1.00 0.00 N ATOM 0 H ASN A 8 8.408 -22.855 -9.606 1.00 0.00 H new ATOM 0 HA ASN A 8 7.796 -22.069 -7.004 1.00 0.00 H new ATOM 0 HB2 ASN A 8 10.437 -22.840 -8.310 1.00 0.00 H new ATOM 0 HB3 ASN A 8 10.214 -22.690 -6.579 1.00 0.00 H new ATOM 0 HD21 ASN A 8 9.170 -26.011 -6.268 1.00 0.00 H new ATOM 0 HD22 ASN A 8 10.044 -24.618 -5.623 1.00 0.00 H new ATOM 176 N GLU A 9 9.629 -19.928 -8.668 1.00 0.00 N ATOM 177 CA GLU A 9 10.179 -18.577 -8.643 1.00 0.00 C ATOM 178 C GLU A 9 9.064 -17.535 -8.657 1.00 0.00 C ATOM 179 O GLU A 9 8.475 -17.253 -9.700 1.00 0.00 O ATOM 180 CB GLU A 9 11.110 -18.359 -9.838 1.00 0.00 C ATOM 181 CG GLU A 9 12.015 -17.148 -9.691 1.00 0.00 C ATOM 182 CD GLU A 9 12.911 -16.940 -10.896 1.00 0.00 C ATOM 183 OE1 GLU A 9 12.387 -16.584 -11.972 1.00 0.00 O ATOM 184 OE2 GLU A 9 14.138 -17.132 -10.763 1.00 0.00 O ATOM 0 H GLU A 9 9.670 -20.384 -9.580 1.00 0.00 H new ATOM 0 HA GLU A 9 10.749 -18.462 -7.721 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.726 -19.248 -9.975 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.509 -18.246 -10.740 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.404 -16.258 -9.540 1.00 0.00 H new ATOM 0 HG3 GLU A 9 12.632 -17.266 -8.800 1.00 0.00 H new ATOM 191 N VAL A 10 8.778 -16.968 -7.489 1.00 0.00 N ATOM 192 CA VAL A 10 7.735 -15.957 -7.365 1.00 0.00 C ATOM 193 C VAL A 10 8.016 -14.763 -8.270 1.00 0.00 C ATOM 194 O VAL A 10 9.143 -14.566 -8.725 1.00 0.00 O ATOM 195 CB VAL A 10 7.599 -15.465 -5.912 1.00 0.00 C ATOM 196 CG1 VAL A 10 8.856 -14.727 -5.478 1.00 0.00 C ATOM 197 CG2 VAL A 10 6.372 -14.579 -5.762 1.00 0.00 C ATOM 0 H VAL A 10 9.254 -17.192 -6.615 1.00 0.00 H new ATOM 0 HA VAL A 10 6.801 -16.428 -7.670 1.00 0.00 H new ATOM 0 HB VAL A 10 7.474 -16.332 -5.264 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.741 -14.387 -4.449 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.713 -15.397 -5.545 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.016 -13.867 -6.129 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.292 -14.241 -4.729 1.00 0.00 H new ATOM 0 HG22 VAL A 10 6.464 -13.715 -6.421 1.00 0.00 H new ATOM 0 HG23 VAL A 10 5.480 -15.145 -6.029 1.00 0.00 H new ATOM 207 N LYS A 11 6.984 -13.967 -8.528 1.00 0.00 N ATOM 208 CA LYS A 11 7.119 -12.789 -9.377 1.00 0.00 C ATOM 209 C LYS A 11 6.618 -11.540 -8.659 1.00 0.00 C ATOM 210 O LYS A 11 5.635 -11.589 -7.921 1.00 0.00 O ATOM 211 CB LYS A 11 6.344 -12.985 -10.682 1.00 0.00 C ATOM 212 CG LYS A 11 6.791 -12.058 -11.800 1.00 0.00 C ATOM 213 CD LYS A 11 6.096 -12.389 -13.110 1.00 0.00 C ATOM 214 CE LYS A 11 6.859 -13.447 -13.893 1.00 0.00 C ATOM 215 NZ LYS A 11 6.109 -13.891 -15.101 1.00 0.00 N ATOM 0 H LYS A 11 6.044 -14.116 -8.161 1.00 0.00 H new ATOM 0 HA LYS A 11 8.176 -12.656 -9.605 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.458 -14.018 -11.011 1.00 0.00 H new ATOM 0 HB3 LYS A 11 5.283 -12.826 -10.492 1.00 0.00 H new ATOM 0 HG2 LYS A 11 6.578 -11.025 -11.525 1.00 0.00 H new ATOM 0 HG3 LYS A 11 7.870 -12.137 -11.930 1.00 0.00 H new ATOM 0 HD2 LYS A 11 5.085 -12.743 -12.908 1.00 0.00 H new ATOM 0 HD3 LYS A 11 6.003 -11.485 -13.712 1.00 0.00 H new ATOM 0 HE2 LYS A 11 7.828 -13.048 -14.193 1.00 0.00 H new ATOM 0 HE3 LYS A 11 7.053 -14.305 -13.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 6.662 -14.612 -15.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 5.195 -14.295 -14.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 5.946 -13.077 -15.727 1.00 0.00 H new ATOM 229 N VAL A 12 7.301 -10.421 -8.882 1.00 0.00 N ATOM 230 CA VAL A 12 6.924 -9.159 -8.258 1.00 0.00 C ATOM 231 C VAL A 12 6.201 -8.251 -9.247 1.00 0.00 C ATOM 232 O VAL A 12 6.526 -8.225 -10.434 1.00 0.00 O ATOM 233 CB VAL A 12 8.154 -8.417 -7.702 1.00 0.00 C ATOM 234 CG1 VAL A 12 7.789 -6.994 -7.312 1.00 0.00 C ATOM 235 CG2 VAL A 12 8.740 -9.171 -6.517 1.00 0.00 C ATOM 0 H VAL A 12 8.118 -10.363 -9.490 1.00 0.00 H new ATOM 0 HA VAL A 12 6.253 -9.402 -7.434 1.00 0.00 H new ATOM 0 HB VAL A 12 8.912 -8.370 -8.484 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.671 -6.486 -6.921 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.421 -6.460 -8.188 1.00 0.00 H new ATOM 0 HG13 VAL A 12 7.013 -7.014 -6.547 1.00 0.00 H new ATOM 0 HG21 VAL A 12 9.608 -8.633 -6.137 1.00 0.00 H new ATOM 0 HG22 VAL A 12 7.990 -9.252 -5.730 1.00 0.00 H new ATOM 0 HG23 VAL A 12 9.042 -10.169 -6.834 1.00 0.00 H new ATOM 245 N VAL A 13 5.219 -7.506 -8.750 1.00 0.00 N ATOM 246 CA VAL A 13 4.450 -6.595 -9.589 1.00 0.00 C ATOM 247 C VAL A 13 4.685 -5.144 -9.184 1.00 0.00 C ATOM 248 O VAL A 13 4.739 -4.822 -7.997 1.00 0.00 O ATOM 249 CB VAL A 13 2.942 -6.900 -9.514 1.00 0.00 C ATOM 250 CG1 VAL A 13 2.151 -5.884 -10.324 1.00 0.00 C ATOM 251 CG2 VAL A 13 2.661 -8.315 -9.998 1.00 0.00 C ATOM 0 H VAL A 13 4.937 -7.516 -7.770 1.00 0.00 H new ATOM 0 HA VAL A 13 4.792 -6.743 -10.613 1.00 0.00 H new ATOM 0 HB VAL A 13 2.625 -6.826 -8.474 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.088 -6.115 -10.259 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.330 -4.884 -9.928 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.468 -5.923 -11.366 1.00 0.00 H new ATOM 0 HG21 VAL A 13 1.591 -8.514 -9.938 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.992 -8.419 -11.031 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.198 -9.027 -9.372 1.00 0.00 H new ATOM 261 N TYR A 14 4.822 -4.273 -10.177 1.00 0.00 N ATOM 262 CA TYR A 14 5.053 -2.856 -9.924 1.00 0.00 C ATOM 263 C TYR A 14 3.941 -2.006 -10.532 1.00 0.00 C ATOM 264 O TYR A 14 3.559 -2.196 -11.688 1.00 0.00 O ATOM 265 CB TYR A 14 6.407 -2.429 -10.494 1.00 0.00 C ATOM 266 CG TYR A 14 7.588 -2.969 -9.720 1.00 0.00 C ATOM 267 CD1 TYR A 14 8.079 -4.245 -9.965 1.00 0.00 C ATOM 268 CD2 TYR A 14 8.211 -2.204 -8.742 1.00 0.00 C ATOM 269 CE1 TYR A 14 9.157 -4.743 -9.260 1.00 0.00 C ATOM 270 CE2 TYR A 14 9.291 -2.693 -8.033 1.00 0.00 C ATOM 271 CZ TYR A 14 9.760 -3.964 -8.295 1.00 0.00 C ATOM 272 OH TYR A 14 10.834 -4.455 -7.590 1.00 0.00 O ATOM 0 H TYR A 14 4.777 -4.523 -11.165 1.00 0.00 H new ATOM 0 HA TYR A 14 5.055 -2.701 -8.845 1.00 0.00 H new ATOM 0 HB2 TYR A 14 6.478 -2.764 -11.529 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.459 -1.340 -10.507 1.00 0.00 H new ATOM 0 HD1 TYR A 14 7.610 -4.858 -10.720 1.00 0.00 H new ATOM 0 HD2 TYR A 14 7.845 -1.210 -8.532 1.00 0.00 H new ATOM 0 HE1 TYR A 14 9.526 -5.737 -9.463 1.00 0.00 H new ATOM 0 HE2 TYR A 14 9.766 -2.084 -7.278 1.00 0.00 H new ATOM 0 HH TYR A 14 11.141 -3.780 -6.950 1.00 0.00 H new ATOM 282 N LEU A 15 3.426 -1.068 -9.746 1.00 0.00 N ATOM 283 CA LEU A 15 2.358 -0.186 -10.205 1.00 0.00 C ATOM 284 C LEU A 15 2.590 1.244 -9.729 1.00 0.00 C ATOM 285 O LEU A 15 3.071 1.469 -8.618 1.00 0.00 O ATOM 286 CB LEU A 15 1.004 -0.690 -9.704 1.00 0.00 C ATOM 287 CG LEU A 15 0.401 -1.868 -10.470 1.00 0.00 C ATOM 288 CD1 LEU A 15 -0.584 -2.626 -9.594 1.00 0.00 C ATOM 289 CD2 LEU A 15 -0.278 -1.385 -11.744 1.00 0.00 C ATOM 0 H LEU A 15 3.730 -0.898 -8.787 1.00 0.00 H new ATOM 0 HA LEU A 15 2.360 -0.190 -11.295 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.111 -0.979 -8.658 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.296 0.138 -9.735 1.00 0.00 H new ATOM 0 HG LEU A 15 1.207 -2.547 -10.747 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.003 -3.461 -10.156 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.069 -3.005 -8.711 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.387 -1.956 -9.286 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.701 -2.237 -12.276 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.073 -0.685 -11.489 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.454 -0.887 -12.380 1.00 0.00 H new ATOM 301 N ARG A 16 2.243 2.208 -10.575 1.00 0.00 N ATOM 302 CA ARG A 16 2.412 3.617 -10.240 1.00 0.00 C ATOM 303 C ARG A 16 1.082 4.242 -9.830 1.00 0.00 C ATOM 304 O ARG A 16 0.142 4.299 -10.623 1.00 0.00 O ATOM 305 CB ARG A 16 3.001 4.379 -11.429 1.00 0.00 C ATOM 306 CG ARG A 16 4.497 4.175 -11.603 1.00 0.00 C ATOM 307 CD ARG A 16 4.797 2.971 -12.482 1.00 0.00 C ATOM 308 NE ARG A 16 4.230 3.116 -13.820 1.00 0.00 N ATOM 309 CZ ARG A 16 4.332 2.189 -14.766 1.00 0.00 C ATOM 310 NH1 ARG A 16 4.977 1.057 -14.522 1.00 0.00 N ATOM 311 NH2 ARG A 16 3.789 2.395 -15.959 1.00 0.00 N ATOM 0 H ARG A 16 1.843 2.039 -11.498 1.00 0.00 H new ATOM 0 HA ARG A 16 3.100 3.684 -9.397 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.492 4.064 -12.340 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.800 5.443 -11.303 1.00 0.00 H new ATOM 0 HG2 ARG A 16 4.938 5.068 -12.045 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.963 4.039 -10.627 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.876 2.837 -12.558 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.397 2.072 -12.014 1.00 0.00 H new ATOM 0 HE ARG A 16 3.728 3.976 -14.040 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.396 0.896 -13.606 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.054 0.347 -15.250 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.293 3.266 -16.150 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.868 1.683 -16.685 1.00 0.00 H new ATOM 325 N CYS A 17 1.011 4.707 -8.588 1.00 0.00 N ATOM 326 CA CYS A 17 -0.204 5.326 -8.072 1.00 0.00 C ATOM 327 C CYS A 17 0.107 6.221 -6.877 1.00 0.00 C ATOM 328 O CYS A 17 1.213 6.192 -6.336 1.00 0.00 O ATOM 329 CB CYS A 17 -1.218 4.253 -7.671 1.00 0.00 C ATOM 330 SG CYS A 17 -2.290 3.709 -9.022 1.00 0.00 S ATOM 0 H CYS A 17 1.781 4.667 -7.920 1.00 0.00 H new ATOM 0 HA CYS A 17 -0.632 5.942 -8.863 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -0.681 3.390 -7.277 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -1.838 4.639 -6.862 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.639 3.773 -10.145 1.00 0.00 H new ATOM 336 N THR A 18 -0.876 7.018 -6.469 1.00 0.00 N ATOM 337 CA THR A 18 -0.707 7.923 -5.339 1.00 0.00 C ATOM 338 C THR A 18 -1.052 7.233 -4.025 1.00 0.00 C ATOM 339 O THR A 18 -2.010 6.465 -3.948 1.00 0.00 O ATOM 340 CB THR A 18 -1.584 9.181 -5.491 1.00 0.00 C ATOM 341 OG1 THR A 18 -1.282 9.843 -6.724 1.00 0.00 O ATOM 342 CG2 THR A 18 -1.364 10.137 -4.329 1.00 0.00 C ATOM 0 H THR A 18 -1.798 7.055 -6.905 1.00 0.00 H new ATOM 0 HA THR A 18 0.342 8.219 -5.326 1.00 0.00 H new ATOM 0 HB THR A 18 -2.629 8.871 -5.493 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.845 10.640 -6.814 1.00 0.00 H new ATOM 0 HG21 THR A 18 -1.993 11.017 -4.458 1.00 0.00 H new ATOM 0 HG22 THR A 18 -1.623 9.639 -3.394 1.00 0.00 H new ATOM 0 HG23 THR A 18 -0.317 10.440 -4.300 1.00 0.00 H new ATOM 350 N GLY A 19 -0.264 7.512 -2.990 1.00 0.00 N ATOM 351 CA GLY A 19 -0.503 6.910 -1.692 1.00 0.00 C ATOM 352 C GLY A 19 -1.830 7.332 -1.093 1.00 0.00 C ATOM 353 O GLY A 19 -2.449 8.292 -1.550 1.00 0.00 O ATOM 0 H GLY A 19 0.535 8.144 -3.028 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -0.480 5.825 -1.789 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.303 7.187 -1.013 1.00 0.00 H new ATOM 357 N GLY A 20 -2.270 6.611 -0.065 1.00 0.00 N ATOM 358 CA GLY A 20 -3.530 6.931 0.580 1.00 0.00 C ATOM 359 C GLY A 20 -4.582 7.403 -0.405 1.00 0.00 C ATOM 360 O GLY A 20 -5.143 8.487 -0.250 1.00 0.00 O ATOM 0 H GLY A 20 -1.776 5.812 0.332 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -3.899 6.051 1.107 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.365 7.705 1.329 1.00 0.00 H new ATOM 364 N GLU A 21 -4.848 6.588 -1.420 1.00 0.00 N ATOM 365 CA GLU A 21 -5.838 6.930 -2.435 1.00 0.00 C ATOM 366 C GLU A 21 -6.694 5.719 -2.791 1.00 0.00 C ATOM 367 O GLU A 21 -6.227 4.783 -3.441 1.00 0.00 O ATOM 368 CB GLU A 21 -5.148 7.468 -3.691 1.00 0.00 C ATOM 369 CG GLU A 21 -6.116 7.970 -4.749 1.00 0.00 C ATOM 370 CD GLU A 21 -5.440 8.834 -5.796 1.00 0.00 C ATOM 371 OE1 GLU A 21 -4.652 9.723 -5.411 1.00 0.00 O ATOM 372 OE2 GLU A 21 -5.698 8.621 -6.999 1.00 0.00 O ATOM 0 H GLU A 21 -4.392 5.687 -1.562 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.487 7.704 -2.026 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.479 8.281 -3.408 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.529 6.680 -4.121 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.589 7.118 -5.237 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.909 8.542 -4.268 1.00 0.00 H new ATOM 379 N VAL A 22 -7.951 5.742 -2.359 1.00 0.00 N ATOM 380 CA VAL A 22 -8.874 4.647 -2.632 1.00 0.00 C ATOM 381 C VAL A 22 -9.337 4.668 -4.084 1.00 0.00 C ATOM 382 O VAL A 22 -9.197 3.681 -4.806 1.00 0.00 O ATOM 383 CB VAL A 22 -10.107 4.709 -1.711 1.00 0.00 C ATOM 384 CG1 VAL A 22 -11.085 3.596 -2.052 1.00 0.00 C ATOM 385 CG2 VAL A 22 -9.685 4.630 -0.251 1.00 0.00 C ATOM 0 H VAL A 22 -8.353 6.508 -1.818 1.00 0.00 H new ATOM 0 HA VAL A 22 -8.332 3.721 -2.439 1.00 0.00 H new ATOM 0 HB VAL A 22 -10.610 5.663 -1.870 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.950 3.656 -1.391 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -11.411 3.703 -3.087 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.596 2.630 -1.923 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.568 4.675 0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -9.158 3.692 -0.075 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.026 5.466 -0.017 1.00 0.00 H new ATOM 395 N GLY A 23 -9.891 5.800 -4.508 1.00 0.00 N ATOM 396 CA GLY A 23 -10.366 5.928 -5.873 1.00 0.00 C ATOM 397 C GLY A 23 -11.859 5.692 -5.991 1.00 0.00 C ATOM 398 O GLY A 23 -12.413 4.827 -5.314 1.00 0.00 O ATOM 0 H GLY A 23 -10.019 6.631 -3.930 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -10.128 6.924 -6.245 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.837 5.216 -6.507 1.00 0.00 H new ATOM 402 N ALA A 24 -12.512 6.464 -6.854 1.00 0.00 N ATOM 403 CA ALA A 24 -13.949 6.334 -7.059 1.00 0.00 C ATOM 404 C ALA A 24 -14.261 5.261 -8.097 1.00 0.00 C ATOM 405 O ALA A 24 -14.948 4.281 -7.806 1.00 0.00 O ATOM 406 CB ALA A 24 -14.545 7.669 -7.481 1.00 0.00 C ATOM 0 H ALA A 24 -12.068 7.186 -7.422 1.00 0.00 H new ATOM 0 HA ALA A 24 -14.400 6.030 -6.114 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -15.619 7.557 -7.631 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.362 8.411 -6.704 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.081 7.997 -8.411 1.00 0.00 H new ATOM 412 N THR A 25 -13.752 5.452 -9.310 1.00 0.00 N ATOM 413 CA THR A 25 -13.977 4.502 -10.392 1.00 0.00 C ATOM 414 C THR A 25 -13.402 3.133 -10.049 1.00 0.00 C ATOM 415 O THR A 25 -12.546 3.010 -9.173 1.00 0.00 O ATOM 416 CB THR A 25 -13.352 4.994 -11.711 1.00 0.00 C ATOM 417 OG1 THR A 25 -14.046 4.421 -12.825 1.00 0.00 O ATOM 418 CG2 THR A 25 -11.878 4.626 -11.781 1.00 0.00 C ATOM 0 H THR A 25 -13.181 6.257 -9.568 1.00 0.00 H new ATOM 0 HA THR A 25 -15.056 4.418 -10.520 1.00 0.00 H new ATOM 0 HB THR A 25 -13.441 6.080 -11.748 1.00 0.00 H new ATOM 0 HG1 THR A 25 -13.644 4.740 -13.660 1.00 0.00 H new ATOM 0 HG21 THR A 25 -11.458 4.984 -12.721 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.348 5.087 -10.948 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.770 3.543 -11.724 1.00 0.00 H new ATOM 426 N SER A 26 -13.877 2.105 -10.747 1.00 0.00 N ATOM 427 CA SER A 26 -13.411 0.743 -10.514 1.00 0.00 C ATOM 428 C SER A 26 -12.290 0.380 -11.482 1.00 0.00 C ATOM 429 O SER A 26 -12.537 0.064 -12.646 1.00 0.00 O ATOM 430 CB SER A 26 -14.569 -0.246 -10.662 1.00 0.00 C ATOM 431 OG SER A 26 -15.231 -0.445 -9.425 1.00 0.00 O ATOM 0 H SER A 26 -14.584 2.190 -11.478 1.00 0.00 H new ATOM 0 HA SER A 26 -13.022 0.686 -9.497 1.00 0.00 H new ATOM 0 HB2 SER A 26 -15.278 0.127 -11.401 1.00 0.00 H new ATOM 0 HB3 SER A 26 -14.192 -1.199 -11.034 1.00 0.00 H new ATOM 0 HG SER A 26 -15.968 -1.080 -9.547 1.00 0.00 H new ATOM 437 N ALA A 27 -11.055 0.427 -10.993 1.00 0.00 N ATOM 438 CA ALA A 27 -9.895 0.101 -11.813 1.00 0.00 C ATOM 439 C ALA A 27 -9.267 -1.218 -11.375 1.00 0.00 C ATOM 440 O ALA A 27 -8.809 -2.005 -12.206 1.00 0.00 O ATOM 441 CB ALA A 27 -8.870 1.224 -11.747 1.00 0.00 C ATOM 0 H ALA A 27 -10.832 0.688 -10.032 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.229 -0.011 -12.844 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.009 0.967 -12.364 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -9.318 2.147 -12.115 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.548 1.363 -10.715 1.00 0.00 H new ATOM 447 N LEU A 28 -9.247 -1.453 -10.068 1.00 0.00 N ATOM 448 CA LEU A 28 -8.673 -2.678 -9.520 1.00 0.00 C ATOM 449 C LEU A 28 -9.679 -3.823 -9.578 1.00 0.00 C ATOM 450 O LEU A 28 -9.301 -4.990 -9.677 1.00 0.00 O ATOM 451 CB LEU A 28 -8.223 -2.452 -8.076 1.00 0.00 C ATOM 452 CG LEU A 28 -7.276 -1.273 -7.845 1.00 0.00 C ATOM 453 CD1 LEU A 28 -7.185 -0.945 -6.363 1.00 0.00 C ATOM 454 CD2 LEU A 28 -5.897 -1.578 -8.412 1.00 0.00 C ATOM 0 H LEU A 28 -9.621 -0.812 -9.368 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.808 -2.948 -10.125 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.110 -2.307 -7.459 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.734 -3.360 -7.723 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.676 -0.402 -8.365 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.507 -0.104 -6.217 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -8.174 -0.683 -5.987 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.809 -1.812 -5.821 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.236 -0.728 -8.239 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.489 -2.461 -7.921 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.977 -1.763 -9.483 1.00 0.00 H new ATOM 466 N ALA A 29 -10.962 -3.481 -9.517 1.00 0.00 N ATOM 467 CA ALA A 29 -12.022 -4.480 -9.567 1.00 0.00 C ATOM 468 C ALA A 29 -11.801 -5.459 -10.715 1.00 0.00 C ATOM 469 O ALA A 29 -11.710 -6.671 -10.521 1.00 0.00 O ATOM 470 CB ALA A 29 -13.378 -3.804 -9.700 1.00 0.00 C ATOM 0 H ALA A 29 -11.292 -2.520 -9.433 1.00 0.00 H new ATOM 0 HA ALA A 29 -12.000 -5.044 -8.635 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -14.160 -4.562 -9.736 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -13.545 -3.151 -8.843 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -13.402 -3.214 -10.616 1.00 0.00 H new ATOM 476 N PRO A 30 -11.714 -4.923 -11.942 1.00 0.00 N ATOM 477 CA PRO A 30 -11.503 -5.732 -13.146 1.00 0.00 C ATOM 478 C PRO A 30 -10.103 -6.333 -13.202 1.00 0.00 C ATOM 479 O PRO A 30 -9.861 -7.302 -13.922 1.00 0.00 O ATOM 480 CB PRO A 30 -11.701 -4.729 -14.286 1.00 0.00 C ATOM 481 CG PRO A 30 -11.380 -3.404 -13.685 1.00 0.00 C ATOM 482 CD PRO A 30 -11.814 -3.486 -12.247 1.00 0.00 C ATOM 0 HA PRO A 30 -12.180 -6.585 -13.188 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -11.045 -4.951 -15.127 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -12.723 -4.755 -14.663 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -10.314 -3.190 -13.759 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -11.903 -2.602 -14.206 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -11.170 -2.892 -11.598 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -12.831 -3.116 -12.112 1.00 0.00 H new ATOM 490 N LYS A 31 -9.183 -5.752 -12.439 1.00 0.00 N ATOM 491 CA LYS A 31 -7.807 -6.231 -12.400 1.00 0.00 C ATOM 492 C LYS A 31 -7.697 -7.503 -11.564 1.00 0.00 C ATOM 493 O LYS A 31 -7.089 -8.485 -11.989 1.00 0.00 O ATOM 494 CB LYS A 31 -6.885 -5.152 -11.828 1.00 0.00 C ATOM 495 CG LYS A 31 -6.748 -3.933 -12.724 1.00 0.00 C ATOM 496 CD LYS A 31 -5.703 -4.150 -13.805 1.00 0.00 C ATOM 497 CE LYS A 31 -4.305 -3.821 -13.303 1.00 0.00 C ATOM 498 NZ LYS A 31 -3.323 -3.725 -14.418 1.00 0.00 N ATOM 0 H LYS A 31 -9.366 -4.948 -11.839 1.00 0.00 H new ATOM 0 HA LYS A 31 -7.500 -6.459 -13.421 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.266 -4.838 -10.856 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -5.898 -5.582 -11.659 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -7.710 -3.710 -13.186 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.475 -3.066 -12.122 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.735 -5.186 -14.141 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.937 -3.527 -14.669 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.328 -2.878 -12.757 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.982 -4.588 -12.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.383 -3.500 -14.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.282 -4.633 -14.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.617 -2.975 -15.076 1.00 0.00 H new ATOM 512 N ILE A 32 -8.289 -7.477 -10.375 1.00 0.00 N ATOM 513 CA ILE A 32 -8.259 -8.629 -9.482 1.00 0.00 C ATOM 514 C ILE A 32 -9.492 -9.506 -9.675 1.00 0.00 C ATOM 515 O ILE A 32 -9.587 -10.594 -9.109 1.00 0.00 O ATOM 516 CB ILE A 32 -8.177 -8.195 -8.007 1.00 0.00 C ATOM 517 CG1 ILE A 32 -7.192 -7.036 -7.847 1.00 0.00 C ATOM 518 CG2 ILE A 32 -7.767 -9.370 -7.131 1.00 0.00 C ATOM 519 CD1 ILE A 32 -7.235 -6.389 -6.480 1.00 0.00 C ATOM 0 H ILE A 32 -8.795 -6.671 -10.008 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.366 -9.201 -9.734 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.163 -7.856 -7.689 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -6.182 -7.400 -8.036 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.406 -6.281 -8.604 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.713 -9.047 -6.091 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.503 -10.169 -7.226 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -6.791 -9.737 -7.448 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -6.510 -5.576 -6.439 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -8.234 -5.994 -6.295 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.991 -7.130 -5.719 1.00 0.00 H new ATOM 531 N GLY A 33 -10.434 -9.025 -10.480 1.00 0.00 N ATOM 532 CA GLY A 33 -11.648 -9.779 -10.735 1.00 0.00 C ATOM 533 C GLY A 33 -11.367 -11.218 -11.118 1.00 0.00 C ATOM 534 O GLY A 33 -11.802 -12.157 -10.451 1.00 0.00 O ATOM 0 H GLY A 33 -10.379 -8.127 -10.960 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.278 -9.759 -9.846 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.210 -9.297 -11.534 1.00 0.00 H new ATOM 538 N PRO A 34 -10.623 -11.407 -12.218 1.00 0.00 N ATOM 539 CA PRO A 34 -10.269 -12.740 -12.715 1.00 0.00 C ATOM 540 C PRO A 34 -9.277 -13.454 -11.803 1.00 0.00 C ATOM 541 O PRO A 34 -9.234 -14.684 -11.757 1.00 0.00 O ATOM 542 CB PRO A 34 -9.632 -12.454 -14.077 1.00 0.00 C ATOM 543 CG PRO A 34 -9.115 -11.061 -13.968 1.00 0.00 C ATOM 544 CD PRO A 34 -10.070 -10.334 -13.062 1.00 0.00 C ATOM 0 HA PRO A 34 -11.136 -13.399 -12.765 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -8.829 -13.158 -14.294 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -10.361 -12.544 -14.882 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -8.105 -11.051 -13.559 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -9.067 -10.585 -14.947 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -9.561 -9.576 -12.466 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -10.851 -9.824 -13.627 1.00 0.00 H new ATOM 552 N LEU A 35 -8.481 -12.675 -11.077 1.00 0.00 N ATOM 553 CA LEU A 35 -7.489 -13.233 -10.165 1.00 0.00 C ATOM 554 C LEU A 35 -8.159 -14.057 -9.070 1.00 0.00 C ATOM 555 O LEU A 35 -7.852 -15.234 -8.888 1.00 0.00 O ATOM 556 CB LEU A 35 -6.656 -12.114 -9.539 1.00 0.00 C ATOM 557 CG LEU A 35 -5.393 -11.711 -10.301 1.00 0.00 C ATOM 558 CD1 LEU A 35 -5.753 -11.091 -11.642 1.00 0.00 C ATOM 559 CD2 LEU A 35 -4.555 -10.748 -9.474 1.00 0.00 C ATOM 0 H LEU A 35 -8.504 -11.656 -11.103 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.833 -13.888 -10.738 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.289 -11.233 -9.433 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.367 -12.422 -8.534 1.00 0.00 H new ATOM 0 HG LEU A 35 -4.802 -12.608 -10.486 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -4.841 -10.811 -12.170 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.310 -11.813 -12.239 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.366 -10.204 -11.480 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.660 -10.472 -10.032 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.138 -9.853 -9.257 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.266 -11.228 -8.539 1.00 0.00 H new ATOM 571 N GLY A 36 -9.079 -13.429 -8.343 1.00 0.00 N ATOM 572 CA GLY A 36 -9.780 -14.120 -7.276 1.00 0.00 C ATOM 573 C GLY A 36 -9.992 -13.242 -6.059 1.00 0.00 C ATOM 574 O GLY A 36 -11.128 -12.998 -5.651 1.00 0.00 O ATOM 0 H GLY A 36 -9.351 -12.455 -8.474 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.746 -14.465 -7.644 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.214 -15.006 -6.987 1.00 0.00 H new ATOM 578 N LEU A 37 -8.897 -12.768 -5.475 1.00 0.00 N ATOM 579 CA LEU A 37 -8.968 -11.913 -4.296 1.00 0.00 C ATOM 580 C LEU A 37 -9.904 -10.732 -4.534 1.00 0.00 C ATOM 581 O LEU A 37 -10.420 -10.549 -5.636 1.00 0.00 O ATOM 582 CB LEU A 37 -7.573 -11.406 -3.924 1.00 0.00 C ATOM 583 CG LEU A 37 -6.648 -12.419 -3.250 1.00 0.00 C ATOM 584 CD1 LEU A 37 -6.097 -13.401 -4.272 1.00 0.00 C ATOM 585 CD2 LEU A 37 -5.514 -11.708 -2.526 1.00 0.00 C ATOM 0 H LEU A 37 -7.949 -12.961 -5.799 1.00 0.00 H new ATOM 0 HA LEU A 37 -9.364 -12.506 -3.472 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.086 -11.046 -4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.685 -10.549 -3.260 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.227 -12.978 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.441 -14.115 -3.774 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.921 -13.935 -4.745 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -5.534 -12.858 -5.031 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.866 -12.445 -2.052 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.936 -11.123 -3.241 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.927 -11.046 -1.765 1.00 0.00 H new ATOM 597 N SER A 38 -10.116 -9.932 -3.494 1.00 0.00 N ATOM 598 CA SER A 38 -10.991 -8.770 -3.589 1.00 0.00 C ATOM 599 C SER A 38 -10.185 -7.476 -3.521 1.00 0.00 C ATOM 600 O SER A 38 -9.192 -7.371 -2.801 1.00 0.00 O ATOM 601 CB SER A 38 -12.032 -8.795 -2.469 1.00 0.00 C ATOM 602 OG SER A 38 -13.235 -8.165 -2.876 1.00 0.00 O ATOM 0 H SER A 38 -9.693 -10.068 -2.576 1.00 0.00 H new ATOM 0 HA SER A 38 -11.502 -8.809 -4.551 1.00 0.00 H new ATOM 0 HB2 SER A 38 -12.237 -9.826 -2.182 1.00 0.00 H new ATOM 0 HB3 SER A 38 -11.635 -8.292 -1.588 1.00 0.00 H new ATOM 0 HG SER A 38 -13.885 -8.196 -2.143 1.00 0.00 H new ATOM 608 N PRO A 39 -10.622 -6.466 -4.288 1.00 0.00 N ATOM 609 CA PRO A 39 -9.957 -5.161 -4.333 1.00 0.00 C ATOM 610 C PRO A 39 -10.128 -4.379 -3.035 1.00 0.00 C ATOM 611 O PRO A 39 -9.309 -3.521 -2.702 1.00 0.00 O ATOM 612 CB PRO A 39 -10.661 -4.443 -5.487 1.00 0.00 C ATOM 613 CG PRO A 39 -12.002 -5.086 -5.570 1.00 0.00 C ATOM 614 CD PRO A 39 -11.799 -6.521 -5.171 1.00 0.00 C ATOM 0 HA PRO A 39 -8.880 -5.257 -4.467 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.746 -3.373 -5.295 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.109 -4.557 -6.420 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -12.713 -4.593 -4.906 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.407 -5.015 -6.580 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -12.671 -6.922 -4.654 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -11.622 -7.158 -6.038 1.00 0.00 H new ATOM 622 N LYS A 40 -11.196 -4.679 -2.305 1.00 0.00 N ATOM 623 CA LYS A 40 -11.475 -4.006 -1.042 1.00 0.00 C ATOM 624 C LYS A 40 -10.438 -4.377 0.013 1.00 0.00 C ATOM 625 O LYS A 40 -9.838 -3.506 0.643 1.00 0.00 O ATOM 626 CB LYS A 40 -12.876 -4.369 -0.545 1.00 0.00 C ATOM 627 CG LYS A 40 -13.383 -3.461 0.562 1.00 0.00 C ATOM 628 CD LYS A 40 -14.897 -3.337 0.532 1.00 0.00 C ATOM 629 CE LYS A 40 -15.569 -4.551 1.154 1.00 0.00 C ATOM 630 NZ LYS A 40 -16.967 -4.720 0.670 1.00 0.00 N ATOM 0 H LYS A 40 -11.884 -5.385 -2.567 1.00 0.00 H new ATOM 0 HA LYS A 40 -11.424 -2.931 -1.214 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -13.571 -4.329 -1.383 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -12.869 -5.398 -0.185 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.068 -3.854 1.529 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.934 -2.473 0.458 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -15.200 -2.438 1.068 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -15.233 -3.222 -0.498 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -14.993 -5.446 0.918 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -15.570 -4.449 2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -17.390 -5.558 1.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -17.524 -3.877 0.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -16.964 -4.843 -0.363 1.00 0.00 H new ATOM 644 N LYS A 41 -10.230 -5.676 0.200 1.00 0.00 N ATOM 645 CA LYS A 41 -9.263 -6.164 1.176 1.00 0.00 C ATOM 646 C LYS A 41 -7.856 -5.681 0.838 1.00 0.00 C ATOM 647 O LYS A 41 -7.131 -5.192 1.705 1.00 0.00 O ATOM 648 CB LYS A 41 -9.289 -7.693 1.230 1.00 0.00 C ATOM 649 CG LYS A 41 -10.631 -8.264 1.652 1.00 0.00 C ATOM 650 CD LYS A 41 -10.945 -7.939 3.103 1.00 0.00 C ATOM 651 CE LYS A 41 -12.394 -8.249 3.443 1.00 0.00 C ATOM 652 NZ LYS A 41 -12.623 -9.711 3.613 1.00 0.00 N ATOM 0 H LYS A 41 -10.719 -6.410 -0.312 1.00 0.00 H new ATOM 0 HA LYS A 41 -9.539 -5.767 2.153 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.029 -8.087 0.248 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.523 -8.037 1.925 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -11.416 -7.863 1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.627 -9.345 1.513 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.287 -8.512 3.756 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.743 -6.885 3.293 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.671 -7.729 4.360 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.042 -7.869 2.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.623 -9.881 3.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.383 -10.205 2.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.024 -10.069 4.384 1.00 0.00 H new ATOM 666 N VAL A 42 -7.477 -5.818 -0.429 1.00 0.00 N ATOM 667 CA VAL A 42 -6.158 -5.393 -0.882 1.00 0.00 C ATOM 668 C VAL A 42 -6.029 -3.875 -0.850 1.00 0.00 C ATOM 669 O VAL A 42 -5.015 -3.336 -0.408 1.00 0.00 O ATOM 670 CB VAL A 42 -5.868 -5.892 -2.310 1.00 0.00 C ATOM 671 CG1 VAL A 42 -4.485 -5.446 -2.761 1.00 0.00 C ATOM 672 CG2 VAL A 42 -5.998 -7.406 -2.382 1.00 0.00 C ATOM 0 H VAL A 42 -8.065 -6.220 -1.159 1.00 0.00 H new ATOM 0 HA VAL A 42 -5.432 -5.831 -0.197 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.603 -5.454 -2.985 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.298 -5.808 -3.772 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.432 -4.357 -2.750 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.733 -5.853 -2.085 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.790 -7.741 -3.398 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.287 -7.865 -1.695 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -7.011 -7.698 -2.104 1.00 0.00 H new ATOM 682 N GLY A 43 -7.065 -3.188 -1.322 1.00 0.00 N ATOM 683 CA GLY A 43 -7.049 -1.737 -1.338 1.00 0.00 C ATOM 684 C GLY A 43 -6.938 -1.143 0.052 1.00 0.00 C ATOM 685 O GLY A 43 -6.169 -0.208 0.275 1.00 0.00 O ATOM 0 H GLY A 43 -7.915 -3.611 -1.694 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -6.212 -1.393 -1.945 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.959 -1.372 -1.814 1.00 0.00 H new ATOM 689 N ASP A 44 -7.710 -1.684 0.988 1.00 0.00 N ATOM 690 CA ASP A 44 -7.696 -1.201 2.364 1.00 0.00 C ATOM 691 C ASP A 44 -6.332 -1.430 3.006 1.00 0.00 C ATOM 692 O ASP A 44 -5.846 -0.595 3.769 1.00 0.00 O ATOM 693 CB ASP A 44 -8.783 -1.899 3.182 1.00 0.00 C ATOM 694 CG ASP A 44 -8.963 -1.279 4.554 1.00 0.00 C ATOM 695 OD1 ASP A 44 -9.262 -0.069 4.623 1.00 0.00 O ATOM 696 OD2 ASP A 44 -8.804 -2.004 5.559 1.00 0.00 O ATOM 0 H ASP A 44 -8.353 -2.457 0.819 1.00 0.00 H new ATOM 0 HA ASP A 44 -7.895 -0.129 2.350 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -9.727 -1.854 2.639 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -8.529 -2.953 3.293 1.00 0.00 H new ATOM 701 N ASP A 45 -5.720 -2.567 2.694 1.00 0.00 N ATOM 702 CA ASP A 45 -4.411 -2.906 3.240 1.00 0.00 C ATOM 703 C ASP A 45 -3.352 -1.912 2.773 1.00 0.00 C ATOM 704 O ASP A 45 -2.548 -1.428 3.570 1.00 0.00 O ATOM 705 CB ASP A 45 -4.014 -4.325 2.827 1.00 0.00 C ATOM 706 CG ASP A 45 -4.648 -5.383 3.708 1.00 0.00 C ATOM 707 OD1 ASP A 45 -4.723 -5.165 4.935 1.00 0.00 O ATOM 708 OD2 ASP A 45 -5.067 -6.429 3.171 1.00 0.00 O ATOM 0 H ASP A 45 -6.110 -3.270 2.066 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.475 -2.856 4.327 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -4.308 -4.495 1.791 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -2.929 -4.423 2.870 1.00 0.00 H new ATOM 713 N ILE A 46 -3.359 -1.613 1.479 1.00 0.00 N ATOM 714 CA ILE A 46 -2.400 -0.677 0.906 1.00 0.00 C ATOM 715 C ILE A 46 -2.640 0.739 1.419 1.00 0.00 C ATOM 716 O ILE A 46 -1.706 1.429 1.826 1.00 0.00 O ATOM 717 CB ILE A 46 -2.467 -0.672 -0.632 1.00 0.00 C ATOM 718 CG1 ILE A 46 -2.181 -2.071 -1.182 1.00 0.00 C ATOM 719 CG2 ILE A 46 -1.483 0.338 -1.202 1.00 0.00 C ATOM 720 CD1 ILE A 46 -2.609 -2.254 -2.621 1.00 0.00 C ATOM 0 H ILE A 46 -4.018 -2.005 0.807 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.410 -1.011 1.217 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.473 -0.381 -0.936 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.113 -2.273 -1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.693 -2.808 -0.563 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.542 0.330 -2.290 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.729 1.334 -0.833 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.472 0.076 -0.892 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.376 -3.269 -2.944 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.682 -2.084 -2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.078 -1.541 -3.252 1.00 0.00 H new ATOM 732 N ALA A 47 -3.899 1.164 1.399 1.00 0.00 N ATOM 733 CA ALA A 47 -4.263 2.496 1.866 1.00 0.00 C ATOM 734 C ALA A 47 -3.822 2.711 3.309 1.00 0.00 C ATOM 735 O ALA A 47 -3.241 3.744 3.645 1.00 0.00 O ATOM 736 CB ALA A 47 -5.764 2.709 1.733 1.00 0.00 C ATOM 0 H ALA A 47 -4.684 0.605 1.064 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.747 3.227 1.244 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -6.022 3.708 2.085 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -6.055 2.606 0.688 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -6.291 1.966 2.331 1.00 0.00 H new ATOM 742 N LYS A 48 -4.101 1.731 4.161 1.00 0.00 N ATOM 743 CA LYS A 48 -3.732 1.812 5.570 1.00 0.00 C ATOM 744 C LYS A 48 -2.218 1.754 5.740 1.00 0.00 C ATOM 745 O LYS A 48 -1.651 2.454 6.579 1.00 0.00 O ATOM 746 CB LYS A 48 -4.388 0.675 6.356 1.00 0.00 C ATOM 747 CG LYS A 48 -3.979 0.632 7.818 1.00 0.00 C ATOM 748 CD LYS A 48 -4.766 1.632 8.648 1.00 0.00 C ATOM 749 CE LYS A 48 -4.201 1.757 10.054 1.00 0.00 C ATOM 750 NZ LYS A 48 -4.523 0.567 10.889 1.00 0.00 N ATOM 0 H LYS A 48 -4.582 0.870 3.901 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.087 2.766 5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.471 0.779 6.293 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.131 -0.275 5.887 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.137 -0.372 8.211 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.913 0.845 7.905 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.748 2.606 8.159 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.810 1.321 8.700 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.119 1.882 10.001 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.602 2.653 10.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.120 0.691 11.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.555 0.462 10.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.119 -0.285 10.450 1.00 0.00 H new ATOM 764 N ALA A 49 -1.568 0.917 4.938 1.00 0.00 N ATOM 765 CA ALA A 49 -0.119 0.771 4.998 1.00 0.00 C ATOM 766 C ALA A 49 0.580 2.050 4.549 1.00 0.00 C ATOM 767 O ALA A 49 1.589 2.455 5.127 1.00 0.00 O ATOM 768 CB ALA A 49 0.329 -0.406 4.145 1.00 0.00 C ATOM 0 H ALA A 49 -2.022 0.330 4.239 1.00 0.00 H new ATOM 0 HA ALA A 49 0.160 0.580 6.034 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.413 -0.503 4.199 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.136 -1.320 4.514 1.00 0.00 H new ATOM 0 HB3 ALA A 49 0.031 -0.239 3.110 1.00 0.00 H new ATOM 774 N THR A 50 0.039 2.682 3.512 1.00 0.00 N ATOM 775 CA THR A 50 0.612 3.914 2.984 1.00 0.00 C ATOM 776 C THR A 50 -0.032 5.138 3.623 1.00 0.00 C ATOM 777 O THR A 50 -0.022 6.227 3.051 1.00 0.00 O ATOM 778 CB THR A 50 0.445 4.000 1.455 1.00 0.00 C ATOM 779 OG1 THR A 50 -0.945 4.048 1.115 1.00 0.00 O ATOM 780 CG2 THR A 50 1.099 2.808 0.772 1.00 0.00 C ATOM 0 H THR A 50 -0.795 2.361 3.021 1.00 0.00 H new ATOM 0 HA THR A 50 1.675 3.898 3.226 1.00 0.00 H new ATOM 0 HB THR A 50 0.934 4.911 1.109 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.356 3.177 1.296 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.968 2.890 -0.307 1.00 0.00 H new ATOM 0 HG22 THR A 50 2.163 2.792 1.009 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.635 1.887 1.125 1.00 0.00 H new ATOM 788 N GLY A 51 -0.592 4.953 4.815 1.00 0.00 N ATOM 789 CA GLY A 51 -1.233 6.052 5.513 1.00 0.00 C ATOM 790 C GLY A 51 -0.323 7.256 5.658 1.00 0.00 C ATOM 791 O GLY A 51 -0.782 8.397 5.626 1.00 0.00 O ATOM 0 H GLY A 51 -0.613 4.061 5.310 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.134 6.344 4.974 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.547 5.717 6.501 1.00 0.00 H new ATOM 795 N ASP A 52 0.971 7.001 5.820 1.00 0.00 N ATOM 796 CA ASP A 52 1.948 8.073 5.972 1.00 0.00 C ATOM 797 C ASP A 52 2.252 8.725 4.627 1.00 0.00 C ATOM 798 O ASP A 52 2.786 9.832 4.570 1.00 0.00 O ATOM 799 CB ASP A 52 3.237 7.532 6.593 1.00 0.00 C ATOM 800 CG ASP A 52 4.296 8.605 6.755 1.00 0.00 C ATOM 801 OD1 ASP A 52 4.926 8.973 5.742 1.00 0.00 O ATOM 802 OD2 ASP A 52 4.495 9.076 7.895 1.00 0.00 O ATOM 0 H ASP A 52 1.367 6.062 5.849 1.00 0.00 H new ATOM 0 HA ASP A 52 1.523 8.828 6.634 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.013 7.097 7.567 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.629 6.730 5.968 1.00 0.00 H new ATOM 807 N TRP A 53 1.910 8.031 3.548 1.00 0.00 N ATOM 808 CA TRP A 53 2.147 8.542 2.203 1.00 0.00 C ATOM 809 C TRP A 53 0.867 9.113 1.603 1.00 0.00 C ATOM 810 O TRP A 53 0.654 9.049 0.392 1.00 0.00 O ATOM 811 CB TRP A 53 2.696 7.434 1.303 1.00 0.00 C ATOM 812 CG TRP A 53 4.140 7.123 1.558 1.00 0.00 C ATOM 813 CD1 TRP A 53 5.208 7.506 0.798 1.00 0.00 C ATOM 814 CD2 TRP A 53 4.673 6.361 2.647 1.00 0.00 C ATOM 815 NE1 TRP A 53 6.373 7.030 1.349 1.00 0.00 N ATOM 816 CE2 TRP A 53 6.072 6.325 2.484 1.00 0.00 C ATOM 817 CE3 TRP A 53 4.106 5.709 3.745 1.00 0.00 C ATOM 818 CZ2 TRP A 53 6.908 5.661 3.378 1.00 0.00 C ATOM 819 CZ3 TRP A 53 4.937 5.050 4.630 1.00 0.00 C ATOM 820 CH2 TRP A 53 6.325 5.030 4.444 1.00 0.00 C ATOM 0 H TRP A 53 1.467 7.112 3.578 1.00 0.00 H new ATOM 0 HA TRP A 53 2.883 9.343 2.271 1.00 0.00 H new ATOM 0 HB2 TRP A 53 2.105 6.530 1.450 1.00 0.00 H new ATOM 0 HB3 TRP A 53 2.574 7.728 0.261 1.00 0.00 H new ATOM 0 HD1 TRP A 53 5.146 8.097 -0.104 1.00 0.00 H new ATOM 0 HE1 TRP A 53 7.310 7.178 0.974 1.00 0.00 H new ATOM 0 HE3 TRP A 53 3.037 5.720 3.899 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 7.978 5.644 3.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 4.509 4.541 5.481 1.00 0.00 H new ATOM 0 HH2 TRP A 53 6.947 4.507 5.155 1.00 0.00 H new ATOM 831 N LYS A 54 0.016 9.671 2.458 1.00 0.00 N ATOM 832 CA LYS A 54 -1.244 10.255 2.013 1.00 0.00 C ATOM 833 C LYS A 54 -0.999 11.521 1.198 1.00 0.00 C ATOM 834 O LYS A 54 -1.020 12.628 1.734 1.00 0.00 O ATOM 835 CB LYS A 54 -2.135 10.573 3.215 1.00 0.00 C ATOM 836 CG LYS A 54 -1.420 11.336 4.317 1.00 0.00 C ATOM 837 CD LYS A 54 -2.381 12.216 5.100 1.00 0.00 C ATOM 838 CE LYS A 54 -1.683 12.907 6.262 1.00 0.00 C ATOM 839 NZ LYS A 54 -2.598 13.829 6.989 1.00 0.00 N ATOM 0 H LYS A 54 0.176 9.731 3.464 1.00 0.00 H new ATOM 0 HA LYS A 54 -1.749 9.527 1.377 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -2.992 11.156 2.877 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -2.525 9.641 3.624 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -0.937 10.632 4.994 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -0.633 11.952 3.883 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -2.813 12.965 4.436 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.205 11.611 5.477 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -1.299 12.157 6.953 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -0.825 13.466 5.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -2.085 14.280 7.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.945 14.560 6.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -3.404 13.292 7.367 1.00 0.00 H new ATOM 853 N GLY A 55 -0.769 11.349 -0.100 1.00 0.00 N ATOM 854 CA GLY A 55 -0.525 12.487 -0.967 1.00 0.00 C ATOM 855 C GLY A 55 0.799 12.386 -1.697 1.00 0.00 C ATOM 856 O GLY A 55 0.975 12.975 -2.764 1.00 0.00 O ATOM 0 H GLY A 55 -0.747 10.442 -0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.333 12.565 -1.695 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.541 13.402 -0.374 1.00 0.00 H new ATOM 860 N LEU A 56 1.735 11.640 -1.121 1.00 0.00 N ATOM 861 CA LEU A 56 3.053 11.466 -1.722 1.00 0.00 C ATOM 862 C LEU A 56 3.068 10.262 -2.659 1.00 0.00 C ATOM 863 O LEU A 56 2.560 9.193 -2.321 1.00 0.00 O ATOM 864 CB LEU A 56 4.113 11.293 -0.634 1.00 0.00 C ATOM 865 CG LEU A 56 4.110 12.341 0.479 1.00 0.00 C ATOM 866 CD1 LEU A 56 4.655 11.751 1.770 1.00 0.00 C ATOM 867 CD2 LEU A 56 4.920 13.561 0.064 1.00 0.00 C ATOM 0 H LEU A 56 1.606 11.146 -0.238 1.00 0.00 H new ATOM 0 HA LEU A 56 3.281 12.359 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.982 10.310 -0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.095 11.298 -1.107 1.00 0.00 H new ATOM 0 HG LEU A 56 3.081 12.655 0.654 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.645 12.512 2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.034 10.909 2.076 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.677 11.408 1.610 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.907 14.297 0.868 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.949 13.263 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.485 13.998 -0.835 1.00 0.00 H new ATOM 879 N ARG A 57 3.656 10.443 -3.838 1.00 0.00 N ATOM 880 CA ARG A 57 3.738 9.372 -4.823 1.00 0.00 C ATOM 881 C ARG A 57 4.918 8.451 -4.527 1.00 0.00 C ATOM 882 O ARG A 57 6.034 8.912 -4.290 1.00 0.00 O ATOM 883 CB ARG A 57 3.874 9.955 -6.231 1.00 0.00 C ATOM 884 CG ARG A 57 5.287 10.399 -6.573 1.00 0.00 C ATOM 885 CD ARG A 57 5.756 11.518 -5.657 1.00 0.00 C ATOM 886 NE ARG A 57 6.919 12.217 -6.198 1.00 0.00 N ATOM 887 CZ ARG A 57 7.385 13.358 -5.704 1.00 0.00 C ATOM 888 NH1 ARG A 57 6.792 13.926 -4.663 1.00 0.00 N ATOM 889 NH2 ARG A 57 8.449 13.934 -6.251 1.00 0.00 N ATOM 0 H ARG A 57 4.082 11.321 -4.133 1.00 0.00 H new ATOM 0 HA ARG A 57 2.819 8.788 -4.766 1.00 0.00 H new ATOM 0 HB2 ARG A 57 3.551 9.209 -6.957 1.00 0.00 H new ATOM 0 HB3 ARG A 57 3.201 10.807 -6.329 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.966 9.551 -6.490 1.00 0.00 H new ATOM 0 HG3 ARG A 57 5.323 10.736 -7.609 1.00 0.00 H new ATOM 0 HD2 ARG A 57 4.943 12.229 -5.507 1.00 0.00 H new ATOM 0 HD3 ARG A 57 6.003 11.106 -4.679 1.00 0.00 H new ATOM 0 HE ARG A 57 7.399 11.806 -6.999 1.00 0.00 H new ATOM 0 HH11 ARG A 57 5.975 13.486 -4.239 1.00 0.00 H new ATOM 0 HH12 ARG A 57 7.153 14.802 -4.286 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.909 13.500 -7.051 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.806 14.811 -5.871 1.00 0.00 H new ATOM 903 N ILE A 58 4.661 7.147 -4.541 1.00 0.00 N ATOM 904 CA ILE A 58 5.702 6.162 -4.274 1.00 0.00 C ATOM 905 C ILE A 58 5.440 4.866 -5.035 1.00 0.00 C ATOM 906 O ILE A 58 4.302 4.564 -5.397 1.00 0.00 O ATOM 907 CB ILE A 58 5.808 5.848 -2.770 1.00 0.00 C ATOM 908 CG1 ILE A 58 4.415 5.648 -2.169 1.00 0.00 C ATOM 909 CG2 ILE A 58 6.548 6.964 -2.047 1.00 0.00 C ATOM 910 CD1 ILE A 58 3.841 4.272 -2.419 1.00 0.00 C ATOM 0 H ILE A 58 3.742 6.749 -4.734 1.00 0.00 H new ATOM 0 HA ILE A 58 6.642 6.597 -4.613 1.00 0.00 H new ATOM 0 HB ILE A 58 6.373 4.924 -2.645 1.00 0.00 H new ATOM 0 HG12 ILE A 58 4.463 5.823 -1.094 1.00 0.00 H new ATOM 0 HG13 ILE A 58 3.739 6.396 -2.583 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.615 6.728 -0.985 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.552 7.063 -2.461 1.00 0.00 H new ATOM 0 HG23 ILE A 58 6.008 7.902 -2.177 1.00 0.00 H new ATOM 0 HD11 ILE A 58 2.853 4.202 -1.965 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.760 4.101 -3.492 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.496 3.519 -1.980 1.00 0.00 H new ATOM 922 N THR A 59 6.501 4.101 -5.273 1.00 0.00 N ATOM 923 CA THR A 59 6.386 2.837 -5.990 1.00 0.00 C ATOM 924 C THR A 59 6.261 1.666 -5.022 1.00 0.00 C ATOM 925 O THR A 59 7.130 1.449 -4.178 1.00 0.00 O ATOM 926 CB THR A 59 7.599 2.601 -6.909 1.00 0.00 C ATOM 927 OG1 THR A 59 7.742 3.695 -7.822 1.00 0.00 O ATOM 928 CG2 THR A 59 7.445 1.303 -7.686 1.00 0.00 C ATOM 0 H THR A 59 7.450 4.335 -4.980 1.00 0.00 H new ATOM 0 HA THR A 59 5.484 2.899 -6.599 1.00 0.00 H new ATOM 0 HB THR A 59 8.490 2.529 -6.286 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.516 3.538 -8.402 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.314 1.158 -8.328 1.00 0.00 H new ATOM 0 HG22 THR A 59 7.366 0.469 -6.989 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.545 1.350 -8.299 1.00 0.00 H new ATOM 936 N VAL A 60 5.173 0.913 -5.150 1.00 0.00 N ATOM 937 CA VAL A 60 4.935 -0.239 -4.288 1.00 0.00 C ATOM 938 C VAL A 60 4.988 -1.540 -5.081 1.00 0.00 C ATOM 939 O VAL A 60 4.436 -1.635 -6.177 1.00 0.00 O ATOM 940 CB VAL A 60 3.570 -0.137 -3.581 1.00 0.00 C ATOM 941 CG1 VAL A 60 3.329 -1.359 -2.707 1.00 0.00 C ATOM 942 CG2 VAL A 60 3.490 1.140 -2.759 1.00 0.00 C ATOM 0 H VAL A 60 4.443 1.080 -5.842 1.00 0.00 H new ATOM 0 HA VAL A 60 5.726 -0.242 -3.538 1.00 0.00 H new ATOM 0 HB VAL A 60 2.789 -0.103 -4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.360 -1.269 -2.216 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.341 -2.257 -3.325 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.113 -1.428 -1.953 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.519 1.196 -2.267 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.279 1.139 -2.007 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.615 2.003 -3.414 1.00 0.00 H new ATOM 952 N LYS A 61 5.657 -2.541 -4.520 1.00 0.00 N ATOM 953 CA LYS A 61 5.783 -3.839 -5.172 1.00 0.00 C ATOM 954 C LYS A 61 4.839 -4.858 -4.543 1.00 0.00 C ATOM 955 O LYS A 61 4.798 -5.011 -3.321 1.00 0.00 O ATOM 956 CB LYS A 61 7.226 -4.341 -5.082 1.00 0.00 C ATOM 957 CG LYS A 61 7.532 -5.084 -3.793 1.00 0.00 C ATOM 958 CD LYS A 61 7.200 -6.562 -3.909 1.00 0.00 C ATOM 959 CE LYS A 61 7.887 -7.375 -2.822 1.00 0.00 C ATOM 960 NZ LYS A 61 7.118 -7.356 -1.547 1.00 0.00 N ATOM 0 H LYS A 61 6.121 -2.478 -3.614 1.00 0.00 H new ATOM 0 HA LYS A 61 5.512 -3.718 -6.221 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.426 -4.999 -5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.904 -3.492 -5.172 1.00 0.00 H new ATOM 0 HG2 LYS A 61 8.587 -4.965 -3.545 1.00 0.00 H new ATOM 0 HG3 LYS A 61 6.961 -4.645 -2.975 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.121 -6.700 -3.841 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.507 -6.929 -4.888 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.006 -8.405 -3.159 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.887 -6.978 -2.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.085 -8.315 -1.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.581 -6.715 -0.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.150 -7.024 -1.731 1.00 0.00 H new ATOM 974 N LEU A 62 4.082 -5.554 -5.383 1.00 0.00 N ATOM 975 CA LEU A 62 3.138 -6.561 -4.909 1.00 0.00 C ATOM 976 C LEU A 62 3.546 -7.954 -5.379 1.00 0.00 C ATOM 977 O LEU A 62 3.711 -8.194 -6.576 1.00 0.00 O ATOM 978 CB LEU A 62 1.726 -6.237 -5.401 1.00 0.00 C ATOM 979 CG LEU A 62 1.193 -4.850 -5.042 1.00 0.00 C ATOM 980 CD1 LEU A 62 -0.106 -4.570 -5.782 1.00 0.00 C ATOM 981 CD2 LEU A 62 0.989 -4.728 -3.539 1.00 0.00 C ATOM 0 H LEU A 62 4.103 -5.440 -6.396 1.00 0.00 H new ATOM 0 HA LEU A 62 3.148 -6.548 -3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.708 -6.342 -6.486 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.042 -6.983 -4.997 1.00 0.00 H new ATOM 0 HG LEU A 62 1.930 -4.108 -5.349 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.471 -3.578 -5.514 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.071 -4.614 -6.857 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.850 -5.317 -5.506 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.609 -3.734 -3.303 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.272 -5.479 -3.207 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.940 -4.884 -3.029 1.00 0.00 H new ATOM 993 N THR A 63 3.704 -8.871 -4.430 1.00 0.00 N ATOM 994 CA THR A 63 4.091 -10.240 -4.747 1.00 0.00 C ATOM 995 C THR A 63 3.052 -11.235 -4.243 1.00 0.00 C ATOM 996 O THR A 63 2.669 -11.207 -3.073 1.00 0.00 O ATOM 997 CB THR A 63 5.461 -10.592 -4.136 1.00 0.00 C ATOM 998 OG1 THR A 63 6.056 -11.675 -4.860 1.00 0.00 O ATOM 999 CG2 THR A 63 5.319 -10.973 -2.670 1.00 0.00 C ATOM 0 H THR A 63 3.570 -8.690 -3.435 1.00 0.00 H new ATOM 0 HA THR A 63 4.158 -10.307 -5.833 1.00 0.00 H new ATOM 0 HB THR A 63 6.102 -9.713 -4.206 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.872 -11.569 -5.817 1.00 0.00 H new ATOM 0 HG21 THR A 63 6.299 -11.217 -2.261 1.00 0.00 H new ATOM 0 HG22 THR A 63 4.893 -10.136 -2.116 1.00 0.00 H new ATOM 0 HG23 THR A 63 4.663 -11.839 -2.581 1.00 0.00 H new ATOM 1007 N ILE A 64 2.601 -12.113 -5.132 1.00 0.00 N ATOM 1008 CA ILE A 64 1.608 -13.119 -4.776 1.00 0.00 C ATOM 1009 C ILE A 64 2.263 -14.472 -4.519 1.00 0.00 C ATOM 1010 O ILE A 64 2.924 -15.028 -5.395 1.00 0.00 O ATOM 1011 CB ILE A 64 0.546 -13.276 -5.880 1.00 0.00 C ATOM 1012 CG1 ILE A 64 -0.318 -12.017 -5.971 1.00 0.00 C ATOM 1013 CG2 ILE A 64 -0.318 -14.500 -5.613 1.00 0.00 C ATOM 1014 CD1 ILE A 64 -1.365 -11.923 -4.884 1.00 0.00 C ATOM 0 H ILE A 64 2.907 -12.148 -6.104 1.00 0.00 H new ATOM 0 HA ILE A 64 1.123 -12.774 -3.863 1.00 0.00 H new ATOM 0 HB ILE A 64 1.054 -13.414 -6.835 1.00 0.00 H new ATOM 0 HG12 ILE A 64 0.327 -11.139 -5.920 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.812 -11.994 -6.943 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.064 -14.598 -6.402 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.309 -15.391 -5.594 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.819 -14.389 -4.651 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.940 -11.006 -5.011 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.033 -12.782 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.878 -11.914 -3.909 1.00 0.00 H new ATOM 1026 N GLN A 65 2.072 -14.996 -3.313 1.00 0.00 N ATOM 1027 CA GLN A 65 2.643 -16.285 -2.941 1.00 0.00 C ATOM 1028 C GLN A 65 1.701 -17.053 -2.020 1.00 0.00 C ATOM 1029 O GLN A 65 1.404 -16.610 -0.912 1.00 0.00 O ATOM 1030 CB GLN A 65 3.997 -16.088 -2.256 1.00 0.00 C ATOM 1031 CG GLN A 65 3.889 -15.792 -0.769 1.00 0.00 C ATOM 1032 CD GLN A 65 5.198 -15.314 -0.173 1.00 0.00 C ATOM 1033 OE1 GLN A 65 6.038 -16.118 0.234 1.00 0.00 O ATOM 1034 NE2 GLN A 65 5.379 -14.000 -0.116 1.00 0.00 N ATOM 0 H GLN A 65 1.526 -14.548 -2.577 1.00 0.00 H new ATOM 0 HA GLN A 65 2.785 -16.867 -3.852 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.600 -16.985 -2.397 1.00 0.00 H new ATOM 0 HB3 GLN A 65 4.526 -15.269 -2.744 1.00 0.00 H new ATOM 0 HG2 GLN A 65 3.123 -15.034 -0.608 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.563 -16.691 -0.246 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.657 -13.370 -0.465 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.241 -13.620 0.277 1.00 0.00 H new ATOM 1043 N ASN A 66 1.234 -18.206 -2.488 1.00 0.00 N ATOM 1044 CA ASN A 66 0.324 -19.035 -1.707 1.00 0.00 C ATOM 1045 C ASN A 66 -0.905 -18.240 -1.278 1.00 0.00 C ATOM 1046 O ASN A 66 -1.272 -18.229 -0.103 1.00 0.00 O ATOM 1047 CB ASN A 66 1.040 -19.593 -0.475 1.00 0.00 C ATOM 1048 CG ASN A 66 0.274 -20.730 0.174 1.00 0.00 C ATOM 1049 OD1 ASN A 66 -0.935 -20.638 0.385 1.00 0.00 O ATOM 1050 ND2 ASN A 66 0.977 -21.810 0.493 1.00 0.00 N ATOM 0 H ASN A 66 1.471 -18.587 -3.404 1.00 0.00 H new ATOM 0 HA ASN A 66 -0.003 -19.863 -2.336 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.031 -19.944 -0.762 1.00 0.00 H new ATOM 0 HB3 ASN A 66 1.183 -18.793 0.252 1.00 0.00 H new ATOM 0 HD21 ASN A 66 0.516 -22.607 0.932 1.00 0.00 H new ATOM 0 HD22 ASN A 66 1.978 -21.842 0.299 1.00 0.00 H new ATOM 1057 N ARG A 67 -1.538 -17.575 -2.240 1.00 0.00 N ATOM 1058 CA ARG A 67 -2.725 -16.776 -1.962 1.00 0.00 C ATOM 1059 C ARG A 67 -2.414 -15.671 -0.957 1.00 0.00 C ATOM 1060 O ARG A 67 -3.297 -15.214 -0.231 1.00 0.00 O ATOM 1061 CB ARG A 67 -3.850 -17.664 -1.428 1.00 0.00 C ATOM 1062 CG ARG A 67 -4.379 -18.657 -2.450 1.00 0.00 C ATOM 1063 CD ARG A 67 -5.377 -18.006 -3.395 1.00 0.00 C ATOM 1064 NE ARG A 67 -5.879 -18.946 -4.393 1.00 0.00 N ATOM 1065 CZ ARG A 67 -5.242 -19.228 -5.523 1.00 0.00 C ATOM 1066 NH1 ARG A 67 -4.082 -18.646 -5.798 1.00 0.00 N ATOM 1067 NH2 ARG A 67 -5.763 -20.095 -6.382 1.00 0.00 N ATOM 0 H ARG A 67 -1.248 -17.574 -3.218 1.00 0.00 H new ATOM 0 HA ARG A 67 -3.048 -16.314 -2.895 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -3.488 -18.210 -0.557 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.671 -17.032 -1.089 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -3.548 -19.068 -3.023 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -4.855 -19.492 -1.935 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -6.213 -17.607 -2.821 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -4.903 -17.162 -3.897 1.00 0.00 H new ATOM 0 HE ARG A 67 -6.768 -19.412 -4.212 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -3.677 -17.980 -5.140 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -3.595 -18.865 -6.667 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -6.654 -20.546 -6.174 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.272 -20.311 -7.250 1.00 0.00 H new ATOM 1081 N GLN A 68 -1.155 -15.248 -0.921 1.00 0.00 N ATOM 1082 CA GLN A 68 -0.728 -14.198 -0.003 1.00 0.00 C ATOM 1083 C GLN A 68 -0.099 -13.034 -0.763 1.00 0.00 C ATOM 1084 O GLN A 68 0.668 -13.237 -1.703 1.00 0.00 O ATOM 1085 CB GLN A 68 0.268 -14.755 1.015 1.00 0.00 C ATOM 1086 CG GLN A 68 0.249 -14.024 2.348 1.00 0.00 C ATOM 1087 CD GLN A 68 1.413 -14.406 3.240 1.00 0.00 C ATOM 1088 OE1 GLN A 68 1.254 -15.171 4.192 1.00 0.00 O ATOM 1089 NE2 GLN A 68 2.591 -13.875 2.937 1.00 0.00 N ATOM 0 H GLN A 68 -0.413 -15.616 -1.516 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.608 -13.831 0.524 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.050 -15.809 1.185 1.00 0.00 H new ATOM 0 HB3 GLN A 68 1.272 -14.701 0.595 1.00 0.00 H new ATOM 0 HG2 GLN A 68 0.271 -12.949 2.169 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -0.686 -14.242 2.864 1.00 0.00 H new ATOM 0 HE21 GLN A 68 2.677 -13.246 2.139 1.00 0.00 H new ATOM 0 HE22 GLN A 68 3.411 -14.096 3.502 1.00 0.00 H new ATOM 1098 N ALA A 69 -0.430 -11.816 -0.348 1.00 0.00 N ATOM 1099 CA ALA A 69 0.103 -10.620 -0.988 1.00 0.00 C ATOM 1100 C ALA A 69 1.052 -9.875 -0.055 1.00 0.00 C ATOM 1101 O ALA A 69 0.800 -9.768 1.144 1.00 0.00 O ATOM 1102 CB ALA A 69 -1.031 -9.707 -1.429 1.00 0.00 C ATOM 0 H ALA A 69 -1.065 -11.631 0.429 1.00 0.00 H new ATOM 0 HA ALA A 69 0.668 -10.930 -1.867 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.618 -8.818 -1.905 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.669 -10.235 -2.138 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.620 -9.413 -0.560 1.00 0.00 H new ATOM 1108 N GLN A 70 2.144 -9.363 -0.615 1.00 0.00 N ATOM 1109 CA GLN A 70 3.131 -8.629 0.169 1.00 0.00 C ATOM 1110 C GLN A 70 3.184 -7.165 -0.256 1.00 0.00 C ATOM 1111 O GLN A 70 3.407 -6.857 -1.427 1.00 0.00 O ATOM 1112 CB GLN A 70 4.512 -9.268 0.015 1.00 0.00 C ATOM 1113 CG GLN A 70 5.404 -9.089 1.233 1.00 0.00 C ATOM 1114 CD GLN A 70 4.839 -9.754 2.472 1.00 0.00 C ATOM 1115 OE1 GLN A 70 4.430 -10.915 2.436 1.00 0.00 O ATOM 1116 NE2 GLN A 70 4.815 -9.021 3.579 1.00 0.00 N ATOM 0 H GLN A 70 2.367 -9.443 -1.607 1.00 0.00 H new ATOM 0 HA GLN A 70 2.833 -8.673 1.216 1.00 0.00 H new ATOM 0 HB2 GLN A 70 4.390 -10.333 -0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 70 5.008 -8.837 -0.855 1.00 0.00 H new ATOM 0 HG2 GLN A 70 6.390 -9.503 1.021 1.00 0.00 H new ATOM 0 HG3 GLN A 70 5.540 -8.025 1.426 1.00 0.00 H new ATOM 0 HE21 GLN A 70 5.164 -8.063 3.564 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.447 -9.416 4.444 1.00 0.00 H new ATOM 1125 N ILE A 71 2.977 -6.268 0.702 1.00 0.00 N ATOM 1126 CA ILE A 71 3.002 -4.837 0.426 1.00 0.00 C ATOM 1127 C ILE A 71 4.195 -4.168 1.101 1.00 0.00 C ATOM 1128 O ILE A 71 4.379 -4.282 2.313 1.00 0.00 O ATOM 1129 CB ILE A 71 1.707 -4.150 0.899 1.00 0.00 C ATOM 1130 CG1 ILE A 71 1.357 -4.596 2.320 1.00 0.00 C ATOM 1131 CG2 ILE A 71 0.564 -4.459 -0.056 1.00 0.00 C ATOM 1132 CD1 ILE A 71 0.107 -3.943 2.868 1.00 0.00 C ATOM 0 H ILE A 71 2.790 -6.507 1.676 1.00 0.00 H new ATOM 0 HA ILE A 71 3.089 -4.725 -0.655 1.00 0.00 H new ATOM 0 HB ILE A 71 1.867 -3.072 0.906 1.00 0.00 H new ATOM 0 HG12 ILE A 71 1.226 -5.678 2.331 1.00 0.00 H new ATOM 0 HG13 ILE A 71 2.195 -4.370 2.980 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.344 -3.967 0.292 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.815 -4.096 -1.053 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.401 -5.536 -0.092 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.080 -4.306 3.879 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.241 -2.862 2.890 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.742 -4.190 2.231 1.00 0.00 H new ATOM 1144 N GLU A 72 5.001 -3.469 0.309 1.00 0.00 N ATOM 1145 CA GLU A 72 6.176 -2.781 0.831 1.00 0.00 C ATOM 1146 C GLU A 72 6.532 -1.577 -0.037 1.00 0.00 C ATOM 1147 O GLU A 72 6.411 -1.624 -1.262 1.00 0.00 O ATOM 1148 CB GLU A 72 7.366 -3.740 0.904 1.00 0.00 C ATOM 1149 CG GLU A 72 8.170 -3.812 -0.383 1.00 0.00 C ATOM 1150 CD GLU A 72 9.285 -2.785 -0.432 1.00 0.00 C ATOM 1151 OE1 GLU A 72 10.334 -3.017 0.203 1.00 0.00 O ATOM 1152 OE2 GLU A 72 9.107 -1.749 -1.106 1.00 0.00 O ATOM 0 H GLU A 72 4.862 -3.364 -0.696 1.00 0.00 H new ATOM 0 HA GLU A 72 5.942 -2.427 1.835 1.00 0.00 H new ATOM 0 HB2 GLU A 72 8.023 -3.429 1.716 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.003 -4.737 1.152 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.596 -4.810 -0.486 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.504 -3.660 -1.232 1.00 0.00 H new ATOM 1159 N VAL A 73 6.970 -0.500 0.606 1.00 0.00 N ATOM 1160 CA VAL A 73 7.344 0.716 -0.106 1.00 0.00 C ATOM 1161 C VAL A 73 8.839 0.741 -0.404 1.00 0.00 C ATOM 1162 O VAL A 73 9.663 0.488 0.475 1.00 0.00 O ATOM 1163 CB VAL A 73 6.972 1.975 0.700 1.00 0.00 C ATOM 1164 CG1 VAL A 73 7.255 3.231 -0.110 1.00 0.00 C ATOM 1165 CG2 VAL A 73 5.512 1.923 1.125 1.00 0.00 C ATOM 0 H VAL A 73 7.075 -0.445 1.619 1.00 0.00 H new ATOM 0 HA VAL A 73 6.789 0.716 -1.044 1.00 0.00 H new ATOM 0 HB VAL A 73 7.588 2.005 1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 73 6.986 4.110 0.476 1.00 0.00 H new ATOM 0 HG12 VAL A 73 8.315 3.272 -0.360 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.667 3.212 -1.028 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.266 2.820 1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.877 1.869 0.241 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.345 1.043 1.746 1.00 0.00 H new ATOM 1175 N VAL A 74 9.183 1.047 -1.651 1.00 0.00 N ATOM 1176 CA VAL A 74 10.579 1.106 -2.067 1.00 0.00 C ATOM 1177 C VAL A 74 11.159 2.498 -1.847 1.00 0.00 C ATOM 1178 O VAL A 74 10.455 3.507 -1.904 1.00 0.00 O ATOM 1179 CB VAL A 74 10.740 0.722 -3.549 1.00 0.00 C ATOM 1180 CG1 VAL A 74 10.258 -0.701 -3.789 1.00 0.00 C ATOM 1181 CG2 VAL A 74 9.991 1.704 -4.438 1.00 0.00 C ATOM 0 H VAL A 74 8.513 1.258 -2.391 1.00 0.00 H new ATOM 0 HA VAL A 74 11.123 0.388 -1.453 1.00 0.00 H new ATOM 0 HB VAL A 74 11.799 0.769 -3.805 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.380 -0.954 -4.842 1.00 0.00 H new ATOM 0 HG12 VAL A 74 10.843 -1.391 -3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 74 9.206 -0.779 -3.517 1.00 0.00 H new ATOM 0 HG21 VAL A 74 10.116 1.417 -5.482 1.00 0.00 H new ATOM 0 HG22 VAL A 74 8.932 1.691 -4.182 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.389 2.708 -4.287 1.00 0.00 H new ATOM 1191 N PRO A 75 12.474 2.558 -1.591 1.00 0.00 N ATOM 1192 CA PRO A 75 13.179 3.822 -1.358 1.00 0.00 C ATOM 1193 C PRO A 75 13.288 4.666 -2.624 1.00 0.00 C ATOM 1194 O PRO A 75 12.887 4.235 -3.705 1.00 0.00 O ATOM 1195 CB PRO A 75 14.567 3.375 -0.893 1.00 0.00 C ATOM 1196 CG PRO A 75 14.744 2.017 -1.481 1.00 0.00 C ATOM 1197 CD PRO A 75 13.374 1.396 -1.508 1.00 0.00 C ATOM 0 HA PRO A 75 12.657 4.453 -0.639 1.00 0.00 H new ATOM 0 HB2 PRO A 75 15.340 4.060 -1.240 1.00 0.00 H new ATOM 0 HB3 PRO A 75 14.630 3.347 0.195 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.165 2.078 -2.485 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.432 1.419 -0.883 1.00 0.00 H new ATOM 0 HD2 PRO A 75 13.251 0.731 -2.363 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.184 0.804 -0.613 1.00 0.00 H new ATOM 1205 N SER A 76 13.833 5.870 -2.482 1.00 0.00 N ATOM 1206 CA SER A 76 13.992 6.775 -3.614 1.00 0.00 C ATOM 1207 C SER A 76 15.198 6.381 -4.460 1.00 0.00 C ATOM 1208 O SER A 76 16.344 6.587 -4.061 1.00 0.00 O ATOM 1209 CB SER A 76 14.148 8.216 -3.123 1.00 0.00 C ATOM 1210 OG SER A 76 14.653 9.052 -4.150 1.00 0.00 O ATOM 0 H SER A 76 14.172 6.241 -1.594 1.00 0.00 H new ATOM 0 HA SER A 76 13.098 6.704 -4.233 1.00 0.00 H new ATOM 0 HB2 SER A 76 13.184 8.594 -2.783 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.821 8.241 -2.266 1.00 0.00 H new ATOM 0 HG SER A 76 14.742 9.968 -3.812 1.00 0.00 H new ATOM 1216 N ALA A 77 14.931 5.813 -5.631 1.00 0.00 N ATOM 1217 CA ALA A 77 15.993 5.390 -6.536 1.00 0.00 C ATOM 1218 C ALA A 77 15.718 5.856 -7.962 1.00 0.00 C ATOM 1219 O ALA A 77 14.721 6.530 -8.223 1.00 0.00 O ATOM 1220 CB ALA A 77 16.152 3.878 -6.494 1.00 0.00 C ATOM 0 H ALA A 77 13.988 5.635 -5.976 1.00 0.00 H new ATOM 0 HA ALA A 77 16.923 5.851 -6.204 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.948 3.577 -7.175 1.00 0.00 H new ATOM 0 HB2 ALA A 77 16.404 3.567 -5.480 1.00 0.00 H new ATOM 0 HB3 ALA A 77 15.218 3.405 -6.797 1.00 0.00 H new ATOM 1226 N SER A 78 16.607 5.493 -8.880 1.00 0.00 N ATOM 1227 CA SER A 78 16.462 5.878 -10.279 1.00 0.00 C ATOM 1228 C SER A 78 16.896 4.743 -11.202 1.00 0.00 C ATOM 1229 O SER A 78 17.441 3.736 -10.752 1.00 0.00 O ATOM 1230 CB SER A 78 17.286 7.133 -10.573 1.00 0.00 C ATOM 1231 OG SER A 78 16.742 7.856 -11.664 1.00 0.00 O ATOM 0 H SER A 78 17.436 4.933 -8.681 1.00 0.00 H new ATOM 0 HA SER A 78 15.409 6.092 -10.464 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.314 7.769 -9.688 1.00 0.00 H new ATOM 0 HB3 SER A 78 18.315 6.852 -10.796 1.00 0.00 H new ATOM 0 HG SER A 78 17.285 8.654 -11.831 1.00 0.00 H new ATOM 1237 N ALA A 79 16.648 4.915 -12.497 1.00 0.00 N ATOM 1238 CA ALA A 79 17.014 3.907 -13.485 1.00 0.00 C ATOM 1239 C ALA A 79 18.414 3.364 -13.222 1.00 0.00 C ATOM 1240 O ALA A 79 18.595 2.165 -13.006 1.00 0.00 O ATOM 1241 CB ALA A 79 16.926 4.488 -14.888 1.00 0.00 C ATOM 0 H ALA A 79 16.196 5.742 -12.886 1.00 0.00 H new ATOM 0 HA ALA A 79 16.310 3.079 -13.402 1.00 0.00 H new ATOM 0 HB1 ALA A 79 17.202 3.725 -15.616 1.00 0.00 H new ATOM 0 HB2 ALA A 79 15.906 4.821 -15.080 1.00 0.00 H new ATOM 0 HB3 ALA A 79 17.607 5.335 -14.974 1.00 0.00 H new ATOM 1247 N LEU A 80 19.401 4.252 -13.242 1.00 0.00 N ATOM 1248 CA LEU A 80 20.787 3.861 -13.006 1.00 0.00 C ATOM 1249 C LEU A 80 21.181 2.687 -13.897 1.00 0.00 C ATOM 1250 O LEU A 80 21.780 1.717 -13.434 1.00 0.00 O ATOM 1251 CB LEU A 80 20.990 3.490 -11.536 1.00 0.00 C ATOM 1252 CG LEU A 80 20.730 4.604 -10.521 1.00 0.00 C ATOM 1253 CD1 LEU A 80 20.480 4.020 -9.140 1.00 0.00 C ATOM 1254 CD2 LEU A 80 21.899 5.578 -10.487 1.00 0.00 C ATOM 0 H LEU A 80 19.268 5.248 -13.419 1.00 0.00 H new ATOM 0 HA LEU A 80 21.425 4.710 -13.252 1.00 0.00 H new ATOM 0 HB2 LEU A 80 20.336 2.651 -11.300 1.00 0.00 H new ATOM 0 HB3 LEU A 80 22.015 3.141 -11.408 1.00 0.00 H new ATOM 0 HG LEU A 80 19.838 5.149 -10.829 1.00 0.00 H new ATOM 0 HD11 LEU A 80 20.297 4.828 -8.431 1.00 0.00 H new ATOM 0 HD12 LEU A 80 19.611 3.363 -9.175 1.00 0.00 H new ATOM 0 HD13 LEU A 80 21.353 3.450 -8.823 1.00 0.00 H new ATOM 0 HD21 LEU A 80 21.697 6.364 -9.759 1.00 0.00 H new ATOM 0 HD22 LEU A 80 22.807 5.046 -10.204 1.00 0.00 H new ATOM 0 HD23 LEU A 80 22.031 6.022 -11.474 1.00 0.00 H new ATOM 1266 N SER A 81 20.841 2.783 -15.179 1.00 0.00 N ATOM 1267 CA SER A 81 21.157 1.729 -16.135 1.00 0.00 C ATOM 1268 C SER A 81 21.359 2.305 -17.533 1.00 0.00 C ATOM 1269 O SER A 81 20.762 3.321 -17.889 1.00 0.00 O ATOM 1270 CB SER A 81 20.042 0.681 -16.158 1.00 0.00 C ATOM 1271 OG SER A 81 20.387 -0.411 -16.993 1.00 0.00 O ATOM 0 H SER A 81 20.347 3.580 -15.579 1.00 0.00 H new ATOM 0 HA SER A 81 22.086 1.254 -15.820 1.00 0.00 H new ATOM 0 HB2 SER A 81 19.853 0.324 -15.146 1.00 0.00 H new ATOM 0 HB3 SER A 81 19.117 1.136 -16.513 1.00 0.00 H new ATOM 0 HG SER A 81 19.660 -1.068 -16.990 1.00 0.00 H new ATOM 1277 N GLY A 82 22.204 1.649 -18.321 1.00 0.00 N ATOM 1278 CA GLY A 82 22.470 2.110 -19.671 1.00 0.00 C ATOM 1279 C GLY A 82 23.107 1.039 -20.535 1.00 0.00 C ATOM 1280 O GLY A 82 22.428 0.308 -21.256 1.00 0.00 O ATOM 0 H GLY A 82 22.710 0.806 -18.049 1.00 0.00 H new ATOM 0 HA2 GLY A 82 21.537 2.436 -20.131 1.00 0.00 H new ATOM 0 HA3 GLY A 82 23.127 2.979 -19.632 1.00 0.00 H new ATOM 1284 N PRO A 83 24.443 0.937 -20.468 1.00 0.00 N ATOM 1285 CA PRO A 83 25.201 -0.048 -21.245 1.00 0.00 C ATOM 1286 C PRO A 83 24.970 -1.474 -20.755 1.00 0.00 C ATOM 1287 O PRO A 83 25.678 -1.960 -19.874 1.00 0.00 O ATOM 1288 CB PRO A 83 26.657 0.366 -21.017 1.00 0.00 C ATOM 1289 CG PRO A 83 26.648 1.083 -19.712 1.00 0.00 C ATOM 1290 CD PRO A 83 25.316 1.776 -19.630 1.00 0.00 C ATOM 0 HA PRO A 83 24.905 -0.056 -22.294 1.00 0.00 H new ATOM 0 HB2 PRO A 83 27.315 -0.502 -20.987 1.00 0.00 H new ATOM 0 HB3 PRO A 83 27.016 1.010 -21.820 1.00 0.00 H new ATOM 0 HG2 PRO A 83 26.777 0.387 -18.883 1.00 0.00 H new ATOM 0 HG3 PRO A 83 27.466 1.801 -19.656 1.00 0.00 H new ATOM 0 HD2 PRO A 83 24.955 1.832 -18.603 1.00 0.00 H new ATOM 0 HD3 PRO A 83 25.371 2.798 -20.005 1.00 0.00 H new ATOM 1298 N SER A 84 23.975 -2.139 -21.333 1.00 0.00 N ATOM 1299 CA SER A 84 23.648 -3.508 -20.953 1.00 0.00 C ATOM 1300 C SER A 84 23.907 -4.469 -22.110 1.00 0.00 C ATOM 1301 O SER A 84 23.692 -4.130 -23.273 1.00 0.00 O ATOM 1302 CB SER A 84 22.186 -3.603 -20.514 1.00 0.00 C ATOM 1303 OG SER A 84 22.006 -4.636 -19.561 1.00 0.00 O ATOM 0 H SER A 84 23.381 -1.752 -22.066 1.00 0.00 H new ATOM 0 HA SER A 84 24.289 -3.790 -20.118 1.00 0.00 H new ATOM 0 HB2 SER A 84 21.868 -2.651 -20.088 1.00 0.00 H new ATOM 0 HB3 SER A 84 21.554 -3.790 -21.382 1.00 0.00 H new ATOM 0 HG SER A 84 21.064 -4.675 -19.295 1.00 0.00 H new ATOM 1309 N SER A 85 24.371 -5.671 -21.780 1.00 0.00 N ATOM 1310 CA SER A 85 24.664 -6.681 -22.790 1.00 0.00 C ATOM 1311 C SER A 85 23.442 -7.557 -23.052 1.00 0.00 C ATOM 1312 O SER A 85 23.516 -8.782 -22.979 1.00 0.00 O ATOM 1313 CB SER A 85 25.843 -7.549 -22.347 1.00 0.00 C ATOM 1314 OG SER A 85 25.526 -8.279 -21.175 1.00 0.00 O ATOM 0 H SER A 85 24.552 -5.968 -20.821 1.00 0.00 H new ATOM 0 HA SER A 85 24.928 -6.169 -23.715 1.00 0.00 H new ATOM 0 HB2 SER A 85 26.112 -8.239 -23.147 1.00 0.00 H new ATOM 0 HB3 SER A 85 26.713 -6.919 -22.163 1.00 0.00 H new ATOM 0 HG SER A 85 24.768 -8.874 -21.355 1.00 0.00 H new ATOM 1320 N GLY A 86 22.318 -6.917 -23.358 1.00 0.00 N ATOM 1321 CA GLY A 86 21.096 -7.652 -23.627 1.00 0.00 C ATOM 1322 C GLY A 86 20.407 -7.190 -24.895 1.00 0.00 C ATOM 1323 O GLY A 86 20.819 -7.548 -25.999 1.00 0.00 O ATOM 0 H GLY A 86 22.232 -5.903 -23.424 1.00 0.00 H new ATOM 0 HA2 GLY A 86 21.326 -8.714 -23.709 1.00 0.00 H new ATOM 0 HA3 GLY A 86 20.414 -7.537 -22.784 1.00 0.00 H new TER 1327 GLY A 86