USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 523 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 44 SER OG : rot 130:sc= 0.46 USER MOD Set 1.2: A 47 SER OG : rot 180:sc= -0.805 USER MOD Set 2.1: A 12 CYS SG : rot 180:sc= 0.911 USER MOD Set 2.2: A 15 CYS SG : rot 126:sc= -1.24! USER MOD Set 3.1: A 4 HIS : no HE2:sc= -6.78! C(o=-6.8!,f=-13!) USER MOD Set 3.2: A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= -2.51! (180deg=-5.32!) USER MOD Single : A 3 LYS NZ :NH3+ 172:sc= -0.876 (180deg=-1.09) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 160:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.456 K(o=-0.46,f=-1.2) USER MOD Single : A 25 LYS NZ :NH3+ -128:sc= -0.742 (180deg=-1.96!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.355 X(o=-0.35,f=-0.11) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 1:sc= 0.687 USER MOD Single : A 46 HIS : no HD1:sc= -0.406 K(o=-0.41,f=-0.97!) USER MOD Single : A 50 THR OG1 : rot 180:sc= -2.64! USER MOD Single : A 54 THR OG1 : rot 93:sc= -1.25 USER MOD Single : A 56 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0137) USER MOD Single : A 57 LYS NZ :NH3+ 158:sc= -0.439 (180deg=-1.46!) USER MOD Single : A 58 THR OG1 : rot 140:sc= -2.29! USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.183 -17.387 -20.219 1.00 0.00 N ATOM 2 CA MET A 1 -15.805 -18.014 -21.517 1.00 0.00 C ATOM 3 C MET A 1 -16.073 -17.031 -22.655 1.00 0.00 C ATOM 4 O MET A 1 -15.161 -16.664 -23.393 1.00 0.00 O ATOM 5 CB MET A 1 -16.618 -19.295 -21.724 1.00 0.00 C ATOM 6 CG MET A 1 -15.706 -20.513 -21.554 1.00 0.00 C ATOM 7 SD MET A 1 -16.708 -21.961 -21.132 1.00 0.00 S ATOM 8 CE MET A 1 -15.406 -23.205 -21.315 1.00 0.00 C ATOM 0 H1 MET A 1 -15.388 -17.463 -19.552 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.413 -16.384 -20.372 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.012 -17.876 -19.826 1.00 0.00 H new ATOM 0 HA MET A 1 -14.744 -18.266 -21.507 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.437 -19.338 -21.006 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.065 -19.298 -22.718 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.151 -20.697 -22.474 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.972 -20.325 -20.771 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.813 -24.192 -21.097 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.026 -23.187 -22.337 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.594 -22.986 -20.622 1.00 0.00 H new ATOM 20 N PRO A 2 -17.301 -16.600 -22.805 1.00 0.00 N ATOM 21 CA PRO A 2 -17.691 -15.639 -23.879 1.00 0.00 C ATOM 22 C PRO A 2 -17.115 -14.244 -23.643 1.00 0.00 C ATOM 23 O PRO A 2 -16.789 -13.879 -22.514 1.00 0.00 O ATOM 24 CB PRO A 2 -19.219 -15.612 -23.813 1.00 0.00 C ATOM 25 CG PRO A 2 -19.569 -16.051 -22.430 1.00 0.00 C ATOM 26 CD PRO A 2 -18.451 -16.984 -21.969 1.00 0.00 C ATOM 0 HA PRO A 2 -17.308 -15.944 -24.853 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -19.602 -14.612 -24.016 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -19.655 -16.278 -24.558 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -19.657 -15.194 -21.763 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -20.531 -16.564 -22.419 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -18.235 -16.855 -20.909 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -18.719 -18.031 -22.114 1.00 0.00 H new ATOM 34 N LYS A 3 -16.998 -13.469 -24.717 1.00 0.00 N ATOM 35 CA LYS A 3 -16.464 -12.116 -24.615 1.00 0.00 C ATOM 36 C LYS A 3 -17.589 -11.116 -24.372 1.00 0.00 C ATOM 37 O LYS A 3 -18.699 -11.281 -24.877 1.00 0.00 O ATOM 38 CB LYS A 3 -15.719 -11.751 -25.900 1.00 0.00 C ATOM 39 CG LYS A 3 -14.423 -12.560 -25.980 1.00 0.00 C ATOM 40 CD LYS A 3 -13.879 -12.518 -27.409 1.00 0.00 C ATOM 41 CE LYS A 3 -14.268 -13.802 -28.141 1.00 0.00 C ATOM 42 NZ LYS A 3 -15.742 -14.001 -28.046 1.00 0.00 N ATOM 0 H LYS A 3 -17.263 -13.752 -25.660 1.00 0.00 H new ATOM 0 HA LYS A 3 -15.772 -12.079 -23.773 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.345 -11.958 -26.768 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -15.497 -10.684 -25.915 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -13.686 -12.154 -25.287 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -14.607 -13.592 -25.681 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -14.278 -11.651 -27.936 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -12.794 -12.410 -27.393 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -13.965 -13.743 -29.186 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -13.746 -14.654 -27.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -16.025 -14.796 -28.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -16.001 -14.210 -27.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -16.230 -13.137 -28.357 1.00 0.00 H new ATOM 56 N HIS A 4 -17.297 -10.080 -23.591 1.00 0.00 N ATOM 57 CA HIS A 4 -18.296 -9.065 -23.287 1.00 0.00 C ATOM 58 C HIS A 4 -17.879 -7.713 -23.854 1.00 0.00 C ATOM 59 O HIS A 4 -16.758 -7.254 -23.635 1.00 0.00 O ATOM 60 CB HIS A 4 -18.482 -8.953 -21.773 1.00 0.00 C ATOM 61 CG HIS A 4 -19.935 -8.715 -21.465 1.00 0.00 C ATOM 62 ND1 HIS A 4 -20.918 -9.640 -21.781 1.00 0.00 N ATOM 63 CD2 HIS A 4 -20.589 -7.662 -20.874 1.00 0.00 C ATOM 64 CE1 HIS A 4 -22.097 -9.130 -21.383 1.00 0.00 C ATOM 65 NE2 HIS A 4 -21.954 -7.926 -20.824 1.00 0.00 N ATOM 0 H HIS A 4 -16.385 -9.923 -23.161 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.239 -9.361 -23.747 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.140 -9.866 -21.285 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -17.877 -8.136 -21.381 1.00 0.00 H new ATOM 0 HD1 HIS A 4 -20.773 -10.543 -22.233 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -20.115 -6.765 -20.504 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -23.045 -9.634 -21.501 1.00 0.00 H new ATOM 73 N GLU A 5 -18.791 -7.080 -24.585 1.00 0.00 N ATOM 74 CA GLU A 5 -18.510 -5.781 -25.180 1.00 0.00 C ATOM 75 C GLU A 5 -19.172 -4.669 -24.374 1.00 0.00 C ATOM 76 O GLU A 5 -20.357 -4.745 -24.048 1.00 0.00 O ATOM 77 CB GLU A 5 -19.022 -5.742 -26.621 1.00 0.00 C ATOM 78 CG GLU A 5 -18.248 -6.754 -27.465 1.00 0.00 C ATOM 79 CD GLU A 5 -19.191 -7.450 -28.441 1.00 0.00 C ATOM 80 OE1 GLU A 5 -20.342 -7.644 -28.086 1.00 0.00 O ATOM 81 OE2 GLU A 5 -18.748 -7.779 -29.530 1.00 0.00 O ATOM 0 H GLU A 5 -19.724 -7.443 -24.778 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.431 -5.627 -25.175 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.087 -5.971 -26.646 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.902 -4.740 -27.034 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -17.452 -6.250 -28.013 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -17.772 -7.491 -26.818 1.00 0.00 H new ATOM 88 N PHE A 6 -18.398 -3.639 -24.056 1.00 0.00 N ATOM 89 CA PHE A 6 -18.915 -2.513 -23.287 1.00 0.00 C ATOM 90 C PHE A 6 -18.306 -1.208 -23.796 1.00 0.00 C ATOM 91 O PHE A 6 -17.117 -1.151 -24.110 1.00 0.00 O ATOM 92 CB PHE A 6 -18.578 -2.711 -21.805 1.00 0.00 C ATOM 93 CG PHE A 6 -19.817 -2.517 -20.966 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.421 -1.257 -20.887 1.00 0.00 C ATOM 95 CD2 PHE A 6 -20.362 -3.600 -20.264 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.569 -1.080 -20.105 1.00 0.00 C ATOM 97 CE2 PHE A 6 -21.510 -3.421 -19.483 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.113 -2.161 -19.404 1.00 0.00 C ATOM 0 H PHE A 6 -17.415 -3.559 -24.317 1.00 0.00 H new ATOM 0 HA PHE A 6 -19.997 -2.461 -23.405 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -18.173 -3.710 -21.646 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -17.808 -2.003 -21.501 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -20.002 -0.422 -21.429 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -19.897 -4.573 -20.325 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -22.035 -0.108 -20.043 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -21.930 -4.256 -18.941 1.00 0.00 H new ATOM 0 HZ PHE A 6 -22.999 -2.023 -18.802 1.00 0.00 H new ATOM 108 N SER A 7 -19.125 -0.164 -23.881 1.00 0.00 N ATOM 109 CA SER A 7 -18.649 1.131 -24.362 1.00 0.00 C ATOM 110 C SER A 7 -18.567 2.128 -23.213 1.00 0.00 C ATOM 111 O SER A 7 -19.583 2.489 -22.619 1.00 0.00 O ATOM 112 CB SER A 7 -19.592 1.666 -25.441 1.00 0.00 C ATOM 113 OG SER A 7 -19.748 3.070 -25.273 1.00 0.00 O ATOM 0 H SER A 7 -20.112 -0.187 -23.626 1.00 0.00 H new ATOM 0 HA SER A 7 -17.653 0.999 -24.786 1.00 0.00 H new ATOM 0 HB2 SER A 7 -19.191 1.449 -26.431 1.00 0.00 H new ATOM 0 HB3 SER A 7 -20.560 1.170 -25.373 1.00 0.00 H new ATOM 0 HG SER A 7 -20.350 3.417 -25.964 1.00 0.00 H new ATOM 119 N VAL A 8 -17.352 2.566 -22.899 1.00 0.00 N ATOM 120 CA VAL A 8 -17.156 3.516 -21.812 1.00 0.00 C ATOM 121 C VAL A 8 -16.267 4.677 -22.246 1.00 0.00 C ATOM 122 O VAL A 8 -15.100 4.483 -22.585 1.00 0.00 O ATOM 123 CB VAL A 8 -16.518 2.811 -20.616 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.088 2.399 -20.972 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.492 3.764 -19.417 1.00 0.00 C ATOM 0 H VAL A 8 -16.497 2.281 -23.377 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.132 3.913 -21.533 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.099 1.924 -20.363 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.631 1.896 -20.120 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.106 1.722 -21.826 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.506 3.285 -21.224 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.037 3.262 -18.563 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.910 4.650 -19.669 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.511 4.059 -19.164 1.00 0.00 H new ATOM 135 N ASP A 9 -16.819 5.884 -22.211 1.00 0.00 N ATOM 136 CA ASP A 9 -16.054 7.068 -22.581 1.00 0.00 C ATOM 137 C ASP A 9 -15.120 7.445 -21.437 1.00 0.00 C ATOM 138 O ASP A 9 -15.573 7.817 -20.355 1.00 0.00 O ATOM 139 CB ASP A 9 -17.002 8.232 -22.881 1.00 0.00 C ATOM 140 CG ASP A 9 -16.774 8.739 -24.303 1.00 0.00 C ATOM 141 OD1 ASP A 9 -16.494 7.923 -25.165 1.00 0.00 O ATOM 142 OD2 ASP A 9 -16.882 9.938 -24.507 1.00 0.00 O ATOM 0 H ASP A 9 -17.783 6.068 -21.933 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.467 6.852 -23.474 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -18.036 7.909 -22.763 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -16.837 9.039 -22.168 1.00 0.00 H new ATOM 147 N MET A 10 -13.818 7.327 -21.672 1.00 0.00 N ATOM 148 CA MET A 10 -12.846 7.642 -20.633 1.00 0.00 C ATOM 149 C MET A 10 -12.655 9.149 -20.493 1.00 0.00 C ATOM 150 O MET A 10 -12.169 9.814 -21.407 1.00 0.00 O ATOM 151 CB MET A 10 -11.505 6.984 -20.965 1.00 0.00 C ATOM 152 CG MET A 10 -10.776 7.814 -22.023 1.00 0.00 C ATOM 153 SD MET A 10 -9.540 6.783 -22.851 1.00 0.00 S ATOM 154 CE MET A 10 -9.074 7.974 -24.131 1.00 0.00 C ATOM 0 H MET A 10 -13.416 7.021 -22.558 1.00 0.00 H new ATOM 0 HA MET A 10 -13.224 7.256 -19.686 1.00 0.00 H new ATOM 0 HB2 MET A 10 -10.894 6.905 -20.066 1.00 0.00 H new ATOM 0 HB3 MET A 10 -11.666 5.970 -21.331 1.00 0.00 H new ATOM 0 HG2 MET A 10 -11.488 8.202 -22.751 1.00 0.00 H new ATOM 0 HG3 MET A 10 -10.295 8.675 -21.558 1.00 0.00 H new ATOM 0 HE1 MET A 10 -8.306 7.539 -24.771 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.949 8.223 -24.732 1.00 0.00 H new ATOM 0 HE3 MET A 10 -8.686 8.878 -23.663 1.00 0.00 H new ATOM 164 N THR A 11 -13.026 9.671 -19.329 1.00 0.00 N ATOM 165 CA THR A 11 -12.878 11.094 -19.052 1.00 0.00 C ATOM 166 C THR A 11 -11.798 11.304 -17.998 1.00 0.00 C ATOM 167 O THR A 11 -11.122 12.332 -17.978 1.00 0.00 O ATOM 168 CB THR A 11 -14.203 11.679 -18.555 1.00 0.00 C ATOM 169 OG1 THR A 11 -14.463 11.212 -17.238 1.00 0.00 O ATOM 170 CG2 THR A 11 -15.338 11.246 -19.485 1.00 0.00 C ATOM 0 H THR A 11 -13.430 9.131 -18.564 1.00 0.00 H new ATOM 0 HA THR A 11 -12.591 11.603 -19.972 1.00 0.00 H new ATOM 0 HB THR A 11 -14.138 12.767 -18.549 1.00 0.00 H new ATOM 0 HG1 THR A 11 -15.310 11.588 -16.919 1.00 0.00 H new ATOM 0 HG21 THR A 11 -16.280 11.664 -19.129 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.139 11.607 -20.494 1.00 0.00 H new ATOM 0 HG23 THR A 11 -15.405 10.158 -19.496 1.00 0.00 H new ATOM 178 N CYS A 12 -11.652 10.315 -17.122 1.00 0.00 N ATOM 179 CA CYS A 12 -10.660 10.378 -16.057 1.00 0.00 C ATOM 180 C CYS A 12 -9.420 9.575 -16.431 1.00 0.00 C ATOM 181 O CYS A 12 -8.725 9.058 -15.561 1.00 0.00 O ATOM 182 CB CYS A 12 -11.262 9.833 -14.760 1.00 0.00 C ATOM 183 SG CYS A 12 -11.981 11.196 -13.811 1.00 0.00 S ATOM 0 H CYS A 12 -12.209 9.460 -17.130 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.367 11.418 -15.912 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -12.026 9.089 -14.985 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.493 9.332 -14.172 1.00 0.00 H new ATOM 0 HG CYS A 12 -12.494 10.734 -12.709 1.00 0.00 H new ATOM 189 N GLY A 13 -9.154 9.482 -17.734 1.00 0.00 N ATOM 190 CA GLY A 13 -7.993 8.742 -18.226 1.00 0.00 C ATOM 191 C GLY A 13 -6.977 8.506 -17.114 1.00 0.00 C ATOM 192 O GLY A 13 -6.582 7.372 -16.854 1.00 0.00 O ATOM 0 H GLY A 13 -9.724 9.908 -18.465 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.316 7.785 -18.636 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.524 9.296 -19.039 1.00 0.00 H new ATOM 196 N GLY A 14 -6.565 9.583 -16.456 1.00 0.00 N ATOM 197 CA GLY A 14 -5.600 9.473 -15.369 1.00 0.00 C ATOM 198 C GLY A 14 -6.167 8.643 -14.221 1.00 0.00 C ATOM 199 O GLY A 14 -5.542 7.686 -13.768 1.00 0.00 O ATOM 0 H GLY A 14 -6.880 10.533 -16.653 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.682 9.014 -15.737 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.337 10.467 -15.009 1.00 0.00 H new ATOM 203 N CYS A 15 -7.357 9.015 -13.759 1.00 0.00 N ATOM 204 CA CYS A 15 -7.999 8.296 -12.665 1.00 0.00 C ATOM 205 C CYS A 15 -8.729 7.060 -13.192 1.00 0.00 C ATOM 206 O CYS A 15 -8.612 5.973 -12.624 1.00 0.00 O ATOM 207 CB CYS A 15 -8.984 9.219 -11.942 1.00 0.00 C ATOM 208 SG CYS A 15 -9.004 10.833 -12.758 1.00 0.00 S ATOM 0 H CYS A 15 -7.892 9.804 -14.122 1.00 0.00 H new ATOM 0 HA CYS A 15 -7.231 7.972 -11.962 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.983 8.782 -11.951 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -8.695 9.331 -10.897 1.00 0.00 H new ATOM 0 HG CYS A 15 -10.226 11.143 -13.077 1.00 0.00 H new ATOM 214 N ALA A 16 -9.470 7.229 -14.284 1.00 0.00 N ATOM 215 CA ALA A 16 -10.201 6.113 -14.883 1.00 0.00 C ATOM 216 C ALA A 16 -9.245 4.967 -15.210 1.00 0.00 C ATOM 217 O ALA A 16 -9.621 3.796 -15.144 1.00 0.00 O ATOM 218 CB ALA A 16 -10.902 6.572 -16.162 1.00 0.00 C ATOM 0 H ALA A 16 -9.581 8.119 -14.770 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.946 5.763 -14.168 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.444 5.734 -16.601 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.602 7.373 -15.926 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.160 6.937 -16.873 1.00 0.00 H new ATOM 224 N GLU A 17 -8.008 5.311 -15.564 1.00 0.00 N ATOM 225 CA GLU A 17 -7.011 4.297 -15.901 1.00 0.00 C ATOM 226 C GLU A 17 -6.740 3.403 -14.698 1.00 0.00 C ATOM 227 O GLU A 17 -6.692 2.180 -14.820 1.00 0.00 O ATOM 228 CB GLU A 17 -5.707 4.964 -16.345 1.00 0.00 C ATOM 229 CG GLU A 17 -4.584 3.925 -16.369 1.00 0.00 C ATOM 230 CD GLU A 17 -3.999 3.750 -14.971 1.00 0.00 C ATOM 231 OE1 GLU A 17 -3.307 4.650 -14.522 1.00 0.00 O ATOM 232 OE2 GLU A 17 -4.248 2.717 -14.370 1.00 0.00 O ATOM 0 H GLU A 17 -7.675 6.273 -15.625 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.400 3.690 -16.718 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.830 5.405 -17.334 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.451 5.776 -15.664 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.968 2.972 -16.732 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.803 4.239 -17.061 1.00 0.00 H new ATOM 239 N ALA A 18 -6.574 4.021 -13.533 1.00 0.00 N ATOM 240 CA ALA A 18 -6.322 3.266 -12.314 1.00 0.00 C ATOM 241 C ALA A 18 -7.577 2.503 -11.910 1.00 0.00 C ATOM 242 O ALA A 18 -7.504 1.439 -11.297 1.00 0.00 O ATOM 243 CB ALA A 18 -5.905 4.213 -11.187 1.00 0.00 C ATOM 0 H ALA A 18 -6.609 5.033 -13.409 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.515 2.557 -12.497 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.719 3.639 -10.279 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.997 4.743 -11.474 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.702 4.933 -11.003 1.00 0.00 H new ATOM 249 N VAL A 19 -8.728 3.056 -12.275 1.00 0.00 N ATOM 250 CA VAL A 19 -10.007 2.429 -11.966 1.00 0.00 C ATOM 251 C VAL A 19 -10.122 1.080 -12.667 1.00 0.00 C ATOM 252 O VAL A 19 -10.690 0.132 -12.123 1.00 0.00 O ATOM 253 CB VAL A 19 -11.157 3.336 -12.402 1.00 0.00 C ATOM 254 CG1 VAL A 19 -12.472 2.563 -12.320 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.229 4.555 -11.478 1.00 0.00 C ATOM 0 H VAL A 19 -8.801 3.936 -12.785 1.00 0.00 H new ATOM 0 HA VAL A 19 -10.063 2.273 -10.889 1.00 0.00 H new ATOM 0 HB VAL A 19 -10.988 3.666 -13.427 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -13.294 3.209 -12.631 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -12.425 1.694 -12.977 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.637 2.234 -11.294 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -12.050 5.201 -11.791 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.397 4.225 -10.453 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.291 5.108 -11.532 1.00 0.00 H new ATOM 265 N SER A 20 -9.583 1.001 -13.880 1.00 0.00 N ATOM 266 CA SER A 20 -9.639 -0.237 -14.647 1.00 0.00 C ATOM 267 C SER A 20 -9.024 -1.380 -13.846 1.00 0.00 C ATOM 268 O SER A 20 -9.475 -2.521 -13.931 1.00 0.00 O ATOM 269 CB SER A 20 -8.884 -0.070 -15.966 1.00 0.00 C ATOM 270 OG SER A 20 -9.642 0.758 -16.839 1.00 0.00 O ATOM 0 H SER A 20 -9.107 1.772 -14.349 1.00 0.00 H new ATOM 0 HA SER A 20 -10.683 -0.470 -14.858 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.905 0.373 -15.784 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.713 -1.043 -16.426 1.00 0.00 H new ATOM 0 HG SER A 20 -9.055 1.129 -17.530 1.00 0.00 H new ATOM 276 N ARG A 21 -8.002 -1.064 -13.058 1.00 0.00 N ATOM 277 CA ARG A 21 -7.349 -2.072 -12.234 1.00 0.00 C ATOM 278 C ARG A 21 -8.371 -2.732 -11.313 1.00 0.00 C ATOM 279 O ARG A 21 -8.342 -3.945 -11.101 1.00 0.00 O ATOM 280 CB ARG A 21 -6.239 -1.433 -11.396 1.00 0.00 C ATOM 281 CG ARG A 21 -5.158 -0.876 -12.325 1.00 0.00 C ATOM 282 CD ARG A 21 -4.317 0.155 -11.571 1.00 0.00 C ATOM 283 NE ARG A 21 -3.513 -0.500 -10.546 1.00 0.00 N ATOM 284 CZ ARG A 21 -3.173 0.137 -9.431 1.00 0.00 C ATOM 285 NH1 ARG A 21 -3.566 1.367 -9.239 1.00 0.00 N ATOM 286 NH2 ARG A 21 -2.447 -0.466 -8.529 1.00 0.00 N ATOM 0 H ARG A 21 -7.611 -0.126 -12.973 1.00 0.00 H new ATOM 0 HA ARG A 21 -6.911 -2.827 -12.887 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.649 -0.635 -10.777 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.808 -2.171 -10.720 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.523 -1.685 -12.687 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.617 -0.416 -13.200 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -3.668 0.685 -12.268 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -4.968 0.899 -11.112 1.00 0.00 H new ATOM 0 HE ARG A 21 -3.207 -1.463 -10.687 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -4.133 1.837 -9.944 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -3.306 1.858 -8.383 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -2.140 -1.427 -8.680 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -2.186 0.024 -7.673 1.00 0.00 H new ATOM 300 N VAL A 22 -9.277 -1.921 -10.776 1.00 0.00 N ATOM 301 CA VAL A 22 -10.314 -2.424 -9.883 1.00 0.00 C ATOM 302 C VAL A 22 -11.143 -3.497 -10.581 1.00 0.00 C ATOM 303 O VAL A 22 -11.807 -4.304 -9.930 1.00 0.00 O ATOM 304 CB VAL A 22 -11.225 -1.278 -9.439 1.00 0.00 C ATOM 305 CG1 VAL A 22 -12.408 -1.841 -8.646 1.00 0.00 C ATOM 306 CG2 VAL A 22 -10.433 -0.314 -8.553 1.00 0.00 C ATOM 0 H VAL A 22 -9.314 -0.915 -10.943 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.834 -2.862 -9.008 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.596 -0.748 -10.317 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.056 -1.024 -8.330 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.972 -2.530 -9.274 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.038 -2.371 -7.768 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -11.080 0.503 -8.235 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.064 -0.846 -7.676 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.590 0.088 -9.115 1.00 0.00 H new ATOM 316 N LEU A 23 -11.100 -3.499 -11.910 1.00 0.00 N ATOM 317 CA LEU A 23 -11.854 -4.479 -12.683 1.00 0.00 C ATOM 318 C LEU A 23 -11.397 -5.885 -12.317 1.00 0.00 C ATOM 319 O LEU A 23 -12.212 -6.794 -12.169 1.00 0.00 O ATOM 320 CB LEU A 23 -11.642 -4.233 -14.182 1.00 0.00 C ATOM 321 CG LEU A 23 -12.475 -5.219 -15.013 1.00 0.00 C ATOM 322 CD1 LEU A 23 -11.840 -6.610 -14.967 1.00 0.00 C ATOM 323 CD2 LEU A 23 -13.902 -5.297 -14.461 1.00 0.00 C ATOM 0 H LEU A 23 -10.557 -2.841 -12.469 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.915 -4.378 -12.453 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.923 -3.210 -14.432 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.586 -4.342 -14.428 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.504 -4.867 -16.044 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.438 -7.303 -15.559 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.830 -6.563 -15.374 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.799 -6.957 -13.935 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -14.485 -5.999 -15.057 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.874 -5.637 -13.426 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -14.364 -4.311 -14.507 1.00 0.00 H new ATOM 335 N ASN A 24 -10.091 -6.052 -12.155 1.00 0.00 N ATOM 336 CA ASN A 24 -9.539 -7.349 -11.789 1.00 0.00 C ATOM 337 C ASN A 24 -10.142 -7.821 -10.470 1.00 0.00 C ATOM 338 O ASN A 24 -10.427 -9.006 -10.293 1.00 0.00 O ATOM 339 CB ASN A 24 -8.019 -7.246 -11.651 1.00 0.00 C ATOM 340 CG ASN A 24 -7.458 -8.543 -11.080 1.00 0.00 C ATOM 341 OD1 ASN A 24 -7.595 -9.602 -11.694 1.00 0.00 O ATOM 342 ND2 ASN A 24 -6.830 -8.525 -9.936 1.00 0.00 N ATOM 0 H ASN A 24 -9.399 -5.312 -12.270 1.00 0.00 H new ATOM 0 HA ASN A 24 -9.782 -8.069 -12.570 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.570 -7.043 -12.623 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.760 -6.411 -11.000 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -6.451 -9.389 -9.548 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -6.718 -7.647 -9.430 1.00 0.00 H new ATOM 349 N LYS A 25 -10.333 -6.882 -9.548 1.00 0.00 N ATOM 350 CA LYS A 25 -10.904 -7.201 -8.244 1.00 0.00 C ATOM 351 C LYS A 25 -12.370 -7.612 -8.379 1.00 0.00 C ATOM 352 O LYS A 25 -12.810 -8.583 -7.764 1.00 0.00 O ATOM 353 CB LYS A 25 -10.798 -5.984 -7.321 1.00 0.00 C ATOM 354 CG LYS A 25 -11.622 -6.226 -6.053 1.00 0.00 C ATOM 355 CD LYS A 25 -11.444 -5.043 -5.096 1.00 0.00 C ATOM 356 CE LYS A 25 -9.971 -4.926 -4.699 1.00 0.00 C ATOM 357 NZ LYS A 25 -9.297 -3.929 -5.578 1.00 0.00 N ATOM 0 H LYS A 25 -10.102 -5.897 -9.679 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.346 -8.035 -7.819 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.755 -5.803 -7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.157 -5.093 -7.835 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.675 -6.346 -6.308 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.303 -7.150 -5.570 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.777 -4.122 -5.574 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.061 -5.183 -4.208 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.888 -4.622 -3.656 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.481 -5.896 -4.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.441 -4.352 -5.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.944 -3.645 -6.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.034 -3.093 -5.017 1.00 0.00 H new ATOM 371 N LEU A 26 -13.118 -6.858 -9.178 1.00 0.00 N ATOM 372 CA LEU A 26 -14.535 -7.140 -9.378 1.00 0.00 C ATOM 373 C LEU A 26 -14.736 -8.338 -10.301 1.00 0.00 C ATOM 374 O LEU A 26 -15.621 -9.164 -10.077 1.00 0.00 O ATOM 375 CB LEU A 26 -15.213 -5.916 -9.994 1.00 0.00 C ATOM 376 CG LEU A 26 -16.623 -5.766 -9.425 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.389 -7.080 -9.595 1.00 0.00 C ATOM 378 CD2 LEU A 26 -16.537 -5.413 -7.939 1.00 0.00 C ATOM 0 H LEU A 26 -12.769 -6.051 -9.695 1.00 0.00 H new ATOM 0 HA LEU A 26 -14.976 -7.372 -8.409 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -14.629 -5.020 -9.783 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.257 -6.020 -11.078 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.146 -4.972 -9.958 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.394 -6.970 -9.188 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -17.451 -7.330 -10.654 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -16.868 -7.876 -9.064 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -17.542 -5.306 -7.532 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -16.013 -6.206 -7.406 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -15.995 -4.475 -7.819 1.00 0.00 H new ATOM 390 N GLY A 27 -13.924 -8.420 -11.349 1.00 0.00 N ATOM 391 CA GLY A 27 -14.039 -9.513 -12.306 1.00 0.00 C ATOM 392 C GLY A 27 -12.994 -10.594 -12.060 1.00 0.00 C ATOM 393 O GLY A 27 -13.328 -11.770 -11.921 1.00 0.00 O ATOM 0 H GLY A 27 -13.185 -7.748 -11.556 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -15.036 -9.950 -12.241 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -13.927 -9.123 -13.318 1.00 0.00 H new ATOM 397 N GLY A 28 -11.727 -10.195 -12.026 1.00 0.00 N ATOM 398 CA GLY A 28 -10.648 -11.153 -11.817 1.00 0.00 C ATOM 399 C GLY A 28 -10.528 -12.072 -13.026 1.00 0.00 C ATOM 400 O GLY A 28 -10.065 -13.207 -12.919 1.00 0.00 O ATOM 0 H GLY A 28 -11.425 -9.227 -12.139 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.708 -10.625 -11.656 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.841 -11.741 -10.920 1.00 0.00 H new ATOM 404 N VAL A 29 -10.958 -11.565 -14.177 1.00 0.00 N ATOM 405 CA VAL A 29 -10.913 -12.332 -15.416 1.00 0.00 C ATOM 406 C VAL A 29 -10.035 -11.634 -16.446 1.00 0.00 C ATOM 407 O VAL A 29 -9.427 -10.601 -16.164 1.00 0.00 O ATOM 408 CB VAL A 29 -12.327 -12.488 -15.976 1.00 0.00 C ATOM 409 CG1 VAL A 29 -13.056 -13.615 -15.237 1.00 0.00 C ATOM 410 CG2 VAL A 29 -13.090 -11.174 -15.786 1.00 0.00 C ATOM 0 H VAL A 29 -11.342 -10.625 -14.277 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.491 -13.314 -15.201 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.273 -12.733 -17.037 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -14.063 -13.722 -15.640 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -12.511 -14.549 -15.370 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -13.113 -13.376 -14.175 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -14.100 -11.279 -16.183 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.141 -10.933 -14.724 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.573 -10.373 -16.315 1.00 0.00 H new ATOM 420 N LYS A 30 -9.977 -12.208 -17.640 1.00 0.00 N ATOM 421 CA LYS A 30 -9.173 -11.638 -18.715 1.00 0.00 C ATOM 422 C LYS A 30 -9.853 -10.399 -19.283 1.00 0.00 C ATOM 423 O LYS A 30 -11.040 -10.424 -19.609 1.00 0.00 O ATOM 424 CB LYS A 30 -8.969 -12.668 -19.827 1.00 0.00 C ATOM 425 CG LYS A 30 -8.049 -12.082 -20.902 1.00 0.00 C ATOM 426 CD LYS A 30 -7.332 -13.218 -21.635 1.00 0.00 C ATOM 427 CE LYS A 30 -6.186 -13.748 -20.769 1.00 0.00 C ATOM 428 NZ LYS A 30 -6.410 -15.192 -20.480 1.00 0.00 N ATOM 0 H LYS A 30 -10.474 -13.063 -17.889 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.202 -11.356 -18.307 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.533 -13.580 -19.418 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.929 -12.942 -20.264 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.629 -11.488 -21.608 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.320 -11.412 -20.446 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -8.035 -14.021 -21.857 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.945 -12.861 -22.589 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.234 -13.612 -21.283 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.129 -13.184 -19.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.632 -15.553 -19.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -7.310 -15.309 -19.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.444 -15.724 -21.373 1.00 0.00 H new ATOM 442 N TYR A 31 -9.095 -9.316 -19.389 1.00 0.00 N ATOM 443 CA TYR A 31 -9.639 -8.069 -19.910 1.00 0.00 C ATOM 444 C TYR A 31 -8.652 -7.391 -20.853 1.00 0.00 C ATOM 445 O TYR A 31 -7.482 -7.768 -20.924 1.00 0.00 O ATOM 446 CB TYR A 31 -9.965 -7.126 -18.752 1.00 0.00 C ATOM 447 CG TYR A 31 -8.842 -7.164 -17.745 1.00 0.00 C ATOM 448 CD1 TYR A 31 -7.598 -6.606 -18.065 1.00 0.00 C ATOM 449 CD2 TYR A 31 -9.043 -7.753 -16.491 1.00 0.00 C ATOM 450 CE1 TYR A 31 -6.556 -6.639 -17.132 1.00 0.00 C ATOM 451 CE2 TYR A 31 -8.000 -7.785 -15.557 1.00 0.00 C ATOM 452 CZ TYR A 31 -6.756 -7.228 -15.877 1.00 0.00 C ATOM 453 OH TYR A 31 -5.728 -7.257 -14.957 1.00 0.00 O ATOM 0 H TYR A 31 -8.111 -9.275 -19.124 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.546 -8.300 -20.468 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -10.102 -6.110 -19.123 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -10.902 -7.422 -18.280 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.443 -6.150 -19.032 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -10.002 -8.183 -16.244 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.596 -6.210 -17.380 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -8.155 -8.239 -14.590 1.00 0.00 H new ATOM 0 HH TYR A 31 -6.034 -7.700 -14.138 1.00 0.00 H new ATOM 463 N ASP A 32 -9.137 -6.384 -21.572 1.00 0.00 N ATOM 464 CA ASP A 32 -8.299 -5.647 -22.509 1.00 0.00 C ATOM 465 C ASP A 32 -8.893 -4.267 -22.775 1.00 0.00 C ATOM 466 O ASP A 32 -10.044 -4.147 -23.194 1.00 0.00 O ATOM 467 CB ASP A 32 -8.182 -6.418 -23.825 1.00 0.00 C ATOM 468 CG ASP A 32 -9.258 -7.496 -23.896 1.00 0.00 C ATOM 469 OD1 ASP A 32 -9.262 -8.357 -23.031 1.00 0.00 O ATOM 470 OD2 ASP A 32 -10.060 -7.443 -24.812 1.00 0.00 O ATOM 0 H ASP A 32 -10.103 -6.061 -21.524 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.308 -5.529 -22.072 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.285 -5.734 -24.667 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.194 -6.873 -23.903 1.00 0.00 H new ATOM 475 N ILE A 33 -8.103 -3.230 -22.524 1.00 0.00 N ATOM 476 CA ILE A 33 -8.563 -1.863 -22.736 1.00 0.00 C ATOM 477 C ILE A 33 -7.712 -1.168 -23.793 1.00 0.00 C ATOM 478 O ILE A 33 -6.488 -1.105 -23.675 1.00 0.00 O ATOM 479 CB ILE A 33 -8.493 -1.079 -21.423 1.00 0.00 C ATOM 480 CG1 ILE A 33 -9.175 0.278 -21.602 1.00 0.00 C ATOM 481 CG2 ILE A 33 -7.029 -0.865 -21.030 1.00 0.00 C ATOM 482 CD1 ILE A 33 -9.314 0.966 -20.242 1.00 0.00 C ATOM 0 H ILE A 33 -7.147 -3.308 -22.176 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.595 -1.897 -23.084 1.00 0.00 H new ATOM 0 HB ILE A 33 -9.000 -1.641 -20.639 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -8.592 0.903 -22.279 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -10.157 0.146 -22.056 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -6.981 -0.307 -20.095 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.542 -1.832 -20.901 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -6.520 -0.304 -21.814 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.800 1.933 -20.371 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -9.915 0.343 -19.579 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.326 1.112 -19.806 1.00 0.00 H new ATOM 494 N ASP A 34 -8.367 -0.651 -24.830 1.00 0.00 N ATOM 495 CA ASP A 34 -7.658 0.035 -25.904 1.00 0.00 C ATOM 496 C ASP A 34 -7.933 1.536 -25.863 1.00 0.00 C ATOM 497 O ASP A 34 -9.019 1.990 -26.221 1.00 0.00 O ATOM 498 CB ASP A 34 -8.088 -0.530 -27.258 1.00 0.00 C ATOM 499 CG ASP A 34 -8.050 -2.054 -27.221 1.00 0.00 C ATOM 500 OD1 ASP A 34 -7.423 -2.589 -26.322 1.00 0.00 O ATOM 501 OD2 ASP A 34 -8.646 -2.663 -28.093 1.00 0.00 O ATOM 0 H ASP A 34 -9.379 -0.694 -24.948 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.589 -0.127 -25.766 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.094 -0.189 -27.501 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -7.428 -0.160 -28.042 1.00 0.00 H new ATOM 506 N LEU A 35 -6.938 2.295 -25.420 1.00 0.00 N ATOM 507 CA LEU A 35 -7.063 3.745 -25.326 1.00 0.00 C ATOM 508 C LEU A 35 -7.337 4.384 -26.691 1.00 0.00 C ATOM 509 O LEU A 35 -8.288 5.150 -26.840 1.00 0.00 O ATOM 510 CB LEU A 35 -5.778 4.338 -24.738 1.00 0.00 C ATOM 511 CG LEU A 35 -6.095 5.068 -23.431 1.00 0.00 C ATOM 512 CD1 LEU A 35 -6.402 4.045 -22.336 1.00 0.00 C ATOM 513 CD2 LEU A 35 -4.889 5.913 -23.011 1.00 0.00 C ATOM 0 H LEU A 35 -6.034 1.930 -25.120 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.911 3.961 -24.676 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.051 3.546 -24.556 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.326 5.028 -25.450 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.960 5.715 -23.579 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -6.628 4.565 -21.405 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.260 3.442 -22.632 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.537 3.398 -22.190 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -5.115 6.433 -22.080 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.025 5.266 -22.864 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.667 6.643 -23.789 1.00 0.00 H new ATOM 525 N PRO A 36 -6.516 4.106 -27.677 1.00 0.00 N ATOM 526 CA PRO A 36 -6.676 4.694 -29.041 1.00 0.00 C ATOM 527 C PRO A 36 -8.002 4.324 -29.703 1.00 0.00 C ATOM 528 O PRO A 36 -8.484 5.042 -30.580 1.00 0.00 O ATOM 529 CB PRO A 36 -5.492 4.143 -29.843 1.00 0.00 C ATOM 530 CG PRO A 36 -4.952 2.992 -29.059 1.00 0.00 C ATOM 531 CD PRO A 36 -5.353 3.206 -27.602 1.00 0.00 C ATOM 0 HA PRO A 36 -6.689 5.783 -28.993 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -5.810 3.822 -30.835 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -4.729 4.908 -29.985 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -5.353 2.050 -29.433 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.868 2.937 -29.155 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -5.609 2.264 -27.117 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.541 3.651 -27.027 1.00 0.00 H new ATOM 539 N ASN A 37 -8.588 3.207 -29.289 1.00 0.00 N ATOM 540 CA ASN A 37 -9.854 2.774 -29.869 1.00 0.00 C ATOM 541 C ASN A 37 -11.021 3.126 -28.950 1.00 0.00 C ATOM 542 O ASN A 37 -12.184 2.994 -29.332 1.00 0.00 O ATOM 543 CB ASN A 37 -9.831 1.261 -30.110 1.00 0.00 C ATOM 544 CG ASN A 37 -10.181 0.956 -31.564 1.00 0.00 C ATOM 545 OD1 ASN A 37 -10.993 0.070 -31.834 1.00 0.00 O ATOM 546 ND2 ASN A 37 -9.613 1.637 -32.521 1.00 0.00 N ATOM 0 H ASN A 37 -8.215 2.593 -28.565 1.00 0.00 H new ATOM 0 HA ASN A 37 -9.988 3.292 -30.818 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.844 0.862 -29.874 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.541 0.768 -29.446 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.841 1.436 -33.495 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.941 2.370 -32.296 1.00 0.00 H new ATOM 553 N LYS A 38 -10.705 3.569 -27.737 1.00 0.00 N ATOM 554 CA LYS A 38 -11.742 3.929 -26.775 1.00 0.00 C ATOM 555 C LYS A 38 -12.733 2.782 -26.628 1.00 0.00 C ATOM 556 O LYS A 38 -13.939 2.998 -26.503 1.00 0.00 O ATOM 557 CB LYS A 38 -12.479 5.185 -27.239 1.00 0.00 C ATOM 558 CG LYS A 38 -11.564 6.006 -28.152 1.00 0.00 C ATOM 559 CD LYS A 38 -11.941 7.485 -28.062 1.00 0.00 C ATOM 560 CE LYS A 38 -11.549 8.193 -29.361 1.00 0.00 C ATOM 561 NZ LYS A 38 -11.323 9.641 -29.089 1.00 0.00 N ATOM 0 H LYS A 38 -9.750 3.687 -27.399 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.272 4.127 -25.812 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.389 4.910 -27.771 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.781 5.781 -26.378 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.523 5.867 -27.860 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.655 5.659 -29.181 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.012 7.588 -27.888 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.435 7.949 -27.216 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.646 7.744 -29.774 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -12.335 8.070 -30.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.057 10.123 -29.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -12.196 10.064 -28.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -10.559 9.748 -28.392 1.00 0.00 H new ATOM 575 N LYS A 39 -12.211 1.563 -26.648 1.00 0.00 N ATOM 576 CA LYS A 39 -13.048 0.379 -26.522 1.00 0.00 C ATOM 577 C LYS A 39 -12.480 -0.557 -25.464 1.00 0.00 C ATOM 578 O LYS A 39 -11.264 -0.682 -25.323 1.00 0.00 O ATOM 579 CB LYS A 39 -13.118 -0.353 -27.865 1.00 0.00 C ATOM 580 CG LYS A 39 -14.575 -0.659 -28.211 1.00 0.00 C ATOM 581 CD LYS A 39 -14.623 -1.577 -29.434 1.00 0.00 C ATOM 582 CE LYS A 39 -15.767 -2.580 -29.280 1.00 0.00 C ATOM 583 NZ LYS A 39 -15.917 -3.357 -30.542 1.00 0.00 N ATOM 0 H LYS A 39 -11.215 1.369 -26.750 1.00 0.00 H new ATOM 0 HA LYS A 39 -14.050 0.689 -26.224 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.669 0.259 -28.647 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -12.544 -1.278 -27.816 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -15.069 -1.136 -27.365 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -15.114 0.266 -28.415 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -14.764 -0.986 -30.339 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -13.676 -2.105 -29.542 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -15.565 -3.254 -28.447 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.695 -2.057 -29.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -16.695 -4.040 -30.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -16.128 -2.708 -31.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -15.033 -3.867 -30.743 1.00 0.00 H new ATOM 597 N VAL A 40 -13.365 -1.215 -24.727 1.00 0.00 N ATOM 598 CA VAL A 40 -12.932 -2.141 -23.691 1.00 0.00 C ATOM 599 C VAL A 40 -13.691 -3.455 -23.805 1.00 0.00 C ATOM 600 O VAL A 40 -14.919 -3.484 -23.721 1.00 0.00 O ATOM 601 CB VAL A 40 -13.164 -1.526 -22.310 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.249 -2.204 -21.288 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.849 -0.028 -22.361 1.00 0.00 C ATOM 0 H VAL A 40 -14.376 -1.126 -24.826 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.868 -2.337 -23.821 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.204 -1.671 -22.018 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.415 -1.765 -20.304 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.471 -3.271 -21.252 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.209 -2.060 -21.579 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.014 0.412 -21.378 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.809 0.115 -22.653 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -13.500 0.456 -23.089 1.00 0.00 H new ATOM 613 N CYS A 41 -12.952 -4.542 -23.994 1.00 0.00 N ATOM 614 CA CYS A 41 -13.566 -5.857 -24.115 1.00 0.00 C ATOM 615 C CYS A 41 -13.077 -6.772 -23.001 1.00 0.00 C ATOM 616 O CYS A 41 -11.896 -7.110 -22.933 1.00 0.00 O ATOM 617 CB CYS A 41 -13.226 -6.473 -25.473 1.00 0.00 C ATOM 618 SG CYS A 41 -14.591 -7.531 -26.014 1.00 0.00 S ATOM 0 H CYS A 41 -11.935 -4.539 -24.066 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.647 -5.744 -24.033 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -13.048 -5.687 -26.207 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -12.307 -7.055 -25.401 1.00 0.00 H new ATOM 0 HG CYS A 41 -15.539 -7.504 -25.125 1.00 0.00 H new ATOM 624 N ILE A 42 -13.995 -7.160 -22.126 1.00 0.00 N ATOM 625 CA ILE A 42 -13.651 -8.029 -21.007 1.00 0.00 C ATOM 626 C ILE A 42 -14.538 -9.265 -20.984 1.00 0.00 C ATOM 627 O ILE A 42 -15.748 -9.178 -21.197 1.00 0.00 O ATOM 628 CB ILE A 42 -13.797 -7.268 -19.691 1.00 0.00 C ATOM 629 CG1 ILE A 42 -13.784 -8.263 -18.520 1.00 0.00 C ATOM 630 CG2 ILE A 42 -15.112 -6.483 -19.697 1.00 0.00 C ATOM 631 CD1 ILE A 42 -15.217 -8.608 -18.102 1.00 0.00 C ATOM 0 H ILE A 42 -14.978 -6.889 -22.168 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.616 -8.348 -21.131 1.00 0.00 H new ATOM 0 HB ILE A 42 -12.967 -6.571 -19.577 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.254 -9.170 -18.810 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -13.244 -7.835 -17.675 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -15.216 -5.940 -18.758 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -15.110 -5.776 -20.527 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -15.948 -7.174 -19.811 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -15.194 -9.314 -17.272 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -15.734 -7.700 -17.792 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.744 -9.056 -18.944 1.00 0.00 H new ATOM 643 N GLU A 43 -13.929 -10.414 -20.714 1.00 0.00 N ATOM 644 CA GLU A 43 -14.676 -11.661 -20.654 1.00 0.00 C ATOM 645 C GLU A 43 -14.809 -12.103 -19.205 1.00 0.00 C ATOM 646 O GLU A 43 -13.814 -12.380 -18.539 1.00 0.00 O ATOM 647 CB GLU A 43 -13.945 -12.743 -21.452 1.00 0.00 C ATOM 648 CG GLU A 43 -14.518 -14.115 -21.095 1.00 0.00 C ATOM 649 CD GLU A 43 -13.578 -14.837 -20.134 1.00 0.00 C ATOM 650 OE1 GLU A 43 -12.383 -14.816 -20.380 1.00 0.00 O ATOM 651 OE2 GLU A 43 -14.066 -15.399 -19.169 1.00 0.00 O ATOM 0 H GLU A 43 -12.929 -10.506 -20.535 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.667 -11.507 -21.082 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.055 -12.558 -22.521 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.878 -12.714 -21.231 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.501 -14.000 -20.638 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.654 -14.708 -21.999 1.00 0.00 H new ATOM 658 N SER A 44 -16.040 -12.148 -18.715 1.00 0.00 N ATOM 659 CA SER A 44 -16.281 -12.539 -17.334 1.00 0.00 C ATOM 660 C SER A 44 -17.235 -13.721 -17.258 1.00 0.00 C ATOM 661 O SER A 44 -17.927 -14.039 -18.225 1.00 0.00 O ATOM 662 CB SER A 44 -16.870 -11.361 -16.558 1.00 0.00 C ATOM 663 OG SER A 44 -18.023 -11.795 -15.850 1.00 0.00 O ATOM 0 H SER A 44 -16.880 -11.921 -19.248 1.00 0.00 H new ATOM 0 HA SER A 44 -15.328 -12.834 -16.894 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.131 -10.962 -15.863 1.00 0.00 H new ATOM 0 HB3 SER A 44 -17.132 -10.554 -17.242 1.00 0.00 H new ATOM 0 HG SER A 44 -17.957 -11.513 -14.914 1.00 0.00 H new ATOM 669 N GLU A 45 -17.269 -14.363 -16.097 1.00 0.00 N ATOM 670 CA GLU A 45 -18.140 -15.505 -15.888 1.00 0.00 C ATOM 671 C GLU A 45 -19.591 -15.048 -15.771 1.00 0.00 C ATOM 672 O GLU A 45 -20.517 -15.806 -16.058 1.00 0.00 O ATOM 673 CB GLU A 45 -17.727 -16.237 -14.613 1.00 0.00 C ATOM 674 CG GLU A 45 -16.203 -16.191 -14.468 1.00 0.00 C ATOM 675 CD GLU A 45 -15.681 -17.558 -14.038 1.00 0.00 C ATOM 676 OE1 GLU A 45 -16.271 -18.140 -13.143 1.00 0.00 O ATOM 677 OE2 GLU A 45 -14.698 -18.002 -14.609 1.00 0.00 O ATOM 0 H GLU A 45 -16.702 -14.110 -15.288 1.00 0.00 H new ATOM 0 HA GLU A 45 -18.051 -16.179 -16.740 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.199 -15.775 -13.746 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.068 -17.272 -14.648 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.748 -15.899 -15.414 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.921 -15.437 -13.733 1.00 0.00 H new ATOM 684 N HIS A 46 -19.779 -13.801 -15.349 1.00 0.00 N ATOM 685 CA HIS A 46 -21.119 -13.247 -15.201 1.00 0.00 C ATOM 686 C HIS A 46 -21.355 -12.145 -16.226 1.00 0.00 C ATOM 687 O HIS A 46 -22.277 -12.221 -17.037 1.00 0.00 O ATOM 688 CB HIS A 46 -21.299 -12.682 -13.791 1.00 0.00 C ATOM 689 CG HIS A 46 -21.957 -13.713 -12.915 1.00 0.00 C ATOM 690 ND1 HIS A 46 -22.197 -15.008 -13.348 1.00 0.00 N ATOM 691 CD2 HIS A 46 -22.432 -13.655 -11.628 1.00 0.00 C ATOM 692 CE1 HIS A 46 -22.791 -15.670 -12.338 1.00 0.00 C ATOM 693 NE2 HIS A 46 -22.958 -14.892 -11.266 1.00 0.00 N ATOM 0 H HIS A 46 -19.025 -13.159 -15.105 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.843 -14.045 -15.366 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -20.332 -12.400 -13.375 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -21.907 -11.778 -13.825 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -22.402 -12.782 -10.993 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -23.096 -16.705 -12.389 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -23.380 -15.149 -10.374 1.00 0.00 H new ATOM 701 N SER A 47 -20.511 -11.122 -16.183 1.00 0.00 N ATOM 702 CA SER A 47 -20.627 -10.003 -17.111 1.00 0.00 C ATOM 703 C SER A 47 -21.853 -9.155 -16.787 1.00 0.00 C ATOM 704 O SER A 47 -22.828 -9.647 -16.221 1.00 0.00 O ATOM 705 CB SER A 47 -20.731 -10.522 -18.544 1.00 0.00 C ATOM 706 OG SER A 47 -20.167 -11.825 -18.614 1.00 0.00 O ATOM 0 H SER A 47 -19.741 -11.043 -15.518 1.00 0.00 H new ATOM 0 HA SER A 47 -19.736 -9.383 -17.011 1.00 0.00 H new ATOM 0 HB2 SER A 47 -21.774 -10.547 -18.859 1.00 0.00 H new ATOM 0 HB3 SER A 47 -20.209 -9.850 -19.225 1.00 0.00 H new ATOM 0 HG SER A 47 -20.234 -12.161 -19.532 1.00 0.00 H new ATOM 712 N MET A 48 -21.793 -7.878 -17.152 1.00 0.00 N ATOM 713 CA MET A 48 -22.904 -6.967 -16.900 1.00 0.00 C ATOM 714 C MET A 48 -23.067 -6.717 -15.404 1.00 0.00 C ATOM 715 O MET A 48 -24.181 -6.540 -14.911 1.00 0.00 O ATOM 716 CB MET A 48 -24.201 -7.546 -17.470 1.00 0.00 C ATOM 717 CG MET A 48 -23.967 -8.010 -18.910 1.00 0.00 C ATOM 718 SD MET A 48 -25.475 -8.781 -19.547 1.00 0.00 S ATOM 719 CE MET A 48 -25.647 -7.750 -21.024 1.00 0.00 C ATOM 0 H MET A 48 -20.993 -7.453 -17.620 1.00 0.00 H new ATOM 0 HA MET A 48 -22.686 -6.019 -17.392 1.00 0.00 H new ATOM 0 HB2 MET A 48 -24.538 -8.383 -16.858 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.990 -6.794 -17.443 1.00 0.00 H new ATOM 0 HG2 MET A 48 -23.687 -7.163 -19.536 1.00 0.00 H new ATOM 0 HG3 MET A 48 -23.140 -8.719 -18.945 1.00 0.00 H new ATOM 0 HE1 MET A 48 -26.532 -8.057 -21.581 1.00 0.00 H new ATOM 0 HE2 MET A 48 -25.748 -6.706 -20.729 1.00 0.00 H new ATOM 0 HE3 MET A 48 -24.764 -7.866 -21.653 1.00 0.00 H new ATOM 729 N ASP A 49 -21.949 -6.700 -14.691 1.00 0.00 N ATOM 730 CA ASP A 49 -21.971 -6.464 -13.251 1.00 0.00 C ATOM 731 C ASP A 49 -20.595 -6.016 -12.772 1.00 0.00 C ATOM 732 O ASP A 49 -20.479 -5.170 -11.887 1.00 0.00 O ATOM 733 CB ASP A 49 -22.378 -7.742 -12.517 1.00 0.00 C ATOM 734 CG ASP A 49 -23.646 -8.316 -13.139 1.00 0.00 C ATOM 735 OD1 ASP A 49 -24.672 -7.663 -13.055 1.00 0.00 O ATOM 736 OD2 ASP A 49 -23.572 -9.401 -13.694 1.00 0.00 O ATOM 0 H ASP A 49 -21.019 -6.846 -15.083 1.00 0.00 H new ATOM 0 HA ASP A 49 -22.697 -5.680 -13.037 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -21.573 -8.475 -12.570 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -22.545 -7.528 -11.461 1.00 0.00 H new ATOM 741 N THR A 50 -19.559 -6.595 -13.366 1.00 0.00 N ATOM 742 CA THR A 50 -18.189 -6.258 -13.002 1.00 0.00 C ATOM 743 C THR A 50 -17.755 -4.942 -13.646 1.00 0.00 C ATOM 744 O THR A 50 -17.046 -4.144 -13.034 1.00 0.00 O ATOM 745 CB THR A 50 -17.239 -7.376 -13.450 1.00 0.00 C ATOM 746 OG1 THR A 50 -15.943 -6.835 -13.657 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.740 -7.995 -14.758 1.00 0.00 C ATOM 0 H THR A 50 -19.641 -7.298 -14.100 1.00 0.00 H new ATOM 0 HA THR A 50 -18.147 -6.147 -11.918 1.00 0.00 H new ATOM 0 HB THR A 50 -17.202 -8.145 -12.678 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.333 -7.547 -13.942 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.060 -8.788 -15.069 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.736 -8.410 -14.606 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.781 -7.228 -15.531 1.00 0.00 H new ATOM 755 N LEU A 51 -18.165 -4.737 -14.893 1.00 0.00 N ATOM 756 CA LEU A 51 -17.795 -3.536 -15.630 1.00 0.00 C ATOM 757 C LEU A 51 -18.381 -2.264 -15.016 1.00 0.00 C ATOM 758 O LEU A 51 -17.666 -1.283 -14.809 1.00 0.00 O ATOM 759 CB LEU A 51 -18.276 -3.663 -17.074 1.00 0.00 C ATOM 760 CG LEU A 51 -17.563 -4.840 -17.747 1.00 0.00 C ATOM 761 CD1 LEU A 51 -18.494 -6.055 -17.791 1.00 0.00 C ATOM 762 CD2 LEU A 51 -17.172 -4.454 -19.176 1.00 0.00 C ATOM 0 H LEU A 51 -18.754 -5.387 -15.414 1.00 0.00 H new ATOM 0 HA LEU A 51 -16.709 -3.450 -15.587 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -19.355 -3.816 -17.097 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -18.073 -2.741 -17.619 1.00 0.00 H new ATOM 0 HG LEU A 51 -16.669 -5.088 -17.175 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -17.982 -6.889 -18.271 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -18.773 -6.336 -16.776 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -19.391 -5.806 -18.358 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -16.665 -5.292 -19.653 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -18.068 -4.202 -19.743 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -16.504 -3.593 -19.150 1.00 0.00 H new ATOM 774 N LEU A 52 -19.683 -2.270 -14.758 1.00 0.00 N ATOM 775 CA LEU A 52 -20.346 -1.091 -14.208 1.00 0.00 C ATOM 776 C LEU A 52 -19.690 -0.620 -12.914 1.00 0.00 C ATOM 777 O LEU A 52 -19.351 0.553 -12.780 1.00 0.00 O ATOM 778 CB LEU A 52 -21.825 -1.386 -13.943 1.00 0.00 C ATOM 779 CG LEU A 52 -22.011 -2.867 -13.593 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.254 -3.032 -12.710 1.00 0.00 C ATOM 781 CD2 LEU A 52 -22.190 -3.690 -14.875 1.00 0.00 C ATOM 0 H LEU A 52 -20.297 -3.069 -14.918 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.252 -0.297 -14.949 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.188 -0.763 -13.126 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.418 -1.135 -14.823 1.00 0.00 H new ATOM 0 HG LEU A 52 -21.129 -3.219 -13.058 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.386 -4.085 -12.461 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.128 -2.456 -11.794 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -24.132 -2.673 -13.247 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.321 -4.741 -14.617 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.068 -3.336 -15.415 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -21.308 -3.579 -15.505 1.00 0.00 H new ATOM 793 N ALA A 53 -19.527 -1.524 -11.960 1.00 0.00 N ATOM 794 CA ALA A 53 -18.926 -1.153 -10.683 1.00 0.00 C ATOM 795 C ALA A 53 -17.543 -0.537 -10.883 1.00 0.00 C ATOM 796 O ALA A 53 -17.230 0.504 -10.306 1.00 0.00 O ATOM 797 CB ALA A 53 -18.814 -2.387 -9.782 1.00 0.00 C ATOM 0 H ALA A 53 -19.796 -2.504 -12.040 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.568 -0.410 -10.210 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.365 -2.103 -8.830 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.807 -2.800 -9.605 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -18.190 -3.137 -10.268 1.00 0.00 H new ATOM 803 N THR A 54 -16.719 -1.190 -11.693 1.00 0.00 N ATOM 804 CA THR A 54 -15.367 -0.703 -11.949 1.00 0.00 C ATOM 805 C THR A 54 -15.364 0.574 -12.790 1.00 0.00 C ATOM 806 O THR A 54 -14.709 1.554 -12.440 1.00 0.00 O ATOM 807 CB THR A 54 -14.557 -1.782 -12.664 1.00 0.00 C ATOM 808 OG1 THR A 54 -14.365 -2.880 -11.784 1.00 0.00 O ATOM 809 CG2 THR A 54 -13.200 -1.212 -13.076 1.00 0.00 C ATOM 0 H THR A 54 -16.960 -2.052 -12.182 1.00 0.00 H new ATOM 0 HA THR A 54 -14.916 -0.468 -10.985 1.00 0.00 H new ATOM 0 HB THR A 54 -15.092 -2.115 -13.553 1.00 0.00 H new ATOM 0 HG1 THR A 54 -15.077 -3.539 -11.922 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.622 -1.982 -13.586 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.349 -0.366 -13.747 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.660 -0.881 -12.189 1.00 0.00 H new ATOM 817 N LEU A 55 -16.073 0.555 -13.913 1.00 0.00 N ATOM 818 CA LEU A 55 -16.109 1.717 -14.794 1.00 0.00 C ATOM 819 C LEU A 55 -16.758 2.918 -14.105 1.00 0.00 C ATOM 820 O LEU A 55 -16.254 4.038 -14.195 1.00 0.00 O ATOM 821 CB LEU A 55 -16.865 1.374 -16.082 1.00 0.00 C ATOM 822 CG LEU A 55 -15.888 0.768 -17.095 1.00 0.00 C ATOM 823 CD1 LEU A 55 -15.040 -0.302 -16.408 1.00 0.00 C ATOM 824 CD2 LEU A 55 -16.667 0.130 -18.251 1.00 0.00 C ATOM 0 H LEU A 55 -16.624 -0.241 -14.233 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.082 1.987 -15.040 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -17.669 0.670 -15.869 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -17.327 2.270 -16.496 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.243 1.555 -17.484 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -14.345 -0.733 -17.128 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -14.480 0.148 -15.588 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -15.689 -1.085 -16.017 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -15.967 -0.299 -18.968 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -17.316 -0.655 -17.863 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -17.272 0.890 -18.745 1.00 0.00 H new ATOM 836 N LYS A 56 -17.874 2.684 -13.424 1.00 0.00 N ATOM 837 CA LYS A 56 -18.574 3.765 -12.735 1.00 0.00 C ATOM 838 C LYS A 56 -17.754 4.298 -11.561 1.00 0.00 C ATOM 839 O LYS A 56 -17.994 5.407 -11.083 1.00 0.00 O ATOM 840 CB LYS A 56 -19.927 3.266 -12.222 1.00 0.00 C ATOM 841 CG LYS A 56 -20.916 4.430 -12.181 1.00 0.00 C ATOM 842 CD LYS A 56 -21.339 4.786 -13.608 1.00 0.00 C ATOM 843 CE LYS A 56 -22.825 4.474 -13.795 1.00 0.00 C ATOM 844 NZ LYS A 56 -23.026 2.997 -13.803 1.00 0.00 N ATOM 0 H LYS A 56 -18.311 1.767 -13.334 1.00 0.00 H new ATOM 0 HA LYS A 56 -18.723 4.575 -13.449 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -20.305 2.476 -12.871 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -19.814 2.835 -11.227 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -21.789 4.159 -11.588 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -20.458 5.294 -11.699 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -21.152 5.842 -13.801 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -20.745 4.221 -14.326 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -23.406 4.926 -12.992 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -23.183 4.905 -14.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -24.018 2.783 -14.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -22.405 2.566 -14.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -22.795 2.610 -12.866 1.00 0.00 H new ATOM 858 N LYS A 57 -16.792 3.506 -11.095 1.00 0.00 N ATOM 859 CA LYS A 57 -15.956 3.921 -9.971 1.00 0.00 C ATOM 860 C LYS A 57 -15.512 5.374 -10.136 1.00 0.00 C ATOM 861 O LYS A 57 -15.618 6.169 -9.202 1.00 0.00 O ATOM 862 CB LYS A 57 -14.731 3.008 -9.858 1.00 0.00 C ATOM 863 CG LYS A 57 -14.388 2.755 -8.384 1.00 0.00 C ATOM 864 CD LYS A 57 -13.642 3.962 -7.815 1.00 0.00 C ATOM 865 CE LYS A 57 -13.091 3.612 -6.431 1.00 0.00 C ATOM 866 NZ LYS A 57 -12.326 2.336 -6.508 1.00 0.00 N ATOM 0 H LYS A 57 -16.573 2.584 -11.472 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.545 3.841 -9.057 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.928 2.061 -10.360 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.880 3.466 -10.363 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.300 2.577 -7.814 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -13.774 1.859 -8.292 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -12.828 4.248 -8.481 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.313 4.819 -7.746 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -12.446 4.414 -6.071 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -13.908 3.516 -5.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -11.659 2.282 -5.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -12.985 1.533 -6.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.799 2.301 -7.404 1.00 0.00 H new ATOM 880 N THR A 58 -15.020 5.722 -11.325 1.00 0.00 N ATOM 881 CA THR A 58 -14.575 7.088 -11.576 1.00 0.00 C ATOM 882 C THR A 58 -15.753 7.971 -11.978 1.00 0.00 C ATOM 883 O THR A 58 -15.644 9.197 -11.994 1.00 0.00 O ATOM 884 CB THR A 58 -13.521 7.101 -12.688 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.357 5.785 -13.197 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.188 7.604 -12.129 1.00 0.00 C ATOM 0 H THR A 58 -14.921 5.087 -12.117 1.00 0.00 H new ATOM 0 HA THR A 58 -14.138 7.481 -10.658 1.00 0.00 H new ATOM 0 HB THR A 58 -13.847 7.764 -13.489 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.259 5.821 -14.171 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.441 7.612 -12.922 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.315 8.614 -11.740 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.858 6.945 -11.326 1.00 0.00 H new ATOM 894 N GLY A 59 -16.883 7.343 -12.296 1.00 0.00 N ATOM 895 CA GLY A 59 -18.073 8.092 -12.688 1.00 0.00 C ATOM 896 C GLY A 59 -18.176 8.219 -14.205 1.00 0.00 C ATOM 897 O GLY A 59 -18.926 9.051 -14.716 1.00 0.00 O ATOM 0 H GLY A 59 -16.999 6.330 -12.290 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.962 7.594 -12.302 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.044 9.085 -12.239 1.00 0.00 H new ATOM 901 N ALA A 60 -17.418 7.395 -14.921 1.00 0.00 N ATOM 902 CA ALA A 60 -17.434 7.431 -16.379 1.00 0.00 C ATOM 903 C ALA A 60 -18.697 6.772 -16.924 1.00 0.00 C ATOM 904 O ALA A 60 -19.200 5.802 -16.354 1.00 0.00 O ATOM 905 CB ALA A 60 -16.204 6.711 -16.932 1.00 0.00 C ATOM 0 H ALA A 60 -16.790 6.699 -14.519 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.420 8.474 -16.695 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.223 6.742 -18.021 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.301 7.203 -16.571 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.209 5.673 -16.599 1.00 0.00 H new ATOM 911 N THR A 61 -19.205 7.305 -18.031 1.00 0.00 N ATOM 912 CA THR A 61 -20.411 6.763 -18.649 1.00 0.00 C ATOM 913 C THR A 61 -20.187 5.318 -19.086 1.00 0.00 C ATOM 914 O THR A 61 -19.178 5.000 -19.716 1.00 0.00 O ATOM 915 CB THR A 61 -20.798 7.613 -19.863 1.00 0.00 C ATOM 916 OG1 THR A 61 -20.829 8.983 -19.488 1.00 0.00 O ATOM 917 CG2 THR A 61 -22.177 7.189 -20.366 1.00 0.00 C ATOM 0 H THR A 61 -18.803 8.107 -18.516 1.00 0.00 H new ATOM 0 HA THR A 61 -21.217 6.786 -17.916 1.00 0.00 H new ATOM 0 HB THR A 61 -20.065 7.469 -20.657 1.00 0.00 H new ATOM 0 HG1 THR A 61 -21.075 9.529 -20.264 1.00 0.00 H new ATOM 0 HG21 THR A 61 -22.451 7.795 -21.230 1.00 0.00 H new ATOM 0 HG22 THR A 61 -22.152 6.138 -20.653 1.00 0.00 H new ATOM 0 HG23 THR A 61 -22.913 7.332 -19.575 1.00 0.00 H new ATOM 925 N VAL A 62 -21.134 4.447 -18.748 1.00 0.00 N ATOM 926 CA VAL A 62 -21.026 3.037 -19.111 1.00 0.00 C ATOM 927 C VAL A 62 -22.226 2.607 -19.949 1.00 0.00 C ATOM 928 O VAL A 62 -23.372 2.884 -19.597 1.00 0.00 O ATOM 929 CB VAL A 62 -20.949 2.173 -17.850 1.00 0.00 C ATOM 930 CG1 VAL A 62 -22.351 2.000 -17.265 1.00 0.00 C ATOM 931 CG2 VAL A 62 -20.373 0.796 -18.201 1.00 0.00 C ATOM 0 H VAL A 62 -21.977 4.689 -18.228 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.117 2.903 -19.698 1.00 0.00 H new ATOM 0 HB VAL A 62 -20.304 2.660 -17.119 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -22.297 1.385 -16.367 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -22.763 2.977 -17.011 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -22.994 1.515 -17.999 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -20.320 0.184 -17.301 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -21.016 0.309 -18.934 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.373 0.915 -18.618 1.00 0.00 H new ATOM 941 N SER A 63 -21.953 1.928 -21.058 1.00 0.00 N ATOM 942 CA SER A 63 -23.016 1.462 -21.940 1.00 0.00 C ATOM 943 C SER A 63 -22.765 0.019 -22.365 1.00 0.00 C ATOM 944 O SER A 63 -21.732 -0.292 -22.958 1.00 0.00 O ATOM 945 CB SER A 63 -23.091 2.355 -23.178 1.00 0.00 C ATOM 946 OG SER A 63 -23.682 1.627 -24.247 1.00 0.00 O ATOM 0 H SER A 63 -21.010 1.689 -21.366 1.00 0.00 H new ATOM 0 HA SER A 63 -23.961 1.509 -21.399 1.00 0.00 H new ATOM 0 HB2 SER A 63 -23.678 3.247 -22.962 1.00 0.00 H new ATOM 0 HB3 SER A 63 -22.093 2.691 -23.459 1.00 0.00 H new ATOM 0 HG SER A 63 -23.733 2.197 -25.042 1.00 0.00 H new ATOM 952 N TYR A 64 -23.716 -0.859 -22.058 1.00 0.00 N ATOM 953 CA TYR A 64 -23.586 -2.265 -22.413 1.00 0.00 C ATOM 954 C TYR A 64 -24.025 -2.488 -23.857 1.00 0.00 C ATOM 955 O TYR A 64 -25.054 -1.970 -24.290 1.00 0.00 O ATOM 956 CB TYR A 64 -24.429 -3.127 -21.461 1.00 0.00 C ATOM 957 CG TYR A 64 -25.743 -3.493 -22.113 1.00 0.00 C ATOM 958 CD1 TYR A 64 -25.815 -4.600 -22.966 1.00 0.00 C ATOM 959 CD2 TYR A 64 -26.888 -2.724 -21.867 1.00 0.00 C ATOM 960 CE1 TYR A 64 -27.028 -4.940 -23.573 1.00 0.00 C ATOM 961 CE2 TYR A 64 -28.103 -3.065 -22.474 1.00 0.00 C ATOM 962 CZ TYR A 64 -28.173 -4.172 -23.328 1.00 0.00 C ATOM 963 OH TYR A 64 -29.369 -4.508 -23.927 1.00 0.00 O ATOM 0 H TYR A 64 -24.578 -0.622 -21.568 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.540 -2.557 -22.319 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -23.881 -4.032 -21.197 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -24.613 -2.584 -20.534 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -24.932 -5.193 -23.156 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -26.834 -1.869 -21.210 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -27.082 -5.795 -24.231 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -28.986 -2.474 -22.283 1.00 0.00 H new ATOM 0 HH TYR A 64 -30.063 -3.874 -23.650 1.00 0.00 H new ATOM 973 N LEU A 65 -23.237 -3.257 -24.595 1.00 0.00 N ATOM 974 CA LEU A 65 -23.552 -3.540 -25.991 1.00 0.00 C ATOM 975 C LEU A 65 -24.211 -4.909 -26.128 1.00 0.00 C ATOM 976 O LEU A 65 -25.155 -5.078 -26.900 1.00 0.00 O ATOM 977 CB LEU A 65 -22.276 -3.498 -26.834 1.00 0.00 C ATOM 978 CG LEU A 65 -21.792 -2.052 -26.951 1.00 0.00 C ATOM 979 CD1 LEU A 65 -20.263 -2.027 -27.013 1.00 0.00 C ATOM 980 CD2 LEU A 65 -22.364 -1.425 -28.225 1.00 0.00 C ATOM 0 H LEU A 65 -22.380 -3.694 -24.255 1.00 0.00 H new ATOM 0 HA LEU A 65 -24.247 -2.780 -26.347 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -21.504 -4.116 -26.376 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -22.468 -3.910 -27.825 1.00 0.00 H new ATOM 0 HG LEU A 65 -22.129 -1.485 -26.083 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -19.919 -0.996 -27.096 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -19.855 -2.474 -26.106 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -19.925 -2.594 -27.881 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -22.020 -0.394 -28.309 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -22.027 -1.992 -29.093 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -23.453 -1.441 -28.181 1.00 0.00 H new ATOM 992 N GLY A 66 -23.707 -5.881 -25.375 1.00 0.00 N ATOM 993 CA GLY A 66 -24.256 -7.231 -25.422 1.00 0.00 C ATOM 994 C GLY A 66 -23.156 -8.258 -25.668 1.00 0.00 C ATOM 995 O GLY A 66 -21.975 -7.916 -25.724 1.00 0.00 O ATOM 0 H GLY A 66 -22.926 -5.761 -24.730 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -24.764 -7.454 -24.484 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -25.004 -7.297 -26.213 1.00 0.00 H new ATOM 999 N LEU A 67 -23.552 -9.519 -25.814 1.00 0.00 N ATOM 1000 CA LEU A 67 -22.590 -10.589 -26.052 1.00 0.00 C ATOM 1001 C LEU A 67 -22.513 -10.922 -27.540 1.00 0.00 C ATOM 1002 O LEU A 67 -23.482 -10.742 -28.279 1.00 0.00 O ATOM 1003 CB LEU A 67 -22.996 -11.838 -25.270 1.00 0.00 C ATOM 1004 CG LEU A 67 -22.636 -11.657 -23.793 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -23.828 -12.064 -22.924 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -21.432 -12.538 -23.449 1.00 0.00 C ATOM 0 H LEU A 67 -24.525 -9.823 -25.772 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.610 -10.251 -25.716 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.067 -12.013 -25.375 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -22.488 -12.714 -25.674 1.00 0.00 H new ATOM 0 HG LEU A 67 -22.388 -10.612 -23.606 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -23.572 -11.935 -21.872 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -24.687 -11.438 -23.168 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -24.075 -13.109 -23.112 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -21.176 -12.409 -22.397 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -21.680 -13.583 -23.637 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -20.582 -12.250 -24.068 1.00 0.00 H new ATOM 1018 N GLU A 68 -21.354 -11.409 -27.972 1.00 0.00 N ATOM 1019 CA GLU A 68 -21.162 -11.767 -29.373 1.00 0.00 C ATOM 1020 C GLU A 68 -21.490 -13.238 -29.600 1.00 0.00 C ATOM 1021 O GLU A 68 -22.279 -13.518 -30.487 1.00 0.00 O ATOM 1022 CB GLU A 68 -19.713 -11.495 -29.787 1.00 0.00 C ATOM 1023 CG GLU A 68 -19.531 -11.847 -31.263 1.00 0.00 C ATOM 1024 CD GLU A 68 -18.332 -11.097 -31.833 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -17.260 -11.210 -31.260 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -18.503 -10.420 -32.834 1.00 0.00 O ATOM 1027 OXT GLU A 68 -20.946 -14.063 -28.883 1.00 0.00 O ATOM 0 H GLU A 68 -20.540 -11.564 -27.378 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.834 -11.159 -29.979 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -19.466 -10.447 -29.619 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -19.031 -12.085 -29.174 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -19.385 -12.921 -31.374 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -20.431 -11.589 -31.821 1.00 0.00 H new TER 1034 GLU A 68