USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 771 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 16 TYR OH : rot 19:sc= 0.464 USER MOD Set 1.2: A 80 THR OG1 : rot 37:sc= 1.74 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 149:sc= -1.56 (180deg=-4.03!) USER MOD Single : A 20 ASN : amide:sc= -0.265 K(o=-0.26,f=-1.5!) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.079 USER MOD Single : A 29 CYS SG : rot -170:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -158:sc= -0.22 (180deg=-1.41!) USER MOD Single : A 36 GLN :FLIP amide:sc= -2.25 F(o=-4.1,f=-2.2) USER MOD Single : A 40 ASN : amide:sc= -0.093 K(o=-0.093,f=-1.1!) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.845 F(o=-2,f=-0.84) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.335) USER MOD Single : A 49 MET CE :methyl -134:sc= -3.77! (180deg=-9.15!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0032) USER MOD Single : A 56 THR OG1 : rot 165:sc= -0.652 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 HIS : no HD1:sc= -2.15! X(o=-2.1!,f=-2.2) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -0.228 K(o=-0.23,f=-4.8!) USER MOD Single : A 74 ASN : amide:sc= -5.52! C(o=-5.5!,f=-10!) USER MOD Single : A 75 SER OG : rot 44:sc= 0.352 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 42:sc= 1 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -4.44! C(o=-4.4!,f=-6.3!) USER MOD Single : A 96 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN :FLIP amide:sc= -1.51! C(o=-2.5!,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.831 0.039 19.758 1.00 0.00 N ATOM 2 CA GLY A 1 -4.044 -0.240 20.945 1.00 0.00 C ATOM 3 C GLY A 1 -2.768 0.576 20.999 1.00 0.00 C ATOM 4 O GLY A 1 -1.810 0.292 20.280 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.693 -0.543 19.768 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.093 1.045 19.744 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.272 -0.185 18.910 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.643 -0.031 21.832 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.795 -1.301 20.971 1.00 0.00 H new ATOM 8 N SER A 2 -2.755 1.595 21.852 1.00 0.00 N ATOM 9 CA SER A 2 -1.589 2.459 21.993 1.00 0.00 C ATOM 10 C SER A 2 -0.582 1.858 22.969 1.00 0.00 C ATOM 11 O SER A 2 0.608 1.763 22.671 1.00 0.00 O ATOM 12 CB SER A 2 -2.012 3.850 22.471 1.00 0.00 C ATOM 13 OG SER A 2 -0.890 4.702 22.618 1.00 0.00 O ATOM 0 H SER A 2 -3.539 1.843 22.456 1.00 0.00 H new ATOM 0 HA SER A 2 -1.114 2.548 21.016 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.712 4.285 21.758 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.537 3.767 23.423 1.00 0.00 H new ATOM 0 HG SER A 2 -1.187 5.585 22.923 1.00 0.00 H new ATOM 19 N SER A 3 -1.070 1.454 24.138 1.00 0.00 N ATOM 20 CA SER A 3 -0.214 0.866 25.161 1.00 0.00 C ATOM 21 C SER A 3 0.375 -0.458 24.682 1.00 0.00 C ATOM 22 O SER A 3 -0.199 -1.523 24.906 1.00 0.00 O ATOM 23 CB SER A 3 -1.003 0.647 26.453 1.00 0.00 C ATOM 24 OG SER A 3 -1.488 1.875 26.969 1.00 0.00 O ATOM 0 H SER A 3 -2.053 1.523 24.400 1.00 0.00 H new ATOM 0 HA SER A 3 0.604 1.559 25.356 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.839 -0.026 26.263 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.366 0.164 27.194 1.00 0.00 H new ATOM 0 HG SER A 3 -1.990 1.708 27.794 1.00 0.00 H new ATOM 30 N GLY A 4 1.526 -0.381 24.019 1.00 0.00 N ATOM 31 CA GLY A 4 2.174 -1.579 23.518 1.00 0.00 C ATOM 32 C GLY A 4 3.355 -1.999 24.370 1.00 0.00 C ATOM 33 O GLY A 4 4.137 -1.159 24.816 1.00 0.00 O ATOM 0 H GLY A 4 2.020 0.489 23.820 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.449 -2.392 23.481 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.511 -1.406 22.496 1.00 0.00 H new ATOM 37 N SER A 5 3.484 -3.302 24.598 1.00 0.00 N ATOM 38 CA SER A 5 4.575 -3.832 25.407 1.00 0.00 C ATOM 39 C SER A 5 5.591 -4.565 24.537 1.00 0.00 C ATOM 40 O SER A 5 6.794 -4.320 24.627 1.00 0.00 O ATOM 41 CB SER A 5 4.030 -4.776 26.480 1.00 0.00 C ATOM 42 OG SER A 5 3.331 -4.060 27.483 1.00 0.00 O ATOM 0 H SER A 5 2.846 -4.010 24.234 1.00 0.00 H new ATOM 0 HA SER A 5 5.076 -2.993 25.891 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.365 -5.508 26.021 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.852 -5.331 26.932 1.00 0.00 H new ATOM 0 HG SER A 5 2.991 -4.687 28.156 1.00 0.00 H new ATOM 48 N SER A 6 5.097 -5.466 23.694 1.00 0.00 N ATOM 49 CA SER A 6 5.961 -6.239 22.809 1.00 0.00 C ATOM 50 C SER A 6 5.543 -6.063 21.352 1.00 0.00 C ATOM 51 O SER A 6 4.628 -6.730 20.872 1.00 0.00 O ATOM 52 CB SER A 6 5.920 -7.721 23.187 1.00 0.00 C ATOM 53 OG SER A 6 6.884 -8.020 24.182 1.00 0.00 O ATOM 0 H SER A 6 4.103 -5.679 23.605 1.00 0.00 H new ATOM 0 HA SER A 6 6.980 -5.870 22.924 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.925 -7.980 23.550 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.105 -8.331 22.302 1.00 0.00 H new ATOM 0 HG SER A 6 6.837 -8.973 24.408 1.00 0.00 H new ATOM 59 N GLY A 7 6.222 -5.158 20.653 1.00 0.00 N ATOM 60 CA GLY A 7 5.908 -4.909 19.258 1.00 0.00 C ATOM 61 C GLY A 7 7.149 -4.768 18.400 1.00 0.00 C ATOM 62 O GLY A 7 8.237 -4.501 18.911 1.00 0.00 O ATOM 0 H GLY A 7 6.984 -4.593 21.028 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.296 -5.726 18.875 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.311 -4.000 19.180 1.00 0.00 H new ATOM 66 N ARG A 8 6.987 -4.949 17.094 1.00 0.00 N ATOM 67 CA ARG A 8 8.105 -4.842 16.164 1.00 0.00 C ATOM 68 C ARG A 8 7.680 -4.133 14.881 1.00 0.00 C ATOM 69 O ARG A 8 6.586 -4.363 14.367 1.00 0.00 O ATOM 70 CB ARG A 8 8.655 -6.231 15.832 1.00 0.00 C ATOM 71 CG ARG A 8 7.618 -7.171 15.239 1.00 0.00 C ATOM 72 CD ARG A 8 8.188 -8.563 15.019 1.00 0.00 C ATOM 73 NE ARG A 8 8.204 -9.349 16.250 1.00 0.00 N ATOM 74 CZ ARG A 8 8.377 -10.665 16.279 1.00 0.00 C ATOM 75 NH1 ARG A 8 8.549 -11.340 15.151 1.00 0.00 N ATOM 76 NH2 ARG A 8 8.379 -11.310 17.439 1.00 0.00 N ATOM 0 H ARG A 8 6.093 -5.170 16.656 1.00 0.00 H new ATOM 0 HA ARG A 8 8.887 -4.253 16.643 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.482 -6.127 15.130 1.00 0.00 H new ATOM 0 HB3 ARG A 8 9.062 -6.678 16.739 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.757 -7.230 15.904 1.00 0.00 H new ATOM 0 HG3 ARG A 8 7.261 -6.769 14.291 1.00 0.00 H new ATOM 0 HD2 ARG A 8 7.596 -9.082 14.265 1.00 0.00 H new ATOM 0 HD3 ARG A 8 9.202 -8.482 14.628 1.00 0.00 H new ATOM 0 HE ARG A 8 8.075 -8.860 17.136 1.00 0.00 H new ATOM 0 HH11 ARG A 8 8.549 -10.848 14.257 1.00 0.00 H new ATOM 0 HH12 ARG A 8 8.682 -12.351 15.177 1.00 0.00 H new ATOM 0 HH21 ARG A 8 8.248 -10.795 18.309 1.00 0.00 H new ATOM 0 HH22 ARG A 8 8.512 -12.321 17.460 1.00 0.00 H new ATOM 90 N MET A 9 8.552 -3.269 14.372 1.00 0.00 N ATOM 91 CA MET A 9 8.266 -2.526 13.150 1.00 0.00 C ATOM 92 C MET A 9 8.526 -3.387 11.918 1.00 0.00 C ATOM 93 O MET A 9 9.504 -4.134 11.865 1.00 0.00 O ATOM 94 CB MET A 9 9.118 -1.257 13.089 1.00 0.00 C ATOM 95 CG MET A 9 8.970 -0.366 14.311 1.00 0.00 C ATOM 96 SD MET A 9 7.618 0.817 14.149 1.00 0.00 S ATOM 97 CE MET A 9 6.200 -0.269 14.282 1.00 0.00 C ATOM 0 H MET A 9 9.462 -3.066 14.786 1.00 0.00 H new ATOM 0 HA MET A 9 7.212 -2.247 13.161 1.00 0.00 H new ATOM 0 HB2 MET A 9 10.166 -1.538 12.979 1.00 0.00 H new ATOM 0 HB3 MET A 9 8.845 -0.689 12.200 1.00 0.00 H new ATOM 0 HG2 MET A 9 8.800 -0.987 15.190 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.902 0.174 14.477 1.00 0.00 H new ATOM 0 HE1 MET A 9 5.371 0.270 14.741 1.00 0.00 H new ATOM 0 HE2 MET A 9 5.907 -0.608 13.288 1.00 0.00 H new ATOM 0 HE3 MET A 9 6.458 -1.130 14.898 1.00 0.00 H new ATOM 107 N LEU A 10 7.646 -3.278 10.929 1.00 0.00 N ATOM 108 CA LEU A 10 7.781 -4.046 9.696 1.00 0.00 C ATOM 109 C LEU A 10 8.079 -3.131 8.513 1.00 0.00 C ATOM 110 O LEU A 10 7.252 -2.301 8.134 1.00 0.00 O ATOM 111 CB LEU A 10 6.504 -4.845 9.429 1.00 0.00 C ATOM 112 CG LEU A 10 6.130 -5.887 10.484 1.00 0.00 C ATOM 113 CD1 LEU A 10 4.733 -6.429 10.227 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.148 -7.018 10.502 1.00 0.00 C ATOM 0 H LEU A 10 6.831 -2.665 10.957 1.00 0.00 H new ATOM 0 HA LEU A 10 8.616 -4.736 9.816 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.675 -4.144 9.330 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.610 -5.351 8.469 1.00 0.00 H new ATOM 0 HG LEU A 10 6.136 -5.404 11.461 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.484 -7.169 10.988 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.013 -5.612 10.267 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.699 -6.895 9.242 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.865 -7.750 11.259 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.175 -7.499 9.524 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.134 -6.616 10.736 1.00 0.00 H new ATOM 126 N ASP A 11 9.263 -3.290 7.933 1.00 0.00 N ATOM 127 CA ASP A 11 9.669 -2.480 6.790 1.00 0.00 C ATOM 128 C ASP A 11 9.041 -3.003 5.503 1.00 0.00 C ATOM 129 O ASP A 11 9.544 -3.946 4.892 1.00 0.00 O ATOM 130 CB ASP A 11 11.193 -2.470 6.661 1.00 0.00 C ATOM 131 CG ASP A 11 11.676 -1.526 5.578 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.380 -1.782 4.393 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.352 -0.531 5.916 1.00 0.00 O ATOM 0 H ASP A 11 9.959 -3.972 8.235 1.00 0.00 H new ATOM 0 HA ASP A 11 9.319 -1.461 6.956 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.634 -2.180 7.615 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.543 -3.479 6.442 1.00 0.00 H new ATOM 138 N PHE A 12 7.937 -2.385 5.095 1.00 0.00 N ATOM 139 CA PHE A 12 7.238 -2.789 3.881 1.00 0.00 C ATOM 140 C PHE A 12 7.649 -1.914 2.700 1.00 0.00 C ATOM 141 O PHE A 12 7.236 -0.759 2.597 1.00 0.00 O ATOM 142 CB PHE A 12 5.724 -2.709 4.088 1.00 0.00 C ATOM 143 CG PHE A 12 5.179 -3.803 4.961 1.00 0.00 C ATOM 144 CD1 PHE A 12 4.982 -5.077 4.454 1.00 0.00 C ATOM 145 CD2 PHE A 12 4.864 -3.557 6.287 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.481 -6.087 5.254 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.364 -4.563 7.093 1.00 0.00 C ATOM 148 CZ PHE A 12 4.171 -5.829 6.575 1.00 0.00 C ATOM 0 H PHE A 12 7.507 -1.602 5.588 1.00 0.00 H new ATOM 0 HA PHE A 12 7.513 -3.820 3.659 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.477 -1.744 4.531 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.230 -2.750 3.117 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.223 -5.284 3.422 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.011 -2.568 6.696 1.00 0.00 H new ATOM 0 HE1 PHE A 12 4.332 -7.076 4.847 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.125 -4.359 8.126 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.778 -6.616 7.202 1.00 0.00 H new ATOM 158 N ARG A 13 8.464 -2.474 1.812 1.00 0.00 N ATOM 159 CA ARG A 13 8.932 -1.745 0.640 1.00 0.00 C ATOM 160 C ARG A 13 7.911 -1.821 -0.492 1.00 0.00 C ATOM 161 O ARG A 13 7.768 -2.855 -1.145 1.00 0.00 O ATOM 162 CB ARG A 13 10.275 -2.306 0.167 1.00 0.00 C ATOM 163 CG ARG A 13 10.906 -1.505 -0.961 1.00 0.00 C ATOM 164 CD ARG A 13 11.603 -0.259 -0.437 1.00 0.00 C ATOM 165 NE ARG A 13 12.770 -0.586 0.377 1.00 0.00 N ATOM 166 CZ ARG A 13 13.674 0.309 0.759 1.00 0.00 C ATOM 167 NH1 ARG A 13 13.545 1.580 0.402 1.00 0.00 N ATOM 168 NH2 ARG A 13 14.709 -0.066 1.500 1.00 0.00 N ATOM 0 H ARG A 13 8.814 -3.430 1.882 1.00 0.00 H new ATOM 0 HA ARG A 13 9.060 -0.700 0.921 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.965 -2.335 1.011 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.133 -3.335 -0.164 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.624 -2.128 -1.494 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.138 -1.219 -1.679 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.910 0.365 -1.277 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.901 0.327 0.155 1.00 0.00 H new ATOM 0 HE ARG A 13 12.898 -1.555 0.668 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.750 1.872 -0.167 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.240 2.266 0.697 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.811 -1.042 1.777 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.403 0.622 1.793 1.00 0.00 H new ATOM 182 N VAL A 14 7.202 -0.719 -0.717 1.00 0.00 N ATOM 183 CA VAL A 14 6.194 -0.661 -1.768 1.00 0.00 C ATOM 184 C VAL A 14 6.795 -0.166 -3.079 1.00 0.00 C ATOM 185 O VAL A 14 7.030 1.029 -3.253 1.00 0.00 O ATOM 186 CB VAL A 14 5.024 0.260 -1.374 1.00 0.00 C ATOM 187 CG1 VAL A 14 4.008 0.347 -2.503 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.368 -0.232 -0.092 1.00 0.00 C ATOM 0 H VAL A 14 7.307 0.145 -0.185 1.00 0.00 H new ATOM 0 HA VAL A 14 5.819 -1.676 -1.903 1.00 0.00 H new ATOM 0 HB VAL A 14 5.417 1.261 -1.194 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.189 1.002 -2.206 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.489 0.749 -3.395 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.617 -0.648 -2.718 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.543 0.430 0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.988 -1.243 -0.242 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.102 -0.236 0.714 1.00 0.00 H new ATOM 198 N GLU A 15 7.042 -1.095 -3.998 1.00 0.00 N ATOM 199 CA GLU A 15 7.617 -0.752 -5.294 1.00 0.00 C ATOM 200 C GLU A 15 6.534 -0.292 -6.265 1.00 0.00 C ATOM 201 O GLU A 15 5.780 -1.104 -6.802 1.00 0.00 O ATOM 202 CB GLU A 15 8.365 -1.953 -5.878 1.00 0.00 C ATOM 203 CG GLU A 15 9.179 -1.618 -7.117 1.00 0.00 C ATOM 204 CD GLU A 15 9.350 -2.808 -8.041 1.00 0.00 C ATOM 205 OE1 GLU A 15 8.430 -3.075 -8.842 1.00 0.00 O ATOM 206 OE2 GLU A 15 10.405 -3.473 -7.962 1.00 0.00 O ATOM 0 H GLU A 15 6.853 -2.089 -3.869 1.00 0.00 H new ATOM 0 HA GLU A 15 8.320 0.068 -5.146 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.029 -2.362 -5.117 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.645 -2.733 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.691 -0.808 -7.660 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.161 -1.253 -6.815 1.00 0.00 H new ATOM 213 N TYR A 16 6.462 1.016 -6.485 1.00 0.00 N ATOM 214 CA TYR A 16 5.470 1.586 -7.389 1.00 0.00 C ATOM 215 C TYR A 16 6.143 2.340 -8.532 1.00 0.00 C ATOM 216 O TYR A 16 7.258 2.842 -8.387 1.00 0.00 O ATOM 217 CB TYR A 16 4.534 2.525 -6.626 1.00 0.00 C ATOM 218 CG TYR A 16 3.395 3.058 -7.465 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.768 2.256 -8.411 1.00 0.00 C ATOM 220 CD2 TYR A 16 2.944 4.363 -7.311 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.728 2.740 -9.181 1.00 0.00 C ATOM 222 CE2 TYR A 16 1.904 4.855 -8.075 1.00 0.00 C ATOM 223 CZ TYR A 16 1.299 4.039 -9.009 1.00 0.00 C ATOM 224 OH TYR A 16 0.262 4.524 -9.773 1.00 0.00 O ATOM 0 H TYR A 16 7.079 1.702 -6.050 1.00 0.00 H new ATOM 0 HA TYR A 16 4.888 0.767 -7.811 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.124 1.996 -5.766 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.112 3.364 -6.238 1.00 0.00 H new ATOM 0 HD1 TYR A 16 3.099 1.237 -8.547 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.415 5.004 -6.581 1.00 0.00 H new ATOM 0 HE1 TYR A 16 1.254 2.104 -9.914 1.00 0.00 H new ATOM 0 HE2 TYR A 16 1.566 5.872 -7.942 1.00 0.00 H new ATOM 0 HH TYR A 16 -0.247 3.775 -10.147 1.00 0.00 H new ATOM 234 N ARG A 17 5.458 2.414 -9.668 1.00 0.00 N ATOM 235 CA ARG A 17 5.988 3.105 -10.837 1.00 0.00 C ATOM 236 C ARG A 17 6.847 4.296 -10.421 1.00 0.00 C ATOM 237 O ARG A 17 8.074 4.246 -10.497 1.00 0.00 O ATOM 238 CB ARG A 17 4.846 3.576 -11.739 1.00 0.00 C ATOM 239 CG ARG A 17 4.043 2.439 -12.349 1.00 0.00 C ATOM 240 CD ARG A 17 2.647 2.893 -12.745 1.00 0.00 C ATOM 241 NE ARG A 17 2.021 1.975 -13.693 1.00 0.00 N ATOM 242 CZ ARG A 17 2.343 1.915 -14.981 1.00 0.00 C ATOM 243 NH1 ARG A 17 3.278 2.717 -15.471 1.00 0.00 N ATOM 244 NH2 ARG A 17 1.729 1.053 -15.780 1.00 0.00 N ATOM 0 H ARG A 17 4.534 2.004 -9.804 1.00 0.00 H new ATOM 0 HA ARG A 17 6.613 2.404 -11.390 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.177 4.213 -11.161 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.257 4.190 -12.540 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.564 2.054 -13.226 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.971 1.619 -11.635 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.025 2.973 -11.853 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.701 3.888 -13.186 1.00 0.00 H new ATOM 0 HE ARG A 17 1.297 1.345 -13.347 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.752 3.382 -14.859 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.524 2.669 -16.460 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.009 0.435 -15.406 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.977 1.008 -16.768 1.00 0.00 H new ATOM 258 N ASP A 18 6.192 5.365 -9.981 1.00 0.00 N ATOM 259 CA ASP A 18 6.895 6.569 -9.552 1.00 0.00 C ATOM 260 C ASP A 18 8.211 6.215 -8.867 1.00 0.00 C ATOM 261 O ASP A 18 9.282 6.639 -9.301 1.00 0.00 O ATOM 262 CB ASP A 18 6.017 7.388 -8.605 1.00 0.00 C ATOM 263 CG ASP A 18 5.518 6.573 -7.428 1.00 0.00 C ATOM 264 OD1 ASP A 18 5.339 5.348 -7.588 1.00 0.00 O ATOM 265 OD2 ASP A 18 5.307 7.161 -6.347 1.00 0.00 O ATOM 0 H ASP A 18 5.176 5.423 -9.912 1.00 0.00 H new ATOM 0 HA ASP A 18 7.116 7.166 -10.437 1.00 0.00 H new ATOM 0 HB2 ASP A 18 6.584 8.243 -8.237 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.164 7.784 -9.156 1.00 0.00 H new ATOM 270 N ARG A 19 8.123 5.436 -7.793 1.00 0.00 N ATOM 271 CA ARG A 19 9.306 5.027 -7.046 1.00 0.00 C ATOM 272 C ARG A 19 8.941 4.023 -5.957 1.00 0.00 C ATOM 273 O ARG A 19 7.784 3.626 -5.828 1.00 0.00 O ATOM 274 CB ARG A 19 9.988 6.246 -6.423 1.00 0.00 C ATOM 275 CG ARG A 19 9.119 6.982 -5.416 1.00 0.00 C ATOM 276 CD ARG A 19 9.960 7.667 -4.350 1.00 0.00 C ATOM 277 NE ARG A 19 9.289 8.839 -3.793 1.00 0.00 N ATOM 278 CZ ARG A 19 9.911 9.773 -3.082 1.00 0.00 C ATOM 279 NH1 ARG A 19 11.212 9.673 -2.844 1.00 0.00 N ATOM 280 NH2 ARG A 19 9.232 10.810 -2.609 1.00 0.00 N ATOM 0 H ARG A 19 7.244 5.076 -7.421 1.00 0.00 H new ATOM 0 HA ARG A 19 9.996 4.548 -7.741 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.907 5.926 -5.932 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.274 6.936 -7.216 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.510 7.724 -5.933 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.433 6.279 -4.944 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.178 6.959 -3.550 1.00 0.00 H new ATOM 0 HD3 ARG A 19 10.916 7.967 -4.779 1.00 0.00 H new ATOM 0 HE ARG A 19 8.288 8.946 -3.959 1.00 0.00 H new ATOM 0 HH11 ARG A 19 11.737 8.878 -3.207 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.687 10.391 -2.298 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.232 10.891 -2.791 1.00 0.00 H new ATOM 0 HH22 ARG A 19 9.710 11.527 -2.063 1.00 0.00 H new ATOM 294 N ASN A 20 9.937 3.615 -5.177 1.00 0.00 N ATOM 295 CA ASN A 20 9.722 2.656 -4.100 1.00 0.00 C ATOM 296 C ASN A 20 9.775 3.345 -2.740 1.00 0.00 C ATOM 297 O ASN A 20 10.808 3.887 -2.347 1.00 0.00 O ATOM 298 CB ASN A 20 10.770 1.543 -4.163 1.00 0.00 C ATOM 299 CG ASN A 20 11.243 1.273 -5.578 1.00 0.00 C ATOM 300 OD1 ASN A 20 10.467 1.358 -6.530 1.00 0.00 O ATOM 301 ND2 ASN A 20 12.522 0.946 -5.722 1.00 0.00 N ATOM 0 H ASN A 20 10.901 3.934 -5.271 1.00 0.00 H new ATOM 0 HA ASN A 20 8.731 2.220 -4.228 1.00 0.00 H new ATOM 0 HB2 ASN A 20 11.624 1.817 -3.543 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.351 0.629 -3.742 1.00 0.00 H new ATOM 0 HD21 ASN A 20 12.898 0.753 -6.650 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.129 0.888 -4.904 1.00 0.00 H new ATOM 308 N VAL A 21 8.655 3.318 -2.025 1.00 0.00 N ATOM 309 CA VAL A 21 8.574 3.938 -0.707 1.00 0.00 C ATOM 310 C VAL A 21 8.570 2.886 0.396 1.00 0.00 C ATOM 311 O VAL A 21 8.081 1.772 0.204 1.00 0.00 O ATOM 312 CB VAL A 21 7.312 4.810 -0.574 1.00 0.00 C ATOM 313 CG1 VAL A 21 6.070 3.939 -0.460 1.00 0.00 C ATOM 314 CG2 VAL A 21 7.432 5.741 0.623 1.00 0.00 C ATOM 0 H VAL A 21 7.791 2.874 -2.336 1.00 0.00 H new ATOM 0 HA VAL A 21 9.456 4.569 -0.599 1.00 0.00 H new ATOM 0 HB VAL A 21 7.217 5.420 -1.472 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.188 4.573 -0.367 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.978 3.318 -1.351 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.153 3.301 0.420 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.531 6.350 0.702 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.552 5.151 1.532 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.298 6.390 0.494 1.00 0.00 H new ATOM 324 N ASP A 22 9.117 3.246 1.551 1.00 0.00 N ATOM 325 CA ASP A 22 9.175 2.333 2.687 1.00 0.00 C ATOM 326 C ASP A 22 8.078 2.652 3.698 1.00 0.00 C ATOM 327 O ASP A 22 7.824 3.816 4.007 1.00 0.00 O ATOM 328 CB ASP A 22 10.546 2.412 3.362 1.00 0.00 C ATOM 329 CG ASP A 22 10.564 1.730 4.716 1.00 0.00 C ATOM 330 OD1 ASP A 22 10.030 0.607 4.823 1.00 0.00 O ATOM 331 OD2 ASP A 22 11.114 2.321 5.670 1.00 0.00 O ATOM 0 H ASP A 22 9.527 4.164 1.726 1.00 0.00 H new ATOM 0 HA ASP A 22 9.018 1.320 2.316 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.293 1.951 2.716 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.830 3.458 3.481 1.00 0.00 H new ATOM 336 N VAL A 23 7.429 1.610 4.208 1.00 0.00 N ATOM 337 CA VAL A 23 6.359 1.779 5.183 1.00 0.00 C ATOM 338 C VAL A 23 6.683 1.057 6.486 1.00 0.00 C ATOM 339 O VAL A 23 7.164 -0.076 6.477 1.00 0.00 O ATOM 340 CB VAL A 23 5.016 1.255 4.639 1.00 0.00 C ATOM 341 CG1 VAL A 23 3.915 1.431 5.674 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.656 1.961 3.341 1.00 0.00 C ATOM 0 H VAL A 23 7.626 0.640 3.962 1.00 0.00 H new ATOM 0 HA VAL A 23 6.273 2.848 5.375 1.00 0.00 H new ATOM 0 HB VAL A 23 5.119 0.190 4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 23 2.974 1.055 5.272 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.172 0.876 6.576 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.809 2.488 5.917 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.705 1.579 2.971 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.571 3.033 3.521 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.434 1.778 2.600 1.00 0.00 H new ATOM 352 N VAL A 24 6.417 1.721 7.606 1.00 0.00 N ATOM 353 CA VAL A 24 6.679 1.142 8.919 1.00 0.00 C ATOM 354 C VAL A 24 5.426 1.161 9.788 1.00 0.00 C ATOM 355 O VAL A 24 4.939 2.226 10.171 1.00 0.00 O ATOM 356 CB VAL A 24 7.808 1.894 9.648 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.771 1.597 11.140 1.00 0.00 C ATOM 358 CG2 VAL A 24 9.161 1.526 9.057 1.00 0.00 C ATOM 0 H VAL A 24 6.020 2.660 7.631 1.00 0.00 H new ATOM 0 HA VAL A 24 6.987 0.110 8.754 1.00 0.00 H new ATOM 0 HB VAL A 24 7.656 2.965 9.511 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.576 2.137 11.639 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.812 1.914 11.551 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.898 0.526 11.301 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.947 2.066 9.584 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.324 0.453 9.162 1.00 0.00 H new ATOM 0 HG23 VAL A 24 9.182 1.794 8.001 1.00 0.00 H new ATOM 368 N LEU A 25 4.909 -0.023 10.096 1.00 0.00 N ATOM 369 CA LEU A 25 3.713 -0.143 10.922 1.00 0.00 C ATOM 370 C LEU A 25 3.729 -1.444 11.718 1.00 0.00 C ATOM 371 O LEU A 25 4.134 -2.489 11.209 1.00 0.00 O ATOM 372 CB LEU A 25 2.458 -0.082 10.049 1.00 0.00 C ATOM 373 CG LEU A 25 2.097 -1.367 9.303 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.723 -1.244 8.662 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.150 -1.688 8.252 1.00 0.00 C ATOM 0 H LEU A 25 5.299 -0.913 9.786 1.00 0.00 H new ATOM 0 HA LEU A 25 3.701 0.691 11.624 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.614 0.198 10.680 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.587 0.715 9.317 1.00 0.00 H new ATOM 0 HG LEU A 25 2.069 -2.186 10.022 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.483 -2.168 8.136 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.024 -1.062 9.435 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.724 -0.414 7.956 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.876 -2.606 7.731 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.211 -0.869 7.536 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.118 -1.820 8.735 1.00 0.00 H new ATOM 387 N GLU A 26 3.284 -1.373 12.969 1.00 0.00 N ATOM 388 CA GLU A 26 3.247 -2.546 13.834 1.00 0.00 C ATOM 389 C GLU A 26 2.424 -3.664 13.200 1.00 0.00 C ATOM 390 O GLU A 26 1.583 -3.416 12.335 1.00 0.00 O ATOM 391 CB GLU A 26 2.663 -2.181 15.201 1.00 0.00 C ATOM 392 CG GLU A 26 3.132 -3.089 16.325 1.00 0.00 C ATOM 393 CD GLU A 26 2.531 -2.715 17.666 1.00 0.00 C ATOM 394 OE1 GLU A 26 2.369 -1.504 17.926 1.00 0.00 O ATOM 395 OE2 GLU A 26 2.224 -3.632 18.455 1.00 0.00 O ATOM 0 H GLU A 26 2.944 -0.516 13.405 1.00 0.00 H new ATOM 0 HA GLU A 26 4.269 -2.900 13.966 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.934 -1.152 15.439 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.575 -2.220 15.144 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.869 -4.120 16.088 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.219 -3.045 16.393 1.00 0.00 H new ATOM 402 N ASP A 27 2.673 -4.893 13.635 1.00 0.00 N ATOM 403 CA ASP A 27 1.956 -6.050 13.111 1.00 0.00 C ATOM 404 C ASP A 27 0.501 -6.040 13.568 1.00 0.00 C ATOM 405 O ASP A 27 -0.321 -6.816 13.079 1.00 0.00 O ATOM 406 CB ASP A 27 2.635 -7.345 13.561 1.00 0.00 C ATOM 407 CG ASP A 27 2.779 -7.430 15.068 1.00 0.00 C ATOM 408 OD1 ASP A 27 1.779 -7.185 15.774 1.00 0.00 O ATOM 409 OD2 ASP A 27 3.893 -7.741 15.541 1.00 0.00 O ATOM 0 H ASP A 27 3.366 -5.115 14.350 1.00 0.00 H new ATOM 0 HA ASP A 27 1.977 -5.997 12.023 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.056 -8.198 13.206 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.620 -7.414 13.100 1.00 0.00 H new ATOM 414 N THR A 28 0.187 -5.156 14.510 1.00 0.00 N ATOM 415 CA THR A 28 -1.168 -5.045 15.035 1.00 0.00 C ATOM 416 C THR A 28 -2.092 -4.366 14.032 1.00 0.00 C ATOM 417 O THR A 28 -3.313 -4.521 14.094 1.00 0.00 O ATOM 418 CB THR A 28 -1.196 -4.256 16.358 1.00 0.00 C ATOM 419 OG1 THR A 28 -0.530 -2.999 16.192 1.00 0.00 O ATOM 420 CG2 THR A 28 -0.528 -5.046 17.473 1.00 0.00 C ATOM 0 H THR A 28 0.854 -4.506 14.925 1.00 0.00 H new ATOM 0 HA THR A 28 -1.519 -6.060 15.219 1.00 0.00 H new ATOM 0 HB THR A 28 -2.237 -4.082 16.631 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.553 -2.502 17.037 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.560 -4.469 18.397 1.00 0.00 H new ATOM 0 HG22 THR A 28 -1.054 -5.990 17.616 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.510 -5.246 17.206 1.00 0.00 H new ATOM 428 N CYS A 29 -1.505 -3.615 13.107 1.00 0.00 N ATOM 429 CA CYS A 29 -2.277 -2.911 12.089 1.00 0.00 C ATOM 430 C CYS A 29 -2.918 -3.895 11.116 1.00 0.00 C ATOM 431 O CYS A 29 -2.395 -4.986 10.885 1.00 0.00 O ATOM 432 CB CYS A 29 -1.383 -1.931 11.328 1.00 0.00 C ATOM 433 SG CYS A 29 -1.084 -0.375 12.199 1.00 0.00 S ATOM 0 H CYS A 29 -0.496 -3.478 13.041 1.00 0.00 H new ATOM 0 HA CYS A 29 -3.070 -2.354 12.589 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.426 -2.411 11.126 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.841 -1.713 10.363 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.498 0.465 11.398 1.00 0.00 H new ATOM 439 N THR A 30 -4.054 -3.504 10.549 1.00 0.00 N ATOM 440 CA THR A 30 -4.769 -4.352 9.603 1.00 0.00 C ATOM 441 C THR A 30 -4.144 -4.274 8.215 1.00 0.00 C ATOM 442 O THR A 30 -3.698 -3.211 7.783 1.00 0.00 O ATOM 443 CB THR A 30 -6.255 -3.960 9.508 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.778 -3.700 10.816 1.00 0.00 O ATOM 445 CG2 THR A 30 -7.064 -5.063 8.843 1.00 0.00 C ATOM 0 H THR A 30 -4.500 -2.604 10.728 1.00 0.00 H new ATOM 0 HA THR A 30 -4.695 -5.374 9.975 1.00 0.00 H new ATOM 0 HB THR A 30 -6.332 -3.058 8.901 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.723 -3.450 10.747 1.00 0.00 H new ATOM 0 HG21 THR A 30 -8.111 -4.763 8.787 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.682 -5.238 7.837 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.980 -5.979 9.428 1.00 0.00 H new ATOM 453 N VAL A 31 -4.117 -5.406 7.518 1.00 0.00 N ATOM 454 CA VAL A 31 -3.549 -5.465 6.177 1.00 0.00 C ATOM 455 C VAL A 31 -4.081 -4.333 5.305 1.00 0.00 C ATOM 456 O VAL A 31 -3.443 -3.932 4.332 1.00 0.00 O ATOM 457 CB VAL A 31 -3.857 -6.811 5.496 1.00 0.00 C ATOM 458 CG1 VAL A 31 -3.066 -7.934 6.151 1.00 0.00 C ATOM 459 CG2 VAL A 31 -5.349 -7.102 5.541 1.00 0.00 C ATOM 0 H VAL A 31 -4.482 -6.295 7.861 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.469 -5.360 6.285 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.554 -6.747 4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.296 -8.878 5.657 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.999 -7.728 6.061 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.335 -8.002 7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.548 -8.057 5.055 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.680 -7.147 6.579 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.890 -6.311 5.022 1.00 0.00 H new ATOM 469 N GLY A 32 -5.256 -3.821 5.660 1.00 0.00 N ATOM 470 CA GLY A 32 -5.855 -2.740 4.899 1.00 0.00 C ATOM 471 C GLY A 32 -5.147 -1.417 5.117 1.00 0.00 C ATOM 472 O GLY A 32 -5.033 -0.609 4.196 1.00 0.00 O ATOM 0 H GLY A 32 -5.804 -4.136 6.461 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.833 -2.990 3.838 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.903 -2.639 5.181 1.00 0.00 H new ATOM 476 N GLU A 33 -4.674 -1.195 6.339 1.00 0.00 N ATOM 477 CA GLU A 33 -3.976 0.041 6.674 1.00 0.00 C ATOM 478 C GLU A 33 -2.917 0.369 5.625 1.00 0.00 C ATOM 479 O GLU A 33 -2.960 1.426 4.995 1.00 0.00 O ATOM 480 CB GLU A 33 -3.325 -0.073 8.054 1.00 0.00 C ATOM 481 CG GLU A 33 -4.286 0.181 9.203 1.00 0.00 C ATOM 482 CD GLU A 33 -4.339 1.642 9.607 1.00 0.00 C ATOM 483 OE1 GLU A 33 -4.504 2.499 8.714 1.00 0.00 O ATOM 484 OE2 GLU A 33 -4.215 1.927 10.817 1.00 0.00 O ATOM 0 H GLU A 33 -4.761 -1.854 7.113 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.708 0.849 6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.897 -1.069 8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.500 0.637 8.117 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -5.284 -0.149 8.916 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.986 -0.419 10.062 1.00 0.00 H new ATOM 491 N ILE A 34 -1.968 -0.543 5.446 1.00 0.00 N ATOM 492 CA ILE A 34 -0.898 -0.350 4.474 1.00 0.00 C ATOM 493 C ILE A 34 -1.399 0.406 3.248 1.00 0.00 C ATOM 494 O ILE A 34 -0.695 1.253 2.697 1.00 0.00 O ATOM 495 CB ILE A 34 -0.298 -1.695 4.024 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.137 -2.517 5.239 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.876 -1.464 3.085 1.00 0.00 C ATOM 498 CD1 ILE A 34 0.861 -3.794 4.877 1.00 0.00 C ATOM 0 H ILE A 34 -1.918 -1.422 5.960 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.124 0.237 4.968 1.00 0.00 H new ATOM 0 HB ILE A 34 -1.063 -2.255 3.486 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.786 -1.907 5.867 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.742 -2.764 5.834 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.289 -2.424 2.776 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.537 -0.915 2.206 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.645 -0.887 3.599 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.139 -4.325 5.787 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.207 -4.425 4.275 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.759 -3.554 4.308 1.00 0.00 H new ATOM 510 N LYS A 35 -2.620 0.096 2.827 1.00 0.00 N ATOM 511 CA LYS A 35 -3.218 0.748 1.668 1.00 0.00 C ATOM 512 C LYS A 35 -3.437 2.234 1.932 1.00 0.00 C ATOM 513 O LYS A 35 -2.802 3.084 1.308 1.00 0.00 O ATOM 514 CB LYS A 35 -4.549 0.081 1.312 1.00 0.00 C ATOM 515 CG LYS A 35 -4.436 -1.415 1.077 1.00 0.00 C ATOM 516 CD LYS A 35 -5.521 -1.916 0.139 1.00 0.00 C ATOM 517 CE LYS A 35 -5.058 -1.894 -1.310 1.00 0.00 C ATOM 518 NZ LYS A 35 -5.405 -0.611 -1.983 1.00 0.00 N ATOM 0 H LYS A 35 -3.215 -0.603 3.271 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.530 0.644 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.263 0.261 2.116 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.953 0.552 0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.457 -1.645 0.658 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.506 -1.940 2.030 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.803 -2.932 0.417 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.412 -1.297 0.247 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -3.979 -2.045 -1.349 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.515 -2.723 -1.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -5.425 -0.754 -3.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.340 -0.291 -1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.692 0.109 -1.747 1.00 0.00 H new ATOM 532 N GLN A 36 -4.338 2.539 2.861 1.00 0.00 N ATOM 533 CA GLN A 36 -4.639 3.923 3.207 1.00 0.00 C ATOM 534 C GLN A 36 -3.365 4.687 3.553 1.00 0.00 C ATOM 535 O GLN A 36 -3.258 5.886 3.292 1.00 0.00 O ATOM 536 CB GLN A 36 -5.614 3.976 4.384 1.00 0.00 C ATOM 537 CG GLN A 36 -6.449 5.246 4.427 1.00 0.00 C ATOM 538 CD GLN A 36 -7.157 5.523 3.115 1.00 0.00 C ATOM 539 OE1 GLN A 36 -6.499 6.264 2.231 1.00 0.00 O flip ATOM 540 NE2 GLN A 36 -8.284 5.076 2.899 1.00 0.00 N flip ATOM 0 H GLN A 36 -4.872 1.847 3.387 1.00 0.00 H new ATOM 0 HA GLN A 36 -5.101 4.395 2.340 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.280 3.115 4.332 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -5.052 3.889 5.314 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.188 5.164 5.224 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.806 6.091 4.674 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.753 4.511 3.607 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.749 5.271 2.012 1.00 0.00 H new ATOM 549 N ILE A 37 -2.401 3.986 4.141 1.00 0.00 N ATOM 550 CA ILE A 37 -1.135 4.599 4.521 1.00 0.00 C ATOM 551 C ILE A 37 -0.389 5.123 3.298 1.00 0.00 C ATOM 552 O ILE A 37 0.122 6.243 3.302 1.00 0.00 O ATOM 553 CB ILE A 37 -0.231 3.603 5.272 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.825 3.276 6.643 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.173 4.170 5.419 1.00 0.00 C ATOM 556 CD1 ILE A 37 -0.152 2.109 7.331 1.00 0.00 C ATOM 0 H ILE A 37 -2.473 2.993 4.364 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.373 5.432 5.183 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.171 2.681 4.693 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.750 4.156 7.282 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.886 3.056 6.527 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.800 3.455 5.952 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.595 4.358 4.432 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.131 5.104 5.979 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.625 1.934 8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.250 1.217 6.713 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.904 2.334 7.479 1.00 0.00 H new ATOM 568 N LEU A 38 -0.331 4.306 2.253 1.00 0.00 N ATOM 569 CA LEU A 38 0.351 4.687 1.021 1.00 0.00 C ATOM 570 C LEU A 38 -0.243 5.968 0.443 1.00 0.00 C ATOM 571 O LEU A 38 0.412 6.677 -0.320 1.00 0.00 O ATOM 572 CB LEU A 38 0.257 3.559 -0.008 1.00 0.00 C ATOM 573 CG LEU A 38 1.106 2.319 0.276 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.797 1.219 -0.728 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.587 2.669 0.248 1.00 0.00 C ATOM 0 H LEU A 38 -0.748 3.375 2.234 1.00 0.00 H new ATOM 0 HA LEU A 38 1.399 4.869 1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.786 3.251 -0.086 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.545 3.957 -0.981 1.00 0.00 H new ATOM 0 HG LEU A 38 0.858 1.953 1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.410 0.345 -0.510 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.257 0.949 -0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 38 1.016 1.574 -1.735 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.176 1.775 0.452 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.850 3.060 -0.735 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.797 3.423 1.007 1.00 0.00 H new ATOM 587 N GLU A 39 -1.485 6.258 0.815 1.00 0.00 N ATOM 588 CA GLU A 39 -2.166 7.454 0.335 1.00 0.00 C ATOM 589 C GLU A 39 -1.694 8.691 1.094 1.00 0.00 C ATOM 590 O GLU A 39 -1.930 9.821 0.669 1.00 0.00 O ATOM 591 CB GLU A 39 -3.682 7.300 0.482 1.00 0.00 C ATOM 592 CG GLU A 39 -4.468 8.494 -0.032 1.00 0.00 C ATOM 593 CD GLU A 39 -5.961 8.349 0.191 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.543 7.366 -0.312 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.547 9.219 0.869 1.00 0.00 O ATOM 0 H GLU A 39 -2.040 5.681 1.447 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.922 7.580 -0.720 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.002 6.407 -0.055 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.922 7.143 1.533 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.116 9.398 0.466 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.274 8.621 -1.097 1.00 0.00 H new ATOM 602 N ASN A 40 -1.026 8.467 2.221 1.00 0.00 N ATOM 603 CA ASN A 40 -0.521 9.562 3.041 1.00 0.00 C ATOM 604 C ASN A 40 0.921 9.898 2.672 1.00 0.00 C ATOM 605 O ASN A 40 1.476 10.891 3.141 1.00 0.00 O ATOM 606 CB ASN A 40 -0.608 9.198 4.525 1.00 0.00 C ATOM 607 CG ASN A 40 -1.977 9.486 5.111 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.635 10.455 4.733 1.00 0.00 O ATOM 609 ND2 ASN A 40 -2.411 8.643 6.041 1.00 0.00 N ATOM 0 H ASN A 40 -0.822 7.537 2.587 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.140 10.439 2.852 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.377 8.140 4.651 1.00 0.00 H new ATOM 0 HB3 ASN A 40 0.146 9.757 5.078 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.324 8.786 6.473 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.831 7.853 6.324 1.00 0.00 H new ATOM 616 N GLU A 41 1.520 9.063 1.829 1.00 0.00 N ATOM 617 CA GLU A 41 2.897 9.272 1.398 1.00 0.00 C ATOM 618 C GLU A 41 2.977 9.411 -0.120 1.00 0.00 C ATOM 619 O GLU A 41 3.828 10.131 -0.645 1.00 0.00 O ATOM 620 CB GLU A 41 3.782 8.112 1.861 1.00 0.00 C ATOM 621 CG GLU A 41 3.923 8.021 3.372 1.00 0.00 C ATOM 622 CD GLU A 41 4.833 9.094 3.938 1.00 0.00 C ATOM 623 OE1 GLU A 41 4.343 10.214 4.192 1.00 0.00 O ATOM 624 OE2 GLU A 41 6.035 8.813 4.127 1.00 0.00 O ATOM 0 H GLU A 41 1.074 8.236 1.431 1.00 0.00 H new ATOM 0 HA GLU A 41 3.255 10.197 1.850 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.367 7.177 1.486 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.772 8.221 1.418 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.938 8.106 3.831 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.315 7.039 3.638 1.00 0.00 H new ATOM 631 N LEU A 42 2.086 8.717 -0.819 1.00 0.00 N ATOM 632 CA LEU A 42 2.055 8.763 -2.277 1.00 0.00 C ATOM 633 C LEU A 42 0.839 9.540 -2.772 1.00 0.00 C ATOM 634 O LEU A 42 0.686 9.774 -3.970 1.00 0.00 O ATOM 635 CB LEU A 42 2.035 7.345 -2.850 1.00 0.00 C ATOM 636 CG LEU A 42 3.175 6.426 -2.408 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.879 4.985 -2.794 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.494 6.883 -3.014 1.00 0.00 C ATOM 0 H LEU A 42 1.376 8.116 -0.401 1.00 0.00 H new ATOM 0 HA LEU A 42 2.954 9.275 -2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.090 6.877 -2.575 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.052 7.414 -3.938 1.00 0.00 H new ATOM 0 HG LEU A 42 3.259 6.479 -1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.701 4.346 -2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.957 4.661 -2.312 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.767 4.914 -3.876 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.294 6.218 -2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.422 6.860 -4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.712 7.900 -2.687 1.00 0.00 H new ATOM 650 N GLN A 43 -0.021 9.939 -1.840 1.00 0.00 N ATOM 651 CA GLN A 43 -1.222 10.691 -2.182 1.00 0.00 C ATOM 652 C GLN A 43 -2.083 9.920 -3.177 1.00 0.00 C ATOM 653 O GLN A 43 -2.858 10.510 -3.930 1.00 0.00 O ATOM 654 CB GLN A 43 -0.847 12.055 -2.764 1.00 0.00 C ATOM 655 CG GLN A 43 -0.192 12.987 -1.758 1.00 0.00 C ATOM 656 CD GLN A 43 1.315 12.832 -1.712 1.00 0.00 C ATOM 657 OE1 GLN A 43 1.790 11.904 -0.889 1.00 0.00 O flip ATOM 658 NE2 GLN A 43 2.045 13.538 -2.408 1.00 0.00 N flip ATOM 0 H GLN A 43 0.092 9.754 -0.843 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.799 10.839 -1.269 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.169 11.908 -3.605 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -1.745 12.532 -3.158 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.440 14.018 -2.010 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.604 12.793 -0.768 1.00 0.00 H new ATOM 0 HE21 GLN A 43 1.637 14.239 -3.027 1.00 0.00 H new ATOM 0 HE22 GLN A 43 3.057 13.422 -2.366 1.00 0.00 H new ATOM 667 N ILE A 44 -1.942 8.599 -3.174 1.00 0.00 N ATOM 668 CA ILE A 44 -2.708 7.747 -4.075 1.00 0.00 C ATOM 669 C ILE A 44 -3.951 7.194 -3.387 1.00 0.00 C ATOM 670 O ILE A 44 -3.911 6.760 -2.235 1.00 0.00 O ATOM 671 CB ILE A 44 -1.859 6.573 -4.598 1.00 0.00 C ATOM 672 CG1 ILE A 44 -0.530 7.086 -5.157 1.00 0.00 C ATOM 673 CG2 ILE A 44 -2.623 5.799 -5.661 1.00 0.00 C ATOM 674 CD1 ILE A 44 0.350 5.992 -5.721 1.00 0.00 C ATOM 0 H ILE A 44 -1.304 8.095 -2.558 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.009 8.370 -4.917 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.647 5.899 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -0.732 7.818 -5.939 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.011 7.605 -4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.010 4.973 -6.021 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.545 5.407 -5.233 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.862 6.462 -6.492 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.275 6.428 -6.099 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.583 5.272 -4.937 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.172 5.488 -6.534 1.00 0.00 H new ATOM 686 N PRO A 45 -5.082 7.207 -4.107 1.00 0.00 N ATOM 687 CA PRO A 45 -6.358 6.708 -3.586 1.00 0.00 C ATOM 688 C PRO A 45 -6.364 5.192 -3.423 1.00 0.00 C ATOM 689 O PRO A 45 -5.989 4.457 -4.336 1.00 0.00 O ATOM 690 CB PRO A 45 -7.368 7.134 -4.654 1.00 0.00 C ATOM 691 CG PRO A 45 -6.570 7.248 -5.907 1.00 0.00 C ATOM 692 CD PRO A 45 -5.202 7.710 -5.486 1.00 0.00 C ATOM 0 HA PRO A 45 -6.575 7.102 -2.593 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.167 6.400 -4.759 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.839 8.083 -4.397 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -6.516 6.290 -6.424 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.026 7.958 -6.597 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.424 7.303 -6.132 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.114 8.796 -5.527 1.00 0.00 H new ATOM 700 N VAL A 46 -6.793 4.729 -2.253 1.00 0.00 N ATOM 701 CA VAL A 46 -6.850 3.300 -1.970 1.00 0.00 C ATOM 702 C VAL A 46 -7.759 2.580 -2.960 1.00 0.00 C ATOM 703 O VAL A 46 -7.745 1.352 -3.051 1.00 0.00 O ATOM 704 CB VAL A 46 -7.351 3.030 -0.539 1.00 0.00 C ATOM 705 CG1 VAL A 46 -7.365 1.537 -0.250 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.491 3.769 0.475 1.00 0.00 C ATOM 0 H VAL A 46 -7.106 5.323 -1.486 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.834 2.917 -2.069 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.372 3.401 -0.455 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.722 1.366 0.766 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -8.027 1.036 -0.956 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.356 1.137 -0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.859 3.567 1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.458 3.430 0.392 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.538 4.840 0.280 1.00 0.00 H new ATOM 716 N SER A 47 -8.549 3.351 -3.699 1.00 0.00 N ATOM 717 CA SER A 47 -9.468 2.787 -4.680 1.00 0.00 C ATOM 718 C SER A 47 -8.730 2.406 -5.960 1.00 0.00 C ATOM 719 O SER A 47 -9.135 1.489 -6.675 1.00 0.00 O ATOM 720 CB SER A 47 -10.583 3.785 -4.999 1.00 0.00 C ATOM 721 OG SER A 47 -11.444 3.961 -3.887 1.00 0.00 O ATOM 0 H SER A 47 -8.571 4.369 -3.637 1.00 0.00 H new ATOM 0 HA SER A 47 -9.908 1.886 -4.253 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.148 4.744 -5.281 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.157 3.432 -5.855 1.00 0.00 H new ATOM 0 HG SER A 47 -12.147 4.605 -4.116 1.00 0.00 H new ATOM 727 N LYS A 48 -7.643 3.116 -6.242 1.00 0.00 N ATOM 728 CA LYS A 48 -6.845 2.854 -7.434 1.00 0.00 C ATOM 729 C LYS A 48 -5.707 1.887 -7.125 1.00 0.00 C ATOM 730 O LYS A 48 -5.245 1.157 -8.001 1.00 0.00 O ATOM 731 CB LYS A 48 -6.280 4.162 -7.993 1.00 0.00 C ATOM 732 CG LYS A 48 -7.349 5.166 -8.388 1.00 0.00 C ATOM 733 CD LYS A 48 -7.859 4.912 -9.797 1.00 0.00 C ATOM 734 CE LYS A 48 -9.270 5.449 -9.984 1.00 0.00 C ATOM 735 NZ LYS A 48 -9.587 5.688 -11.419 1.00 0.00 N ATOM 0 H LYS A 48 -7.294 3.878 -5.661 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.494 2.397 -8.182 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.627 4.614 -7.247 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.663 3.939 -8.864 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.179 5.111 -7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.943 6.176 -8.323 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.191 5.383 -10.518 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.846 3.842 -10.003 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.986 4.741 -9.567 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.381 6.380 -9.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -10.376 6.361 -11.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.751 6.080 -11.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.855 4.790 -11.870 1.00 0.00 H new ATOM 749 N MET A 49 -5.260 1.888 -5.873 1.00 0.00 N ATOM 750 CA MET A 49 -4.177 1.008 -5.449 1.00 0.00 C ATOM 751 C MET A 49 -4.692 -0.406 -5.198 1.00 0.00 C ATOM 752 O MET A 49 -5.828 -0.596 -4.762 1.00 0.00 O ATOM 753 CB MET A 49 -3.515 1.554 -4.182 1.00 0.00 C ATOM 754 CG MET A 49 -2.874 2.919 -4.372 1.00 0.00 C ATOM 755 SD MET A 49 -1.524 3.220 -3.215 1.00 0.00 S ATOM 756 CE MET A 49 -2.327 4.293 -2.028 1.00 0.00 C ATOM 0 H MET A 49 -5.630 2.487 -5.136 1.00 0.00 H new ATOM 0 HA MET A 49 -3.438 0.970 -6.250 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.262 1.619 -3.391 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.755 0.848 -3.846 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.498 3.001 -5.392 1.00 0.00 H new ATOM 0 HG3 MET A 49 -3.632 3.692 -4.249 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.678 5.140 -1.806 1.00 0.00 H new ATOM 0 HE2 MET A 49 -3.267 4.655 -2.443 1.00 0.00 H new ATOM 0 HE3 MET A 49 -2.525 3.738 -1.111 1.00 0.00 H new ATOM 766 N LEU A 50 -3.850 -1.395 -5.477 1.00 0.00 N ATOM 767 CA LEU A 50 -4.220 -2.793 -5.283 1.00 0.00 C ATOM 768 C LEU A 50 -3.096 -3.564 -4.599 1.00 0.00 C ATOM 769 O LEU A 50 -2.091 -3.903 -5.226 1.00 0.00 O ATOM 770 CB LEU A 50 -4.558 -3.443 -6.625 1.00 0.00 C ATOM 771 CG LEU A 50 -5.647 -2.756 -7.450 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.719 -3.356 -8.845 1.00 0.00 C ATOM 773 CD2 LEU A 50 -6.994 -2.864 -6.750 1.00 0.00 C ATOM 0 H LEU A 50 -2.906 -1.255 -5.838 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.100 -2.824 -4.640 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.649 -3.485 -7.225 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.866 -4.472 -6.440 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.393 -1.700 -7.544 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.500 -2.854 -9.417 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.760 -3.225 -9.347 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.949 -4.419 -8.772 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.757 -2.370 -7.351 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.255 -3.915 -6.624 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.936 -2.385 -5.773 1.00 0.00 H new ATOM 785 N LEU A 51 -3.272 -3.840 -3.312 1.00 0.00 N ATOM 786 CA LEU A 51 -2.273 -4.574 -2.543 1.00 0.00 C ATOM 787 C LEU A 51 -2.038 -5.959 -3.137 1.00 0.00 C ATOM 788 O LEU A 51 -2.980 -6.718 -3.364 1.00 0.00 O ATOM 789 CB LEU A 51 -2.716 -4.701 -1.084 1.00 0.00 C ATOM 790 CG LEU A 51 -1.595 -4.753 -0.045 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.544 -5.776 -0.444 1.00 0.00 C ATOM 792 CD2 LEU A 51 -0.966 -3.379 0.130 1.00 0.00 C ATOM 0 H LEU A 51 -4.097 -3.567 -2.779 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.337 -4.017 -2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.365 -3.858 -0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.318 -5.604 -0.985 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.024 -5.058 0.909 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.245 -5.799 0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.004 -6.761 -0.516 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.118 -5.503 -1.409 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.170 -3.435 0.873 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.551 -3.045 -0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.725 -2.671 0.464 1.00 0.00 H new ATOM 804 N LYS A 52 -0.773 -6.283 -3.386 1.00 0.00 N ATOM 805 CA LYS A 52 -0.412 -7.578 -3.951 1.00 0.00 C ATOM 806 C LYS A 52 0.986 -7.995 -3.506 1.00 0.00 C ATOM 807 O LYS A 52 1.819 -7.152 -3.173 1.00 0.00 O ATOM 808 CB LYS A 52 -0.479 -7.528 -5.479 1.00 0.00 C ATOM 809 CG LYS A 52 -1.827 -7.079 -6.015 1.00 0.00 C ATOM 810 CD LYS A 52 -1.785 -6.859 -7.518 1.00 0.00 C ATOM 811 CE LYS A 52 -3.162 -7.020 -8.143 1.00 0.00 C ATOM 812 NZ LYS A 52 -3.112 -6.918 -9.628 1.00 0.00 N ATOM 0 H LYS A 52 0.019 -5.666 -3.205 1.00 0.00 H new ATOM 0 HA LYS A 52 -1.126 -8.317 -3.587 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.292 -6.851 -5.846 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.250 -8.517 -5.877 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.582 -7.828 -5.777 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.127 -6.156 -5.520 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.402 -5.861 -7.730 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.093 -7.569 -7.972 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -3.579 -7.986 -7.859 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.832 -6.256 -7.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -4.070 -7.033 -10.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.738 -5.986 -9.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -2.493 -7.663 -10.007 1.00 0.00 H new ATOM 826 N GLY A 53 1.238 -9.300 -3.505 1.00 0.00 N ATOM 827 CA GLY A 53 2.537 -9.805 -3.100 1.00 0.00 C ATOM 828 C GLY A 53 2.480 -10.569 -1.792 1.00 0.00 C ATOM 829 O GLY A 53 3.512 -10.981 -1.261 1.00 0.00 O ATOM 0 H GLY A 53 0.566 -10.017 -3.777 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.930 -10.456 -3.881 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.232 -8.972 -3.000 1.00 0.00 H new ATOM 833 N TRP A 54 1.274 -10.757 -1.271 1.00 0.00 N ATOM 834 CA TRP A 54 1.087 -11.476 -0.015 1.00 0.00 C ATOM 835 C TRP A 54 1.676 -12.879 -0.099 1.00 0.00 C ATOM 836 O TRP A 54 1.837 -13.433 -1.187 1.00 0.00 O ATOM 837 CB TRP A 54 -0.399 -11.553 0.336 1.00 0.00 C ATOM 838 CG TRP A 54 -0.964 -10.251 0.819 1.00 0.00 C ATOM 839 CD1 TRP A 54 -1.939 -9.508 0.217 1.00 0.00 C ATOM 840 CD2 TRP A 54 -0.587 -9.540 2.002 1.00 0.00 C ATOM 841 NE1 TRP A 54 -2.190 -8.376 0.955 1.00 0.00 N ATOM 842 CE2 TRP A 54 -1.374 -8.373 2.056 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.338 -9.775 3.023 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -1.263 -7.447 3.089 1.00 0.00 C ATOM 845 CZ3 TRP A 54 0.448 -8.855 4.048 1.00 0.00 C ATOM 846 CH2 TRP A 54 -0.349 -7.703 4.075 1.00 0.00 C ATOM 0 H TRP A 54 0.410 -10.422 -1.698 1.00 0.00 H new ATOM 0 HA TRP A 54 1.610 -10.929 0.770 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -0.956 -11.879 -0.542 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.544 -12.312 1.105 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -2.439 -9.771 -0.703 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.873 -7.655 0.721 1.00 0.00 H new ATOM 0 HE3 TRP A 54 0.956 -10.660 3.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.876 -6.558 3.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.160 -9.027 4.842 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.240 -7.003 4.890 1.00 0.00 H new ATOM 857 N LYS A 55 1.997 -13.451 1.057 1.00 0.00 N ATOM 858 CA LYS A 55 2.568 -14.792 1.116 1.00 0.00 C ATOM 859 C LYS A 55 1.484 -15.852 0.949 1.00 0.00 C ATOM 860 O LYS A 55 1.759 -16.977 0.529 1.00 0.00 O ATOM 861 CB LYS A 55 3.299 -15.000 2.443 1.00 0.00 C ATOM 862 CG LYS A 55 3.857 -16.402 2.618 1.00 0.00 C ATOM 863 CD LYS A 55 5.122 -16.605 1.800 1.00 0.00 C ATOM 864 CE LYS A 55 6.342 -16.040 2.511 1.00 0.00 C ATOM 865 NZ LYS A 55 6.828 -16.950 3.585 1.00 0.00 N ATOM 0 H LYS A 55 1.871 -13.006 1.966 1.00 0.00 H new ATOM 0 HA LYS A 55 3.280 -14.893 0.297 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.116 -14.282 2.515 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.614 -14.786 3.263 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.071 -16.580 3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.107 -17.133 2.317 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.269 -17.669 1.613 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.010 -16.123 0.829 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.140 -15.874 1.787 1.00 0.00 H new ATOM 0 HE3 LYS A 55 6.095 -15.070 2.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.331 -16.397 4.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.018 -17.435 4.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.474 -17.655 3.177 1.00 0.00 H new ATOM 879 N THR A 56 0.249 -15.487 1.280 1.00 0.00 N ATOM 880 CA THR A 56 -0.876 -16.406 1.167 1.00 0.00 C ATOM 881 C THR A 56 -1.638 -16.185 -0.135 1.00 0.00 C ATOM 882 O THR A 56 -1.673 -15.075 -0.664 1.00 0.00 O ATOM 883 CB THR A 56 -1.850 -16.251 2.351 1.00 0.00 C ATOM 884 OG1 THR A 56 -2.680 -15.100 2.155 1.00 0.00 O ATOM 885 CG2 THR A 56 -1.091 -16.117 3.662 1.00 0.00 C ATOM 0 H THR A 56 0.003 -14.561 1.629 1.00 0.00 H new ATOM 0 HA THR A 56 -0.462 -17.414 1.176 1.00 0.00 H new ATOM 0 HB THR A 56 -2.473 -17.144 2.400 1.00 0.00 H new ATOM 0 HG1 THR A 56 -3.443 -15.139 2.769 1.00 0.00 H new ATOM 0 HG21 THR A 56 -1.800 -16.009 4.483 1.00 0.00 H new ATOM 0 HG22 THR A 56 -0.482 -17.007 3.823 1.00 0.00 H new ATOM 0 HG23 THR A 56 -0.446 -15.239 3.621 1.00 0.00 H new ATOM 893 N GLY A 57 -2.248 -17.250 -0.646 1.00 0.00 N ATOM 894 CA GLY A 57 -3.001 -17.151 -1.883 1.00 0.00 C ATOM 895 C GLY A 57 -3.689 -15.809 -2.037 1.00 0.00 C ATOM 896 O GLY A 57 -3.547 -15.145 -3.064 1.00 0.00 O ATOM 0 H GLY A 57 -2.234 -18.179 -0.226 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.330 -17.311 -2.727 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.748 -17.944 -1.915 1.00 0.00 H new ATOM 900 N ASP A 58 -4.436 -15.408 -1.014 1.00 0.00 N ATOM 901 CA ASP A 58 -5.149 -14.136 -1.040 1.00 0.00 C ATOM 902 C ASP A 58 -5.407 -13.629 0.375 1.00 0.00 C ATOM 903 O ASP A 58 -5.781 -14.396 1.262 1.00 0.00 O ATOM 904 CB ASP A 58 -6.473 -14.284 -1.792 1.00 0.00 C ATOM 905 CG ASP A 58 -7.386 -15.316 -1.158 1.00 0.00 C ATOM 906 OD1 ASP A 58 -7.976 -15.016 -0.099 1.00 0.00 O ATOM 907 OD2 ASP A 58 -7.511 -16.423 -1.723 1.00 0.00 O ATOM 0 H ASP A 58 -4.563 -15.945 -0.156 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.525 -13.408 -1.559 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.982 -13.320 -1.819 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.271 -14.567 -2.825 1.00 0.00 H new ATOM 912 N VAL A 59 -5.204 -12.331 0.579 1.00 0.00 N ATOM 913 CA VAL A 59 -5.415 -11.720 1.886 1.00 0.00 C ATOM 914 C VAL A 59 -6.460 -10.613 1.814 1.00 0.00 C ATOM 915 O VAL A 59 -6.456 -9.803 0.888 1.00 0.00 O ATOM 916 CB VAL A 59 -4.106 -11.139 2.452 1.00 0.00 C ATOM 917 CG1 VAL A 59 -4.326 -10.591 3.854 1.00 0.00 C ATOM 918 CG2 VAL A 59 -3.009 -12.194 2.449 1.00 0.00 C ATOM 0 H VAL A 59 -4.894 -11.682 -0.144 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.771 -12.508 2.549 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.789 -10.316 1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.390 -10.185 4.237 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.078 -9.802 3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.668 -11.393 4.508 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.091 -11.766 2.852 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.316 -13.040 3.064 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.833 -12.533 1.428 1.00 0.00 H new ATOM 928 N GLU A 60 -7.354 -10.586 2.797 1.00 0.00 N ATOM 929 CA GLU A 60 -8.407 -9.577 2.844 1.00 0.00 C ATOM 930 C GLU A 60 -8.086 -8.504 3.881 1.00 0.00 C ATOM 931 O GLU A 60 -7.308 -8.733 4.807 1.00 0.00 O ATOM 932 CB GLU A 60 -9.753 -10.228 3.168 1.00 0.00 C ATOM 933 CG GLU A 60 -9.715 -11.130 4.390 1.00 0.00 C ATOM 934 CD GLU A 60 -11.065 -11.748 4.700 1.00 0.00 C ATOM 935 OE1 GLU A 60 -12.076 -11.017 4.664 1.00 0.00 O ATOM 936 OE2 GLU A 60 -11.109 -12.965 4.980 1.00 0.00 O ATOM 0 H GLU A 60 -7.371 -11.250 3.571 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.467 -9.104 1.864 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.496 -9.446 3.327 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.082 -10.810 2.307 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.985 -11.923 4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.376 -10.555 5.252 1.00 0.00 H new ATOM 943 N ASP A 61 -8.690 -7.333 3.716 1.00 0.00 N ATOM 944 CA ASP A 61 -8.470 -6.223 4.637 1.00 0.00 C ATOM 945 C ASP A 61 -8.963 -6.573 6.038 1.00 0.00 C ATOM 946 O ASP A 61 -8.717 -5.840 6.995 1.00 0.00 O ATOM 947 CB ASP A 61 -9.180 -4.966 4.133 1.00 0.00 C ATOM 948 CG ASP A 61 -10.682 -5.146 4.041 1.00 0.00 C ATOM 949 OD1 ASP A 61 -11.148 -5.756 3.056 1.00 0.00 O ATOM 950 OD2 ASP A 61 -11.393 -4.678 4.955 1.00 0.00 O ATOM 0 H ASP A 61 -9.336 -7.127 2.954 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.398 -6.031 4.686 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.957 -4.134 4.801 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.788 -4.700 3.151 1.00 0.00 H new ATOM 955 N SER A 62 -9.661 -7.699 6.150 1.00 0.00 N ATOM 956 CA SER A 62 -10.193 -8.144 7.432 1.00 0.00 C ATOM 957 C SER A 62 -9.155 -8.958 8.198 1.00 0.00 C ATOM 958 O SER A 62 -9.430 -9.480 9.279 1.00 0.00 O ATOM 959 CB SER A 62 -11.458 -8.979 7.221 1.00 0.00 C ATOM 960 OG SER A 62 -12.473 -8.218 6.592 1.00 0.00 O ATOM 0 H SER A 62 -9.871 -8.319 5.368 1.00 0.00 H new ATOM 0 HA SER A 62 -10.443 -7.261 8.020 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.224 -9.852 6.612 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.818 -9.348 8.181 1.00 0.00 H new ATOM 0 HG SER A 62 -13.270 -8.775 6.467 1.00 0.00 H new ATOM 966 N THR A 63 -7.957 -9.062 7.630 1.00 0.00 N ATOM 967 CA THR A 63 -6.876 -9.812 8.257 1.00 0.00 C ATOM 968 C THR A 63 -5.813 -8.877 8.821 1.00 0.00 C ATOM 969 O THR A 63 -5.555 -7.808 8.267 1.00 0.00 O ATOM 970 CB THR A 63 -6.214 -10.782 7.261 1.00 0.00 C ATOM 971 OG1 THR A 63 -7.200 -11.657 6.701 1.00 0.00 O ATOM 972 CG2 THR A 63 -5.130 -11.603 7.943 1.00 0.00 C ATOM 0 H THR A 63 -7.711 -8.636 6.736 1.00 0.00 H new ATOM 0 HA THR A 63 -7.320 -10.385 9.071 1.00 0.00 H new ATOM 0 HB THR A 63 -5.756 -10.194 6.466 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.772 -12.270 6.067 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.677 -12.281 7.219 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.366 -10.936 8.343 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.569 -12.181 8.756 1.00 0.00 H new ATOM 980 N VAL A 64 -5.197 -9.286 9.926 1.00 0.00 N ATOM 981 CA VAL A 64 -4.159 -8.485 10.564 1.00 0.00 C ATOM 982 C VAL A 64 -2.771 -9.022 10.236 1.00 0.00 C ATOM 983 O VAL A 64 -2.587 -10.226 10.048 1.00 0.00 O ATOM 984 CB VAL A 64 -4.337 -8.452 12.094 1.00 0.00 C ATOM 985 CG1 VAL A 64 -4.199 -9.850 12.678 1.00 0.00 C ATOM 986 CG2 VAL A 64 -3.333 -7.500 12.726 1.00 0.00 C ATOM 0 H VAL A 64 -5.399 -10.167 10.398 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.255 -7.472 10.173 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.340 -8.088 12.318 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.328 -9.807 13.760 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.960 -10.501 12.248 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.210 -10.245 12.446 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.473 -7.489 13.807 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.321 -7.832 12.494 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.485 -6.496 12.330 1.00 0.00 H new ATOM 996 N LEU A 65 -1.795 -8.123 10.168 1.00 0.00 N ATOM 997 CA LEU A 65 -0.421 -8.506 9.863 1.00 0.00 C ATOM 998 C LEU A 65 0.046 -9.632 10.779 1.00 0.00 C ATOM 999 O LEU A 65 0.310 -10.747 10.327 1.00 0.00 O ATOM 1000 CB LEU A 65 0.509 -7.300 10.004 1.00 0.00 C ATOM 1001 CG LEU A 65 0.069 -6.025 9.282 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.520 -4.793 10.052 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.617 -6.000 7.863 1.00 0.00 C ATOM 0 H LEU A 65 -1.930 -7.123 10.320 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.389 -8.863 8.834 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.619 -7.073 11.064 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.495 -7.581 9.634 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.020 -6.017 9.230 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.198 -3.896 9.524 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.079 -4.805 11.049 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.607 -4.794 10.136 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.294 -5.086 7.364 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.706 -6.032 7.893 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.244 -6.864 7.314 1.00 0.00 H new ATOM 1015 N LYS A 66 0.145 -9.335 12.071 1.00 0.00 N ATOM 1016 CA LYS A 66 0.576 -10.323 13.053 1.00 0.00 C ATOM 1017 C LYS A 66 -0.011 -11.695 12.739 1.00 0.00 C ATOM 1018 O LYS A 66 0.550 -12.723 13.119 1.00 0.00 O ATOM 1019 CB LYS A 66 0.161 -9.888 14.460 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.302 -10.151 14.771 1.00 0.00 C ATOM 1021 CD LYS A 66 -1.889 -9.061 15.652 1.00 0.00 C ATOM 1022 CE LYS A 66 -2.999 -9.600 16.541 1.00 0.00 C ATOM 1023 NZ LYS A 66 -4.028 -8.564 16.834 1.00 0.00 N ATOM 0 H LYS A 66 -0.068 -8.417 12.462 1.00 0.00 H new ATOM 0 HA LYS A 66 1.663 -10.394 13.007 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.779 -10.411 15.190 1.00 0.00 H new ATOM 0 HB3 LYS A 66 0.363 -8.823 14.576 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.867 -10.212 13.841 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.401 -11.116 15.269 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.103 -8.630 16.271 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.280 -8.258 15.027 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.471 -10.454 16.055 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.572 -9.962 17.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.767 -8.971 17.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.583 -7.760 17.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.454 -8.236 15.944 1.00 0.00 H new ATOM 1037 N SER A 67 -1.144 -11.704 12.043 1.00 0.00 N ATOM 1038 CA SER A 67 -1.808 -12.950 11.680 1.00 0.00 C ATOM 1039 C SER A 67 -0.910 -13.807 10.793 1.00 0.00 C ATOM 1040 O SER A 67 -0.763 -15.009 11.015 1.00 0.00 O ATOM 1041 CB SER A 67 -3.127 -12.659 10.961 1.00 0.00 C ATOM 1042 OG SER A 67 -3.971 -13.797 10.963 1.00 0.00 O ATOM 0 H SER A 67 -1.621 -10.862 11.720 1.00 0.00 H new ATOM 0 HA SER A 67 -2.016 -13.502 12.597 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.634 -11.826 11.448 1.00 0.00 H new ATOM 0 HB3 SER A 67 -2.925 -12.354 9.934 1.00 0.00 H new ATOM 0 HG SER A 67 -4.808 -13.585 10.499 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.311 -13.179 9.787 1.00 0.00 N ATOM 1049 CA LEU A 68 0.574 -13.883 8.865 1.00 0.00 C ATOM 1050 C LEU A 68 1.997 -13.935 9.410 1.00 0.00 C ATOM 1051 O LEU A 68 2.764 -14.843 9.086 1.00 0.00 O ATOM 1052 CB LEU A 68 0.564 -13.199 7.496 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.800 -13.080 6.816 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.776 -11.987 5.759 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -1.207 -14.411 6.200 1.00 0.00 C ATOM 0 H LEU A 68 -0.422 -12.185 9.589 1.00 0.00 H new ATOM 0 HA LEU A 68 0.209 -14.904 8.757 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.980 -12.198 7.609 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.232 -13.748 6.833 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.539 -12.811 7.571 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.755 -11.917 5.286 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.530 -11.034 6.227 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.025 -12.226 5.006 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.180 -14.307 5.720 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.467 -14.710 5.458 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.266 -15.170 6.980 1.00 0.00 H new ATOM 1067 N HIS A 69 2.344 -12.956 10.240 1.00 0.00 N ATOM 1068 CA HIS A 69 3.676 -12.892 10.832 1.00 0.00 C ATOM 1069 C HIS A 69 4.742 -12.718 9.755 1.00 0.00 C ATOM 1070 O HIS A 69 5.685 -13.505 9.667 1.00 0.00 O ATOM 1071 CB HIS A 69 3.957 -14.157 11.645 1.00 0.00 C ATOM 1072 CG HIS A 69 3.132 -14.264 12.890 1.00 0.00 C ATOM 1073 ND1 HIS A 69 3.172 -13.328 13.902 1.00 0.00 N ATOM 1074 CD2 HIS A 69 2.241 -15.203 13.284 1.00 0.00 C ATOM 1075 CE1 HIS A 69 2.342 -13.688 14.865 1.00 0.00 C ATOM 1076 NE2 HIS A 69 1.764 -14.822 14.514 1.00 0.00 N ATOM 0 H HIS A 69 1.722 -12.197 10.518 1.00 0.00 H new ATOM 0 HA HIS A 69 3.711 -12.028 11.495 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.771 -15.030 11.019 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.013 -14.178 11.916 1.00 0.00 H new ATOM 0 HD2 HIS A 69 1.958 -16.088 12.733 1.00 0.00 H new ATOM 0 HE1 HIS A 69 2.166 -13.147 15.783 1.00 0.00 H new ATOM 0 HE2 HIS A 69 1.075 -15.332 15.067 1.00 0.00 H new ATOM 1085 N LEU A 70 4.585 -11.684 8.936 1.00 0.00 N ATOM 1086 CA LEU A 70 5.534 -11.407 7.863 1.00 0.00 C ATOM 1087 C LEU A 70 6.947 -11.243 8.415 1.00 0.00 C ATOM 1088 O LEU A 70 7.149 -10.885 9.575 1.00 0.00 O ATOM 1089 CB LEU A 70 5.121 -10.145 7.104 1.00 0.00 C ATOM 1090 CG LEU A 70 3.934 -10.293 6.152 1.00 0.00 C ATOM 1091 CD1 LEU A 70 4.208 -11.376 5.120 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.663 -10.604 6.929 1.00 0.00 C ATOM 0 H LEU A 70 3.810 -11.024 8.994 1.00 0.00 H new ATOM 0 HA LEU A 70 5.528 -12.254 7.177 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.883 -9.369 7.832 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.979 -9.793 6.531 1.00 0.00 H new ATOM 0 HG LEU A 70 3.794 -9.348 5.628 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.352 -11.467 4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.093 -11.112 4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.375 -12.327 5.626 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.828 -10.706 6.235 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.792 -11.535 7.481 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.457 -9.794 7.628 1.00 0.00 H new ATOM 1104 N PRO A 71 7.949 -11.508 7.564 1.00 0.00 N ATOM 1105 CA PRO A 71 9.361 -11.394 7.943 1.00 0.00 C ATOM 1106 C PRO A 71 9.790 -9.945 8.151 1.00 0.00 C ATOM 1107 O PRO A 71 9.240 -9.030 7.538 1.00 0.00 O ATOM 1108 CB PRO A 71 10.099 -12.004 6.749 1.00 0.00 C ATOM 1109 CG PRO A 71 9.170 -11.828 5.598 1.00 0.00 C ATOM 1110 CD PRO A 71 7.782 -11.939 6.166 1.00 0.00 C ATOM 0 HA PRO A 71 9.570 -11.891 8.890 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.049 -11.500 6.571 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.324 -13.057 6.919 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.320 -10.860 5.120 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.342 -12.589 4.837 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.077 -11.303 5.631 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.402 -12.959 6.103 1.00 0.00 H new ATOM 1118 N LYS A 72 10.776 -9.744 9.018 1.00 0.00 N ATOM 1119 CA LYS A 72 11.281 -8.407 9.306 1.00 0.00 C ATOM 1120 C LYS A 72 11.441 -7.598 8.023 1.00 0.00 C ATOM 1121 O LYS A 72 11.012 -6.447 7.947 1.00 0.00 O ATOM 1122 CB LYS A 72 12.623 -8.493 10.037 1.00 0.00 C ATOM 1123 CG LYS A 72 13.104 -7.160 10.584 1.00 0.00 C ATOM 1124 CD LYS A 72 14.491 -7.275 11.193 1.00 0.00 C ATOM 1125 CE LYS A 72 15.143 -5.911 11.357 1.00 0.00 C ATOM 1126 NZ LYS A 72 16.495 -6.012 11.973 1.00 0.00 N ATOM 0 H LYS A 72 11.242 -10.491 9.534 1.00 0.00 H new ATOM 0 HA LYS A 72 10.557 -7.902 9.946 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.534 -9.203 10.859 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.375 -8.888 9.354 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.117 -6.421 9.783 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.403 -6.801 11.338 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.424 -7.766 12.164 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.116 -7.905 10.560 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.223 -5.427 10.383 1.00 0.00 H new ATOM 0 HE3 LYS A 72 14.508 -5.277 11.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 16.905 -5.061 12.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.416 -6.450 12.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 17.109 -6.595 11.369 1.00 0.00 H new ATOM 1140 N ASN A 73 12.059 -8.208 7.017 1.00 0.00 N ATOM 1141 CA ASN A 73 12.274 -7.543 5.736 1.00 0.00 C ATOM 1142 C ASN A 73 11.169 -7.901 4.746 1.00 0.00 C ATOM 1143 O ASN A 73 11.156 -8.995 4.183 1.00 0.00 O ATOM 1144 CB ASN A 73 13.637 -7.931 5.159 1.00 0.00 C ATOM 1145 CG ASN A 73 13.750 -9.420 4.895 1.00 0.00 C ATOM 1146 OD1 ASN A 73 13.503 -10.240 5.780 1.00 0.00 O ATOM 1147 ND2 ASN A 73 14.126 -9.777 3.672 1.00 0.00 N ATOM 0 H ASN A 73 12.420 -9.161 7.063 1.00 0.00 H new ATOM 0 HA ASN A 73 12.252 -6.466 5.905 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.804 -7.386 4.230 1.00 0.00 H new ATOM 0 HB3 ASN A 73 14.422 -7.627 5.852 1.00 0.00 H new ATOM 0 HD21 ASN A 73 14.220 -10.765 3.435 1.00 0.00 H new ATOM 0 HD22 ASN A 73 14.321 -9.063 2.970 1.00 0.00 H new ATOM 1154 N ASN A 74 10.244 -6.969 4.538 1.00 0.00 N ATOM 1155 CA ASN A 74 9.136 -7.185 3.616 1.00 0.00 C ATOM 1156 C ASN A 74 9.246 -6.262 2.406 1.00 0.00 C ATOM 1157 O ASN A 74 9.806 -5.169 2.496 1.00 0.00 O ATOM 1158 CB ASN A 74 7.801 -6.955 4.327 1.00 0.00 C ATOM 1159 CG ASN A 74 7.455 -8.079 5.285 1.00 0.00 C ATOM 1160 OD1 ASN A 74 7.300 -9.230 4.878 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.330 -7.748 6.565 1.00 0.00 N ATOM 0 H ASN A 74 10.240 -6.057 4.996 1.00 0.00 H new ATOM 0 HA ASN A 74 9.182 -8.217 3.268 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.842 -6.014 4.875 1.00 0.00 H new ATOM 0 HB3 ASN A 74 7.009 -6.857 3.584 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.096 -8.461 7.256 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.468 -6.781 6.857 1.00 0.00 H new ATOM 1168 N SER A 75 8.708 -6.709 1.276 1.00 0.00 N ATOM 1169 CA SER A 75 8.749 -5.925 0.047 1.00 0.00 C ATOM 1170 C SER A 75 7.465 -6.107 -0.756 1.00 0.00 C ATOM 1171 O SER A 75 7.244 -7.154 -1.367 1.00 0.00 O ATOM 1172 CB SER A 75 9.957 -6.329 -0.801 1.00 0.00 C ATOM 1173 OG SER A 75 10.002 -7.733 -0.988 1.00 0.00 O ATOM 0 H SER A 75 8.239 -7.610 1.186 1.00 0.00 H new ATOM 0 HA SER A 75 8.841 -4.873 0.319 1.00 0.00 H new ATOM 0 HB2 SER A 75 9.908 -5.831 -1.770 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.874 -5.994 -0.316 1.00 0.00 H new ATOM 0 HG SER A 75 9.104 -8.064 -1.198 1.00 0.00 H new ATOM 1179 N LEU A 76 6.621 -5.082 -0.751 1.00 0.00 N ATOM 1180 CA LEU A 76 5.358 -5.127 -1.479 1.00 0.00 C ATOM 1181 C LEU A 76 5.419 -4.258 -2.731 1.00 0.00 C ATOM 1182 O LEU A 76 6.431 -3.610 -3.000 1.00 0.00 O ATOM 1183 CB LEU A 76 4.211 -4.664 -0.579 1.00 0.00 C ATOM 1184 CG LEU A 76 3.757 -5.654 0.494 1.00 0.00 C ATOM 1185 CD1 LEU A 76 2.937 -4.946 1.561 1.00 0.00 C ATOM 1186 CD2 LEU A 76 2.958 -6.788 -0.131 1.00 0.00 C ATOM 0 H LEU A 76 6.788 -4.209 -0.251 1.00 0.00 H new ATOM 0 HA LEU A 76 5.180 -6.158 -1.783 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.513 -3.739 -0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.355 -4.425 -1.210 1.00 0.00 H new ATOM 0 HG LEU A 76 4.642 -6.078 0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.623 -5.667 2.316 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.542 -4.170 2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.057 -4.493 1.103 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.643 -7.483 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.079 -6.381 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.579 -7.313 -0.857 1.00 0.00 H new ATOM 1198 N TYR A 77 4.331 -4.248 -3.492 1.00 0.00 N ATOM 1199 CA TYR A 77 4.261 -3.459 -4.716 1.00 0.00 C ATOM 1200 C TYR A 77 2.821 -3.067 -5.031 1.00 0.00 C ATOM 1201 O TYR A 77 1.891 -3.841 -4.804 1.00 0.00 O ATOM 1202 CB TYR A 77 4.855 -4.242 -5.888 1.00 0.00 C ATOM 1203 CG TYR A 77 4.227 -5.603 -6.087 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.671 -6.707 -5.370 1.00 0.00 C ATOM 1205 CD2 TYR A 77 3.189 -5.784 -6.993 1.00 0.00 C ATOM 1206 CE1 TYR A 77 4.100 -7.952 -5.550 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.611 -7.025 -7.178 1.00 0.00 C ATOM 1208 CZ TYR A 77 3.070 -8.106 -6.454 1.00 0.00 C ATOM 1209 OH TYR A 77 2.498 -9.344 -6.637 1.00 0.00 O ATOM 0 H TYR A 77 3.485 -4.778 -3.283 1.00 0.00 H new ATOM 0 HA TYR A 77 4.841 -2.549 -4.564 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.736 -3.659 -6.801 1.00 0.00 H new ATOM 0 HB3 TYR A 77 5.926 -4.365 -5.726 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.476 -6.590 -4.660 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.828 -4.940 -7.562 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.458 -8.800 -4.986 1.00 0.00 H new ATOM 0 HE2 TYR A 77 1.804 -7.148 -7.885 1.00 0.00 H new ATOM 0 HH TYR A 77 1.786 -9.280 -7.308 1.00 0.00 H new ATOM 1219 N VAL A 78 2.644 -1.858 -5.554 1.00 0.00 N ATOM 1220 CA VAL A 78 1.318 -1.362 -5.903 1.00 0.00 C ATOM 1221 C VAL A 78 1.088 -1.416 -7.409 1.00 0.00 C ATOM 1222 O VAL A 78 1.945 -1.008 -8.194 1.00 0.00 O ATOM 1223 CB VAL A 78 1.114 0.085 -5.415 1.00 0.00 C ATOM 1224 CG1 VAL A 78 -0.060 0.731 -6.136 1.00 0.00 C ATOM 1225 CG2 VAL A 78 0.908 0.115 -3.909 1.00 0.00 C ATOM 0 H VAL A 78 3.403 -1.204 -5.745 1.00 0.00 H new ATOM 0 HA VAL A 78 0.597 -2.011 -5.406 1.00 0.00 H new ATOM 0 HB VAL A 78 2.012 0.658 -5.647 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.189 1.753 -5.778 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.134 0.744 -7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.967 0.160 -5.938 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.766 1.145 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.027 -0.473 -3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.783 -0.305 -3.414 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.073 -1.923 -7.807 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.417 -2.031 -9.220 1.00 0.00 C ATOM 1237 C LEU A 79 -1.729 -1.312 -9.518 1.00 0.00 C ATOM 1238 O LEU A 79 -2.808 -1.798 -9.178 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.524 -3.501 -9.628 1.00 0.00 C ATOM 1240 CG LEU A 79 0.698 -4.371 -9.332 1.00 0.00 C ATOM 1241 CD1 LEU A 79 0.491 -5.781 -9.864 1.00 0.00 C ATOM 1242 CD2 LEU A 79 1.952 -3.751 -9.931 1.00 0.00 C ATOM 0 H LEU A 79 -0.793 -2.266 -7.171 1.00 0.00 H new ATOM 0 HA LEU A 79 0.375 -1.556 -9.799 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.386 -3.936 -9.122 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.727 -3.546 -10.698 1.00 0.00 H new ATOM 0 HG LEU A 79 0.826 -4.428 -8.251 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.371 -6.386 -9.644 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.383 -6.225 -9.387 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.336 -5.744 -10.942 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.812 -4.384 -9.710 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.834 -3.663 -11.011 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.110 -2.762 -9.501 1.00 0.00 H new ATOM 1254 N THR A 80 -1.629 -0.151 -10.159 1.00 0.00 N ATOM 1255 CA THR A 80 -2.806 0.635 -10.504 1.00 0.00 C ATOM 1256 C THR A 80 -3.169 0.465 -11.975 1.00 0.00 C ATOM 1257 O THR A 80 -2.600 1.106 -12.858 1.00 0.00 O ATOM 1258 CB THR A 80 -2.589 2.132 -10.211 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.544 2.647 -11.043 1.00 0.00 O ATOM 1260 CG2 THR A 80 -2.232 2.350 -8.748 1.00 0.00 C ATOM 0 H THR A 80 -0.744 0.265 -10.449 1.00 0.00 H new ATOM 0 HA THR A 80 -3.624 0.266 -9.885 1.00 0.00 H new ATOM 0 HB THR A 80 -3.518 2.660 -10.425 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.591 2.225 -11.926 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.083 3.414 -8.564 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.041 1.983 -8.117 1.00 0.00 H new ATOM 0 HG23 THR A 80 -1.315 1.810 -8.513 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.141 -0.419 -12.246 1.00 0.00 N ATOM 1269 CA PRO A 81 -4.602 -0.693 -13.611 1.00 0.00 C ATOM 1270 C PRO A 81 -5.368 0.481 -14.210 1.00 0.00 C ATOM 1271 O PRO A 81 -5.140 0.863 -15.358 1.00 0.00 O ATOM 1272 CB PRO A 81 -5.526 -1.901 -13.436 1.00 0.00 C ATOM 1273 CG PRO A 81 -6.000 -1.816 -12.027 1.00 0.00 C ATOM 1274 CD PRO A 81 -4.864 -1.219 -11.243 1.00 0.00 C ATOM 0 HA PRO A 81 -3.772 -0.869 -14.295 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.360 -1.866 -14.137 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.995 -2.835 -13.619 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -6.894 -1.196 -11.953 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.263 -2.802 -11.644 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.224 -0.602 -10.420 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.227 -1.989 -10.808 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.278 1.050 -13.427 1.00 0.00 N ATOM 1283 CA ASP A 82 -7.077 2.183 -13.880 1.00 0.00 C ATOM 1284 C ASP A 82 -6.233 3.452 -13.944 1.00 0.00 C ATOM 1285 O ASP A 82 -6.072 4.051 -15.008 1.00 0.00 O ATOM 1286 CB ASP A 82 -8.272 2.396 -12.950 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.420 1.455 -13.257 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -9.781 1.328 -14.446 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -9.958 0.846 -12.309 1.00 0.00 O ATOM 0 H ASP A 82 -6.481 0.745 -12.475 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.442 1.961 -14.883 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.955 2.252 -11.917 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.617 3.426 -13.037 1.00 0.00 H new ATOM 1294 N LEU A 83 -5.698 3.859 -12.798 1.00 0.00 N ATOM 1295 CA LEU A 83 -4.871 5.058 -12.722 1.00 0.00 C ATOM 1296 C LEU A 83 -3.937 5.152 -13.925 1.00 0.00 C ATOM 1297 O LEU A 83 -3.224 4.207 -14.263 1.00 0.00 O ATOM 1298 CB LEU A 83 -4.056 5.060 -11.428 1.00 0.00 C ATOM 1299 CG LEU A 83 -3.656 6.433 -10.888 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -4.884 7.209 -10.439 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -2.665 6.288 -9.742 1.00 0.00 C ATOM 0 H LEU A 83 -5.822 3.376 -11.908 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.531 5.925 -12.728 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.631 4.543 -10.660 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.149 4.478 -11.593 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.173 6.991 -11.690 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.579 8.184 -10.058 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.558 7.345 -11.285 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.396 6.656 -9.652 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.392 7.276 -9.370 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.121 5.711 -8.938 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -1.772 5.774 -10.096 1.00 0.00 H new ATOM 1313 N PRO A 84 -3.937 6.320 -14.585 1.00 0.00 N ATOM 1314 CA PRO A 84 -3.093 6.566 -15.758 1.00 0.00 C ATOM 1315 C PRO A 84 -1.614 6.657 -15.398 1.00 0.00 C ATOM 1316 O PRO A 84 -1.243 6.868 -14.244 1.00 0.00 O ATOM 1317 CB PRO A 84 -3.600 7.911 -16.283 1.00 0.00 C ATOM 1318 CG PRO A 84 -4.189 8.585 -15.093 1.00 0.00 C ATOM 1319 CD PRO A 84 -4.761 7.489 -14.237 1.00 0.00 C ATOM 0 HA PRO A 84 -3.159 5.757 -16.486 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.789 8.500 -16.710 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -4.343 7.775 -17.069 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.431 9.149 -14.549 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.963 9.293 -15.389 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.690 7.729 -13.176 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -5.815 7.317 -14.455 1.00 0.00 H new ATOM 1327 N PRO A 85 -0.747 6.497 -16.410 1.00 0.00 N ATOM 1328 CA PRO A 85 0.706 6.558 -16.225 1.00 0.00 C ATOM 1329 C PRO A 85 1.190 7.968 -15.904 1.00 0.00 C ATOM 1330 O PRO A 85 0.676 8.960 -16.422 1.00 0.00 O ATOM 1331 CB PRO A 85 1.255 6.099 -17.577 1.00 0.00 C ATOM 1332 CG PRO A 85 0.177 6.420 -18.553 1.00 0.00 C ATOM 1333 CD PRO A 85 -1.119 6.243 -17.812 1.00 0.00 C ATOM 0 HA PRO A 85 1.037 5.946 -15.386 1.00 0.00 H new ATOM 0 HB2 PRO A 85 2.181 6.618 -17.825 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.479 5.032 -17.572 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.278 7.440 -18.924 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.225 5.759 -19.419 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -1.879 6.943 -18.159 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -1.524 5.240 -17.945 1.00 0.00 H new ATOM 1341 N PRO A 86 2.203 8.062 -15.030 1.00 0.00 N ATOM 1342 CA PRO A 86 2.780 9.347 -14.622 1.00 0.00 C ATOM 1343 C PRO A 86 3.560 10.016 -15.748 1.00 0.00 C ATOM 1344 O PRO A 86 4.745 9.747 -15.940 1.00 0.00 O ATOM 1345 CB PRO A 86 3.718 8.966 -13.474 1.00 0.00 C ATOM 1346 CG PRO A 86 4.075 7.543 -13.734 1.00 0.00 C ATOM 1347 CD PRO A 86 2.864 6.922 -14.374 1.00 0.00 C ATOM 0 HA PRO A 86 2.012 10.068 -14.342 1.00 0.00 H new ATOM 0 HB2 PRO A 86 4.604 9.600 -13.460 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.228 9.081 -12.507 1.00 0.00 H new ATOM 0 HG2 PRO A 86 4.943 7.472 -14.390 1.00 0.00 H new ATOM 0 HG3 PRO A 86 4.333 7.030 -12.808 1.00 0.00 H new ATOM 0 HD2 PRO A 86 3.140 6.150 -15.092 1.00 0.00 H new ATOM 0 HD3 PRO A 86 2.215 6.452 -13.635 1.00 0.00 H new ATOM 1355 N SER A 87 2.887 10.890 -16.490 1.00 0.00 N ATOM 1356 CA SER A 87 3.516 11.595 -17.600 1.00 0.00 C ATOM 1357 C SER A 87 4.505 12.639 -17.089 1.00 0.00 C ATOM 1358 O SER A 87 5.668 12.657 -17.492 1.00 0.00 O ATOM 1359 CB SER A 87 2.455 12.267 -18.474 1.00 0.00 C ATOM 1360 OG SER A 87 1.885 11.343 -19.385 1.00 0.00 O ATOM 0 H SER A 87 1.906 11.127 -16.342 1.00 0.00 H new ATOM 0 HA SER A 87 4.060 10.865 -18.199 1.00 0.00 H new ATOM 0 HB2 SER A 87 1.673 12.689 -17.843 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.903 13.095 -19.023 1.00 0.00 H new ATOM 0 HG SER A 87 1.209 11.796 -19.931 1.00 0.00 H new ATOM 1366 N SER A 88 4.033 13.507 -16.200 1.00 0.00 N ATOM 1367 CA SER A 88 4.874 14.557 -15.636 1.00 0.00 C ATOM 1368 C SER A 88 4.999 14.398 -14.124 1.00 0.00 C ATOM 1369 O SER A 88 4.222 14.973 -13.362 1.00 0.00 O ATOM 1370 CB SER A 88 4.298 15.934 -15.970 1.00 0.00 C ATOM 1371 OG SER A 88 3.016 16.105 -15.391 1.00 0.00 O ATOM 0 H SER A 88 3.073 13.504 -15.855 1.00 0.00 H new ATOM 0 HA SER A 88 5.867 14.470 -16.076 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.971 16.711 -15.607 1.00 0.00 H new ATOM 0 HB3 SER A 88 4.230 16.051 -17.052 1.00 0.00 H new ATOM 0 HG SER A 88 3.017 15.741 -14.481 1.00 0.00 H new ATOM 1377 N SER A 89 5.984 13.614 -13.697 1.00 0.00 N ATOM 1378 CA SER A 89 6.210 13.376 -12.276 1.00 0.00 C ATOM 1379 C SER A 89 6.382 14.693 -11.525 1.00 0.00 C ATOM 1380 O SER A 89 6.840 15.687 -12.089 1.00 0.00 O ATOM 1381 CB SER A 89 7.446 12.497 -12.076 1.00 0.00 C ATOM 1382 OG SER A 89 7.125 11.125 -12.227 1.00 0.00 O ATOM 0 H SER A 89 6.638 13.133 -14.315 1.00 0.00 H new ATOM 0 HA SER A 89 5.337 12.861 -11.875 1.00 0.00 H new ATOM 0 HB2 SER A 89 8.215 12.775 -12.797 1.00 0.00 H new ATOM 0 HB3 SER A 89 7.862 12.669 -11.083 1.00 0.00 H new ATOM 0 HG SER A 89 7.932 10.584 -12.096 1.00 0.00 H new ATOM 1388 N SER A 90 6.011 14.692 -10.249 1.00 0.00 N ATOM 1389 CA SER A 90 6.120 15.887 -9.420 1.00 0.00 C ATOM 1390 C SER A 90 6.088 15.525 -7.939 1.00 0.00 C ATOM 1391 O SER A 90 5.134 14.912 -7.457 1.00 0.00 O ATOM 1392 CB SER A 90 4.986 16.862 -9.743 1.00 0.00 C ATOM 1393 OG SER A 90 5.332 18.186 -9.376 1.00 0.00 O ATOM 0 H SER A 90 5.632 13.877 -9.766 1.00 0.00 H new ATOM 0 HA SER A 90 7.075 16.366 -9.639 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.762 16.824 -10.809 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.081 16.560 -9.216 1.00 0.00 H new ATOM 0 HG SER A 90 4.592 18.790 -9.594 1.00 0.00 H new ATOM 1399 N HIS A 91 7.139 15.908 -7.220 1.00 0.00 N ATOM 1400 CA HIS A 91 7.232 15.625 -5.792 1.00 0.00 C ATOM 1401 C HIS A 91 8.380 16.405 -5.158 1.00 0.00 C ATOM 1402 O HIS A 91 9.537 16.253 -5.549 1.00 0.00 O ATOM 1403 CB HIS A 91 7.429 14.126 -5.560 1.00 0.00 C ATOM 1404 CG HIS A 91 7.526 13.753 -4.113 1.00 0.00 C ATOM 1405 ND1 HIS A 91 6.460 13.830 -3.242 1.00 0.00 N ATOM 1406 CD2 HIS A 91 8.571 13.294 -3.385 1.00 0.00 C ATOM 1407 CE1 HIS A 91 6.845 13.438 -2.041 1.00 0.00 C ATOM 1408 NE2 HIS A 91 8.123 13.107 -2.101 1.00 0.00 N ATOM 0 H HIS A 91 7.937 16.415 -7.603 1.00 0.00 H new ATOM 0 HA HIS A 91 6.300 15.938 -5.322 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.598 13.584 -6.012 1.00 0.00 H new ATOM 0 HB3 HIS A 91 8.336 13.803 -6.072 1.00 0.00 H new ATOM 0 HD1 HIS A 91 5.520 14.141 -3.487 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.572 13.109 -3.747 1.00 0.00 H new ATOM 0 HE1 HIS A 91 6.222 13.395 -1.160 1.00 0.00 H new ATOM 1417 N ALA A 92 8.051 17.240 -4.178 1.00 0.00 N ATOM 1418 CA ALA A 92 9.054 18.043 -3.489 1.00 0.00 C ATOM 1419 C ALA A 92 8.468 18.708 -2.249 1.00 0.00 C ATOM 1420 O ALA A 92 7.370 19.262 -2.290 1.00 0.00 O ATOM 1421 CB ALA A 92 9.630 19.090 -4.431 1.00 0.00 C ATOM 0 H ALA A 92 7.097 17.378 -3.843 1.00 0.00 H new ATOM 0 HA ALA A 92 9.857 17.379 -3.167 1.00 0.00 H new ATOM 0 HB1 ALA A 92 10.378 19.682 -3.903 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.095 18.596 -5.284 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.831 19.743 -4.781 1.00 0.00 H new ATOM 1427 N GLY A 93 9.208 18.650 -1.146 1.00 0.00 N ATOM 1428 CA GLY A 93 8.744 19.250 0.091 1.00 0.00 C ATOM 1429 C GLY A 93 8.144 18.232 1.041 1.00 0.00 C ATOM 1430 O GLY A 93 6.983 18.347 1.431 1.00 0.00 O ATOM 0 H GLY A 93 10.121 18.198 -1.087 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.577 19.753 0.582 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.000 20.013 -0.136 1.00 0.00 H new ATOM 1434 N ALA A 94 8.937 17.233 1.412 1.00 0.00 N ATOM 1435 CA ALA A 94 8.478 16.190 2.322 1.00 0.00 C ATOM 1436 C ALA A 94 9.204 16.271 3.660 1.00 0.00 C ATOM 1437 O ALA A 94 10.083 17.112 3.852 1.00 0.00 O ATOM 1438 CB ALA A 94 8.674 14.818 1.694 1.00 0.00 C ATOM 0 H ALA A 94 9.901 17.123 1.097 1.00 0.00 H new ATOM 0 HA ALA A 94 7.415 16.344 2.506 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.327 14.049 2.384 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.104 14.757 0.767 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.732 14.663 1.480 1.00 0.00 H new ATOM 1444 N LEU A 95 8.831 15.392 4.584 1.00 0.00 N ATOM 1445 CA LEU A 95 9.446 15.363 5.906 1.00 0.00 C ATOM 1446 C LEU A 95 9.107 14.069 6.637 1.00 0.00 C ATOM 1447 O LEU A 95 8.150 13.380 6.285 1.00 0.00 O ATOM 1448 CB LEU A 95 8.984 16.566 6.731 1.00 0.00 C ATOM 1449 CG LEU A 95 7.539 16.522 7.229 1.00 0.00 C ATOM 1450 CD1 LEU A 95 6.591 16.187 6.087 1.00 0.00 C ATOM 1451 CD2 LEU A 95 7.394 15.513 8.359 1.00 0.00 C ATOM 0 H LEU A 95 8.105 14.690 4.442 1.00 0.00 H new ATOM 0 HA LEU A 95 10.527 15.412 5.778 1.00 0.00 H new ATOM 0 HB2 LEU A 95 9.642 16.664 7.594 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.113 17.465 6.129 1.00 0.00 H new ATOM 0 HG LEU A 95 7.277 17.508 7.614 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.567 16.160 6.460 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.674 16.947 5.310 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.852 15.214 5.672 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.359 15.496 8.701 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.675 14.523 8.001 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.044 15.797 9.186 1.00 0.00 H new ATOM 1463 N GLN A 96 9.895 13.747 7.657 1.00 0.00 N ATOM 1464 CA GLN A 96 9.676 12.536 8.439 1.00 0.00 C ATOM 1465 C GLN A 96 10.466 12.579 9.743 1.00 0.00 C ATOM 1466 O GLN A 96 11.690 12.712 9.734 1.00 0.00 O ATOM 1467 CB GLN A 96 10.074 11.301 7.629 1.00 0.00 C ATOM 1468 CG GLN A 96 9.805 9.989 8.347 1.00 0.00 C ATOM 1469 CD GLN A 96 8.411 9.454 8.083 1.00 0.00 C ATOM 1470 OE1 GLN A 96 7.515 10.197 7.682 1.00 0.00 O ATOM 1471 NE2 GLN A 96 8.221 8.159 8.308 1.00 0.00 N ATOM 0 H GLN A 96 10.691 14.308 7.961 1.00 0.00 H new ATOM 0 HA GLN A 96 8.615 12.477 8.680 1.00 0.00 H new ATOM 0 HB2 GLN A 96 9.531 11.306 6.684 1.00 0.00 H new ATOM 0 HB3 GLN A 96 11.135 11.362 7.387 1.00 0.00 H new ATOM 0 HG2 GLN A 96 10.540 9.249 8.031 1.00 0.00 H new ATOM 0 HG3 GLN A 96 9.938 10.132 9.419 1.00 0.00 H new ATOM 0 HE21 GLN A 96 8.993 7.580 8.640 1.00 0.00 H new ATOM 0 HE22 GLN A 96 7.303 7.743 8.149 1.00 0.00 H new ATOM 1480 N GLU A 97 9.758 12.466 10.863 1.00 0.00 N ATOM 1481 CA GLU A 97 10.395 12.494 12.174 1.00 0.00 C ATOM 1482 C GLU A 97 10.398 11.105 12.807 1.00 0.00 C ATOM 1483 O GLU A 97 9.413 10.687 13.417 1.00 0.00 O ATOM 1484 CB GLU A 97 9.676 13.484 13.093 1.00 0.00 C ATOM 1485 CG GLU A 97 9.823 14.933 12.661 1.00 0.00 C ATOM 1486 CD GLU A 97 9.229 15.904 13.662 1.00 0.00 C ATOM 1487 OE1 GLU A 97 9.947 16.293 14.608 1.00 0.00 O ATOM 1488 OE2 GLU A 97 8.048 16.275 13.501 1.00 0.00 O ATOM 0 H GLU A 97 8.744 12.354 10.888 1.00 0.00 H new ATOM 0 HA GLU A 97 11.428 12.816 12.042 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.617 13.230 13.129 1.00 0.00 H new ATOM 0 HB3 GLU A 97 10.064 13.374 14.106 1.00 0.00 H new ATOM 0 HG2 GLU A 97 10.880 15.161 12.522 1.00 0.00 H new ATOM 0 HG3 GLU A 97 9.338 15.071 11.695 1.00 0.00 H new ATOM 1495 N SER A 98 11.511 10.395 12.656 1.00 0.00 N ATOM 1496 CA SER A 98 11.641 9.052 13.209 1.00 0.00 C ATOM 1497 C SER A 98 13.090 8.577 13.148 1.00 0.00 C ATOM 1498 O SER A 98 13.940 9.219 12.529 1.00 0.00 O ATOM 1499 CB SER A 98 10.741 8.076 12.450 1.00 0.00 C ATOM 1500 OG SER A 98 11.205 7.877 11.126 1.00 0.00 O ATOM 0 H SER A 98 12.336 10.727 12.156 1.00 0.00 H new ATOM 0 HA SER A 98 11.331 9.084 14.253 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.711 7.121 12.975 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.721 8.460 12.427 1.00 0.00 H new ATOM 0 HG SER A 98 10.613 7.248 10.663 1.00 0.00 H new ATOM 1506 N LEU A 99 13.364 7.449 13.793 1.00 0.00 N ATOM 1507 CA LEU A 99 14.710 6.887 13.813 1.00 0.00 C ATOM 1508 C LEU A 99 14.694 5.420 13.393 1.00 0.00 C ATOM 1509 O LEU A 99 13.631 4.823 13.232 1.00 0.00 O ATOM 1510 CB LEU A 99 15.320 7.023 15.209 1.00 0.00 C ATOM 1511 CG LEU A 99 16.012 8.352 15.512 1.00 0.00 C ATOM 1512 CD1 LEU A 99 15.006 9.375 16.017 1.00 0.00 C ATOM 1513 CD2 LEU A 99 17.128 8.153 16.528 1.00 0.00 C ATOM 0 H LEU A 99 12.672 6.905 14.309 1.00 0.00 H new ATOM 0 HA LEU A 99 15.320 7.443 13.101 1.00 0.00 H new ATOM 0 HB2 LEU A 99 14.531 6.871 15.945 1.00 0.00 H new ATOM 0 HB3 LEU A 99 16.044 6.220 15.347 1.00 0.00 H new ATOM 0 HG LEU A 99 16.451 8.730 14.589 1.00 0.00 H new ATOM 0 HD11 LEU A 99 15.517 10.315 16.227 1.00 0.00 H new ATOM 0 HD12 LEU A 99 14.242 9.540 15.257 1.00 0.00 H new ATOM 0 HD13 LEU A 99 14.537 9.005 16.929 1.00 0.00 H new ATOM 0 HD21 LEU A 99 17.609 9.109 16.732 1.00 0.00 H new ATOM 0 HD22 LEU A 99 16.711 7.752 17.452 1.00 0.00 H new ATOM 0 HD23 LEU A 99 17.863 7.454 16.129 1.00 0.00 H new ATOM 1525 N ASN A 100 15.880 4.847 13.220 1.00 0.00 N ATOM 1526 CA ASN A 100 16.002 3.449 12.821 1.00 0.00 C ATOM 1527 C ASN A 100 17.312 2.851 13.327 1.00 0.00 C ATOM 1528 O ASN A 100 18.391 3.203 12.850 1.00 0.00 O ATOM 1529 CB ASN A 100 15.926 3.323 11.298 1.00 0.00 C ATOM 1530 CG ASN A 100 14.935 4.295 10.687 1.00 0.00 C ATOM 1531 OD1 ASN A 100 15.344 5.551 10.551 1.00 0.00 O flip ATOM 1532 ND2 ASN A 100 13.814 3.920 10.341 1.00 0.00 N flip ATOM 0 H ASN A 100 16.770 5.328 13.350 1.00 0.00 H new ATOM 0 HA ASN A 100 15.175 2.897 13.266 1.00 0.00 H new ATOM 0 HB2 ASN A 100 16.914 3.499 10.872 1.00 0.00 H new ATOM 0 HB3 ASN A 100 15.642 2.304 11.034 1.00 0.00 H new ATOM 0 HD21 ASN A 100 13.542 2.945 10.464 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.158 4.585 9.931 1.00 0.00 H new TER 1539 ASN A 100