USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 992 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 92 THR OG1 : rot 180:sc= 0.0668 USER MOD Set 1.2: A 93 GLN : amide:sc= 0.728 K(o=0.79,f=-3.5!) USER MOD Set 2.1: A 16 GLN : amide:sc= -0.678! X(o=0.79!,f=0.44) USER MOD Set 2.2: A 60 GLN : amide:sc= 1.46 K(o=0.79,f=-2.5) USER MOD Set 3.1: A 5 MET CE :methyl 178:sc= -0.906 (180deg=-0.941) USER MOD Set 3.2: A 33 THR OG1 : rot 58:sc= 0.751 USER MOD Set 4.1: A 11 ASN : amide:sc= -0.956! X(o=-3.8!,f=-4) USER MOD Set 4.2: A 13 CYS SG : rot -163:sc= -1.09 USER MOD Set 4.3: A 43 HIS : no HD1:sc= -1.8! X(o=-3.8!,f=-4) USER MOD Set 5.1: A 8 CYS SG : rot 81:sc= -0.774 USER MOD Set 5.2: A 15 SER OG : rot -130:sc= 0.0958 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -125:sc= 0.15 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -179:sc= 1.24 (180deg=1.23) USER MOD Single : A 3 LYS NZ :NH3+ 170:sc= 1.25 (180deg=1.17) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -80:sc= -0.679 USER MOD Single : A 17 MET CE :methyl 167:sc= -2.29 (180deg=-2.44) USER MOD Single : A 23 LYS NZ :NH3+ -179:sc= 1.24 (180deg=1.09) USER MOD Single : A 24 THR OG1 : rot 94:sc= 0.332 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -97:sc= 1.27 USER MOD Single : A 35 CYS SG : rot -93:sc= -0.199 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 72:sc= 0.0019 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 162:sc= -0.454 (180deg=-1.95!) USER MOD Single : A 50 MET CE :methyl 157:sc= -0.167 (180deg=-0.751) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0704 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 175:sc= 0.355 USER MOD Single : A 67 ASN : amide:sc= 1.56 K(o=1.6,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.0134 X(o=0.013,f=-0.1) USER MOD Single : A 73 TYR OH : rot 81:sc= 0.0884 USER MOD Single : A 78 SER OG : rot 87:sc= 0.557 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.653 USER MOD Single : A 82 CYS SG : rot 180:sc= 0.225 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 100 GLN : amide:sc= -2.46! C(o=-2.5!,f=-2!) USER MOD Single : A 107 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.33) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0714 USER MOD Single : A 114 THR OG1 : rot 84:sc= 1.23 USER MOD Single : A 118 GLN : amide:sc= 1.24 K(o=1.2,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 165:sc= 2.51 (180deg=2.33) USER MOD Single : A 125 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 129 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.2) USER MOD Single : A 131 SER OG : rot 83:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.964 -1.751 1.468 1.00 0.00 N ATOM 2 CA MET A 1 1.788 -0.871 0.576 1.00 0.00 C ATOM 3 C MET A 1 3.012 -1.657 0.052 1.00 0.00 C ATOM 4 O MET A 1 3.248 -2.763 0.529 1.00 0.00 O ATOM 5 CB MET A 1 2.151 0.449 1.316 1.00 0.00 C ATOM 6 CG MET A 1 2.269 1.671 0.391 1.00 0.00 C ATOM 7 SD MET A 1 0.788 2.039 -0.592 1.00 0.00 S ATOM 8 CE MET A 1 1.325 3.544 -1.452 1.00 0.00 C ATOM 0 H1 MET A 1 -0.016 -1.775 1.122 1.00 0.00 H new ATOM 0 H2 MET A 1 1.357 -2.714 1.464 1.00 0.00 H new ATOM 0 H3 MET A 1 0.980 -1.375 2.437 1.00 0.00 H new ATOM 0 HA MET A 1 1.216 -0.574 -0.303 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.392 0.650 2.072 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.096 0.311 1.841 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.510 2.544 0.997 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.107 1.514 -0.288 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.523 3.899 -2.100 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.568 4.314 -0.720 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.207 3.324 -2.054 1.00 0.00 H new ATOM 18 N LYS A 2 3.793 -1.152 -0.927 1.00 0.00 N ATOM 19 CA LYS A 2 4.905 -1.930 -1.526 1.00 0.00 C ATOM 20 C LYS A 2 5.901 -2.262 -0.431 1.00 0.00 C ATOM 21 O LYS A 2 6.377 -1.340 0.218 1.00 0.00 O ATOM 22 CB LYS A 2 5.629 -1.205 -2.688 1.00 0.00 C ATOM 23 CG LYS A 2 4.694 -0.691 -3.791 1.00 0.00 C ATOM 24 CD LYS A 2 4.188 0.752 -3.542 1.00 0.00 C ATOM 25 CE LYS A 2 5.113 1.867 -4.073 1.00 0.00 C ATOM 26 NZ LYS A 2 4.739 2.273 -5.461 1.00 0.00 N ATOM 0 H LYS A 2 3.678 -0.217 -1.318 1.00 0.00 H new ATOM 0 HA LYS A 2 4.470 -2.829 -1.962 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.190 -0.363 -2.282 1.00 0.00 H new ATOM 0 HB3 LYS A 2 6.354 -1.888 -3.131 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.217 -0.725 -4.747 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.837 -1.360 -3.873 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.208 0.862 -4.005 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.052 0.893 -2.470 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.058 2.732 -3.412 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.147 1.521 -4.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 5.391 3.012 -5.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.799 1.448 -6.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.767 2.642 -5.465 1.00 0.00 H new ATOM 40 N LYS A 3 6.169 -3.537 -0.169 1.00 0.00 N ATOM 41 CA LYS A 3 6.946 -3.928 1.004 1.00 0.00 C ATOM 42 C LYS A 3 8.393 -4.034 0.573 1.00 0.00 C ATOM 43 O LYS A 3 8.681 -4.632 -0.462 1.00 0.00 O ATOM 44 CB LYS A 3 6.401 -5.215 1.649 1.00 0.00 C ATOM 45 CG LYS A 3 4.869 -5.245 1.798 1.00 0.00 C ATOM 46 CD LYS A 3 4.297 -6.525 2.433 1.00 0.00 C ATOM 47 CE LYS A 3 5.011 -6.962 3.721 1.00 0.00 C ATOM 48 NZ LYS A 3 4.333 -8.110 4.378 1.00 0.00 N ATOM 0 H LYS A 3 5.861 -4.316 -0.751 1.00 0.00 H new ATOM 0 HA LYS A 3 6.864 -3.178 1.790 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.713 -6.070 1.049 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.853 -5.335 2.634 1.00 0.00 H new ATOM 0 HG2 LYS A 3 4.562 -4.391 2.401 1.00 0.00 H new ATOM 0 HG3 LYS A 3 4.422 -5.116 0.812 1.00 0.00 H new ATOM 0 HD2 LYS A 3 3.241 -6.368 2.652 1.00 0.00 H new ATOM 0 HD3 LYS A 3 4.355 -7.335 1.706 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.040 -7.235 3.489 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.053 -6.122 4.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.935 -8.478 5.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 3.424 -7.796 4.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 4.164 -8.860 3.678 1.00 0.00 H new ATOM 62 N VAL A 4 9.286 -3.476 1.378 1.00 0.00 N ATOM 63 CA VAL A 4 10.715 -3.486 1.129 1.00 0.00 C ATOM 64 C VAL A 4 11.383 -4.269 2.248 1.00 0.00 C ATOM 65 O VAL A 4 10.863 -4.326 3.366 1.00 0.00 O ATOM 66 CB VAL A 4 11.281 -2.060 1.009 1.00 0.00 C ATOM 67 CG1 VAL A 4 12.727 -2.099 0.486 1.00 0.00 C ATOM 68 CG2 VAL A 4 10.429 -1.145 0.107 1.00 0.00 C ATOM 0 H VAL A 4 9.029 -2.994 2.240 1.00 0.00 H new ATOM 0 HA VAL A 4 10.920 -3.968 0.173 1.00 0.00 H new ATOM 0 HB VAL A 4 11.258 -1.635 2.013 1.00 0.00 H new ATOM 0 HG11 VAL A 4 13.113 -1.083 0.407 1.00 0.00 H new ATOM 0 HG12 VAL A 4 13.348 -2.670 1.176 1.00 0.00 H new ATOM 0 HG13 VAL A 4 12.746 -2.572 -0.496 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.881 -0.154 0.063 1.00 0.00 H new ATOM 0 HG22 VAL A 4 10.381 -1.566 -0.897 1.00 0.00 H new ATOM 0 HG23 VAL A 4 9.422 -1.067 0.516 1.00 0.00 H new ATOM 78 N MET A 5 12.555 -4.831 1.972 1.00 0.00 N ATOM 79 CA MET A 5 13.314 -5.610 2.927 1.00 0.00 C ATOM 80 C MET A 5 14.763 -5.182 2.820 1.00 0.00 C ATOM 81 O MET A 5 15.277 -5.075 1.705 1.00 0.00 O ATOM 82 CB MET A 5 13.173 -7.087 2.558 1.00 0.00 C ATOM 83 CG MET A 5 13.844 -8.017 3.578 1.00 0.00 C ATOM 84 SD MET A 5 13.289 -7.812 5.294 1.00 0.00 S ATOM 85 CE MET A 5 11.595 -8.440 5.135 1.00 0.00 C ATOM 0 H MET A 5 13.007 -4.753 1.061 1.00 0.00 H new ATOM 0 HA MET A 5 12.958 -5.458 3.946 1.00 0.00 H new ATOM 0 HB2 MET A 5 12.115 -7.339 2.483 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.612 -7.255 1.575 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.666 -9.049 3.276 1.00 0.00 H new ATOM 0 HG3 MET A 5 14.921 -7.855 3.540 1.00 0.00 H new ATOM 0 HE1 MET A 5 11.107 -8.423 6.110 1.00 0.00 H new ATOM 0 HE2 MET A 5 11.038 -7.812 4.439 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.620 -9.463 4.760 1.00 0.00 H new ATOM 95 N PHE A 6 15.415 -4.998 3.966 1.00 0.00 N ATOM 96 CA PHE A 6 16.807 -4.608 4.055 1.00 0.00 C ATOM 97 C PHE A 6 17.535 -5.736 4.780 1.00 0.00 C ATOM 98 O PHE A 6 17.318 -5.950 5.975 1.00 0.00 O ATOM 99 CB PHE A 6 16.949 -3.255 4.751 1.00 0.00 C ATOM 100 CG PHE A 6 16.341 -2.137 3.935 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.963 -1.890 4.033 1.00 0.00 C ATOM 102 CD2 PHE A 6 17.102 -1.444 2.977 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.343 -0.992 3.160 1.00 0.00 C ATOM 104 CE2 PHE A 6 16.488 -0.494 2.142 1.00 0.00 C ATOM 105 CZ PHE A 6 15.105 -0.266 2.230 1.00 0.00 C ATOM 0 H PHE A 6 14.973 -5.121 4.877 1.00 0.00 H new ATOM 0 HA PHE A 6 17.251 -4.468 3.069 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.466 -3.296 5.727 1.00 0.00 H new ATOM 0 HB3 PHE A 6 18.004 -3.045 4.926 1.00 0.00 H new ATOM 0 HD1 PHE A 6 14.379 -2.397 4.787 1.00 0.00 H new ATOM 0 HD2 PHE A 6 18.160 -1.642 2.882 1.00 0.00 H new ATOM 0 HE1 PHE A 6 13.272 -0.856 3.201 1.00 0.00 H new ATOM 0 HE2 PHE A 6 17.081 0.062 1.431 1.00 0.00 H new ATOM 0 HZ PHE A 6 14.631 0.462 1.588 1.00 0.00 H new ATOM 115 N VAL A 7 18.320 -6.519 4.049 1.00 0.00 N ATOM 116 CA VAL A 7 18.906 -7.755 4.565 1.00 0.00 C ATOM 117 C VAL A 7 20.267 -7.400 5.158 1.00 0.00 C ATOM 118 O VAL A 7 21.122 -6.879 4.441 1.00 0.00 O ATOM 119 CB VAL A 7 19.019 -8.821 3.453 1.00 0.00 C ATOM 120 CG1 VAL A 7 19.276 -10.213 4.036 1.00 0.00 C ATOM 121 CG2 VAL A 7 17.759 -8.887 2.564 1.00 0.00 C ATOM 0 H VAL A 7 18.570 -6.317 3.081 1.00 0.00 H new ATOM 0 HA VAL A 7 18.271 -8.192 5.336 1.00 0.00 H new ATOM 0 HB VAL A 7 19.865 -8.514 2.838 1.00 0.00 H new ATOM 0 HG11 VAL A 7 19.350 -10.939 3.226 1.00 0.00 H new ATOM 0 HG12 VAL A 7 20.208 -10.204 4.602 1.00 0.00 H new ATOM 0 HG13 VAL A 7 18.453 -10.489 4.696 1.00 0.00 H new ATOM 0 HG21 VAL A 7 17.893 -9.652 1.800 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.893 -9.135 3.178 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.600 -7.920 2.086 1.00 0.00 H new ATOM 131 N CYS A 8 20.471 -7.636 6.454 1.00 0.00 N ATOM 132 CA CYS A 8 21.671 -7.206 7.158 1.00 0.00 C ATOM 133 C CYS A 8 22.761 -8.299 7.139 1.00 0.00 C ATOM 134 O CYS A 8 22.476 -9.473 6.895 1.00 0.00 O ATOM 135 CB CYS A 8 21.302 -6.801 8.599 1.00 0.00 C ATOM 136 SG CYS A 8 19.836 -5.722 8.698 1.00 0.00 S ATOM 0 H CYS A 8 19.804 -8.133 7.044 1.00 0.00 H new ATOM 0 HA CYS A 8 22.089 -6.340 6.645 1.00 0.00 H new ATOM 0 HB2 CYS A 8 21.121 -7.701 9.186 1.00 0.00 H new ATOM 0 HB3 CYS A 8 22.151 -6.290 9.053 1.00 0.00 H new ATOM 0 HG CYS A 8 18.759 -6.445 8.620 1.00 0.00 H new ATOM 142 N LYS A 9 24.012 -7.900 7.422 1.00 0.00 N ATOM 143 CA LYS A 9 25.174 -8.769 7.670 1.00 0.00 C ATOM 144 C LYS A 9 26.198 -7.912 8.420 1.00 0.00 C ATOM 145 O LYS A 9 26.264 -6.712 8.142 1.00 0.00 O ATOM 146 CB LYS A 9 25.732 -9.289 6.322 1.00 0.00 C ATOM 147 CG LYS A 9 26.895 -10.287 6.483 1.00 0.00 C ATOM 148 CD LYS A 9 27.395 -10.809 5.127 1.00 0.00 C ATOM 149 CE LYS A 9 28.580 -11.769 5.336 1.00 0.00 C ATOM 150 NZ LYS A 9 29.133 -12.282 4.051 1.00 0.00 N ATOM 0 H LYS A 9 24.252 -6.911 7.487 1.00 0.00 H new ATOM 0 HA LYS A 9 24.916 -9.647 8.262 1.00 0.00 H new ATOM 0 HB2 LYS A 9 24.927 -9.768 5.765 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.071 -8.441 5.727 1.00 0.00 H new ATOM 0 HG2 LYS A 9 27.717 -9.804 7.011 1.00 0.00 H new ATOM 0 HG3 LYS A 9 26.570 -11.127 7.098 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.587 -11.323 4.606 1.00 0.00 H new ATOM 0 HD3 LYS A 9 27.700 -9.974 4.497 1.00 0.00 H new ATOM 0 HE2 LYS A 9 29.367 -11.254 5.887 1.00 0.00 H new ATOM 0 HE3 LYS A 9 28.258 -12.610 5.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 29.928 -12.923 4.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 28.391 -12.797 3.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 29.466 -11.484 3.473 1.00 0.00 H new ATOM 164 N ARG A 10 27.056 -8.498 9.260 1.00 0.00 N ATOM 165 CA ARG A 10 27.940 -7.770 10.198 1.00 0.00 C ATOM 166 C ARG A 10 27.091 -6.929 11.152 1.00 0.00 C ATOM 167 O ARG A 10 25.892 -7.189 11.263 1.00 0.00 O ATOM 168 CB ARG A 10 29.044 -6.981 9.434 1.00 0.00 C ATOM 169 CG ARG A 10 30.505 -7.235 9.851 1.00 0.00 C ATOM 170 CD ARG A 10 30.971 -6.744 11.240 1.00 0.00 C ATOM 171 NE ARG A 10 32.021 -7.624 11.792 1.00 0.00 N ATOM 172 CZ ARG A 10 33.338 -7.570 11.546 1.00 0.00 C ATOM 173 NH1 ARG A 10 33.852 -6.692 10.689 1.00 0.00 N ATOM 174 NH2 ARG A 10 34.151 -8.424 12.163 1.00 0.00 N ATOM 0 H ARG A 10 27.164 -9.511 9.314 1.00 0.00 H new ATOM 0 HA ARG A 10 28.492 -8.473 10.821 1.00 0.00 H new ATOM 0 HB2 ARG A 10 28.951 -7.211 8.373 1.00 0.00 H new ATOM 0 HB3 ARG A 10 28.840 -5.917 9.549 1.00 0.00 H new ATOM 0 HG2 ARG A 10 30.681 -8.310 9.803 1.00 0.00 H new ATOM 0 HG3 ARG A 10 31.149 -6.772 9.103 1.00 0.00 H new ATOM 0 HD2 ARG A 10 31.351 -5.726 11.160 1.00 0.00 H new ATOM 0 HD3 ARG A 10 30.121 -6.715 11.922 1.00 0.00 H new ATOM 0 HE ARG A 10 31.709 -8.355 12.432 1.00 0.00 H new ATOM 0 HH11 ARG A 10 33.240 -6.038 10.200 1.00 0.00 H new ATOM 0 HH12 ARG A 10 34.858 -6.673 10.521 1.00 0.00 H new ATOM 0 HH21 ARG A 10 33.770 -9.110 12.815 1.00 0.00 H new ATOM 0 HH22 ARG A 10 35.155 -8.393 11.984 1.00 0.00 H new ATOM 188 N ASN A 11 27.688 -5.972 11.875 1.00 0.00 N ATOM 189 CA ASN A 11 26.934 -5.111 12.780 1.00 0.00 C ATOM 190 C ASN A 11 25.943 -4.358 11.911 1.00 0.00 C ATOM 191 O ASN A 11 26.326 -3.510 11.104 1.00 0.00 O ATOM 192 CB ASN A 11 27.816 -4.166 13.607 1.00 0.00 C ATOM 193 CG ASN A 11 27.004 -3.483 14.711 1.00 0.00 C ATOM 194 OD1 ASN A 11 25.808 -3.709 14.878 1.00 0.00 O ATOM 195 ND2 ASN A 11 27.649 -2.641 15.497 1.00 0.00 N ATOM 0 H ASN A 11 28.689 -5.779 11.847 1.00 0.00 H new ATOM 0 HA ASN A 11 26.428 -5.713 13.535 1.00 0.00 H new ATOM 0 HB2 ASN A 11 28.640 -4.726 14.050 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.257 -3.412 12.956 1.00 0.00 H new ATOM 0 HD21 ASN A 11 27.154 -2.169 16.254 1.00 0.00 H new ATOM 0 HD22 ASN A 11 28.642 -2.462 15.347 1.00 0.00 H new ATOM 202 N SER A 12 24.675 -4.715 12.051 1.00 0.00 N ATOM 203 CA SER A 12 23.567 -4.338 11.191 1.00 0.00 C ATOM 204 C SER A 12 23.259 -2.854 11.092 1.00 0.00 C ATOM 205 O SER A 12 22.331 -2.508 10.374 1.00 0.00 O ATOM 206 CB SER A 12 22.352 -5.131 11.660 1.00 0.00 C ATOM 207 OG SER A 12 22.744 -6.478 11.897 1.00 0.00 O ATOM 0 H SER A 12 24.375 -5.315 12.819 1.00 0.00 H new ATOM 0 HA SER A 12 23.857 -4.580 10.169 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.944 -4.692 12.570 1.00 0.00 H new ATOM 0 HB3 SER A 12 21.565 -5.094 10.907 1.00 0.00 H new ATOM 0 HG SER A 12 22.786 -6.961 11.045 1.00 0.00 H new ATOM 213 N CYS A 13 24.021 -1.969 11.734 1.00 0.00 N ATOM 214 CA CYS A 13 23.836 -0.527 11.671 1.00 0.00 C ATOM 215 C CYS A 13 23.585 -0.048 10.243 1.00 0.00 C ATOM 216 O CYS A 13 22.610 0.645 10.019 1.00 0.00 O ATOM 217 CB CYS A 13 25.066 0.157 12.284 1.00 0.00 C ATOM 218 SG CYS A 13 25.369 -0.572 13.915 1.00 0.00 S ATOM 0 H CYS A 13 24.803 -2.247 12.327 1.00 0.00 H new ATOM 0 HA CYS A 13 22.948 -0.258 12.243 1.00 0.00 H new ATOM 0 HB2 CYS A 13 25.935 0.022 11.641 1.00 0.00 H new ATOM 0 HB3 CYS A 13 24.899 1.230 12.373 1.00 0.00 H new ATOM 0 HG CYS A 13 26.159 0.203 14.597 1.00 0.00 H new ATOM 224 N ARG A 14 24.384 -0.483 9.264 1.00 0.00 N ATOM 225 CA ARG A 14 24.274 0.008 7.874 1.00 0.00 C ATOM 226 C ARG A 14 22.929 -0.348 7.226 1.00 0.00 C ATOM 227 O ARG A 14 22.323 0.461 6.537 1.00 0.00 O ATOM 228 CB ARG A 14 25.487 -0.490 7.036 1.00 0.00 C ATOM 229 CG ARG A 14 25.612 -2.029 6.923 1.00 0.00 C ATOM 230 CD ARG A 14 26.891 -2.476 6.206 1.00 0.00 C ATOM 231 NE ARG A 14 27.077 -3.937 6.319 1.00 0.00 N ATOM 232 CZ ARG A 14 28.047 -4.662 5.741 1.00 0.00 C ATOM 233 NH1 ARG A 14 28.918 -4.119 4.900 1.00 0.00 N ATOM 234 NH2 ARG A 14 28.143 -5.953 6.031 1.00 0.00 N ATOM 0 H ARG A 14 25.119 -1.177 9.403 1.00 0.00 H new ATOM 0 HA ARG A 14 24.302 1.097 7.899 1.00 0.00 H new ATOM 0 HB2 ARG A 14 25.413 -0.071 6.032 1.00 0.00 H new ATOM 0 HB3 ARG A 14 26.402 -0.097 7.479 1.00 0.00 H new ATOM 0 HG2 ARG A 14 25.592 -2.464 7.922 1.00 0.00 H new ATOM 0 HG3 ARG A 14 24.747 -2.420 6.388 1.00 0.00 H new ATOM 0 HD2 ARG A 14 26.841 -2.192 5.155 1.00 0.00 H new ATOM 0 HD3 ARG A 14 27.751 -1.962 6.635 1.00 0.00 H new ATOM 0 HE ARG A 14 26.403 -4.444 6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 14 28.861 -3.125 4.678 1.00 0.00 H new ATOM 0 HH12 ARG A 14 29.645 -4.695 4.476 1.00 0.00 H new ATOM 0 HH21 ARG A 14 27.486 -6.379 6.684 1.00 0.00 H new ATOM 0 HH22 ARG A 14 28.874 -6.519 5.601 1.00 0.00 H new ATOM 248 N SER A 15 22.437 -1.549 7.492 1.00 0.00 N ATOM 249 CA SER A 15 21.299 -2.157 6.810 1.00 0.00 C ATOM 250 C SER A 15 19.999 -1.903 7.567 1.00 0.00 C ATOM 251 O SER A 15 18.990 -1.529 6.974 1.00 0.00 O ATOM 252 CB SER A 15 21.631 -3.644 6.662 1.00 0.00 C ATOM 253 OG SER A 15 22.468 -4.085 7.736 1.00 0.00 O ATOM 0 H SER A 15 22.832 -2.151 8.215 1.00 0.00 H new ATOM 0 HA SER A 15 21.135 -1.716 5.827 1.00 0.00 H new ATOM 0 HB2 SER A 15 20.710 -4.228 6.649 1.00 0.00 H new ATOM 0 HB3 SER A 15 22.132 -3.817 5.709 1.00 0.00 H new ATOM 0 HG SER A 15 23.239 -4.569 7.373 1.00 0.00 H new ATOM 259 N GLN A 16 20.036 -1.985 8.890 1.00 0.00 N ATOM 260 CA GLN A 16 18.926 -1.570 9.730 1.00 0.00 C ATOM 261 C GLN A 16 18.717 -0.051 9.609 1.00 0.00 C ATOM 262 O GLN A 16 17.577 0.414 9.580 1.00 0.00 O ATOM 263 CB GLN A 16 19.178 -2.105 11.150 1.00 0.00 C ATOM 264 CG GLN A 16 19.906 -1.118 12.078 1.00 0.00 C ATOM 265 CD GLN A 16 20.025 -1.625 13.511 1.00 0.00 C ATOM 266 OE1 GLN A 16 21.061 -2.121 13.942 1.00 0.00 O ATOM 267 NE2 GLN A 16 18.972 -1.462 14.289 1.00 0.00 N ATOM 0 H GLN A 16 20.838 -2.342 9.409 1.00 0.00 H new ATOM 0 HA GLN A 16 17.975 -1.995 9.410 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.222 -2.371 11.600 1.00 0.00 H new ATOM 0 HB3 GLN A 16 19.764 -3.021 11.082 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.903 -0.924 11.683 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.373 -0.167 12.078 1.00 0.00 H new ATOM 0 HE21 GLN A 16 18.119 -1.048 13.913 1.00 0.00 H new ATOM 0 HE22 GLN A 16 19.011 -1.750 15.267 1.00 0.00 H new ATOM 276 N MET A 17 19.795 0.735 9.443 1.00 0.00 N ATOM 277 CA MET A 17 19.691 2.163 9.135 1.00 0.00 C ATOM 278 C MET A 17 19.013 2.359 7.798 1.00 0.00 C ATOM 279 O MET A 17 18.217 3.280 7.654 1.00 0.00 O ATOM 280 CB MET A 17 21.065 2.835 9.077 1.00 0.00 C ATOM 281 CG MET A 17 21.038 4.290 8.585 1.00 0.00 C ATOM 282 SD MET A 17 20.339 5.538 9.692 1.00 0.00 S ATOM 283 CE MET A 17 18.531 5.419 9.689 1.00 0.00 C ATOM 0 H MET A 17 20.754 0.397 9.519 1.00 0.00 H new ATOM 0 HA MET A 17 19.107 2.619 9.934 1.00 0.00 H new ATOM 0 HB2 MET A 17 21.512 2.808 10.071 1.00 0.00 H new ATOM 0 HB3 MET A 17 21.713 2.254 8.421 1.00 0.00 H new ATOM 0 HG2 MET A 17 22.061 4.584 8.351 1.00 0.00 H new ATOM 0 HG3 MET A 17 20.477 4.318 7.651 1.00 0.00 H new ATOM 0 HE1 MET A 17 18.127 6.003 10.516 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.142 5.806 8.747 1.00 0.00 H new ATOM 0 HE3 MET A 17 18.235 4.376 9.802 1.00 0.00 H new ATOM 293 N ALA A 18 19.326 1.520 6.818 1.00 0.00 N ATOM 294 CA ALA A 18 18.717 1.655 5.513 1.00 0.00 C ATOM 295 C ALA A 18 17.201 1.516 5.638 1.00 0.00 C ATOM 296 O ALA A 18 16.476 2.329 5.074 1.00 0.00 O ATOM 297 CB ALA A 18 19.362 0.642 4.572 1.00 0.00 C ATOM 0 H ALA A 18 19.990 0.750 6.906 1.00 0.00 H new ATOM 0 HA ALA A 18 18.890 2.643 5.085 1.00 0.00 H new ATOM 0 HB1 ALA A 18 18.915 0.729 3.582 1.00 0.00 H new ATOM 0 HB2 ALA A 18 20.432 0.837 4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 18 19.200 -0.365 4.956 1.00 0.00 H new ATOM 303 N GLU A 19 16.723 0.602 6.488 1.00 0.00 N ATOM 304 CA GLU A 19 15.308 0.546 6.829 1.00 0.00 C ATOM 305 C GLU A 19 14.862 1.815 7.569 1.00 0.00 C ATOM 306 O GLU A 19 13.778 2.311 7.279 1.00 0.00 O ATOM 307 CB GLU A 19 14.999 -0.703 7.659 1.00 0.00 C ATOM 308 CG GLU A 19 13.489 -0.941 7.802 1.00 0.00 C ATOM 309 CD GLU A 19 13.083 -1.335 9.228 1.00 0.00 C ATOM 310 OE1 GLU A 19 13.132 -2.541 9.558 1.00 0.00 O ATOM 311 OE2 GLU A 19 12.759 -0.433 10.037 1.00 0.00 O ATOM 0 H GLU A 19 17.297 -0.104 6.948 1.00 0.00 H new ATOM 0 HA GLU A 19 14.744 0.488 5.898 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.460 -1.573 7.191 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.445 -0.600 8.648 1.00 0.00 H new ATOM 0 HG2 GLU A 19 12.954 -0.036 7.513 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.182 -1.727 7.111 1.00 0.00 H new ATOM 318 N GLY A 20 15.658 2.392 8.480 1.00 0.00 N ATOM 319 CA GLY A 20 15.237 3.551 9.259 1.00 0.00 C ATOM 320 C GLY A 20 15.047 4.776 8.372 1.00 0.00 C ATOM 321 O GLY A 20 14.014 5.439 8.444 1.00 0.00 O ATOM 0 H GLY A 20 16.602 2.068 8.692 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.304 3.325 9.775 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.981 3.766 10.025 1.00 0.00 H new ATOM 325 N PHE A 21 15.997 5.040 7.468 1.00 0.00 N ATOM 326 CA PHE A 21 15.856 6.084 6.458 1.00 0.00 C ATOM 327 C PHE A 21 14.701 5.723 5.535 1.00 0.00 C ATOM 328 O PHE A 21 13.950 6.613 5.162 1.00 0.00 O ATOM 329 CB PHE A 21 17.144 6.265 5.636 1.00 0.00 C ATOM 330 CG PHE A 21 18.196 7.164 6.244 1.00 0.00 C ATOM 331 CD1 PHE A 21 17.900 8.506 6.548 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.503 6.689 6.433 1.00 0.00 C ATOM 333 CE1 PHE A 21 18.891 9.350 7.079 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.487 7.528 6.962 1.00 0.00 C ATOM 335 CZ PHE A 21 20.186 8.859 7.302 1.00 0.00 C ATOM 0 H PHE A 21 16.882 4.535 7.419 1.00 0.00 H new ATOM 0 HA PHE A 21 15.658 7.028 6.965 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.586 5.283 5.469 1.00 0.00 H new ATOM 0 HB3 PHE A 21 16.874 6.664 4.658 1.00 0.00 H new ATOM 0 HD1 PHE A 21 16.906 8.890 6.372 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.749 5.671 6.169 1.00 0.00 H new ATOM 0 HE1 PHE A 21 18.655 10.377 7.315 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.488 7.151 7.111 1.00 0.00 H new ATOM 0 HZ PHE A 21 20.945 9.497 7.731 1.00 0.00 H new ATOM 345 N ALA A 22 14.523 4.456 5.158 1.00 0.00 N ATOM 346 CA ALA A 22 13.483 4.087 4.207 1.00 0.00 C ATOM 347 C ALA A 22 12.094 4.269 4.817 1.00 0.00 C ATOM 348 O ALA A 22 11.219 4.781 4.131 1.00 0.00 O ATOM 349 CB ALA A 22 13.741 2.675 3.677 1.00 0.00 C ATOM 0 H ALA A 22 15.084 3.674 5.497 1.00 0.00 H new ATOM 0 HA ALA A 22 13.515 4.757 3.348 1.00 0.00 H new ATOM 0 HB1 ALA A 22 12.960 2.405 2.966 1.00 0.00 H new ATOM 0 HB2 ALA A 22 14.710 2.645 3.180 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.737 1.968 4.507 1.00 0.00 H new ATOM 355 N LYS A 23 11.865 3.945 6.095 1.00 0.00 N ATOM 356 CA LYS A 23 10.574 4.197 6.738 1.00 0.00 C ATOM 357 C LYS A 23 10.327 5.688 6.967 1.00 0.00 C ATOM 358 O LYS A 23 9.179 6.115 6.998 1.00 0.00 O ATOM 359 CB LYS A 23 10.393 3.335 8.007 1.00 0.00 C ATOM 360 CG LYS A 23 11.164 3.799 9.256 1.00 0.00 C ATOM 361 CD LYS A 23 10.775 2.958 10.486 1.00 0.00 C ATOM 362 CE LYS A 23 11.478 3.459 11.764 1.00 0.00 C ATOM 363 NZ LYS A 23 11.011 2.729 12.975 1.00 0.00 N ATOM 0 H LYS A 23 12.558 3.508 6.703 1.00 0.00 H new ATOM 0 HA LYS A 23 9.792 3.879 6.048 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.331 3.303 8.251 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.698 2.315 7.775 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.236 3.716 9.078 1.00 0.00 H new ATOM 0 HG3 LYS A 23 10.953 4.851 9.448 1.00 0.00 H new ATOM 0 HD2 LYS A 23 9.695 2.996 10.626 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.037 1.915 10.311 1.00 0.00 H new ATOM 0 HE2 LYS A 23 12.556 3.335 11.658 1.00 0.00 H new ATOM 0 HE3 LYS A 23 11.290 4.526 11.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.494 3.106 13.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 9.984 2.854 13.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.228 1.717 12.876 1.00 0.00 H new ATOM 377 N THR A 24 11.392 6.474 7.095 1.00 0.00 N ATOM 378 CA THR A 24 11.359 7.924 7.220 1.00 0.00 C ATOM 379 C THR A 24 11.003 8.579 5.874 1.00 0.00 C ATOM 380 O THR A 24 10.093 9.403 5.791 1.00 0.00 O ATOM 381 CB THR A 24 12.760 8.313 7.738 1.00 0.00 C ATOM 382 OG1 THR A 24 12.839 8.067 9.127 1.00 0.00 O ATOM 383 CG2 THR A 24 13.232 9.729 7.426 1.00 0.00 C ATOM 0 H THR A 24 12.341 6.100 7.115 1.00 0.00 H new ATOM 0 HA THR A 24 10.590 8.274 7.908 1.00 0.00 H new ATOM 0 HB THR A 24 13.446 7.677 7.178 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.211 7.173 9.280 1.00 0.00 H new ATOM 0 HG21 THR A 24 14.228 9.880 7.842 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.264 9.872 6.346 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.542 10.448 7.867 1.00 0.00 H new ATOM 391 N LEU A 25 11.715 8.198 4.812 1.00 0.00 N ATOM 392 CA LEU A 25 11.694 8.846 3.505 1.00 0.00 C ATOM 393 C LEU A 25 10.607 8.273 2.589 1.00 0.00 C ATOM 394 O LEU A 25 10.103 8.970 1.714 1.00 0.00 O ATOM 395 CB LEU A 25 13.066 8.657 2.837 1.00 0.00 C ATOM 396 CG LEU A 25 14.228 9.470 3.427 1.00 0.00 C ATOM 397 CD1 LEU A 25 15.541 9.059 2.746 1.00 0.00 C ATOM 398 CD2 LEU A 25 14.035 10.979 3.241 1.00 0.00 C ATOM 0 H LEU A 25 12.346 7.397 4.843 1.00 0.00 H new ATOM 0 HA LEU A 25 11.472 9.902 3.658 1.00 0.00 H new ATOM 0 HB2 LEU A 25 13.328 7.600 2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 25 12.971 8.913 1.782 1.00 0.00 H new ATOM 0 HG LEU A 25 14.259 9.259 4.496 1.00 0.00 H new ATOM 0 HD11 LEU A 25 16.365 9.637 3.165 1.00 0.00 H new ATOM 0 HD12 LEU A 25 15.721 7.997 2.913 1.00 0.00 H new ATOM 0 HD13 LEU A 25 15.471 9.251 1.675 1.00 0.00 H new ATOM 0 HD21 LEU A 25 14.882 11.510 3.675 1.00 0.00 H new ATOM 0 HD22 LEU A 25 13.968 11.209 2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 25 13.117 11.292 3.738 1.00 0.00 H new ATOM 410 N GLY A 26 10.238 7.009 2.803 1.00 0.00 N ATOM 411 CA GLY A 26 9.254 6.249 2.033 1.00 0.00 C ATOM 412 C GLY A 26 7.903 6.182 2.751 1.00 0.00 C ATOM 413 O GLY A 26 7.050 5.363 2.402 1.00 0.00 O ATOM 0 H GLY A 26 10.641 6.458 3.561 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.123 6.710 1.054 1.00 0.00 H new ATOM 0 HA3 GLY A 26 9.626 5.239 1.863 1.00 0.00 H new ATOM 417 N ALA A 27 7.715 7.010 3.781 1.00 0.00 N ATOM 418 CA ALA A 27 6.548 7.017 4.641 1.00 0.00 C ATOM 419 C ALA A 27 5.295 7.283 3.809 1.00 0.00 C ATOM 420 O ALA A 27 5.214 8.299 3.113 1.00 0.00 O ATOM 421 CB ALA A 27 6.732 8.077 5.736 1.00 0.00 C ATOM 0 H ALA A 27 8.402 7.717 4.042 1.00 0.00 H new ATOM 0 HA ALA A 27 6.430 6.045 5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.856 8.085 6.385 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.618 7.841 6.325 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.852 9.058 5.276 1.00 0.00 H new ATOM 427 N GLY A 28 4.329 6.363 3.873 1.00 0.00 N ATOM 428 CA GLY A 28 3.064 6.494 3.155 1.00 0.00 C ATOM 429 C GLY A 28 3.169 6.174 1.666 1.00 0.00 C ATOM 430 O GLY A 28 2.216 6.404 0.920 1.00 0.00 O ATOM 0 H GLY A 28 4.404 5.508 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.328 5.831 3.609 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.692 7.512 3.274 1.00 0.00 H new ATOM 434 N LYS A 29 4.313 5.642 1.225 1.00 0.00 N ATOM 435 CA LYS A 29 4.610 5.315 -0.156 1.00 0.00 C ATOM 436 C LYS A 29 4.990 3.850 -0.253 1.00 0.00 C ATOM 437 O LYS A 29 4.674 3.197 -1.241 1.00 0.00 O ATOM 438 CB LYS A 29 5.753 6.205 -0.645 1.00 0.00 C ATOM 439 CG LYS A 29 5.399 7.698 -0.648 1.00 0.00 C ATOM 440 CD LYS A 29 4.381 8.079 -1.735 1.00 0.00 C ATOM 441 CE LYS A 29 4.181 9.602 -1.764 1.00 0.00 C ATOM 442 NZ LYS A 29 3.241 10.030 -2.835 1.00 0.00 N ATOM 0 H LYS A 29 5.085 5.421 1.855 1.00 0.00 H new ATOM 0 HA LYS A 29 3.736 5.490 -0.783 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.625 6.046 -0.011 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.034 5.903 -1.654 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.997 7.971 0.328 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.309 8.280 -0.792 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.730 7.732 -2.708 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.429 7.584 -1.542 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.802 9.934 -0.798 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.144 10.090 -1.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.139 11.065 -2.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.613 9.737 -3.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.313 9.587 -2.680 1.00 0.00 H new ATOM 456 N ILE A 30 5.617 3.312 0.792 1.00 0.00 N ATOM 457 CA ILE A 30 6.037 1.926 0.900 1.00 0.00 C ATOM 458 C ILE A 30 5.841 1.445 2.340 1.00 0.00 C ATOM 459 O ILE A 30 5.494 2.218 3.232 1.00 0.00 O ATOM 460 CB ILE A 30 7.512 1.796 0.455 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.470 2.703 1.259 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.623 2.096 -1.044 1.00 0.00 C ATOM 463 CD1 ILE A 30 9.921 2.207 1.281 1.00 0.00 C ATOM 0 H ILE A 30 5.854 3.859 1.620 1.00 0.00 H new ATOM 0 HA ILE A 30 5.431 1.298 0.247 1.00 0.00 H new ATOM 0 HB ILE A 30 7.821 0.770 0.656 1.00 0.00 H new ATOM 0 HG12 ILE A 30 8.446 3.707 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.107 2.781 2.284 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.663 2.004 -1.357 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.012 1.388 -1.603 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.273 3.110 -1.239 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.532 2.896 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 30 9.960 1.216 1.733 1.00 0.00 H new ATOM 0 HD13 ILE A 30 10.304 2.157 0.262 1.00 0.00 H new ATOM 475 N ALA A 31 6.089 0.155 2.539 1.00 0.00 N ATOM 476 CA ALA A 31 6.202 -0.508 3.830 1.00 0.00 C ATOM 477 C ALA A 31 7.640 -1.008 3.870 1.00 0.00 C ATOM 478 O ALA A 31 8.195 -1.362 2.833 1.00 0.00 O ATOM 479 CB ALA A 31 5.182 -1.649 3.927 1.00 0.00 C ATOM 0 H ALA A 31 6.224 -0.490 1.760 1.00 0.00 H new ATOM 0 HA ALA A 31 5.988 0.146 4.675 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.275 -2.139 4.896 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.175 -1.247 3.818 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.370 -2.374 3.135 1.00 0.00 H new ATOM 485 N VAL A 32 8.261 -1.025 5.039 1.00 0.00 N ATOM 486 CA VAL A 32 9.692 -1.237 5.176 1.00 0.00 C ATOM 487 C VAL A 32 9.994 -2.230 6.318 1.00 0.00 C ATOM 488 O VAL A 32 9.326 -2.185 7.356 1.00 0.00 O ATOM 489 CB VAL A 32 10.310 0.162 5.423 1.00 0.00 C ATOM 490 CG1 VAL A 32 11.755 0.219 4.972 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.583 1.350 4.748 1.00 0.00 C ATOM 0 H VAL A 32 7.780 -0.890 5.928 1.00 0.00 H new ATOM 0 HA VAL A 32 10.125 -1.687 4.283 1.00 0.00 H new ATOM 0 HB VAL A 32 10.207 0.280 6.502 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.156 1.215 5.160 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.338 -0.518 5.525 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.812 0.001 3.906 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.102 2.278 4.989 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.578 1.207 3.667 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.557 1.403 5.112 1.00 0.00 H new ATOM 501 N THR A 33 10.998 -3.104 6.139 1.00 0.00 N ATOM 502 CA THR A 33 11.347 -4.163 7.101 1.00 0.00 C ATOM 503 C THR A 33 12.851 -4.494 7.020 1.00 0.00 C ATOM 504 O THR A 33 13.477 -4.234 5.991 1.00 0.00 O ATOM 505 CB THR A 33 10.496 -5.428 6.831 1.00 0.00 C ATOM 506 OG1 THR A 33 9.568 -5.300 5.757 1.00 0.00 O ATOM 507 CG2 THR A 33 9.690 -5.842 8.062 1.00 0.00 C ATOM 0 H THR A 33 11.597 -3.095 5.313 1.00 0.00 H new ATOM 0 HA THR A 33 11.131 -3.805 8.108 1.00 0.00 H new ATOM 0 HB THR A 33 11.239 -6.179 6.564 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.050 -5.075 4.934 1.00 0.00 H new ATOM 0 HG21 THR A 33 9.106 -6.733 7.832 1.00 0.00 H new ATOM 0 HG22 THR A 33 10.370 -6.056 8.887 1.00 0.00 H new ATOM 0 HG23 THR A 33 9.018 -5.032 8.346 1.00 0.00 H new ATOM 515 N SER A 34 13.437 -5.104 8.054 1.00 0.00 N ATOM 516 CA SER A 34 14.847 -5.502 8.103 1.00 0.00 C ATOM 517 C SER A 34 14.950 -6.940 8.636 1.00 0.00 C ATOM 518 O SER A 34 14.039 -7.410 9.323 1.00 0.00 O ATOM 519 CB SER A 34 15.666 -4.491 8.923 1.00 0.00 C ATOM 520 OG SER A 34 15.061 -4.140 10.154 1.00 0.00 O ATOM 0 H SER A 34 12.928 -5.342 8.906 1.00 0.00 H new ATOM 0 HA SER A 34 15.276 -5.494 7.101 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.653 -4.909 9.119 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.814 -3.589 8.330 1.00 0.00 H new ATOM 0 HG SER A 34 14.574 -3.296 10.050 1.00 0.00 H new ATOM 526 N CYS A 35 16.039 -7.653 8.316 1.00 0.00 N ATOM 527 CA CYS A 35 16.252 -9.041 8.743 1.00 0.00 C ATOM 528 C CYS A 35 17.745 -9.361 8.865 1.00 0.00 C ATOM 529 O CYS A 35 18.567 -8.600 8.357 1.00 0.00 O ATOM 530 CB CYS A 35 15.557 -9.987 7.746 1.00 0.00 C ATOM 531 SG CYS A 35 16.123 -9.751 6.037 1.00 0.00 S ATOM 0 H CYS A 35 16.801 -7.280 7.750 1.00 0.00 H new ATOM 0 HA CYS A 35 15.816 -9.182 9.732 1.00 0.00 H new ATOM 0 HB2 CYS A 35 15.739 -11.019 8.045 1.00 0.00 H new ATOM 0 HB3 CYS A 35 14.480 -9.828 7.792 1.00 0.00 H new ATOM 0 HG CYS A 35 15.342 -8.904 5.434 1.00 0.00 H new ATOM 537 N GLY A 36 18.101 -10.492 9.488 1.00 0.00 N ATOM 538 CA GLY A 36 19.485 -10.985 9.547 1.00 0.00 C ATOM 539 C GLY A 36 20.394 -10.105 10.404 1.00 0.00 C ATOM 540 O GLY A 36 21.534 -9.848 10.019 1.00 0.00 O ATOM 0 H GLY A 36 17.433 -11.095 9.969 1.00 0.00 H new ATOM 0 HA2 GLY A 36 19.487 -11.999 9.947 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.889 -11.040 8.536 1.00 0.00 H new ATOM 544 N LEU A 37 19.871 -9.588 11.526 1.00 0.00 N ATOM 545 CA LEU A 37 20.476 -8.559 12.386 1.00 0.00 C ATOM 546 C LEU A 37 21.718 -9.068 13.161 1.00 0.00 C ATOM 547 O LEU A 37 21.692 -9.124 14.394 1.00 0.00 O ATOM 548 CB LEU A 37 19.391 -7.998 13.334 1.00 0.00 C ATOM 549 CG LEU A 37 19.751 -6.637 13.969 1.00 0.00 C ATOM 550 CD1 LEU A 37 19.226 -5.493 13.089 1.00 0.00 C ATOM 551 CD2 LEU A 37 19.140 -6.476 15.368 1.00 0.00 C ATOM 0 H LEU A 37 18.964 -9.894 11.877 1.00 0.00 H new ATOM 0 HA LEU A 37 20.851 -7.758 11.749 1.00 0.00 H new ATOM 0 HB2 LEU A 37 18.458 -7.893 12.780 1.00 0.00 H new ATOM 0 HB3 LEU A 37 19.209 -8.721 14.129 1.00 0.00 H new ATOM 0 HG LEU A 37 20.837 -6.602 14.050 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.484 -4.536 13.544 1.00 0.00 H new ATOM 0 HD12 LEU A 37 19.678 -5.558 12.099 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.143 -5.571 12.999 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.419 -5.505 15.777 1.00 0.00 H new ATOM 0 HD22 LEU A 37 18.054 -6.543 15.301 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.513 -7.265 16.021 1.00 0.00 H new ATOM 563 N GLU A 38 22.765 -9.547 12.468 1.00 0.00 N ATOM 564 CA GLU A 38 23.936 -10.252 13.005 1.00 0.00 C ATOM 565 C GLU A 38 23.609 -11.467 13.893 1.00 0.00 C ATOM 566 O GLU A 38 24.516 -12.053 14.489 1.00 0.00 O ATOM 567 CB GLU A 38 24.829 -9.263 13.764 1.00 0.00 C ATOM 568 CG GLU A 38 26.323 -9.594 13.601 1.00 0.00 C ATOM 569 CD GLU A 38 27.268 -8.556 14.237 1.00 0.00 C ATOM 570 OE1 GLU A 38 26.908 -7.899 15.244 1.00 0.00 O ATOM 571 OE2 GLU A 38 28.412 -8.425 13.738 1.00 0.00 O ATOM 0 H GLU A 38 22.817 -9.445 11.454 1.00 0.00 H new ATOM 0 HA GLU A 38 24.459 -10.663 12.141 1.00 0.00 H new ATOM 0 HB2 GLU A 38 24.640 -8.252 13.402 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.568 -9.277 14.822 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.519 -10.569 14.046 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.553 -9.676 12.539 1.00 0.00 H new ATOM 578 N SER A 39 22.335 -11.860 13.970 1.00 0.00 N ATOM 579 CA SER A 39 21.828 -12.834 14.931 1.00 0.00 C ATOM 580 C SER A 39 22.137 -12.399 16.380 1.00 0.00 C ATOM 581 O SER A 39 22.358 -13.241 17.257 1.00 0.00 O ATOM 582 CB SER A 39 22.354 -14.230 14.573 1.00 0.00 C ATOM 583 OG SER A 39 22.006 -14.581 13.237 1.00 0.00 O ATOM 0 H SER A 39 21.612 -11.498 13.348 1.00 0.00 H new ATOM 0 HA SER A 39 20.741 -12.882 14.874 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.438 -14.255 14.688 1.00 0.00 H new ATOM 0 HB3 SER A 39 21.943 -14.965 15.265 1.00 0.00 H new ATOM 0 HG SER A 39 22.354 -15.474 13.032 1.00 0.00 H new ATOM 589 N SER A 40 22.128 -11.082 16.628 1.00 0.00 N ATOM 590 CA SER A 40 22.473 -10.462 17.904 1.00 0.00 C ATOM 591 C SER A 40 21.393 -9.430 18.265 1.00 0.00 C ATOM 592 O SER A 40 20.251 -9.827 18.508 1.00 0.00 O ATOM 593 CB SER A 40 23.910 -9.910 17.851 1.00 0.00 C ATOM 594 OG SER A 40 24.854 -10.949 17.635 1.00 0.00 O ATOM 0 H SER A 40 21.870 -10.399 15.916 1.00 0.00 H new ATOM 0 HA SER A 40 22.480 -11.191 18.715 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.989 -9.172 17.053 1.00 0.00 H new ATOM 0 HB3 SER A 40 24.139 -9.396 18.784 1.00 0.00 H new ATOM 0 HG SER A 40 24.778 -11.274 16.714 1.00 0.00 H new ATOM 600 N ARG A 41 21.715 -8.130 18.330 1.00 0.00 N ATOM 601 CA ARG A 41 20.791 -7.055 18.705 1.00 0.00 C ATOM 602 C ARG A 41 21.280 -5.732 18.104 1.00 0.00 C ATOM 603 O ARG A 41 22.331 -5.701 17.461 1.00 0.00 O ATOM 604 CB ARG A 41 20.587 -7.004 20.239 1.00 0.00 C ATOM 605 CG ARG A 41 21.742 -6.476 21.109 1.00 0.00 C ATOM 606 CD ARG A 41 22.966 -7.393 21.204 1.00 0.00 C ATOM 607 NE ARG A 41 22.646 -8.711 21.790 1.00 0.00 N ATOM 608 CZ ARG A 41 23.517 -9.705 22.022 1.00 0.00 C ATOM 609 NH1 ARG A 41 24.809 -9.563 21.732 1.00 0.00 N ATOM 610 NH2 ARG A 41 23.084 -10.851 22.541 1.00 0.00 N ATOM 0 H ARG A 41 22.653 -7.790 18.117 1.00 0.00 H new ATOM 0 HA ARG A 41 19.802 -7.252 18.290 1.00 0.00 H new ATOM 0 HB2 ARG A 41 19.711 -6.387 20.438 1.00 0.00 H new ATOM 0 HB3 ARG A 41 20.350 -8.013 20.577 1.00 0.00 H new ATOM 0 HG2 ARG A 41 22.061 -5.512 20.713 1.00 0.00 H new ATOM 0 HG3 ARG A 41 21.364 -6.298 22.116 1.00 0.00 H new ATOM 0 HD2 ARG A 41 23.387 -7.535 20.209 1.00 0.00 H new ATOM 0 HD3 ARG A 41 23.733 -6.908 21.808 1.00 0.00 H new ATOM 0 HE ARG A 41 21.672 -8.881 22.042 1.00 0.00 H new ATOM 0 HH11 ARG A 41 25.148 -8.690 21.328 1.00 0.00 H new ATOM 0 HH12 ARG A 41 25.460 -10.327 21.914 1.00 0.00 H new ATOM 0 HH21 ARG A 41 22.095 -10.970 22.760 1.00 0.00 H new ATOM 0 HH22 ARG A 41 23.741 -11.610 22.720 1.00 0.00 H new ATOM 624 N VAL A 42 20.510 -4.655 18.285 1.00 0.00 N ATOM 625 CA VAL A 42 20.823 -3.319 17.789 1.00 0.00 C ATOM 626 C VAL A 42 22.048 -2.733 18.496 1.00 0.00 C ATOM 627 O VAL A 42 22.575 -3.314 19.447 1.00 0.00 O ATOM 628 CB VAL A 42 19.571 -2.423 17.922 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.361 -3.035 17.213 1.00 0.00 C ATOM 630 CG2 VAL A 42 19.173 -2.106 19.373 1.00 0.00 C ATOM 0 H VAL A 42 19.628 -4.694 18.795 1.00 0.00 H new ATOM 0 HA VAL A 42 21.090 -3.375 16.734 1.00 0.00 H new ATOM 0 HB VAL A 42 19.861 -1.487 17.445 1.00 0.00 H new ATOM 0 HG11 VAL A 42 17.500 -2.376 17.329 1.00 0.00 H new ATOM 0 HG12 VAL A 42 18.584 -3.158 16.153 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.136 -4.007 17.652 1.00 0.00 H new ATOM 0 HG21 VAL A 42 18.286 -1.473 19.377 1.00 0.00 H new ATOM 0 HG22 VAL A 42 18.959 -3.034 19.903 1.00 0.00 H new ATOM 0 HG23 VAL A 42 19.992 -1.586 19.870 1.00 0.00 H new ATOM 640 N HIS A 43 22.484 -1.556 18.042 1.00 0.00 N ATOM 641 CA HIS A 43 23.748 -0.961 18.449 1.00 0.00 C ATOM 642 C HIS A 43 23.532 0.510 18.811 1.00 0.00 C ATOM 643 O HIS A 43 23.430 1.342 17.910 1.00 0.00 O ATOM 644 CB HIS A 43 24.748 -1.151 17.310 1.00 0.00 C ATOM 645 CG HIS A 43 26.169 -0.814 17.694 1.00 0.00 C ATOM 646 ND1 HIS A 43 27.011 0.074 17.054 1.00 0.00 N ATOM 647 CD2 HIS A 43 26.890 -1.393 18.706 1.00 0.00 C ATOM 648 CE1 HIS A 43 28.204 0.034 17.678 1.00 0.00 C ATOM 649 NE2 HIS A 43 28.179 -0.848 18.692 1.00 0.00 N ATOM 0 H HIS A 43 21.961 -0.988 17.376 1.00 0.00 H new ATOM 0 HA HIS A 43 24.149 -1.444 19.340 1.00 0.00 H new ATOM 0 HB2 HIS A 43 24.707 -2.186 16.970 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.450 -0.527 16.467 1.00 0.00 H new ATOM 0 HD2 HIS A 43 26.526 -2.141 19.395 1.00 0.00 H new ATOM 0 HE1 HIS A 43 29.062 0.629 17.402 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.946 -1.075 19.325 1.00 0.00 H new ATOM 657 N PRO A 44 23.405 0.845 20.104 1.00 0.00 N ATOM 658 CA PRO A 44 23.197 2.194 20.621 1.00 0.00 C ATOM 659 C PRO A 44 24.029 3.308 19.973 1.00 0.00 C ATOM 660 O PRO A 44 23.518 4.414 19.820 1.00 0.00 O ATOM 661 CB PRO A 44 23.445 2.075 22.124 1.00 0.00 C ATOM 662 CG PRO A 44 22.857 0.702 22.431 1.00 0.00 C ATOM 663 CD PRO A 44 23.152 -0.113 21.172 1.00 0.00 C ATOM 0 HA PRO A 44 22.187 2.523 20.374 1.00 0.00 H new ATOM 0 HB2 PRO A 44 24.506 2.129 22.369 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.948 2.867 22.684 1.00 0.00 H new ATOM 0 HG2 PRO A 44 23.319 0.257 23.312 1.00 0.00 H new ATOM 0 HG3 PRO A 44 21.786 0.761 22.628 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.015 -0.761 21.324 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.310 -0.758 20.922 1.00 0.00 H new ATOM 671 N THR A 45 25.263 3.045 19.534 1.00 0.00 N ATOM 672 CA THR A 45 26.071 4.045 18.837 1.00 0.00 C ATOM 673 C THR A 45 25.418 4.441 17.503 1.00 0.00 C ATOM 674 O THR A 45 25.373 5.624 17.170 1.00 0.00 O ATOM 675 CB THR A 45 27.509 3.514 18.663 1.00 0.00 C ATOM 676 OG1 THR A 45 27.946 2.919 19.878 1.00 0.00 O ATOM 677 CG2 THR A 45 28.475 4.640 18.282 1.00 0.00 C ATOM 0 H THR A 45 25.725 2.143 19.651 1.00 0.00 H new ATOM 0 HA THR A 45 26.124 4.956 19.433 1.00 0.00 H new ATOM 0 HB THR A 45 27.502 2.776 17.861 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.859 2.580 19.767 1.00 0.00 H new ATOM 0 HG21 THR A 45 29.480 4.234 18.167 1.00 0.00 H new ATOM 0 HG22 THR A 45 28.156 5.091 17.342 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.478 5.398 19.066 1.00 0.00 H new ATOM 685 N ALA A 46 24.833 3.488 16.760 1.00 0.00 N ATOM 686 CA ALA A 46 24.080 3.814 15.554 1.00 0.00 C ATOM 687 C ALA A 46 22.825 4.572 15.939 1.00 0.00 C ATOM 688 O ALA A 46 22.537 5.591 15.327 1.00 0.00 O ATOM 689 CB ALA A 46 23.740 2.552 14.748 1.00 0.00 C ATOM 0 H ALA A 46 24.871 2.492 16.978 1.00 0.00 H new ATOM 0 HA ALA A 46 24.696 4.444 14.912 1.00 0.00 H new ATOM 0 HB1 ALA A 46 23.179 2.830 13.856 1.00 0.00 H new ATOM 0 HB2 ALA A 46 24.661 2.048 14.455 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.138 1.880 15.360 1.00 0.00 H new ATOM 695 N ILE A 47 22.122 4.132 16.986 1.00 0.00 N ATOM 696 CA ILE A 47 20.900 4.805 17.437 1.00 0.00 C ATOM 697 C ILE A 47 21.234 6.274 17.694 1.00 0.00 C ATOM 698 O ILE A 47 20.507 7.140 17.223 1.00 0.00 O ATOM 699 CB ILE A 47 20.268 4.121 18.663 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.467 2.857 18.309 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.333 5.059 19.452 1.00 0.00 C ATOM 702 CD1 ILE A 47 20.283 1.629 17.905 1.00 0.00 C ATOM 0 H ILE A 47 22.378 3.313 17.537 1.00 0.00 H new ATOM 0 HA ILE A 47 20.140 4.736 16.659 1.00 0.00 H new ATOM 0 HB ILE A 47 21.125 3.845 19.278 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.851 2.591 19.168 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.788 3.100 17.492 1.00 0.00 H new ATOM 0 HG21 ILE A 47 18.916 4.524 20.305 1.00 0.00 H new ATOM 0 HG22 ILE A 47 19.897 5.922 19.806 1.00 0.00 H new ATOM 0 HG23 ILE A 47 18.524 5.395 18.804 1.00 0.00 H new ATOM 0 HD11 ILE A 47 19.609 0.803 17.679 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.879 1.862 17.023 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.943 1.345 18.724 1.00 0.00 H new ATOM 714 N ALA A 48 22.357 6.564 18.352 1.00 0.00 N ATOM 715 CA ALA A 48 22.780 7.930 18.605 1.00 0.00 C ATOM 716 C ALA A 48 23.018 8.696 17.308 1.00 0.00 C ATOM 717 O ALA A 48 22.582 9.836 17.185 1.00 0.00 O ATOM 718 CB ALA A 48 24.039 7.952 19.469 1.00 0.00 C ATOM 0 H ALA A 48 22.993 5.857 18.721 1.00 0.00 H new ATOM 0 HA ALA A 48 21.972 8.427 19.143 1.00 0.00 H new ATOM 0 HB1 ALA A 48 24.340 8.984 19.647 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.835 7.464 20.422 1.00 0.00 H new ATOM 0 HB3 ALA A 48 24.842 7.424 18.955 1.00 0.00 H new ATOM 724 N MET A 49 23.671 8.077 16.321 1.00 0.00 N ATOM 725 CA MET A 49 23.903 8.733 15.037 1.00 0.00 C ATOM 726 C MET A 49 22.602 8.997 14.291 1.00 0.00 C ATOM 727 O MET A 49 22.574 9.852 13.405 1.00 0.00 O ATOM 728 CB MET A 49 24.849 7.954 14.131 1.00 0.00 C ATOM 729 CG MET A 49 26.264 7.888 14.694 1.00 0.00 C ATOM 730 SD MET A 49 27.022 9.388 15.384 1.00 0.00 S ATOM 731 CE MET A 49 26.834 9.000 17.142 1.00 0.00 C ATOM 0 H MET A 49 24.045 7.130 16.387 1.00 0.00 H new ATOM 0 HA MET A 49 24.377 9.683 15.285 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.467 6.942 13.994 1.00 0.00 H new ATOM 0 HB3 MET A 49 24.873 8.421 13.147 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.269 7.129 15.477 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.916 7.529 13.898 1.00 0.00 H new ATOM 0 HE1 MET A 49 27.507 9.627 17.727 1.00 0.00 H new ATOM 0 HE2 MET A 49 25.805 9.189 17.448 1.00 0.00 H new ATOM 0 HE3 MET A 49 27.076 7.951 17.311 1.00 0.00 H new ATOM 741 N MET A 50 21.537 8.267 14.612 1.00 0.00 N ATOM 742 CA MET A 50 20.273 8.408 13.915 1.00 0.00 C ATOM 743 C MET A 50 19.420 9.403 14.682 1.00 0.00 C ATOM 744 O MET A 50 18.739 10.220 14.075 1.00 0.00 O ATOM 745 CB MET A 50 19.606 7.043 13.742 1.00 0.00 C ATOM 746 CG MET A 50 20.507 6.025 13.033 1.00 0.00 C ATOM 747 SD MET A 50 21.990 6.624 12.149 1.00 0.00 S ATOM 748 CE MET A 50 22.999 5.128 12.105 1.00 0.00 C ATOM 0 H MET A 50 21.530 7.569 15.356 1.00 0.00 H new ATOM 0 HA MET A 50 20.419 8.795 12.906 1.00 0.00 H new ATOM 0 HB2 MET A 50 19.327 6.654 14.721 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.685 7.164 13.172 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.837 5.302 13.779 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.891 5.484 12.315 1.00 0.00 H new ATOM 0 HE1 MET A 50 23.713 5.195 11.284 1.00 0.00 H new ATOM 0 HE2 MET A 50 23.538 5.025 13.047 1.00 0.00 H new ATOM 0 HE3 MET A 50 22.356 4.260 11.957 1.00 0.00 H new ATOM 758 N GLU A 51 19.538 9.434 16.005 1.00 0.00 N ATOM 759 CA GLU A 51 18.964 10.448 16.866 1.00 0.00 C ATOM 760 C GLU A 51 19.554 11.825 16.520 1.00 0.00 C ATOM 761 O GLU A 51 18.833 12.823 16.508 1.00 0.00 O ATOM 762 CB GLU A 51 19.240 10.036 18.324 1.00 0.00 C ATOM 763 CG GLU A 51 18.569 10.973 19.332 1.00 0.00 C ATOM 764 CD GLU A 51 18.771 10.480 20.775 1.00 0.00 C ATOM 765 OE1 GLU A 51 19.857 10.724 21.357 1.00 0.00 O ATOM 766 OE2 GLU A 51 17.840 9.860 21.345 1.00 0.00 O ATOM 0 H GLU A 51 20.057 8.724 16.522 1.00 0.00 H new ATOM 0 HA GLU A 51 17.886 10.529 16.723 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.884 9.018 18.485 1.00 0.00 H new ATOM 0 HB3 GLU A 51 20.316 10.029 18.499 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.980 11.977 19.228 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.503 11.041 19.115 1.00 0.00 H new ATOM 773 N GLU A 52 20.828 11.859 16.123 1.00 0.00 N ATOM 774 CA GLU A 52 21.546 13.018 15.596 1.00 0.00 C ATOM 775 C GLU A 52 20.918 13.554 14.288 1.00 0.00 C ATOM 776 O GLU A 52 21.307 14.628 13.827 1.00 0.00 O ATOM 777 CB GLU A 52 23.031 12.642 15.394 1.00 0.00 C ATOM 778 CG GLU A 52 23.902 12.776 16.655 1.00 0.00 C ATOM 779 CD GLU A 52 24.289 14.243 16.910 1.00 0.00 C ATOM 780 OE1 GLU A 52 25.287 14.704 16.306 1.00 0.00 O ATOM 781 OE2 GLU A 52 23.612 14.931 17.712 1.00 0.00 O ATOM 0 H GLU A 52 21.419 11.029 16.164 1.00 0.00 H new ATOM 0 HA GLU A 52 21.471 13.829 16.320 1.00 0.00 H new ATOM 0 HB2 GLU A 52 23.087 11.613 15.037 1.00 0.00 H new ATOM 0 HB3 GLU A 52 23.449 13.274 14.611 1.00 0.00 H new ATOM 0 HG2 GLU A 52 23.362 12.385 17.517 1.00 0.00 H new ATOM 0 HG3 GLU A 52 24.803 12.173 16.543 1.00 0.00 H new ATOM 788 N VAL A 53 19.945 12.844 13.701 1.00 0.00 N ATOM 789 CA VAL A 53 19.174 13.265 12.528 1.00 0.00 C ATOM 790 C VAL A 53 17.660 12.999 12.736 1.00 0.00 C ATOM 791 O VAL A 53 16.861 13.130 11.807 1.00 0.00 O ATOM 792 CB VAL A 53 19.826 12.648 11.260 1.00 0.00 C ATOM 793 CG1 VAL A 53 19.812 11.114 11.227 1.00 0.00 C ATOM 794 CG2 VAL A 53 19.297 13.204 9.932 1.00 0.00 C ATOM 0 H VAL A 53 19.664 11.926 14.045 1.00 0.00 H new ATOM 0 HA VAL A 53 19.212 14.344 12.379 1.00 0.00 H new ATOM 0 HB VAL A 53 20.863 12.970 11.355 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.286 10.765 10.309 1.00 0.00 H new ATOM 0 HG12 VAL A 53 20.358 10.727 12.087 1.00 0.00 H new ATOM 0 HG13 VAL A 53 18.782 10.759 11.261 1.00 0.00 H new ATOM 0 HG21 VAL A 53 19.809 12.715 9.103 1.00 0.00 H new ATOM 0 HG22 VAL A 53 18.226 13.015 9.859 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.479 14.278 9.889 1.00 0.00 H new ATOM 804 N GLY A 54 17.235 12.692 13.970 1.00 0.00 N ATOM 805 CA GLY A 54 15.831 12.523 14.331 1.00 0.00 C ATOM 806 C GLY A 54 15.197 11.251 13.753 1.00 0.00 C ATOM 807 O GLY A 54 14.025 11.285 13.367 1.00 0.00 O ATOM 0 H GLY A 54 17.872 12.553 14.754 1.00 0.00 H new ATOM 0 HA2 GLY A 54 15.744 12.501 15.417 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.268 13.390 13.984 1.00 0.00 H new ATOM 811 N ILE A 55 15.948 10.143 13.683 1.00 0.00 N ATOM 812 CA ILE A 55 15.502 8.850 13.162 1.00 0.00 C ATOM 813 C ILE A 55 15.637 7.799 14.275 1.00 0.00 C ATOM 814 O ILE A 55 16.469 7.929 15.175 1.00 0.00 O ATOM 815 CB ILE A 55 16.215 8.483 11.839 1.00 0.00 C ATOM 816 CG1 ILE A 55 15.950 9.620 10.829 1.00 0.00 C ATOM 817 CG2 ILE A 55 15.720 7.125 11.281 1.00 0.00 C ATOM 818 CD1 ILE A 55 16.528 9.320 9.458 1.00 0.00 C ATOM 0 H ILE A 55 16.917 10.125 14.000 1.00 0.00 H new ATOM 0 HA ILE A 55 14.449 8.897 12.884 1.00 0.00 H new ATOM 0 HB ILE A 55 17.285 8.374 12.018 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.876 9.781 10.740 1.00 0.00 H new ATOM 0 HG13 ILE A 55 16.381 10.547 11.208 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.243 6.901 10.351 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.920 6.338 12.008 1.00 0.00 H new ATOM 0 HG23 ILE A 55 14.648 7.179 11.090 1.00 0.00 H new ATOM 0 HD11 ILE A 55 16.315 10.150 8.784 1.00 0.00 H new ATOM 0 HD12 ILE A 55 17.607 9.186 9.539 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.078 8.408 9.065 1.00 0.00 H new ATOM 830 N ASP A 56 14.833 6.737 14.188 1.00 0.00 N ATOM 831 CA ASP A 56 14.755 5.638 15.153 1.00 0.00 C ATOM 832 C ASP A 56 15.155 4.331 14.473 1.00 0.00 C ATOM 833 O ASP A 56 14.588 3.971 13.440 1.00 0.00 O ATOM 834 CB ASP A 56 13.320 5.517 15.703 1.00 0.00 C ATOM 835 CG ASP A 56 12.956 4.067 16.092 1.00 0.00 C ATOM 836 OD1 ASP A 56 13.575 3.505 17.026 1.00 0.00 O ATOM 837 OD2 ASP A 56 12.063 3.483 15.431 1.00 0.00 O ATOM 0 H ASP A 56 14.189 6.614 13.407 1.00 0.00 H new ATOM 0 HA ASP A 56 15.436 5.842 15.980 1.00 0.00 H new ATOM 0 HB2 ASP A 56 13.213 6.162 16.576 1.00 0.00 H new ATOM 0 HB3 ASP A 56 12.615 5.876 14.953 1.00 0.00 H new ATOM 842 N ILE A 57 16.117 3.628 15.076 1.00 0.00 N ATOM 843 CA ILE A 57 16.502 2.254 14.744 1.00 0.00 C ATOM 844 C ILE A 57 16.666 1.411 16.027 1.00 0.00 C ATOM 845 O ILE A 57 17.095 0.263 15.968 1.00 0.00 O ATOM 846 CB ILE A 57 17.711 2.228 13.778 1.00 0.00 C ATOM 847 CG1 ILE A 57 18.987 2.965 14.227 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.270 2.720 12.387 1.00 0.00 C ATOM 849 CD1 ILE A 57 20.141 2.741 13.237 1.00 0.00 C ATOM 0 H ILE A 57 16.671 4.016 15.839 1.00 0.00 H new ATOM 0 HA ILE A 57 15.699 1.772 14.187 1.00 0.00 H new ATOM 0 HB ILE A 57 18.018 1.182 13.762 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.782 4.032 14.313 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.282 2.616 15.217 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.122 2.701 11.707 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.485 2.069 12.003 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.890 3.739 12.465 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.026 3.275 13.583 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.362 1.676 13.171 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.854 3.114 12.254 1.00 0.00 H new ATOM 861 N SER A 58 16.289 1.957 17.185 1.00 0.00 N ATOM 862 CA SER A 58 16.314 1.316 18.490 1.00 0.00 C ATOM 863 C SER A 58 15.215 0.256 18.618 1.00 0.00 C ATOM 864 O SER A 58 15.440 -0.797 19.217 1.00 0.00 O ATOM 865 CB SER A 58 16.113 2.395 19.573 1.00 0.00 C ATOM 866 OG SER A 58 16.445 3.697 19.097 1.00 0.00 O ATOM 0 H SER A 58 15.939 2.914 17.234 1.00 0.00 H new ATOM 0 HA SER A 58 17.275 0.817 18.614 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.075 2.385 19.907 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.729 2.158 20.440 1.00 0.00 H new ATOM 0 HG SER A 58 16.303 4.353 19.811 1.00 0.00 H new ATOM 872 N GLY A 59 14.035 0.521 18.044 1.00 0.00 N ATOM 873 CA GLY A 59 12.871 -0.358 18.150 1.00 0.00 C ATOM 874 C GLY A 59 12.919 -1.547 17.185 1.00 0.00 C ATOM 875 O GLY A 59 12.049 -2.419 17.239 1.00 0.00 O ATOM 0 H GLY A 59 13.863 1.359 17.489 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.798 -0.731 19.172 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.968 0.221 17.957 1.00 0.00 H new ATOM 879 N GLN A 60 13.904 -1.579 16.285 1.00 0.00 N ATOM 880 CA GLN A 60 14.125 -2.651 15.333 1.00 0.00 C ATOM 881 C GLN A 60 14.665 -3.878 16.052 1.00 0.00 C ATOM 882 O GLN A 60 15.332 -3.746 17.079 1.00 0.00 O ATOM 883 CB GLN A 60 15.160 -2.196 14.306 1.00 0.00 C ATOM 884 CG GLN A 60 14.615 -1.066 13.442 1.00 0.00 C ATOM 885 CD GLN A 60 15.646 -0.651 12.409 1.00 0.00 C ATOM 886 OE1 GLN A 60 16.835 -0.625 12.684 1.00 0.00 O ATOM 887 NE2 GLN A 60 15.244 -0.315 11.210 1.00 0.00 N ATOM 0 H GLN A 60 14.590 -0.829 16.202 1.00 0.00 H new ATOM 0 HA GLN A 60 13.182 -2.898 14.844 1.00 0.00 H new ATOM 0 HB2 GLN A 60 16.063 -1.863 14.818 1.00 0.00 H new ATOM 0 HB3 GLN A 60 15.444 -3.037 13.674 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.700 -1.388 12.944 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.354 -0.213 14.069 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.250 -0.337 10.980 1.00 0.00 H new ATOM 0 HE22 GLN A 60 15.924 -0.031 10.505 1.00 0.00 H new ATOM 896 N THR A 61 14.464 -5.050 15.454 1.00 0.00 N ATOM 897 CA THR A 61 14.930 -6.309 16.027 1.00 0.00 C ATOM 898 C THR A 61 15.260 -7.405 15.009 1.00 0.00 C ATOM 899 O THR A 61 14.905 -7.327 13.829 1.00 0.00 O ATOM 900 CB THR A 61 13.920 -6.842 17.077 1.00 0.00 C ATOM 901 OG1 THR A 61 12.572 -6.543 16.729 1.00 0.00 O ATOM 902 CG2 THR A 61 14.234 -6.244 18.448 1.00 0.00 C ATOM 0 H THR A 61 13.976 -5.153 14.564 1.00 0.00 H new ATOM 0 HA THR A 61 15.878 -6.062 16.505 1.00 0.00 H new ATOM 0 HB THR A 61 14.024 -7.927 17.105 1.00 0.00 H new ATOM 0 HG1 THR A 61 11.970 -6.898 17.416 1.00 0.00 H new ATOM 0 HG21 THR A 61 13.522 -6.622 19.181 1.00 0.00 H new ATOM 0 HG22 THR A 61 15.244 -6.525 18.745 1.00 0.00 H new ATOM 0 HG23 THR A 61 14.160 -5.158 18.397 1.00 0.00 H new ATOM 910 N SER A 62 15.972 -8.424 15.499 1.00 0.00 N ATOM 911 CA SER A 62 16.443 -9.592 14.772 1.00 0.00 C ATOM 912 C SER A 62 15.292 -10.505 14.339 1.00 0.00 C ATOM 913 O SER A 62 14.357 -10.742 15.110 1.00 0.00 O ATOM 914 CB SER A 62 17.391 -10.366 15.705 1.00 0.00 C ATOM 915 OG SER A 62 18.226 -9.461 16.409 1.00 0.00 O ATOM 0 H SER A 62 16.250 -8.450 16.480 1.00 0.00 H new ATOM 0 HA SER A 62 16.950 -9.266 13.864 1.00 0.00 H new ATOM 0 HB2 SER A 62 16.813 -10.963 16.410 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.000 -11.059 15.124 1.00 0.00 H new ATOM 0 HG SER A 62 18.769 -9.955 17.058 1.00 0.00 H new ATOM 921 N ASP A 63 15.402 -11.064 13.130 1.00 0.00 N ATOM 922 CA ASP A 63 14.543 -12.124 12.604 1.00 0.00 C ATOM 923 C ASP A 63 15.319 -12.725 11.416 1.00 0.00 C ATOM 924 O ASP A 63 15.824 -11.942 10.603 1.00 0.00 O ATOM 925 CB ASP A 63 13.185 -11.524 12.194 1.00 0.00 C ATOM 926 CG ASP A 63 12.063 -12.574 12.083 1.00 0.00 C ATOM 927 OD1 ASP A 63 12.022 -13.530 12.896 1.00 0.00 O ATOM 928 OD2 ASP A 63 11.160 -12.398 11.231 1.00 0.00 O ATOM 0 H ASP A 63 16.121 -10.777 12.466 1.00 0.00 H new ATOM 0 HA ASP A 63 14.318 -12.903 13.332 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.895 -10.768 12.924 1.00 0.00 H new ATOM 0 HB3 ASP A 63 13.294 -11.017 11.235 1.00 0.00 H new ATOM 933 N PRO A 64 15.543 -14.050 11.321 1.00 0.00 N ATOM 934 CA PRO A 64 16.465 -14.628 10.338 1.00 0.00 C ATOM 935 C PRO A 64 15.876 -14.707 8.924 1.00 0.00 C ATOM 936 O PRO A 64 14.668 -14.868 8.754 1.00 0.00 O ATOM 937 CB PRO A 64 16.825 -16.015 10.886 1.00 0.00 C ATOM 938 CG PRO A 64 15.594 -16.407 11.702 1.00 0.00 C ATOM 939 CD PRO A 64 15.087 -15.072 12.251 1.00 0.00 C ATOM 0 HA PRO A 64 17.344 -13.994 10.219 1.00 0.00 H new ATOM 0 HB2 PRO A 64 17.017 -16.726 10.083 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.722 -15.982 11.504 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.842 -16.898 11.083 1.00 0.00 H new ATOM 0 HG3 PRO A 64 15.848 -17.100 12.504 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.000 -15.071 12.328 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.478 -14.889 13.252 1.00 0.00 H new ATOM 947 N ILE A 65 16.751 -14.659 7.908 1.00 0.00 N ATOM 948 CA ILE A 65 16.400 -14.574 6.483 1.00 0.00 C ATOM 949 C ILE A 65 15.549 -15.764 6.048 1.00 0.00 C ATOM 950 O ILE A 65 14.612 -15.617 5.269 1.00 0.00 O ATOM 951 CB ILE A 65 17.690 -14.417 5.625 1.00 0.00 C ATOM 952 CG1 ILE A 65 17.368 -14.127 4.137 1.00 0.00 C ATOM 953 CG2 ILE A 65 18.651 -15.620 5.756 1.00 0.00 C ATOM 954 CD1 ILE A 65 18.602 -13.923 3.239 1.00 0.00 C ATOM 0 H ILE A 65 17.759 -14.679 8.062 1.00 0.00 H new ATOM 0 HA ILE A 65 15.787 -13.687 6.322 1.00 0.00 H new ATOM 0 HB ILE A 65 18.209 -13.549 6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 65 16.779 -14.953 3.739 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.744 -13.235 4.082 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.531 -15.452 5.135 1.00 0.00 H new ATOM 0 HG22 ILE A 65 18.957 -15.730 6.796 1.00 0.00 H new ATOM 0 HG23 ILE A 65 18.144 -16.528 5.429 1.00 0.00 H new ATOM 0 HD11 ILE A 65 18.279 -13.726 2.217 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.183 -13.077 3.606 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.218 -14.822 3.258 1.00 0.00 H new ATOM 966 N GLU A 66 15.848 -16.941 6.591 1.00 0.00 N ATOM 967 CA GLU A 66 15.219 -18.186 6.184 1.00 0.00 C ATOM 968 C GLU A 66 13.758 -18.267 6.633 1.00 0.00 C ATOM 969 O GLU A 66 12.989 -19.045 6.062 1.00 0.00 O ATOM 970 CB GLU A 66 16.043 -19.357 6.741 1.00 0.00 C ATOM 971 CG GLU A 66 17.325 -19.596 5.934 1.00 0.00 C ATOM 972 CD GLU A 66 18.087 -20.831 6.446 1.00 0.00 C ATOM 973 OE1 GLU A 66 18.941 -20.690 7.357 1.00 0.00 O ATOM 974 OE2 GLU A 66 17.851 -21.953 5.933 1.00 0.00 O ATOM 0 H GLU A 66 16.540 -17.054 7.332 1.00 0.00 H new ATOM 0 HA GLU A 66 15.202 -18.235 5.095 1.00 0.00 H new ATOM 0 HB2 GLU A 66 16.302 -19.155 7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 66 15.436 -20.263 6.733 1.00 0.00 H new ATOM 0 HG2 GLU A 66 17.075 -19.731 4.882 1.00 0.00 H new ATOM 0 HG3 GLU A 66 17.967 -18.717 5.999 1.00 0.00 H new ATOM 981 N ASN A 67 13.364 -17.464 7.627 1.00 0.00 N ATOM 982 CA ASN A 67 11.979 -17.350 8.043 1.00 0.00 C ATOM 983 C ASN A 67 11.186 -16.399 7.135 1.00 0.00 C ATOM 984 O ASN A 67 9.954 -16.434 7.171 1.00 0.00 O ATOM 985 CB ASN A 67 11.878 -16.980 9.533 1.00 0.00 C ATOM 986 CG ASN A 67 11.222 -15.627 9.805 1.00 0.00 C ATOM 987 OD1 ASN A 67 10.059 -15.554 10.201 1.00 0.00 O ATOM 988 ND2 ASN A 67 11.951 -14.544 9.624 1.00 0.00 N ATOM 0 H ASN A 67 14.005 -16.877 8.161 1.00 0.00 H new ATOM 0 HA ASN A 67 11.512 -18.328 7.930 1.00 0.00 H new ATOM 0 HB2 ASN A 67 11.312 -17.755 10.050 1.00 0.00 H new ATOM 0 HB3 ASN A 67 12.880 -16.977 9.963 1.00 0.00 H new ATOM 0 HD21 ASN A 67 11.553 -13.624 9.813 1.00 0.00 H new ATOM 0 HD22 ASN A 67 12.913 -14.626 9.295 1.00 0.00 H new ATOM 995 N PHE A 68 11.854 -15.566 6.320 1.00 0.00 N ATOM 996 CA PHE A 68 11.173 -14.651 5.416 1.00 0.00 C ATOM 997 C PHE A 68 10.794 -15.356 4.114 1.00 0.00 C ATOM 998 O PHE A 68 11.235 -16.471 3.816 1.00 0.00 O ATOM 999 CB PHE A 68 12.004 -13.383 5.160 1.00 0.00 C ATOM 1000 CG PHE A 68 11.969 -12.440 6.339 1.00 0.00 C ATOM 1001 CD1 PHE A 68 10.893 -11.548 6.502 1.00 0.00 C ATOM 1002 CD2 PHE A 68 12.977 -12.503 7.311 1.00 0.00 C ATOM 1003 CE1 PHE A 68 10.837 -10.709 7.629 1.00 0.00 C ATOM 1004 CE2 PHE A 68 12.913 -11.677 8.443 1.00 0.00 C ATOM 1005 CZ PHE A 68 11.857 -10.762 8.594 1.00 0.00 C ATOM 0 H PHE A 68 12.872 -15.515 6.276 1.00 0.00 H new ATOM 0 HA PHE A 68 10.250 -14.329 5.898 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.036 -13.662 4.949 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.624 -12.872 4.275 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.109 -11.508 5.760 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.803 -13.188 7.188 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.011 -10.025 7.753 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.679 -11.745 9.202 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.830 -10.102 9.449 1.00 0.00 H new ATOM 1015 N ASN A 69 9.962 -14.675 3.328 1.00 0.00 N ATOM 1016 CA ASN A 69 9.423 -15.127 2.073 1.00 0.00 C ATOM 1017 C ASN A 69 9.471 -13.871 1.219 1.00 0.00 C ATOM 1018 O ASN A 69 8.541 -13.064 1.271 1.00 0.00 O ATOM 1019 CB ASN A 69 7.999 -15.647 2.320 1.00 0.00 C ATOM 1020 CG ASN A 69 7.251 -15.979 1.042 1.00 0.00 C ATOM 1021 OD1 ASN A 69 7.061 -17.130 0.655 1.00 0.00 O ATOM 1022 ND2 ASN A 69 6.746 -14.934 0.437 1.00 0.00 N ATOM 0 H ASN A 69 9.635 -13.741 3.576 1.00 0.00 H new ATOM 0 HA ASN A 69 9.956 -15.947 1.591 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.049 -16.538 2.946 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.437 -14.897 2.877 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.167 -15.056 -0.394 1.00 0.00 H new ATOM 0 HD22 ASN A 69 6.932 -13.998 0.796 1.00 0.00 H new ATOM 1029 N ALA A 70 10.604 -13.599 0.565 1.00 0.00 N ATOM 1030 CA ALA A 70 10.751 -12.420 -0.267 1.00 0.00 C ATOM 1031 C ALA A 70 9.671 -12.296 -1.333 1.00 0.00 C ATOM 1032 O ALA A 70 9.418 -11.192 -1.804 1.00 0.00 O ATOM 1033 CB ALA A 70 12.079 -12.462 -0.984 1.00 0.00 C ATOM 0 H ALA A 70 11.434 -14.190 0.602 1.00 0.00 H new ATOM 0 HA ALA A 70 10.674 -11.568 0.408 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.184 -11.574 -1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.887 -12.489 -0.253 1.00 0.00 H new ATOM 0 HB3 ALA A 70 12.126 -13.353 -1.610 1.00 0.00 H new ATOM 1039 N ASP A 71 9.045 -13.406 -1.714 1.00 0.00 N ATOM 1040 CA ASP A 71 7.894 -13.408 -2.603 1.00 0.00 C ATOM 1041 C ASP A 71 6.798 -12.457 -2.095 1.00 0.00 C ATOM 1042 O ASP A 71 6.050 -11.893 -2.897 1.00 0.00 O ATOM 1043 CB ASP A 71 7.379 -14.841 -2.813 1.00 0.00 C ATOM 1044 CG ASP A 71 5.853 -14.903 -2.965 1.00 0.00 C ATOM 1045 OD1 ASP A 71 5.166 -15.031 -1.923 1.00 0.00 O ATOM 1046 OD2 ASP A 71 5.352 -14.859 -4.113 1.00 0.00 O ATOM 0 H ASP A 71 9.328 -14.337 -1.409 1.00 0.00 H new ATOM 0 HA ASP A 71 8.204 -13.030 -3.577 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.847 -15.265 -3.702 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.682 -15.460 -1.968 1.00 0.00 H new ATOM 1051 N ASP A 72 6.734 -12.229 -0.781 1.00 0.00 N ATOM 1052 CA ASP A 72 5.762 -11.351 -0.149 1.00 0.00 C ATOM 1053 C ASP A 72 6.190 -9.870 -0.153 1.00 0.00 C ATOM 1054 O ASP A 72 5.378 -9.019 0.201 1.00 0.00 O ATOM 1055 CB ASP A 72 5.491 -11.829 1.287 1.00 0.00 C ATOM 1056 CG ASP A 72 4.271 -11.125 1.904 1.00 0.00 C ATOM 1057 OD1 ASP A 72 3.149 -11.289 1.368 1.00 0.00 O ATOM 1058 OD2 ASP A 72 4.412 -10.470 2.964 1.00 0.00 O ATOM 0 H ASP A 72 7.374 -12.663 -0.116 1.00 0.00 H new ATOM 0 HA ASP A 72 4.847 -11.406 -0.739 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.327 -12.907 1.286 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.369 -11.641 1.904 1.00 0.00 H new ATOM 1063 N TYR A 73 7.421 -9.525 -0.565 1.00 0.00 N ATOM 1064 CA TYR A 73 7.977 -8.183 -0.444 1.00 0.00 C ATOM 1065 C TYR A 73 8.456 -7.725 -1.807 1.00 0.00 C ATOM 1066 O TYR A 73 9.421 -8.271 -2.335 1.00 0.00 O ATOM 1067 CB TYR A 73 9.119 -8.085 0.575 1.00 0.00 C ATOM 1068 CG TYR A 73 8.795 -8.588 1.961 1.00 0.00 C ATOM 1069 CD1 TYR A 73 8.732 -9.971 2.187 1.00 0.00 C ATOM 1070 CD2 TYR A 73 8.583 -7.692 3.020 1.00 0.00 C ATOM 1071 CE1 TYR A 73 8.399 -10.475 3.453 1.00 0.00 C ATOM 1072 CE2 TYR A 73 8.258 -8.182 4.301 1.00 0.00 C ATOM 1073 CZ TYR A 73 8.144 -9.579 4.516 1.00 0.00 C ATOM 1074 OH TYR A 73 7.788 -10.071 5.737 1.00 0.00 O ATOM 0 H TYR A 73 8.063 -10.189 -0.998 1.00 0.00 H new ATOM 0 HA TYR A 73 7.183 -7.535 -0.072 1.00 0.00 H new ATOM 0 HB2 TYR A 73 9.973 -8.646 0.194 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.429 -7.043 0.648 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.942 -10.655 1.378 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.669 -6.628 2.854 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.338 -11.541 3.614 1.00 0.00 H new ATOM 0 HE2 TYR A 73 8.096 -7.494 5.118 1.00 0.00 H new ATOM 0 HH TYR A 73 8.591 -10.356 6.222 1.00 0.00 H new ATOM 1084 N ASP A 74 7.803 -6.701 -2.358 1.00 0.00 N ATOM 1085 CA ASP A 74 8.007 -6.324 -3.761 1.00 0.00 C ATOM 1086 C ASP A 74 9.404 -5.793 -4.089 1.00 0.00 C ATOM 1087 O ASP A 74 9.719 -5.594 -5.260 1.00 0.00 O ATOM 1088 CB ASP A 74 6.978 -5.271 -4.189 1.00 0.00 C ATOM 1089 CG ASP A 74 6.631 -5.306 -5.690 1.00 0.00 C ATOM 1090 OD1 ASP A 74 6.649 -6.390 -6.321 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.228 -4.242 -6.217 1.00 0.00 O ATOM 0 H ASP A 74 7.131 -6.119 -1.858 1.00 0.00 H new ATOM 0 HA ASP A 74 7.884 -7.254 -4.315 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.064 -5.415 -3.612 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.360 -4.282 -3.938 1.00 0.00 H new ATOM 1096 N VAL A 75 10.234 -5.476 -3.094 1.00 0.00 N ATOM 1097 CA VAL A 75 11.497 -4.774 -3.296 1.00 0.00 C ATOM 1098 C VAL A 75 12.487 -5.331 -2.265 1.00 0.00 C ATOM 1099 O VAL A 75 12.224 -5.279 -1.063 1.00 0.00 O ATOM 1100 CB VAL A 75 11.189 -3.273 -3.172 1.00 0.00 C ATOM 1101 CG1 VAL A 75 12.361 -2.306 -2.949 1.00 0.00 C ATOM 1102 CG2 VAL A 75 10.303 -2.675 -4.274 1.00 0.00 C ATOM 0 H VAL A 75 10.044 -5.702 -2.118 1.00 0.00 H new ATOM 0 HA VAL A 75 11.958 -4.919 -4.273 1.00 0.00 H new ATOM 0 HB VAL A 75 10.635 -3.334 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.983 -1.286 -2.882 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.874 -2.564 -2.023 1.00 0.00 H new ATOM 0 HG13 VAL A 75 13.058 -2.381 -3.783 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.153 -1.612 -4.084 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.788 -2.805 -5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.338 -3.182 -4.280 1.00 0.00 H new ATOM 1112 N VAL A 76 13.636 -5.858 -2.692 1.00 0.00 N ATOM 1113 CA VAL A 76 14.640 -6.408 -1.810 1.00 0.00 C ATOM 1114 C VAL A 76 15.886 -5.582 -2.021 1.00 0.00 C ATOM 1115 O VAL A 76 16.346 -5.439 -3.155 1.00 0.00 O ATOM 1116 CB VAL A 76 14.899 -7.877 -2.193 1.00 0.00 C ATOM 1117 CG1 VAL A 76 16.214 -8.419 -1.599 1.00 0.00 C ATOM 1118 CG2 VAL A 76 13.720 -8.770 -1.767 1.00 0.00 C ATOM 0 H VAL A 76 13.889 -5.910 -3.679 1.00 0.00 H new ATOM 0 HA VAL A 76 14.328 -6.381 -0.766 1.00 0.00 H new ATOM 0 HB VAL A 76 14.996 -7.903 -3.278 1.00 0.00 H new ATOM 0 HG11 VAL A 76 16.348 -9.458 -1.900 1.00 0.00 H new ATOM 0 HG12 VAL A 76 17.051 -7.825 -1.965 1.00 0.00 H new ATOM 0 HG13 VAL A 76 16.174 -8.358 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 76 13.926 -9.803 -2.048 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.588 -8.707 -0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.810 -8.433 -2.264 1.00 0.00 H new ATOM 1128 N ILE A 77 16.450 -5.121 -0.911 1.00 0.00 N ATOM 1129 CA ILE A 77 17.742 -4.503 -0.856 1.00 0.00 C ATOM 1130 C ILE A 77 18.514 -5.392 0.096 1.00 0.00 C ATOM 1131 O ILE A 77 18.341 -5.313 1.314 1.00 0.00 O ATOM 1132 CB ILE A 77 17.635 -3.068 -0.340 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.761 -2.145 -1.211 1.00 0.00 C ATOM 1134 CG2 ILE A 77 19.042 -2.481 -0.190 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.066 -2.127 -2.716 1.00 0.00 C ATOM 0 H ILE A 77 15.994 -5.176 -0.000 1.00 0.00 H new ATOM 0 HA ILE A 77 18.226 -4.420 -1.829 1.00 0.00 H new ATOM 0 HB ILE A 77 17.130 -3.120 0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 77 15.719 -2.437 -1.078 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.857 -1.128 -0.832 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.972 -1.457 0.178 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.614 -3.082 0.517 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.543 -2.485 -1.158 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.384 -1.440 -3.217 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.093 -1.799 -2.875 1.00 0.00 H new ATOM 0 HD13 ILE A 77 16.938 -3.129 -3.125 1.00 0.00 H new ATOM 1147 N SER A 78 19.291 -6.325 -0.429 1.00 0.00 N ATOM 1148 CA SER A 78 20.208 -7.020 0.435 1.00 0.00 C ATOM 1149 C SER A 78 21.364 -6.055 0.751 1.00 0.00 C ATOM 1150 O SER A 78 21.558 -5.044 0.074 1.00 0.00 O ATOM 1151 CB SER A 78 20.539 -8.382 -0.180 1.00 0.00 C ATOM 1152 OG SER A 78 21.055 -8.280 -1.474 1.00 0.00 O ATOM 0 H SER A 78 19.303 -6.605 -1.410 1.00 0.00 H new ATOM 0 HA SER A 78 19.804 -7.290 1.411 1.00 0.00 H new ATOM 0 HB2 SER A 78 21.261 -8.896 0.455 1.00 0.00 H new ATOM 0 HB3 SER A 78 19.638 -8.995 -0.200 1.00 0.00 H new ATOM 0 HG SER A 78 22.025 -8.151 -1.430 1.00 0.00 H new ATOM 1158 N LEU A 79 22.120 -6.299 1.813 1.00 0.00 N ATOM 1159 CA LEU A 79 23.364 -5.594 2.120 1.00 0.00 C ATOM 1160 C LEU A 79 24.326 -6.677 2.603 1.00 0.00 C ATOM 1161 O LEU A 79 25.030 -6.528 3.602 1.00 0.00 O ATOM 1162 CB LEU A 79 23.180 -4.453 3.144 1.00 0.00 C ATOM 1163 CG LEU A 79 22.325 -3.259 2.666 1.00 0.00 C ATOM 1164 CD1 LEU A 79 20.835 -3.399 3.016 1.00 0.00 C ATOM 1165 CD2 LEU A 79 22.842 -1.951 3.280 1.00 0.00 C ATOM 0 H LEU A 79 21.882 -7.010 2.504 1.00 0.00 H new ATOM 0 HA LEU A 79 23.752 -5.078 1.242 1.00 0.00 H new ATOM 0 HB2 LEU A 79 22.724 -4.866 4.044 1.00 0.00 H new ATOM 0 HB3 LEU A 79 24.165 -4.081 3.428 1.00 0.00 H new ATOM 0 HG LEU A 79 22.416 -3.245 1.580 1.00 0.00 H new ATOM 0 HD11 LEU A 79 20.292 -2.527 2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 79 20.434 -4.298 2.547 1.00 0.00 H new ATOM 0 HD13 LEU A 79 20.721 -3.472 4.098 1.00 0.00 H new ATOM 0 HD21 LEU A 79 22.229 -1.119 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 79 22.788 -2.013 4.367 1.00 0.00 H new ATOM 0 HD23 LEU A 79 23.876 -1.791 2.976 1.00 0.00 H new ATOM 1177 N CYS A 80 24.307 -7.818 1.911 1.00 0.00 N ATOM 1178 CA CYS A 80 25.018 -9.034 2.271 1.00 0.00 C ATOM 1179 C CYS A 80 26.496 -8.959 1.850 1.00 0.00 C ATOM 1180 O CYS A 80 27.189 -9.973 1.887 1.00 0.00 O ATOM 1181 CB CYS A 80 24.269 -10.223 1.632 1.00 0.00 C ATOM 1182 SG CYS A 80 22.588 -10.348 2.325 1.00 0.00 S ATOM 0 H CYS A 80 23.771 -7.918 1.049 1.00 0.00 H new ATOM 0 HA CYS A 80 25.034 -9.167 3.353 1.00 0.00 H new ATOM 0 HB2 CYS A 80 24.217 -10.092 0.551 1.00 0.00 H new ATOM 0 HB3 CYS A 80 24.816 -11.148 1.814 1.00 0.00 H new ATOM 0 HG CYS A 80 21.967 -11.350 1.778 1.00 0.00 H new ATOM 1188 N GLY A 81 26.979 -7.777 1.447 1.00 0.00 N ATOM 1189 CA GLY A 81 28.323 -7.590 0.909 1.00 0.00 C ATOM 1190 C GLY A 81 28.435 -8.168 -0.502 1.00 0.00 C ATOM 1191 O GLY A 81 29.531 -8.537 -0.927 1.00 0.00 O ATOM 0 H GLY A 81 26.436 -6.915 1.488 1.00 0.00 H new ATOM 0 HA2 GLY A 81 28.566 -6.528 0.891 1.00 0.00 H new ATOM 0 HA3 GLY A 81 29.050 -8.073 1.562 1.00 0.00 H new ATOM 1195 N CYS A 82 27.304 -8.219 -1.224 1.00 0.00 N ATOM 1196 CA CYS A 82 27.111 -8.915 -2.487 1.00 0.00 C ATOM 1197 C CYS A 82 27.543 -10.391 -2.385 1.00 0.00 C ATOM 1198 O CYS A 82 27.871 -10.896 -1.310 1.00 0.00 O ATOM 1199 CB CYS A 82 27.804 -8.122 -3.608 1.00 0.00 C ATOM 1200 SG CYS A 82 26.970 -8.387 -5.203 1.00 0.00 S ATOM 0 H CYS A 82 26.455 -7.745 -0.915 1.00 0.00 H new ATOM 0 HA CYS A 82 26.051 -8.960 -2.739 1.00 0.00 H new ATOM 0 HB2 CYS A 82 27.800 -7.060 -3.363 1.00 0.00 H new ATOM 0 HB3 CYS A 82 28.847 -8.428 -3.684 1.00 0.00 H new ATOM 0 HG CYS A 82 27.576 -7.704 -6.128 1.00 0.00 H new ATOM 1206 N GLY A 83 27.486 -11.116 -3.501 1.00 0.00 N ATOM 1207 CA GLY A 83 28.003 -12.480 -3.645 1.00 0.00 C ATOM 1208 C GLY A 83 27.142 -13.565 -2.983 1.00 0.00 C ATOM 1209 O GLY A 83 27.049 -14.671 -3.521 1.00 0.00 O ATOM 0 H GLY A 83 27.065 -10.760 -4.359 1.00 0.00 H new ATOM 0 HA2 GLY A 83 28.098 -12.708 -4.707 1.00 0.00 H new ATOM 0 HA3 GLY A 83 29.006 -12.521 -3.219 1.00 0.00 H new ATOM 1213 N VAL A 84 26.492 -13.263 -1.854 1.00 0.00 N ATOM 1214 CA VAL A 84 25.560 -14.143 -1.160 1.00 0.00 C ATOM 1215 C VAL A 84 24.447 -14.505 -2.146 1.00 0.00 C ATOM 1216 O VAL A 84 23.747 -13.623 -2.655 1.00 0.00 O ATOM 1217 CB VAL A 84 25.046 -13.474 0.133 1.00 0.00 C ATOM 1218 CG1 VAL A 84 23.981 -14.324 0.845 1.00 0.00 C ATOM 1219 CG2 VAL A 84 26.233 -13.247 1.088 1.00 0.00 C ATOM 0 H VAL A 84 26.608 -12.365 -1.385 1.00 0.00 H new ATOM 0 HA VAL A 84 26.044 -15.064 -0.835 1.00 0.00 H new ATOM 0 HB VAL A 84 24.582 -12.527 -0.144 1.00 0.00 H new ATOM 0 HG11 VAL A 84 23.651 -13.811 1.749 1.00 0.00 H new ATOM 0 HG12 VAL A 84 23.130 -14.472 0.180 1.00 0.00 H new ATOM 0 HG13 VAL A 84 24.406 -15.292 1.112 1.00 0.00 H new ATOM 0 HG21 VAL A 84 25.878 -12.775 2.004 1.00 0.00 H new ATOM 0 HG22 VAL A 84 26.694 -14.205 1.329 1.00 0.00 H new ATOM 0 HG23 VAL A 84 26.968 -12.601 0.608 1.00 0.00 H new ATOM 1229 N ASN A 85 24.309 -15.804 -2.429 1.00 0.00 N ATOM 1230 CA ASN A 85 23.184 -16.302 -3.208 1.00 0.00 C ATOM 1231 C ASN A 85 21.950 -16.257 -2.307 1.00 0.00 C ATOM 1232 O ASN A 85 22.050 -16.467 -1.095 1.00 0.00 O ATOM 1233 CB ASN A 85 23.430 -17.718 -3.768 1.00 0.00 C ATOM 1234 CG ASN A 85 23.154 -18.847 -2.771 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.016 -19.283 -2.608 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.180 -19.361 -2.103 1.00 0.00 N ATOM 0 H ASN A 85 24.965 -16.525 -2.128 1.00 0.00 H new ATOM 0 HA ASN A 85 23.040 -15.672 -4.086 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.801 -17.863 -4.646 1.00 0.00 H new ATOM 0 HB3 ASN A 85 24.465 -17.789 -4.102 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.029 -20.126 -1.446 1.00 0.00 H new ATOM 0 HD22 ASN A 85 25.119 -18.991 -2.247 1.00 0.00 H new ATOM 1243 N LEU A 86 20.794 -15.999 -2.911 1.00 0.00 N ATOM 1244 CA LEU A 86 19.498 -15.932 -2.236 1.00 0.00 C ATOM 1245 C LEU A 86 18.547 -16.874 -2.986 1.00 0.00 C ATOM 1246 O LEU A 86 18.748 -17.088 -4.188 1.00 0.00 O ATOM 1247 CB LEU A 86 18.937 -14.492 -2.251 1.00 0.00 C ATOM 1248 CG LEU A 86 19.856 -13.369 -1.717 1.00 0.00 C ATOM 1249 CD1 LEU A 86 19.148 -12.015 -1.857 1.00 0.00 C ATOM 1250 CD2 LEU A 86 20.251 -13.539 -0.246 1.00 0.00 C ATOM 0 H LEU A 86 20.729 -15.825 -3.914 1.00 0.00 H new ATOM 0 HA LEU A 86 19.603 -16.228 -1.192 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.665 -14.246 -3.278 1.00 0.00 H new ATOM 0 HB3 LEU A 86 18.017 -14.482 -1.667 1.00 0.00 H new ATOM 0 HG LEU A 86 20.767 -13.421 -2.314 1.00 0.00 H new ATOM 0 HD11 LEU A 86 19.797 -11.224 -1.480 1.00 0.00 H new ATOM 0 HD12 LEU A 86 18.922 -11.829 -2.907 1.00 0.00 H new ATOM 0 HD13 LEU A 86 18.221 -12.028 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 86 20.895 -12.713 0.055 1.00 0.00 H new ATOM 0 HD22 LEU A 86 19.354 -13.544 0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 86 20.785 -14.481 -0.119 1.00 0.00 H new ATOM 1262 N PRO A 87 17.507 -17.427 -2.329 1.00 0.00 N ATOM 1263 CA PRO A 87 16.449 -18.160 -3.020 1.00 0.00 C ATOM 1264 C PRO A 87 15.847 -17.321 -4.155 1.00 0.00 C ATOM 1265 O PRO A 87 15.777 -16.097 -4.024 1.00 0.00 O ATOM 1266 CB PRO A 87 15.393 -18.480 -1.965 1.00 0.00 C ATOM 1267 CG PRO A 87 16.127 -18.365 -0.628 1.00 0.00 C ATOM 1268 CD PRO A 87 17.284 -17.403 -0.892 1.00 0.00 C ATOM 0 HA PRO A 87 16.839 -19.068 -3.480 1.00 0.00 H new ATOM 0 HB2 PRO A 87 14.557 -17.783 -2.018 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.983 -19.480 -2.106 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.468 -17.985 0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.490 -19.336 -0.293 1.00 0.00 H new ATOM 0 HD2 PRO A 87 17.040 -16.397 -0.552 1.00 0.00 H new ATOM 0 HD3 PRO A 87 18.179 -17.713 -0.353 1.00 0.00 H new ATOM 1276 N PRO A 88 15.314 -17.933 -5.222 1.00 0.00 N ATOM 1277 CA PRO A 88 14.932 -17.190 -6.416 1.00 0.00 C ATOM 1278 C PRO A 88 13.774 -16.210 -6.205 1.00 0.00 C ATOM 1279 O PRO A 88 13.643 -15.248 -6.960 1.00 0.00 O ATOM 1280 CB PRO A 88 14.629 -18.246 -7.485 1.00 0.00 C ATOM 1281 CG PRO A 88 14.282 -19.493 -6.672 1.00 0.00 C ATOM 1282 CD PRO A 88 15.169 -19.362 -5.437 1.00 0.00 C ATOM 0 HA PRO A 88 15.746 -16.532 -6.722 1.00 0.00 H new ATOM 0 HB2 PRO A 88 13.801 -17.942 -8.125 1.00 0.00 H new ATOM 0 HB3 PRO A 88 15.488 -18.417 -8.134 1.00 0.00 H new ATOM 0 HG2 PRO A 88 13.225 -19.520 -6.408 1.00 0.00 H new ATOM 0 HG3 PRO A 88 14.495 -20.407 -7.226 1.00 0.00 H new ATOM 0 HD2 PRO A 88 14.714 -19.846 -4.573 1.00 0.00 H new ATOM 0 HD3 PRO A 88 16.137 -19.837 -5.596 1.00 0.00 H new ATOM 1290 N GLU A 89 12.966 -16.378 -5.152 1.00 0.00 N ATOM 1291 CA GLU A 89 11.880 -15.464 -4.839 1.00 0.00 C ATOM 1292 C GLU A 89 12.418 -14.079 -4.484 1.00 0.00 C ATOM 1293 O GLU A 89 11.757 -13.072 -4.707 1.00 0.00 O ATOM 1294 CB GLU A 89 11.007 -16.028 -3.716 1.00 0.00 C ATOM 1295 CG GLU A 89 11.749 -16.454 -2.445 1.00 0.00 C ATOM 1296 CD GLU A 89 10.750 -16.923 -1.372 1.00 0.00 C ATOM 1297 OE1 GLU A 89 9.997 -16.065 -0.856 1.00 0.00 O ATOM 1298 OE2 GLU A 89 10.730 -18.135 -1.043 1.00 0.00 O ATOM 0 H GLU A 89 13.053 -17.155 -4.497 1.00 0.00 H new ATOM 0 HA GLU A 89 11.255 -15.357 -5.726 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.265 -15.277 -3.446 1.00 0.00 H new ATOM 0 HB3 GLU A 89 10.463 -16.890 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU A 89 12.448 -17.258 -2.676 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.338 -15.620 -2.063 1.00 0.00 H new ATOM 1305 N TRP A 90 13.644 -13.996 -3.974 1.00 0.00 N ATOM 1306 CA TRP A 90 14.285 -12.722 -3.697 1.00 0.00 C ATOM 1307 C TRP A 90 14.600 -11.922 -4.974 1.00 0.00 C ATOM 1308 O TRP A 90 14.883 -10.731 -4.870 1.00 0.00 O ATOM 1309 CB TRP A 90 15.540 -12.958 -2.839 1.00 0.00 C ATOM 1310 CG TRP A 90 15.307 -13.466 -1.434 1.00 0.00 C ATOM 1311 CD1 TRP A 90 15.012 -14.734 -1.067 1.00 0.00 C ATOM 1312 CD2 TRP A 90 15.291 -12.715 -0.182 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.809 -14.803 0.303 1.00 0.00 N ATOM 1314 CE2 TRP A 90 14.944 -13.574 0.897 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.398 -11.354 0.123 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.723 -13.099 2.199 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.212 -10.845 1.418 1.00 0.00 C ATOM 1318 CH2 TRP A 90 14.857 -11.722 2.464 1.00 0.00 C ATOM 0 H TRP A 90 14.216 -14.809 -3.743 1.00 0.00 H new ATOM 0 HA TRP A 90 13.584 -12.104 -3.137 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.180 -13.671 -3.359 1.00 0.00 H new ATOM 0 HB3 TRP A 90 16.092 -12.020 -2.776 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.944 -15.573 -1.744 1.00 0.00 H new ATOM 0 HE1 TRP A 90 14.587 -15.662 0.807 1.00 0.00 H new ATOM 0 HE3 TRP A 90 15.634 -10.664 -0.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 14.453 -13.783 2.990 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.340 -9.790 1.612 1.00 0.00 H new ATOM 0 HH2 TRP A 90 14.689 -11.341 3.460 1.00 0.00 H new ATOM 1329 N VAL A 91 14.513 -12.526 -6.164 1.00 0.00 N ATOM 1330 CA VAL A 91 14.973 -11.955 -7.420 1.00 0.00 C ATOM 1331 C VAL A 91 13.792 -11.468 -8.272 1.00 0.00 C ATOM 1332 O VAL A 91 13.934 -10.505 -9.026 1.00 0.00 O ATOM 1333 CB VAL A 91 15.838 -12.992 -8.153 1.00 0.00 C ATOM 1334 CG1 VAL A 91 16.470 -12.460 -9.448 1.00 0.00 C ATOM 1335 CG2 VAL A 91 16.954 -13.572 -7.263 1.00 0.00 C ATOM 0 H VAL A 91 14.107 -13.455 -6.276 1.00 0.00 H new ATOM 0 HA VAL A 91 15.586 -11.075 -7.223 1.00 0.00 H new ATOM 0 HB VAL A 91 15.135 -13.783 -8.413 1.00 0.00 H new ATOM 0 HG11 VAL A 91 17.066 -13.246 -9.911 1.00 0.00 H new ATOM 0 HG12 VAL A 91 15.684 -12.148 -10.135 1.00 0.00 H new ATOM 0 HG13 VAL A 91 17.109 -11.608 -9.217 1.00 0.00 H new ATOM 0 HG21 VAL A 91 17.533 -14.299 -7.833 1.00 0.00 H new ATOM 0 HG22 VAL A 91 17.609 -12.767 -6.930 1.00 0.00 H new ATOM 0 HG23 VAL A 91 16.510 -14.061 -6.396 1.00 0.00 H new ATOM 1345 N THR A 92 12.623 -12.095 -8.146 1.00 0.00 N ATOM 1346 CA THR A 92 11.476 -11.892 -9.034 1.00 0.00 C ATOM 1347 C THR A 92 10.733 -10.564 -8.795 1.00 0.00 C ATOM 1348 O THR A 92 9.901 -10.142 -9.603 1.00 0.00 O ATOM 1349 CB THR A 92 10.549 -13.108 -8.866 1.00 0.00 C ATOM 1350 OG1 THR A 92 10.369 -13.403 -7.488 1.00 0.00 O ATOM 1351 CG2 THR A 92 11.196 -14.333 -9.511 1.00 0.00 C ATOM 0 H THR A 92 12.442 -12.774 -7.407 1.00 0.00 H new ATOM 0 HA THR A 92 11.832 -11.813 -10.061 1.00 0.00 H new ATOM 0 HB THR A 92 9.592 -12.875 -9.333 1.00 0.00 H new ATOM 0 HG1 THR A 92 9.776 -14.178 -7.394 1.00 0.00 H new ATOM 0 HG21 THR A 92 10.540 -15.196 -9.393 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.358 -14.143 -10.572 1.00 0.00 H new ATOM 0 HG23 THR A 92 12.152 -14.536 -9.029 1.00 0.00 H new ATOM 1359 N GLN A 93 11.038 -9.925 -7.671 1.00 0.00 N ATOM 1360 CA GLN A 93 10.551 -8.666 -7.171 1.00 0.00 C ATOM 1361 C GLN A 93 10.749 -7.495 -8.145 1.00 0.00 C ATOM 1362 O GLN A 93 11.540 -7.575 -9.090 1.00 0.00 O ATOM 1363 CB GLN A 93 11.325 -8.482 -5.860 1.00 0.00 C ATOM 1364 CG GLN A 93 11.045 -9.533 -4.778 1.00 0.00 C ATOM 1365 CD GLN A 93 9.644 -10.155 -4.873 1.00 0.00 C ATOM 1366 OE1 GLN A 93 8.602 -9.504 -4.851 1.00 0.00 O ATOM 1367 NE2 GLN A 93 9.599 -11.450 -5.123 1.00 0.00 N ATOM 0 H GLN A 93 11.711 -10.333 -7.022 1.00 0.00 H new ATOM 0 HA GLN A 93 9.470 -8.675 -7.030 1.00 0.00 H new ATOM 0 HB2 GLN A 93 12.392 -8.490 -6.083 1.00 0.00 H new ATOM 0 HB3 GLN A 93 11.092 -7.497 -5.455 1.00 0.00 H new ATOM 0 HG2 GLN A 93 11.791 -10.325 -4.851 1.00 0.00 H new ATOM 0 HG3 GLN A 93 11.163 -9.073 -3.797 1.00 0.00 H new ATOM 0 HE21 GLN A 93 10.460 -11.996 -5.143 1.00 0.00 H new ATOM 0 HE22 GLN A 93 8.703 -11.905 -5.297 1.00 0.00 H new ATOM 1376 N GLU A 94 10.033 -6.394 -7.901 1.00 0.00 N ATOM 1377 CA GLU A 94 10.123 -5.170 -8.662 1.00 0.00 C ATOM 1378 C GLU A 94 11.522 -4.589 -8.475 1.00 0.00 C ATOM 1379 O GLU A 94 12.142 -4.172 -9.458 1.00 0.00 O ATOM 1380 CB GLU A 94 9.002 -4.211 -8.216 1.00 0.00 C ATOM 1381 CG GLU A 94 9.322 -2.720 -8.322 1.00 0.00 C ATOM 1382 CD GLU A 94 9.600 -2.217 -9.755 1.00 0.00 C ATOM 1383 OE1 GLU A 94 9.113 -2.819 -10.744 1.00 0.00 O ATOM 1384 OE2 GLU A 94 10.279 -1.170 -9.898 1.00 0.00 O ATOM 0 H GLU A 94 9.356 -6.341 -7.140 1.00 0.00 H new ATOM 0 HA GLU A 94 9.979 -5.346 -9.728 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.114 -4.416 -8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 94 8.747 -4.436 -7.180 1.00 0.00 H new ATOM 0 HG2 GLU A 94 8.487 -2.154 -7.909 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.192 -2.505 -7.701 1.00 0.00 H new ATOM 1391 N ILE A 95 12.044 -4.633 -7.243 1.00 0.00 N ATOM 1392 CA ILE A 95 13.445 -4.313 -7.013 1.00 0.00 C ATOM 1393 C ILE A 95 14.135 -5.518 -6.406 1.00 0.00 C ATOM 1394 O ILE A 95 13.618 -6.153 -5.484 1.00 0.00 O ATOM 1395 CB ILE A 95 13.638 -3.101 -6.078 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.265 -1.738 -6.680 1.00 0.00 C ATOM 1397 CG2 ILE A 95 15.069 -2.978 -5.523 1.00 0.00 C ATOM 1398 CD1 ILE A 95 13.992 -1.330 -7.968 1.00 0.00 C ATOM 0 H ILE A 95 11.520 -4.884 -6.405 1.00 0.00 H new ATOM 0 HA ILE A 95 13.880 -4.052 -7.978 1.00 0.00 H new ATOM 0 HB ILE A 95 12.934 -3.329 -5.278 1.00 0.00 H new ATOM 0 HG12 ILE A 95 12.193 -1.736 -6.879 1.00 0.00 H new ATOM 0 HG13 ILE A 95 13.451 -0.972 -5.927 1.00 0.00 H new ATOM 0 HG21 ILE A 95 15.134 -2.105 -4.874 1.00 0.00 H new ATOM 0 HG22 ILE A 95 15.316 -3.873 -4.953 1.00 0.00 H new ATOM 0 HG23 ILE A 95 15.772 -2.869 -6.349 1.00 0.00 H new ATOM 0 HD11 ILE A 95 13.640 -0.350 -8.290 1.00 0.00 H new ATOM 0 HD12 ILE A 95 15.065 -1.287 -7.782 1.00 0.00 H new ATOM 0 HD13 ILE A 95 13.788 -2.063 -8.749 1.00 0.00 H new ATOM 1410 N PHE A 96 15.323 -5.801 -6.921 1.00 0.00 N ATOM 1411 CA PHE A 96 16.250 -6.704 -6.294 1.00 0.00 C ATOM 1412 C PHE A 96 17.605 -6.072 -6.548 1.00 0.00 C ATOM 1413 O PHE A 96 18.074 -6.001 -7.687 1.00 0.00 O ATOM 1414 CB PHE A 96 16.204 -8.174 -6.715 1.00 0.00 C ATOM 1415 CG PHE A 96 17.363 -8.929 -6.072 1.00 0.00 C ATOM 1416 CD1 PHE A 96 17.704 -8.683 -4.723 1.00 0.00 C ATOM 1417 CD2 PHE A 96 18.190 -9.777 -6.832 1.00 0.00 C ATOM 1418 CE1 PHE A 96 18.827 -9.268 -4.141 1.00 0.00 C ATOM 1419 CE2 PHE A 96 19.313 -10.389 -6.241 1.00 0.00 C ATOM 1420 CZ PHE A 96 19.637 -10.134 -4.896 1.00 0.00 C ATOM 0 H PHE A 96 15.664 -5.401 -7.795 1.00 0.00 H new ATOM 0 HA PHE A 96 15.988 -6.804 -5.241 1.00 0.00 H new ATOM 0 HB2 PHE A 96 15.256 -8.619 -6.414 1.00 0.00 H new ATOM 0 HB3 PHE A 96 16.263 -8.254 -7.800 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.082 -8.028 -4.131 1.00 0.00 H new ATOM 0 HD2 PHE A 96 17.963 -9.959 -7.872 1.00 0.00 H new ATOM 0 HE1 PHE A 96 19.075 -9.056 -3.111 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.929 -11.058 -6.824 1.00 0.00 H new ATOM 0 HZ PHE A 96 20.502 -10.600 -4.447 1.00 0.00 H new ATOM 1430 N GLU A 97 18.189 -5.562 -5.478 1.00 0.00 N ATOM 1431 CA GLU A 97 19.487 -4.937 -5.442 1.00 0.00 C ATOM 1432 C GLU A 97 20.188 -5.450 -4.187 1.00 0.00 C ATOM 1433 O GLU A 97 19.563 -5.999 -3.274 1.00 0.00 O ATOM 1434 CB GLU A 97 19.332 -3.407 -5.376 1.00 0.00 C ATOM 1435 CG GLU A 97 19.034 -2.751 -6.725 1.00 0.00 C ATOM 1436 CD GLU A 97 18.795 -1.238 -6.577 1.00 0.00 C ATOM 1437 OE1 GLU A 97 19.692 -0.518 -6.077 1.00 0.00 O ATOM 1438 OE2 GLU A 97 17.722 -0.749 -7.004 1.00 0.00 O ATOM 0 H GLU A 97 17.739 -5.577 -4.563 1.00 0.00 H new ATOM 0 HA GLU A 97 20.064 -5.175 -6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 97 18.529 -3.164 -4.680 1.00 0.00 H new ATOM 0 HB3 GLU A 97 20.247 -2.977 -4.969 1.00 0.00 H new ATOM 0 HG2 GLU A 97 19.867 -2.924 -7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 97 18.155 -3.217 -7.171 1.00 0.00 H new ATOM 1445 N ASP A 98 21.490 -5.205 -4.140 1.00 0.00 N ATOM 1446 CA ASP A 98 22.329 -5.395 -2.970 1.00 0.00 C ATOM 1447 C ASP A 98 23.164 -4.129 -2.845 1.00 0.00 C ATOM 1448 O ASP A 98 23.750 -3.687 -3.837 1.00 0.00 O ATOM 1449 CB ASP A 98 23.226 -6.639 -3.061 1.00 0.00 C ATOM 1450 CG ASP A 98 24.059 -6.793 -1.783 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.187 -6.253 -1.715 1.00 0.00 O ATOM 1452 OD2 ASP A 98 23.579 -7.491 -0.861 1.00 0.00 O ATOM 0 H ASP A 98 22.008 -4.856 -4.946 1.00 0.00 H new ATOM 0 HA ASP A 98 21.707 -5.567 -2.092 1.00 0.00 H new ATOM 0 HB2 ASP A 98 22.612 -7.527 -3.212 1.00 0.00 H new ATOM 0 HB3 ASP A 98 23.886 -6.557 -3.925 1.00 0.00 H new ATOM 1457 N TRP A 99 23.202 -3.530 -1.657 1.00 0.00 N ATOM 1458 CA TRP A 99 23.972 -2.329 -1.368 1.00 0.00 C ATOM 1459 C TRP A 99 25.093 -2.752 -0.427 1.00 0.00 C ATOM 1460 O TRP A 99 24.970 -2.668 0.793 1.00 0.00 O ATOM 1461 CB TRP A 99 23.081 -1.202 -0.812 1.00 0.00 C ATOM 1462 CG TRP A 99 21.935 -0.720 -1.659 1.00 0.00 C ATOM 1463 CD1 TRP A 99 21.741 -0.931 -2.985 1.00 0.00 C ATOM 1464 CD2 TRP A 99 20.782 0.061 -1.223 1.00 0.00 C ATOM 1465 NE1 TRP A 99 20.545 -0.374 -3.380 1.00 0.00 N ATOM 1466 CE2 TRP A 99 19.883 0.204 -2.321 1.00 0.00 C ATOM 1467 CE3 TRP A 99 20.390 0.634 0.010 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 18.624 0.804 -2.183 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 19.134 1.255 0.150 1.00 0.00 C ATOM 1470 CH2 TRP A 99 18.243 1.304 -0.933 1.00 0.00 C ATOM 0 H TRP A 99 22.684 -3.878 -0.850 1.00 0.00 H new ATOM 0 HA TRP A 99 24.403 -1.899 -2.272 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.672 -1.540 0.140 1.00 0.00 H new ATOM 0 HB3 TRP A 99 23.721 -0.346 -0.599 1.00 0.00 H new ATOM 0 HD1 TRP A 99 22.424 -1.458 -3.635 1.00 0.00 H new ATOM 0 HE1 TRP A 99 20.194 -0.388 -4.338 1.00 0.00 H new ATOM 0 HE3 TRP A 99 21.062 0.595 0.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 17.957 0.879 -3.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 18.855 1.696 1.096 1.00 0.00 H new ATOM 0 HH2 TRP A 99 17.259 1.729 -0.801 1.00 0.00 H new ATOM 1481 N GLN A 100 26.171 -3.272 -1.010 1.00 0.00 N ATOM 1482 CA GLN A 100 27.403 -3.725 -0.362 1.00 0.00 C ATOM 1483 C GLN A 100 28.207 -2.568 0.275 1.00 0.00 C ATOM 1484 O GLN A 100 29.406 -2.424 0.027 1.00 0.00 O ATOM 1485 CB GLN A 100 28.250 -4.569 -1.329 1.00 0.00 C ATOM 1486 CG GLN A 100 28.614 -3.978 -2.700 1.00 0.00 C ATOM 1487 CD GLN A 100 27.461 -3.786 -3.697 1.00 0.00 C ATOM 1488 OE1 GLN A 100 27.484 -2.858 -4.498 1.00 0.00 O ATOM 1489 NE2 GLN A 100 26.408 -4.591 -3.651 1.00 0.00 N ATOM 0 H GLN A 100 26.211 -3.398 -2.021 1.00 0.00 H new ATOM 0 HA GLN A 100 27.114 -4.367 0.470 1.00 0.00 H new ATOM 0 HB2 GLN A 100 29.180 -4.820 -0.820 1.00 0.00 H new ATOM 0 HB3 GLN A 100 27.719 -5.505 -1.503 1.00 0.00 H new ATOM 0 HG2 GLN A 100 29.088 -3.010 -2.538 1.00 0.00 H new ATOM 0 HG3 GLN A 100 29.359 -4.625 -3.162 1.00 0.00 H new ATOM 0 HE21 GLN A 100 26.386 -5.364 -2.986 1.00 0.00 H new ATOM 0 HE22 GLN A 100 25.621 -4.437 -4.281 1.00 0.00 H new ATOM 1498 N LEU A 101 27.543 -1.680 1.017 1.00 0.00 N ATOM 1499 CA LEU A 101 28.164 -0.475 1.550 1.00 0.00 C ATOM 1500 C LEU A 101 29.140 -0.811 2.687 1.00 0.00 C ATOM 1501 O LEU A 101 29.154 -1.936 3.186 1.00 0.00 O ATOM 1502 CB LEU A 101 27.073 0.530 2.010 1.00 0.00 C ATOM 1503 CG LEU A 101 26.928 1.805 1.157 1.00 0.00 C ATOM 1504 CD1 LEU A 101 28.182 2.682 1.209 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.585 1.482 -0.300 1.00 0.00 C ATOM 0 H LEU A 101 26.558 -1.780 1.263 1.00 0.00 H new ATOM 0 HA LEU A 101 28.746 -0.004 0.758 1.00 0.00 H new ATOM 0 HB2 LEU A 101 26.113 0.014 2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 101 27.289 0.826 3.037 1.00 0.00 H new ATOM 0 HG LEU A 101 26.101 2.364 1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 101 28.032 3.568 0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 101 28.372 2.984 2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 101 29.036 2.119 0.832 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.492 2.409 -0.866 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.376 0.870 -0.733 1.00 0.00 H new ATOM 0 HD23 LEU A 101 25.642 0.936 -0.340 1.00 0.00 H new ATOM 1517 N GLU A 102 29.923 0.190 3.104 1.00 0.00 N ATOM 1518 CA GLU A 102 30.951 0.103 4.137 1.00 0.00 C ATOM 1519 C GLU A 102 30.454 -0.617 5.386 1.00 0.00 C ATOM 1520 O GLU A 102 29.311 -0.456 5.803 1.00 0.00 O ATOM 1521 CB GLU A 102 31.427 1.516 4.514 1.00 0.00 C ATOM 1522 CG GLU A 102 32.416 2.071 3.489 1.00 0.00 C ATOM 1523 CD GLU A 102 32.900 3.485 3.871 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.158 4.466 3.621 1.00 0.00 O ATOM 1525 OE2 GLU A 102 34.026 3.616 4.406 1.00 0.00 O ATOM 0 H GLU A 102 29.850 1.127 2.708 1.00 0.00 H new ATOM 0 HA GLU A 102 31.778 -0.478 3.728 1.00 0.00 H new ATOM 0 HB2 GLU A 102 30.567 2.182 4.588 1.00 0.00 H new ATOM 0 HB3 GLU A 102 31.897 1.492 5.497 1.00 0.00 H new ATOM 0 HG2 GLU A 102 33.273 1.402 3.411 1.00 0.00 H new ATOM 0 HG3 GLU A 102 31.944 2.101 2.507 1.00 0.00 H new ATOM 1532 N ASP A 103 31.345 -1.399 5.984 1.00 0.00 N ATOM 1533 CA ASP A 103 31.117 -2.125 7.233 1.00 0.00 C ATOM 1534 C ASP A 103 31.478 -1.208 8.410 1.00 0.00 C ATOM 1535 O ASP A 103 32.658 -0.877 8.570 1.00 0.00 O ATOM 1536 CB ASP A 103 31.981 -3.389 7.262 1.00 0.00 C ATOM 1537 CG ASP A 103 31.909 -4.082 8.629 1.00 0.00 C ATOM 1538 OD1 ASP A 103 30.894 -3.923 9.348 1.00 0.00 O ATOM 1539 OD2 ASP A 103 32.866 -4.821 8.955 1.00 0.00 O ATOM 0 H ASP A 103 32.278 -1.552 5.602 1.00 0.00 H new ATOM 0 HA ASP A 103 30.070 -2.419 7.308 1.00 0.00 H new ATOM 0 HB2 ASP A 103 31.648 -4.077 6.485 1.00 0.00 H new ATOM 0 HB3 ASP A 103 33.016 -3.130 7.037 1.00 0.00 H new ATOM 1544 N PRO A 104 30.505 -0.755 9.224 1.00 0.00 N ATOM 1545 CA PRO A 104 30.779 0.093 10.370 1.00 0.00 C ATOM 1546 C PRO A 104 31.197 -0.716 11.613 1.00 0.00 C ATOM 1547 O PRO A 104 31.584 -0.086 12.590 1.00 0.00 O ATOM 1548 CB PRO A 104 29.473 0.851 10.597 1.00 0.00 C ATOM 1549 CG PRO A 104 28.419 -0.197 10.242 1.00 0.00 C ATOM 1550 CD PRO A 104 29.071 -0.958 9.088 1.00 0.00 C ATOM 0 HA PRO A 104 31.621 0.761 10.189 1.00 0.00 H new ATOM 0 HB2 PRO A 104 29.375 1.192 11.628 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.399 1.733 9.961 1.00 0.00 H new ATOM 0 HG2 PRO A 104 28.200 -0.852 11.085 1.00 0.00 H new ATOM 0 HG3 PRO A 104 27.477 0.262 9.942 1.00 0.00 H new ATOM 0 HD2 PRO A 104 28.822 -2.018 9.132 1.00 0.00 H new ATOM 0 HD3 PRO A 104 28.715 -0.587 8.127 1.00 0.00 H new ATOM 1558 N ASP A 105 31.125 -2.058 11.586 1.00 0.00 N ATOM 1559 CA ASP A 105 31.451 -3.009 12.660 1.00 0.00 C ATOM 1560 C ASP A 105 31.364 -2.409 14.073 1.00 0.00 C ATOM 1561 O ASP A 105 30.274 -2.288 14.632 1.00 0.00 O ATOM 1562 CB ASP A 105 32.827 -3.646 12.397 1.00 0.00 C ATOM 1563 CG ASP A 105 33.227 -4.636 13.509 1.00 0.00 C ATOM 1564 OD1 ASP A 105 32.354 -5.359 14.041 1.00 0.00 O ATOM 1565 OD2 ASP A 105 34.430 -4.671 13.858 1.00 0.00 O ATOM 0 H ASP A 105 30.812 -2.543 10.745 1.00 0.00 H new ATOM 0 HA ASP A 105 30.685 -3.784 12.638 1.00 0.00 H new ATOM 0 HB2 ASP A 105 32.809 -4.165 11.439 1.00 0.00 H new ATOM 0 HB3 ASP A 105 33.581 -2.862 12.321 1.00 0.00 H new ATOM 1570 N GLY A 106 32.502 -1.985 14.618 1.00 0.00 N ATOM 1571 CA GLY A 106 32.661 -1.302 15.901 1.00 0.00 C ATOM 1572 C GLY A 106 33.582 -0.085 15.754 1.00 0.00 C ATOM 1573 O GLY A 106 34.518 0.087 16.539 1.00 0.00 O ATOM 0 H GLY A 106 33.396 -2.118 14.145 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.687 -0.985 16.273 1.00 0.00 H new ATOM 0 HA3 GLY A 106 33.075 -1.991 16.637 1.00 0.00 H new ATOM 1577 N GLN A 107 33.372 0.691 14.687 1.00 0.00 N ATOM 1578 CA GLN A 107 34.185 1.838 14.290 1.00 0.00 C ATOM 1579 C GLN A 107 34.035 3.040 15.228 1.00 0.00 C ATOM 1580 O GLN A 107 33.365 3.010 16.266 1.00 0.00 O ATOM 1581 CB GLN A 107 33.791 2.247 12.855 1.00 0.00 C ATOM 1582 CG GLN A 107 34.335 1.273 11.810 1.00 0.00 C ATOM 1583 CD GLN A 107 35.669 1.711 11.206 1.00 0.00 C ATOM 1584 OE1 GLN A 107 36.627 2.012 11.915 1.00 0.00 O ATOM 1585 NE2 GLN A 107 35.755 1.775 9.883 1.00 0.00 N ATOM 0 H GLN A 107 32.594 0.527 14.049 1.00 0.00 H new ATOM 0 HA GLN A 107 35.230 1.534 14.343 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.705 2.293 12.777 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.168 3.249 12.647 1.00 0.00 H new ATOM 0 HG2 GLN A 107 34.457 0.292 12.268 1.00 0.00 H new ATOM 0 HG3 GLN A 107 33.602 1.163 11.011 1.00 0.00 H new ATOM 0 HE21 GLN A 107 34.952 1.522 9.307 1.00 0.00 H new ATOM 0 HE22 GLN A 107 36.624 2.077 9.442 1.00 0.00 H new ATOM 1594 N SER A 108 34.698 4.118 14.816 1.00 0.00 N ATOM 1595 CA SER A 108 34.568 5.454 15.370 1.00 0.00 C ATOM 1596 C SER A 108 33.184 6.020 15.020 1.00 0.00 C ATOM 1597 O SER A 108 32.541 5.555 14.070 1.00 0.00 O ATOM 1598 CB SER A 108 35.705 6.326 14.813 1.00 0.00 C ATOM 1599 OG SER A 108 35.897 6.104 13.422 1.00 0.00 O ATOM 0 H SER A 108 35.371 4.077 14.051 1.00 0.00 H new ATOM 0 HA SER A 108 34.649 5.436 16.457 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.477 7.378 14.987 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.629 6.107 15.349 1.00 0.00 H new ATOM 0 HG SER A 108 36.625 6.674 13.097 1.00 0.00 H new ATOM 1605 N LEU A 109 32.747 7.069 15.735 1.00 0.00 N ATOM 1606 CA LEU A 109 31.461 7.732 15.477 1.00 0.00 C ATOM 1607 C LEU A 109 31.369 8.201 14.034 1.00 0.00 C ATOM 1608 O LEU A 109 30.309 8.112 13.425 1.00 0.00 O ATOM 1609 CB LEU A 109 31.233 8.958 16.387 1.00 0.00 C ATOM 1610 CG LEU A 109 31.122 8.715 17.904 1.00 0.00 C ATOM 1611 CD1 LEU A 109 30.596 9.989 18.580 1.00 0.00 C ATOM 1612 CD2 LEU A 109 30.201 7.540 18.237 1.00 0.00 C ATOM 0 H LEU A 109 33.274 7.480 16.506 1.00 0.00 H new ATOM 0 HA LEU A 109 30.696 6.985 15.688 1.00 0.00 H new ATOM 0 HB2 LEU A 109 32.052 9.657 16.219 1.00 0.00 H new ATOM 0 HB3 LEU A 109 30.319 9.453 16.059 1.00 0.00 H new ATOM 0 HG LEU A 109 32.116 8.465 18.276 1.00 0.00 H new ATOM 0 HD11 LEU A 109 30.515 9.824 19.654 1.00 0.00 H new ATOM 0 HD12 LEU A 109 31.285 10.812 18.390 1.00 0.00 H new ATOM 0 HD13 LEU A 109 29.614 10.237 18.176 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.155 7.409 19.318 1.00 0.00 H new ATOM 0 HD22 LEU A 109 29.201 7.742 17.853 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.590 6.631 17.777 1.00 0.00 H new ATOM 1624 N GLU A 110 32.486 8.670 13.477 1.00 0.00 N ATOM 1625 CA GLU A 110 32.528 9.261 12.146 1.00 0.00 C ATOM 1626 C GLU A 110 32.057 8.263 11.111 1.00 0.00 C ATOM 1627 O GLU A 110 31.343 8.652 10.192 1.00 0.00 O ATOM 1628 CB GLU A 110 33.946 9.737 11.810 1.00 0.00 C ATOM 1629 CG GLU A 110 34.301 10.924 12.700 1.00 0.00 C ATOM 1630 CD GLU A 110 35.659 11.541 12.316 1.00 0.00 C ATOM 1631 OE1 GLU A 110 35.687 12.468 11.469 1.00 0.00 O ATOM 1632 OE2 GLU A 110 36.704 11.120 12.869 1.00 0.00 O ATOM 0 H GLU A 110 33.393 8.649 13.944 1.00 0.00 H new ATOM 0 HA GLU A 110 31.860 10.123 12.134 1.00 0.00 H new ATOM 0 HB2 GLU A 110 34.660 8.927 11.962 1.00 0.00 H new ATOM 0 HB3 GLU A 110 34.007 10.023 10.760 1.00 0.00 H new ATOM 0 HG2 GLU A 110 33.522 11.683 12.622 1.00 0.00 H new ATOM 0 HG3 GLU A 110 34.329 10.602 13.741 1.00 0.00 H new ATOM 1639 N VAL A 111 32.388 6.980 11.263 1.00 0.00 N ATOM 1640 CA VAL A 111 31.982 6.003 10.277 1.00 0.00 C ATOM 1641 C VAL A 111 30.485 5.736 10.442 1.00 0.00 C ATOM 1642 O VAL A 111 29.772 5.748 9.443 1.00 0.00 O ATOM 1643 CB VAL A 111 32.877 4.752 10.365 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.533 3.730 9.273 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.356 5.150 10.210 1.00 0.00 C ATOM 0 H VAL A 111 32.925 6.608 12.046 1.00 0.00 H new ATOM 0 HA VAL A 111 32.122 6.376 9.262 1.00 0.00 H new ATOM 0 HB VAL A 111 32.702 4.298 11.340 1.00 0.00 H new ATOM 0 HG11 VAL A 111 33.186 2.862 9.368 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.495 3.417 9.382 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.674 4.184 8.292 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.981 4.259 10.274 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.504 5.629 9.242 1.00 0.00 H new ATOM 0 HG23 VAL A 111 34.631 5.844 11.004 1.00 0.00 H new ATOM 1655 N PHE A 112 29.969 5.620 11.671 1.00 0.00 N ATOM 1656 CA PHE A 112 28.524 5.537 11.898 1.00 0.00 C ATOM 1657 C PHE A 112 27.773 6.732 11.291 1.00 0.00 C ATOM 1658 O PHE A 112 26.682 6.542 10.764 1.00 0.00 O ATOM 1659 CB PHE A 112 28.214 5.341 13.397 1.00 0.00 C ATOM 1660 CG PHE A 112 28.599 3.970 13.908 1.00 0.00 C ATOM 1661 CD1 PHE A 112 27.836 2.850 13.535 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.733 3.806 14.721 1.00 0.00 C ATOM 1663 CE1 PHE A 112 28.239 1.563 13.937 1.00 0.00 C ATOM 1664 CE2 PHE A 112 30.117 2.520 15.138 1.00 0.00 C ATOM 1665 CZ PHE A 112 29.386 1.396 14.728 1.00 0.00 C ATOM 0 H PHE A 112 30.531 5.582 12.522 1.00 0.00 H new ATOM 0 HA PHE A 112 28.155 4.656 11.373 1.00 0.00 H new ATOM 0 HB2 PHE A 112 28.744 6.099 13.974 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.149 5.499 13.565 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.943 2.977 12.941 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.309 4.667 15.025 1.00 0.00 H new ATOM 0 HE1 PHE A 112 27.663 0.700 13.636 1.00 0.00 H new ATOM 0 HE2 PHE A 112 30.979 2.397 15.777 1.00 0.00 H new ATOM 0 HZ PHE A 112 29.704 0.406 15.020 1.00 0.00 H new ATOM 1675 N ARG A 113 28.347 7.943 11.284 1.00 0.00 N ATOM 1676 CA ARG A 113 27.740 9.101 10.593 1.00 0.00 C ATOM 1677 C ARG A 113 27.863 8.978 9.074 1.00 0.00 C ATOM 1678 O ARG A 113 26.910 9.251 8.347 1.00 0.00 O ATOM 1679 CB ARG A 113 28.416 10.426 11.008 1.00 0.00 C ATOM 1680 CG ARG A 113 28.284 10.736 12.509 1.00 0.00 C ATOM 1681 CD ARG A 113 28.971 12.047 12.910 1.00 0.00 C ATOM 1682 NE ARG A 113 28.152 13.232 12.584 1.00 0.00 N ATOM 1683 CZ ARG A 113 27.302 13.864 13.411 1.00 0.00 C ATOM 1684 NH1 ARG A 113 27.031 13.375 14.616 1.00 0.00 N ATOM 1685 NH2 ARG A 113 26.708 14.987 13.027 1.00 0.00 N ATOM 0 H ARG A 113 29.231 8.151 11.748 1.00 0.00 H new ATOM 0 HA ARG A 113 26.690 9.107 10.884 1.00 0.00 H new ATOM 0 HB2 ARG A 113 29.473 10.384 10.745 1.00 0.00 H new ATOM 0 HB3 ARG A 113 27.978 11.244 10.436 1.00 0.00 H new ATOM 0 HG2 ARG A 113 27.228 10.790 12.772 1.00 0.00 H new ATOM 0 HG3 ARG A 113 28.714 9.916 13.084 1.00 0.00 H new ATOM 0 HD2 ARG A 113 29.177 12.034 13.980 1.00 0.00 H new ATOM 0 HD3 ARG A 113 29.932 12.121 12.401 1.00 0.00 H new ATOM 0 HE ARG A 113 28.240 13.607 11.640 1.00 0.00 H new ATOM 0 HH11 ARG A 113 27.470 12.508 14.925 1.00 0.00 H new ATOM 0 HH12 ARG A 113 26.384 13.867 15.232 1.00 0.00 H new ATOM 0 HH21 ARG A 113 26.896 15.373 12.102 1.00 0.00 H new ATOM 0 HH22 ARG A 113 26.063 15.464 13.657 1.00 0.00 H new ATOM 1699 N THR A 114 29.035 8.598 8.590 1.00 0.00 N ATOM 1700 CA THR A 114 29.375 8.658 7.175 1.00 0.00 C ATOM 1701 C THR A 114 28.704 7.542 6.377 1.00 0.00 C ATOM 1702 O THR A 114 28.280 7.756 5.243 1.00 0.00 O ATOM 1703 CB THR A 114 30.910 8.607 7.061 1.00 0.00 C ATOM 1704 OG1 THR A 114 31.471 9.734 7.708 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.412 8.588 5.617 1.00 0.00 C ATOM 0 H THR A 114 29.787 8.234 9.175 1.00 0.00 H new ATOM 0 HA THR A 114 29.001 9.586 6.743 1.00 0.00 H new ATOM 0 HB THR A 114 31.220 7.675 7.533 1.00 0.00 H new ATOM 0 HG1 THR A 114 31.555 9.552 8.667 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.501 8.552 5.611 1.00 0.00 H new ATOM 0 HG22 THR A 114 31.017 7.710 5.106 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.076 9.489 5.103 1.00 0.00 H new ATOM 1713 N VAL A 115 28.599 6.335 6.930 1.00 0.00 N ATOM 1714 CA VAL A 115 28.029 5.196 6.205 1.00 0.00 C ATOM 1715 C VAL A 115 26.530 5.447 6.090 1.00 0.00 C ATOM 1716 O VAL A 115 25.977 5.390 4.999 1.00 0.00 O ATOM 1717 CB VAL A 115 28.409 3.875 6.904 1.00 0.00 C ATOM 1718 CG1 VAL A 115 27.791 2.649 6.218 1.00 0.00 C ATOM 1719 CG2 VAL A 115 29.935 3.722 6.877 1.00 0.00 C ATOM 0 H VAL A 115 28.901 6.118 7.880 1.00 0.00 H new ATOM 0 HA VAL A 115 28.431 5.098 5.197 1.00 0.00 H new ATOM 0 HB VAL A 115 28.025 3.922 7.923 1.00 0.00 H new ATOM 0 HG11 VAL A 115 28.090 1.745 6.750 1.00 0.00 H new ATOM 0 HG12 VAL A 115 26.704 2.735 6.230 1.00 0.00 H new ATOM 0 HG13 VAL A 115 28.139 2.595 5.187 1.00 0.00 H new ATOM 0 HG21 VAL A 115 30.216 2.791 7.369 1.00 0.00 H new ATOM 0 HG22 VAL A 115 30.281 3.705 5.843 1.00 0.00 H new ATOM 0 HG23 VAL A 115 30.394 4.561 7.400 1.00 0.00 H new ATOM 1729 N ARG A 116 25.910 5.866 7.195 1.00 0.00 N ATOM 1730 CA ARG A 116 24.540 6.370 7.270 1.00 0.00 C ATOM 1731 C ARG A 116 24.240 7.326 6.122 1.00 0.00 C ATOM 1732 O ARG A 116 23.280 7.088 5.402 1.00 0.00 O ATOM 1733 CB ARG A 116 24.413 7.002 8.670 1.00 0.00 C ATOM 1734 CG ARG A 116 23.265 7.980 8.947 1.00 0.00 C ATOM 1735 CD ARG A 116 23.622 8.854 10.151 1.00 0.00 C ATOM 1736 NE ARG A 116 24.385 10.055 9.736 1.00 0.00 N ATOM 1737 CZ ARG A 116 24.336 11.274 10.294 1.00 0.00 C ATOM 1738 NH1 ARG A 116 23.674 11.494 11.427 1.00 0.00 N ATOM 1739 NH2 ARG A 116 24.976 12.278 9.708 1.00 0.00 N ATOM 0 H ARG A 116 26.373 5.862 8.104 1.00 0.00 H new ATOM 0 HA ARG A 116 23.794 5.584 7.152 1.00 0.00 H new ATOM 0 HB2 ARG A 116 24.333 6.189 9.391 1.00 0.00 H new ATOM 0 HB3 ARG A 116 25.347 7.524 8.881 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.085 8.604 8.072 1.00 0.00 H new ATOM 0 HG3 ARG A 116 22.344 7.431 9.142 1.00 0.00 H new ATOM 0 HD2 ARG A 116 22.710 9.159 10.665 1.00 0.00 H new ATOM 0 HD3 ARG A 116 24.210 8.274 10.862 1.00 0.00 H new ATOM 0 HE ARG A 116 25.015 9.943 8.941 1.00 0.00 H new ATOM 0 HH11 ARG A 116 23.189 10.726 11.891 1.00 0.00 H new ATOM 0 HH12 ARG A 116 23.652 12.430 11.831 1.00 0.00 H new ATOM 0 HH21 ARG A 116 25.496 12.117 8.845 1.00 0.00 H new ATOM 0 HH22 ARG A 116 24.948 13.211 10.120 1.00 0.00 H new ATOM 1753 N GLY A 117 25.045 8.363 5.897 1.00 0.00 N ATOM 1754 CA GLY A 117 24.720 9.345 4.857 1.00 0.00 C ATOM 1755 C GLY A 117 24.738 8.727 3.464 1.00 0.00 C ATOM 1756 O GLY A 117 23.839 8.958 2.658 1.00 0.00 O ATOM 0 H GLY A 117 25.909 8.546 6.407 1.00 0.00 H new ATOM 0 HA2 GLY A 117 23.735 9.769 5.053 1.00 0.00 H new ATOM 0 HA3 GLY A 117 25.435 10.167 4.898 1.00 0.00 H new ATOM 1760 N GLN A 118 25.706 7.852 3.195 1.00 0.00 N ATOM 1761 CA GLN A 118 25.785 7.170 1.909 1.00 0.00 C ATOM 1762 C GLN A 118 24.584 6.253 1.721 1.00 0.00 C ATOM 1763 O GLN A 118 24.015 6.197 0.633 1.00 0.00 O ATOM 1764 CB GLN A 118 27.100 6.391 1.811 1.00 0.00 C ATOM 1765 CG GLN A 118 28.287 7.355 1.890 1.00 0.00 C ATOM 1766 CD GLN A 118 29.599 6.577 1.933 1.00 0.00 C ATOM 1767 OE1 GLN A 118 30.167 6.211 0.906 1.00 0.00 O ATOM 1768 NE2 GLN A 118 30.072 6.278 3.131 1.00 0.00 N ATOM 0 H GLN A 118 26.445 7.600 3.852 1.00 0.00 H new ATOM 0 HA GLN A 118 25.767 7.910 1.109 1.00 0.00 H new ATOM 0 HB2 GLN A 118 27.160 5.660 2.617 1.00 0.00 H new ATOM 0 HB3 GLN A 118 27.134 5.835 0.874 1.00 0.00 H new ATOM 0 HG2 GLN A 118 28.280 8.022 1.028 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.198 7.980 2.778 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.581 6.595 3.967 1.00 0.00 H new ATOM 0 HE22 GLN A 118 30.928 5.731 3.219 1.00 0.00 H new ATOM 1777 N VAL A 119 24.162 5.592 2.798 1.00 0.00 N ATOM 1778 CA VAL A 119 22.962 4.759 2.798 1.00 0.00 C ATOM 1779 C VAL A 119 21.744 5.639 2.519 1.00 0.00 C ATOM 1780 O VAL A 119 20.890 5.231 1.742 1.00 0.00 O ATOM 1781 CB VAL A 119 22.853 3.992 4.132 1.00 0.00 C ATOM 1782 CG1 VAL A 119 21.510 3.281 4.310 1.00 0.00 C ATOM 1783 CG2 VAL A 119 23.957 2.926 4.223 1.00 0.00 C ATOM 0 H VAL A 119 24.644 5.620 3.696 1.00 0.00 H new ATOM 0 HA VAL A 119 23.015 4.009 2.009 1.00 0.00 H new ATOM 0 HB VAL A 119 22.954 4.743 4.915 1.00 0.00 H new ATOM 0 HG11 VAL A 119 21.498 2.761 5.268 1.00 0.00 H new ATOM 0 HG12 VAL A 119 20.704 4.014 4.285 1.00 0.00 H new ATOM 0 HG13 VAL A 119 21.370 2.561 3.504 1.00 0.00 H new ATOM 0 HG21 VAL A 119 23.870 2.391 5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 119 23.852 2.222 3.397 1.00 0.00 H new ATOM 0 HG23 VAL A 119 24.933 3.408 4.167 1.00 0.00 H new ATOM 1793 N LYS A 120 21.663 6.850 3.085 1.00 0.00 N ATOM 1794 CA LYS A 120 20.497 7.716 2.900 1.00 0.00 C ATOM 1795 C LYS A 120 20.270 8.030 1.429 1.00 0.00 C ATOM 1796 O LYS A 120 19.125 8.057 0.989 1.00 0.00 O ATOM 1797 CB LYS A 120 20.570 8.955 3.812 1.00 0.00 C ATOM 1798 CG LYS A 120 21.196 10.271 3.292 1.00 0.00 C ATOM 1799 CD LYS A 120 20.294 11.479 3.602 1.00 0.00 C ATOM 1800 CE LYS A 120 18.996 11.488 2.766 1.00 0.00 C ATOM 1801 NZ LYS A 120 19.136 12.261 1.509 1.00 0.00 N ATOM 0 H LYS A 120 22.393 7.250 3.675 1.00 0.00 H new ATOM 0 HA LYS A 120 19.605 7.177 3.219 1.00 0.00 H new ATOM 0 HB2 LYS A 120 19.552 9.184 4.127 1.00 0.00 H new ATOM 0 HB3 LYS A 120 21.123 8.666 4.706 1.00 0.00 H new ATOM 0 HG2 LYS A 120 22.174 10.417 3.751 1.00 0.00 H new ATOM 0 HG3 LYS A 120 21.356 10.200 2.216 1.00 0.00 H new ATOM 0 HD2 LYS A 120 20.038 11.473 4.662 1.00 0.00 H new ATOM 0 HD3 LYS A 120 20.848 12.398 3.413 1.00 0.00 H new ATOM 0 HE2 LYS A 120 18.713 10.462 2.529 1.00 0.00 H new ATOM 0 HE3 LYS A 120 18.187 11.912 3.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 18.346 12.034 0.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 19.125 13.278 1.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 20.035 12.014 1.048 1.00 0.00 H new ATOM 1815 N GLU A 121 21.343 8.206 0.659 1.00 0.00 N ATOM 1816 CA GLU A 121 21.231 8.436 -0.775 1.00 0.00 C ATOM 1817 C GLU A 121 20.760 7.167 -1.484 1.00 0.00 C ATOM 1818 O GLU A 121 19.890 7.260 -2.344 1.00 0.00 O ATOM 1819 CB GLU A 121 22.562 8.916 -1.376 1.00 0.00 C ATOM 1820 CG GLU A 121 23.019 10.289 -0.873 1.00 0.00 C ATOM 1821 CD GLU A 121 21.978 11.392 -1.150 1.00 0.00 C ATOM 1822 OE1 GLU A 121 21.983 11.965 -2.267 1.00 0.00 O ATOM 1823 OE2 GLU A 121 21.152 11.682 -0.252 1.00 0.00 O ATOM 0 H GLU A 121 22.301 8.193 1.009 1.00 0.00 H new ATOM 0 HA GLU A 121 20.492 9.223 -0.926 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.336 8.182 -1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 121 22.466 8.953 -2.461 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.211 10.235 0.199 1.00 0.00 H new ATOM 0 HG3 GLU A 121 23.961 10.554 -1.353 1.00 0.00 H new ATOM 1830 N ARG A 122 21.279 5.979 -1.142 1.00 0.00 N ATOM 1831 CA ARG A 122 20.815 4.741 -1.782 1.00 0.00 C ATOM 1832 C ARG A 122 19.341 4.499 -1.466 1.00 0.00 C ATOM 1833 O ARG A 122 18.567 4.210 -2.375 1.00 0.00 O ATOM 1834 CB ARG A 122 21.667 3.533 -1.364 1.00 0.00 C ATOM 1835 CG ARG A 122 22.969 3.373 -2.162 1.00 0.00 C ATOM 1836 CD ARG A 122 24.050 4.405 -1.836 1.00 0.00 C ATOM 1837 NE ARG A 122 25.237 4.246 -2.697 1.00 0.00 N ATOM 1838 CZ ARG A 122 26.266 5.102 -2.777 1.00 0.00 C ATOM 1839 NH1 ARG A 122 26.285 6.203 -2.027 1.00 0.00 N ATOM 1840 NH2 ARG A 122 27.273 4.847 -3.606 1.00 0.00 N ATOM 0 H ARG A 122 22.007 5.850 -0.439 1.00 0.00 H new ATOM 0 HA ARG A 122 20.927 4.861 -2.860 1.00 0.00 H new ATOM 0 HB2 ARG A 122 21.912 3.624 -0.306 1.00 0.00 H new ATOM 0 HB3 ARG A 122 21.072 2.627 -1.476 1.00 0.00 H new ATOM 0 HG2 ARG A 122 23.371 2.376 -1.980 1.00 0.00 H new ATOM 0 HG3 ARG A 122 22.737 3.433 -3.225 1.00 0.00 H new ATOM 0 HD2 ARG A 122 23.643 5.409 -1.960 1.00 0.00 H new ATOM 0 HD3 ARG A 122 24.343 4.306 -0.791 1.00 0.00 H new ATOM 0 HE ARG A 122 25.279 3.412 -3.283 1.00 0.00 H new ATOM 0 HH11 ARG A 122 25.514 6.398 -1.388 1.00 0.00 H new ATOM 0 HH12 ARG A 122 27.070 6.851 -2.092 1.00 0.00 H new ATOM 0 HH21 ARG A 122 27.261 4.003 -4.178 1.00 0.00 H new ATOM 0 HH22 ARG A 122 28.058 5.496 -3.670 1.00 0.00 H new ATOM 1854 N VAL A 123 18.933 4.705 -0.214 1.00 0.00 N ATOM 1855 CA VAL A 123 17.544 4.645 0.194 1.00 0.00 C ATOM 1856 C VAL A 123 16.720 5.593 -0.660 1.00 0.00 C ATOM 1857 O VAL A 123 15.758 5.175 -1.295 1.00 0.00 O ATOM 1858 CB VAL A 123 17.467 4.957 1.695 1.00 0.00 C ATOM 1859 CG1 VAL A 123 16.029 5.123 2.156 1.00 0.00 C ATOM 1860 CG2 VAL A 123 18.081 3.837 2.548 1.00 0.00 C ATOM 0 H VAL A 123 19.573 4.921 0.550 1.00 0.00 H new ATOM 0 HA VAL A 123 17.125 3.650 0.041 1.00 0.00 H new ATOM 0 HB VAL A 123 18.026 5.883 1.829 1.00 0.00 H new ATOM 0 HG11 VAL A 123 16.012 5.343 3.223 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.564 5.943 1.609 1.00 0.00 H new ATOM 0 HG13 VAL A 123 15.478 4.202 1.967 1.00 0.00 H new ATOM 0 HG21 VAL A 123 18.005 4.100 3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 123 17.545 2.906 2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 123 19.130 3.710 2.281 1.00 0.00 H new ATOM 1870 N GLU A 124 17.114 6.853 -0.728 1.00 0.00 N ATOM 1871 CA GLU A 124 16.339 7.853 -1.429 1.00 0.00 C ATOM 1872 C GLU A 124 16.272 7.558 -2.928 1.00 0.00 C ATOM 1873 O GLU A 124 15.245 7.806 -3.553 1.00 0.00 O ATOM 1874 CB GLU A 124 16.923 9.209 -1.080 1.00 0.00 C ATOM 1875 CG GLU A 124 16.073 10.344 -1.637 1.00 0.00 C ATOM 1876 CD GLU A 124 16.622 11.732 -1.251 1.00 0.00 C ATOM 1877 OE1 GLU A 124 16.876 11.979 -0.048 1.00 0.00 O ATOM 1878 OE2 GLU A 124 16.794 12.588 -2.152 1.00 0.00 O ATOM 0 H GLU A 124 17.971 7.206 -0.303 1.00 0.00 H new ATOM 0 HA GLU A 124 15.296 7.842 -1.113 1.00 0.00 H new ATOM 0 HB2 GLU A 124 16.997 9.306 0.003 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.936 9.283 -1.477 1.00 0.00 H new ATOM 0 HG2 GLU A 124 16.029 10.263 -2.723 1.00 0.00 H new ATOM 0 HG3 GLU A 124 15.052 10.245 -1.269 1.00 0.00 H new ATOM 1885 N ASN A 125 17.324 6.972 -3.502 1.00 0.00 N ATOM 1886 CA ASN A 125 17.324 6.497 -4.880 1.00 0.00 C ATOM 1887 C ASN A 125 16.295 5.392 -5.082 1.00 0.00 C ATOM 1888 O ASN A 125 15.517 5.461 -6.029 1.00 0.00 O ATOM 1889 CB ASN A 125 18.705 5.983 -5.306 1.00 0.00 C ATOM 1890 CG ASN A 125 19.572 7.084 -5.906 1.00 0.00 C ATOM 1891 OD1 ASN A 125 19.650 7.238 -7.121 1.00 0.00 O ATOM 1892 ND2 ASN A 125 20.224 7.882 -5.075 1.00 0.00 N ATOM 0 H ASN A 125 18.207 6.814 -3.016 1.00 0.00 H new ATOM 0 HA ASN A 125 17.062 7.352 -5.503 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.213 5.554 -4.442 1.00 0.00 H new ATOM 0 HB3 ASN A 125 18.583 5.182 -6.035 1.00 0.00 H new ATOM 0 HD21 ASN A 125 20.802 8.638 -5.442 1.00 0.00 H new ATOM 0 HD22 ASN A 125 20.149 7.741 -4.068 1.00 0.00 H new ATOM 1899 N LEU A 126 16.257 4.388 -4.200 1.00 0.00 N ATOM 1900 CA LEU A 126 15.245 3.326 -4.247 1.00 0.00 C ATOM 1901 C LEU A 126 13.859 3.942 -4.208 1.00 0.00 C ATOM 1902 O LEU A 126 13.025 3.625 -5.051 1.00 0.00 O ATOM 1903 CB LEU A 126 15.499 2.279 -3.144 1.00 0.00 C ATOM 1904 CG LEU A 126 14.295 1.704 -2.368 1.00 0.00 C ATOM 1905 CD1 LEU A 126 14.454 0.212 -2.132 1.00 0.00 C ATOM 1906 CD2 LEU A 126 14.119 2.327 -0.981 1.00 0.00 C ATOM 0 H LEU A 126 16.925 4.288 -3.435 1.00 0.00 H new ATOM 0 HA LEU A 126 15.317 2.778 -5.187 1.00 0.00 H new ATOM 0 HB2 LEU A 126 16.027 1.442 -3.600 1.00 0.00 H new ATOM 0 HB3 LEU A 126 16.177 2.725 -2.416 1.00 0.00 H new ATOM 0 HG LEU A 126 13.432 1.931 -2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 126 13.590 -0.164 -1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 126 14.527 -0.302 -3.090 1.00 0.00 H new ATOM 0 HD13 LEU A 126 15.359 0.030 -1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.256 1.880 -0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 126 15.013 2.145 -0.384 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.963 3.401 -1.082 1.00 0.00 H new ATOM 1918 N ILE A 127 13.650 4.865 -3.282 1.00 0.00 N ATOM 1919 CA ILE A 127 12.405 5.602 -3.120 1.00 0.00 C ATOM 1920 C ILE A 127 12.062 6.344 -4.412 1.00 0.00 C ATOM 1921 O ILE A 127 10.914 6.295 -4.839 1.00 0.00 O ATOM 1922 CB ILE A 127 12.594 6.519 -1.902 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.200 5.707 -0.653 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.843 7.854 -1.930 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.176 5.956 0.486 1.00 0.00 C ATOM 0 H ILE A 127 14.363 5.130 -2.602 1.00 0.00 H new ATOM 0 HA ILE A 127 11.551 4.950 -2.935 1.00 0.00 H new ATOM 0 HB ILE A 127 13.641 6.823 -1.901 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.192 5.980 -0.340 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.182 4.645 -0.896 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.056 8.411 -1.017 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.166 8.435 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.771 7.667 -1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 127 12.876 5.372 1.356 1.00 0.00 H new ATOM 0 HD12 ILE A 127 14.179 5.660 0.177 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.174 7.015 0.742 1.00 0.00 H new ATOM 1937 N ALA A 128 13.035 6.973 -5.071 1.00 0.00 N ATOM 1938 CA ALA A 128 12.804 7.689 -6.315 1.00 0.00 C ATOM 1939 C ALA A 128 12.259 6.766 -7.416 1.00 0.00 C ATOM 1940 O ALA A 128 11.518 7.232 -8.287 1.00 0.00 O ATOM 1941 CB ALA A 128 14.080 8.414 -6.761 1.00 0.00 C ATOM 0 H ALA A 128 14.004 6.998 -4.753 1.00 0.00 H new ATOM 0 HA ALA A 128 12.035 8.439 -6.132 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.890 8.945 -7.694 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.381 9.126 -5.993 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.877 7.687 -6.914 1.00 0.00 H new ATOM 1947 N LYS A 129 12.593 5.467 -7.389 1.00 0.00 N ATOM 1948 CA LYS A 129 12.061 4.499 -8.332 1.00 0.00 C ATOM 1949 C LYS A 129 10.614 4.126 -8.006 1.00 0.00 C ATOM 1950 O LYS A 129 9.809 3.992 -8.929 1.00 0.00 O ATOM 1951 CB LYS A 129 12.913 3.221 -8.341 1.00 0.00 C ATOM 1952 CG LYS A 129 14.391 3.491 -8.647 1.00 0.00 C ATOM 1953 CD LYS A 129 15.213 2.224 -8.423 1.00 0.00 C ATOM 1954 CE LYS A 129 16.702 2.565 -8.564 1.00 0.00 C ATOM 1955 NZ LYS A 129 17.556 1.361 -8.754 1.00 0.00 N ATOM 0 H LYS A 129 13.240 5.068 -6.709 1.00 0.00 H new ATOM 0 HA LYS A 129 12.090 4.969 -9.315 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.832 2.730 -7.371 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.514 2.530 -9.083 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.501 3.828 -9.678 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.762 4.292 -8.008 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.012 1.815 -7.433 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.931 1.459 -9.147 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.837 3.237 -9.411 1.00 0.00 H new ATOM 0 HE3 LYS A 129 17.032 3.102 -7.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 18.558 1.635 -8.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 17.352 0.669 -8.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.356 0.936 -9.682 1.00 0.00 H new ATOM 1969 N ILE A 130 10.284 3.957 -6.721 1.00 0.00 N ATOM 1970 CA ILE A 130 9.022 3.373 -6.286 1.00 0.00 C ATOM 1971 C ILE A 130 7.940 4.338 -5.807 1.00 0.00 C ATOM 1972 O ILE A 130 6.766 4.102 -6.109 1.00 0.00 O ATOM 1973 CB ILE A 130 9.297 2.278 -5.236 1.00 0.00 C ATOM 1974 CG1 ILE A 130 10.060 2.718 -3.970 1.00 0.00 C ATOM 1975 CG2 ILE A 130 9.897 1.054 -5.949 1.00 0.00 C ATOM 1976 CD1 ILE A 130 10.646 1.557 -3.154 1.00 0.00 C ATOM 0 H ILE A 130 10.895 4.226 -5.950 1.00 0.00 H new ATOM 0 HA ILE A 130 8.585 2.953 -7.192 1.00 0.00 H new ATOM 0 HB ILE A 130 8.337 2.006 -4.796 1.00 0.00 H new ATOM 0 HG12 ILE A 130 10.869 3.388 -4.261 1.00 0.00 H new ATOM 0 HG13 ILE A 130 9.386 3.291 -3.333 1.00 0.00 H new ATOM 0 HG21 ILE A 130 10.097 0.270 -5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.192 0.685 -6.694 1.00 0.00 H new ATOM 0 HG23 ILE A 130 10.827 1.339 -6.440 1.00 0.00 H new ATOM 0 HD11 ILE A 130 11.166 1.952 -2.281 1.00 0.00 H new ATOM 0 HD12 ILE A 130 9.841 0.898 -2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 130 11.348 0.996 -3.771 1.00 0.00 H new ATOM 1988 N SER A 131 8.281 5.351 -5.026 1.00 0.00 N ATOM 1989 CA SER A 131 7.314 6.237 -4.409 1.00 0.00 C ATOM 1990 C SER A 131 6.627 7.098 -5.476 1.00 0.00 C ATOM 1991 O SER A 131 5.388 7.271 -5.398 1.00 0.00 O ATOM 1992 CB SER A 131 8.003 7.087 -3.347 1.00 0.00 C ATOM 1993 OG SER A 131 8.601 6.226 -2.380 1.00 0.00 O ATOM 1994 OXT SER A 131 7.319 7.616 -6.385 1.00 0.00 O ATOM 0 H SER A 131 9.249 5.581 -4.802 1.00 0.00 H new ATOM 0 HA SER A 131 6.538 5.650 -3.918 1.00 0.00 H new ATOM 0 HB2 SER A 131 8.761 7.722 -3.806 1.00 0.00 H new ATOM 0 HB3 SER A 131 7.281 7.748 -2.867 1.00 0.00 H new ATOM 0 HG SER A 131 9.473 5.921 -2.708 1.00 0.00 H new TER 2000 SER A 131