USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=29 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 16 GLN : amide:sc= 2.53 K(o=6.2,f=-5.2!) USER MOD Set 1.2: A 23 LYS NZ :NH3+ -175:sc= 1.13 (180deg=0) USER MOD Set 1.3: A 60 GLN : amide:sc= 1.13 K(o=6.2,f=-0.42) USER MOD Set 1.4: A 62 SER OG : rot 157:sc= 1.39 USER MOD Set 2.1: A 12 SER OG : rot 150:sc= 0 USER MOD Set 2.2: A 40 SER OG : rot 180:sc= 0.343 USER MOD Set 3.1: A 11 ASN : amide:sc= -0.373 K(o=0.91,f=-3.1!) USER MOD Set 3.2: A 34 SER OG : rot -80:sc= 1.29 USER MOD Set 4.1: A 8 SER OG : rot 109:sc= 2.44 USER MOD Set 4.2: A 15 SER OG : rot 84:sc= 1.17 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 175:sc= 2.48 (180deg=2.37) USER MOD Single : A 3 LYS NZ :NH3+ -177:sc= 1.28 (180deg=1.21) USER MOD Single : A 5 MET CE :methyl -169:sc= -1.4 (180deg=-2.12!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 168:sc= 1.54 USER MOD Single : A 17 MET CE :methyl 168:sc=-0.00104 (180deg=-0.287) USER MOD Single : A 24 THR OG1 : rot -73:sc= 0.186 USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 1.25 (180deg=1.13) USER MOD Single : A 33 THR OG1 : rot 72:sc= 0.803 USER MOD Single : A 35 SER OG : rot 160:sc= -0.0568 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0.804 K(o=0.8,f=-7.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 177:sc= -0.68 (180deg=-0.767) USER MOD Single : A 50 MET CE :methyl -159:sc= -1.15 (180deg=-3.18!) USER MOD Single : A 58 SER OG : rot -74:sc= 0.969 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.676 K(o=0.68,f=-0.029) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -84:sc= 1.21 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.842 K(o=0.84,f=-0.16) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.455 X(o=0.45,f=-0.0058) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 70:sc= 1.19 USER MOD Single : A 118 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.092) USER MOD Single : A 120 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.2) USER MOD Single : A 125 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.2) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0.0275 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.994 -0.031 0.716 1.00 0.00 N ATOM 2 CA MET A 1 2.477 -0.031 -0.705 1.00 0.00 C ATOM 3 C MET A 1 2.743 -1.467 -1.192 1.00 0.00 C ATOM 4 O MET A 1 3.395 -2.231 -0.486 1.00 0.00 O ATOM 5 CB MET A 1 3.742 0.855 -0.877 1.00 0.00 C ATOM 6 CG MET A 1 3.885 1.398 -2.306 1.00 0.00 C ATOM 7 SD MET A 1 2.569 2.542 -2.825 1.00 0.00 S ATOM 8 CE MET A 1 3.094 4.075 -2.004 1.00 0.00 C ATOM 0 H1 MET A 1 1.821 0.947 1.024 1.00 0.00 H new ATOM 0 H2 MET A 1 1.111 -0.576 0.782 1.00 0.00 H new ATOM 0 H3 MET A 1 2.715 -0.464 1.328 1.00 0.00 H new ATOM 0 HA MET A 1 1.688 0.399 -1.322 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.696 1.689 -0.177 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.628 0.273 -0.622 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.844 1.908 -2.391 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.909 0.556 -2.998 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.383 4.870 -2.229 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.131 3.916 -0.926 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.083 4.360 -2.363 1.00 0.00 H new ATOM 20 N LYS A 2 2.283 -1.852 -2.396 1.00 0.00 N ATOM 21 CA LYS A 2 2.454 -3.223 -2.946 1.00 0.00 C ATOM 22 C LYS A 2 3.831 -3.389 -3.607 1.00 0.00 C ATOM 23 O LYS A 2 3.980 -3.118 -4.797 1.00 0.00 O ATOM 24 CB LYS A 2 1.305 -3.534 -3.940 1.00 0.00 C ATOM 25 CG LYS A 2 -0.116 -3.435 -3.351 1.00 0.00 C ATOM 26 CD LYS A 2 -0.490 -4.533 -2.344 1.00 0.00 C ATOM 27 CE LYS A 2 -0.709 -5.889 -3.033 1.00 0.00 C ATOM 28 NZ LYS A 2 -1.144 -6.922 -2.054 1.00 0.00 N ATOM 0 H LYS A 2 1.779 -1.224 -3.023 1.00 0.00 H new ATOM 0 HA LYS A 2 2.407 -3.940 -2.126 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.380 -2.848 -4.784 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.449 -4.540 -4.334 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.222 -2.466 -2.862 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -0.833 -3.458 -4.171 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.300 -4.627 -1.599 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -1.397 -4.245 -1.812 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.460 -5.786 -3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 2 0.214 -6.208 -3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.366 -7.805 -2.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.380 -7.096 -1.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -1.990 -6.588 -1.550 1.00 0.00 H new ATOM 42 N LYS A 3 4.856 -3.773 -2.839 1.00 0.00 N ATOM 43 CA LYS A 3 6.257 -3.794 -3.319 1.00 0.00 C ATOM 44 C LYS A 3 6.562 -5.007 -4.204 1.00 0.00 C ATOM 45 O LYS A 3 6.052 -6.104 -3.973 1.00 0.00 O ATOM 46 CB LYS A 3 7.273 -3.691 -2.164 1.00 0.00 C ATOM 47 CG LYS A 3 6.970 -2.541 -1.197 1.00 0.00 C ATOM 48 CD LYS A 3 8.083 -2.347 -0.163 1.00 0.00 C ATOM 49 CE LYS A 3 7.648 -1.259 0.830 1.00 0.00 C ATOM 50 NZ LYS A 3 8.641 -1.093 1.926 1.00 0.00 N ATOM 0 H LYS A 3 4.748 -4.078 -1.872 1.00 0.00 H new ATOM 0 HA LYS A 3 6.367 -2.905 -3.939 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.282 -4.630 -1.611 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.272 -3.556 -2.578 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.837 -1.619 -1.762 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.029 -2.739 -0.683 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.278 -3.282 0.362 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.011 -2.059 -0.656 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.524 -0.313 0.303 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.677 -1.518 1.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.293 -0.387 2.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.778 -2.003 2.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.547 -0.773 1.528 1.00 0.00 H new ATOM 64 N VAL A 4 7.448 -4.808 -5.181 1.00 0.00 N ATOM 65 CA VAL A 4 7.930 -5.855 -6.104 1.00 0.00 C ATOM 66 C VAL A 4 9.377 -6.221 -5.787 1.00 0.00 C ATOM 67 O VAL A 4 10.167 -5.332 -5.486 1.00 0.00 O ATOM 68 CB VAL A 4 7.807 -5.405 -7.574 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.237 -6.501 -8.557 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.375 -5.004 -7.939 1.00 0.00 C ATOM 0 H VAL A 4 7.865 -3.895 -5.363 1.00 0.00 H new ATOM 0 HA VAL A 4 7.303 -6.735 -5.965 1.00 0.00 H new ATOM 0 HB VAL A 4 8.471 -4.545 -7.659 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.132 -6.135 -9.578 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.278 -6.768 -8.372 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.607 -7.380 -8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.339 -4.695 -8.984 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.710 -5.854 -7.789 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.056 -4.177 -7.305 1.00 0.00 H new ATOM 80 N MET A 5 9.750 -7.497 -5.916 1.00 0.00 N ATOM 81 CA MET A 5 11.146 -7.955 -5.855 1.00 0.00 C ATOM 82 C MET A 5 11.484 -8.847 -7.060 1.00 0.00 C ATOM 83 O MET A 5 10.960 -9.954 -7.179 1.00 0.00 O ATOM 84 CB MET A 5 11.436 -8.703 -4.535 1.00 0.00 C ATOM 85 CG MET A 5 12.907 -9.170 -4.468 1.00 0.00 C ATOM 86 SD MET A 5 14.097 -7.815 -4.601 1.00 0.00 S ATOM 87 CE MET A 5 14.267 -7.312 -2.872 1.00 0.00 C ATOM 0 H MET A 5 9.083 -8.254 -6.068 1.00 0.00 H new ATOM 0 HA MET A 5 11.782 -7.071 -5.889 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.220 -8.050 -3.689 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.774 -9.565 -4.449 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.071 -9.697 -3.528 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.090 -9.885 -5.270 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.812 -6.369 -2.819 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.278 -7.185 -2.431 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.814 -8.078 -2.322 1.00 0.00 H new ATOM 97 N PHE A 6 12.380 -8.402 -7.935 1.00 0.00 N ATOM 98 CA PHE A 6 12.950 -9.253 -8.990 1.00 0.00 C ATOM 99 C PHE A 6 14.119 -10.079 -8.437 1.00 0.00 C ATOM 100 O PHE A 6 14.890 -9.575 -7.624 1.00 0.00 O ATOM 101 CB PHE A 6 13.370 -8.413 -10.197 1.00 0.00 C ATOM 102 CG PHE A 6 12.286 -7.471 -10.681 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.197 -7.934 -11.447 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.333 -6.125 -10.286 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.133 -7.067 -11.744 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.268 -5.263 -10.575 1.00 0.00 C ATOM 107 CZ PHE A 6 10.159 -5.736 -11.301 1.00 0.00 C ATOM 0 H PHE A 6 12.735 -7.446 -7.939 1.00 0.00 H new ATOM 0 HA PHE A 6 12.184 -9.949 -9.331 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.255 -7.833 -9.936 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.654 -9.078 -11.012 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.181 -8.953 -11.805 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.196 -5.752 -9.756 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.291 -7.427 -12.316 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.298 -4.236 -10.241 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.331 -5.077 -11.516 1.00 0.00 H new ATOM 117 N VAL A 7 14.241 -11.343 -8.852 1.00 0.00 N ATOM 118 CA VAL A 7 15.234 -12.308 -8.351 1.00 0.00 C ATOM 119 C VAL A 7 15.864 -13.083 -9.514 1.00 0.00 C ATOM 120 O VAL A 7 15.157 -13.670 -10.329 1.00 0.00 O ATOM 121 CB VAL A 7 14.589 -13.278 -7.332 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.645 -14.140 -6.629 1.00 0.00 C ATOM 123 CG2 VAL A 7 13.821 -12.547 -6.222 1.00 0.00 C ATOM 0 H VAL A 7 13.633 -11.739 -9.569 1.00 0.00 H new ATOM 0 HA VAL A 7 16.022 -11.755 -7.840 1.00 0.00 H new ATOM 0 HB VAL A 7 13.906 -13.889 -7.923 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.156 -14.809 -5.921 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.186 -14.729 -7.370 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.344 -13.496 -6.096 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.390 -13.277 -5.537 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.503 -11.895 -5.676 1.00 0.00 H new ATOM 0 HG23 VAL A 7 13.024 -11.949 -6.664 1.00 0.00 H new ATOM 133 N SER A 8 17.198 -13.112 -9.583 1.00 0.00 N ATOM 134 CA SER A 8 17.975 -13.877 -10.590 1.00 0.00 C ATOM 135 C SER A 8 19.273 -14.455 -9.997 1.00 0.00 C ATOM 136 O SER A 8 19.547 -14.238 -8.820 1.00 0.00 O ATOM 137 CB SER A 8 18.247 -12.976 -11.806 1.00 0.00 C ATOM 138 OG SER A 8 18.690 -11.686 -11.415 1.00 0.00 O ATOM 0 H SER A 8 17.790 -12.597 -8.931 1.00 0.00 H new ATOM 0 HA SER A 8 17.387 -14.736 -10.913 1.00 0.00 H new ATOM 0 HB2 SER A 8 18.999 -13.442 -12.443 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.338 -12.884 -12.401 1.00 0.00 H new ATOM 0 HG SER A 8 19.641 -11.588 -11.629 1.00 0.00 H new ATOM 144 N LYS A 9 20.104 -15.165 -10.786 1.00 0.00 N ATOM 145 CA LYS A 9 21.469 -15.566 -10.357 1.00 0.00 C ATOM 146 C LYS A 9 22.301 -14.320 -10.050 1.00 0.00 C ATOM 147 O LYS A 9 22.531 -14.022 -8.888 1.00 0.00 O ATOM 148 CB LYS A 9 22.132 -16.520 -11.378 1.00 0.00 C ATOM 149 CG LYS A 9 23.531 -16.959 -10.893 1.00 0.00 C ATOM 150 CD LYS A 9 24.290 -17.851 -11.889 1.00 0.00 C ATOM 151 CE LYS A 9 24.689 -17.138 -13.196 1.00 0.00 C ATOM 152 NZ LYS A 9 25.520 -18.026 -14.063 1.00 0.00 N ATOM 0 H LYS A 9 19.858 -15.475 -11.726 1.00 0.00 H new ATOM 0 HA LYS A 9 21.402 -16.143 -9.435 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.502 -17.397 -11.525 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.217 -16.023 -12.344 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.128 -16.070 -10.689 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.425 -17.495 -9.950 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.190 -18.232 -11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.670 -18.714 -12.133 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.792 -16.834 -13.736 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.244 -16.230 -12.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.774 -17.520 -14.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.386 -18.296 -13.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.979 -18.881 -14.303 1.00 0.00 H new ATOM 166 N ARG A 10 22.682 -13.558 -11.078 1.00 0.00 N ATOM 167 CA ARG A 10 23.284 -12.224 -10.914 1.00 0.00 C ATOM 168 C ARG A 10 22.153 -11.230 -10.726 1.00 0.00 C ATOM 169 O ARG A 10 21.315 -11.103 -11.613 1.00 0.00 O ATOM 170 CB ARG A 10 24.076 -11.847 -12.177 1.00 0.00 C ATOM 171 CG ARG A 10 25.505 -12.401 -12.204 1.00 0.00 C ATOM 172 CD ARG A 10 26.101 -12.041 -13.574 1.00 0.00 C ATOM 173 NE ARG A 10 27.532 -12.372 -13.724 1.00 0.00 N ATOM 174 CZ ARG A 10 28.593 -11.784 -13.204 1.00 0.00 C ATOM 175 NH1 ARG A 10 28.540 -10.914 -12.236 1.00 0.00 N ATOM 176 NH2 ARG A 10 29.755 -12.066 -13.710 1.00 0.00 N ATOM 0 H ARG A 10 22.583 -13.846 -12.052 1.00 0.00 H new ATOM 0 HA ARG A 10 23.960 -12.218 -10.059 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.539 -12.212 -13.053 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.117 -10.761 -12.257 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.101 -11.970 -11.399 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.503 -13.481 -12.056 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.538 -12.560 -14.349 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.968 -10.973 -13.745 1.00 0.00 H new ATOM 0 HE ARG A 10 27.731 -13.176 -14.319 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.640 -10.651 -11.835 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.399 -10.496 -11.879 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.827 -12.724 -14.486 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.596 -11.629 -13.332 1.00 0.00 H new ATOM 190 N ASN A 11 22.114 -10.499 -9.623 1.00 0.00 N ATOM 191 CA ASN A 11 21.182 -9.374 -9.508 1.00 0.00 C ATOM 192 C ASN A 11 21.598 -8.279 -10.505 1.00 0.00 C ATOM 193 O ASN A 11 20.776 -7.788 -11.272 1.00 0.00 O ATOM 194 CB ASN A 11 21.198 -8.852 -8.067 1.00 0.00 C ATOM 195 CG ASN A 11 20.154 -7.783 -7.804 1.00 0.00 C ATOM 196 OD1 ASN A 11 19.458 -7.294 -8.671 1.00 0.00 O ATOM 197 ND2 ASN A 11 20.012 -7.375 -6.576 1.00 0.00 N ATOM 0 H ASN A 11 22.703 -10.655 -8.805 1.00 0.00 H new ATOM 0 HA ASN A 11 20.166 -9.690 -9.745 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.034 -9.686 -7.384 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.186 -8.448 -7.845 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.324 -6.655 -6.354 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.588 -7.775 -5.836 1.00 0.00 H new ATOM 204 N SER A 12 22.905 -7.996 -10.540 1.00 0.00 N ATOM 205 CA SER A 12 23.583 -6.949 -11.317 1.00 0.00 C ATOM 206 C SER A 12 23.216 -6.876 -12.796 1.00 0.00 C ATOM 207 O SER A 12 23.239 -5.784 -13.362 1.00 0.00 O ATOM 208 CB SER A 12 25.089 -7.194 -11.204 1.00 0.00 C ATOM 209 OG SER A 12 25.413 -8.492 -11.672 1.00 0.00 O ATOM 0 H SER A 12 23.569 -8.534 -9.983 1.00 0.00 H new ATOM 0 HA SER A 12 23.258 -5.999 -10.894 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.630 -6.446 -11.783 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.405 -7.085 -10.167 1.00 0.00 H new ATOM 0 HG SER A 12 26.319 -8.488 -12.047 1.00 0.00 H new ATOM 215 N SER A 13 22.889 -8.018 -13.403 1.00 0.00 N ATOM 216 CA SER A 13 22.314 -8.125 -14.740 1.00 0.00 C ATOM 217 C SER A 13 20.777 -8.127 -14.678 1.00 0.00 C ATOM 218 O SER A 13 20.164 -7.070 -14.577 1.00 0.00 O ATOM 219 CB SER A 13 22.940 -9.321 -15.484 1.00 0.00 C ATOM 220 OG SER A 13 22.651 -10.515 -14.782 1.00 0.00 O ATOM 0 H SER A 13 23.023 -8.926 -12.958 1.00 0.00 H new ATOM 0 HA SER A 13 22.563 -7.245 -15.333 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.546 -9.378 -16.499 1.00 0.00 H new ATOM 0 HB3 SER A 13 24.019 -9.187 -15.568 1.00 0.00 H new ATOM 0 HG SER A 13 22.871 -11.287 -15.345 1.00 0.00 H new ATOM 226 N ARG A 14 20.127 -9.296 -14.685 1.00 0.00 N ATOM 227 CA ARG A 14 18.668 -9.456 -14.867 1.00 0.00 C ATOM 228 C ARG A 14 17.785 -8.693 -13.877 1.00 0.00 C ATOM 229 O ARG A 14 16.943 -7.907 -14.303 1.00 0.00 O ATOM 230 CB ARG A 14 18.329 -10.956 -14.901 1.00 0.00 C ATOM 231 CG ARG A 14 18.812 -11.619 -16.204 1.00 0.00 C ATOM 232 CD ARG A 14 18.421 -13.098 -16.230 1.00 0.00 C ATOM 233 NE ARG A 14 19.332 -13.944 -15.416 1.00 0.00 N ATOM 234 CZ ARG A 14 19.293 -15.264 -15.324 1.00 0.00 C ATOM 235 NH1 ARG A 14 18.311 -15.966 -15.798 1.00 0.00 N ATOM 236 NH2 ARG A 14 20.258 -15.902 -14.735 1.00 0.00 N ATOM 0 H ARG A 14 20.609 -10.186 -14.561 1.00 0.00 H new ATOM 0 HA ARG A 14 18.427 -8.986 -15.821 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.790 -11.453 -14.047 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.251 -11.088 -14.803 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.377 -11.107 -17.062 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.894 -11.521 -16.289 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.402 -13.207 -15.859 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.425 -13.453 -17.261 1.00 0.00 H new ATOM 0 HE ARG A 14 20.054 -13.463 -14.879 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.530 -15.502 -16.263 1.00 0.00 H new ATOM 0 HH12 ARG A 14 18.319 -16.982 -15.706 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.046 -15.386 -14.343 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.228 -16.919 -14.664 1.00 0.00 H new ATOM 250 N SER A 15 17.938 -8.889 -12.571 1.00 0.00 N ATOM 251 CA SER A 15 17.025 -8.245 -11.599 1.00 0.00 C ATOM 252 C SER A 15 17.205 -6.731 -11.523 1.00 0.00 C ATOM 253 O SER A 15 16.224 -6.002 -11.424 1.00 0.00 O ATOM 254 CB SER A 15 17.100 -8.933 -10.246 1.00 0.00 C ATOM 255 OG SER A 15 16.588 -10.232 -10.443 1.00 0.00 O ATOM 0 H SER A 15 18.664 -9.473 -12.156 1.00 0.00 H new ATOM 0 HA SER A 15 16.008 -8.380 -11.967 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.127 -8.969 -9.883 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.517 -8.392 -9.500 1.00 0.00 H new ATOM 0 HG SER A 15 17.299 -10.816 -10.780 1.00 0.00 H new ATOM 261 N GLN A 16 18.424 -6.240 -11.707 1.00 0.00 N ATOM 262 CA GLN A 16 18.748 -4.827 -11.886 1.00 0.00 C ATOM 263 C GLN A 16 18.200 -4.243 -13.195 1.00 0.00 C ATOM 264 O GLN A 16 17.649 -3.142 -13.182 1.00 0.00 O ATOM 265 CB GLN A 16 20.273 -4.761 -11.786 1.00 0.00 C ATOM 266 CG GLN A 16 20.888 -3.369 -11.719 1.00 0.00 C ATOM 267 CD GLN A 16 20.278 -2.564 -10.584 1.00 0.00 C ATOM 268 OE1 GLN A 16 19.378 -1.769 -10.789 1.00 0.00 O ATOM 269 NE2 GLN A 16 20.699 -2.775 -9.364 1.00 0.00 N ATOM 0 H GLN A 16 19.249 -6.839 -11.737 1.00 0.00 H new ATOM 0 HA GLN A 16 18.271 -4.207 -11.127 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.581 -5.314 -10.899 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.695 -5.280 -12.647 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.966 -3.449 -11.576 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.730 -2.851 -12.665 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.453 -3.441 -9.193 1.00 0.00 H new ATOM 0 HE22 GLN A 16 20.274 -2.274 -8.584 1.00 0.00 H new ATOM 278 N MET A 17 18.237 -4.996 -14.301 1.00 0.00 N ATOM 279 CA MET A 17 17.562 -4.632 -15.559 1.00 0.00 C ATOM 280 C MET A 17 16.052 -4.466 -15.344 1.00 0.00 C ATOM 281 O MET A 17 15.469 -3.457 -15.736 1.00 0.00 O ATOM 282 CB MET A 17 17.882 -5.666 -16.660 1.00 0.00 C ATOM 283 CG MET A 17 19.342 -5.547 -17.127 1.00 0.00 C ATOM 284 SD MET A 17 19.922 -6.915 -18.162 1.00 0.00 S ATOM 285 CE MET A 17 19.325 -6.350 -19.777 1.00 0.00 C ATOM 0 H MET A 17 18.739 -5.882 -14.351 1.00 0.00 H new ATOM 0 HA MET A 17 17.942 -3.667 -15.894 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.699 -6.672 -16.282 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.213 -5.517 -17.508 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.456 -4.616 -17.682 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.985 -5.476 -16.250 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.773 -6.958 -20.563 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.240 -6.446 -19.818 1.00 0.00 H new ATOM 0 HE3 MET A 17 19.603 -5.306 -19.923 1.00 0.00 H new ATOM 295 N ALA A 18 15.424 -5.400 -14.630 1.00 0.00 N ATOM 296 CA ALA A 18 14.016 -5.286 -14.247 1.00 0.00 C ATOM 297 C ALA A 18 13.745 -4.173 -13.220 1.00 0.00 C ATOM 298 O ALA A 18 12.666 -3.592 -13.280 1.00 0.00 O ATOM 299 CB ALA A 18 13.540 -6.648 -13.749 1.00 0.00 C ATOM 0 H ALA A 18 15.875 -6.254 -14.302 1.00 0.00 H new ATOM 0 HA ALA A 18 13.446 -4.989 -15.127 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.491 -6.583 -13.458 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.651 -7.385 -14.544 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.137 -6.950 -12.888 1.00 0.00 H new ATOM 305 N GLU A 19 14.682 -3.790 -12.338 1.00 0.00 N ATOM 306 CA GLU A 19 14.393 -2.705 -11.383 1.00 0.00 C ATOM 307 C GLU A 19 14.366 -1.392 -12.130 1.00 0.00 C ATOM 308 O GLU A 19 13.422 -0.630 -11.974 1.00 0.00 O ATOM 309 CB GLU A 19 15.395 -2.621 -10.223 1.00 0.00 C ATOM 310 CG GLU A 19 15.001 -1.523 -9.215 1.00 0.00 C ATOM 311 CD GLU A 19 15.887 -1.535 -7.955 1.00 0.00 C ATOM 312 OE1 GLU A 19 16.048 -2.617 -7.342 1.00 0.00 O ATOM 313 OE2 GLU A 19 16.392 -0.455 -7.567 1.00 0.00 O ATOM 0 H GLU A 19 15.614 -4.197 -12.264 1.00 0.00 H new ATOM 0 HA GLU A 19 13.425 -2.924 -10.932 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.445 -3.583 -9.713 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.391 -2.416 -10.615 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.074 -0.548 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.959 -1.658 -8.924 1.00 0.00 H new ATOM 320 N GLY A 20 15.355 -1.152 -12.993 1.00 0.00 N ATOM 321 CA GLY A 20 15.396 0.053 -13.808 1.00 0.00 C ATOM 322 C GLY A 20 14.159 0.201 -14.686 1.00 0.00 C ATOM 323 O GLY A 20 13.495 1.226 -14.594 1.00 0.00 O ATOM 0 H GLY A 20 16.141 -1.784 -13.142 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.485 0.925 -13.159 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.285 0.033 -14.438 1.00 0.00 H new ATOM 327 N PHE A 21 13.775 -0.830 -15.451 1.00 0.00 N ATOM 328 CA PHE A 21 12.531 -0.778 -16.236 1.00 0.00 C ATOM 329 C PHE A 21 11.285 -0.616 -15.362 1.00 0.00 C ATOM 330 O PHE A 21 10.396 0.157 -15.707 1.00 0.00 O ATOM 331 CB PHE A 21 12.405 -2.029 -17.133 1.00 0.00 C ATOM 332 CG PHE A 21 12.932 -1.851 -18.541 1.00 0.00 C ATOM 333 CD1 PHE A 21 12.290 -0.940 -19.398 1.00 0.00 C ATOM 334 CD2 PHE A 21 14.014 -2.613 -19.019 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.744 -0.766 -20.714 1.00 0.00 C ATOM 336 CE2 PHE A 21 14.473 -2.433 -20.333 1.00 0.00 C ATOM 337 CZ PHE A 21 13.838 -1.512 -21.184 1.00 0.00 C ATOM 0 H PHE A 21 14.299 -1.700 -15.544 1.00 0.00 H new ATOM 0 HA PHE A 21 12.592 0.110 -16.865 1.00 0.00 H new ATOM 0 HB2 PHE A 21 12.939 -2.854 -16.661 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.355 -2.318 -17.186 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.444 -0.372 -19.042 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.491 -3.336 -18.375 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.253 -0.059 -21.366 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.317 -3.004 -20.691 1.00 0.00 H new ATOM 0 HZ PHE A 21 14.190 -1.378 -22.196 1.00 0.00 H new ATOM 347 N ALA A 22 11.189 -1.304 -14.220 1.00 0.00 N ATOM 348 CA ALA A 22 9.980 -1.227 -13.393 1.00 0.00 C ATOM 349 C ALA A 22 9.881 0.129 -12.678 1.00 0.00 C ATOM 350 O ALA A 22 8.789 0.659 -12.487 1.00 0.00 O ATOM 351 CB ALA A 22 9.959 -2.433 -12.453 1.00 0.00 C ATOM 0 H ALA A 22 11.921 -1.911 -13.851 1.00 0.00 H new ATOM 0 HA ALA A 22 9.085 -1.277 -14.013 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.066 -2.393 -11.829 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.951 -3.352 -13.040 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.845 -2.416 -11.819 1.00 0.00 H new ATOM 357 N LYS A 23 11.032 0.738 -12.377 1.00 0.00 N ATOM 358 CA LYS A 23 11.157 2.111 -11.890 1.00 0.00 C ATOM 359 C LYS A 23 10.702 3.089 -12.967 1.00 0.00 C ATOM 360 O LYS A 23 9.737 3.808 -12.755 1.00 0.00 O ATOM 361 CB LYS A 23 12.611 2.340 -11.431 1.00 0.00 C ATOM 362 CG LYS A 23 12.733 3.593 -10.569 1.00 0.00 C ATOM 363 CD LYS A 23 14.170 3.809 -10.071 1.00 0.00 C ATOM 364 CE LYS A 23 14.985 4.632 -11.087 1.00 0.00 C ATOM 365 NZ LYS A 23 16.343 4.964 -10.567 1.00 0.00 N ATOM 0 H LYS A 23 11.933 0.270 -12.470 1.00 0.00 H new ATOM 0 HA LYS A 23 10.509 2.283 -11.030 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.957 1.474 -10.867 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.259 2.432 -12.303 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.414 4.462 -11.145 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.061 3.512 -9.715 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.153 4.323 -9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.652 2.845 -9.908 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.079 4.072 -12.017 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.450 5.552 -11.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.830 5.588 -11.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.255 5.446 -9.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.892 4.089 -10.447 1.00 0.00 H new ATOM 379 N THR A 24 11.274 3.049 -14.168 1.00 0.00 N ATOM 380 CA THR A 24 10.894 3.993 -15.232 1.00 0.00 C ATOM 381 C THR A 24 9.502 3.755 -15.829 1.00 0.00 C ATOM 382 O THR A 24 8.990 4.639 -16.516 1.00 0.00 O ATOM 383 CB THR A 24 11.968 4.071 -16.312 1.00 0.00 C ATOM 384 OG1 THR A 24 12.140 2.812 -16.920 1.00 0.00 O ATOM 385 CG2 THR A 24 13.281 4.521 -15.682 1.00 0.00 C ATOM 0 H THR A 24 11.997 2.381 -14.434 1.00 0.00 H new ATOM 0 HA THR A 24 10.823 4.965 -14.743 1.00 0.00 H new ATOM 0 HB THR A 24 11.660 4.788 -17.073 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.611 2.213 -16.304 1.00 0.00 H new ATOM 0 HG21 THR A 24 14.052 4.578 -16.450 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.149 5.502 -15.227 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.582 3.804 -14.918 1.00 0.00 H new ATOM 393 N LEU A 25 8.845 2.633 -15.495 1.00 0.00 N ATOM 394 CA LEU A 25 7.439 2.369 -15.818 1.00 0.00 C ATOM 395 C LEU A 25 6.469 2.579 -14.628 1.00 0.00 C ATOM 396 O LEU A 25 5.263 2.409 -14.802 1.00 0.00 O ATOM 397 CB LEU A 25 7.314 0.955 -16.432 1.00 0.00 C ATOM 398 CG LEU A 25 7.987 0.803 -17.814 1.00 0.00 C ATOM 399 CD1 LEU A 25 8.188 -0.677 -18.144 1.00 0.00 C ATOM 400 CD2 LEU A 25 7.134 1.434 -18.916 1.00 0.00 C ATOM 0 H LEU A 25 9.288 1.870 -14.983 1.00 0.00 H new ATOM 0 HA LEU A 25 7.126 3.112 -16.552 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.754 0.232 -15.745 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.257 0.704 -16.525 1.00 0.00 H new ATOM 0 HG LEU A 25 8.949 1.313 -17.768 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.663 -0.771 -19.121 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.823 -1.136 -17.386 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.221 -1.181 -18.161 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.633 1.312 -19.877 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.160 0.945 -18.948 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.000 2.496 -18.709 1.00 0.00 H new ATOM 412 N GLY A 26 6.957 2.938 -13.430 1.00 0.00 N ATOM 413 CA GLY A 26 6.133 2.979 -12.208 1.00 0.00 C ATOM 414 C GLY A 26 6.636 3.812 -11.019 1.00 0.00 C ATOM 415 O GLY A 26 6.089 3.666 -9.930 1.00 0.00 O ATOM 0 H GLY A 26 7.929 3.207 -13.280 1.00 0.00 H new ATOM 0 HA2 GLY A 26 5.147 3.354 -12.484 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.999 1.954 -11.863 1.00 0.00 H new ATOM 419 N ALA A 27 7.636 4.690 -11.174 1.00 0.00 N ATOM 420 CA ALA A 27 8.288 5.398 -10.057 1.00 0.00 C ATOM 421 C ALA A 27 7.332 6.279 -9.215 1.00 0.00 C ATOM 422 O ALA A 27 7.534 6.438 -8.010 1.00 0.00 O ATOM 423 CB ALA A 27 9.436 6.244 -10.629 1.00 0.00 C ATOM 0 H ALA A 27 8.021 4.933 -12.087 1.00 0.00 H new ATOM 0 HA ALA A 27 8.657 4.642 -9.364 1.00 0.00 H new ATOM 0 HB1 ALA A 27 9.933 6.778 -9.819 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.153 5.593 -11.129 1.00 0.00 H new ATOM 0 HB3 ALA A 27 9.037 6.962 -11.345 1.00 0.00 H new ATOM 429 N GLY A 28 6.275 6.823 -9.832 1.00 0.00 N ATOM 430 CA GLY A 28 5.224 7.603 -9.154 1.00 0.00 C ATOM 431 C GLY A 28 4.130 6.762 -8.470 1.00 0.00 C ATOM 432 O GLY A 28 3.176 7.330 -7.928 1.00 0.00 O ATOM 0 H GLY A 28 6.121 6.733 -10.836 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.692 8.242 -8.405 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.753 8.261 -9.884 1.00 0.00 H new ATOM 436 N LYS A 29 4.234 5.423 -8.526 1.00 0.00 N ATOM 437 CA LYS A 29 3.215 4.449 -8.103 1.00 0.00 C ATOM 438 C LYS A 29 3.696 3.673 -6.864 1.00 0.00 C ATOM 439 O LYS A 29 3.747 4.231 -5.768 1.00 0.00 O ATOM 440 CB LYS A 29 2.818 3.563 -9.314 1.00 0.00 C ATOM 441 CG LYS A 29 2.406 4.330 -10.587 1.00 0.00 C ATOM 442 CD LYS A 29 0.904 4.584 -10.696 1.00 0.00 C ATOM 443 CE LYS A 29 0.271 5.392 -9.554 1.00 0.00 C ATOM 444 NZ LYS A 29 -1.211 5.438 -9.702 1.00 0.00 N ATOM 0 H LYS A 29 5.073 4.969 -8.886 1.00 0.00 H new ATOM 0 HA LYS A 29 2.303 4.952 -7.783 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.658 2.913 -9.558 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.992 2.918 -9.015 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.929 5.286 -10.609 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.734 3.767 -11.461 1.00 0.00 H new ATOM 0 HD2 LYS A 29 0.711 5.106 -11.633 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.397 3.621 -10.757 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.532 4.943 -8.596 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.673 6.405 -9.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.631 5.869 -8.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.459 6.005 -10.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.579 4.472 -9.817 1.00 0.00 H new ATOM 458 N ILE A 30 4.045 2.395 -7.044 1.00 0.00 N ATOM 459 CA ILE A 30 4.539 1.473 -6.002 1.00 0.00 C ATOM 460 C ILE A 30 6.081 1.421 -5.978 1.00 0.00 C ATOM 461 O ILE A 30 6.738 1.995 -6.846 1.00 0.00 O ATOM 462 CB ILE A 30 3.859 0.086 -6.148 1.00 0.00 C ATOM 463 CG1 ILE A 30 4.105 -0.659 -7.478 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.334 0.246 -5.991 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.507 -1.251 -7.662 1.00 0.00 C ATOM 0 H ILE A 30 3.990 1.950 -7.960 1.00 0.00 H new ATOM 0 HA ILE A 30 4.256 1.852 -5.020 1.00 0.00 H new ATOM 0 HB ILE A 30 4.319 -0.519 -5.367 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.377 -1.466 -7.561 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.912 0.030 -8.300 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.854 -0.727 -6.093 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.111 0.659 -5.007 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.958 0.919 -6.761 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.567 -1.750 -8.629 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.248 -0.452 -7.619 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.705 -1.972 -6.869 1.00 0.00 H new ATOM 477 N ALA A 31 6.679 0.710 -5.009 1.00 0.00 N ATOM 478 CA ALA A 31 8.135 0.522 -4.953 1.00 0.00 C ATOM 479 C ALA A 31 8.579 -0.769 -5.640 1.00 0.00 C ATOM 480 O ALA A 31 8.095 -1.862 -5.343 1.00 0.00 O ATOM 481 CB ALA A 31 8.640 0.550 -3.513 1.00 0.00 C ATOM 0 H ALA A 31 6.172 0.254 -4.250 1.00 0.00 H new ATOM 0 HA ALA A 31 8.577 1.356 -5.498 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.721 0.408 -3.504 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.396 1.511 -3.061 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.164 -0.250 -2.945 1.00 0.00 H new ATOM 487 N VAL A 32 9.554 -0.635 -6.529 1.00 0.00 N ATOM 488 CA VAL A 32 10.255 -1.750 -7.157 1.00 0.00 C ATOM 489 C VAL A 32 11.605 -2.046 -6.496 1.00 0.00 C ATOM 490 O VAL A 32 12.280 -1.141 -6.002 1.00 0.00 O ATOM 491 CB VAL A 32 10.414 -1.472 -8.648 1.00 0.00 C ATOM 492 CG1 VAL A 32 9.027 -1.439 -9.302 1.00 0.00 C ATOM 493 CG2 VAL A 32 11.181 -0.186 -8.982 1.00 0.00 C ATOM 0 H VAL A 32 9.889 0.276 -6.842 1.00 0.00 H new ATOM 0 HA VAL A 32 9.653 -2.648 -7.019 1.00 0.00 H new ATOM 0 HB VAL A 32 11.023 -2.283 -9.047 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.132 -1.241 -10.369 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.534 -2.401 -9.159 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.427 -0.652 -8.844 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.245 -0.071 -10.064 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.658 0.670 -8.556 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.186 -0.243 -8.563 1.00 0.00 H new ATOM 503 N THR A 33 12.001 -3.321 -6.502 1.00 0.00 N ATOM 504 CA THR A 33 13.202 -3.818 -5.814 1.00 0.00 C ATOM 505 C THR A 33 13.830 -4.984 -6.576 1.00 0.00 C ATOM 506 O THR A 33 13.127 -5.708 -7.282 1.00 0.00 O ATOM 507 CB THR A 33 12.904 -4.253 -4.361 1.00 0.00 C ATOM 508 OG1 THR A 33 11.723 -3.678 -3.844 1.00 0.00 O ATOM 509 CG2 THR A 33 14.030 -3.837 -3.418 1.00 0.00 C ATOM 0 H THR A 33 11.488 -4.053 -6.994 1.00 0.00 H new ATOM 0 HA THR A 33 13.906 -2.987 -5.783 1.00 0.00 H new ATOM 0 HB THR A 33 12.798 -5.337 -4.411 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.944 -4.092 -4.270 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.792 -4.157 -2.404 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.962 -4.304 -3.736 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.141 -2.753 -3.440 1.00 0.00 H new ATOM 517 N SER A 34 15.132 -5.192 -6.421 1.00 0.00 N ATOM 518 CA SER A 34 15.891 -6.274 -7.054 1.00 0.00 C ATOM 519 C SER A 34 16.894 -6.965 -6.123 1.00 0.00 C ATOM 520 O SER A 34 17.641 -6.329 -5.371 1.00 0.00 O ATOM 521 CB SER A 34 16.599 -5.767 -8.302 1.00 0.00 C ATOM 522 OG SER A 34 17.475 -4.689 -8.036 1.00 0.00 O ATOM 0 H SER A 34 15.712 -4.594 -5.832 1.00 0.00 H new ATOM 0 HA SER A 34 15.156 -7.033 -7.322 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.163 -6.584 -8.752 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.855 -5.452 -9.034 1.00 0.00 H new ATOM 0 HG SER A 34 16.959 -3.859 -7.963 1.00 0.00 H new ATOM 528 N SER A 35 16.922 -8.296 -6.205 1.00 0.00 N ATOM 529 CA SER A 35 17.742 -9.206 -5.408 1.00 0.00 C ATOM 530 C SER A 35 18.277 -10.354 -6.273 1.00 0.00 C ATOM 531 O SER A 35 18.042 -10.401 -7.481 1.00 0.00 O ATOM 532 CB SER A 35 16.950 -9.695 -4.198 1.00 0.00 C ATOM 533 OG SER A 35 17.837 -10.328 -3.298 1.00 0.00 O ATOM 0 H SER A 35 16.335 -8.797 -6.872 1.00 0.00 H new ATOM 0 HA SER A 35 18.615 -8.673 -5.030 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.451 -8.858 -3.710 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.172 -10.390 -4.512 1.00 0.00 H new ATOM 0 HG SER A 35 17.432 -10.358 -2.406 1.00 0.00 H new ATOM 539 N GLY A 36 19.026 -11.287 -5.690 1.00 0.00 N ATOM 540 CA GLY A 36 19.433 -12.503 -6.393 1.00 0.00 C ATOM 541 C GLY A 36 20.445 -13.368 -5.645 1.00 0.00 C ATOM 542 O GLY A 36 20.885 -13.012 -4.552 1.00 0.00 O ATOM 0 H GLY A 36 19.365 -11.225 -4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.545 -13.102 -6.597 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.858 -12.223 -7.357 1.00 0.00 H new ATOM 546 N LEU A 37 20.812 -14.511 -6.235 1.00 0.00 N ATOM 547 CA LEU A 37 21.721 -15.501 -5.625 1.00 0.00 C ATOM 548 C LEU A 37 23.124 -14.911 -5.377 1.00 0.00 C ATOM 549 O LEU A 37 23.775 -15.216 -4.379 1.00 0.00 O ATOM 550 CB LEU A 37 21.817 -16.763 -6.507 1.00 0.00 C ATOM 551 CG LEU A 37 20.490 -17.440 -6.911 1.00 0.00 C ATOM 552 CD1 LEU A 37 20.774 -18.716 -7.706 1.00 0.00 C ATOM 553 CD2 LEU A 37 19.620 -17.806 -5.711 1.00 0.00 C ATOM 0 H LEU A 37 20.484 -14.783 -7.162 1.00 0.00 H new ATOM 0 HA LEU A 37 21.303 -15.777 -4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.353 -16.499 -7.418 1.00 0.00 H new ATOM 0 HB3 LEU A 37 22.426 -17.498 -5.981 1.00 0.00 H new ATOM 0 HG LEU A 37 19.946 -16.714 -7.515 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.832 -19.187 -7.987 1.00 0.00 H new ATOM 0 HD12 LEU A 37 21.337 -18.467 -8.605 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.355 -19.405 -7.093 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.701 -18.278 -6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.162 -18.498 -5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.375 -16.904 -5.151 1.00 0.00 H new ATOM 565 N GLU A 38 23.554 -14.022 -6.273 1.00 0.00 N ATOM 566 CA GLU A 38 24.733 -13.170 -6.174 1.00 0.00 C ATOM 567 C GLU A 38 24.286 -11.723 -6.416 1.00 0.00 C ATOM 568 O GLU A 38 23.864 -11.359 -7.518 1.00 0.00 O ATOM 569 CB GLU A 38 25.781 -13.656 -7.191 1.00 0.00 C ATOM 570 CG GLU A 38 27.098 -12.876 -7.144 1.00 0.00 C ATOM 571 CD GLU A 38 27.818 -13.030 -5.794 1.00 0.00 C ATOM 572 OE1 GLU A 38 28.615 -13.986 -5.628 1.00 0.00 O ATOM 573 OE2 GLU A 38 27.587 -12.188 -4.894 1.00 0.00 O ATOM 0 H GLU A 38 23.050 -13.870 -7.147 1.00 0.00 H new ATOM 0 HA GLU A 38 25.198 -13.218 -5.190 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.988 -14.711 -7.009 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.361 -13.582 -8.194 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.752 -13.223 -7.944 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.900 -11.820 -7.329 1.00 0.00 H new ATOM 580 N SER A 39 24.353 -10.880 -5.384 1.00 0.00 N ATOM 581 CA SER A 39 24.012 -9.455 -5.490 1.00 0.00 C ATOM 582 C SER A 39 24.919 -8.725 -6.476 1.00 0.00 C ATOM 583 O SER A 39 24.456 -7.885 -7.246 1.00 0.00 O ATOM 584 CB SER A 39 24.127 -8.792 -4.121 1.00 0.00 C ATOM 585 OG SER A 39 25.405 -9.033 -3.549 1.00 0.00 O ATOM 0 H SER A 39 24.645 -11.164 -4.449 1.00 0.00 H new ATOM 0 HA SER A 39 22.988 -9.390 -5.857 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.963 -7.719 -4.217 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.350 -9.175 -3.460 1.00 0.00 H new ATOM 0 HG SER A 39 25.458 -8.598 -2.673 1.00 0.00 H new ATOM 591 N SER A 40 26.196 -9.117 -6.508 1.00 0.00 N ATOM 592 CA SER A 40 27.223 -8.561 -7.394 1.00 0.00 C ATOM 593 C SER A 40 27.267 -7.012 -7.268 1.00 0.00 C ATOM 594 O SER A 40 27.240 -6.483 -6.153 1.00 0.00 O ATOM 595 CB SER A 40 26.985 -9.145 -8.802 1.00 0.00 C ATOM 596 OG SER A 40 27.878 -8.640 -9.783 1.00 0.00 O ATOM 0 H SER A 40 26.555 -9.853 -5.899 1.00 0.00 H new ATOM 0 HA SER A 40 28.236 -8.853 -7.116 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.082 -10.230 -8.758 1.00 0.00 H new ATOM 0 HB3 SER A 40 25.961 -8.929 -9.108 1.00 0.00 H new ATOM 0 HG SER A 40 27.676 -9.049 -10.650 1.00 0.00 H new ATOM 602 N ARG A 41 27.341 -6.279 -8.388 1.00 0.00 N ATOM 603 CA ARG A 41 27.355 -4.801 -8.480 1.00 0.00 C ATOM 604 C ARG A 41 26.273 -4.304 -9.450 1.00 0.00 C ATOM 605 O ARG A 41 25.168 -4.833 -9.473 1.00 0.00 O ATOM 606 CB ARG A 41 28.808 -4.360 -8.805 1.00 0.00 C ATOM 607 CG ARG A 41 29.380 -4.923 -10.128 1.00 0.00 C ATOM 608 CD ARG A 41 30.750 -4.317 -10.472 1.00 0.00 C ATOM 609 NE ARG A 41 31.768 -4.599 -9.436 1.00 0.00 N ATOM 610 CZ ARG A 41 32.562 -5.651 -9.336 1.00 0.00 C ATOM 611 NH1 ARG A 41 32.515 -6.642 -10.180 1.00 0.00 N ATOM 612 NH2 ARG A 41 33.430 -5.730 -8.370 1.00 0.00 N ATOM 0 H ARG A 41 27.396 -6.719 -9.307 1.00 0.00 H new ATOM 0 HA ARG A 41 27.086 -4.328 -7.536 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.841 -3.271 -8.846 1.00 0.00 H new ATOM 0 HB3 ARG A 41 29.457 -4.668 -7.985 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.473 -6.006 -10.050 1.00 0.00 H new ATOM 0 HG3 ARG A 41 28.681 -4.721 -10.939 1.00 0.00 H new ATOM 0 HD2 ARG A 41 31.090 -4.714 -11.429 1.00 0.00 H new ATOM 0 HD3 ARG A 41 30.647 -3.239 -10.592 1.00 0.00 H new ATOM 0 HE ARG A 41 31.870 -3.893 -8.707 1.00 0.00 H new ATOM 0 HH11 ARG A 41 31.848 -6.623 -10.952 1.00 0.00 H new ATOM 0 HH12 ARG A 41 33.145 -7.437 -10.069 1.00 0.00 H new ATOM 0 HH21 ARG A 41 33.500 -4.978 -7.685 1.00 0.00 H new ATOM 0 HH22 ARG A 41 34.040 -6.544 -8.298 1.00 0.00 H new ATOM 626 N VAL A 42 26.570 -3.299 -10.267 1.00 0.00 N ATOM 627 CA VAL A 42 25.778 -2.837 -11.413 1.00 0.00 C ATOM 628 C VAL A 42 26.547 -3.329 -12.650 1.00 0.00 C ATOM 629 O VAL A 42 27.705 -2.961 -12.825 1.00 0.00 O ATOM 630 CB VAL A 42 25.595 -1.307 -11.328 1.00 0.00 C ATOM 631 CG1 VAL A 42 24.516 -1.012 -10.282 1.00 0.00 C ATOM 632 CG2 VAL A 42 26.855 -0.525 -10.911 1.00 0.00 C ATOM 0 H VAL A 42 27.420 -2.749 -10.144 1.00 0.00 H new ATOM 0 HA VAL A 42 24.762 -3.230 -11.448 1.00 0.00 H new ATOM 0 HB VAL A 42 25.335 -0.981 -12.335 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.369 0.065 -10.204 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.581 -1.485 -10.581 1.00 0.00 H new ATOM 0 HG13 VAL A 42 24.829 -1.406 -9.315 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.628 0.541 -10.879 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.179 -0.856 -9.924 1.00 0.00 H new ATOM 0 HG23 VAL A 42 27.651 -0.705 -11.634 1.00 0.00 H new ATOM 642 N HIS A 43 25.979 -4.239 -13.454 1.00 0.00 N ATOM 643 CA HIS A 43 26.756 -4.927 -14.509 1.00 0.00 C ATOM 644 C HIS A 43 27.253 -3.958 -15.597 1.00 0.00 C ATOM 645 O HIS A 43 26.447 -3.180 -16.106 1.00 0.00 O ATOM 646 CB HIS A 43 25.947 -6.105 -15.079 1.00 0.00 C ATOM 647 CG HIS A 43 26.716 -6.943 -16.057 1.00 0.00 C ATOM 648 ND1 HIS A 43 27.061 -6.562 -17.354 1.00 0.00 N ATOM 649 CD2 HIS A 43 27.286 -8.146 -15.772 1.00 0.00 C ATOM 650 CE1 HIS A 43 27.831 -7.561 -17.823 1.00 0.00 C ATOM 651 NE2 HIS A 43 27.985 -8.517 -16.893 1.00 0.00 N ATOM 0 H HIS A 43 24.999 -4.517 -13.400 1.00 0.00 H new ATOM 0 HA HIS A 43 27.660 -5.335 -14.057 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.612 -6.737 -14.256 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.053 -5.718 -15.568 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.204 -8.698 -14.848 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.265 -7.590 -18.811 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.529 -9.373 -17.001 1.00 0.00 H new ATOM 659 N PRO A 44 28.545 -3.981 -15.988 1.00 0.00 N ATOM 660 CA PRO A 44 29.147 -2.958 -16.853 1.00 0.00 C ATOM 661 C PRO A 44 28.481 -2.836 -18.229 1.00 0.00 C ATOM 662 O PRO A 44 28.287 -1.725 -18.725 1.00 0.00 O ATOM 663 CB PRO A 44 30.625 -3.352 -16.978 1.00 0.00 C ATOM 664 CG PRO A 44 30.634 -4.848 -16.675 1.00 0.00 C ATOM 665 CD PRO A 44 29.561 -4.954 -15.601 1.00 0.00 C ATOM 0 HA PRO A 44 29.013 -1.970 -16.412 1.00 0.00 H new ATOM 0 HB2 PRO A 44 31.011 -3.144 -17.976 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.247 -2.798 -16.275 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.393 -5.445 -17.555 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.606 -5.187 -16.317 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.146 -5.961 -15.555 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.966 -4.731 -14.614 1.00 0.00 H new ATOM 673 N THR A 45 28.066 -3.959 -18.825 1.00 0.00 N ATOM 674 CA THR A 45 27.335 -3.957 -20.104 1.00 0.00 C ATOM 675 C THR A 45 25.874 -3.574 -19.883 1.00 0.00 C ATOM 676 O THR A 45 25.308 -2.848 -20.698 1.00 0.00 O ATOM 677 CB THR A 45 27.477 -5.308 -20.828 1.00 0.00 C ATOM 678 OG1 THR A 45 28.848 -5.632 -20.956 1.00 0.00 O ATOM 679 CG2 THR A 45 26.885 -5.285 -22.241 1.00 0.00 C ATOM 0 H THR A 45 28.224 -4.890 -18.441 1.00 0.00 H new ATOM 0 HA THR A 45 27.777 -3.203 -20.755 1.00 0.00 H new ATOM 0 HB THR A 45 26.936 -6.040 -20.229 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.939 -6.493 -21.415 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.013 -6.263 -22.705 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.823 -5.045 -22.187 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.397 -4.531 -22.838 1.00 0.00 H new ATOM 687 N ALA A 46 25.269 -3.940 -18.747 1.00 0.00 N ATOM 688 CA ALA A 46 23.920 -3.480 -18.413 1.00 0.00 C ATOM 689 C ALA A 46 23.849 -1.959 -18.212 1.00 0.00 C ATOM 690 O ALA A 46 22.907 -1.356 -18.708 1.00 0.00 O ATOM 691 CB ALA A 46 23.384 -4.248 -17.202 1.00 0.00 C ATOM 0 H ALA A 46 25.691 -4.551 -18.048 1.00 0.00 H new ATOM 0 HA ALA A 46 23.275 -3.694 -19.265 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.380 -3.897 -16.964 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.351 -5.313 -17.432 1.00 0.00 H new ATOM 0 HB3 ALA A 46 24.039 -4.082 -16.347 1.00 0.00 H new ATOM 697 N ILE A 47 24.842 -1.304 -17.593 1.00 0.00 N ATOM 698 CA ILE A 47 24.874 0.170 -17.494 1.00 0.00 C ATOM 699 C ILE A 47 24.725 0.799 -18.893 1.00 0.00 C ATOM 700 O ILE A 47 23.889 1.681 -19.072 1.00 0.00 O ATOM 701 CB ILE A 47 26.149 0.669 -16.766 1.00 0.00 C ATOM 702 CG1 ILE A 47 26.271 0.119 -15.323 1.00 0.00 C ATOM 703 CG2 ILE A 47 26.150 2.207 -16.684 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.672 0.289 -14.727 1.00 0.00 C ATOM 0 H ILE A 47 25.636 -1.768 -17.152 1.00 0.00 H new ATOM 0 HA ILE A 47 24.028 0.492 -16.887 1.00 0.00 H new ATOM 0 HB ILE A 47 26.993 0.304 -17.351 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.548 0.628 -14.685 1.00 0.00 H new ATOM 0 HG13 ILE A 47 26.009 -0.939 -15.321 1.00 0.00 H new ATOM 0 HG21 ILE A 47 27.051 2.543 -16.171 1.00 0.00 H new ATOM 0 HG22 ILE A 47 26.128 2.625 -17.690 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.271 2.543 -16.133 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.689 -0.117 -13.715 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.397 -0.243 -15.343 1.00 0.00 H new ATOM 0 HD13 ILE A 47 27.929 1.348 -14.697 1.00 0.00 H new ATOM 716 N ALA A 48 25.434 0.279 -19.901 1.00 0.00 N ATOM 717 CA ALA A 48 25.304 0.716 -21.296 1.00 0.00 C ATOM 718 C ALA A 48 23.923 0.418 -21.903 1.00 0.00 C ATOM 719 O ALA A 48 23.218 1.331 -22.327 1.00 0.00 O ATOM 720 CB ALA A 48 26.417 0.058 -22.121 1.00 0.00 C ATOM 0 H ALA A 48 26.121 -0.464 -19.770 1.00 0.00 H new ATOM 0 HA ALA A 48 25.403 1.801 -21.317 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.334 0.373 -23.161 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.388 0.359 -21.727 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.321 -1.026 -22.062 1.00 0.00 H new ATOM 726 N MET A 49 23.517 -0.857 -21.936 1.00 0.00 N ATOM 727 CA MET A 49 22.267 -1.284 -22.592 1.00 0.00 C ATOM 728 C MET A 49 21.010 -0.723 -21.916 1.00 0.00 C ATOM 729 O MET A 49 19.962 -0.663 -22.551 1.00 0.00 O ATOM 730 CB MET A 49 22.155 -2.813 -22.629 1.00 0.00 C ATOM 731 CG MET A 49 23.322 -3.561 -23.291 1.00 0.00 C ATOM 732 SD MET A 49 23.704 -3.164 -25.018 1.00 0.00 S ATOM 733 CE MET A 49 24.891 -1.805 -24.837 1.00 0.00 C ATOM 0 H MET A 49 24.041 -1.622 -21.511 1.00 0.00 H new ATOM 0 HA MET A 49 22.320 -0.883 -23.604 1.00 0.00 H new ATOM 0 HB2 MET A 49 22.053 -3.174 -21.606 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.237 -3.077 -23.154 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.218 -3.377 -22.698 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.114 -4.629 -23.230 1.00 0.00 H new ATOM 0 HE1 MET A 49 25.249 -1.501 -25.821 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.405 -0.960 -24.350 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.734 -2.137 -24.231 1.00 0.00 H new ATOM 743 N MET A 50 21.094 -0.325 -20.650 1.00 0.00 N ATOM 744 CA MET A 50 19.992 0.291 -19.911 1.00 0.00 C ATOM 745 C MET A 50 20.013 1.820 -20.075 1.00 0.00 C ATOM 746 O MET A 50 18.968 2.413 -20.330 1.00 0.00 O ATOM 747 CB MET A 50 20.041 -0.198 -18.454 1.00 0.00 C ATOM 748 CG MET A 50 19.941 -1.730 -18.351 1.00 0.00 C ATOM 749 SD MET A 50 18.342 -2.447 -18.828 1.00 0.00 S ATOM 750 CE MET A 50 17.259 -1.659 -17.608 1.00 0.00 C ATOM 0 H MET A 50 21.945 -0.423 -20.097 1.00 0.00 H new ATOM 0 HA MET A 50 19.028 -0.017 -20.316 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.970 0.136 -17.992 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.225 0.256 -17.893 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.717 -2.170 -18.977 1.00 0.00 H new ATOM 0 HG3 MET A 50 20.158 -2.022 -17.323 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.344 -2.242 -17.504 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.769 -1.610 -16.646 1.00 0.00 H new ATOM 0 HE3 MET A 50 17.011 -0.650 -17.939 1.00 0.00 H new ATOM 760 N GLU A 51 21.183 2.469 -20.082 1.00 0.00 N ATOM 761 CA GLU A 51 21.321 3.889 -20.447 1.00 0.00 C ATOM 762 C GLU A 51 20.808 4.177 -21.874 1.00 0.00 C ATOM 763 O GLU A 51 20.151 5.197 -22.092 1.00 0.00 O ATOM 764 CB GLU A 51 22.791 4.312 -20.270 1.00 0.00 C ATOM 765 CG GLU A 51 23.075 5.755 -20.692 1.00 0.00 C ATOM 766 CD GLU A 51 24.511 6.170 -20.312 1.00 0.00 C ATOM 767 OE1 GLU A 51 25.460 5.838 -21.064 1.00 0.00 O ATOM 768 OE2 GLU A 51 24.697 6.848 -19.271 1.00 0.00 O ATOM 0 H GLU A 51 22.067 2.024 -19.834 1.00 0.00 H new ATOM 0 HA GLU A 51 20.695 4.484 -19.782 1.00 0.00 H new ATOM 0 HB2 GLU A 51 23.071 4.188 -19.224 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.424 3.642 -20.852 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.936 5.857 -21.768 1.00 0.00 H new ATOM 0 HG3 GLU A 51 22.360 6.425 -20.214 1.00 0.00 H new ATOM 775 N GLU A 52 21.013 3.255 -22.825 1.00 0.00 N ATOM 776 CA GLU A 52 20.453 3.327 -24.189 1.00 0.00 C ATOM 777 C GLU A 52 18.920 3.498 -24.221 1.00 0.00 C ATOM 778 O GLU A 52 18.398 4.153 -25.127 1.00 0.00 O ATOM 779 CB GLU A 52 20.807 2.046 -24.961 1.00 0.00 C ATOM 780 CG GLU A 52 22.231 2.059 -25.526 1.00 0.00 C ATOM 781 CD GLU A 52 22.603 0.749 -26.247 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.787 -0.205 -26.308 1.00 0.00 O ATOM 783 OE2 GLU A 52 23.732 0.664 -26.783 1.00 0.00 O ATOM 0 H GLU A 52 21.582 2.423 -22.669 1.00 0.00 H new ATOM 0 HA GLU A 52 20.893 4.212 -24.649 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.693 1.187 -24.300 1.00 0.00 H new ATOM 0 HB3 GLU A 52 20.099 1.915 -25.779 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.333 2.892 -26.222 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.937 2.234 -24.714 1.00 0.00 H new ATOM 790 N VAL A 53 18.198 2.937 -23.239 1.00 0.00 N ATOM 791 CA VAL A 53 16.727 3.057 -23.099 1.00 0.00 C ATOM 792 C VAL A 53 16.280 4.082 -22.036 1.00 0.00 C ATOM 793 O VAL A 53 15.106 4.118 -21.666 1.00 0.00 O ATOM 794 CB VAL A 53 16.055 1.674 -22.933 1.00 0.00 C ATOM 795 CG1 VAL A 53 16.156 0.873 -24.234 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.680 0.843 -21.811 1.00 0.00 C ATOM 0 H VAL A 53 18.623 2.375 -22.502 1.00 0.00 H new ATOM 0 HA VAL A 53 16.368 3.474 -24.040 1.00 0.00 H new ATOM 0 HB VAL A 53 15.014 1.871 -22.677 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.679 -0.098 -24.101 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.656 1.417 -25.036 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.205 0.729 -24.492 1.00 0.00 H new ATOM 0 HG21 VAL A 53 16.168 -0.117 -21.741 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.736 0.677 -22.026 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.582 1.376 -20.865 1.00 0.00 H new ATOM 806 N GLY A 54 17.186 4.950 -21.559 1.00 0.00 N ATOM 807 CA GLY A 54 16.888 6.002 -20.569 1.00 0.00 C ATOM 808 C GLY A 54 16.975 5.554 -19.103 1.00 0.00 C ATOM 809 O GLY A 54 16.441 6.230 -18.224 1.00 0.00 O ATOM 0 H GLY A 54 18.162 4.942 -21.854 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.579 6.831 -20.722 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.885 6.385 -20.758 1.00 0.00 H new ATOM 813 N ILE A 55 17.616 4.410 -18.837 1.00 0.00 N ATOM 814 CA ILE A 55 17.623 3.710 -17.543 1.00 0.00 C ATOM 815 C ILE A 55 19.066 3.549 -17.042 1.00 0.00 C ATOM 816 O ILE A 55 19.653 2.475 -17.104 1.00 0.00 O ATOM 817 CB ILE A 55 16.874 2.361 -17.679 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.491 2.519 -18.352 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.707 1.708 -16.296 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.744 1.211 -18.609 1.00 0.00 C ATOM 0 H ILE A 55 18.167 3.925 -19.545 1.00 0.00 H new ATOM 0 HA ILE A 55 17.094 4.296 -16.791 1.00 0.00 H new ATOM 0 HB ILE A 55 17.479 1.722 -18.322 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.869 3.158 -17.724 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.623 3.037 -19.302 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.179 0.760 -16.402 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.689 1.529 -15.857 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.135 2.371 -15.647 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.786 1.426 -19.083 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.339 0.575 -19.265 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.573 0.698 -17.663 1.00 0.00 H new ATOM 832 N ASP A 56 19.674 4.617 -16.535 1.00 0.00 N ATOM 833 CA ASP A 56 20.997 4.517 -15.903 1.00 0.00 C ATOM 834 C ASP A 56 20.907 3.718 -14.582 1.00 0.00 C ATOM 835 O ASP A 56 20.429 4.230 -13.567 1.00 0.00 O ATOM 836 CB ASP A 56 21.575 5.925 -15.703 1.00 0.00 C ATOM 837 CG ASP A 56 22.925 5.919 -14.965 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.578 4.849 -14.881 1.00 0.00 O ATOM 839 OD2 ASP A 56 23.333 6.988 -14.451 1.00 0.00 O ATOM 0 H ASP A 56 19.280 5.558 -16.546 1.00 0.00 H new ATOM 0 HA ASP A 56 21.679 3.968 -16.553 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.700 6.402 -16.675 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.862 6.528 -15.141 1.00 0.00 H new ATOM 844 N ILE A 57 21.382 2.462 -14.585 1.00 0.00 N ATOM 845 CA ILE A 57 21.433 1.607 -13.384 1.00 0.00 C ATOM 846 C ILE A 57 22.686 1.851 -12.532 1.00 0.00 C ATOM 847 O ILE A 57 22.802 1.262 -11.469 1.00 0.00 O ATOM 848 CB ILE A 57 21.326 0.098 -13.734 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.493 -0.400 -14.620 1.00 0.00 C ATOM 850 CG2 ILE A 57 19.970 -0.231 -14.381 1.00 0.00 C ATOM 851 CD1 ILE A 57 22.910 -1.852 -14.336 1.00 0.00 C ATOM 0 H ILE A 57 21.743 2.007 -15.423 1.00 0.00 H new ATOM 0 HA ILE A 57 20.563 1.892 -12.793 1.00 0.00 H new ATOM 0 HB ILE A 57 21.398 -0.439 -12.788 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.205 -0.313 -15.668 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.354 0.252 -14.471 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.927 -1.295 -14.614 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.166 0.022 -13.690 1.00 0.00 H new ATOM 0 HG23 ILE A 57 19.855 0.346 -15.298 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.733 -2.130 -14.995 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.230 -1.942 -13.298 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.063 -2.515 -14.513 1.00 0.00 H new ATOM 863 N SER A 58 23.645 2.679 -12.958 1.00 0.00 N ATOM 864 CA SER A 58 24.958 2.760 -12.295 1.00 0.00 C ATOM 865 C SER A 58 24.936 3.287 -10.850 1.00 0.00 C ATOM 866 O SER A 58 25.769 2.885 -10.038 1.00 0.00 O ATOM 867 CB SER A 58 25.937 3.562 -13.143 1.00 0.00 C ATOM 868 OG SER A 58 25.569 4.918 -13.259 1.00 0.00 O ATOM 0 H SER A 58 23.541 3.303 -13.758 1.00 0.00 H new ATOM 0 HA SER A 58 25.292 1.726 -12.209 1.00 0.00 H new ATOM 0 HB2 SER A 58 26.932 3.496 -12.703 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.998 3.120 -14.137 1.00 0.00 H new ATOM 0 HG SER A 58 24.806 4.999 -13.868 1.00 0.00 H new ATOM 874 N GLY A 59 23.963 4.142 -10.509 1.00 0.00 N ATOM 875 CA GLY A 59 23.704 4.617 -9.141 1.00 0.00 C ATOM 876 C GLY A 59 22.677 3.784 -8.359 1.00 0.00 C ATOM 877 O GLY A 59 22.246 4.196 -7.280 1.00 0.00 O ATOM 0 H GLY A 59 23.317 4.533 -11.194 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.644 4.623 -8.589 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.355 5.649 -9.188 1.00 0.00 H new ATOM 881 N GLN A 60 22.239 2.642 -8.903 1.00 0.00 N ATOM 882 CA GLN A 60 21.115 1.841 -8.400 1.00 0.00 C ATOM 883 C GLN A 60 21.579 0.644 -7.542 1.00 0.00 C ATOM 884 O GLN A 60 22.665 0.102 -7.753 1.00 0.00 O ATOM 885 CB GLN A 60 20.252 1.453 -9.615 1.00 0.00 C ATOM 886 CG GLN A 60 18.825 1.040 -9.219 1.00 0.00 C ATOM 887 CD GLN A 60 17.817 1.249 -10.343 1.00 0.00 C ATOM 888 OE1 GLN A 60 17.233 2.311 -10.489 1.00 0.00 O ATOM 889 NE2 GLN A 60 17.578 0.285 -11.202 1.00 0.00 N ATOM 0 H GLN A 60 22.671 2.236 -9.733 1.00 0.00 H new ATOM 0 HA GLN A 60 20.506 2.421 -7.707 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.204 2.295 -10.306 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.730 0.631 -10.148 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.823 -0.010 -8.926 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.514 1.615 -8.347 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.051 -0.613 -11.105 1.00 0.00 H new ATOM 0 HE22 GLN A 60 16.919 0.435 -11.966 1.00 0.00 H new ATOM 898 N THR A 61 20.767 0.223 -6.562 1.00 0.00 N ATOM 899 CA THR A 61 21.164 -0.814 -5.580 1.00 0.00 C ATOM 900 C THR A 61 20.916 -2.233 -6.073 1.00 0.00 C ATOM 901 O THR A 61 19.915 -2.484 -6.744 1.00 0.00 O ATOM 902 CB THR A 61 20.495 -0.612 -4.212 1.00 0.00 C ATOM 903 OG1 THR A 61 21.089 -1.481 -3.273 1.00 0.00 O ATOM 904 CG2 THR A 61 18.979 -0.842 -4.180 1.00 0.00 C ATOM 0 H THR A 61 19.823 0.584 -6.422 1.00 0.00 H new ATOM 0 HA THR A 61 22.240 -0.689 -5.461 1.00 0.00 H new ATOM 0 HB THR A 61 20.650 0.440 -3.973 1.00 0.00 H new ATOM 0 HG1 THR A 61 20.667 -1.355 -2.398 1.00 0.00 H new ATOM 0 HG21 THR A 61 18.607 -0.674 -3.169 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.491 -0.150 -4.866 1.00 0.00 H new ATOM 0 HG23 THR A 61 18.760 -1.866 -4.481 1.00 0.00 H new ATOM 912 N SER A 62 21.793 -3.168 -5.689 1.00 0.00 N ATOM 913 CA SER A 62 21.609 -4.607 -5.892 1.00 0.00 C ATOM 914 C SER A 62 21.715 -5.356 -4.550 1.00 0.00 C ATOM 915 O SER A 62 22.800 -5.436 -3.974 1.00 0.00 O ATOM 916 CB SER A 62 22.665 -5.159 -6.861 1.00 0.00 C ATOM 917 OG SER A 62 22.566 -4.602 -8.163 1.00 0.00 O ATOM 0 H SER A 62 22.669 -2.939 -5.219 1.00 0.00 H new ATOM 0 HA SER A 62 20.617 -4.761 -6.318 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.659 -4.958 -6.460 1.00 0.00 H new ATOM 0 HB3 SER A 62 22.560 -6.242 -6.926 1.00 0.00 H new ATOM 0 HG SER A 62 23.428 -4.685 -8.621 1.00 0.00 H new ATOM 923 N ASP A 63 20.616 -5.927 -4.046 1.00 0.00 N ATOM 924 CA ASP A 63 20.593 -6.713 -2.797 1.00 0.00 C ATOM 925 C ASP A 63 20.906 -8.219 -3.021 1.00 0.00 C ATOM 926 O ASP A 63 20.759 -8.700 -4.153 1.00 0.00 O ATOM 927 CB ASP A 63 19.233 -6.512 -2.100 1.00 0.00 C ATOM 928 CG ASP A 63 19.389 -6.366 -0.574 1.00 0.00 C ATOM 929 OD1 ASP A 63 20.020 -5.379 -0.130 1.00 0.00 O ATOM 930 OD2 ASP A 63 18.887 -7.220 0.189 1.00 0.00 O ATOM 0 H ASP A 63 19.703 -5.858 -4.496 1.00 0.00 H new ATOM 0 HA ASP A 63 21.391 -6.346 -2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.746 -5.624 -2.502 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.583 -7.359 -2.320 1.00 0.00 H new ATOM 935 N PRO A 64 21.356 -8.980 -1.999 1.00 0.00 N ATOM 936 CA PRO A 64 21.478 -10.445 -2.051 1.00 0.00 C ATOM 937 C PRO A 64 20.241 -11.148 -1.446 1.00 0.00 C ATOM 938 O PRO A 64 19.629 -10.665 -0.492 1.00 0.00 O ATOM 939 CB PRO A 64 22.744 -10.776 -1.257 1.00 0.00 C ATOM 940 CG PRO A 64 22.751 -9.690 -0.188 1.00 0.00 C ATOM 941 CD PRO A 64 22.113 -8.473 -0.863 1.00 0.00 C ATOM 0 HA PRO A 64 21.539 -10.799 -3.080 1.00 0.00 H new ATOM 0 HB2 PRO A 64 22.702 -11.774 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.637 -10.738 -1.881 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.185 -9.997 0.691 1.00 0.00 H new ATOM 0 HG3 PRO A 64 23.765 -9.471 0.146 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.462 -7.941 -0.169 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.876 -7.766 -1.189 1.00 0.00 H new ATOM 949 N ILE A 65 19.924 -12.353 -1.931 1.00 0.00 N ATOM 950 CA ILE A 65 18.692 -13.098 -1.582 1.00 0.00 C ATOM 951 C ILE A 65 18.561 -13.504 -0.099 1.00 0.00 C ATOM 952 O ILE A 65 17.454 -13.777 0.361 1.00 0.00 O ATOM 953 CB ILE A 65 18.548 -14.298 -2.548 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.142 -14.924 -2.504 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.638 -15.360 -2.290 1.00 0.00 C ATOM 956 CD1 ILE A 65 16.888 -15.943 -3.624 1.00 0.00 C ATOM 0 H ILE A 65 20.521 -12.854 -2.589 1.00 0.00 H new ATOM 0 HA ILE A 65 17.855 -12.412 -1.711 1.00 0.00 H new ATOM 0 HB ILE A 65 18.688 -13.906 -3.555 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.001 -15.413 -1.540 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.398 -14.130 -2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.509 -16.190 -2.985 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.622 -14.914 -2.436 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.554 -15.727 -1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 65 15.878 -16.343 -3.530 1.00 0.00 H new ATOM 0 HD12 ILE A 65 16.996 -15.454 -4.592 1.00 0.00 H new ATOM 0 HD13 ILE A 65 17.609 -16.757 -3.546 1.00 0.00 H new ATOM 968 N GLU A 66 19.658 -13.528 0.664 1.00 0.00 N ATOM 969 CA GLU A 66 19.653 -13.865 2.102 1.00 0.00 C ATOM 970 C GLU A 66 19.697 -12.636 3.035 1.00 0.00 C ATOM 971 O GLU A 66 19.519 -12.784 4.248 1.00 0.00 O ATOM 972 CB GLU A 66 20.773 -14.869 2.411 1.00 0.00 C ATOM 973 CG GLU A 66 20.576 -16.198 1.665 1.00 0.00 C ATOM 974 CD GLU A 66 21.583 -17.261 2.159 1.00 0.00 C ATOM 975 OE1 GLU A 66 22.723 -17.313 1.634 1.00 0.00 O ATOM 976 OE2 GLU A 66 21.244 -18.057 3.070 1.00 0.00 O ATOM 0 H GLU A 66 20.587 -13.313 0.303 1.00 0.00 H new ATOM 0 HA GLU A 66 18.692 -14.333 2.314 1.00 0.00 H new ATOM 0 HB2 GLU A 66 21.734 -14.437 2.134 1.00 0.00 H new ATOM 0 HB3 GLU A 66 20.806 -15.057 3.484 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.558 -16.557 1.816 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.703 -16.041 0.594 1.00 0.00 H new ATOM 983 N ASN A 67 19.894 -11.419 2.500 1.00 0.00 N ATOM 984 CA ASN A 67 19.736 -10.170 3.263 1.00 0.00 C ATOM 985 C ASN A 67 18.286 -9.663 3.219 1.00 0.00 C ATOM 986 O ASN A 67 17.766 -9.177 4.229 1.00 0.00 O ATOM 987 CB ASN A 67 20.693 -9.112 2.706 1.00 0.00 C ATOM 988 CG ASN A 67 20.540 -7.776 3.414 1.00 0.00 C ATOM 989 OD1 ASN A 67 20.978 -7.590 4.542 1.00 0.00 O ATOM 990 ND2 ASN A 67 19.901 -6.819 2.784 1.00 0.00 N ATOM 0 H ASN A 67 20.167 -11.274 1.528 1.00 0.00 H new ATOM 0 HA ASN A 67 19.978 -10.368 4.307 1.00 0.00 H new ATOM 0 HB2 ASN A 67 21.720 -9.462 2.810 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.507 -8.981 1.640 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.767 -5.913 3.234 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.539 -6.980 1.844 1.00 0.00 H new ATOM 997 N PHE A 68 17.635 -9.781 2.058 1.00 0.00 N ATOM 998 CA PHE A 68 16.237 -9.404 1.875 1.00 0.00 C ATOM 999 C PHE A 68 15.283 -10.380 2.593 1.00 0.00 C ATOM 1000 O PHE A 68 15.648 -11.511 2.922 1.00 0.00 O ATOM 1001 CB PHE A 68 15.955 -9.232 0.370 1.00 0.00 C ATOM 1002 CG PHE A 68 14.728 -9.933 -0.171 1.00 0.00 C ATOM 1003 CD1 PHE A 68 14.801 -11.294 -0.514 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.522 -9.230 -0.346 1.00 0.00 C ATOM 1005 CE1 PHE A 68 13.687 -11.933 -1.077 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.421 -9.869 -0.939 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.507 -11.216 -1.323 1.00 0.00 C ATOM 0 H PHE A 68 18.072 -10.145 1.211 1.00 0.00 H new ATOM 0 HA PHE A 68 16.044 -8.442 2.351 1.00 0.00 H new ATOM 0 HB2 PHE A 68 15.860 -8.167 0.160 1.00 0.00 H new ATOM 0 HB3 PHE A 68 16.824 -9.589 -0.183 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.713 -11.847 -0.344 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.443 -8.202 -0.025 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.738 -12.983 -1.323 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.504 -9.321 -1.100 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.669 -11.698 -1.805 1.00 0.00 H new ATOM 1017 N ASN A 69 14.042 -9.938 2.827 1.00 0.00 N ATOM 1018 CA ASN A 69 12.963 -10.758 3.378 1.00 0.00 C ATOM 1019 C ASN A 69 11.654 -10.504 2.617 1.00 0.00 C ATOM 1020 O ASN A 69 11.116 -9.403 2.672 1.00 0.00 O ATOM 1021 CB ASN A 69 12.856 -10.452 4.887 1.00 0.00 C ATOM 1022 CG ASN A 69 11.554 -10.921 5.515 1.00 0.00 C ATOM 1023 OD1 ASN A 69 10.851 -10.177 6.179 1.00 0.00 O ATOM 1024 ND2 ASN A 69 11.180 -12.165 5.314 1.00 0.00 N ATOM 0 H ASN A 69 13.756 -8.978 2.633 1.00 0.00 H new ATOM 0 HA ASN A 69 13.175 -11.820 3.257 1.00 0.00 H new ATOM 0 HB2 ASN A 69 13.690 -10.926 5.405 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.956 -9.377 5.039 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.305 -12.505 5.713 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.765 -12.790 4.759 1.00 0.00 H new ATOM 1031 N ALA A 70 11.105 -11.523 1.950 1.00 0.00 N ATOM 1032 CA ALA A 70 9.965 -11.382 1.029 1.00 0.00 C ATOM 1033 C ALA A 70 8.615 -10.982 1.672 1.00 0.00 C ATOM 1034 O ALA A 70 7.632 -10.808 0.958 1.00 0.00 O ATOM 1035 CB ALA A 70 9.827 -12.686 0.240 1.00 0.00 C ATOM 0 H ALA A 70 11.441 -12.482 2.033 1.00 0.00 H new ATOM 0 HA ALA A 70 10.196 -10.535 0.383 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.987 -12.606 -0.451 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.743 -12.870 -0.322 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.652 -13.512 0.930 1.00 0.00 H new ATOM 1041 N ASP A 71 8.542 -10.824 2.997 1.00 0.00 N ATOM 1042 CA ASP A 71 7.271 -10.591 3.706 1.00 0.00 C ATOM 1043 C ASP A 71 6.687 -9.196 3.411 1.00 0.00 C ATOM 1044 O ASP A 71 5.468 -9.018 3.364 1.00 0.00 O ATOM 1045 CB ASP A 71 7.493 -10.782 5.210 1.00 0.00 C ATOM 1046 CG ASP A 71 6.174 -10.689 5.998 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.349 -11.631 5.903 1.00 0.00 O ATOM 1048 OD2 ASP A 71 5.968 -9.693 6.734 1.00 0.00 O ATOM 0 H ASP A 71 9.357 -10.853 3.610 1.00 0.00 H new ATOM 0 HA ASP A 71 6.540 -11.315 3.346 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.956 -11.753 5.389 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.188 -10.025 5.574 1.00 0.00 H new ATOM 1053 N ASP A 72 7.561 -8.217 3.152 1.00 0.00 N ATOM 1054 CA ASP A 72 7.195 -6.841 2.789 1.00 0.00 C ATOM 1055 C ASP A 72 6.949 -6.653 1.273 1.00 0.00 C ATOM 1056 O ASP A 72 6.597 -5.557 0.832 1.00 0.00 O ATOM 1057 CB ASP A 72 8.290 -5.907 3.325 1.00 0.00 C ATOM 1058 CG ASP A 72 7.838 -4.443 3.465 1.00 0.00 C ATOM 1059 OD1 ASP A 72 6.699 -4.181 3.928 1.00 0.00 O ATOM 1060 OD2 ASP A 72 8.657 -3.535 3.191 1.00 0.00 O ATOM 0 H ASP A 72 8.570 -8.363 3.190 1.00 0.00 H new ATOM 0 HA ASP A 72 6.237 -6.594 3.247 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.622 -6.271 4.298 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.151 -5.950 2.658 1.00 0.00 H new ATOM 1065 N TYR A 73 7.140 -7.710 0.466 1.00 0.00 N ATOM 1066 CA TYR A 73 7.127 -7.681 -0.999 1.00 0.00 C ATOM 1067 C TYR A 73 6.102 -8.684 -1.541 1.00 0.00 C ATOM 1068 O TYR A 73 6.404 -9.853 -1.785 1.00 0.00 O ATOM 1069 CB TYR A 73 8.543 -7.932 -1.552 1.00 0.00 C ATOM 1070 CG TYR A 73 9.623 -7.065 -0.935 1.00 0.00 C ATOM 1071 CD1 TYR A 73 10.187 -7.459 0.291 1.00 0.00 C ATOM 1072 CD2 TYR A 73 10.037 -5.863 -1.541 1.00 0.00 C ATOM 1073 CE1 TYR A 73 11.143 -6.658 0.931 1.00 0.00 C ATOM 1074 CE2 TYR A 73 10.963 -5.030 -0.882 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.528 -5.429 0.354 1.00 0.00 C ATOM 1076 OH TYR A 73 12.438 -4.640 0.988 1.00 0.00 O ATOM 0 H TYR A 73 7.315 -8.644 0.836 1.00 0.00 H new ATOM 0 HA TYR A 73 6.820 -6.692 -1.339 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.801 -8.979 -1.393 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.533 -7.766 -2.629 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.880 -8.390 0.745 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.646 -5.581 -2.507 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.584 -6.980 1.863 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.243 -4.084 -1.321 1.00 0.00 H new ATOM 0 HH TYR A 73 12.594 -3.830 0.458 1.00 0.00 H new ATOM 1086 N ASP A 74 4.866 -8.216 -1.736 1.00 0.00 N ATOM 1087 CA ASP A 74 3.720 -9.015 -2.189 1.00 0.00 C ATOM 1088 C ASP A 74 3.979 -9.759 -3.511 1.00 0.00 C ATOM 1089 O ASP A 74 3.385 -10.808 -3.765 1.00 0.00 O ATOM 1090 CB ASP A 74 2.522 -8.077 -2.412 1.00 0.00 C ATOM 1091 CG ASP A 74 2.179 -7.207 -1.195 1.00 0.00 C ATOM 1092 OD1 ASP A 74 2.913 -6.225 -0.944 1.00 0.00 O ATOM 1093 OD2 ASP A 74 1.135 -7.465 -0.552 1.00 0.00 O ATOM 0 H ASP A 74 4.626 -7.237 -1.578 1.00 0.00 H new ATOM 0 HA ASP A 74 3.532 -9.760 -1.416 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.734 -7.428 -3.262 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.650 -8.674 -2.677 1.00 0.00 H new ATOM 1098 N VAL A 75 4.861 -9.208 -4.352 1.00 0.00 N ATOM 1099 CA VAL A 75 5.135 -9.676 -5.712 1.00 0.00 C ATOM 1100 C VAL A 75 6.611 -10.046 -5.865 1.00 0.00 C ATOM 1101 O VAL A 75 7.471 -9.169 -5.798 1.00 0.00 O ATOM 1102 CB VAL A 75 4.733 -8.589 -6.725 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.830 -9.121 -8.151 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.311 -8.052 -6.513 1.00 0.00 C ATOM 0 H VAL A 75 5.422 -8.396 -4.094 1.00 0.00 H new ATOM 0 HA VAL A 75 4.545 -10.571 -5.907 1.00 0.00 H new ATOM 0 HB VAL A 75 5.433 -7.769 -6.564 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.542 -8.338 -8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.855 -9.431 -8.355 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.163 -9.975 -8.267 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.095 -7.290 -7.261 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.596 -8.869 -6.609 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.232 -7.616 -5.517 1.00 0.00 H new ATOM 1114 N VAL A 76 6.923 -11.319 -6.118 1.00 0.00 N ATOM 1115 CA VAL A 76 8.304 -11.810 -6.288 1.00 0.00 C ATOM 1116 C VAL A 76 8.473 -12.491 -7.645 1.00 0.00 C ATOM 1117 O VAL A 76 7.690 -13.363 -8.005 1.00 0.00 O ATOM 1118 CB VAL A 76 8.729 -12.749 -5.143 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.216 -13.112 -5.273 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.537 -12.098 -3.766 1.00 0.00 C ATOM 0 H VAL A 76 6.219 -12.051 -6.213 1.00 0.00 H new ATOM 0 HA VAL A 76 8.963 -10.943 -6.252 1.00 0.00 H new ATOM 0 HB VAL A 76 8.099 -13.635 -5.220 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.501 -13.776 -4.457 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.386 -13.614 -6.225 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.817 -12.204 -5.229 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.849 -12.794 -2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.140 -11.192 -3.705 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.486 -11.845 -3.627 1.00 0.00 H new ATOM 1130 N ILE A 77 9.492 -12.106 -8.409 1.00 0.00 N ATOM 1131 CA ILE A 77 9.684 -12.561 -9.793 1.00 0.00 C ATOM 1132 C ILE A 77 10.983 -13.344 -9.938 1.00 0.00 C ATOM 1133 O ILE A 77 12.052 -12.802 -9.684 1.00 0.00 O ATOM 1134 CB ILE A 77 9.695 -11.355 -10.752 1.00 0.00 C ATOM 1135 CG1 ILE A 77 8.465 -10.434 -10.608 1.00 0.00 C ATOM 1136 CG2 ILE A 77 9.859 -11.822 -12.208 1.00 0.00 C ATOM 1137 CD1 ILE A 77 7.112 -11.112 -10.835 1.00 0.00 C ATOM 0 H ILE A 77 10.216 -11.464 -8.087 1.00 0.00 H new ATOM 0 HA ILE A 77 8.854 -13.220 -10.048 1.00 0.00 H new ATOM 0 HB ILE A 77 10.556 -10.751 -10.467 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.472 -9.999 -9.609 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.563 -9.610 -11.315 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.864 -10.956 -12.870 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.799 -12.364 -12.313 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.030 -12.478 -12.475 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.313 -10.381 -10.711 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.075 -11.522 -11.844 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.982 -11.917 -10.111 1.00 0.00 H new ATOM 1149 N SER A 78 10.908 -14.574 -10.434 1.00 0.00 N ATOM 1150 CA SER A 78 12.074 -15.354 -10.842 1.00 0.00 C ATOM 1151 C SER A 78 12.389 -15.036 -12.302 1.00 0.00 C ATOM 1152 O SER A 78 11.712 -15.486 -13.225 1.00 0.00 O ATOM 1153 CB SER A 78 11.821 -16.843 -10.615 1.00 0.00 C ATOM 1154 OG SER A 78 13.032 -17.563 -10.768 1.00 0.00 O ATOM 0 H SER A 78 10.024 -15.065 -10.566 1.00 0.00 H new ATOM 0 HA SER A 78 12.941 -15.088 -10.237 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.415 -17.004 -9.617 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.078 -17.208 -11.324 1.00 0.00 H new ATOM 0 HG SER A 78 13.181 -17.754 -11.718 1.00 0.00 H new ATOM 1160 N LEU A 79 13.447 -14.261 -12.536 1.00 0.00 N ATOM 1161 CA LEU A 79 13.978 -13.907 -13.861 1.00 0.00 C ATOM 1162 C LEU A 79 14.897 -15.018 -14.401 1.00 0.00 C ATOM 1163 O LEU A 79 15.895 -14.755 -15.063 1.00 0.00 O ATOM 1164 CB LEU A 79 14.648 -12.522 -13.738 1.00 0.00 C ATOM 1165 CG LEU A 79 13.705 -11.368 -13.377 1.00 0.00 C ATOM 1166 CD1 LEU A 79 14.533 -10.097 -13.421 1.00 0.00 C ATOM 1167 CD2 LEU A 79 12.573 -11.176 -14.367 1.00 0.00 C ATOM 0 H LEU A 79 13.984 -13.842 -11.777 1.00 0.00 H new ATOM 0 HA LEU A 79 13.186 -13.830 -14.606 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.430 -12.581 -12.981 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.137 -12.288 -14.684 1.00 0.00 H new ATOM 0 HG LEU A 79 13.266 -11.592 -12.405 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.903 -9.244 -13.170 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.349 -10.169 -12.702 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.942 -9.964 -14.422 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.947 -10.343 -14.047 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.985 -10.963 -15.353 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.972 -12.084 -14.413 1.00 0.00 H new ATOM 1179 N CYS A 80 14.598 -16.261 -14.043 1.00 0.00 N ATOM 1180 CA CYS A 80 15.401 -17.466 -14.232 1.00 0.00 C ATOM 1181 C CYS A 80 14.513 -18.703 -14.018 1.00 0.00 C ATOM 1182 O CYS A 80 13.571 -18.631 -13.227 1.00 0.00 O ATOM 1183 CB CYS A 80 16.492 -17.457 -13.139 1.00 0.00 C ATOM 1184 SG CYS A 80 17.439 -19.002 -12.969 1.00 0.00 S ATOM 0 H CYS A 80 13.716 -16.470 -13.575 1.00 0.00 H new ATOM 0 HA CYS A 80 15.832 -17.493 -15.233 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.188 -16.645 -13.351 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.022 -17.232 -12.182 1.00 0.00 H new ATOM 1189 N GLY A 81 14.884 -19.864 -14.572 1.00 0.00 N ATOM 1190 CA GLY A 81 14.275 -21.169 -14.249 1.00 0.00 C ATOM 1191 C GLY A 81 14.706 -21.692 -12.860 1.00 0.00 C ATOM 1192 O GLY A 81 14.928 -22.889 -12.677 1.00 0.00 O ATOM 0 H GLY A 81 15.627 -19.929 -15.268 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.189 -21.078 -14.279 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.555 -21.896 -15.011 1.00 0.00 H new ATOM 1196 N CYS A 82 14.892 -20.774 -11.900 1.00 0.00 N ATOM 1197 CA CYS A 82 15.488 -20.969 -10.574 1.00 0.00 C ATOM 1198 C CYS A 82 14.453 -21.328 -9.489 1.00 0.00 C ATOM 1199 O CYS A 82 14.843 -21.533 -8.345 1.00 0.00 O ATOM 1200 CB CYS A 82 16.226 -19.671 -10.159 1.00 0.00 C ATOM 1201 SG CYS A 82 17.799 -19.207 -10.970 1.00 0.00 S ATOM 0 H CYS A 82 14.608 -19.805 -12.043 1.00 0.00 H new ATOM 0 HA CYS A 82 16.175 -21.812 -10.651 1.00 0.00 H new ATOM 0 HB2 CYS A 82 15.531 -18.844 -10.304 1.00 0.00 H new ATOM 0 HB3 CYS A 82 16.422 -19.739 -9.089 1.00 0.00 H new ATOM 1206 N GLY A 83 13.151 -21.397 -9.799 1.00 0.00 N ATOM 1207 CA GLY A 83 12.050 -21.506 -8.820 1.00 0.00 C ATOM 1208 C GLY A 83 12.189 -22.595 -7.746 1.00 0.00 C ATOM 1209 O GLY A 83 11.828 -22.358 -6.594 1.00 0.00 O ATOM 0 H GLY A 83 12.821 -21.378 -10.764 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.944 -20.544 -8.318 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.124 -21.684 -9.367 1.00 0.00 H new ATOM 1213 N VAL A 84 12.776 -23.750 -8.083 1.00 0.00 N ATOM 1214 CA VAL A 84 13.033 -24.853 -7.125 1.00 0.00 C ATOM 1215 C VAL A 84 14.309 -24.673 -6.287 1.00 0.00 C ATOM 1216 O VAL A 84 14.466 -25.322 -5.250 1.00 0.00 O ATOM 1217 CB VAL A 84 13.028 -26.229 -7.822 1.00 0.00 C ATOM 1218 CG1 VAL A 84 11.661 -26.521 -8.450 1.00 0.00 C ATOM 1219 CG2 VAL A 84 14.112 -26.365 -8.901 1.00 0.00 C ATOM 0 H VAL A 84 13.091 -23.955 -9.031 1.00 0.00 H new ATOM 0 HA VAL A 84 12.201 -24.813 -6.422 1.00 0.00 H new ATOM 0 HB VAL A 84 13.245 -26.956 -7.039 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.684 -27.497 -8.935 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.896 -26.520 -7.673 1.00 0.00 H new ATOM 0 HG13 VAL A 84 11.429 -25.754 -9.189 1.00 0.00 H new ATOM 0 HG21 VAL A 84 14.054 -27.356 -9.352 1.00 0.00 H new ATOM 0 HG22 VAL A 84 13.958 -25.607 -9.669 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.094 -26.229 -8.449 1.00 0.00 H new ATOM 1229 N ASN A 85 15.215 -23.782 -6.710 1.00 0.00 N ATOM 1230 CA ASN A 85 16.445 -23.413 -5.998 1.00 0.00 C ATOM 1231 C ASN A 85 16.256 -22.179 -5.082 1.00 0.00 C ATOM 1232 O ASN A 85 17.010 -22.000 -4.124 1.00 0.00 O ATOM 1233 CB ASN A 85 17.546 -23.192 -7.055 1.00 0.00 C ATOM 1234 CG ASN A 85 18.960 -23.154 -6.486 1.00 0.00 C ATOM 1235 OD1 ASN A 85 19.267 -23.685 -5.428 1.00 0.00 O ATOM 1236 ND2 ASN A 85 19.888 -22.555 -7.199 1.00 0.00 N ATOM 0 H ASN A 85 15.107 -23.279 -7.591 1.00 0.00 H new ATOM 0 HA ASN A 85 16.732 -24.218 -5.322 1.00 0.00 H new ATOM 0 HB2 ASN A 85 17.486 -23.988 -7.797 1.00 0.00 H new ATOM 0 HB3 ASN A 85 17.351 -22.255 -7.576 1.00 0.00 H new ATOM 0 HD21 ASN A 85 20.853 -22.536 -6.868 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.643 -22.109 -8.083 1.00 0.00 H new ATOM 1243 N LEU A 86 15.247 -21.335 -5.344 1.00 0.00 N ATOM 1244 CA LEU A 86 14.862 -20.234 -4.444 1.00 0.00 C ATOM 1245 C LEU A 86 14.380 -20.765 -3.071 1.00 0.00 C ATOM 1246 O LEU A 86 13.779 -21.846 -3.018 1.00 0.00 O ATOM 1247 CB LEU A 86 13.746 -19.368 -5.069 1.00 0.00 C ATOM 1248 CG LEU A 86 14.028 -18.751 -6.450 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.897 -17.799 -6.818 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.346 -17.985 -6.519 1.00 0.00 C ATOM 0 H LEU A 86 14.674 -21.395 -6.186 1.00 0.00 H new ATOM 0 HA LEU A 86 15.753 -19.623 -4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.848 -19.980 -5.149 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.519 -18.558 -4.376 1.00 0.00 H new ATOM 0 HG LEU A 86 14.099 -19.583 -7.150 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.094 -17.360 -7.796 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.956 -18.347 -6.849 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.831 -17.007 -6.072 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.478 -17.578 -7.521 1.00 0.00 H new ATOM 0 HD22 LEU A 86 15.331 -17.170 -5.795 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.171 -18.659 -6.289 1.00 0.00 H new ATOM 1262 N PRO A 87 14.563 -20.009 -1.968 1.00 0.00 N ATOM 1263 CA PRO A 87 13.952 -20.333 -0.675 1.00 0.00 C ATOM 1264 C PRO A 87 12.415 -20.372 -0.793 1.00 0.00 C ATOM 1265 O PRO A 87 11.840 -19.435 -1.362 1.00 0.00 O ATOM 1266 CB PRO A 87 14.423 -19.243 0.298 1.00 0.00 C ATOM 1267 CG PRO A 87 15.705 -18.722 -0.348 1.00 0.00 C ATOM 1268 CD PRO A 87 15.386 -18.818 -1.838 1.00 0.00 C ATOM 0 HA PRO A 87 14.250 -21.320 -0.321 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.679 -18.454 0.408 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.610 -19.646 1.293 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.925 -17.698 -0.045 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.570 -19.327 -0.078 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.856 -17.932 -2.187 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.296 -18.900 -2.432 1.00 0.00 H new ATOM 1276 N PRO A 88 11.717 -21.406 -0.281 1.00 0.00 N ATOM 1277 CA PRO A 88 10.270 -21.545 -0.463 1.00 0.00 C ATOM 1278 C PRO A 88 9.465 -20.368 0.106 1.00 0.00 C ATOM 1279 O PRO A 88 8.483 -19.961 -0.509 1.00 0.00 O ATOM 1280 CB PRO A 88 9.889 -22.883 0.185 1.00 0.00 C ATOM 1281 CG PRO A 88 11.036 -23.169 1.154 1.00 0.00 C ATOM 1282 CD PRO A 88 12.242 -22.547 0.451 1.00 0.00 C ATOM 0 HA PRO A 88 10.021 -21.533 -1.524 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.934 -22.816 0.707 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.790 -23.673 -0.560 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.861 -22.718 2.131 1.00 0.00 H new ATOM 0 HG3 PRO A 88 11.170 -24.238 1.316 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.999 -22.237 1.171 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.716 -23.261 -0.222 1.00 0.00 H new ATOM 1290 N GLU A 89 9.900 -19.735 1.199 1.00 0.00 N ATOM 1291 CA GLU A 89 9.234 -18.538 1.734 1.00 0.00 C ATOM 1292 C GLU A 89 9.327 -17.312 0.801 1.00 0.00 C ATOM 1293 O GLU A 89 8.430 -16.466 0.815 1.00 0.00 O ATOM 1294 CB GLU A 89 9.717 -18.213 3.161 1.00 0.00 C ATOM 1295 CG GLU A 89 11.237 -18.097 3.351 1.00 0.00 C ATOM 1296 CD GLU A 89 11.866 -19.447 3.743 1.00 0.00 C ATOM 1297 OE1 GLU A 89 12.193 -20.244 2.834 1.00 0.00 O ATOM 1298 OE2 GLU A 89 12.025 -19.718 4.961 1.00 0.00 O ATOM 0 H GLU A 89 10.715 -20.032 1.735 1.00 0.00 H new ATOM 0 HA GLU A 89 8.173 -18.783 1.788 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.260 -17.274 3.472 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.345 -18.986 3.833 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.693 -17.737 2.429 1.00 0.00 H new ATOM 0 HG3 GLU A 89 11.452 -17.357 4.122 1.00 0.00 H new ATOM 1305 N TRP A 90 10.355 -17.208 -0.054 1.00 0.00 N ATOM 1306 CA TRP A 90 10.412 -16.178 -1.099 1.00 0.00 C ATOM 1307 C TRP A 90 9.512 -16.510 -2.311 1.00 0.00 C ATOM 1308 O TRP A 90 9.184 -15.618 -3.091 1.00 0.00 O ATOM 1309 CB TRP A 90 11.873 -15.925 -1.500 1.00 0.00 C ATOM 1310 CG TRP A 90 12.858 -15.529 -0.430 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.184 -15.460 -0.670 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.705 -15.146 0.988 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.853 -15.050 0.458 1.00 0.00 N ATOM 1314 CE2 TRP A 90 14.004 -14.877 1.518 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.633 -15.001 1.904 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.234 -14.529 2.855 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 11.852 -14.700 3.263 1.00 0.00 C ATOM 1318 CH2 TRP A 90 13.154 -14.479 3.746 1.00 0.00 C ATOM 0 H TRP A 90 11.163 -17.830 -0.041 1.00 0.00 H new ATOM 0 HA TRP A 90 10.006 -15.253 -0.689 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.247 -16.832 -1.975 1.00 0.00 H new ATOM 0 HB3 TRP A 90 11.877 -15.143 -2.259 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.653 -15.694 -1.614 1.00 0.00 H new ATOM 0 HE1 TRP A 90 15.860 -14.894 0.500 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.620 -15.125 1.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.233 -14.302 3.196 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 11.012 -14.638 3.940 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.320 -14.273 4.793 1.00 0.00 H new ATOM 1329 N VAL A 91 9.064 -17.764 -2.450 1.00 0.00 N ATOM 1330 CA VAL A 91 8.142 -18.240 -3.494 1.00 0.00 C ATOM 1331 C VAL A 91 6.677 -18.135 -3.049 1.00 0.00 C ATOM 1332 O VAL A 91 5.835 -17.712 -3.837 1.00 0.00 O ATOM 1333 CB VAL A 91 8.506 -19.688 -3.898 1.00 0.00 C ATOM 1334 CG1 VAL A 91 7.470 -20.341 -4.818 1.00 0.00 C ATOM 1335 CG2 VAL A 91 9.872 -19.728 -4.594 1.00 0.00 C ATOM 0 H VAL A 91 9.345 -18.508 -1.812 1.00 0.00 H new ATOM 0 HA VAL A 91 8.252 -17.596 -4.367 1.00 0.00 H new ATOM 0 HB VAL A 91 8.531 -20.255 -2.968 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.788 -21.355 -5.062 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.505 -20.375 -4.313 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.379 -19.759 -5.735 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.110 -20.755 -4.870 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.842 -19.109 -5.491 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.637 -19.348 -3.917 1.00 0.00 H new ATOM 1345 N THR A 92 6.343 -18.450 -1.794 1.00 0.00 N ATOM 1346 CA THR A 92 4.948 -18.540 -1.300 1.00 0.00 C ATOM 1347 C THR A 92 4.309 -17.188 -0.915 1.00 0.00 C ATOM 1348 O THR A 92 3.402 -17.123 -0.081 1.00 0.00 O ATOM 1349 CB THR A 92 4.814 -19.596 -0.187 1.00 0.00 C ATOM 1350 OG1 THR A 92 5.698 -19.304 0.881 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.136 -20.997 -0.719 1.00 0.00 C ATOM 0 H THR A 92 7.037 -18.654 -1.075 1.00 0.00 H new ATOM 0 HA THR A 92 4.360 -18.875 -2.154 1.00 0.00 H new ATOM 0 HB THR A 92 3.783 -19.571 0.167 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.600 -19.983 1.581 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.034 -21.724 0.086 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.446 -21.248 -1.524 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.158 -21.016 -1.098 1.00 0.00 H new ATOM 1359 N GLN A 93 4.754 -16.094 -1.546 1.00 0.00 N ATOM 1360 CA GLN A 93 4.137 -14.762 -1.465 1.00 0.00 C ATOM 1361 C GLN A 93 2.904 -14.637 -2.379 1.00 0.00 C ATOM 1362 O GLN A 93 2.613 -15.521 -3.187 1.00 0.00 O ATOM 1363 CB GLN A 93 5.194 -13.677 -1.756 1.00 0.00 C ATOM 1364 CG GLN A 93 6.383 -13.706 -0.777 1.00 0.00 C ATOM 1365 CD GLN A 93 5.966 -13.632 0.696 1.00 0.00 C ATOM 1366 OE1 GLN A 93 5.063 -12.905 1.093 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.581 -14.412 1.562 1.00 0.00 N ATOM 0 H GLN A 93 5.579 -16.111 -2.146 1.00 0.00 H new ATOM 0 HA GLN A 93 3.768 -14.615 -0.450 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.566 -13.806 -2.772 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.720 -12.697 -1.712 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.954 -14.620 -0.939 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.047 -12.871 -1.000 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.335 -15.024 1.251 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.303 -14.403 2.543 1.00 0.00 H new ATOM 1376 N GLU A 94 2.155 -13.541 -2.214 1.00 0.00 N ATOM 1377 CA GLU A 94 0.835 -13.343 -2.832 1.00 0.00 C ATOM 1378 C GLU A 94 0.847 -13.497 -4.368 1.00 0.00 C ATOM 1379 O GLU A 94 -0.057 -14.117 -4.934 1.00 0.00 O ATOM 1380 CB GLU A 94 0.311 -11.959 -2.419 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.169 -11.813 -2.760 1.00 0.00 C ATOM 1382 CD GLU A 94 -1.701 -10.432 -2.337 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -1.520 -9.447 -3.093 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -2.298 -10.306 -1.240 1.00 0.00 O ATOM 0 H GLU A 94 2.452 -12.753 -1.639 1.00 0.00 H new ATOM 0 HA GLU A 94 0.170 -14.128 -2.471 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.458 -11.815 -1.349 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.884 -11.183 -2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.314 -11.949 -3.832 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.740 -12.595 -2.259 1.00 0.00 H new ATOM 1391 N ILE A 95 1.894 -12.989 -5.030 1.00 0.00 N ATOM 1392 CA ILE A 95 2.173 -13.221 -6.453 1.00 0.00 C ATOM 1393 C ILE A 95 3.618 -13.706 -6.620 1.00 0.00 C ATOM 1394 O ILE A 95 4.561 -13.020 -6.221 1.00 0.00 O ATOM 1395 CB ILE A 95 1.892 -11.950 -7.293 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.409 -11.511 -7.166 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.268 -12.181 -8.773 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.018 -10.269 -7.979 1.00 0.00 C ATOM 0 H ILE A 95 2.587 -12.391 -4.580 1.00 0.00 H new ATOM 0 HA ILE A 95 1.504 -13.997 -6.825 1.00 0.00 H new ATOM 0 HB ILE A 95 2.514 -11.145 -6.901 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.226 -12.341 -7.475 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.193 -11.319 -6.115 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.063 -11.277 -9.346 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.328 -12.424 -8.845 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.679 -13.006 -9.174 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.037 -10.048 -7.820 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.620 -9.419 -7.657 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.194 -10.457 -9.038 1.00 0.00 H new ATOM 1410 N PHE A 96 3.791 -14.859 -7.272 1.00 0.00 N ATOM 1411 CA PHE A 96 5.088 -15.370 -7.721 1.00 0.00 C ATOM 1412 C PHE A 96 5.028 -15.745 -9.213 1.00 0.00 C ATOM 1413 O PHE A 96 4.010 -16.247 -9.697 1.00 0.00 O ATOM 1414 CB PHE A 96 5.587 -16.513 -6.824 1.00 0.00 C ATOM 1415 CG PHE A 96 6.884 -17.138 -7.308 1.00 0.00 C ATOM 1416 CD1 PHE A 96 8.120 -16.541 -6.995 1.00 0.00 C ATOM 1417 CD2 PHE A 96 6.855 -18.291 -8.115 1.00 0.00 C ATOM 1418 CE1 PHE A 96 9.315 -17.090 -7.489 1.00 0.00 C ATOM 1419 CE2 PHE A 96 8.051 -18.847 -8.604 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.283 -18.245 -8.290 1.00 0.00 C ATOM 0 H PHE A 96 3.015 -15.477 -7.508 1.00 0.00 H new ATOM 0 HA PHE A 96 5.831 -14.579 -7.624 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.730 -16.134 -5.812 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.819 -17.284 -6.770 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.150 -15.658 -6.373 1.00 0.00 H new ATOM 0 HD2 PHE A 96 5.909 -18.751 -8.360 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.260 -16.624 -7.253 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.023 -19.734 -9.219 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.203 -18.669 -8.664 1.00 0.00 H new ATOM 1430 N GLU A 97 6.104 -15.468 -9.954 1.00 0.00 N ATOM 1431 CA GLU A 97 6.156 -15.599 -11.418 1.00 0.00 C ATOM 1432 C GLU A 97 7.533 -16.075 -11.908 1.00 0.00 C ATOM 1433 O GLU A 97 8.549 -15.821 -11.261 1.00 0.00 O ATOM 1434 CB GLU A 97 5.775 -14.246 -12.060 1.00 0.00 C ATOM 1435 CG GLU A 97 4.613 -14.340 -13.056 1.00 0.00 C ATOM 1436 CD GLU A 97 5.008 -15.096 -14.335 1.00 0.00 C ATOM 1437 OE1 GLU A 97 4.985 -16.350 -14.328 1.00 0.00 O ATOM 1438 OE2 GLU A 97 5.352 -14.432 -15.341 1.00 0.00 O ATOM 0 H GLU A 97 6.981 -15.140 -9.549 1.00 0.00 H new ATOM 0 HA GLU A 97 5.440 -16.363 -11.722 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.509 -13.542 -11.271 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.647 -13.838 -12.571 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.770 -14.844 -12.583 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.278 -13.336 -13.317 1.00 0.00 H new ATOM 1445 N ASP A 98 7.580 -16.718 -13.078 1.00 0.00 N ATOM 1446 CA ASP A 98 8.798 -17.230 -13.722 1.00 0.00 C ATOM 1447 C ASP A 98 8.869 -16.751 -15.183 1.00 0.00 C ATOM 1448 O ASP A 98 8.043 -17.123 -16.022 1.00 0.00 O ATOM 1449 CB ASP A 98 8.833 -18.763 -13.616 1.00 0.00 C ATOM 1450 CG ASP A 98 10.146 -19.397 -14.129 1.00 0.00 C ATOM 1451 OD1 ASP A 98 10.731 -18.908 -15.125 1.00 0.00 O ATOM 1452 OD2 ASP A 98 10.568 -20.424 -13.541 1.00 0.00 O ATOM 0 H ASP A 98 6.740 -16.905 -13.625 1.00 0.00 H new ATOM 0 HA ASP A 98 9.677 -16.839 -13.210 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.686 -19.049 -12.574 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.997 -19.176 -14.181 1.00 0.00 H new ATOM 1457 N TRP A 99 9.854 -15.896 -15.481 1.00 0.00 N ATOM 1458 CA TRP A 99 10.002 -15.231 -16.786 1.00 0.00 C ATOM 1459 C TRP A 99 10.933 -15.964 -17.768 1.00 0.00 C ATOM 1460 O TRP A 99 11.199 -15.442 -18.850 1.00 0.00 O ATOM 1461 CB TRP A 99 10.433 -13.775 -16.573 1.00 0.00 C ATOM 1462 CG TRP A 99 9.430 -12.841 -15.962 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.280 -13.169 -15.327 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.515 -11.390 -15.878 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.665 -12.026 -14.861 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.435 -10.913 -15.088 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.431 -10.437 -16.357 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.345 -9.582 -14.673 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.370 -9.100 -15.928 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.355 -8.683 -15.048 1.00 0.00 C ATOM 0 H TRP A 99 10.583 -15.641 -14.814 1.00 0.00 H new ATOM 0 HA TRP A 99 9.025 -15.258 -17.268 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.321 -13.776 -15.941 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.729 -13.366 -17.539 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.902 -14.173 -15.204 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.753 -12.010 -14.405 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.191 -10.736 -17.064 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.511 -9.250 -14.073 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.106 -8.390 -16.276 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.353 -7.674 -14.662 1.00 0.00 H new ATOM 1481 N GLN A 100 11.429 -17.156 -17.421 1.00 0.00 N ATOM 1482 CA GLN A 100 12.432 -17.917 -18.180 1.00 0.00 C ATOM 1483 C GLN A 100 13.783 -17.172 -18.264 1.00 0.00 C ATOM 1484 O GLN A 100 14.610 -17.325 -17.365 1.00 0.00 O ATOM 1485 CB GLN A 100 11.870 -18.390 -19.544 1.00 0.00 C ATOM 1486 CG GLN A 100 10.496 -19.087 -19.472 1.00 0.00 C ATOM 1487 CD GLN A 100 9.809 -19.115 -20.838 1.00 0.00 C ATOM 1488 OE1 GLN A 100 9.797 -20.120 -21.542 1.00 0.00 O ATOM 1489 NE2 GLN A 100 9.227 -18.013 -21.275 1.00 0.00 N ATOM 0 H GLN A 100 11.133 -17.637 -16.572 1.00 0.00 H new ATOM 0 HA GLN A 100 12.656 -18.831 -17.629 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.790 -17.528 -20.206 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.586 -19.075 -19.998 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.623 -20.106 -19.106 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.861 -18.568 -18.755 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.231 -17.171 -20.699 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.774 -18.003 -22.189 1.00 0.00 H new ATOM 1498 N LEU A 101 13.969 -16.325 -19.290 1.00 0.00 N ATOM 1499 CA LEU A 101 15.163 -15.507 -19.583 1.00 0.00 C ATOM 1500 C LEU A 101 16.504 -16.286 -19.664 1.00 0.00 C ATOM 1501 O LEU A 101 16.569 -17.511 -19.556 1.00 0.00 O ATOM 1502 CB LEU A 101 15.227 -14.311 -18.596 1.00 0.00 C ATOM 1503 CG LEU A 101 14.020 -13.355 -18.538 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.393 -12.167 -17.669 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.624 -12.794 -19.899 1.00 0.00 C ATOM 0 H LEU A 101 13.238 -16.182 -19.987 1.00 0.00 H new ATOM 0 HA LEU A 101 15.038 -15.136 -20.600 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.383 -14.712 -17.595 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.109 -13.720 -18.844 1.00 0.00 H new ATOM 0 HG LEU A 101 13.182 -13.932 -18.148 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.551 -11.477 -17.615 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.643 -12.514 -16.666 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.253 -11.656 -18.101 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.768 -12.129 -19.783 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.461 -12.238 -20.321 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.359 -13.613 -20.567 1.00 0.00 H new ATOM 1517 N GLU A 102 17.591 -15.541 -19.887 1.00 0.00 N ATOM 1518 CA GLU A 102 18.986 -16.003 -19.907 1.00 0.00 C ATOM 1519 C GLU A 102 19.876 -14.927 -19.263 1.00 0.00 C ATOM 1520 O GLU A 102 19.555 -13.742 -19.364 1.00 0.00 O ATOM 1521 CB GLU A 102 19.391 -16.276 -21.368 1.00 0.00 C ATOM 1522 CG GLU A 102 20.833 -16.774 -21.556 1.00 0.00 C ATOM 1523 CD GLU A 102 21.101 -18.070 -20.763 1.00 0.00 C ATOM 1524 OE1 GLU A 102 21.445 -17.985 -19.559 1.00 0.00 O ATOM 1525 OE2 GLU A 102 20.962 -19.178 -21.338 1.00 0.00 O ATOM 0 H GLU A 102 17.518 -14.540 -20.069 1.00 0.00 H new ATOM 0 HA GLU A 102 19.105 -16.925 -19.338 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.709 -17.016 -21.787 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.260 -15.360 -21.944 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.021 -16.951 -22.615 1.00 0.00 H new ATOM 0 HG3 GLU A 102 21.530 -16.000 -21.233 1.00 0.00 H new ATOM 1532 N ASP A 103 20.976 -15.291 -18.595 1.00 0.00 N ATOM 1533 CA ASP A 103 21.899 -14.296 -18.032 1.00 0.00 C ATOM 1534 C ASP A 103 22.787 -13.692 -19.140 1.00 0.00 C ATOM 1535 O ASP A 103 23.526 -14.433 -19.800 1.00 0.00 O ATOM 1536 CB ASP A 103 22.751 -14.871 -16.886 1.00 0.00 C ATOM 1537 CG ASP A 103 22.882 -13.851 -15.751 1.00 0.00 C ATOM 1538 OD1 ASP A 103 23.439 -12.757 -15.986 1.00 0.00 O ATOM 1539 OD2 ASP A 103 22.318 -14.133 -14.667 1.00 0.00 O ATOM 0 H ASP A 103 21.249 -16.260 -18.431 1.00 0.00 H new ATOM 0 HA ASP A 103 21.294 -13.499 -17.601 1.00 0.00 H new ATOM 0 HB2 ASP A 103 22.294 -15.786 -16.509 1.00 0.00 H new ATOM 0 HB3 ASP A 103 23.740 -15.138 -17.259 1.00 0.00 H new ATOM 1544 N PRO A 104 22.735 -12.366 -19.379 1.00 0.00 N ATOM 1545 CA PRO A 104 23.413 -11.761 -20.520 1.00 0.00 C ATOM 1546 C PRO A 104 24.898 -11.451 -20.269 1.00 0.00 C ATOM 1547 O PRO A 104 25.607 -11.082 -21.202 1.00 0.00 O ATOM 1548 CB PRO A 104 22.592 -10.514 -20.804 1.00 0.00 C ATOM 1549 CG PRO A 104 22.188 -10.045 -19.409 1.00 0.00 C ATOM 1550 CD PRO A 104 21.892 -11.373 -18.716 1.00 0.00 C ATOM 0 HA PRO A 104 23.457 -12.442 -21.370 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.175 -9.758 -21.331 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.723 -10.735 -21.423 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.987 -9.493 -18.914 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.316 -9.391 -19.432 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.118 -11.317 -17.651 1.00 0.00 H new ATOM 0 HD3 PRO A 104 20.837 -11.634 -18.805 1.00 0.00 H new ATOM 1558 N ASP A 105 25.388 -11.619 -19.037 1.00 0.00 N ATOM 1559 CA ASP A 105 26.796 -11.470 -18.661 1.00 0.00 C ATOM 1560 C ASP A 105 27.755 -12.162 -19.651 1.00 0.00 C ATOM 1561 O ASP A 105 27.775 -13.392 -19.777 1.00 0.00 O ATOM 1562 CB ASP A 105 26.980 -12.036 -17.245 1.00 0.00 C ATOM 1563 CG ASP A 105 28.458 -12.061 -16.815 1.00 0.00 C ATOM 1564 OD1 ASP A 105 29.179 -11.068 -17.065 1.00 0.00 O ATOM 1565 OD2 ASP A 105 28.881 -13.048 -16.164 1.00 0.00 O ATOM 0 H ASP A 105 24.794 -11.871 -18.247 1.00 0.00 H new ATOM 0 HA ASP A 105 27.049 -10.410 -18.688 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.408 -11.435 -16.538 1.00 0.00 H new ATOM 0 HB3 ASP A 105 26.575 -13.047 -17.204 1.00 0.00 H new ATOM 1570 N GLY A 106 28.540 -11.354 -20.375 1.00 0.00 N ATOM 1571 CA GLY A 106 29.602 -11.837 -21.270 1.00 0.00 C ATOM 1572 C GLY A 106 29.098 -12.388 -22.612 1.00 0.00 C ATOM 1573 O GLY A 106 29.900 -12.864 -23.419 1.00 0.00 O ATOM 0 H GLY A 106 28.456 -10.338 -20.357 1.00 0.00 H new ATOM 0 HA2 GLY A 106 30.296 -11.020 -21.464 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.164 -12.618 -20.758 1.00 0.00 H new ATOM 1577 N GLN A 107 27.786 -12.319 -22.862 1.00 0.00 N ATOM 1578 CA GLN A 107 27.182 -12.601 -24.168 1.00 0.00 C ATOM 1579 C GLN A 107 27.338 -11.374 -25.097 1.00 0.00 C ATOM 1580 O GLN A 107 27.791 -10.307 -24.664 1.00 0.00 O ATOM 1581 CB GLN A 107 25.710 -13.025 -23.991 1.00 0.00 C ATOM 1582 CG GLN A 107 25.457 -14.070 -22.885 1.00 0.00 C ATOM 1583 CD GLN A 107 26.401 -15.270 -22.931 1.00 0.00 C ATOM 1584 OE1 GLN A 107 26.377 -16.074 -23.854 1.00 0.00 O ATOM 1585 NE2 GLN A 107 27.267 -15.438 -21.951 1.00 0.00 N ATOM 0 H GLN A 107 27.103 -12.061 -22.150 1.00 0.00 H new ATOM 0 HA GLN A 107 27.700 -13.434 -24.643 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.116 -12.137 -23.773 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.348 -13.426 -24.938 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.551 -13.585 -21.914 1.00 0.00 H new ATOM 0 HG3 GLN A 107 24.430 -14.426 -22.965 1.00 0.00 H new ATOM 0 HE21 GLN A 107 27.296 -14.775 -21.177 1.00 0.00 H new ATOM 0 HE22 GLN A 107 27.908 -16.231 -21.967 1.00 0.00 H new ATOM 1594 N SER A 108 26.968 -11.501 -26.376 1.00 0.00 N ATOM 1595 CA SER A 108 26.973 -10.359 -27.305 1.00 0.00 C ATOM 1596 C SER A 108 25.977 -9.276 -26.878 1.00 0.00 C ATOM 1597 O SER A 108 24.966 -9.558 -26.226 1.00 0.00 O ATOM 1598 CB SER A 108 26.708 -10.823 -28.745 1.00 0.00 C ATOM 1599 OG SER A 108 25.378 -11.300 -28.883 1.00 0.00 O ATOM 0 H SER A 108 26.662 -12.380 -26.793 1.00 0.00 H new ATOM 0 HA SER A 108 27.967 -9.913 -27.272 1.00 0.00 H new ATOM 0 HB2 SER A 108 26.876 -9.996 -29.435 1.00 0.00 H new ATOM 0 HB3 SER A 108 27.412 -11.611 -29.014 1.00 0.00 H new ATOM 0 HG SER A 108 25.228 -11.589 -29.807 1.00 0.00 H new ATOM 1605 N LEU A 109 26.233 -8.021 -27.264 1.00 0.00 N ATOM 1606 CA LEU A 109 25.374 -6.898 -26.869 1.00 0.00 C ATOM 1607 C LEU A 109 23.950 -7.058 -27.420 1.00 0.00 C ATOM 1608 O LEU A 109 22.999 -6.695 -26.745 1.00 0.00 O ATOM 1609 CB LEU A 109 26.020 -5.555 -27.272 1.00 0.00 C ATOM 1610 CG LEU A 109 26.999 -5.009 -26.214 1.00 0.00 C ATOM 1611 CD1 LEU A 109 28.239 -5.878 -25.998 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.476 -3.610 -26.609 1.00 0.00 C ATOM 0 H LEU A 109 27.026 -7.757 -27.848 1.00 0.00 H new ATOM 0 HA LEU A 109 25.281 -6.899 -25.783 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.550 -5.683 -28.216 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.235 -4.819 -27.445 1.00 0.00 H new ATOM 0 HG LEU A 109 26.434 -5.000 -25.282 1.00 0.00 H new ATOM 0 HD11 LEU A 109 28.875 -5.423 -25.239 1.00 0.00 H new ATOM 0 HD12 LEU A 109 27.934 -6.871 -25.668 1.00 0.00 H new ATOM 0 HD13 LEU A 109 28.793 -5.960 -26.933 1.00 0.00 H new ATOM 0 HD21 LEU A 109 28.167 -3.235 -25.854 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.982 -3.657 -27.573 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.619 -2.940 -26.681 1.00 0.00 H new ATOM 1624 N GLU A 110 23.763 -7.717 -28.564 1.00 0.00 N ATOM 1625 CA GLU A 110 22.432 -8.027 -29.105 1.00 0.00 C ATOM 1626 C GLU A 110 21.651 -9.034 -28.247 1.00 0.00 C ATOM 1627 O GLU A 110 20.442 -8.887 -28.083 1.00 0.00 O ATOM 1628 CB GLU A 110 22.576 -8.569 -30.530 1.00 0.00 C ATOM 1629 CG GLU A 110 23.117 -7.534 -31.532 1.00 0.00 C ATOM 1630 CD GLU A 110 22.169 -6.327 -31.687 1.00 0.00 C ATOM 1631 OE1 GLU A 110 21.259 -6.375 -32.551 1.00 0.00 O ATOM 1632 OE2 GLU A 110 22.326 -5.325 -30.944 1.00 0.00 O ATOM 0 H GLU A 110 24.530 -8.053 -29.146 1.00 0.00 H new ATOM 0 HA GLU A 110 21.861 -7.099 -29.100 1.00 0.00 H new ATOM 0 HB2 GLU A 110 23.243 -9.431 -30.516 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.604 -8.923 -30.875 1.00 0.00 H new ATOM 0 HG2 GLU A 110 24.095 -7.186 -31.201 1.00 0.00 H new ATOM 0 HG3 GLU A 110 23.260 -8.009 -32.502 1.00 0.00 H new ATOM 1639 N VAL A 111 22.320 -10.012 -27.626 1.00 0.00 N ATOM 1640 CA VAL A 111 21.692 -10.902 -26.623 1.00 0.00 C ATOM 1641 C VAL A 111 21.382 -10.106 -25.352 1.00 0.00 C ATOM 1642 O VAL A 111 20.312 -10.267 -24.764 1.00 0.00 O ATOM 1643 CB VAL A 111 22.576 -12.132 -26.326 1.00 0.00 C ATOM 1644 CG1 VAL A 111 22.047 -12.980 -25.159 1.00 0.00 C ATOM 1645 CG2 VAL A 111 22.647 -13.044 -27.558 1.00 0.00 C ATOM 0 H VAL A 111 23.305 -10.214 -27.797 1.00 0.00 H new ATOM 0 HA VAL A 111 20.756 -11.284 -27.030 1.00 0.00 H new ATOM 0 HB VAL A 111 23.557 -11.738 -26.060 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.710 -13.830 -24.997 1.00 0.00 H new ATOM 0 HG12 VAL A 111 22.010 -12.372 -24.255 1.00 0.00 H new ATOM 0 HG13 VAL A 111 21.046 -13.340 -25.396 1.00 0.00 H new ATOM 0 HG21 VAL A 111 23.273 -13.908 -27.336 1.00 0.00 H new ATOM 0 HG22 VAL A 111 21.644 -13.381 -27.820 1.00 0.00 H new ATOM 0 HG23 VAL A 111 23.074 -12.492 -28.395 1.00 0.00 H new ATOM 1655 N PHE A 112 22.266 -9.178 -24.981 1.00 0.00 N ATOM 1656 CA PHE A 112 22.086 -8.298 -23.815 1.00 0.00 C ATOM 1657 C PHE A 112 20.874 -7.364 -24.006 1.00 0.00 C ATOM 1658 O PHE A 112 20.058 -7.204 -23.099 1.00 0.00 O ATOM 1659 CB PHE A 112 23.421 -7.571 -23.517 1.00 0.00 C ATOM 1660 CG PHE A 112 23.746 -7.375 -22.053 1.00 0.00 C ATOM 1661 CD1 PHE A 112 22.867 -6.685 -21.200 1.00 0.00 C ATOM 1662 CD2 PHE A 112 24.918 -7.949 -21.526 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.153 -6.589 -19.829 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.192 -7.870 -20.152 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.322 -7.173 -19.304 1.00 0.00 C ATOM 0 H PHE A 112 23.138 -9.011 -25.484 1.00 0.00 H new ATOM 0 HA PHE A 112 21.843 -8.883 -22.928 1.00 0.00 H new ATOM 0 HB2 PHE A 112 24.232 -8.135 -23.978 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.397 -6.594 -23.999 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.973 -6.229 -21.599 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.611 -8.453 -22.183 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.473 -6.065 -19.174 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.073 -8.346 -19.749 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.547 -7.084 -18.251 1.00 0.00 H new ATOM 1675 N ARG A 113 20.665 -6.848 -25.223 1.00 0.00 N ATOM 1676 CA ARG A 113 19.463 -6.092 -25.629 1.00 0.00 C ATOM 1677 C ARG A 113 18.228 -6.989 -25.765 1.00 0.00 C ATOM 1678 O ARG A 113 17.161 -6.595 -25.315 1.00 0.00 O ATOM 1679 CB ARG A 113 19.745 -5.312 -26.930 1.00 0.00 C ATOM 1680 CG ARG A 113 20.829 -4.237 -26.739 1.00 0.00 C ATOM 1681 CD ARG A 113 21.125 -3.489 -28.044 1.00 0.00 C ATOM 1682 NE ARG A 113 22.242 -2.534 -27.884 1.00 0.00 N ATOM 1683 CZ ARG A 113 23.322 -2.434 -28.640 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.593 -3.234 -29.634 1.00 0.00 N ATOM 1685 NH2 ARG A 113 24.177 -1.485 -28.406 1.00 0.00 N ATOM 0 H ARG A 113 21.344 -6.945 -25.978 1.00 0.00 H new ATOM 0 HA ARG A 113 19.233 -5.379 -24.837 1.00 0.00 H new ATOM 0 HB2 ARG A 113 20.059 -6.008 -27.708 1.00 0.00 H new ATOM 0 HB3 ARG A 113 18.825 -4.841 -27.276 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.506 -3.527 -25.978 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.743 -4.704 -26.372 1.00 0.00 H new ATOM 0 HD2 ARG A 113 21.369 -4.206 -28.828 1.00 0.00 H new ATOM 0 HD3 ARG A 113 20.232 -2.954 -28.368 1.00 0.00 H new ATOM 0 HE ARG A 113 22.172 -1.880 -27.104 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.952 -3.993 -29.867 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.446 -3.101 -30.178 1.00 0.00 H new ATOM 0 HH21 ARG A 113 24.012 -0.826 -27.645 1.00 0.00 H new ATOM 0 HH22 ARG A 113 25.014 -1.399 -28.983 1.00 0.00 H new ATOM 1699 N THR A 114 18.357 -8.215 -26.273 1.00 0.00 N ATOM 1700 CA THR A 114 17.234 -9.177 -26.389 1.00 0.00 C ATOM 1701 C THR A 114 16.594 -9.459 -25.029 1.00 0.00 C ATOM 1702 O THR A 114 15.376 -9.333 -24.892 1.00 0.00 O ATOM 1703 CB THR A 114 17.665 -10.499 -27.047 1.00 0.00 C ATOM 1704 OG1 THR A 114 18.059 -10.261 -28.384 1.00 0.00 O ATOM 1705 CG2 THR A 114 16.544 -11.544 -27.105 1.00 0.00 C ATOM 0 H THR A 114 19.243 -8.581 -26.620 1.00 0.00 H new ATOM 0 HA THR A 114 16.494 -8.704 -27.035 1.00 0.00 H new ATOM 0 HB THR A 114 18.478 -10.883 -26.431 1.00 0.00 H new ATOM 0 HG1 THR A 114 18.907 -9.769 -28.393 1.00 0.00 H new ATOM 0 HG21 THR A 114 16.917 -12.451 -27.581 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.210 -11.776 -26.094 1.00 0.00 H new ATOM 0 HG23 THR A 114 15.708 -11.149 -27.682 1.00 0.00 H new ATOM 1713 N VAL A 115 17.389 -9.752 -23.989 1.00 0.00 N ATOM 1714 CA VAL A 115 16.829 -9.965 -22.649 1.00 0.00 C ATOM 1715 C VAL A 115 16.283 -8.666 -22.043 1.00 0.00 C ATOM 1716 O VAL A 115 15.275 -8.730 -21.352 1.00 0.00 O ATOM 1717 CB VAL A 115 17.787 -10.724 -21.718 1.00 0.00 C ATOM 1718 CG1 VAL A 115 18.239 -12.052 -22.335 1.00 0.00 C ATOM 1719 CG2 VAL A 115 19.016 -9.925 -21.300 1.00 0.00 C ATOM 0 H VAL A 115 18.403 -9.845 -24.048 1.00 0.00 H new ATOM 0 HA VAL A 115 15.969 -10.625 -22.766 1.00 0.00 H new ATOM 0 HB VAL A 115 17.201 -10.910 -20.818 1.00 0.00 H new ATOM 0 HG11 VAL A 115 18.915 -12.561 -21.648 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.369 -12.682 -22.521 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.755 -11.859 -23.276 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.639 -10.533 -20.644 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.586 -9.645 -22.186 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.702 -9.025 -20.771 1.00 0.00 H new ATOM 1729 N ARG A 116 16.833 -7.481 -22.374 1.00 0.00 N ATOM 1730 CA ARG A 116 16.221 -6.177 -22.005 1.00 0.00 C ATOM 1731 C ARG A 116 14.829 -6.013 -22.627 1.00 0.00 C ATOM 1732 O ARG A 116 13.915 -5.597 -21.934 1.00 0.00 O ATOM 1733 CB ARG A 116 17.195 -4.986 -22.272 1.00 0.00 C ATOM 1734 CG ARG A 116 16.718 -3.943 -23.310 1.00 0.00 C ATOM 1735 CD ARG A 116 17.742 -2.839 -23.604 1.00 0.00 C ATOM 1736 NE ARG A 116 17.497 -2.267 -24.954 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.355 -1.594 -25.705 1.00 0.00 C ATOM 1738 NH1 ARG A 116 19.469 -1.156 -25.215 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.115 -1.354 -26.959 1.00 0.00 N ATOM 0 H ARG A 116 17.704 -7.394 -22.898 1.00 0.00 H new ATOM 0 HA ARG A 116 16.054 -6.167 -20.928 1.00 0.00 H new ATOM 0 HB2 ARG A 116 17.378 -4.473 -21.328 1.00 0.00 H new ATOM 0 HB3 ARG A 116 18.151 -5.391 -22.605 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.476 -4.457 -24.240 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.797 -3.483 -22.951 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.672 -2.056 -22.849 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.752 -3.244 -23.549 1.00 0.00 H new ATOM 0 HE ARG A 116 16.566 -2.409 -25.345 1.00 0.00 H new ATOM 0 HH11 ARG A 116 19.698 -1.327 -24.236 1.00 0.00 H new ATOM 0 HH12 ARG A 116 20.119 -0.639 -25.808 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.250 -1.686 -27.385 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.792 -0.833 -27.517 1.00 0.00 H new ATOM 1753 N GLY A 117 14.651 -6.382 -23.895 1.00 0.00 N ATOM 1754 CA GLY A 117 13.366 -6.288 -24.615 1.00 0.00 C ATOM 1755 C GLY A 117 12.298 -7.220 -24.039 1.00 0.00 C ATOM 1756 O GLY A 117 11.164 -6.803 -23.800 1.00 0.00 O ATOM 0 H GLY A 117 15.405 -6.762 -24.467 1.00 0.00 H new ATOM 0 HA2 GLY A 117 13.006 -5.260 -24.575 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.524 -6.529 -25.666 1.00 0.00 H new ATOM 1760 N GLN A 118 12.688 -8.456 -23.702 1.00 0.00 N ATOM 1761 CA GLN A 118 11.827 -9.393 -22.967 1.00 0.00 C ATOM 1762 C GLN A 118 11.480 -8.883 -21.566 1.00 0.00 C ATOM 1763 O GLN A 118 10.311 -8.867 -21.181 1.00 0.00 O ATOM 1764 CB GLN A 118 12.522 -10.753 -22.845 1.00 0.00 C ATOM 1765 CG GLN A 118 12.549 -11.507 -24.182 1.00 0.00 C ATOM 1766 CD GLN A 118 13.149 -12.898 -24.012 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.091 -13.297 -24.681 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.626 -13.677 -23.088 1.00 0.00 N ATOM 0 H GLN A 118 13.607 -8.835 -23.930 1.00 0.00 H new ATOM 0 HA GLN A 118 10.899 -9.488 -23.532 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.542 -10.608 -22.490 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.007 -11.358 -22.098 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.537 -11.589 -24.578 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.131 -10.942 -24.910 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.840 -13.347 -22.528 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.007 -14.610 -22.932 1.00 0.00 H new ATOM 1777 N VAL A 119 12.491 -8.430 -20.814 1.00 0.00 N ATOM 1778 CA VAL A 119 12.306 -7.862 -19.472 1.00 0.00 C ATOM 1779 C VAL A 119 11.368 -6.657 -19.522 1.00 0.00 C ATOM 1780 O VAL A 119 10.444 -6.616 -18.727 1.00 0.00 O ATOM 1781 CB VAL A 119 13.662 -7.510 -18.817 1.00 0.00 C ATOM 1782 CG1 VAL A 119 13.567 -6.565 -17.612 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.327 -8.790 -18.312 1.00 0.00 C ATOM 0 H VAL A 119 13.464 -8.447 -21.120 1.00 0.00 H new ATOM 0 HA VAL A 119 11.838 -8.619 -18.843 1.00 0.00 H new ATOM 0 HB VAL A 119 14.230 -7.004 -19.598 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.566 -6.375 -17.219 1.00 0.00 H new ATOM 0 HG12 VAL A 119 13.114 -5.623 -17.923 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.953 -7.024 -16.837 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.283 -8.545 -17.850 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.681 -9.270 -17.577 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.492 -9.469 -19.149 1.00 0.00 H new ATOM 1793 N LYS A 120 11.518 -5.730 -20.476 1.00 0.00 N ATOM 1794 CA LYS A 120 10.613 -4.583 -20.681 1.00 0.00 C ATOM 1795 C LYS A 120 9.154 -5.032 -20.791 1.00 0.00 C ATOM 1796 O LYS A 120 8.313 -4.577 -20.023 1.00 0.00 O ATOM 1797 CB LYS A 120 11.059 -3.801 -21.925 1.00 0.00 C ATOM 1798 CG LYS A 120 10.155 -2.589 -22.202 1.00 0.00 C ATOM 1799 CD LYS A 120 10.630 -1.843 -23.456 1.00 0.00 C ATOM 1800 CE LYS A 120 9.783 -0.598 -23.768 1.00 0.00 C ATOM 1801 NZ LYS A 120 8.414 -0.937 -24.258 1.00 0.00 N ATOM 0 H LYS A 120 12.288 -5.753 -21.144 1.00 0.00 H new ATOM 0 HA LYS A 120 10.671 -3.927 -19.813 1.00 0.00 H new ATOM 0 HB2 LYS A 120 12.087 -3.463 -21.791 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.052 -4.463 -22.791 1.00 0.00 H new ATOM 0 HG2 LYS A 120 9.125 -2.919 -22.336 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.166 -1.916 -21.345 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.670 -1.545 -23.323 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.599 -2.521 -24.309 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.701 0.014 -22.870 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.294 0.004 -24.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.871 -0.062 -24.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.485 -1.454 -25.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.931 -1.531 -23.554 1.00 0.00 H new ATOM 1815 N GLU A 121 8.864 -5.956 -21.706 1.00 0.00 N ATOM 1816 CA GLU A 121 7.495 -6.425 -21.969 1.00 0.00 C ATOM 1817 C GLU A 121 6.862 -7.092 -20.736 1.00 0.00 C ATOM 1818 O GLU A 121 5.715 -6.799 -20.389 1.00 0.00 O ATOM 1819 CB GLU A 121 7.521 -7.368 -23.184 1.00 0.00 C ATOM 1820 CG GLU A 121 6.119 -7.791 -23.638 1.00 0.00 C ATOM 1821 CD GLU A 121 6.188 -8.622 -24.934 1.00 0.00 C ATOM 1822 OE1 GLU A 121 6.372 -9.863 -24.857 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.046 -8.044 -26.040 1.00 0.00 O ATOM 0 H GLU A 121 9.570 -6.404 -22.290 1.00 0.00 H new ATOM 0 HA GLU A 121 6.862 -5.566 -22.194 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.032 -6.874 -24.011 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.101 -8.257 -22.936 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.639 -8.374 -22.852 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.503 -6.907 -23.801 1.00 0.00 H new ATOM 1830 N ARG A 122 7.623 -7.939 -20.029 1.00 0.00 N ATOM 1831 CA ARG A 122 7.141 -8.616 -18.817 1.00 0.00 C ATOM 1832 C ARG A 122 7.099 -7.690 -17.589 1.00 0.00 C ATOM 1833 O ARG A 122 6.173 -7.798 -16.789 1.00 0.00 O ATOM 1834 CB ARG A 122 7.950 -9.904 -18.589 1.00 0.00 C ATOM 1835 CG ARG A 122 7.758 -10.950 -19.705 1.00 0.00 C ATOM 1836 CD ARG A 122 8.302 -12.322 -19.290 1.00 0.00 C ATOM 1837 NE ARG A 122 7.318 -13.067 -18.466 1.00 0.00 N ATOM 1838 CZ ARG A 122 6.418 -13.939 -18.897 1.00 0.00 C ATOM 1839 NH1 ARG A 122 6.275 -14.222 -20.163 1.00 0.00 N ATOM 1840 NH2 ARG A 122 5.627 -14.551 -18.070 1.00 0.00 N ATOM 0 H ARG A 122 8.584 -8.173 -20.279 1.00 0.00 H new ATOM 0 HA ARG A 122 6.100 -8.899 -18.970 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.008 -9.652 -18.515 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.659 -10.343 -17.635 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.698 -11.036 -19.946 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.265 -10.615 -20.610 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.548 -12.902 -20.180 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.227 -12.194 -18.728 1.00 0.00 H new ATOM 0 HE ARG A 122 7.336 -12.889 -17.462 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.867 -13.766 -20.857 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.571 -14.899 -20.458 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.692 -14.364 -17.069 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.940 -15.219 -18.421 1.00 0.00 H new ATOM 1854 N VAL A 123 8.001 -6.710 -17.482 1.00 0.00 N ATOM 1855 CA VAL A 123 7.948 -5.628 -16.475 1.00 0.00 C ATOM 1856 C VAL A 123 6.685 -4.788 -16.655 1.00 0.00 C ATOM 1857 O VAL A 123 5.998 -4.553 -15.665 1.00 0.00 O ATOM 1858 CB VAL A 123 9.178 -4.705 -16.519 1.00 0.00 C ATOM 1859 CG1 VAL A 123 8.927 -3.419 -15.732 1.00 0.00 C ATOM 1860 CG2 VAL A 123 10.403 -5.335 -15.853 1.00 0.00 C ATOM 0 H VAL A 123 8.808 -6.639 -18.102 1.00 0.00 H new ATOM 0 HA VAL A 123 7.938 -6.120 -15.502 1.00 0.00 H new ATOM 0 HB VAL A 123 9.355 -4.521 -17.579 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.812 -2.785 -15.779 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.077 -2.889 -16.162 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.712 -3.665 -14.692 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.244 -4.644 -15.911 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.179 -5.548 -14.808 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.659 -6.262 -16.366 1.00 0.00 H new ATOM 1870 N GLU A 124 6.373 -4.336 -17.879 1.00 0.00 N ATOM 1871 CA GLU A 124 5.147 -3.568 -18.159 1.00 0.00 C ATOM 1872 C GLU A 124 3.926 -4.342 -17.653 1.00 0.00 C ATOM 1873 O GLU A 124 3.190 -3.860 -16.798 1.00 0.00 O ATOM 1874 CB GLU A 124 4.986 -3.293 -19.667 1.00 0.00 C ATOM 1875 CG GLU A 124 5.867 -2.160 -20.202 1.00 0.00 C ATOM 1876 CD GLU A 124 5.627 -1.913 -21.705 1.00 0.00 C ATOM 1877 OE1 GLU A 124 4.487 -1.560 -22.096 1.00 0.00 O ATOM 1878 OE2 GLU A 124 6.586 -2.039 -22.507 1.00 0.00 O ATOM 0 H GLU A 124 6.959 -4.491 -18.700 1.00 0.00 H new ATOM 0 HA GLU A 124 5.226 -2.611 -17.642 1.00 0.00 H new ATOM 0 HB2 GLU A 124 5.216 -4.206 -20.217 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.943 -3.052 -19.871 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.662 -1.246 -19.645 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.916 -2.405 -20.036 1.00 0.00 H new ATOM 1885 N ASN A 125 3.788 -5.589 -18.103 1.00 0.00 N ATOM 1886 CA ASN A 125 2.729 -6.519 -17.710 1.00 0.00 C ATOM 1887 C ASN A 125 2.647 -6.726 -16.178 1.00 0.00 C ATOM 1888 O ASN A 125 1.557 -6.917 -15.646 1.00 0.00 O ATOM 1889 CB ASN A 125 2.984 -7.839 -18.468 1.00 0.00 C ATOM 1890 CG ASN A 125 1.829 -8.835 -18.457 1.00 0.00 C ATOM 1891 OD1 ASN A 125 0.701 -8.549 -18.080 1.00 0.00 O ATOM 1892 ND2 ASN A 125 2.073 -10.049 -18.903 1.00 0.00 N ATOM 0 H ASN A 125 4.436 -5.995 -18.778 1.00 0.00 H new ATOM 0 HA ASN A 125 1.756 -6.108 -17.978 1.00 0.00 H new ATOM 0 HB2 ASN A 125 3.227 -7.602 -19.504 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.861 -8.322 -18.037 1.00 0.00 H new ATOM 0 HD21 ASN A 125 1.325 -10.742 -18.932 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.010 -10.297 -19.220 1.00 0.00 H new ATOM 1899 N LEU A 126 3.768 -6.649 -15.448 1.00 0.00 N ATOM 1900 CA LEU A 126 3.811 -6.792 -13.988 1.00 0.00 C ATOM 1901 C LEU A 126 3.442 -5.494 -13.254 1.00 0.00 C ATOM 1902 O LEU A 126 2.470 -5.456 -12.501 1.00 0.00 O ATOM 1903 CB LEU A 126 5.202 -7.348 -13.611 1.00 0.00 C ATOM 1904 CG LEU A 126 5.401 -7.886 -12.183 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.613 -6.795 -11.137 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.242 -8.797 -11.776 1.00 0.00 C ATOM 0 H LEU A 126 4.685 -6.483 -15.863 1.00 0.00 H new ATOM 0 HA LEU A 126 3.048 -7.497 -13.658 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.440 -8.152 -14.307 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.934 -6.557 -13.775 1.00 0.00 H new ATOM 0 HG LEU A 126 6.324 -8.464 -12.212 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.746 -7.252 -10.156 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.501 -6.216 -11.390 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.744 -6.137 -11.116 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.406 -9.164 -10.763 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.308 -8.236 -11.812 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.184 -9.641 -12.463 1.00 0.00 H new ATOM 1918 N ILE A 127 4.196 -4.413 -13.475 1.00 0.00 N ATOM 1919 CA ILE A 127 4.031 -3.125 -12.795 1.00 0.00 C ATOM 1920 C ILE A 127 2.653 -2.499 -13.087 1.00 0.00 C ATOM 1921 O ILE A 127 2.043 -1.892 -12.210 1.00 0.00 O ATOM 1922 CB ILE A 127 5.237 -2.226 -13.183 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.873 -1.506 -11.980 1.00 0.00 C ATOM 1924 CG2 ILE A 127 4.975 -1.248 -14.341 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.919 -0.609 -11.182 1.00 0.00 C ATOM 0 H ILE A 127 4.960 -4.410 -14.151 1.00 0.00 H new ATOM 0 HA ILE A 127 4.037 -3.252 -11.712 1.00 0.00 H new ATOM 0 HB ILE A 127 5.965 -2.942 -13.563 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.291 -2.255 -11.307 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.705 -0.899 -12.338 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.876 -0.666 -14.536 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.704 -1.808 -15.236 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.160 -0.576 -14.072 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.460 -0.147 -10.356 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.519 0.168 -11.834 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.099 -1.210 -10.788 1.00 0.00 H new ATOM 1937 N ALA A 128 2.111 -2.730 -14.287 1.00 0.00 N ATOM 1938 CA ALA A 128 0.851 -2.139 -14.750 1.00 0.00 C ATOM 1939 C ALA A 128 -0.423 -2.839 -14.205 1.00 0.00 C ATOM 1940 O ALA A 128 -1.541 -2.413 -14.505 1.00 0.00 O ATOM 1941 CB ALA A 128 0.891 -2.043 -16.280 1.00 0.00 C ATOM 0 H ALA A 128 2.544 -3.344 -14.977 1.00 0.00 H new ATOM 0 HA ALA A 128 0.769 -1.136 -14.331 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.039 -1.605 -16.642 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.729 -1.416 -16.583 1.00 0.00 H new ATOM 0 HB3 ALA A 128 1.012 -3.040 -16.704 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.269 -3.897 -13.389 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.364 -4.542 -12.622 1.00 0.00 C ATOM 1949 C LYS A 129 -1.557 -3.953 -11.216 1.00 0.00 C ATOM 1950 O LYS A 129 -2.590 -4.187 -10.588 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.111 -6.057 -12.548 1.00 0.00 C ATOM 1952 CG LYS A 129 -1.331 -6.720 -13.910 1.00 0.00 C ATOM 1953 CD LYS A 129 -1.027 -8.220 -13.856 1.00 0.00 C ATOM 1954 CE LYS A 129 -1.054 -8.763 -15.289 1.00 0.00 C ATOM 1955 NZ LYS A 129 -0.915 -10.246 -15.332 1.00 0.00 N ATOM 0 H LYS A 129 0.637 -4.341 -13.237 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.293 -4.342 -13.156 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.091 -6.242 -12.210 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.777 -6.504 -11.810 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.362 -6.567 -14.229 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.693 -6.244 -14.655 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.052 -8.395 -13.401 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.763 -8.736 -13.240 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.989 -8.473 -15.768 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.248 -8.307 -15.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.939 -10.568 -16.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -0.011 -10.523 -14.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.699 -10.684 -14.806 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.567 -3.199 -10.729 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.507 -2.604 -9.377 1.00 0.00 C ATOM 1971 C ILE A 130 -0.382 -1.062 -9.399 1.00 0.00 C ATOM 1972 O ILE A 130 -0.197 -0.435 -8.354 1.00 0.00 O ATOM 1973 CB ILE A 130 0.583 -3.300 -8.522 1.00 0.00 C ATOM 1974 CG1 ILE A 130 1.949 -3.352 -9.243 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.100 -4.709 -8.129 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.053 -4.074 -8.461 1.00 0.00 C ATOM 0 H ILE A 130 0.256 -2.972 -11.287 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.465 -2.791 -8.891 1.00 0.00 H new ATOM 0 HB ILE A 130 0.740 -2.709 -7.620 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.819 -3.847 -10.205 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.275 -2.333 -9.451 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.864 -5.201 -7.528 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.821 -4.630 -7.551 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -0.086 -5.294 -9.030 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.976 -4.063 -9.041 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.216 -3.567 -7.510 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.753 -5.105 -8.276 1.00 0.00 H new ATOM 1988 N SER A 131 -0.518 -0.455 -10.583 1.00 0.00 N ATOM 1989 CA SER A 131 -0.603 0.994 -10.817 1.00 0.00 C ATOM 1990 C SER A 131 -1.965 1.605 -10.443 1.00 0.00 C ATOM 1991 O SER A 131 -1.977 2.764 -9.964 1.00 0.00 O ATOM 1992 CB SER A 131 -0.228 1.300 -12.272 1.00 0.00 C ATOM 1993 OG SER A 131 -0.957 0.471 -13.166 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.015 0.947 -10.634 1.00 0.00 O ATOM 0 H SER A 131 -0.575 -0.988 -11.451 1.00 0.00 H new ATOM 0 HA SER A 131 0.112 1.471 -10.146 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.432 2.348 -12.492 1.00 0.00 H new ATOM 0 HB3 SER A 131 0.841 1.146 -12.417 1.00 0.00 H new ATOM 0 HG SER A 131 -0.704 0.683 -14.089 1.00 0.00 H new TER 2000 SER A 131