USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 897 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 65 ASN : amide:sc= -1.15 K(o=-4,f=-4.6!) USER MOD Set 1.2: A 71 THR OG1 : rot 160:sc= 0 USER MOD Set 1.3: A 95 HIS : no HD1:sc= -2.9! C(o=-4!,f=-10!) USER MOD Set 2.1: A 45 THR OG1 : rot -84:sc= 0.791 USER MOD Set 2.2: A 84 GLN : amide:sc= -0.614 K(o=0.18,f=-0.56) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.0061) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0.0305 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 110:sc= -0.864 USER MOD Single : A 48 SER OG : rot 16:sc= 0.407 USER MOD Single : A 52 THR OG1 : rot 110:sc= -1.47 USER MOD Single : A 53 GLN : amide:sc= -2.09 K(o=-2.1,f=-8.1!) USER MOD Single : A 58 HIS : no HE2:sc= 0.0117 X(o=0.012,f=-0.33) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS : no HD1:sc= -0.0174 X(o=-0.017,f=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 33:sc= 0.179 USER MOD Single : A 73 CYS SG : rot -151:sc= 0.17 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.482 X(o=-0.48,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= -0.0267 USER MOD Single : A 87 TYR OH : rot -168:sc= 0.655 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 160:sc= 0.328 (180deg=-0.184) USER MOD Single : A 100 THR OG1 : rot 45:sc= 0.171 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.661 USER MOD Single : A 108 ASN : amide:sc= -0.117 X(o=-0.12,f=-0.37) USER MOD Single : A 109 SER OG : rot -8:sc= 0.492 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 CYS SG : rot 2:sc= 0.534 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 31:sc= 0.803 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.754 5.304 25.680 1.00 0.00 N ATOM 2 CA GLY A 1 7.720 5.956 24.899 1.00 0.00 C ATOM 3 C GLY A 1 7.273 7.269 25.510 1.00 0.00 C ATOM 4 O GLY A 1 6.464 7.287 26.438 1.00 0.00 O ATOM 0 H1 GLY A 1 9.025 4.411 25.221 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.585 5.926 25.744 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.395 5.106 26.636 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.090 6.136 23.890 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.862 5.290 24.810 1.00 0.00 H new ATOM 8 N SER A 2 7.803 8.373 24.991 1.00 0.00 N ATOM 9 CA SER A 2 7.458 9.696 25.496 1.00 0.00 C ATOM 10 C SER A 2 7.922 10.783 24.531 1.00 0.00 C ATOM 11 O SER A 2 9.067 10.780 24.079 1.00 0.00 O ATOM 12 CB SER A 2 8.085 9.920 26.873 1.00 0.00 C ATOM 13 OG SER A 2 9.490 9.742 26.828 1.00 0.00 O ATOM 0 H SER A 2 8.473 8.377 24.221 1.00 0.00 H new ATOM 0 HA SER A 2 6.373 9.752 25.586 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.854 10.926 27.222 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.650 9.225 27.592 1.00 0.00 H new ATOM 0 HG SER A 2 9.868 9.892 27.720 1.00 0.00 H new ATOM 19 N SER A 3 7.023 11.712 24.220 1.00 0.00 N ATOM 20 CA SER A 3 7.338 12.804 23.305 1.00 0.00 C ATOM 21 C SER A 3 8.491 13.646 23.841 1.00 0.00 C ATOM 22 O SER A 3 9.504 13.833 23.168 1.00 0.00 O ATOM 23 CB SER A 3 6.106 13.685 23.087 1.00 0.00 C ATOM 24 OG SER A 3 5.022 12.928 22.576 1.00 0.00 O ATOM 0 H SER A 3 6.072 11.731 24.588 1.00 0.00 H new ATOM 0 HA SER A 3 7.640 12.371 22.351 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.817 14.150 24.029 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.349 14.491 22.395 1.00 0.00 H new ATOM 0 HG SER A 3 4.246 13.513 22.447 1.00 0.00 H new ATOM 30 N GLY A 4 8.329 14.154 25.060 1.00 0.00 N ATOM 31 CA GLY A 4 9.363 14.971 25.667 1.00 0.00 C ATOM 32 C GLY A 4 9.018 16.446 25.655 1.00 0.00 C ATOM 33 O GLY A 4 9.810 17.272 25.201 1.00 0.00 O ATOM 0 H GLY A 4 7.500 14.014 25.637 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.521 14.646 26.695 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.302 14.816 25.136 1.00 0.00 H new ATOM 37 N SER A 5 7.832 16.780 26.153 1.00 0.00 N ATOM 38 CA SER A 5 7.381 18.166 26.192 1.00 0.00 C ATOM 39 C SER A 5 7.110 18.608 27.627 1.00 0.00 C ATOM 40 O SER A 5 7.215 17.816 28.563 1.00 0.00 O ATOM 41 CB SER A 5 6.118 18.338 25.346 1.00 0.00 C ATOM 42 OG SER A 5 4.969 17.898 26.049 1.00 0.00 O ATOM 0 H SER A 5 7.166 16.109 26.535 1.00 0.00 H new ATOM 0 HA SER A 5 8.173 18.792 25.780 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.001 19.386 25.071 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.218 17.775 24.418 1.00 0.00 H new ATOM 0 HG SER A 5 4.175 18.020 25.487 1.00 0.00 H new ATOM 48 N SER A 6 6.760 19.880 27.791 1.00 0.00 N ATOM 49 CA SER A 6 6.477 20.431 29.111 1.00 0.00 C ATOM 50 C SER A 6 5.048 20.109 29.539 1.00 0.00 C ATOM 51 O SER A 6 4.339 20.964 30.068 1.00 0.00 O ATOM 52 CB SER A 6 6.692 21.945 29.112 1.00 0.00 C ATOM 53 OG SER A 6 8.061 22.266 29.294 1.00 0.00 O ATOM 0 H SER A 6 6.666 20.548 27.026 1.00 0.00 H new ATOM 0 HA SER A 6 7.164 19.973 29.823 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.339 22.366 28.171 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.100 22.399 29.907 1.00 0.00 H new ATOM 0 HG SER A 6 8.172 23.240 29.289 1.00 0.00 H new ATOM 59 N GLY A 7 4.633 18.867 29.306 1.00 0.00 N ATOM 60 CA GLY A 7 3.292 18.453 29.673 1.00 0.00 C ATOM 61 C GLY A 7 2.229 19.402 29.156 1.00 0.00 C ATOM 62 O GLY A 7 1.688 20.210 29.911 1.00 0.00 O ATOM 0 H GLY A 7 5.202 18.141 28.870 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.104 17.454 29.281 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.220 18.388 30.759 1.00 0.00 H new ATOM 66 N HIS A 8 1.931 19.306 27.864 1.00 0.00 N ATOM 67 CA HIS A 8 0.927 20.165 27.246 1.00 0.00 C ATOM 68 C HIS A 8 -0.160 19.332 26.573 1.00 0.00 C ATOM 69 O HIS A 8 0.012 18.134 26.346 1.00 0.00 O ATOM 70 CB HIS A 8 1.580 21.094 26.222 1.00 0.00 C ATOM 71 CG HIS A 8 2.239 22.291 26.835 1.00 0.00 C ATOM 72 ND1 HIS A 8 3.599 22.514 26.777 1.00 0.00 N ATOM 73 CD2 HIS A 8 1.717 23.336 27.519 1.00 0.00 C ATOM 74 CE1 HIS A 8 3.885 23.642 27.401 1.00 0.00 C ATOM 75 NE2 HIS A 8 2.760 24.161 27.860 1.00 0.00 N ATOM 0 H HIS A 8 2.370 18.643 27.225 1.00 0.00 H new ATOM 0 HA HIS A 8 0.467 20.767 28.030 1.00 0.00 H new ATOM 0 HB2 HIS A 8 2.322 20.532 25.654 1.00 0.00 H new ATOM 0 HB3 HIS A 8 0.823 21.429 25.513 1.00 0.00 H new ATOM 0 HD2 HIS A 8 0.674 23.492 27.753 1.00 0.00 H new ATOM 0 HE1 HIS A 8 4.871 24.068 27.517 1.00 0.00 H new ATOM 0 HE2 HIS A 8 2.679 25.033 28.383 1.00 0.00 H new ATOM 83 N PHE A 9 -1.280 19.973 26.258 1.00 0.00 N ATOM 84 CA PHE A 9 -2.396 19.291 25.613 1.00 0.00 C ATOM 85 C PHE A 9 -2.945 20.121 24.455 1.00 0.00 C ATOM 86 O PHE A 9 -3.135 21.332 24.562 1.00 0.00 O ATOM 87 CB PHE A 9 -3.507 19.014 26.628 1.00 0.00 C ATOM 88 CG PHE A 9 -3.237 17.824 27.503 1.00 0.00 C ATOM 89 CD1 PHE A 9 -3.372 16.538 27.006 1.00 0.00 C ATOM 90 CD2 PHE A 9 -2.848 17.991 28.822 1.00 0.00 C ATOM 91 CE1 PHE A 9 -3.124 15.440 27.808 1.00 0.00 C ATOM 92 CE2 PHE A 9 -2.598 16.897 29.629 1.00 0.00 C ATOM 93 CZ PHE A 9 -2.737 15.620 29.121 1.00 0.00 C ATOM 0 H PHE A 9 -1.439 20.964 26.439 1.00 0.00 H new ATOM 0 HA PHE A 9 -2.030 18.344 25.217 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -3.641 19.894 27.257 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.445 18.857 26.095 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -3.675 16.392 25.980 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -2.739 18.987 29.224 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -3.233 14.443 27.408 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -2.294 17.040 30.655 1.00 0.00 H new ATOM 0 HZ PHE A 9 -2.543 14.764 29.750 1.00 0.00 H new ATOM 103 N PRO A 10 -3.205 19.453 23.321 1.00 0.00 N ATOM 104 CA PRO A 10 -3.735 20.107 22.121 1.00 0.00 C ATOM 105 C PRO A 10 -5.179 20.563 22.299 1.00 0.00 C ATOM 106 O PRO A 10 -6.079 19.745 22.486 1.00 0.00 O ATOM 107 CB PRO A 10 -3.647 19.014 21.053 1.00 0.00 C ATOM 108 CG PRO A 10 -3.692 17.735 21.815 1.00 0.00 C ATOM 109 CD PRO A 10 -3.002 18.008 23.123 1.00 0.00 C ATOM 0 HA PRO A 10 -3.180 21.012 21.871 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -4.474 19.083 20.347 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.727 19.098 20.475 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.721 17.413 21.976 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.190 16.937 21.268 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -3.437 17.426 23.936 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.943 17.753 23.080 1.00 0.00 H new ATOM 117 N ALA A 11 -5.393 21.873 22.240 1.00 0.00 N ATOM 118 CA ALA A 11 -6.728 22.437 22.392 1.00 0.00 C ATOM 119 C ALA A 11 -7.429 22.559 21.044 1.00 0.00 C ATOM 120 O ALA A 11 -7.318 23.580 20.365 1.00 0.00 O ATOM 121 CB ALA A 11 -6.653 23.795 23.075 1.00 0.00 C ATOM 0 H ALA A 11 -4.658 22.564 22.088 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.312 21.761 23.016 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.657 24.204 23.182 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -6.200 23.682 24.060 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -6.047 24.472 22.473 1.00 0.00 H new ATOM 127 N ARG A 12 -8.152 21.511 20.661 1.00 0.00 N ATOM 128 CA ARG A 12 -8.870 21.501 19.392 1.00 0.00 C ATOM 129 C ARG A 12 -8.076 22.230 18.312 1.00 0.00 C ATOM 130 O ARG A 12 -8.627 23.027 17.553 1.00 0.00 O ATOM 131 CB ARG A 12 -10.245 22.150 19.555 1.00 0.00 C ATOM 132 CG ARG A 12 -11.281 21.234 20.186 1.00 0.00 C ATOM 133 CD ARG A 12 -11.901 20.302 19.158 1.00 0.00 C ATOM 134 NE ARG A 12 -12.682 21.030 18.160 1.00 0.00 N ATOM 135 CZ ARG A 12 -12.215 21.362 16.962 1.00 0.00 C ATOM 136 NH1 ARG A 12 -10.979 21.034 16.614 1.00 0.00 N ATOM 137 NH2 ARG A 12 -12.986 22.025 16.109 1.00 0.00 N ATOM 0 H ARG A 12 -8.256 20.658 21.211 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.000 20.463 19.085 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -10.144 23.046 20.167 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -10.604 22.471 18.577 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.815 20.646 20.977 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.062 21.834 20.653 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -11.114 19.736 18.660 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -12.542 19.579 19.663 1.00 0.00 H new ATOM 0 HE ARG A 12 -13.637 21.298 18.396 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -10.383 20.525 17.267 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -10.623 21.291 15.693 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -13.938 22.280 16.374 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -12.627 22.280 15.189 1.00 0.00 H new ATOM 151 N VAL A 13 -6.777 21.951 18.249 1.00 0.00 N ATOM 152 CA VAL A 13 -5.907 22.579 17.262 1.00 0.00 C ATOM 153 C VAL A 13 -6.170 22.026 15.866 1.00 0.00 C ATOM 154 O VAL A 13 -5.892 20.860 15.586 1.00 0.00 O ATOM 155 CB VAL A 13 -4.422 22.374 17.612 1.00 0.00 C ATOM 156 CG1 VAL A 13 -4.090 23.032 18.943 1.00 0.00 C ATOM 157 CG2 VAL A 13 -4.082 20.892 17.642 1.00 0.00 C ATOM 0 H VAL A 13 -6.305 21.294 18.870 1.00 0.00 H new ATOM 0 HA VAL A 13 -6.132 23.645 17.275 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.816 22.848 16.839 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.036 22.876 19.173 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.294 24.101 18.881 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.702 22.591 19.730 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.028 20.765 17.891 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.695 20.393 18.393 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.279 20.454 16.664 1.00 0.00 H new ATOM 167 N LYS A 14 -6.708 22.870 14.993 1.00 0.00 N ATOM 168 CA LYS A 14 -7.008 22.468 13.624 1.00 0.00 C ATOM 169 C LYS A 14 -6.053 23.135 12.639 1.00 0.00 C ATOM 170 O LYS A 14 -5.965 24.361 12.579 1.00 0.00 O ATOM 171 CB LYS A 14 -8.454 22.826 13.270 1.00 0.00 C ATOM 172 CG LYS A 14 -8.960 22.140 12.014 1.00 0.00 C ATOM 173 CD LYS A 14 -9.251 20.669 12.260 1.00 0.00 C ATOM 174 CE LYS A 14 -10.065 20.064 11.126 1.00 0.00 C ATOM 175 NZ LYS A 14 -10.854 18.884 11.578 1.00 0.00 N ATOM 0 H LYS A 14 -6.946 23.838 15.209 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.880 21.388 13.553 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.101 22.558 14.106 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -8.531 23.906 13.140 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.865 22.638 11.666 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.218 22.237 11.221 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -8.313 20.124 12.367 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.793 20.556 13.199 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.739 20.818 10.720 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.397 19.766 10.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -11.395 18.500 10.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.209 18.154 11.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.510 19.173 12.332 1.00 0.00 H new ATOM 189 N VAL A 15 -5.341 22.319 11.868 1.00 0.00 N ATOM 190 CA VAL A 15 -4.394 22.830 10.884 1.00 0.00 C ATOM 191 C VAL A 15 -4.645 22.218 9.511 1.00 0.00 C ATOM 192 O VAL A 15 -4.815 21.006 9.383 1.00 0.00 O ATOM 193 CB VAL A 15 -2.940 22.545 11.304 1.00 0.00 C ATOM 194 CG1 VAL A 15 -2.743 21.061 11.574 1.00 0.00 C ATOM 195 CG2 VAL A 15 -1.972 23.034 10.236 1.00 0.00 C ATOM 0 H VAL A 15 -5.402 21.302 11.906 1.00 0.00 H new ATOM 0 HA VAL A 15 -4.544 23.908 10.830 1.00 0.00 H new ATOM 0 HB VAL A 15 -2.733 23.088 12.226 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.710 20.879 11.869 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -3.411 20.745 12.376 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.967 20.494 10.671 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.949 22.825 10.549 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -2.177 22.520 9.297 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -2.096 24.108 10.097 1.00 0.00 H new ATOM 205 N GLU A 16 -4.665 23.065 8.486 1.00 0.00 N ATOM 206 CA GLU A 16 -4.895 22.606 7.121 1.00 0.00 C ATOM 207 C GLU A 16 -3.583 22.211 6.451 1.00 0.00 C ATOM 208 O GLU A 16 -2.519 22.760 6.739 1.00 0.00 O ATOM 209 CB GLU A 16 -5.590 23.697 6.303 1.00 0.00 C ATOM 210 CG GLU A 16 -4.719 24.916 6.052 1.00 0.00 C ATOM 211 CD GLU A 16 -5.527 26.142 5.672 1.00 0.00 C ATOM 212 OE1 GLU A 16 -6.043 26.818 6.587 1.00 0.00 O ATOM 213 OE2 GLU A 16 -5.644 26.425 4.462 1.00 0.00 O ATOM 0 H GLU A 16 -4.525 24.071 8.575 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.539 21.728 7.164 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.901 23.279 5.345 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.496 24.009 6.824 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.137 25.132 6.948 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -4.009 24.693 5.256 1.00 0.00 H new ATOM 220 N PRO A 17 -3.657 21.233 5.536 1.00 0.00 N ATOM 221 CA PRO A 17 -2.485 20.742 4.806 1.00 0.00 C ATOM 222 C PRO A 17 -1.949 21.766 3.811 1.00 0.00 C ATOM 223 O PRO A 17 -2.699 22.308 3.000 1.00 0.00 O ATOM 224 CB PRO A 17 -3.017 19.509 4.070 1.00 0.00 C ATOM 225 CG PRO A 17 -4.478 19.757 3.922 1.00 0.00 C ATOM 226 CD PRO A 17 -4.891 20.533 5.142 1.00 0.00 C ATOM 0 HA PRO A 17 -1.649 20.531 5.473 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.536 19.389 3.099 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -2.826 18.597 4.636 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.688 20.319 3.012 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.028 18.819 3.851 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.696 21.233 4.919 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.250 19.876 5.934 1.00 0.00 H new ATOM 234 N ALA A 18 -0.648 22.027 3.880 1.00 0.00 N ATOM 235 CA ALA A 18 -0.012 22.985 2.984 1.00 0.00 C ATOM 236 C ALA A 18 0.875 22.278 1.965 1.00 0.00 C ATOM 237 O ALA A 18 1.734 22.898 1.339 1.00 0.00 O ATOM 238 CB ALA A 18 0.799 23.996 3.782 1.00 0.00 C ATOM 0 H ALA A 18 -0.014 21.588 4.547 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.796 23.513 2.440 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.268 24.705 3.100 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.141 24.532 4.466 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.569 23.476 4.352 1.00 0.00 H new ATOM 244 N VAL A 19 0.661 20.976 1.804 1.00 0.00 N ATOM 245 CA VAL A 19 1.442 20.184 0.860 1.00 0.00 C ATOM 246 C VAL A 19 0.535 19.438 -0.112 1.00 0.00 C ATOM 247 O VAL A 19 -0.581 19.053 0.235 1.00 0.00 O ATOM 248 CB VAL A 19 2.341 19.169 1.589 1.00 0.00 C ATOM 249 CG1 VAL A 19 1.504 18.057 2.202 1.00 0.00 C ATOM 250 CG2 VAL A 19 3.382 18.600 0.636 1.00 0.00 C ATOM 0 H VAL A 19 -0.046 20.447 2.315 1.00 0.00 H new ATOM 0 HA VAL A 19 2.070 20.881 0.305 1.00 0.00 H new ATOM 0 HB VAL A 19 2.862 19.685 2.395 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.157 17.349 2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.801 18.483 2.917 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.954 17.540 1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 19 4.009 17.884 1.167 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.881 18.099 -0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 19 4.002 19.409 0.249 1.00 0.00 H new ATOM 260 N ASP A 20 1.023 19.237 -1.332 1.00 0.00 N ATOM 261 CA ASP A 20 0.258 18.535 -2.355 1.00 0.00 C ATOM 262 C ASP A 20 0.782 17.115 -2.547 1.00 0.00 C ATOM 263 O ASP A 20 1.876 16.911 -3.076 1.00 0.00 O ATOM 264 CB ASP A 20 0.317 19.297 -3.680 1.00 0.00 C ATOM 265 CG ASP A 20 0.482 20.791 -3.481 1.00 0.00 C ATOM 266 OD1 ASP A 20 -0.545 21.489 -3.348 1.00 0.00 O ATOM 267 OD2 ASP A 20 1.638 21.263 -3.459 1.00 0.00 O ATOM 0 H ASP A 20 1.945 19.551 -1.636 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.779 18.479 -2.023 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.147 18.919 -4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.595 19.107 -4.246 1.00 0.00 H new ATOM 272 N THR A 21 -0.005 16.135 -2.114 1.00 0.00 N ATOM 273 CA THR A 21 0.380 14.735 -2.236 1.00 0.00 C ATOM 274 C THR A 21 -0.661 13.945 -3.021 1.00 0.00 C ATOM 275 O THR A 21 -0.963 12.799 -2.691 1.00 0.00 O ATOM 276 CB THR A 21 0.568 14.082 -0.854 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.685 14.028 -0.163 1.00 0.00 O ATOM 278 CG2 THR A 21 1.579 14.856 -0.022 1.00 0.00 C ATOM 0 H THR A 21 -0.913 16.286 -1.675 1.00 0.00 H new ATOM 0 HA THR A 21 1.329 14.714 -2.772 1.00 0.00 H new ATOM 0 HB THR A 21 0.944 13.070 -1.003 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.557 13.610 0.714 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.695 14.376 0.950 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.540 14.870 -0.537 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.228 15.878 0.118 1.00 0.00 H new ATOM 286 N SER A 22 -1.205 14.565 -4.063 1.00 0.00 N ATOM 287 CA SER A 22 -2.215 13.920 -4.895 1.00 0.00 C ATOM 288 C SER A 22 -1.591 13.358 -6.169 1.00 0.00 C ATOM 289 O SER A 22 -2.236 12.623 -6.916 1.00 0.00 O ATOM 290 CB SER A 22 -3.323 14.913 -5.251 1.00 0.00 C ATOM 291 OG SER A 22 -2.794 16.210 -5.470 1.00 0.00 O ATOM 0 H SER A 22 -0.964 15.513 -4.352 1.00 0.00 H new ATOM 0 HA SER A 22 -2.645 13.095 -4.327 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.846 14.574 -6.145 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.057 14.947 -4.446 1.00 0.00 H new ATOM 0 HG SER A 22 -3.522 16.826 -5.698 1.00 0.00 H new ATOM 297 N ARG A 23 -0.333 13.710 -6.409 1.00 0.00 N ATOM 298 CA ARG A 23 0.379 13.242 -7.593 1.00 0.00 C ATOM 299 C ARG A 23 1.405 12.175 -7.224 1.00 0.00 C ATOM 300 O ARG A 23 2.313 11.879 -8.001 1.00 0.00 O ATOM 301 CB ARG A 23 1.073 14.413 -8.292 1.00 0.00 C ATOM 302 CG ARG A 23 0.127 15.535 -8.686 1.00 0.00 C ATOM 303 CD ARG A 23 0.888 16.764 -9.160 1.00 0.00 C ATOM 304 NE ARG A 23 1.473 17.508 -8.048 1.00 0.00 N ATOM 305 CZ ARG A 23 1.905 18.760 -8.148 1.00 0.00 C ATOM 306 NH1 ARG A 23 1.817 19.404 -9.303 1.00 0.00 N ATOM 307 NH2 ARG A 23 2.426 19.370 -7.091 1.00 0.00 N ATOM 0 H ARG A 23 0.215 14.318 -5.800 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.349 12.801 -8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.843 14.813 -7.633 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.578 14.044 -9.185 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.539 15.190 -9.477 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.500 15.800 -7.835 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.677 16.459 -9.847 1.00 0.00 H new ATOM 0 HD3 ARG A 23 0.214 17.415 -9.717 1.00 0.00 H new ATOM 0 HE ARG A 23 1.554 17.041 -7.145 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.417 18.938 -10.117 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.149 20.365 -9.377 1.00 0.00 H new ATOM 0 HH21 ARG A 23 2.495 18.877 -6.201 1.00 0.00 H new ATOM 0 HH22 ARG A 23 2.757 20.331 -7.169 1.00 0.00 H new ATOM 321 N ILE A 24 1.253 11.601 -6.035 1.00 0.00 N ATOM 322 CA ILE A 24 2.165 10.567 -5.565 1.00 0.00 C ATOM 323 C ILE A 24 1.772 9.197 -6.109 1.00 0.00 C ATOM 324 O ILE A 24 0.651 8.733 -5.900 1.00 0.00 O ATOM 325 CB ILE A 24 2.201 10.505 -4.026 1.00 0.00 C ATOM 326 CG1 ILE A 24 3.029 11.663 -3.466 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.765 9.170 -3.563 1.00 0.00 C ATOM 328 CD1 ILE A 24 3.142 11.651 -1.958 1.00 0.00 C ATOM 0 H ILE A 24 0.507 11.835 -5.380 1.00 0.00 H new ATOM 0 HA ILE A 24 3.157 10.830 -5.933 1.00 0.00 H new ATOM 0 HB ILE A 24 1.182 10.597 -3.649 1.00 0.00 H new ATOM 0 HG12 ILE A 24 4.029 11.626 -3.898 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.581 12.605 -3.781 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.784 9.141 -2.474 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.137 8.361 -3.936 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.778 9.050 -3.947 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.742 12.500 -1.631 1.00 0.00 H new ATOM 0 HD12 ILE A 24 2.147 11.719 -1.518 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.618 10.725 -1.636 1.00 0.00 H new ATOM 340 N LYS A 25 2.702 8.554 -6.806 1.00 0.00 N ATOM 341 CA LYS A 25 2.455 7.236 -7.378 1.00 0.00 C ATOM 342 C LYS A 25 3.234 6.162 -6.626 1.00 0.00 C ATOM 343 O LYS A 25 4.320 6.418 -6.105 1.00 0.00 O ATOM 344 CB LYS A 25 2.842 7.219 -8.859 1.00 0.00 C ATOM 345 CG LYS A 25 1.711 7.627 -9.787 1.00 0.00 C ATOM 346 CD LYS A 25 2.165 7.659 -11.237 1.00 0.00 C ATOM 347 CE LYS A 25 3.088 8.837 -11.507 1.00 0.00 C ATOM 348 NZ LYS A 25 3.550 8.867 -12.923 1.00 0.00 N ATOM 0 H LYS A 25 3.635 8.925 -6.989 1.00 0.00 H new ATOM 0 HA LYS A 25 1.391 7.021 -7.284 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.687 7.890 -9.013 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.177 6.217 -9.127 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.881 6.929 -9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.339 8.610 -9.499 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.680 6.729 -11.478 1.00 0.00 H new ATOM 0 HD3 LYS A 25 1.295 7.720 -11.890 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.568 9.766 -11.275 1.00 0.00 H new ATOM 0 HE3 LYS A 25 3.952 8.781 -10.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 4.177 9.684 -13.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 4.068 7.991 -13.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.728 8.946 -13.555 1.00 0.00 H new ATOM 362 N VAL A 26 2.673 4.958 -6.574 1.00 0.00 N ATOM 363 CA VAL A 26 3.317 3.844 -5.888 1.00 0.00 C ATOM 364 C VAL A 26 3.209 2.560 -6.703 1.00 0.00 C ATOM 365 O VAL A 26 2.118 2.158 -7.107 1.00 0.00 O ATOM 366 CB VAL A 26 2.698 3.609 -4.497 1.00 0.00 C ATOM 367 CG1 VAL A 26 3.134 4.697 -3.528 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.182 3.544 -4.592 1.00 0.00 C ATOM 0 H VAL A 26 1.774 4.729 -6.999 1.00 0.00 H new ATOM 0 HA VAL A 26 4.368 4.109 -5.771 1.00 0.00 H new ATOM 0 HB VAL A 26 3.056 2.652 -4.116 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.687 4.514 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.220 4.690 -3.437 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.808 5.668 -3.900 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.762 3.378 -3.600 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.802 4.483 -4.994 1.00 0.00 H new ATOM 0 HG23 VAL A 26 0.893 2.725 -5.250 1.00 0.00 H new ATOM 378 N PHE A 27 4.349 1.920 -6.942 1.00 0.00 N ATOM 379 CA PHE A 27 4.383 0.681 -7.710 1.00 0.00 C ATOM 380 C PHE A 27 5.225 -0.376 -7.000 1.00 0.00 C ATOM 381 O PHE A 27 6.107 -0.052 -6.206 1.00 0.00 O ATOM 382 CB PHE A 27 4.944 0.939 -9.110 1.00 0.00 C ATOM 383 CG PHE A 27 6.248 1.684 -9.105 1.00 0.00 C ATOM 384 CD1 PHE A 27 7.443 1.014 -8.894 1.00 0.00 C ATOM 385 CD2 PHE A 27 6.280 3.053 -9.313 1.00 0.00 C ATOM 386 CE1 PHE A 27 8.644 1.698 -8.889 1.00 0.00 C ATOM 387 CE2 PHE A 27 7.478 3.742 -9.309 1.00 0.00 C ATOM 388 CZ PHE A 27 8.662 3.063 -9.098 1.00 0.00 C ATOM 0 H PHE A 27 5.261 2.239 -6.615 1.00 0.00 H new ATOM 0 HA PHE A 27 3.362 0.309 -7.798 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.082 -0.015 -9.619 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.213 1.506 -9.687 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.436 -0.054 -8.732 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.357 3.589 -9.480 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.568 1.165 -8.722 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.488 4.810 -9.471 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.600 3.598 -9.096 1.00 0.00 H new ATOM 398 N GLY A 28 4.944 -1.642 -7.292 1.00 0.00 N ATOM 399 CA GLY A 28 5.683 -2.728 -6.674 1.00 0.00 C ATOM 400 C GLY A 28 4.776 -3.831 -6.167 1.00 0.00 C ATOM 401 O GLY A 28 3.562 -3.661 -6.050 1.00 0.00 O ATOM 0 H GLY A 28 4.218 -1.935 -7.945 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.386 -3.143 -7.397 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.273 -2.337 -5.845 1.00 0.00 H new ATOM 405 N PRO A 29 5.368 -4.994 -5.856 1.00 0.00 N ATOM 406 CA PRO A 29 4.623 -6.153 -5.355 1.00 0.00 C ATOM 407 C PRO A 29 4.093 -5.934 -3.942 1.00 0.00 C ATOM 408 O PRO A 29 3.041 -6.457 -3.576 1.00 0.00 O ATOM 409 CB PRO A 29 5.664 -7.275 -5.367 1.00 0.00 C ATOM 410 CG PRO A 29 6.975 -6.578 -5.253 1.00 0.00 C ATOM 411 CD PRO A 29 6.811 -5.267 -5.971 1.00 0.00 C ATOM 0 HA PRO A 29 3.741 -6.364 -5.960 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.510 -7.966 -4.539 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.605 -7.860 -6.285 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.243 -6.420 -4.208 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.772 -7.171 -5.701 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.407 -4.479 -5.510 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.125 -5.337 -7.012 1.00 0.00 H new ATOM 419 N GLY A 30 4.828 -5.156 -3.153 1.00 0.00 N ATOM 420 CA GLY A 30 4.414 -4.882 -1.789 1.00 0.00 C ATOM 421 C GLY A 30 3.106 -4.118 -1.722 1.00 0.00 C ATOM 422 O GLY A 30 2.389 -4.190 -0.724 1.00 0.00 O ATOM 0 H GLY A 30 5.702 -4.711 -3.434 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.310 -5.823 -1.248 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.192 -4.309 -1.285 1.00 0.00 H new ATOM 426 N ILE A 31 2.796 -3.385 -2.786 1.00 0.00 N ATOM 427 CA ILE A 31 1.566 -2.605 -2.843 1.00 0.00 C ATOM 428 C ILE A 31 0.575 -3.213 -3.830 1.00 0.00 C ATOM 429 O ILE A 31 -0.624 -2.942 -3.766 1.00 0.00 O ATOM 430 CB ILE A 31 1.844 -1.145 -3.245 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.613 -0.276 -2.977 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.245 -1.066 -4.711 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.365 -0.016 -1.508 1.00 0.00 C ATOM 0 H ILE A 31 3.379 -3.315 -3.620 1.00 0.00 H new ATOM 0 HA ILE A 31 1.135 -2.622 -1.842 1.00 0.00 H new ATOM 0 HB ILE A 31 2.670 -0.769 -2.641 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.733 0.678 -3.491 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.264 -0.761 -3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.438 -0.028 -4.980 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.146 -1.657 -4.874 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.438 -1.457 -5.331 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.523 0.606 -1.393 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.213 -0.964 -0.991 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.226 0.497 -1.079 1.00 0.00 H new ATOM 445 N GLU A 32 1.085 -4.037 -4.740 1.00 0.00 N ATOM 446 CA GLU A 32 0.243 -4.684 -5.740 1.00 0.00 C ATOM 447 C GLU A 32 -0.272 -6.027 -5.231 1.00 0.00 C ATOM 448 O GLU A 32 -1.457 -6.336 -5.351 1.00 0.00 O ATOM 449 CB GLU A 32 1.022 -4.884 -7.042 1.00 0.00 C ATOM 450 CG GLU A 32 1.371 -3.585 -7.749 1.00 0.00 C ATOM 451 CD GLU A 32 0.293 -3.141 -8.718 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.785 -2.717 -8.254 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.529 -3.218 -9.942 1.00 0.00 O ATOM 0 H GLU A 32 2.075 -4.272 -4.806 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.612 -4.036 -5.932 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.941 -5.428 -6.825 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.434 -5.507 -7.715 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.531 -2.803 -7.007 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.310 -3.710 -8.288 1.00 0.00 H new ATOM 460 N GLY A 33 0.629 -6.822 -4.661 1.00 0.00 N ATOM 461 CA GLY A 33 0.247 -8.123 -4.142 1.00 0.00 C ATOM 462 C GLY A 33 0.740 -9.261 -5.013 1.00 0.00 C ATOM 463 O GLY A 33 0.001 -10.207 -5.289 1.00 0.00 O ATOM 0 H GLY A 33 1.616 -6.589 -4.549 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.647 -8.241 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.839 -8.175 -4.062 1.00 0.00 H new ATOM 467 N LYS A 34 1.991 -9.172 -5.449 1.00 0.00 N ATOM 468 CA LYS A 34 2.583 -10.202 -6.295 1.00 0.00 C ATOM 469 C LYS A 34 3.347 -11.221 -5.457 1.00 0.00 C ATOM 470 O LYS A 34 2.921 -12.368 -5.317 1.00 0.00 O ATOM 471 CB LYS A 34 3.520 -9.568 -7.326 1.00 0.00 C ATOM 472 CG LYS A 34 3.003 -8.258 -7.894 1.00 0.00 C ATOM 473 CD LYS A 34 1.944 -8.492 -8.959 1.00 0.00 C ATOM 474 CE LYS A 34 0.549 -8.550 -8.354 1.00 0.00 C ATOM 475 NZ LYS A 34 -0.360 -9.428 -9.141 1.00 0.00 N ATOM 0 H LYS A 34 2.616 -8.396 -5.230 1.00 0.00 H new ATOM 0 HA LYS A 34 1.776 -10.718 -6.815 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.492 -9.395 -6.863 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.677 -10.272 -8.143 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.585 -7.652 -7.091 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.832 -7.693 -8.321 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.988 -7.693 -9.699 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.153 -9.424 -9.483 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.612 -8.918 -7.330 1.00 0.00 H new ATOM 0 HE3 LYS A 34 0.131 -7.544 -8.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.300 -9.441 -8.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -0.441 -9.063 -10.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.025 -10.394 -9.165 1.00 0.00 H new ATOM 489 N ASP A 35 4.476 -10.796 -4.900 1.00 0.00 N ATOM 490 CA ASP A 35 5.297 -11.672 -4.073 1.00 0.00 C ATOM 491 C ASP A 35 5.103 -11.361 -2.592 1.00 0.00 C ATOM 492 O ASP A 35 6.008 -11.560 -1.781 1.00 0.00 O ATOM 493 CB ASP A 35 6.773 -11.526 -4.448 1.00 0.00 C ATOM 494 CG ASP A 35 7.006 -11.652 -5.941 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.649 -10.709 -6.679 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.546 -12.692 -6.371 1.00 0.00 O ATOM 0 H ASP A 35 4.843 -9.850 -5.006 1.00 0.00 H new ATOM 0 HA ASP A 35 4.983 -12.700 -4.254 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.137 -10.557 -4.107 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.354 -12.287 -3.927 1.00 0.00 H new ATOM 501 N VAL A 36 3.917 -10.870 -2.246 1.00 0.00 N ATOM 502 CA VAL A 36 3.604 -10.531 -0.864 1.00 0.00 C ATOM 503 C VAL A 36 3.153 -11.761 -0.085 1.00 0.00 C ATOM 504 O VAL A 36 2.507 -11.647 0.957 1.00 0.00 O ATOM 505 CB VAL A 36 2.504 -9.455 -0.785 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.404 -8.896 0.626 1.00 0.00 C ATOM 507 CG2 VAL A 36 2.772 -8.345 -1.790 1.00 0.00 C ATOM 0 H VAL A 36 3.157 -10.698 -2.905 1.00 0.00 H new ATOM 0 HA VAL A 36 4.519 -10.138 -0.420 1.00 0.00 H new ATOM 0 HB VAL A 36 1.549 -9.917 -1.035 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.622 -8.138 0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.161 -9.701 1.320 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.357 -8.448 0.908 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.985 -7.594 -1.721 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.735 -7.883 -1.574 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.788 -8.762 -2.797 1.00 0.00 H new ATOM 517 N PHE A 37 3.498 -12.938 -0.597 1.00 0.00 N ATOM 518 CA PHE A 37 3.129 -14.191 0.051 1.00 0.00 C ATOM 519 C PHE A 37 3.457 -14.151 1.540 1.00 0.00 C ATOM 520 O PHE A 37 4.223 -13.302 1.996 1.00 0.00 O ATOM 521 CB PHE A 37 3.854 -15.365 -0.611 1.00 0.00 C ATOM 522 CG PHE A 37 3.940 -15.250 -2.106 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.802 -15.020 -2.864 1.00 0.00 C ATOM 524 CD2 PHE A 37 5.158 -15.371 -2.755 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.878 -14.914 -4.240 1.00 0.00 C ATOM 526 CE2 PHE A 37 5.241 -15.265 -4.130 1.00 0.00 C ATOM 527 CZ PHE A 37 4.099 -15.037 -4.874 1.00 0.00 C ATOM 0 H PHE A 37 4.032 -13.050 -1.459 1.00 0.00 H new ATOM 0 HA PHE A 37 2.053 -14.326 -0.062 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.862 -15.437 -0.202 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.339 -16.291 -0.355 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.845 -14.923 -2.373 1.00 0.00 H new ATOM 0 HD2 PHE A 37 6.054 -15.550 -2.179 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.984 -14.735 -4.819 1.00 0.00 H new ATOM 0 HE2 PHE A 37 6.197 -15.360 -4.623 1.00 0.00 H new ATOM 0 HZ PHE A 37 4.161 -14.955 -5.949 1.00 0.00 H new ATOM 537 N ARG A 38 2.870 -15.076 2.294 1.00 0.00 N ATOM 538 CA ARG A 38 3.098 -15.146 3.733 1.00 0.00 C ATOM 539 C ARG A 38 4.559 -15.463 4.037 1.00 0.00 C ATOM 540 O ARG A 38 5.169 -16.309 3.383 1.00 0.00 O ATOM 541 CB ARG A 38 2.193 -16.206 4.363 1.00 0.00 C ATOM 542 CG ARG A 38 1.812 -15.903 5.803 1.00 0.00 C ATOM 543 CD ARG A 38 0.992 -17.031 6.410 1.00 0.00 C ATOM 544 NE ARG A 38 0.994 -16.984 7.870 1.00 0.00 N ATOM 545 CZ ARG A 38 0.961 -18.065 8.640 1.00 0.00 C ATOM 546 NH1 ARG A 38 0.923 -19.272 8.093 1.00 0.00 N ATOM 547 NH2 ARG A 38 0.965 -17.941 9.961 1.00 0.00 N ATOM 0 H ARG A 38 2.234 -15.787 1.932 1.00 0.00 H new ATOM 0 HA ARG A 38 2.859 -14.173 4.161 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.285 -16.297 3.767 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.697 -17.172 4.325 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.714 -15.748 6.395 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.242 -14.975 5.842 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.034 -16.970 6.047 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.391 -17.989 6.077 1.00 0.00 H new ATOM 0 HE ARG A 38 1.022 -16.070 8.323 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.919 -19.372 7.078 1.00 0.00 H new ATOM 0 HH12 ARG A 38 0.898 -20.101 8.687 1.00 0.00 H new ATOM 0 HH21 ARG A 38 0.993 -17.014 10.386 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.940 -18.772 10.551 1.00 0.00 H new ATOM 561 N GLU A 39 5.113 -14.778 5.032 1.00 0.00 N ATOM 562 CA GLU A 39 6.503 -14.987 5.421 1.00 0.00 C ATOM 563 C GLU A 39 7.446 -14.661 4.267 1.00 0.00 C ATOM 564 O GLU A 39 8.518 -15.253 4.141 1.00 0.00 O ATOM 565 CB GLU A 39 6.717 -16.432 5.877 1.00 0.00 C ATOM 566 CG GLU A 39 6.049 -16.758 7.202 1.00 0.00 C ATOM 567 CD GLU A 39 6.517 -15.856 8.328 1.00 0.00 C ATOM 568 OE1 GLU A 39 7.601 -16.120 8.889 1.00 0.00 O ATOM 569 OE2 GLU A 39 5.798 -14.886 8.648 1.00 0.00 O ATOM 0 H GLU A 39 4.622 -14.074 5.583 1.00 0.00 H new ATOM 0 HA GLU A 39 6.726 -14.316 6.250 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.334 -17.106 5.111 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.787 -16.622 5.963 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.968 -16.666 7.092 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.255 -17.796 7.463 1.00 0.00 H new ATOM 576 N ALA A 40 7.038 -13.717 3.426 1.00 0.00 N ATOM 577 CA ALA A 40 7.846 -13.311 2.283 1.00 0.00 C ATOM 578 C ALA A 40 8.280 -11.854 2.407 1.00 0.00 C ATOM 579 O ALA A 40 7.575 -11.033 2.994 1.00 0.00 O ATOM 580 CB ALA A 40 7.075 -13.526 0.989 1.00 0.00 C ATOM 0 H ALA A 40 6.152 -13.219 3.515 1.00 0.00 H new ATOM 0 HA ALA A 40 8.743 -13.930 2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.690 -13.219 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.821 -14.581 0.888 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.161 -12.933 1.007 1.00 0.00 H new ATOM 586 N THR A 41 9.446 -11.539 1.850 1.00 0.00 N ATOM 587 CA THR A 41 9.974 -10.182 1.900 1.00 0.00 C ATOM 588 C THR A 41 9.517 -9.369 0.695 1.00 0.00 C ATOM 589 O THR A 41 10.068 -9.497 -0.399 1.00 0.00 O ATOM 590 CB THR A 41 11.514 -10.180 1.952 1.00 0.00 C ATOM 591 OG1 THR A 41 11.966 -10.890 3.111 1.00 0.00 O ATOM 592 CG2 THR A 41 12.053 -8.758 1.980 1.00 0.00 C ATOM 0 H THR A 41 10.042 -12.206 1.359 1.00 0.00 H new ATOM 0 HA THR A 41 9.586 -9.726 2.811 1.00 0.00 H new ATOM 0 HB THR A 41 11.886 -10.675 1.055 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.946 -10.886 3.136 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.142 -8.782 2.017 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.732 -8.229 1.082 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.672 -8.242 2.861 1.00 0.00 H new ATOM 600 N THR A 42 8.506 -8.531 0.901 1.00 0.00 N ATOM 601 CA THR A 42 7.974 -7.697 -0.169 1.00 0.00 C ATOM 602 C THR A 42 8.112 -6.216 0.167 1.00 0.00 C ATOM 603 O THR A 42 8.009 -5.822 1.329 1.00 0.00 O ATOM 604 CB THR A 42 6.492 -8.013 -0.444 1.00 0.00 C ATOM 605 OG1 THR A 42 6.060 -7.343 -1.633 1.00 0.00 O ATOM 606 CG2 THR A 42 5.621 -7.588 0.728 1.00 0.00 C ATOM 0 H THR A 42 8.039 -8.412 1.800 1.00 0.00 H new ATOM 0 HA THR A 42 8.557 -7.920 -1.062 1.00 0.00 H new ATOM 0 HB THR A 42 6.393 -9.090 -0.578 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.909 -8.001 -2.343 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.579 -7.821 0.510 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.933 -8.122 1.625 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.726 -6.515 0.889 1.00 0.00 H new ATOM 614 N ASP A 43 8.344 -5.401 -0.856 1.00 0.00 N ATOM 615 CA ASP A 43 8.494 -3.963 -0.668 1.00 0.00 C ATOM 616 C ASP A 43 8.033 -3.202 -1.908 1.00 0.00 C ATOM 617 O ASP A 43 7.992 -3.754 -3.008 1.00 0.00 O ATOM 618 CB ASP A 43 9.951 -3.617 -0.356 1.00 0.00 C ATOM 619 CG ASP A 43 10.876 -3.897 -1.523 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.417 -3.804 -2.681 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.060 -4.210 -1.280 1.00 0.00 O ATOM 0 H ASP A 43 8.432 -5.712 -1.824 1.00 0.00 H new ATOM 0 HA ASP A 43 7.869 -3.665 0.174 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.021 -2.563 -0.086 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.280 -4.191 0.510 1.00 0.00 H new ATOM 626 N PHE A 44 7.686 -1.933 -1.722 1.00 0.00 N ATOM 627 CA PHE A 44 7.225 -1.097 -2.824 1.00 0.00 C ATOM 628 C PHE A 44 8.056 0.178 -2.924 1.00 0.00 C ATOM 629 O PHE A 44 8.918 0.440 -2.083 1.00 0.00 O ATOM 630 CB PHE A 44 5.747 -0.744 -2.641 1.00 0.00 C ATOM 631 CG PHE A 44 5.450 -0.069 -1.332 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.256 -0.817 -0.181 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.366 1.311 -1.252 1.00 0.00 C ATOM 634 CE1 PHE A 44 4.982 -0.199 1.024 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.093 1.935 -0.049 1.00 0.00 C ATOM 636 CZ PHE A 44 4.901 1.178 1.091 1.00 0.00 C ATOM 0 H PHE A 44 7.715 -1.461 -0.818 1.00 0.00 H new ATOM 0 HA PHE A 44 7.345 -1.661 -3.749 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.434 -0.092 -3.456 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.152 -1.655 -2.714 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.320 -1.894 -0.227 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.516 1.907 -2.140 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.831 -0.793 1.913 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.030 3.012 -0.000 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.688 1.662 2.033 1.00 0.00 H new ATOM 646 N THR A 45 7.793 0.970 -3.959 1.00 0.00 N ATOM 647 CA THR A 45 8.516 2.217 -4.171 1.00 0.00 C ATOM 648 C THR A 45 7.556 3.389 -4.334 1.00 0.00 C ATOM 649 O THR A 45 6.567 3.298 -5.061 1.00 0.00 O ATOM 650 CB THR A 45 9.425 2.135 -5.412 1.00 0.00 C ATOM 651 OG1 THR A 45 10.225 0.949 -5.357 1.00 0.00 O ATOM 652 CG2 THR A 45 10.326 3.357 -5.505 1.00 0.00 C ATOM 0 H THR A 45 7.084 0.769 -4.664 1.00 0.00 H new ATOM 0 HA THR A 45 9.134 2.378 -3.287 1.00 0.00 H new ATOM 0 HB THR A 45 8.790 2.103 -6.298 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.023 1.118 -4.814 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.958 3.276 -6.389 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.714 4.256 -5.578 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.952 3.416 -4.615 1.00 0.00 H new ATOM 660 N VAL A 46 7.854 4.492 -3.654 1.00 0.00 N ATOM 661 CA VAL A 46 7.017 5.684 -3.726 1.00 0.00 C ATOM 662 C VAL A 46 7.686 6.776 -4.553 1.00 0.00 C ATOM 663 O VAL A 46 8.717 7.322 -4.161 1.00 0.00 O ATOM 664 CB VAL A 46 6.706 6.236 -2.322 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.861 7.497 -2.419 1.00 0.00 C ATOM 666 CG2 VAL A 46 6.009 5.181 -1.477 1.00 0.00 C ATOM 0 H VAL A 46 8.669 4.585 -3.047 1.00 0.00 H new ATOM 0 HA VAL A 46 6.085 5.388 -4.207 1.00 0.00 H new ATOM 0 HB VAL A 46 7.647 6.494 -1.836 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.651 7.872 -1.417 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.402 8.255 -2.985 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.923 7.268 -2.924 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.797 5.588 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.075 4.889 -1.957 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.655 4.308 -1.379 1.00 0.00 H new ATOM 676 N ASP A 47 7.092 7.090 -5.699 1.00 0.00 N ATOM 677 CA ASP A 47 7.629 8.119 -6.582 1.00 0.00 C ATOM 678 C ASP A 47 7.244 9.511 -6.091 1.00 0.00 C ATOM 679 O ASP A 47 6.071 9.791 -5.845 1.00 0.00 O ATOM 680 CB ASP A 47 7.123 7.910 -8.010 1.00 0.00 C ATOM 681 CG ASP A 47 8.045 7.028 -8.828 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.800 6.236 -8.224 1.00 0.00 O ATOM 683 OD2 ASP A 47 8.013 7.128 -10.072 1.00 0.00 O ATOM 0 H ASP A 47 6.238 6.647 -6.038 1.00 0.00 H new ATOM 0 HA ASP A 47 8.716 8.039 -6.575 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.130 7.462 -7.978 1.00 0.00 H new ATOM 0 HB3 ASP A 47 7.020 8.878 -8.501 1.00 0.00 H new ATOM 688 N SER A 48 8.241 10.379 -5.950 1.00 0.00 N ATOM 689 CA SER A 48 8.008 11.741 -5.483 1.00 0.00 C ATOM 690 C SER A 48 8.739 12.749 -6.364 1.00 0.00 C ATOM 691 O SER A 48 9.876 12.521 -6.776 1.00 0.00 O ATOM 692 CB SER A 48 8.464 11.890 -4.031 1.00 0.00 C ATOM 693 OG SER A 48 9.784 11.406 -3.859 1.00 0.00 O ATOM 0 H SER A 48 9.217 10.164 -6.152 1.00 0.00 H new ATOM 0 HA SER A 48 6.938 11.941 -5.542 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.417 12.939 -3.738 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.785 11.345 -3.376 1.00 0.00 H new ATOM 0 HG SER A 48 10.218 11.321 -4.734 1.00 0.00 H new ATOM 699 N ARG A 49 8.077 13.866 -6.649 1.00 0.00 N ATOM 700 CA ARG A 49 8.662 14.910 -7.482 1.00 0.00 C ATOM 701 C ARG A 49 8.432 16.288 -6.868 1.00 0.00 C ATOM 702 O ARG A 49 9.354 16.934 -6.371 1.00 0.00 O ATOM 703 CB ARG A 49 8.067 14.861 -8.890 1.00 0.00 C ATOM 704 CG ARG A 49 8.921 14.095 -9.886 1.00 0.00 C ATOM 705 CD ARG A 49 10.317 14.689 -9.997 1.00 0.00 C ATOM 706 NE ARG A 49 10.972 14.318 -11.248 1.00 0.00 N ATOM 707 CZ ARG A 49 12.266 14.503 -11.483 1.00 0.00 C ATOM 708 NH1 ARG A 49 13.040 15.052 -10.556 1.00 0.00 N ATOM 709 NH2 ARG A 49 12.790 14.140 -12.647 1.00 0.00 N ATOM 0 H ARG A 49 7.135 14.071 -6.315 1.00 0.00 H new ATOM 0 HA ARG A 49 9.736 14.733 -7.542 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.080 14.402 -8.842 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.927 15.880 -9.252 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.992 13.052 -9.579 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.440 14.108 -10.864 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.255 15.775 -9.928 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.923 14.351 -9.156 1.00 0.00 H new ATOM 0 HE ARG A 49 10.405 13.893 -11.982 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.642 15.333 -9.660 1.00 0.00 H new ATOM 0 HH12 ARG A 49 14.033 15.193 -10.739 1.00 0.00 H new ATOM 0 HH21 ARG A 49 12.199 13.718 -13.363 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.784 14.283 -12.826 1.00 0.00 H new ATOM 723 N PRO A 50 7.173 16.749 -6.904 1.00 0.00 N ATOM 724 CA PRO A 50 6.793 18.055 -6.356 1.00 0.00 C ATOM 725 C PRO A 50 6.865 18.087 -4.833 1.00 0.00 C ATOM 726 O PRO A 50 6.491 19.079 -4.205 1.00 0.00 O ATOM 727 CB PRO A 50 5.346 18.229 -6.826 1.00 0.00 C ATOM 728 CG PRO A 50 4.842 16.841 -7.023 1.00 0.00 C ATOM 729 CD PRO A 50 6.024 16.032 -7.482 1.00 0.00 C ATOM 0 HA PRO A 50 7.463 18.848 -6.690 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.751 18.765 -6.086 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.297 18.803 -7.751 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.431 16.440 -6.097 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.042 16.818 -7.763 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.971 15.004 -7.124 1.00 0.00 H new ATOM 0 HD3 PRO A 50 6.083 15.988 -8.570 1.00 0.00 H new ATOM 737 N LEU A 51 7.349 16.999 -4.245 1.00 0.00 N ATOM 738 CA LEU A 51 7.472 16.903 -2.795 1.00 0.00 C ATOM 739 C LEU A 51 8.937 16.870 -2.373 1.00 0.00 C ATOM 740 O LEU A 51 9.356 17.611 -1.483 1.00 0.00 O ATOM 741 CB LEU A 51 6.754 15.653 -2.284 1.00 0.00 C ATOM 742 CG LEU A 51 5.433 15.309 -2.973 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.734 14.170 -2.248 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.532 16.534 -3.039 1.00 0.00 C ATOM 0 H LEU A 51 7.663 16.170 -4.750 1.00 0.00 H new ATOM 0 HA LEU A 51 7.007 17.786 -2.357 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.428 14.803 -2.389 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.563 15.778 -1.218 1.00 0.00 H new ATOM 0 HG LEU A 51 5.649 14.986 -3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.796 13.939 -2.752 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.375 13.288 -2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.529 14.465 -1.219 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.596 16.271 -3.532 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.323 16.887 -2.029 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.031 17.322 -3.603 1.00 0.00 H new ATOM 756 N THR A 52 9.715 16.007 -3.020 1.00 0.00 N ATOM 757 CA THR A 52 11.133 15.878 -2.713 1.00 0.00 C ATOM 758 C THR A 52 11.928 15.473 -3.949 1.00 0.00 C ATOM 759 O THR A 52 11.398 14.833 -4.856 1.00 0.00 O ATOM 760 CB THR A 52 11.375 14.841 -1.599 1.00 0.00 C ATOM 761 OG1 THR A 52 12.610 15.121 -0.930 1.00 0.00 O ATOM 762 CG2 THR A 52 11.410 13.432 -2.170 1.00 0.00 C ATOM 0 H THR A 52 9.386 15.387 -3.760 1.00 0.00 H new ATOM 0 HA THR A 52 11.472 16.855 -2.370 1.00 0.00 H new ATOM 0 HB THR A 52 10.553 14.907 -0.886 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.425 15.446 -0.024 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.582 12.717 -1.365 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.458 13.212 -2.654 1.00 0.00 H new ATOM 0 HG23 THR A 52 12.215 13.356 -2.901 1.00 0.00 H new ATOM 770 N GLN A 53 13.203 15.851 -3.977 1.00 0.00 N ATOM 771 CA GLN A 53 14.070 15.527 -5.103 1.00 0.00 C ATOM 772 C GLN A 53 15.272 14.707 -4.646 1.00 0.00 C ATOM 773 O GLN A 53 15.701 13.778 -5.332 1.00 0.00 O ATOM 774 CB GLN A 53 14.544 16.806 -5.794 1.00 0.00 C ATOM 775 CG GLN A 53 13.416 17.619 -6.410 1.00 0.00 C ATOM 776 CD GLN A 53 12.825 16.957 -7.640 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.478 16.855 -8.678 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.581 16.504 -7.528 1.00 0.00 N ATOM 0 H GLN A 53 13.657 16.381 -3.233 1.00 0.00 H new ATOM 0 HA GLN A 53 13.495 14.931 -5.812 1.00 0.00 H new ATOM 0 HB2 GLN A 53 15.074 17.425 -5.070 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.260 16.544 -6.573 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.631 17.765 -5.668 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.790 18.607 -6.678 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.077 16.610 -6.648 1.00 0.00 H new ATOM 0 HE22 GLN A 53 11.130 16.050 -8.322 1.00 0.00 H new ATOM 787 N VAL A 54 15.813 15.056 -3.483 1.00 0.00 N ATOM 788 CA VAL A 54 16.965 14.352 -2.933 1.00 0.00 C ATOM 789 C VAL A 54 16.639 13.739 -1.576 1.00 0.00 C ATOM 790 O VAL A 54 17.462 13.753 -0.662 1.00 0.00 O ATOM 791 CB VAL A 54 18.177 15.291 -2.782 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.553 15.898 -4.125 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.882 16.379 -1.760 1.00 0.00 C ATOM 0 H VAL A 54 15.471 15.823 -2.903 1.00 0.00 H new ATOM 0 HA VAL A 54 17.215 13.558 -3.636 1.00 0.00 H new ATOM 0 HB VAL A 54 19.025 14.707 -2.424 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.411 16.558 -3.998 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.808 15.102 -4.825 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.710 16.469 -4.515 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.748 17.034 -1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.021 16.962 -2.087 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.665 15.922 -0.794 1.00 0.00 H new ATOM 803 N GLY A 55 15.430 13.199 -1.452 1.00 0.00 N ATOM 804 CA GLY A 55 15.015 12.587 -0.204 1.00 0.00 C ATOM 805 C GLY A 55 14.316 13.567 0.718 1.00 0.00 C ATOM 806 O GLY A 55 14.526 14.775 0.625 1.00 0.00 O ATOM 0 H GLY A 55 14.731 13.175 -2.194 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.346 11.753 -0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.888 12.175 0.303 1.00 0.00 H new ATOM 810 N GLY A 56 13.480 13.044 1.610 1.00 0.00 N ATOM 811 CA GLY A 56 12.759 13.896 2.539 1.00 0.00 C ATOM 812 C GLY A 56 12.672 13.296 3.928 1.00 0.00 C ATOM 813 O GLY A 56 12.810 14.002 4.926 1.00 0.00 O ATOM 0 H GLY A 56 13.289 12.047 1.706 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.253 14.866 2.596 1.00 0.00 H new ATOM 0 HA3 GLY A 56 11.753 14.073 2.159 1.00 0.00 H new ATOM 817 N ASP A 57 12.441 11.989 3.992 1.00 0.00 N ATOM 818 CA ASP A 57 12.334 11.294 5.270 1.00 0.00 C ATOM 819 C ASP A 57 11.065 11.706 6.009 1.00 0.00 C ATOM 820 O ASP A 57 11.092 11.969 7.211 1.00 0.00 O ATOM 821 CB ASP A 57 13.561 11.584 6.137 1.00 0.00 C ATOM 822 CG ASP A 57 14.854 11.522 5.349 1.00 0.00 C ATOM 823 OD1 ASP A 57 15.046 12.372 4.455 1.00 0.00 O ATOM 824 OD2 ASP A 57 15.675 10.622 5.625 1.00 0.00 O ATOM 0 H ASP A 57 12.324 11.390 3.175 1.00 0.00 H new ATOM 0 HA ASP A 57 12.285 10.224 5.070 1.00 0.00 H new ATOM 0 HB2 ASP A 57 13.460 12.572 6.586 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.603 10.865 6.955 1.00 0.00 H new ATOM 829 N HIS A 58 9.954 11.760 5.281 1.00 0.00 N ATOM 830 CA HIS A 58 8.674 12.141 5.867 1.00 0.00 C ATOM 831 C HIS A 58 7.573 11.173 5.444 1.00 0.00 C ATOM 832 O HIS A 58 6.414 11.562 5.295 1.00 0.00 O ATOM 833 CB HIS A 58 8.303 13.565 5.454 1.00 0.00 C ATOM 834 CG HIS A 58 8.813 14.614 6.394 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.008 15.590 6.942 1.00 0.00 N ATOM 836 CD2 HIS A 58 10.056 14.834 6.884 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.733 16.366 7.727 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.979 15.929 7.710 1.00 0.00 N ATOM 0 H HIS A 58 9.914 11.545 4.285 1.00 0.00 H new ATOM 0 HA HIS A 58 8.773 12.100 6.952 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.698 13.760 4.457 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.218 13.644 5.388 1.00 0.00 H new ATOM 0 HD1 HIS A 58 7.009 15.696 6.768 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.942 14.257 6.666 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.369 17.214 8.288 1.00 0.00 H new ATOM 846 N ILE A 59 7.943 9.911 5.251 1.00 0.00 N ATOM 847 CA ILE A 59 6.987 8.889 4.845 1.00 0.00 C ATOM 848 C ILE A 59 6.629 7.976 6.013 1.00 0.00 C ATOM 849 O ILE A 59 7.450 7.729 6.897 1.00 0.00 O ATOM 850 CB ILE A 59 7.536 8.033 3.688 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.709 8.886 2.430 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.610 6.857 3.414 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.403 9.226 1.746 1.00 0.00 C ATOM 0 H ILE A 59 8.898 9.572 5.369 1.00 0.00 H new ATOM 0 HA ILE A 59 6.091 9.411 4.507 1.00 0.00 H new ATOM 0 HB ILE A 59 8.512 7.643 3.976 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.222 9.810 2.695 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.351 8.356 1.727 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.011 6.261 2.594 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.533 6.238 4.308 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.621 7.228 3.143 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.602 9.832 0.862 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.898 8.307 1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 59 5.767 9.784 2.433 1.00 0.00 H new ATOM 865 N LYS A 60 5.398 7.476 6.010 1.00 0.00 N ATOM 866 CA LYS A 60 4.930 6.587 7.067 1.00 0.00 C ATOM 867 C LYS A 60 3.904 5.595 6.529 1.00 0.00 C ATOM 868 O LYS A 60 3.044 5.953 5.724 1.00 0.00 O ATOM 869 CB LYS A 60 4.320 7.399 8.211 1.00 0.00 C ATOM 870 CG LYS A 60 3.626 6.547 9.259 1.00 0.00 C ATOM 871 CD LYS A 60 4.605 5.622 9.964 1.00 0.00 C ATOM 872 CE LYS A 60 5.250 6.302 11.162 1.00 0.00 C ATOM 873 NZ LYS A 60 6.087 5.356 11.952 1.00 0.00 N ATOM 0 H LYS A 60 4.706 7.671 5.287 1.00 0.00 H new ATOM 0 HA LYS A 60 5.787 6.028 7.443 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.106 7.982 8.691 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.603 8.109 7.799 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.142 7.193 9.992 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.841 5.956 8.787 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.085 4.722 10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.378 5.307 9.263 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.866 7.133 10.820 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.474 6.723 11.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.509 5.857 12.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.494 4.576 12.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.843 4.974 11.348 1.00 0.00 H new ATOM 887 N ALA A 61 3.998 4.349 6.981 1.00 0.00 N ATOM 888 CA ALA A 61 3.075 3.307 6.548 1.00 0.00 C ATOM 889 C ALA A 61 2.658 2.422 7.718 1.00 0.00 C ATOM 890 O ALA A 61 3.372 2.318 8.716 1.00 0.00 O ATOM 891 CB ALA A 61 3.706 2.468 5.447 1.00 0.00 C ATOM 0 H ALA A 61 4.704 4.036 7.647 1.00 0.00 H new ATOM 0 HA ALA A 61 2.180 3.789 6.155 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.006 1.694 5.133 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.947 3.106 4.597 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.618 2.003 5.821 1.00 0.00 H new ATOM 897 N HIS A 62 1.498 1.787 7.589 1.00 0.00 N ATOM 898 CA HIS A 62 0.986 0.910 8.636 1.00 0.00 C ATOM 899 C HIS A 62 0.096 -0.180 8.046 1.00 0.00 C ATOM 900 O HIS A 62 -0.998 0.098 7.553 1.00 0.00 O ATOM 901 CB HIS A 62 0.203 1.720 9.670 1.00 0.00 C ATOM 902 CG HIS A 62 0.022 1.008 10.976 1.00 0.00 C ATOM 903 ND1 HIS A 62 0.648 1.400 12.140 1.00 0.00 N ATOM 904 CD2 HIS A 62 -0.722 -0.076 11.297 1.00 0.00 C ATOM 905 CE1 HIS A 62 0.299 0.587 13.121 1.00 0.00 C ATOM 906 NE2 HIS A 62 -0.533 -0.317 12.636 1.00 0.00 N ATOM 0 H HIS A 62 0.895 1.863 6.770 1.00 0.00 H new ATOM 0 HA HIS A 62 1.836 0.434 9.125 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.720 2.663 9.848 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.777 1.966 9.261 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -1.348 -0.645 10.626 1.00 0.00 H new ATOM 0 HE1 HIS A 62 0.636 0.651 14.145 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.965 -1.072 13.169 1.00 0.00 H new ATOM 914 N ILE A 63 0.573 -1.419 8.098 1.00 0.00 N ATOM 915 CA ILE A 63 -0.179 -2.549 7.568 1.00 0.00 C ATOM 916 C ILE A 63 -1.222 -3.033 8.570 1.00 0.00 C ATOM 917 O ILE A 63 -0.972 -3.068 9.774 1.00 0.00 O ATOM 918 CB ILE A 63 0.749 -3.723 7.204 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.813 -3.268 6.203 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.058 -4.881 6.638 1.00 0.00 C ATOM 921 CD1 ILE A 63 3.113 -4.034 6.313 1.00 0.00 C ATOM 0 H ILE A 63 1.477 -1.666 8.502 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.679 -2.199 6.665 1.00 0.00 H new ATOM 0 HB ILE A 63 1.251 -4.065 8.109 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.420 -3.378 5.192 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.012 -2.207 6.354 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.612 -5.703 6.386 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.781 -5.218 7.381 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.584 -4.554 5.741 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.820 -3.658 5.574 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.529 -3.904 7.312 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.928 -5.093 6.133 1.00 0.00 H new ATOM 933 N ALA A 64 -2.393 -3.406 8.064 1.00 0.00 N ATOM 934 CA ALA A 64 -3.473 -3.892 8.913 1.00 0.00 C ATOM 935 C ALA A 64 -4.001 -5.234 8.417 1.00 0.00 C ATOM 936 O ALA A 64 -4.774 -5.292 7.462 1.00 0.00 O ATOM 937 CB ALA A 64 -4.598 -2.869 8.973 1.00 0.00 C ATOM 0 H ALA A 64 -2.618 -3.381 7.069 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.075 -4.037 9.917 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.398 -3.245 9.611 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.217 -1.933 9.382 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.985 -2.695 7.969 1.00 0.00 H new ATOM 943 N ASN A 65 -3.577 -6.310 9.072 1.00 0.00 N ATOM 944 CA ASN A 65 -4.007 -7.652 8.696 1.00 0.00 C ATOM 945 C ASN A 65 -5.519 -7.799 8.839 1.00 0.00 C ATOM 946 O ASN A 65 -6.165 -7.096 9.616 1.00 0.00 O ATOM 947 CB ASN A 65 -3.298 -8.697 9.559 1.00 0.00 C ATOM 948 CG ASN A 65 -1.847 -8.887 9.162 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.443 -8.529 8.055 1.00 0.00 O ATOM 950 ND2 ASN A 65 -1.055 -9.454 10.065 1.00 0.00 N ATOM 0 H ASN A 65 -2.936 -6.279 9.865 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.742 -7.812 7.651 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.349 -8.395 10.605 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.822 -9.649 9.476 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.069 -9.608 9.854 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.433 -9.735 10.970 1.00 0.00 H new ATOM 957 N PRO A 66 -6.097 -8.735 8.072 1.00 0.00 N ATOM 958 CA PRO A 66 -7.539 -8.998 8.095 1.00 0.00 C ATOM 959 C PRO A 66 -7.989 -9.649 9.399 1.00 0.00 C ATOM 960 O PRO A 66 -9.175 -9.912 9.595 1.00 0.00 O ATOM 961 CB PRO A 66 -7.744 -9.957 6.920 1.00 0.00 C ATOM 962 CG PRO A 66 -6.426 -10.629 6.745 1.00 0.00 C ATOM 963 CD PRO A 66 -5.388 -9.609 7.123 1.00 0.00 C ATOM 0 HA PRO A 66 -8.122 -8.080 8.020 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.532 -10.680 7.132 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.038 -9.421 6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.352 -11.514 7.377 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.291 -10.961 5.716 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.515 -10.075 7.581 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.034 -9.055 6.254 1.00 0.00 H new ATOM 971 N SER A 67 -7.034 -9.905 10.287 1.00 0.00 N ATOM 972 CA SER A 67 -7.331 -10.529 11.571 1.00 0.00 C ATOM 973 C SER A 67 -7.295 -9.499 12.696 1.00 0.00 C ATOM 974 O SER A 67 -7.889 -9.699 13.755 1.00 0.00 O ATOM 975 CB SER A 67 -6.334 -11.653 11.859 1.00 0.00 C ATOM 976 OG SER A 67 -6.582 -12.779 11.037 1.00 0.00 O ATOM 0 H SER A 67 -6.048 -9.690 10.141 1.00 0.00 H new ATOM 0 HA SER A 67 -8.335 -10.950 11.520 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.319 -11.294 11.692 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.401 -11.943 12.908 1.00 0.00 H new ATOM 0 HG SER A 67 -5.930 -13.482 11.240 1.00 0.00 H new ATOM 982 N GLY A 68 -6.591 -8.396 12.458 1.00 0.00 N ATOM 983 CA GLY A 68 -6.489 -7.351 13.460 1.00 0.00 C ATOM 984 C GLY A 68 -5.052 -6.976 13.762 1.00 0.00 C ATOM 985 O GLY A 68 -4.774 -5.864 14.208 1.00 0.00 O ATOM 0 H GLY A 68 -6.090 -8.208 11.590 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.027 -6.468 13.116 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.975 -7.683 14.377 1.00 0.00 H new ATOM 989 N ALA A 69 -4.135 -7.908 13.520 1.00 0.00 N ATOM 990 CA ALA A 69 -2.719 -7.670 13.769 1.00 0.00 C ATOM 991 C ALA A 69 -2.158 -6.635 12.799 1.00 0.00 C ATOM 992 O ALA A 69 -2.868 -6.142 11.923 1.00 0.00 O ATOM 993 CB ALA A 69 -1.939 -8.971 13.666 1.00 0.00 C ATOM 0 H ALA A 69 -4.348 -8.835 13.152 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.614 -7.276 14.780 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.883 -8.778 13.854 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.315 -9.680 14.403 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.059 -9.389 12.666 1.00 0.00 H new ATOM 999 N SER A 70 -0.879 -6.311 12.962 1.00 0.00 N ATOM 1000 CA SER A 70 -0.224 -5.332 12.103 1.00 0.00 C ATOM 1001 C SER A 70 1.198 -5.770 11.766 1.00 0.00 C ATOM 1002 O SER A 70 1.977 -6.128 12.650 1.00 0.00 O ATOM 1003 CB SER A 70 -0.200 -3.961 12.783 1.00 0.00 C ATOM 1004 OG SER A 70 0.640 -3.973 13.924 1.00 0.00 O ATOM 0 H SER A 70 -0.276 -6.712 13.681 1.00 0.00 H new ATOM 0 HA SER A 70 -0.793 -5.260 11.176 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.150 -3.208 12.077 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.211 -3.678 13.075 1.00 0.00 H new ATOM 0 HG SER A 70 1.386 -4.591 13.775 1.00 0.00 H new ATOM 1010 N THR A 71 1.530 -5.740 10.479 1.00 0.00 N ATOM 1011 CA THR A 71 2.857 -6.134 10.022 1.00 0.00 C ATOM 1012 C THR A 71 3.833 -4.966 10.093 1.00 0.00 C ATOM 1013 O THR A 71 3.533 -3.866 9.631 1.00 0.00 O ATOM 1014 CB THR A 71 2.818 -6.669 8.578 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.917 -7.779 8.491 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.205 -7.099 8.123 1.00 0.00 C ATOM 0 H THR A 71 0.898 -5.447 9.734 1.00 0.00 H new ATOM 0 HA THR A 71 3.197 -6.928 10.687 1.00 0.00 H new ATOM 0 HB THR A 71 2.471 -5.867 7.926 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.648 -7.910 7.558 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.153 -7.473 7.101 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.882 -6.246 8.163 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.575 -7.887 8.779 1.00 0.00 H new ATOM 1024 N GLU A 72 5.003 -5.212 10.675 1.00 0.00 N ATOM 1025 CA GLU A 72 6.023 -4.179 10.806 1.00 0.00 C ATOM 1026 C GLU A 72 6.515 -3.723 9.435 1.00 0.00 C ATOM 1027 O GLU A 72 6.828 -4.544 8.572 1.00 0.00 O ATOM 1028 CB GLU A 72 7.200 -4.694 11.637 1.00 0.00 C ATOM 1029 CG GLU A 72 7.920 -3.605 12.414 1.00 0.00 C ATOM 1030 CD GLU A 72 9.016 -4.153 13.307 1.00 0.00 C ATOM 1031 OE1 GLU A 72 8.818 -5.239 13.891 1.00 0.00 O ATOM 1032 OE2 GLU A 72 10.072 -3.497 13.421 1.00 0.00 O ATOM 0 H GLU A 72 5.267 -6.118 11.063 1.00 0.00 H new ATOM 0 HA GLU A 72 5.575 -3.325 11.315 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.838 -5.448 12.336 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.912 -5.188 10.976 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.351 -2.889 11.714 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.198 -3.061 13.023 1.00 0.00 H new ATOM 1039 N CYS A 73 6.580 -2.410 9.243 1.00 0.00 N ATOM 1040 CA CYS A 73 7.032 -1.845 7.977 1.00 0.00 C ATOM 1041 C CYS A 73 8.355 -1.107 8.153 1.00 0.00 C ATOM 1042 O CYS A 73 8.582 -0.453 9.171 1.00 0.00 O ATOM 1043 CB CYS A 73 5.975 -0.894 7.412 1.00 0.00 C ATOM 1044 SG CYS A 73 5.542 0.469 8.518 1.00 0.00 S ATOM 0 H CYS A 73 6.326 -1.718 9.947 1.00 0.00 H new ATOM 0 HA CYS A 73 7.184 -2.665 7.275 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.338 -0.482 6.470 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.074 -1.463 7.184 1.00 0.00 H new ATOM 0 HG CYS A 73 4.315 0.837 8.294 1.00 0.00 H new ATOM 1050 N PHE A 74 9.226 -1.217 7.155 1.00 0.00 N ATOM 1051 CA PHE A 74 10.528 -0.562 7.201 1.00 0.00 C ATOM 1052 C PHE A 74 10.715 0.361 6.000 1.00 0.00 C ATOM 1053 O PHE A 74 10.842 -0.097 4.864 1.00 0.00 O ATOM 1054 CB PHE A 74 11.646 -1.606 7.234 1.00 0.00 C ATOM 1055 CG PHE A 74 11.290 -2.841 8.010 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.754 -2.745 9.285 1.00 0.00 C ATOM 1057 CD2 PHE A 74 11.490 -4.100 7.466 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.426 -3.880 10.001 1.00 0.00 C ATOM 1059 CE2 PHE A 74 11.163 -5.239 8.177 1.00 0.00 C ATOM 1060 CZ PHE A 74 10.630 -5.129 9.446 1.00 0.00 C ATOM 0 H PHE A 74 9.054 -1.754 6.305 1.00 0.00 H new ATOM 0 HA PHE A 74 10.573 0.039 8.110 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.898 -1.889 6.212 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.538 -1.157 7.670 1.00 0.00 H new ATOM 0 HD1 PHE A 74 10.591 -1.772 9.724 1.00 0.00 H new ATOM 0 HD2 PHE A 74 11.907 -4.192 6.474 1.00 0.00 H new ATOM 0 HE1 PHE A 74 10.010 -3.791 10.994 1.00 0.00 H new ATOM 0 HE2 PHE A 74 11.324 -6.214 7.741 1.00 0.00 H new ATOM 0 HZ PHE A 74 10.373 -6.017 10.004 1.00 0.00 H new ATOM 1070 N VAL A 75 10.730 1.665 6.260 1.00 0.00 N ATOM 1071 CA VAL A 75 10.901 2.654 5.203 1.00 0.00 C ATOM 1072 C VAL A 75 12.376 2.858 4.876 1.00 0.00 C ATOM 1073 O VAL A 75 13.227 2.865 5.766 1.00 0.00 O ATOM 1074 CB VAL A 75 10.281 4.008 5.595 1.00 0.00 C ATOM 1075 CG1 VAL A 75 10.485 5.029 4.486 1.00 0.00 C ATOM 1076 CG2 VAL A 75 8.803 3.844 5.916 1.00 0.00 C ATOM 0 H VAL A 75 10.626 2.061 7.194 1.00 0.00 H new ATOM 0 HA VAL A 75 10.386 2.269 4.323 1.00 0.00 H new ATOM 0 HB VAL A 75 10.785 4.374 6.490 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.040 5.980 4.780 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.552 5.166 4.310 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.009 4.674 3.572 1.00 0.00 H new ATOM 0 HG21 VAL A 75 8.381 4.811 6.191 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.282 3.456 5.041 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.686 3.148 6.746 1.00 0.00 H new ATOM 1086 N THR A 76 12.674 3.024 3.591 1.00 0.00 N ATOM 1087 CA THR A 76 14.046 3.228 3.144 1.00 0.00 C ATOM 1088 C THR A 76 14.138 4.390 2.162 1.00 0.00 C ATOM 1089 O THR A 76 13.767 4.261 0.996 1.00 0.00 O ATOM 1090 CB THR A 76 14.614 1.961 2.477 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.583 0.866 3.399 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.042 2.192 2.005 1.00 0.00 C ATOM 0 H THR A 76 11.983 3.021 2.841 1.00 0.00 H new ATOM 0 HA THR A 76 14.636 3.458 4.031 1.00 0.00 H new ATOM 0 HB THR A 76 13.995 1.724 1.611 1.00 0.00 H new ATOM 0 HG1 THR A 76 14.944 0.064 2.967 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.422 1.284 1.537 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.059 3.007 1.281 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.670 2.451 2.858 1.00 0.00 H new ATOM 1100 N ASP A 77 14.635 5.525 2.641 1.00 0.00 N ATOM 1101 CA ASP A 77 14.778 6.711 1.805 1.00 0.00 C ATOM 1102 C ASP A 77 16.039 6.625 0.950 1.00 0.00 C ATOM 1103 O ASP A 77 17.151 6.791 1.449 1.00 0.00 O ATOM 1104 CB ASP A 77 14.819 7.971 2.671 1.00 0.00 C ATOM 1105 CG ASP A 77 13.800 7.935 3.793 1.00 0.00 C ATOM 1106 OD1 ASP A 77 12.606 8.175 3.517 1.00 0.00 O ATOM 1107 OD2 ASP A 77 14.197 7.669 4.947 1.00 0.00 O ATOM 0 H ASP A 77 14.946 5.649 3.605 1.00 0.00 H new ATOM 0 HA ASP A 77 13.914 6.764 1.142 1.00 0.00 H new ATOM 0 HB2 ASP A 77 15.817 8.085 3.094 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.636 8.845 2.045 1.00 0.00 H new ATOM 1112 N ASN A 78 15.856 6.363 -0.340 1.00 0.00 N ATOM 1113 CA ASN A 78 16.980 6.253 -1.264 1.00 0.00 C ATOM 1114 C ASN A 78 17.618 7.617 -1.509 1.00 0.00 C ATOM 1115 O ASN A 78 18.633 7.723 -2.196 1.00 0.00 O ATOM 1116 CB ASN A 78 16.518 5.646 -2.591 1.00 0.00 C ATOM 1117 CG ASN A 78 15.865 4.290 -2.410 1.00 0.00 C ATOM 1118 OD1 ASN A 78 16.539 3.294 -2.144 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.546 4.245 -2.555 1.00 0.00 N ATOM 0 H ASN A 78 14.941 6.223 -0.769 1.00 0.00 H new ATOM 0 HA ASN A 78 17.727 5.599 -0.814 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.813 6.324 -3.072 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.373 5.548 -3.260 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.051 3.360 -2.446 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.028 5.095 -2.775 1.00 0.00 H new ATOM 1126 N ALA A 79 17.014 8.656 -0.943 1.00 0.00 N ATOM 1127 CA ALA A 79 17.525 10.013 -1.098 1.00 0.00 C ATOM 1128 C ALA A 79 17.762 10.346 -2.567 1.00 0.00 C ATOM 1129 O ALA A 79 18.585 11.201 -2.895 1.00 0.00 O ATOM 1130 CB ALA A 79 18.809 10.188 -0.301 1.00 0.00 C ATOM 0 H ALA A 79 16.171 8.585 -0.373 1.00 0.00 H new ATOM 0 HA ALA A 79 16.775 10.703 -0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.179 11.206 -0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 79 18.610 10.001 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 79 19.559 9.483 -0.659 1.00 0.00 H new ATOM 1136 N ASP A 80 17.036 9.666 -3.447 1.00 0.00 N ATOM 1137 CA ASP A 80 17.167 9.890 -4.882 1.00 0.00 C ATOM 1138 C ASP A 80 15.861 10.413 -5.472 1.00 0.00 C ATOM 1139 O ASP A 80 15.685 10.439 -6.689 1.00 0.00 O ATOM 1140 CB ASP A 80 17.577 8.595 -5.587 1.00 0.00 C ATOM 1141 CG ASP A 80 18.264 8.851 -6.914 1.00 0.00 C ATOM 1142 OD1 ASP A 80 17.597 9.362 -7.838 1.00 0.00 O ATOM 1143 OD2 ASP A 80 19.468 8.539 -7.028 1.00 0.00 O ATOM 0 H ASP A 80 16.351 8.955 -3.192 1.00 0.00 H new ATOM 0 HA ASP A 80 17.942 10.641 -5.038 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.245 8.028 -4.939 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.693 7.979 -5.752 1.00 0.00 H new ATOM 1148 N GLY A 81 14.948 10.829 -4.600 1.00 0.00 N ATOM 1149 CA GLY A 81 13.670 11.345 -5.053 1.00 0.00 C ATOM 1150 C GLY A 81 12.565 10.312 -4.969 1.00 0.00 C ATOM 1151 O GLY A 81 11.524 10.450 -5.612 1.00 0.00 O ATOM 0 H GLY A 81 15.071 10.818 -3.587 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.398 12.213 -4.452 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.765 11.688 -6.083 1.00 0.00 H new ATOM 1155 N THR A 82 12.790 9.270 -4.173 1.00 0.00 N ATOM 1156 CA THR A 82 11.806 8.207 -4.009 1.00 0.00 C ATOM 1157 C THR A 82 11.989 7.490 -2.677 1.00 0.00 C ATOM 1158 O THR A 82 12.946 7.750 -1.947 1.00 0.00 O ATOM 1159 CB THR A 82 11.897 7.177 -5.151 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.267 6.850 -5.408 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.252 7.716 -6.419 1.00 0.00 C ATOM 0 H THR A 82 13.645 9.140 -3.632 1.00 0.00 H new ATOM 0 HA THR A 82 10.824 8.679 -4.032 1.00 0.00 H new ATOM 0 HB THR A 82 11.361 6.279 -4.844 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.316 6.194 -6.134 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.329 6.971 -7.211 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.202 7.936 -6.228 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.763 8.628 -6.728 1.00 0.00 H new ATOM 1169 N TYR A 83 11.067 6.586 -2.366 1.00 0.00 N ATOM 1170 CA TYR A 83 11.126 5.832 -1.119 1.00 0.00 C ATOM 1171 C TYR A 83 10.926 4.341 -1.374 1.00 0.00 C ATOM 1172 O TYR A 83 10.448 3.941 -2.435 1.00 0.00 O ATOM 1173 CB TYR A 83 10.065 6.339 -0.141 1.00 0.00 C ATOM 1174 CG TYR A 83 10.078 7.840 0.042 1.00 0.00 C ATOM 1175 CD1 TYR A 83 10.914 8.439 0.976 1.00 0.00 C ATOM 1176 CD2 TYR A 83 9.255 8.660 -0.721 1.00 0.00 C ATOM 1177 CE1 TYR A 83 10.929 9.810 1.146 1.00 0.00 C ATOM 1178 CE2 TYR A 83 9.264 10.032 -0.558 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.103 10.602 0.377 1.00 0.00 C ATOM 1180 OH TYR A 83 10.115 11.968 0.542 1.00 0.00 O ATOM 0 H TYR A 83 10.270 6.357 -2.960 1.00 0.00 H new ATOM 0 HA TYR A 83 12.114 5.979 -0.682 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.081 6.033 -0.495 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.218 5.862 0.827 1.00 0.00 H new ATOM 0 HD1 TYR A 83 11.563 7.822 1.580 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.597 8.217 -1.454 1.00 0.00 H new ATOM 0 HE1 TYR A 83 11.584 10.259 1.878 1.00 0.00 H new ATOM 0 HE2 TYR A 83 8.618 10.655 -1.159 1.00 0.00 H new ATOM 0 HH TYR A 83 9.476 12.378 -0.077 1.00 0.00 H new ATOM 1190 N GLN A 84 11.297 3.525 -0.393 1.00 0.00 N ATOM 1191 CA GLN A 84 11.159 2.078 -0.511 1.00 0.00 C ATOM 1192 C GLN A 84 10.819 1.452 0.838 1.00 0.00 C ATOM 1193 O GLN A 84 11.652 1.414 1.744 1.00 0.00 O ATOM 1194 CB GLN A 84 12.448 1.465 -1.061 1.00 0.00 C ATOM 1195 CG GLN A 84 12.310 0.000 -1.442 1.00 0.00 C ATOM 1196 CD GLN A 84 11.886 -0.191 -2.885 1.00 0.00 C ATOM 1197 OE1 GLN A 84 12.438 0.430 -3.794 1.00 0.00 O ATOM 1198 NE2 GLN A 84 10.899 -1.052 -3.103 1.00 0.00 N ATOM 0 H GLN A 84 11.695 3.841 0.492 1.00 0.00 H new ATOM 0 HA GLN A 84 10.343 1.871 -1.203 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.765 2.031 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.236 1.565 -0.314 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.262 -0.505 -1.277 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.579 -0.474 -0.787 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.470 -1.545 -2.320 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.570 -1.220 -4.054 1.00 0.00 H new ATOM 1207 N VAL A 85 9.590 0.962 0.965 1.00 0.00 N ATOM 1208 CA VAL A 85 9.140 0.337 2.203 1.00 0.00 C ATOM 1209 C VAL A 85 9.062 -1.179 2.056 1.00 0.00 C ATOM 1210 O VAL A 85 8.424 -1.691 1.136 1.00 0.00 O ATOM 1211 CB VAL A 85 7.762 0.872 2.633 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.323 0.229 3.940 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.795 2.388 2.760 1.00 0.00 C ATOM 0 H VAL A 85 8.888 0.986 0.225 1.00 0.00 H new ATOM 0 HA VAL A 85 9.873 0.588 2.969 1.00 0.00 H new ATOM 0 HB VAL A 85 7.034 0.610 1.865 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.347 0.620 4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.258 -0.851 3.810 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.050 0.457 4.720 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.813 2.749 3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.535 2.674 3.507 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.061 2.828 1.799 1.00 0.00 H new ATOM 1223 N GLU A 86 9.714 -1.891 2.970 1.00 0.00 N ATOM 1224 CA GLU A 86 9.718 -3.349 2.941 1.00 0.00 C ATOM 1225 C GLU A 86 9.079 -3.919 4.204 1.00 0.00 C ATOM 1226 O GLU A 86 9.336 -3.446 5.311 1.00 0.00 O ATOM 1227 CB GLU A 86 11.147 -3.875 2.797 1.00 0.00 C ATOM 1228 CG GLU A 86 11.231 -5.387 2.678 1.00 0.00 C ATOM 1229 CD GLU A 86 12.632 -5.915 2.915 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.442 -5.896 1.965 1.00 0.00 O ATOM 1231 OE2 GLU A 86 12.918 -6.346 4.052 1.00 0.00 O ATOM 0 H GLU A 86 10.246 -1.482 3.739 1.00 0.00 H new ATOM 0 HA GLU A 86 9.132 -3.672 2.080 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.604 -3.424 1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.732 -3.554 3.659 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.549 -5.842 3.396 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.896 -5.688 1.685 1.00 0.00 H new ATOM 1238 N TYR A 87 8.246 -4.939 4.030 1.00 0.00 N ATOM 1239 CA TYR A 87 7.568 -5.572 5.154 1.00 0.00 C ATOM 1240 C TYR A 87 7.328 -7.054 4.881 1.00 0.00 C ATOM 1241 O TYR A 87 7.237 -7.479 3.729 1.00 0.00 O ATOM 1242 CB TYR A 87 6.237 -4.872 5.435 1.00 0.00 C ATOM 1243 CG TYR A 87 5.183 -5.131 4.382 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.341 -6.233 4.470 1.00 0.00 C ATOM 1245 CD2 TYR A 87 5.028 -4.273 3.301 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.377 -6.473 3.510 1.00 0.00 C ATOM 1247 CE2 TYR A 87 4.066 -4.505 2.337 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.243 -5.606 2.446 1.00 0.00 C ATOM 1249 OH TYR A 87 2.283 -5.842 1.488 1.00 0.00 O ATOM 0 H TYR A 87 8.024 -5.345 3.121 1.00 0.00 H new ATOM 0 HA TYR A 87 8.210 -5.481 6.030 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.860 -5.201 6.403 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.409 -3.798 5.509 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.442 -6.913 5.303 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.671 -3.410 3.212 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.732 -7.335 3.592 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.959 -3.828 1.503 1.00 0.00 H new ATOM 0 HH TYR A 87 2.440 -5.259 0.716 1.00 0.00 H new ATOM 1259 N THR A 88 7.225 -7.838 5.950 1.00 0.00 N ATOM 1260 CA THR A 88 6.997 -9.272 5.828 1.00 0.00 C ATOM 1261 C THR A 88 5.700 -9.682 6.517 1.00 0.00 C ATOM 1262 O THR A 88 5.633 -9.813 7.739 1.00 0.00 O ATOM 1263 CB THR A 88 8.162 -10.080 6.429 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.409 -9.454 6.108 1.00 0.00 O ATOM 1265 CG2 THR A 88 8.157 -11.508 5.906 1.00 0.00 C ATOM 0 H THR A 88 7.296 -7.503 6.911 1.00 0.00 H new ATOM 0 HA THR A 88 6.925 -9.491 4.763 1.00 0.00 H new ATOM 0 HB THR A 88 8.036 -10.106 7.511 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.145 -9.973 6.495 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.989 -12.059 6.345 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.218 -11.991 6.177 1.00 0.00 H new ATOM 0 HG23 THR A 88 8.260 -11.498 4.821 1.00 0.00 H new ATOM 1273 N PRO A 89 4.645 -9.892 5.716 1.00 0.00 N ATOM 1274 CA PRO A 89 3.330 -10.292 6.228 1.00 0.00 C ATOM 1275 C PRO A 89 3.328 -11.719 6.767 1.00 0.00 C ATOM 1276 O PRO A 89 3.664 -12.664 6.053 1.00 0.00 O ATOM 1277 CB PRO A 89 2.424 -10.184 4.999 1.00 0.00 C ATOM 1278 CG PRO A 89 3.339 -10.357 3.836 1.00 0.00 C ATOM 1279 CD PRO A 89 4.653 -9.754 4.250 1.00 0.00 C ATOM 0 HA PRO A 89 3.012 -9.671 7.065 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.649 -10.950 5.010 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.918 -9.219 4.964 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.455 -11.411 3.584 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.943 -9.860 2.951 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.496 -10.280 3.801 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.730 -8.710 3.945 1.00 0.00 H new ATOM 1287 N PHE A 90 2.948 -11.867 8.032 1.00 0.00 N ATOM 1288 CA PHE A 90 2.903 -13.179 8.667 1.00 0.00 C ATOM 1289 C PHE A 90 1.501 -13.776 8.583 1.00 0.00 C ATOM 1290 O PHE A 90 1.141 -14.652 9.368 1.00 0.00 O ATOM 1291 CB PHE A 90 3.339 -13.076 10.130 1.00 0.00 C ATOM 1292 CG PHE A 90 2.834 -11.841 10.820 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.558 -11.804 11.359 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.636 -10.716 10.930 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.091 -10.669 11.995 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.175 -9.579 11.565 1.00 0.00 C ATOM 1297 CZ PHE A 90 1.900 -9.555 12.097 1.00 0.00 C ATOM 0 H PHE A 90 2.667 -11.095 8.637 1.00 0.00 H new ATOM 0 HA PHE A 90 3.591 -13.836 8.135 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.985 -13.955 10.669 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.428 -13.090 10.178 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.921 -12.672 11.281 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.633 -10.728 10.515 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.095 -10.654 12.412 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.811 -8.710 11.646 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.537 -8.666 12.592 1.00 0.00 H new ATOM 1307 N GLU A 91 0.716 -13.294 7.625 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.647 -13.779 7.439 1.00 0.00 C ATOM 1309 C GLU A 91 -1.064 -13.682 5.975 1.00 0.00 C ATOM 1310 O GLU A 91 -0.886 -12.646 5.334 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.619 -12.982 8.312 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.785 -13.548 9.712 1.00 0.00 C ATOM 1313 CD GLU A 91 -2.806 -14.667 9.772 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -3.831 -14.574 9.065 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -2.579 -15.636 10.527 1.00 0.00 O ATOM 0 H GLU A 91 1.000 -12.569 6.966 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.677 -14.827 7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.268 -11.953 8.385 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.593 -12.953 7.823 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.823 -13.919 10.066 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.087 -12.749 10.389 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.620 -14.770 5.451 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.064 -14.810 4.063 1.00 0.00 C ATOM 1324 C LYS A 92 -3.481 -14.262 3.929 1.00 0.00 C ATOM 1325 O LYS A 92 -4.457 -14.995 4.082 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.006 -16.243 3.528 1.00 0.00 C ATOM 1327 CG LYS A 92 -2.549 -17.276 4.500 1.00 0.00 C ATOM 1328 CD LYS A 92 -2.652 -18.648 3.855 1.00 0.00 C ATOM 1329 CE LYS A 92 -3.788 -19.462 4.455 1.00 0.00 C ATOM 1330 NZ LYS A 92 -3.551 -20.927 4.321 1.00 0.00 N ATOM 0 H LYS A 92 -1.774 -15.636 5.968 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.394 -14.183 3.475 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -2.572 -16.298 2.598 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -0.972 -16.491 3.287 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.900 -17.331 5.374 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.532 -16.964 4.853 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.810 -18.536 2.782 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.711 -19.184 3.984 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -3.900 -19.207 5.509 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.724 -19.199 3.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -4.138 -21.438 5.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -3.801 -21.233 3.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -2.548 -21.134 4.500 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.586 -12.968 3.640 1.00 0.00 N ATOM 1345 CA GLY A 93 -4.888 -12.345 3.489 1.00 0.00 C ATOM 1346 C GLY A 93 -4.795 -10.927 2.961 1.00 0.00 C ATOM 1347 O GLY A 93 -3.737 -10.498 2.498 1.00 0.00 O ATOM 0 H GLY A 93 -2.793 -12.341 3.508 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.497 -12.943 2.811 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.398 -12.338 4.452 1.00 0.00 H new ATOM 1351 N LEU A 94 -5.903 -10.199 3.028 1.00 0.00 N ATOM 1352 CA LEU A 94 -5.943 -8.821 2.551 1.00 0.00 C ATOM 1353 C LEU A 94 -5.746 -7.840 3.702 1.00 0.00 C ATOM 1354 O LEU A 94 -6.557 -7.780 4.626 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.274 -8.541 1.850 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.610 -7.069 1.610 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.678 -6.472 0.566 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -9.062 -6.916 1.181 1.00 0.00 C ATOM 0 H LEU A 94 -6.786 -10.539 3.408 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.129 -8.686 1.839 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.270 -9.053 0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.074 -8.983 2.443 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.470 -6.527 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.932 -5.424 0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.647 -6.547 0.913 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.786 -7.017 -0.372 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.283 -5.862 1.015 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.229 -7.472 0.258 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.715 -7.305 1.962 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.664 -7.070 3.639 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.362 -6.089 4.675 1.00 0.00 C ATOM 1372 C HIS A 95 -4.638 -4.673 4.179 1.00 0.00 C ATOM 1373 O HIS A 95 -4.679 -4.423 2.975 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.902 -6.213 5.114 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.334 -7.586 4.925 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -2.982 -8.732 5.337 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.173 -7.994 4.363 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.243 -9.785 5.037 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.139 -9.364 4.445 1.00 0.00 N ATOM 0 H HIS A 95 -3.982 -7.107 2.881 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.009 -6.288 5.530 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.300 -5.499 4.551 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.823 -5.938 6.166 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.414 -7.360 3.930 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.498 -10.815 5.241 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.384 -9.960 4.104 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.827 -3.749 5.117 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.099 -2.358 4.775 1.00 0.00 C ATOM 1389 C VAL A 96 -3.909 -1.467 5.113 1.00 0.00 C ATOM 1390 O VAL A 96 -3.631 -1.200 6.283 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.345 -1.833 5.512 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.568 -0.361 5.202 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.569 -2.656 5.140 1.00 0.00 C ATOM 0 H VAL A 96 -4.797 -3.939 6.119 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.281 -2.325 3.701 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.180 -1.933 6.585 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.453 -0.008 5.732 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.699 0.214 5.523 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.712 -0.233 4.129 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.441 -2.272 5.670 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.739 -2.590 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.406 -3.697 5.418 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.208 -1.008 4.081 1.00 0.00 N ATOM 1404 CA VAL A 97 -2.048 -0.144 4.268 1.00 0.00 C ATOM 1405 C VAL A 97 -2.438 1.327 4.174 1.00 0.00 C ATOM 1406 O VAL A 97 -2.945 1.780 3.149 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.954 -0.442 3.226 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.247 0.468 3.438 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.543 -1.905 3.288 1.00 0.00 C ATOM 0 H VAL A 97 -3.423 -1.220 3.107 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.656 -0.350 5.264 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.358 -0.245 2.233 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.010 0.243 2.693 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.063 1.508 3.338 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.655 0.305 4.436 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.231 -2.097 2.545 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.157 -2.133 4.281 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.408 -2.535 3.082 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.196 2.067 5.252 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.522 3.488 5.291 1.00 0.00 C ATOM 1421 C GLU A 98 -1.268 4.339 5.116 1.00 0.00 C ATOM 1422 O GLU A 98 -0.387 4.350 5.976 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.210 3.839 6.611 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.711 3.600 6.599 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.306 3.553 7.993 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.934 4.405 8.826 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -6.144 2.663 8.250 1.00 0.00 O ATOM 0 H GLU A 98 -1.776 1.706 6.109 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.202 3.702 4.467 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.763 3.249 7.412 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.020 4.887 6.843 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.196 4.391 6.027 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.921 2.661 6.086 1.00 0.00 H new ATOM 1434 N VAL A 99 -1.194 5.050 3.995 1.00 0.00 N ATOM 1435 CA VAL A 99 -0.049 5.905 3.706 1.00 0.00 C ATOM 1436 C VAL A 99 -0.382 7.372 3.952 1.00 0.00 C ATOM 1437 O VAL A 99 -1.486 7.829 3.652 1.00 0.00 O ATOM 1438 CB VAL A 99 0.426 5.734 2.251 1.00 0.00 C ATOM 1439 CG1 VAL A 99 1.694 6.537 2.005 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.646 4.263 1.932 1.00 0.00 C ATOM 0 H VAL A 99 -1.914 5.051 3.272 1.00 0.00 H new ATOM 0 HA VAL A 99 0.752 5.600 4.380 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.350 6.114 1.587 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.014 6.404 0.972 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.498 7.593 2.191 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.480 6.191 2.676 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.981 4.161 0.900 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.403 3.855 2.602 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.288 3.718 2.066 1.00 0.00 H new ATOM 1450 N THR A 100 0.580 8.108 4.499 1.00 0.00 N ATOM 1451 CA THR A 100 0.389 9.524 4.786 1.00 0.00 C ATOM 1452 C THR A 100 1.692 10.299 4.621 1.00 0.00 C ATOM 1453 O THR A 100 2.685 10.012 5.289 1.00 0.00 O ATOM 1454 CB THR A 100 -0.146 9.741 6.215 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.659 9.020 7.154 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.593 9.286 6.325 1.00 0.00 C ATOM 0 H THR A 100 1.500 7.747 4.752 1.00 0.00 H new ATOM 0 HA THR A 100 -0.345 9.895 4.071 1.00 0.00 H new ATOM 0 HB THR A 100 -0.099 10.807 6.440 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.607 9.158 6.946 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.949 9.449 7.342 1.00 0.00 H new ATOM 0 HG22 THR A 100 -2.208 9.857 5.629 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.660 8.226 6.082 1.00 0.00 H new ATOM 1464 N TYR A 101 1.680 11.282 3.728 1.00 0.00 N ATOM 1465 CA TYR A 101 2.861 12.098 3.473 1.00 0.00 C ATOM 1466 C TYR A 101 2.739 13.460 4.149 1.00 0.00 C ATOM 1467 O TYR A 101 1.838 14.241 3.840 1.00 0.00 O ATOM 1468 CB TYR A 101 3.067 12.280 1.969 1.00 0.00 C ATOM 1469 CG TYR A 101 4.300 13.082 1.619 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.401 14.424 1.967 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.363 12.500 0.939 1.00 0.00 C ATOM 1472 CE1 TYR A 101 5.525 15.161 1.648 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.491 13.229 0.618 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.567 14.559 0.975 1.00 0.00 C ATOM 1475 OH TYR A 101 7.689 15.290 0.655 1.00 0.00 O ATOM 0 H TYR A 101 0.865 11.533 3.168 1.00 0.00 H new ATOM 0 HA TYR A 101 3.725 11.581 3.891 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.137 11.299 1.499 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.191 12.774 1.548 1.00 0.00 H new ATOM 0 HD1 TYR A 101 3.587 14.898 2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.306 11.459 0.657 1.00 0.00 H new ATOM 0 HE1 TYR A 101 5.587 16.203 1.924 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.309 12.760 0.091 1.00 0.00 H new ATOM 0 HH TYR A 101 8.329 14.717 0.183 1.00 0.00 H new ATOM 1485 N ASP A 102 3.652 13.739 5.073 1.00 0.00 N ATOM 1486 CA ASP A 102 3.648 15.007 5.793 1.00 0.00 C ATOM 1487 C ASP A 102 2.306 15.239 6.480 1.00 0.00 C ATOM 1488 O ASP A 102 1.730 16.323 6.388 1.00 0.00 O ATOM 1489 CB ASP A 102 3.953 16.162 4.837 1.00 0.00 C ATOM 1490 CG ASP A 102 4.467 17.392 5.559 1.00 0.00 C ATOM 1491 OD1 ASP A 102 5.523 17.294 6.219 1.00 0.00 O ATOM 1492 OD2 ASP A 102 3.813 18.451 5.463 1.00 0.00 O ATOM 0 H ASP A 102 4.404 13.104 5.341 1.00 0.00 H new ATOM 0 HA ASP A 102 4.424 14.964 6.558 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.693 15.838 4.105 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.050 16.420 4.284 1.00 0.00 H new ATOM 1497 N ASP A 103 1.813 14.214 7.166 1.00 0.00 N ATOM 1498 CA ASP A 103 0.539 14.306 7.868 1.00 0.00 C ATOM 1499 C ASP A 103 -0.606 14.543 6.888 1.00 0.00 C ATOM 1500 O ASP A 103 -1.569 15.243 7.199 1.00 0.00 O ATOM 1501 CB ASP A 103 0.582 15.432 8.903 1.00 0.00 C ATOM 1502 CG ASP A 103 1.524 15.127 10.051 1.00 0.00 C ATOM 1503 OD1 ASP A 103 1.576 13.956 10.480 1.00 0.00 O ATOM 1504 OD2 ASP A 103 2.209 16.060 10.520 1.00 0.00 O ATOM 0 H ASP A 103 2.277 13.309 7.251 1.00 0.00 H new ATOM 0 HA ASP A 103 0.366 13.359 8.380 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.893 16.357 8.417 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.421 15.600 9.295 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.493 13.955 5.701 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.518 14.102 4.674 1.00 0.00 C ATOM 1511 C VAL A 104 -1.647 12.832 3.841 1.00 0.00 C ATOM 1512 O VAL A 104 -0.692 12.369 3.217 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.210 15.288 3.740 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.254 15.383 2.637 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -1.138 16.585 4.531 1.00 0.00 C ATOM 0 H VAL A 104 0.298 13.372 5.427 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.459 14.291 5.190 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.239 15.120 3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.021 16.226 1.987 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.251 14.463 2.053 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.239 15.528 3.080 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.920 17.412 3.855 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.093 16.763 5.025 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.350 16.511 5.280 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.857 12.254 3.827 1.00 0.00 N ATOM 1526 CA PRO A 105 -3.141 11.030 3.073 1.00 0.00 C ATOM 1527 C PRO A 105 -3.127 11.261 1.566 1.00 0.00 C ATOM 1528 O PRO A 105 -3.326 12.383 1.098 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.546 10.642 3.541 1.00 0.00 C ATOM 1530 CG PRO A 105 -5.164 11.923 3.985 1.00 0.00 C ATOM 1531 CD PRO A 105 -4.042 12.751 4.547 1.00 0.00 C ATOM 0 HA PRO A 105 -2.390 10.260 3.250 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.119 10.184 2.735 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.506 9.918 4.355 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.646 12.433 3.151 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.933 11.745 4.737 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.201 13.815 4.372 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.944 12.616 5.624 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.890 10.194 0.810 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.851 10.281 -0.644 1.00 0.00 C ATOM 1541 C ILE A 106 -4.158 9.793 -1.259 1.00 0.00 C ATOM 1542 O ILE A 106 -4.913 9.033 -0.653 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.685 9.461 -1.227 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.547 8.131 -0.482 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.389 10.254 -1.151 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.486 7.221 -1.062 1.00 0.00 C ATOM 0 H ILE A 106 -2.722 9.259 1.181 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.705 11.332 -0.893 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.897 9.249 -2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.310 8.332 0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.506 7.614 -0.498 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.425 9.661 -1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.493 11.177 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -0.169 10.493 -0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.443 6.297 -0.485 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.732 6.990 -2.098 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.483 7.719 -1.021 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.434 10.239 -2.494 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.649 9.859 -3.220 1.00 0.00 C ATOM 1560 C PRO A 107 -5.637 8.395 -3.645 1.00 0.00 C ATOM 1561 O PRO A 107 -6.551 7.928 -4.323 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.630 10.773 -4.448 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.191 11.104 -4.650 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.580 11.148 -3.277 1.00 0.00 C ATOM 0 HA PRO A 107 -6.542 9.968 -2.604 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -6.048 10.272 -5.321 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.224 11.672 -4.282 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.701 10.354 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.078 12.062 -5.158 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.542 10.814 -3.288 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.586 12.158 -2.867 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.594 7.675 -3.242 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.463 6.263 -3.582 1.00 0.00 C ATOM 1574 C ASN A 108 -4.714 5.384 -2.360 1.00 0.00 C ATOM 1575 O ASN A 108 -4.997 4.193 -2.487 1.00 0.00 O ATOM 1576 CB ASN A 108 -3.071 5.981 -4.150 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.584 7.089 -5.063 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.597 7.764 -4.768 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.276 7.281 -6.180 1.00 0.00 N ATOM 0 H ASN A 108 -3.828 8.046 -2.680 1.00 0.00 H new ATOM 0 HA ASN A 108 -5.211 6.026 -4.338 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.365 5.854 -3.329 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.090 5.041 -4.702 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.996 8.012 -6.834 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.088 6.698 -6.384 1.00 0.00 H new ATOM 1586 N SER A 109 -4.609 5.980 -1.177 1.00 0.00 N ATOM 1587 CA SER A 109 -4.822 5.252 0.068 1.00 0.00 C ATOM 1588 C SER A 109 -6.260 5.409 0.551 1.00 0.00 C ATOM 1589 O SER A 109 -6.959 6.361 0.201 1.00 0.00 O ATOM 1590 CB SER A 109 -3.853 5.745 1.144 1.00 0.00 C ATOM 1591 OG SER A 109 -2.578 5.146 0.997 1.00 0.00 O ATOM 0 H SER A 109 -4.378 6.966 -1.054 1.00 0.00 H new ATOM 0 HA SER A 109 -4.635 4.195 -0.122 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.758 6.829 1.083 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.254 5.516 2.131 1.00 0.00 H new ATOM 0 HG SER A 109 -2.624 4.443 0.316 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.715 4.454 1.376 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.892 3.317 1.800 1.00 0.00 C ATOM 1599 C PRO A 110 -5.622 2.341 0.660 1.00 0.00 C ATOM 1600 O PRO A 110 -6.188 2.467 -0.427 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.741 2.650 2.885 1.00 0.00 C ATOM 1602 CG PRO A 110 -8.143 3.034 2.558 1.00 0.00 C ATOM 1603 CD PRO A 110 -8.067 4.411 1.958 1.00 0.00 C ATOM 0 HA PRO A 110 -4.907 3.632 2.144 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.615 1.567 2.877 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.457 2.996 3.879 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.588 2.327 1.857 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.767 3.032 3.452 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.836 4.562 1.200 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -8.205 5.186 2.712 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.754 1.368 0.914 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.408 0.370 -0.092 1.00 0.00 C ATOM 1613 C PHE A 111 -4.947 -1.004 0.297 1.00 0.00 C ATOM 1614 O PHE A 111 -5.370 -1.219 1.433 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.890 0.302 -0.273 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.345 1.377 -1.169 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.524 1.309 -2.542 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.653 2.454 -0.640 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.024 2.297 -3.370 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.150 3.444 -1.463 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.335 3.365 -2.829 1.00 0.00 C ATOM 0 H PHE A 111 -4.277 1.249 1.808 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.866 0.667 -1.035 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.412 0.377 0.704 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.624 -0.672 -0.684 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.060 0.475 -2.970 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.505 2.521 0.428 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.172 2.234 -4.438 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.613 4.279 -1.038 1.00 0.00 H new ATOM 0 HZ PHE A 111 -0.942 4.137 -3.474 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.928 -1.931 -0.654 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.414 -3.285 -0.414 1.00 0.00 C ATOM 1633 C LYS A 112 -4.435 -4.319 -0.961 1.00 0.00 C ATOM 1634 O LYS A 112 -4.300 -4.479 -2.174 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.789 -3.478 -1.057 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.943 -3.075 -0.157 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.163 -2.663 -0.964 1.00 0.00 C ATOM 1638 CE LYS A 112 -9.942 -3.874 -1.454 1.00 0.00 C ATOM 1639 NZ LYS A 112 -11.369 -3.542 -1.726 1.00 0.00 N ATOM 0 H LYS A 112 -4.581 -1.770 -1.599 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.501 -3.427 0.663 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.836 -2.895 -1.977 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.906 -4.525 -1.337 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.203 -3.907 0.497 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.634 -2.249 0.484 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.811 -2.036 -0.352 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.850 -2.061 -1.817 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.479 -4.260 -2.362 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.889 -4.666 -0.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.866 -4.393 -2.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.818 -3.197 -0.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.420 -2.804 -2.457 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.755 -5.020 -0.059 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.791 -6.040 -0.451 1.00 0.00 C ATOM 1655 C VAL A 113 -3.329 -7.440 -0.175 1.00 0.00 C ATOM 1656 O VAL A 113 -3.265 -7.929 0.953 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.452 -5.862 0.288 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.493 -6.989 -0.064 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.840 -4.508 -0.039 1.00 0.00 C ATOM 0 H VAL A 113 -3.855 -4.899 0.949 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.624 -5.922 -1.522 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.641 -5.901 1.361 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.448 -6.846 0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.932 -7.944 0.225 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.307 -6.986 -1.138 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.106 -4.399 0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.664 -4.438 -1.112 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.523 -3.716 0.269 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.859 -8.080 -1.212 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.406 -9.425 -1.081 1.00 0.00 C ATOM 1671 C ALA A 114 -3.322 -10.480 -1.279 1.00 0.00 C ATOM 1672 O ALA A 114 -2.942 -10.790 -2.408 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.536 -9.634 -2.078 1.00 0.00 C ATOM 0 H ALA A 114 -3.921 -7.689 -2.152 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.802 -9.533 -0.071 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.935 -10.642 -1.969 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.327 -8.908 -1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.156 -9.501 -3.091 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.827 -11.027 -0.173 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.787 -12.047 -0.224 1.00 0.00 C ATOM 1681 C VAL A 115 -2.347 -13.378 -0.714 1.00 0.00 C ATOM 1682 O VAL A 115 -3.515 -13.696 -0.484 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.135 -12.254 1.155 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.030 -13.296 1.073 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.596 -10.936 1.692 1.00 0.00 C ATOM 0 H VAL A 115 -3.130 -10.780 0.769 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.031 -11.693 -0.925 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.895 -12.619 1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.419 -13.429 2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.448 -14.244 0.734 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.732 -12.963 0.368 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.138 -11.100 2.668 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.150 -10.540 1.003 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.413 -10.222 1.790 1.00 0.00 H new ATOM 1695 N THR A 116 -1.507 -14.155 -1.389 1.00 0.00 N ATOM 1696 CA THR A 116 -1.917 -15.453 -1.912 1.00 0.00 C ATOM 1697 C THR A 116 -0.918 -16.540 -1.532 1.00 0.00 C ATOM 1698 O THR A 116 0.290 -16.307 -1.517 1.00 0.00 O ATOM 1699 CB THR A 116 -2.064 -15.420 -3.445 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.494 -16.699 -3.923 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.747 -15.042 -4.107 1.00 0.00 C ATOM 0 H THR A 116 -0.537 -13.908 -1.587 1.00 0.00 H new ATOM 0 HA THR A 116 -2.885 -15.681 -1.466 1.00 0.00 H new ATOM 0 HB THR A 116 -2.810 -14.667 -3.701 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.587 -16.669 -4.898 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.875 -15.025 -5.189 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.437 -14.055 -3.763 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.016 -15.774 -3.844 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.431 -17.727 -1.225 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.582 -18.850 -0.845 1.00 0.00 C ATOM 1711 C GLU A 117 0.479 -19.115 -1.909 1.00 0.00 C ATOM 1712 O GLU A 117 0.171 -19.574 -3.008 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.427 -20.107 -0.628 1.00 0.00 C ATOM 1714 CG GLU A 117 -2.286 -20.054 0.624 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.992 -21.367 0.903 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -2.371 -22.430 0.695 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -4.165 -21.331 1.329 1.00 0.00 O ATOM 0 H GLU A 117 -2.429 -17.936 -1.232 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.080 -18.593 0.088 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.071 -20.256 -1.495 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.767 -20.973 -0.569 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.661 -19.793 1.478 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -3.028 -19.262 0.518 1.00 0.00 H new ATOM 1724 N GLY A 118 1.732 -18.821 -1.574 1.00 0.00 N ATOM 1725 CA GLY A 118 2.820 -19.033 -2.510 1.00 0.00 C ATOM 1726 C GLY A 118 3.666 -20.238 -2.153 1.00 0.00 C ATOM 1727 O GLY A 118 3.279 -21.377 -2.414 1.00 0.00 O ATOM 0 H GLY A 118 2.013 -18.440 -0.671 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.412 -19.163 -3.512 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.451 -18.145 -2.536 1.00 0.00 H new ATOM 1731 N CYS A 119 4.826 -19.988 -1.555 1.00 0.00 N ATOM 1732 CA CYS A 119 5.732 -21.062 -1.163 1.00 0.00 C ATOM 1733 C CYS A 119 6.572 -20.652 0.042 1.00 0.00 C ATOM 1734 O CYS A 119 7.170 -19.577 0.055 1.00 0.00 O ATOM 1735 CB CYS A 119 6.643 -21.440 -2.331 1.00 0.00 C ATOM 1736 SG CYS A 119 5.771 -22.141 -3.751 1.00 0.00 S ATOM 0 H CYS A 119 5.161 -19.051 -1.331 1.00 0.00 H new ATOM 0 HA CYS A 119 5.131 -21.928 -0.886 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.188 -20.553 -2.655 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.384 -22.159 -1.982 1.00 0.00 H new ATOM 0 HG CYS A 119 4.493 -22.150 -3.514 1.00 0.00 H new ATOM 1742 N GLN A 120 6.611 -21.516 1.051 1.00 0.00 N ATOM 1743 CA GLN A 120 7.376 -21.241 2.262 1.00 0.00 C ATOM 1744 C GLN A 120 8.871 -21.192 1.961 1.00 0.00 C ATOM 1745 O GLN A 120 9.414 -22.035 1.248 1.00 0.00 O ATOM 1746 CB GLN A 120 7.092 -22.306 3.322 1.00 0.00 C ATOM 1747 CG GLN A 120 7.694 -21.987 4.681 1.00 0.00 C ATOM 1748 CD GLN A 120 7.363 -23.034 5.726 1.00 0.00 C ATOM 1749 OE1 GLN A 120 6.476 -23.866 5.530 1.00 0.00 O ATOM 1750 NE2 GLN A 120 8.077 -23.000 6.846 1.00 0.00 N ATOM 0 H GLN A 120 6.123 -22.411 1.054 1.00 0.00 H new ATOM 0 HA GLN A 120 7.068 -20.267 2.644 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.013 -22.421 3.430 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.482 -23.264 2.977 1.00 0.00 H new ATOM 0 HG2 GLN A 120 8.777 -21.905 4.584 1.00 0.00 H new ATOM 0 HG3 GLN A 120 7.330 -21.016 5.017 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.803 -22.293 6.967 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.900 -23.681 7.585 1.00 0.00 H new ATOM 1759 N PRO A 121 9.553 -20.180 2.517 1.00 0.00 N ATOM 1760 CA PRO A 121 10.994 -19.996 2.323 1.00 0.00 C ATOM 1761 C PRO A 121 11.816 -21.068 3.030 1.00 0.00 C ATOM 1762 O PRO A 121 11.352 -21.689 3.986 1.00 0.00 O ATOM 1763 CB PRO A 121 11.263 -18.622 2.941 1.00 0.00 C ATOM 1764 CG PRO A 121 10.176 -18.438 3.943 1.00 0.00 C ATOM 1765 CD PRO A 121 8.971 -19.137 3.379 1.00 0.00 C ATOM 0 HA PRO A 121 11.276 -20.069 1.273 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.246 -18.585 3.411 1.00 0.00 H new ATOM 0 HB3 PRO A 121 11.242 -17.837 2.185 1.00 0.00 H new ATOM 0 HG2 PRO A 121 10.458 -18.862 4.907 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.972 -17.380 4.108 1.00 0.00 H new ATOM 0 HD2 PRO A 121 8.351 -19.566 4.166 1.00 0.00 H new ATOM 0 HD3 PRO A 121 8.339 -18.454 2.812 1.00 0.00 H new ATOM 1773 N SER A 122 13.039 -21.280 2.554 1.00 0.00 N ATOM 1774 CA SER A 122 13.924 -22.280 3.139 1.00 0.00 C ATOM 1775 C SER A 122 15.279 -21.669 3.487 1.00 0.00 C ATOM 1776 O SER A 122 16.027 -21.248 2.605 1.00 0.00 O ATOM 1777 CB SER A 122 14.113 -23.452 2.174 1.00 0.00 C ATOM 1778 OG SER A 122 15.082 -24.363 2.662 1.00 0.00 O ATOM 0 H SER A 122 13.439 -20.773 1.765 1.00 0.00 H new ATOM 0 HA SER A 122 13.463 -22.645 4.057 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.163 -23.968 2.033 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.421 -23.077 1.198 1.00 0.00 H new ATOM 0 HG SER A 122 15.183 -25.104 2.028 1.00 0.00 H new ATOM 1784 N SER A 123 15.587 -21.626 4.779 1.00 0.00 N ATOM 1785 CA SER A 123 16.849 -21.064 5.246 1.00 0.00 C ATOM 1786 C SER A 123 18.028 -21.684 4.502 1.00 0.00 C ATOM 1787 O SER A 123 18.093 -22.899 4.321 1.00 0.00 O ATOM 1788 CB SER A 123 17.006 -21.289 6.751 1.00 0.00 C ATOM 1789 OG SER A 123 15.942 -20.690 7.470 1.00 0.00 O ATOM 0 H SER A 123 14.980 -21.974 5.521 1.00 0.00 H new ATOM 0 HA SER A 123 16.838 -19.993 5.045 1.00 0.00 H new ATOM 0 HB2 SER A 123 17.034 -22.358 6.961 1.00 0.00 H new ATOM 0 HB3 SER A 123 17.956 -20.873 7.087 1.00 0.00 H new ATOM 0 HG SER A 123 16.065 -20.849 8.429 1.00 0.00 H new ATOM 1795 N GLY A 124 18.959 -20.838 4.071 1.00 0.00 N ATOM 1796 CA GLY A 124 20.123 -21.320 3.351 1.00 0.00 C ATOM 1797 C GLY A 124 21.403 -21.165 4.148 1.00 0.00 C ATOM 1798 O GLY A 124 21.457 -20.437 5.140 1.00 0.00 O ATOM 0 H GLY A 124 18.928 -19.828 4.208 1.00 0.00 H new ATOM 0 HA2 GLY A 124 19.981 -22.371 3.099 1.00 0.00 H new ATOM 0 HA3 GLY A 124 20.216 -20.776 2.411 1.00 0.00 H new ATOM 1802 N PRO A 125 22.463 -21.862 3.714 1.00 0.00 N ATOM 1803 CA PRO A 125 23.768 -21.816 4.381 1.00 0.00 C ATOM 1804 C PRO A 125 24.460 -20.468 4.208 1.00 0.00 C ATOM 1805 O PRO A 125 24.368 -19.844 3.151 1.00 0.00 O ATOM 1806 CB PRO A 125 24.564 -22.920 3.680 1.00 0.00 C ATOM 1807 CG PRO A 125 23.930 -23.050 2.339 1.00 0.00 C ATOM 1808 CD PRO A 125 22.470 -22.750 2.539 1.00 0.00 C ATOM 0 HA PRO A 125 23.680 -21.954 5.459 1.00 0.00 H new ATOM 0 HB2 PRO A 125 25.618 -22.656 3.596 1.00 0.00 H new ATOM 0 HB3 PRO A 125 24.514 -23.857 4.234 1.00 0.00 H new ATOM 0 HG2 PRO A 125 24.377 -22.356 1.627 1.00 0.00 H new ATOM 0 HG3 PRO A 125 24.071 -24.053 1.937 1.00 0.00 H new ATOM 0 HD2 PRO A 125 22.036 -22.264 1.665 1.00 0.00 H new ATOM 0 HD3 PRO A 125 21.894 -23.658 2.718 1.00 0.00 H new ATOM 1816 N SER A 126 25.153 -20.025 5.252 1.00 0.00 N ATOM 1817 CA SER A 126 25.858 -18.749 5.216 1.00 0.00 C ATOM 1818 C SER A 126 27.326 -18.929 5.588 1.00 0.00 C ATOM 1819 O SER A 126 27.665 -19.096 6.760 1.00 0.00 O ATOM 1820 CB SER A 126 25.197 -17.750 6.168 1.00 0.00 C ATOM 1821 OG SER A 126 25.228 -18.221 7.504 1.00 0.00 O ATOM 0 H SER A 126 25.241 -20.531 6.133 1.00 0.00 H new ATOM 0 HA SER A 126 25.804 -18.361 4.199 1.00 0.00 H new ATOM 0 HB2 SER A 126 25.709 -16.790 6.106 1.00 0.00 H new ATOM 0 HB3 SER A 126 24.164 -17.581 5.863 1.00 0.00 H new ATOM 0 HG SER A 126 26.029 -18.770 7.639 1.00 0.00 H new ATOM 1827 N SER A 127 28.194 -18.893 4.582 1.00 0.00 N ATOM 1828 CA SER A 127 29.626 -19.056 4.802 1.00 0.00 C ATOM 1829 C SER A 127 30.315 -17.700 4.925 1.00 0.00 C ATOM 1830 O SER A 127 30.713 -17.101 3.927 1.00 0.00 O ATOM 1831 CB SER A 127 30.251 -19.857 3.658 1.00 0.00 C ATOM 1832 OG SER A 127 30.025 -21.246 3.824 1.00 0.00 O ATOM 0 H SER A 127 27.930 -18.752 3.607 1.00 0.00 H new ATOM 0 HA SER A 127 29.766 -19.600 5.736 1.00 0.00 H new ATOM 0 HB2 SER A 127 29.830 -19.528 2.708 1.00 0.00 H new ATOM 0 HB3 SER A 127 31.323 -19.662 3.617 1.00 0.00 H new ATOM 0 HG SER A 127 30.433 -21.735 3.079 1.00 0.00 H new ATOM 1838 N GLY A 128 30.451 -17.222 6.158 1.00 0.00 N ATOM 1839 CA GLY A 128 31.090 -15.941 6.391 1.00 0.00 C ATOM 1840 C GLY A 128 30.384 -15.124 7.454 1.00 0.00 C ATOM 1841 O GLY A 128 29.925 -15.666 8.459 1.00 0.00 O ATOM 0 H GLY A 128 30.130 -17.700 7.000 1.00 0.00 H new ATOM 0 HA2 GLY A 128 32.125 -16.104 6.691 1.00 0.00 H new ATOM 0 HA3 GLY A 128 31.114 -15.376 5.459 1.00 0.00 H new TER 1845 GLY A 128