USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1047 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 100 GLN :FLIP amide:sc= 0.773 F(o=0.48!,f=2.3) USER MOD Set 1.2: A 119 HIS : no HE2:sc= 1.52 K(o=2.3,f=-13!) USER MOD Set 2.1: A 82 SER OG : rot -80:sc= 1.35 USER MOD Set 2.2: A 93 HIS : no HE2:sc= 0.546 K(o=1.9,f=-8.6!) USER MOD Set 3.1: A 55 SER OG : rot 167:sc= 0.58 USER MOD Set 3.2: A 56 THR OG1 : rot 124:sc= 0.482 USER MOD Set 4.1: A 54 GLN : amide:sc= 0.738 K(o=1.4,f=-0.058) USER MOD Set 4.2: A 59 ASN : amide:sc= 0.668 K(o=1.4,f=-0.98) USER MOD Set 5.1: A 37 LYS NZ :NH3+ 167:sc= 0.927 (180deg=-1.16) USER MOD Set 5.2: A 40 THR OG1 : rot 107:sc= 1.99 USER MOD Set 5.3: A 53 THR OG1 : rot 180:sc= 0.751 USER MOD Set 5.4: A 128 TYR OH : rot 25:sc= 0.518 USER MOD Set 6.1: A 45 ASN : amide:sc= 0.623 K(o=1.8,f=-3.4!) USER MOD Set 6.2: A 48 THR OG1 : rot -101:sc= 1.14 USER MOD Set 7.1: A 39 THR OG1 : rot 180:sc= 0.749 USER MOD Set 7.2: A 131 GLN : amide:sc= 1.32 X(o=2.1,f=1.8) USER MOD Set 8.1: A 19 TYR OH : rot 34:sc= 0.492 USER MOD Set 8.2: A 102 THR OG1 : rot 22:sc= 1.96 USER MOD Single : A 1 VAL N :NH3+ -178:sc= -0.305 (180deg=-0.319) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -118:sc= 0.772 (180deg=-1.33!) USER MOD Single : A 13 SER OG : rot 52:sc= 1.21 USER MOD Single : A 14 LYS NZ :NH3+ 158:sc= 1.23 (180deg=0.846) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 20 MET CE :methyl -176:sc= 0 (180deg=-0.0324) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot -86:sc= 0.966 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.094 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.564 F(o=-3.6,f=-0.56) USER MOD Single : A 34 ASN : amide:sc= 0.444 K(o=0.44,f=-9.2!) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 82:sc= 0.408 USER MOD Single : A 52 LYS NZ :NH3+ 168:sc= 0.957 (180deg=0.000102) USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= -0.247 (180deg=-0.65) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0806 USER MOD Single : A 63 SER OG : rot 33:sc= 0.447 USER MOD Single : A 65 LYS NZ :NH3+ -171:sc= 2.49 (180deg=2.33) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -93:sc= 1.2 USER MOD Single : A 79 LYS NZ :NH3+ 167:sc= 1.26 (180deg=1.16) USER MOD Single : A 81 LYS NZ :NH3+ -163:sc= 1.19 (180deg=1.13) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.218 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.156 K(o=-0.16,f=-4.8!) USER MOD Single : A 96 LYS NZ :NH3+ 160:sc= 1.19 (180deg=1.08) USER MOD Single : A 98 ASN : amide:sc= -1.46 K(o=-1.5,f=-2.7) USER MOD Single : A 103 SER OG : rot -17:sc= 0.443 USER MOD Single : A 108 MET CE :methyl 175:sc= 0 (180deg=-0.0217) USER MOD Single : A 112 LYS NZ :NH3+ 154:sc= 0.964 (180deg=0.773) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot -10:sc= -0.98 USER MOD Single : A 125 THR OG1 : rot 40:sc= 0.158 USER MOD Single : A 127 THR OG1 : rot -58:sc= 1.21 USER MOD Single : A 130 LYS NZ :NH3+ -168:sc= 2.44 (180deg=1.93) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.048 -12.721 -4.511 1.00 0.00 N ATOM 2 CA VAL A 1 10.086 -11.901 -3.311 1.00 0.00 C ATOM 3 C VAL A 1 11.398 -11.110 -3.217 1.00 0.00 C ATOM 4 O VAL A 1 11.406 -9.979 -2.723 1.00 0.00 O ATOM 5 CB VAL A 1 9.795 -12.769 -2.072 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.831 -13.876 -1.838 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.672 -11.911 -0.806 1.00 0.00 C ATOM 0 H1 VAL A 1 9.136 -13.217 -4.564 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.162 -12.116 -5.349 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.820 -13.418 -4.480 1.00 0.00 H new ATOM 0 HA VAL A 1 9.299 -11.148 -3.360 1.00 0.00 H new ATOM 0 HB VAL A 1 8.843 -13.256 -2.283 1.00 0.00 H new ATOM 0 HG11 VAL A 1 10.560 -14.445 -0.949 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.854 -14.541 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.815 -13.429 -1.697 1.00 0.00 H new ATOM 0 HG21 VAL A 1 9.467 -12.553 0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.605 -11.372 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.857 -11.197 -0.928 1.00 0.00 H new ATOM 19 N ASP A 2 12.489 -11.703 -3.713 1.00 0.00 N ATOM 20 CA ASP A 2 13.882 -11.270 -3.621 1.00 0.00 C ATOM 21 C ASP A 2 14.164 -10.062 -4.521 1.00 0.00 C ATOM 22 O ASP A 2 15.075 -10.058 -5.346 1.00 0.00 O ATOM 23 CB ASP A 2 14.794 -12.450 -4.002 1.00 0.00 C ATOM 24 CG ASP A 2 14.352 -13.770 -3.388 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.275 -14.238 -3.828 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.066 -14.260 -2.488 1.00 0.00 O ATOM 0 H ASP A 2 12.409 -12.576 -4.235 1.00 0.00 H new ATOM 0 HA ASP A 2 14.083 -10.957 -2.597 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.814 -12.550 -5.087 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.813 -12.231 -3.683 1.00 0.00 H new ATOM 31 N ALA A 3 13.369 -9.014 -4.347 1.00 0.00 N ATOM 32 CA ALA A 3 13.427 -7.775 -5.091 1.00 0.00 C ATOM 33 C ALA A 3 12.771 -6.715 -4.223 1.00 0.00 C ATOM 34 O ALA A 3 13.408 -5.718 -3.889 1.00 0.00 O ATOM 35 CB ALA A 3 12.703 -7.925 -6.434 1.00 0.00 C ATOM 0 H ALA A 3 12.629 -9.011 -3.645 1.00 0.00 H new ATOM 0 HA ALA A 3 14.455 -7.495 -5.320 1.00 0.00 H new ATOM 0 HB1 ALA A 3 12.755 -6.984 -6.982 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.179 -8.713 -7.018 1.00 0.00 H new ATOM 0 HB3 ALA A 3 11.659 -8.185 -6.258 1.00 0.00 H new ATOM 41 N PHE A 4 11.517 -6.965 -3.833 1.00 0.00 N ATOM 42 CA PHE A 4 10.664 -6.078 -3.054 1.00 0.00 C ATOM 43 C PHE A 4 11.395 -5.503 -1.841 1.00 0.00 C ATOM 44 O PHE A 4 11.308 -4.303 -1.595 1.00 0.00 O ATOM 45 CB PHE A 4 9.398 -6.849 -2.651 1.00 0.00 C ATOM 46 CG PHE A 4 8.613 -7.460 -3.802 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.473 -6.782 -5.029 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.039 -8.736 -3.652 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.855 -7.413 -6.122 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.433 -9.372 -4.748 1.00 0.00 C ATOM 51 CZ PHE A 4 7.363 -8.720 -5.990 1.00 0.00 C ATOM 0 H PHE A 4 11.050 -7.841 -4.068 1.00 0.00 H new ATOM 0 HA PHE A 4 10.384 -5.219 -3.663 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.682 -7.646 -1.963 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.741 -6.174 -2.103 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.842 -5.772 -5.130 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.064 -9.228 -2.691 1.00 0.00 H new ATOM 0 HE1 PHE A 4 7.759 -6.892 -7.063 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.020 -10.364 -4.636 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.931 -9.224 -6.842 1.00 0.00 H new ATOM 61 N VAL A 5 12.126 -6.367 -1.129 1.00 0.00 N ATOM 62 CA VAL A 5 12.971 -6.064 0.024 1.00 0.00 C ATOM 63 C VAL A 5 13.661 -4.695 -0.108 1.00 0.00 C ATOM 64 O VAL A 5 14.672 -4.598 -0.808 1.00 0.00 O ATOM 65 CB VAL A 5 14.047 -7.169 0.158 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.928 -6.919 1.393 1.00 0.00 C ATOM 67 CG2 VAL A 5 13.499 -8.600 0.260 1.00 0.00 C ATOM 0 H VAL A 5 12.142 -7.360 -1.360 1.00 0.00 H new ATOM 0 HA VAL A 5 12.336 -6.029 0.909 1.00 0.00 H new ATOM 0 HB VAL A 5 14.615 -7.103 -0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.678 -7.706 1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.424 -5.953 1.297 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.307 -6.920 2.289 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.328 -9.302 0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.857 -8.682 1.137 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.922 -8.833 -0.635 1.00 0.00 H new ATOM 77 N GLY A 6 13.180 -3.653 0.581 1.00 0.00 N ATOM 78 CA GLY A 6 13.945 -2.421 0.751 1.00 0.00 C ATOM 79 C GLY A 6 13.075 -1.170 0.697 1.00 0.00 C ATOM 80 O GLY A 6 11.879 -1.222 0.967 1.00 0.00 O ATOM 0 H GLY A 6 12.263 -3.643 1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.468 -2.453 1.707 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.706 -2.362 -0.027 1.00 0.00 H new ATOM 84 N THR A 7 13.696 -0.035 0.361 1.00 0.00 N ATOM 85 CA THR A 7 13.046 1.261 0.250 1.00 0.00 C ATOM 86 C THR A 7 13.132 1.737 -1.193 1.00 0.00 C ATOM 87 O THR A 7 14.221 1.789 -1.771 1.00 0.00 O ATOM 88 CB THR A 7 13.696 2.265 1.208 1.00 0.00 C ATOM 89 OG1 THR A 7 13.676 1.740 2.519 1.00 0.00 O ATOM 90 CG2 THR A 7 12.946 3.598 1.212 1.00 0.00 C ATOM 0 H THR A 7 14.694 0.001 0.154 1.00 0.00 H new ATOM 0 HA THR A 7 11.996 1.174 0.529 1.00 0.00 H new ATOM 0 HB THR A 7 14.719 2.436 0.871 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.093 2.379 3.134 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.433 4.287 1.902 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.954 4.023 0.208 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.916 3.435 1.529 1.00 0.00 H new ATOM 98 N TRP A 8 11.979 2.089 -1.758 1.00 0.00 N ATOM 99 CA TRP A 8 11.837 2.521 -3.131 1.00 0.00 C ATOM 100 C TRP A 8 11.457 3.997 -3.189 1.00 0.00 C ATOM 101 O TRP A 8 10.934 4.553 -2.222 1.00 0.00 O ATOM 102 CB TRP A 8 10.789 1.657 -3.826 1.00 0.00 C ATOM 103 CG TRP A 8 11.020 0.177 -3.807 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.758 -0.654 -2.772 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.551 -0.669 -4.869 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.080 -1.948 -3.123 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.584 -2.013 -4.406 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.995 -0.439 -6.187 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.046 -3.065 -5.208 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.531 -1.474 -6.975 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.559 -2.790 -6.485 1.00 0.00 C ATOM 0 H TRP A 8 11.095 2.078 -1.250 1.00 0.00 H new ATOM 0 HA TRP A 8 12.789 2.404 -3.649 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.822 1.857 -3.364 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.718 1.977 -4.865 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.358 -0.350 -1.816 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.961 -2.755 -2.511 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.922 0.555 -6.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.008 -4.082 -4.846 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.921 -1.256 -7.958 1.00 0.00 H new ATOM 0 HH2 TRP A 8 12.973 -3.585 -7.087 1.00 0.00 H new ATOM 122 N LYS A 9 11.756 4.625 -4.325 1.00 0.00 N ATOM 123 CA LYS A 9 11.451 5.997 -4.682 1.00 0.00 C ATOM 124 C LYS A 9 10.565 5.958 -5.926 1.00 0.00 C ATOM 125 O LYS A 9 10.897 5.251 -6.873 1.00 0.00 O ATOM 126 CB LYS A 9 12.769 6.736 -4.955 1.00 0.00 C ATOM 127 CG LYS A 9 12.551 8.135 -5.546 1.00 0.00 C ATOM 128 CD LYS A 9 13.782 9.032 -5.355 1.00 0.00 C ATOM 129 CE LYS A 9 15.079 8.512 -5.999 1.00 0.00 C ATOM 130 NZ LYS A 9 15.004 8.394 -7.471 1.00 0.00 N ATOM 0 H LYS A 9 12.256 4.145 -5.073 1.00 0.00 H new ATOM 0 HA LYS A 9 10.928 6.522 -3.883 1.00 0.00 H new ATOM 0 HB2 LYS A 9 13.332 6.822 -4.026 1.00 0.00 H new ATOM 0 HB3 LYS A 9 13.376 6.146 -5.642 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.325 8.050 -6.609 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.686 8.599 -5.072 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.561 10.017 -5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 9 13.953 9.164 -4.287 1.00 0.00 H new ATOM 0 HE2 LYS A 9 15.898 9.182 -5.738 1.00 0.00 H new ATOM 0 HE3 LYS A 9 15.318 7.536 -5.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.134 7.400 -7.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.075 8.726 -7.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.751 8.974 -7.904 1.00 0.00 H new ATOM 144 N LEU A 10 9.441 6.677 -5.935 1.00 0.00 N ATOM 145 CA LEU A 10 8.600 6.797 -7.117 1.00 0.00 C ATOM 146 C LEU A 10 9.410 7.489 -8.206 1.00 0.00 C ATOM 147 O LEU A 10 10.110 8.457 -7.907 1.00 0.00 O ATOM 148 CB LEU A 10 7.334 7.592 -6.767 1.00 0.00 C ATOM 149 CG LEU A 10 6.336 7.719 -7.931 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.900 7.686 -7.406 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.503 9.035 -8.692 1.00 0.00 C ATOM 0 H LEU A 10 9.093 7.189 -5.124 1.00 0.00 H new ATOM 0 HA LEU A 10 8.286 5.817 -7.475 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.836 7.111 -5.925 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.623 8.590 -6.438 1.00 0.00 H new ATOM 0 HG LEU A 10 6.537 6.881 -8.598 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.205 7.777 -8.241 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.724 6.743 -6.888 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.746 8.514 -6.714 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.778 9.080 -9.504 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.339 9.871 -8.013 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.511 9.093 -9.102 1.00 0.00 H new ATOM 163 N VAL A 11 9.322 7.006 -9.448 1.00 0.00 N ATOM 164 CA VAL A 11 10.001 7.635 -10.574 1.00 0.00 C ATOM 165 C VAL A 11 8.978 8.092 -11.619 1.00 0.00 C ATOM 166 O VAL A 11 8.733 9.293 -11.728 1.00 0.00 O ATOM 167 CB VAL A 11 11.170 6.756 -11.061 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.787 5.342 -11.501 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.948 7.439 -12.187 1.00 0.00 C ATOM 0 H VAL A 11 8.783 6.176 -9.696 1.00 0.00 H new ATOM 0 HA VAL A 11 10.495 8.560 -10.277 1.00 0.00 H new ATOM 0 HB VAL A 11 11.795 6.641 -10.176 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.680 4.807 -11.825 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.330 4.812 -10.665 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.078 5.397 -12.327 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.765 6.793 -12.508 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.281 7.626 -13.029 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.353 8.385 -11.828 1.00 0.00 H new ATOM 179 N ASP A 12 8.343 7.171 -12.348 1.00 0.00 N ATOM 180 CA ASP A 12 7.401 7.504 -13.414 1.00 0.00 C ATOM 181 C ASP A 12 5.988 7.099 -12.990 1.00 0.00 C ATOM 182 O ASP A 12 5.791 6.021 -12.424 1.00 0.00 O ATOM 183 CB ASP A 12 7.776 6.802 -14.731 1.00 0.00 C ATOM 184 CG ASP A 12 9.246 6.951 -15.099 1.00 0.00 C ATOM 185 OD1 ASP A 12 9.621 8.062 -15.524 1.00 0.00 O ATOM 186 OD2 ASP A 12 9.986 5.951 -14.951 1.00 0.00 O ATOM 0 H ASP A 12 8.470 6.168 -12.213 1.00 0.00 H new ATOM 0 HA ASP A 12 7.441 8.580 -13.585 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.535 5.742 -14.650 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.164 7.208 -15.537 1.00 0.00 H new ATOM 191 N SER A 13 4.988 7.927 -13.296 1.00 0.00 N ATOM 192 CA SER A 13 3.582 7.568 -13.197 1.00 0.00 C ATOM 193 C SER A 13 2.760 8.575 -13.998 1.00 0.00 C ATOM 194 O SER A 13 3.258 9.664 -14.293 1.00 0.00 O ATOM 195 CB SER A 13 3.127 7.509 -11.732 1.00 0.00 C ATOM 196 OG SER A 13 1.856 6.895 -11.660 1.00 0.00 O ATOM 0 H SER A 13 5.140 8.881 -13.625 1.00 0.00 H new ATOM 0 HA SER A 13 3.431 6.572 -13.612 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.848 6.948 -11.138 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.082 8.514 -11.313 1.00 0.00 H new ATOM 0 HG SER A 13 1.877 6.043 -12.143 1.00 0.00 H new ATOM 202 N LYS A 14 1.529 8.203 -14.364 1.00 0.00 N ATOM 203 CA LYS A 14 0.553 9.007 -15.091 1.00 0.00 C ATOM 204 C LYS A 14 -0.846 8.457 -14.759 1.00 0.00 C ATOM 205 O LYS A 14 -0.973 7.400 -14.138 1.00 0.00 O ATOM 206 CB LYS A 14 0.786 8.909 -16.613 1.00 0.00 C ATOM 207 CG LYS A 14 2.057 9.532 -17.221 1.00 0.00 C ATOM 208 CD LYS A 14 1.987 11.052 -17.484 1.00 0.00 C ATOM 209 CE LYS A 14 2.377 11.978 -16.321 1.00 0.00 C ATOM 210 NZ LYS A 14 3.757 11.749 -15.847 1.00 0.00 N ATOM 0 H LYS A 14 1.170 7.274 -14.145 1.00 0.00 H new ATOM 0 HA LYS A 14 0.648 10.053 -14.798 1.00 0.00 H new ATOM 0 HB2 LYS A 14 0.780 7.852 -16.878 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.072 9.366 -17.106 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.894 9.334 -16.552 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.275 9.027 -18.162 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.634 11.280 -18.331 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.969 11.297 -17.786 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.274 13.016 -16.638 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.683 11.827 -15.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 4.099 12.597 -15.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.770 10.939 -15.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.375 11.550 -16.660 1.00 0.00 H new ATOM 224 N ASN A 15 -1.895 9.167 -15.193 1.00 0.00 N ATOM 225 CA ASN A 15 -3.283 8.697 -15.234 1.00 0.00 C ATOM 226 C ASN A 15 -3.879 8.411 -13.853 1.00 0.00 C ATOM 227 O ASN A 15 -4.920 7.764 -13.757 1.00 0.00 O ATOM 228 CB ASN A 15 -3.428 7.460 -16.145 1.00 0.00 C ATOM 229 CG ASN A 15 -3.051 7.740 -17.594 1.00 0.00 C ATOM 230 OD1 ASN A 15 -1.881 7.673 -17.958 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.031 8.049 -18.437 1.00 0.00 N ATOM 0 H ASN A 15 -1.795 10.122 -15.538 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.857 9.523 -15.654 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.799 6.657 -15.761 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -4.458 7.105 -16.105 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.820 8.238 -19.417 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.994 8.097 -18.104 1.00 0.00 H new ATOM 238 N PHE A 16 -3.244 8.837 -12.758 1.00 0.00 N ATOM 239 CA PHE A 16 -3.833 8.685 -11.428 1.00 0.00 C ATOM 240 C PHE A 16 -5.140 9.466 -11.347 1.00 0.00 C ATOM 241 O PHE A 16 -6.116 9.009 -10.755 1.00 0.00 O ATOM 242 CB PHE A 16 -2.841 9.115 -10.338 1.00 0.00 C ATOM 243 CG PHE A 16 -2.134 7.921 -9.729 1.00 0.00 C ATOM 244 CD1 PHE A 16 -1.190 7.215 -10.499 1.00 0.00 C ATOM 245 CD2 PHE A 16 -2.628 7.350 -8.541 1.00 0.00 C ATOM 246 CE1 PHE A 16 -0.779 5.932 -10.107 1.00 0.00 C ATOM 247 CE2 PHE A 16 -2.235 6.054 -8.164 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.323 5.340 -8.956 1.00 0.00 C ATOM 0 H PHE A 16 -2.328 9.287 -12.767 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.058 7.632 -11.256 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -2.105 9.797 -10.763 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.370 9.663 -9.558 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -0.781 7.662 -11.393 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -3.310 7.909 -7.918 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -0.043 5.399 -10.691 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -2.635 5.608 -7.265 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.039 4.335 -8.680 1.00 0.00 H new ATOM 258 N ASP A 17 -5.116 10.645 -11.950 1.00 0.00 N ATOM 259 CA ASP A 17 -6.171 11.633 -11.991 1.00 0.00 C ATOM 260 C ASP A 17 -7.467 10.980 -12.468 1.00 0.00 C ATOM 261 O ASP A 17 -8.358 10.726 -11.662 1.00 0.00 O ATOM 262 CB ASP A 17 -5.669 12.778 -12.888 1.00 0.00 C ATOM 263 CG ASP A 17 -4.268 13.184 -12.447 1.00 0.00 C ATOM 264 OD1 ASP A 17 -3.331 12.433 -12.807 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.178 14.124 -11.633 1.00 0.00 O ATOM 0 H ASP A 17 -4.290 10.955 -12.462 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.406 12.048 -11.011 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.657 12.460 -13.931 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.345 13.630 -12.822 1.00 0.00 H new ATOM 270 N ASP A 18 -7.520 10.644 -13.759 1.00 0.00 N ATOM 271 CA ASP A 18 -8.564 9.861 -14.415 1.00 0.00 C ATOM 272 C ASP A 18 -9.075 8.724 -13.522 1.00 0.00 C ATOM 273 O ASP A 18 -10.256 8.639 -13.182 1.00 0.00 O ATOM 274 CB ASP A 18 -7.959 9.305 -15.714 1.00 0.00 C ATOM 275 CG ASP A 18 -8.767 8.143 -16.271 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.955 8.374 -16.571 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.173 7.047 -16.364 1.00 0.00 O ATOM 0 H ASP A 18 -6.790 10.930 -14.412 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.428 10.493 -14.623 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.907 10.100 -16.458 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.937 8.978 -15.526 1.00 0.00 H new ATOM 282 N TYR A 19 -8.150 7.859 -13.113 1.00 0.00 N ATOM 283 CA TYR A 19 -8.456 6.667 -12.342 1.00 0.00 C ATOM 284 C TYR A 19 -9.205 6.998 -11.049 1.00 0.00 C ATOM 285 O TYR A 19 -10.106 6.272 -10.637 1.00 0.00 O ATOM 286 CB TYR A 19 -7.134 5.950 -12.069 1.00 0.00 C ATOM 287 CG TYR A 19 -7.242 4.477 -11.743 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.522 4.031 -10.439 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.927 3.547 -12.745 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.439 2.660 -10.133 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.893 2.181 -12.447 1.00 0.00 C ATOM 292 CZ TYR A 19 -7.134 1.741 -11.146 1.00 0.00 C ATOM 293 OH TYR A 19 -6.907 0.430 -10.875 1.00 0.00 O ATOM 0 H TYR A 19 -7.156 7.972 -13.313 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.126 6.018 -12.905 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.493 6.064 -12.943 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.634 6.451 -11.240 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.800 4.740 -9.673 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.711 3.886 -13.747 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.609 2.318 -9.123 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.679 1.465 -13.227 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.472 0.148 -10.126 1.00 0.00 H new ATOM 303 N MET A 20 -8.807 8.073 -10.365 1.00 0.00 N ATOM 304 CA MET A 20 -9.476 8.498 -9.144 1.00 0.00 C ATOM 305 C MET A 20 -10.767 9.254 -9.461 1.00 0.00 C ATOM 306 O MET A 20 -11.744 9.111 -8.722 1.00 0.00 O ATOM 307 CB MET A 20 -8.503 9.290 -8.268 1.00 0.00 C ATOM 308 CG MET A 20 -7.578 8.317 -7.524 1.00 0.00 C ATOM 309 SD MET A 20 -6.522 7.229 -8.516 1.00 0.00 S ATOM 310 CE MET A 20 -5.918 6.073 -7.262 1.00 0.00 C ATOM 0 H MET A 20 -8.022 8.663 -10.641 1.00 0.00 H new ATOM 0 HA MET A 20 -9.781 7.624 -8.569 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.914 9.970 -8.883 1.00 0.00 H new ATOM 0 HB3 MET A 20 -9.055 9.902 -7.554 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.933 8.903 -6.869 1.00 0.00 H new ATOM 0 HG3 MET A 20 -8.198 7.689 -6.884 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.200 5.388 -7.714 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.434 6.628 -6.459 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.756 5.505 -6.857 1.00 0.00 H new ATOM 320 N LYS A 21 -10.791 9.992 -10.573 1.00 0.00 N ATOM 321 CA LYS A 21 -11.939 10.687 -11.148 1.00 0.00 C ATOM 322 C LYS A 21 -12.927 9.677 -11.762 1.00 0.00 C ATOM 323 O LYS A 21 -13.401 9.844 -12.884 1.00 0.00 O ATOM 324 CB LYS A 21 -11.401 11.669 -12.203 1.00 0.00 C ATOM 325 CG LYS A 21 -12.406 12.729 -12.673 1.00 0.00 C ATOM 326 CD LYS A 21 -11.864 13.366 -13.959 1.00 0.00 C ATOM 327 CE LYS A 21 -12.825 14.430 -14.506 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.357 14.977 -15.796 1.00 0.00 N ATOM 0 H LYS A 21 -9.949 10.127 -11.132 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.488 11.234 -10.382 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.526 12.175 -11.794 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.064 11.100 -13.069 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.380 12.275 -12.855 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.547 13.488 -11.903 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.892 13.819 -13.761 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.708 12.593 -14.712 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -13.816 13.994 -14.633 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.923 15.239 -13.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.031 15.693 -16.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -11.422 15.415 -15.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.288 14.209 -16.494 1.00 0.00 H new ATOM 342 N SER A 22 -13.235 8.616 -11.019 1.00 0.00 N ATOM 343 CA SER A 22 -14.046 7.484 -11.431 1.00 0.00 C ATOM 344 C SER A 22 -14.099 6.511 -10.251 1.00 0.00 C ATOM 345 O SER A 22 -15.173 6.235 -9.724 1.00 0.00 O ATOM 346 CB SER A 22 -13.481 6.827 -12.701 1.00 0.00 C ATOM 347 OG SER A 22 -12.092 6.599 -12.579 1.00 0.00 O ATOM 0 H SER A 22 -12.904 8.523 -10.059 1.00 0.00 H new ATOM 0 HA SER A 22 -15.055 7.805 -11.690 1.00 0.00 H new ATOM 0 HB2 SER A 22 -13.993 5.883 -12.885 1.00 0.00 H new ATOM 0 HB3 SER A 22 -13.674 7.467 -13.562 1.00 0.00 H new ATOM 0 HG SER A 22 -11.603 7.406 -12.844 1.00 0.00 H new ATOM 353 N LEU A 23 -12.938 6.030 -9.791 1.00 0.00 N ATOM 354 CA LEU A 23 -12.868 5.141 -8.632 1.00 0.00 C ATOM 355 C LEU A 23 -13.333 5.825 -7.336 1.00 0.00 C ATOM 356 O LEU A 23 -13.790 5.159 -6.399 1.00 0.00 O ATOM 357 CB LEU A 23 -11.444 4.580 -8.506 1.00 0.00 C ATOM 358 CG LEU A 23 -11.227 3.632 -7.319 1.00 0.00 C ATOM 359 CD1 LEU A 23 -12.184 2.436 -7.320 1.00 0.00 C ATOM 360 CD2 LEU A 23 -9.789 3.106 -7.350 1.00 0.00 C ATOM 0 H LEU A 23 -12.032 6.244 -10.208 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.561 4.315 -8.791 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.195 4.051 -9.426 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.747 5.413 -8.419 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.424 4.208 -6.415 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.978 1.805 -6.455 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.213 2.793 -7.272 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.043 1.858 -8.233 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.630 2.432 -6.508 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.618 2.569 -8.283 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.094 3.943 -7.281 1.00 0.00 H new ATOM 372 N GLY A 24 -13.188 7.150 -7.247 1.00 0.00 N ATOM 373 CA GLY A 24 -13.538 7.886 -6.044 1.00 0.00 C ATOM 374 C GLY A 24 -12.511 7.625 -4.948 1.00 0.00 C ATOM 375 O GLY A 24 -12.864 7.419 -3.790 1.00 0.00 O ATOM 0 H GLY A 24 -12.828 7.732 -8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.584 8.953 -6.262 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.529 7.588 -5.702 1.00 0.00 H new ATOM 379 N VAL A 25 -11.233 7.661 -5.330 1.00 0.00 N ATOM 380 CA VAL A 25 -10.084 7.624 -4.431 1.00 0.00 C ATOM 381 C VAL A 25 -9.392 8.992 -4.540 1.00 0.00 C ATOM 382 O VAL A 25 -8.175 9.124 -4.637 1.00 0.00 O ATOM 383 CB VAL A 25 -9.259 6.355 -4.757 1.00 0.00 C ATOM 384 CG1 VAL A 25 -7.799 6.345 -4.297 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.950 5.166 -4.085 1.00 0.00 C ATOM 0 H VAL A 25 -10.963 7.719 -6.312 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.315 7.511 -3.372 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.224 6.313 -5.846 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.333 5.403 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.265 7.172 -4.764 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.758 6.453 -3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -9.392 4.254 -4.296 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.987 5.328 -3.008 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.964 5.068 -4.472 1.00 0.00 H new ATOM 395 N GLY A 26 -10.214 10.044 -4.538 1.00 0.00 N ATOM 396 CA GLY A 26 -9.764 11.422 -4.576 1.00 0.00 C ATOM 397 C GLY A 26 -10.807 12.291 -5.262 1.00 0.00 C ATOM 398 O GLY A 26 -11.468 13.092 -4.610 1.00 0.00 O ATOM 0 H GLY A 26 -11.229 9.951 -4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.587 11.783 -3.563 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.815 11.489 -5.109 1.00 0.00 H new ATOM 402 N PHE A 27 -10.922 12.160 -6.589 1.00 0.00 N ATOM 403 CA PHE A 27 -11.777 13.005 -7.427 1.00 0.00 C ATOM 404 C PHE A 27 -11.469 14.504 -7.239 1.00 0.00 C ATOM 405 O PHE A 27 -12.301 15.352 -7.546 1.00 0.00 O ATOM 406 CB PHE A 27 -13.262 12.672 -7.170 1.00 0.00 C ATOM 407 CG PHE A 27 -14.076 12.380 -8.420 1.00 0.00 C ATOM 408 CD1 PHE A 27 -14.374 13.413 -9.328 1.00 0.00 C ATOM 409 CD2 PHE A 27 -14.565 11.082 -8.664 1.00 0.00 C ATOM 410 CE1 PHE A 27 -15.137 13.146 -10.478 1.00 0.00 C ATOM 411 CE2 PHE A 27 -15.341 10.819 -9.805 1.00 0.00 C ATOM 412 CZ PHE A 27 -15.611 11.847 -10.723 1.00 0.00 C ATOM 0 H PHE A 27 -10.414 11.451 -7.118 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.560 12.786 -8.473 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -13.317 11.808 -6.508 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -13.721 13.508 -6.642 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.015 14.414 -9.141 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -14.342 10.285 -7.970 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -15.359 13.941 -11.174 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -15.730 9.826 -9.976 1.00 0.00 H new ATOM 0 HZ PHE A 27 -16.182 11.639 -11.616 1.00 0.00 H new ATOM 422 N ALA A 28 -10.272 14.817 -6.728 1.00 0.00 N ATOM 423 CA ALA A 28 -9.849 16.125 -6.242 1.00 0.00 C ATOM 424 C ALA A 28 -8.493 15.944 -5.559 1.00 0.00 C ATOM 425 O ALA A 28 -7.471 16.390 -6.065 1.00 0.00 O ATOM 426 CB ALA A 28 -10.870 16.716 -5.256 1.00 0.00 C ATOM 0 H ALA A 28 -9.533 14.119 -6.640 1.00 0.00 H new ATOM 0 HA ALA A 28 -9.775 16.823 -7.076 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.523 17.691 -4.914 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.833 16.828 -5.753 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.978 16.049 -4.401 1.00 0.00 H new ATOM 432 N THR A 29 -8.463 15.226 -4.435 1.00 0.00 N ATOM 433 CA THR A 29 -7.270 15.025 -3.622 1.00 0.00 C ATOM 434 C THR A 29 -6.112 14.476 -4.456 1.00 0.00 C ATOM 435 O THR A 29 -4.968 14.924 -4.353 1.00 0.00 O ATOM 436 CB THR A 29 -7.642 14.067 -2.478 1.00 0.00 C ATOM 437 OG1 THR A 29 -8.986 14.325 -2.097 1.00 0.00 O ATOM 438 CG2 THR A 29 -6.693 14.237 -1.286 1.00 0.00 C ATOM 0 H THR A 29 -9.288 14.759 -4.059 1.00 0.00 H new ATOM 0 HA THR A 29 -6.928 15.977 -3.217 1.00 0.00 H new ATOM 0 HB THR A 29 -7.546 13.036 -2.818 1.00 0.00 H new ATOM 0 HG1 THR A 29 -9.241 13.721 -1.369 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.979 13.547 -0.492 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.671 14.024 -1.601 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.753 15.261 -0.917 1.00 0.00 H new ATOM 446 N ARG A 30 -6.408 13.496 -5.313 1.00 0.00 N ATOM 447 CA ARG A 30 -5.376 12.878 -6.121 1.00 0.00 C ATOM 448 C ARG A 30 -4.770 13.854 -7.135 1.00 0.00 C ATOM 449 O ARG A 30 -3.719 13.543 -7.673 1.00 0.00 O ATOM 450 CB ARG A 30 -5.864 11.571 -6.770 1.00 0.00 C ATOM 451 CG ARG A 30 -4.730 10.530 -6.779 1.00 0.00 C ATOM 452 CD ARG A 30 -4.589 9.837 -5.409 1.00 0.00 C ATOM 453 NE ARG A 30 -3.195 9.451 -5.125 1.00 0.00 N ATOM 454 CZ ARG A 30 -2.784 8.698 -4.093 1.00 0.00 C ATOM 455 NH1 ARG A 30 -3.648 7.940 -3.420 1.00 0.00 N ATOM 456 NH2 ARG A 30 -1.495 8.724 -3.747 1.00 0.00 N ATOM 0 H ARG A 30 -7.346 13.122 -5.458 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.564 12.604 -5.447 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -6.722 11.181 -6.221 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -6.199 11.765 -7.789 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -4.927 9.783 -7.548 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -3.790 11.016 -7.041 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.946 10.506 -4.626 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -5.223 8.950 -5.385 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.479 9.786 -5.770 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -4.632 7.928 -3.688 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.325 7.371 -2.637 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -0.840 9.310 -4.264 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -1.165 8.158 -2.965 1.00 0.00 H new ATOM 470 N GLN A 31 -5.358 15.034 -7.373 1.00 0.00 N ATOM 471 CA GLN A 31 -4.711 16.052 -8.198 1.00 0.00 C ATOM 472 C GLN A 31 -3.365 16.495 -7.615 1.00 0.00 C ATOM 473 O GLN A 31 -2.512 16.955 -8.373 1.00 0.00 O ATOM 474 CB GLN A 31 -5.654 17.241 -8.460 1.00 0.00 C ATOM 475 CG GLN A 31 -6.972 16.857 -9.161 1.00 0.00 C ATOM 476 CD GLN A 31 -6.716 16.115 -10.465 1.00 0.00 C ATOM 477 OE1 GLN A 31 -6.419 14.827 -10.353 1.00 0.00 O flip ATOM 478 NE2 GLN A 31 -6.745 16.700 -11.543 1.00 0.00 N flip ATOM 0 H GLN A 31 -6.272 15.302 -7.008 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.491 15.598 -9.164 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.887 17.722 -7.510 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -5.132 17.977 -9.071 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -7.569 16.232 -8.497 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -7.554 17.757 -9.361 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -6.979 17.692 -11.579 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -6.535 16.194 -12.404 1.00 0.00 H new ATOM 487 N VAL A 32 -3.160 16.322 -6.302 1.00 0.00 N ATOM 488 CA VAL A 32 -1.851 16.450 -5.666 1.00 0.00 C ATOM 489 C VAL A 32 -1.322 15.066 -5.252 1.00 0.00 C ATOM 490 O VAL A 32 -0.141 14.750 -5.418 1.00 0.00 O ATOM 491 CB VAL A 32 -1.930 17.482 -4.524 1.00 0.00 C ATOM 492 CG1 VAL A 32 -2.949 17.140 -3.433 1.00 0.00 C ATOM 493 CG2 VAL A 32 -0.563 17.719 -3.876 1.00 0.00 C ATOM 0 H VAL A 32 -3.908 16.087 -5.650 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.114 16.838 -6.368 1.00 0.00 H new ATOM 0 HB VAL A 32 -2.274 18.394 -5.012 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.939 17.918 -2.669 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.944 17.075 -3.872 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.689 16.183 -2.980 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.662 18.453 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.188 16.782 -3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.135 18.091 -4.626 1.00 0.00 H new ATOM 503 N GLY A 33 -2.207 14.199 -4.747 1.00 0.00 N ATOM 504 CA GLY A 33 -1.846 12.851 -4.326 1.00 0.00 C ATOM 505 C GLY A 33 -1.317 11.969 -5.465 1.00 0.00 C ATOM 506 O GLY A 33 -0.811 10.873 -5.204 1.00 0.00 O ATOM 0 H GLY A 33 -3.195 14.418 -4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.088 12.915 -3.546 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.719 12.372 -3.883 1.00 0.00 H new ATOM 510 N ASN A 34 -1.500 12.381 -6.721 1.00 0.00 N ATOM 511 CA ASN A 34 -0.891 11.783 -7.904 1.00 0.00 C ATOM 512 C ASN A 34 0.634 11.810 -7.770 1.00 0.00 C ATOM 513 O ASN A 34 1.291 10.797 -7.997 1.00 0.00 O ATOM 514 CB ASN A 34 -1.382 12.474 -9.203 1.00 0.00 C ATOM 515 CG ASN A 34 -1.329 14.010 -9.188 1.00 0.00 C ATOM 516 OD1 ASN A 34 -0.643 14.603 -8.363 1.00 0.00 O ATOM 517 ND2 ASN A 34 -2.078 14.698 -10.043 1.00 0.00 N ATOM 0 H ASN A 34 -2.102 13.173 -6.948 1.00 0.00 H new ATOM 0 HA ASN A 34 -1.204 10.741 -7.977 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -0.780 12.114 -10.037 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.409 12.164 -9.394 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -2.081 15.718 -10.012 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.650 14.207 -10.730 1.00 0.00 H new ATOM 524 N MET A 35 1.185 12.960 -7.380 1.00 0.00 N ATOM 525 CA MET A 35 2.610 13.216 -7.314 1.00 0.00 C ATOM 526 C MET A 35 3.144 12.895 -5.921 1.00 0.00 C ATOM 527 O MET A 35 4.236 12.343 -5.793 1.00 0.00 O ATOM 528 CB MET A 35 2.857 14.683 -7.689 1.00 0.00 C ATOM 529 CG MET A 35 4.349 15.005 -7.826 1.00 0.00 C ATOM 530 SD MET A 35 4.689 16.703 -8.366 1.00 0.00 S ATOM 531 CE MET A 35 6.493 16.617 -8.507 1.00 0.00 C ATOM 0 H MET A 35 0.625 13.762 -7.093 1.00 0.00 H new ATOM 0 HA MET A 35 3.142 12.574 -8.016 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.352 14.905 -8.629 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.416 15.329 -6.930 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.837 14.835 -6.866 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.796 14.311 -8.538 1.00 0.00 H new ATOM 0 HE1 MET A 35 6.879 17.583 -8.832 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.922 16.362 -7.538 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.765 15.854 -9.236 1.00 0.00 H new ATOM 541 N THR A 36 2.407 13.283 -4.877 1.00 0.00 N ATOM 542 CA THR A 36 2.896 13.270 -3.503 1.00 0.00 C ATOM 543 C THR A 36 2.970 11.850 -2.915 1.00 0.00 C ATOM 544 O THR A 36 2.270 11.527 -1.955 1.00 0.00 O ATOM 545 CB THR A 36 2.032 14.244 -2.685 1.00 0.00 C ATOM 546 OG1 THR A 36 1.956 15.455 -3.408 1.00 0.00 O ATOM 547 CG2 THR A 36 2.612 14.585 -1.311 1.00 0.00 C ATOM 0 H THR A 36 1.447 13.617 -4.966 1.00 0.00 H new ATOM 0 HA THR A 36 3.930 13.612 -3.469 1.00 0.00 H new ATOM 0 HB THR A 36 1.069 13.759 -2.527 1.00 0.00 H new ATOM 0 HG1 THR A 36 1.267 15.379 -4.101 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.945 15.277 -0.796 1.00 0.00 H new ATOM 0 HG22 THR A 36 2.714 13.673 -0.723 1.00 0.00 H new ATOM 0 HG23 THR A 36 3.591 15.049 -1.434 1.00 0.00 H new ATOM 555 N LYS A 37 3.857 11.009 -3.459 1.00 0.00 N ATOM 556 CA LYS A 37 4.203 9.699 -2.920 1.00 0.00 C ATOM 557 C LYS A 37 5.668 9.357 -3.259 1.00 0.00 C ATOM 558 O LYS A 37 5.927 8.343 -3.915 1.00 0.00 O ATOM 559 CB LYS A 37 3.208 8.657 -3.460 1.00 0.00 C ATOM 560 CG LYS A 37 3.206 7.403 -2.580 1.00 0.00 C ATOM 561 CD LYS A 37 2.399 6.281 -3.247 1.00 0.00 C ATOM 562 CE LYS A 37 2.161 5.069 -2.332 1.00 0.00 C ATOM 563 NZ LYS A 37 3.337 4.695 -1.517 1.00 0.00 N ATOM 0 H LYS A 37 4.367 11.233 -4.313 1.00 0.00 H new ATOM 0 HA LYS A 37 4.127 9.700 -1.833 1.00 0.00 H new ATOM 0 HB2 LYS A 37 2.206 9.086 -3.493 1.00 0.00 H new ATOM 0 HB3 LYS A 37 3.474 8.389 -4.483 1.00 0.00 H new ATOM 0 HG2 LYS A 37 4.230 7.070 -2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 37 2.779 7.636 -1.605 1.00 0.00 H new ATOM 0 HD2 LYS A 37 1.436 6.678 -3.568 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.923 5.951 -4.144 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.325 5.286 -1.668 1.00 0.00 H new ATOM 0 HE3 LYS A 37 1.869 4.216 -2.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 3.047 4.025 -0.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 4.053 4.250 -2.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.739 5.547 -1.076 1.00 0.00 H new ATOM 577 N PRO A 38 6.629 10.195 -2.827 1.00 0.00 N ATOM 578 CA PRO A 38 8.008 10.139 -3.277 1.00 0.00 C ATOM 579 C PRO A 38 8.694 8.846 -2.847 1.00 0.00 C ATOM 580 O PRO A 38 9.382 8.246 -3.662 1.00 0.00 O ATOM 581 CB PRO A 38 8.697 11.377 -2.695 1.00 0.00 C ATOM 582 CG PRO A 38 7.871 11.692 -1.451 1.00 0.00 C ATOM 583 CD PRO A 38 6.462 11.269 -1.865 1.00 0.00 C ATOM 0 HA PRO A 38 8.065 10.140 -4.366 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.739 11.176 -2.445 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.693 12.208 -3.401 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.221 11.136 -0.581 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.916 12.750 -1.192 1.00 0.00 H new ATOM 0 HD2 PRO A 38 5.887 10.933 -1.002 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.918 12.105 -2.305 1.00 0.00 H new ATOM 591 N THR A 39 8.522 8.416 -1.594 1.00 0.00 N ATOM 592 CA THR A 39 9.129 7.198 -1.072 1.00 0.00 C ATOM 593 C THR A 39 8.049 6.125 -0.913 1.00 0.00 C ATOM 594 O THR A 39 6.853 6.417 -0.831 1.00 0.00 O ATOM 595 CB THR A 39 9.879 7.530 0.233 1.00 0.00 C ATOM 596 OG1 THR A 39 11.033 8.280 -0.092 1.00 0.00 O ATOM 597 CG2 THR A 39 10.368 6.317 1.028 1.00 0.00 C ATOM 0 H THR A 39 7.951 8.912 -0.910 1.00 0.00 H new ATOM 0 HA THR A 39 9.868 6.791 -1.761 1.00 0.00 H new ATOM 0 HB THR A 39 9.157 8.061 0.853 1.00 0.00 H new ATOM 0 HG1 THR A 39 11.521 8.501 0.728 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.883 6.655 1.928 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.516 5.698 1.308 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.055 5.733 0.415 1.00 0.00 H new ATOM 605 N THR A 40 8.456 4.855 -0.907 1.00 0.00 N ATOM 606 CA THR A 40 7.655 3.749 -0.403 1.00 0.00 C ATOM 607 C THR A 40 8.613 2.711 0.179 1.00 0.00 C ATOM 608 O THR A 40 9.435 2.153 -0.546 1.00 0.00 O ATOM 609 CB THR A 40 6.768 3.162 -1.512 1.00 0.00 C ATOM 610 OG1 THR A 40 5.839 4.142 -1.935 1.00 0.00 O ATOM 611 CG2 THR A 40 5.954 1.967 -1.013 1.00 0.00 C ATOM 0 H THR A 40 9.368 4.566 -1.259 1.00 0.00 H new ATOM 0 HA THR A 40 6.974 4.091 0.376 1.00 0.00 H new ATOM 0 HB THR A 40 7.428 2.846 -2.320 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.096 4.476 -2.820 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.340 1.580 -1.826 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.630 1.186 -0.666 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.311 2.282 -0.191 1.00 0.00 H new ATOM 619 N ILE A 41 8.519 2.460 1.484 1.00 0.00 N ATOM 620 CA ILE A 41 9.240 1.377 2.131 1.00 0.00 C ATOM 621 C ILE A 41 8.457 0.085 1.876 1.00 0.00 C ATOM 622 O ILE A 41 7.228 0.088 1.944 1.00 0.00 O ATOM 623 CB ILE A 41 9.418 1.700 3.624 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.385 2.880 3.821 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.905 0.473 4.401 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.485 3.344 5.279 1.00 0.00 C ATOM 0 H ILE A 41 7.938 3.006 2.120 1.00 0.00 H new ATOM 0 HA ILE A 41 10.244 1.251 1.726 1.00 0.00 H new ATOM 0 HB ILE A 41 8.443 1.986 4.018 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.376 2.592 3.470 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.058 3.716 3.202 1.00 0.00 H new ATOM 0 HG21 ILE A 41 10.022 0.732 5.453 1.00 0.00 H new ATOM 0 HG22 ILE A 41 9.177 -0.332 4.304 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.864 0.145 3.999 1.00 0.00 H new ATOM 0 HD11 ILE A 41 11.183 4.178 5.348 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.503 3.663 5.628 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.841 2.521 5.899 1.00 0.00 H new ATOM 638 N ILE A 42 9.164 -1.003 1.557 1.00 0.00 N ATOM 639 CA ILE A 42 8.620 -2.338 1.361 1.00 0.00 C ATOM 640 C ILE A 42 9.484 -3.300 2.187 1.00 0.00 C ATOM 641 O ILE A 42 10.504 -3.810 1.713 1.00 0.00 O ATOM 642 CB ILE A 42 8.612 -2.697 -0.139 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.823 -1.710 -1.021 1.00 0.00 C ATOM 644 CG2 ILE A 42 8.060 -4.112 -0.345 1.00 0.00 C ATOM 645 CD1 ILE A 42 6.304 -1.776 -0.834 1.00 0.00 C ATOM 0 H ILE A 42 10.175 -0.969 1.424 1.00 0.00 H new ATOM 0 HA ILE A 42 7.584 -2.402 1.694 1.00 0.00 H new ATOM 0 HB ILE A 42 9.653 -2.637 -0.458 1.00 0.00 H new ATOM 0 HG12 ILE A 42 8.161 -0.697 -0.804 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.058 -1.907 -2.067 1.00 0.00 H new ATOM 0 HG21 ILE A 42 8.060 -4.351 -1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.686 -4.828 0.188 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.041 -4.164 0.038 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.825 -1.050 -1.491 1.00 0.00 H new ATOM 0 HD12 ILE A 42 5.950 -2.777 -1.080 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.055 -1.548 0.202 1.00 0.00 H new ATOM 657 N GLU A 43 9.081 -3.534 3.437 1.00 0.00 N ATOM 658 CA GLU A 43 9.776 -4.433 4.345 1.00 0.00 C ATOM 659 C GLU A 43 9.170 -5.824 4.183 1.00 0.00 C ATOM 660 O GLU A 43 8.058 -6.076 4.641 1.00 0.00 O ATOM 661 CB GLU A 43 9.616 -3.930 5.784 1.00 0.00 C ATOM 662 CG GLU A 43 10.497 -2.711 6.094 1.00 0.00 C ATOM 663 CD GLU A 43 9.990 -1.940 7.308 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.155 -2.480 8.069 1.00 0.00 O ATOM 665 OE2 GLU A 43 10.338 -0.746 7.452 1.00 0.00 O ATOM 0 H GLU A 43 8.255 -3.098 3.846 1.00 0.00 H new ATOM 0 HA GLU A 43 10.841 -4.471 4.118 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.572 -3.671 5.959 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.864 -4.736 6.475 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.521 -3.039 6.273 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.521 -2.050 5.228 1.00 0.00 H new ATOM 672 N VAL A 44 9.885 -6.734 3.523 1.00 0.00 N ATOM 673 CA VAL A 44 9.504 -8.138 3.517 1.00 0.00 C ATOM 674 C VAL A 44 9.644 -8.687 4.939 1.00 0.00 C ATOM 675 O VAL A 44 10.580 -8.329 5.652 1.00 0.00 O ATOM 676 CB VAL A 44 10.353 -8.909 2.499 1.00 0.00 C ATOM 677 CG1 VAL A 44 10.120 -10.422 2.590 1.00 0.00 C ATOM 678 CG2 VAL A 44 10.016 -8.441 1.073 1.00 0.00 C ATOM 0 H VAL A 44 10.727 -6.521 2.989 1.00 0.00 H new ATOM 0 HA VAL A 44 8.465 -8.257 3.209 1.00 0.00 H new ATOM 0 HB VAL A 44 11.399 -8.706 2.730 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.740 -10.931 1.852 1.00 0.00 H new ATOM 0 HG12 VAL A 44 10.383 -10.771 3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.070 -10.641 2.394 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.623 -8.993 0.356 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.960 -8.622 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.225 -7.375 0.981 1.00 0.00 H new ATOM 688 N ASN A 45 8.701 -9.537 5.346 1.00 0.00 N ATOM 689 CA ASN A 45 8.679 -10.225 6.631 1.00 0.00 C ATOM 690 C ASN A 45 8.566 -11.732 6.358 1.00 0.00 C ATOM 691 O ASN A 45 8.298 -12.117 5.223 1.00 0.00 O ATOM 692 CB ASN A 45 7.512 -9.652 7.446 1.00 0.00 C ATOM 693 CG ASN A 45 7.435 -10.186 8.873 1.00 0.00 C ATOM 694 OD1 ASN A 45 8.375 -10.792 9.380 1.00 0.00 O ATOM 695 ND2 ASN A 45 6.318 -9.941 9.550 1.00 0.00 N ATOM 0 H ASN A 45 7.899 -9.773 4.762 1.00 0.00 H new ATOM 0 HA ASN A 45 9.586 -10.074 7.216 1.00 0.00 H new ATOM 0 HB2 ASN A 45 7.603 -8.566 7.479 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.577 -9.878 6.933 1.00 0.00 H new ATOM 0 HD21 ASN A 45 6.226 -10.259 10.515 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.552 -9.435 9.105 1.00 0.00 H new ATOM 702 N GLY A 46 8.821 -12.579 7.361 1.00 0.00 N ATOM 703 CA GLY A 46 8.985 -14.031 7.258 1.00 0.00 C ATOM 704 C GLY A 46 8.286 -14.681 6.060 1.00 0.00 C ATOM 705 O GLY A 46 8.945 -15.206 5.163 1.00 0.00 O ATOM 0 H GLY A 46 8.924 -12.250 8.321 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.050 -14.258 7.204 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.607 -14.489 8.172 1.00 0.00 H new ATOM 709 N ASP A 47 6.953 -14.655 6.062 1.00 0.00 N ATOM 710 CA ASP A 47 6.068 -15.219 5.052 1.00 0.00 C ATOM 711 C ASP A 47 5.214 -14.120 4.398 1.00 0.00 C ATOM 712 O ASP A 47 4.193 -14.432 3.771 1.00 0.00 O ATOM 713 CB ASP A 47 5.139 -16.202 5.778 1.00 0.00 C ATOM 714 CG ASP A 47 4.183 -15.460 6.710 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.655 -14.504 7.370 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.989 -15.821 6.703 1.00 0.00 O ATOM 0 H ASP A 47 6.433 -14.210 6.819 1.00 0.00 H new ATOM 0 HA ASP A 47 6.651 -15.706 4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.569 -16.777 5.048 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.733 -16.914 6.351 1.00 0.00 H new ATOM 721 N THR A 48 5.601 -12.857 4.593 1.00 0.00 N ATOM 722 CA THR A 48 4.733 -11.685 4.604 1.00 0.00 C ATOM 723 C THR A 48 5.482 -10.482 4.026 1.00 0.00 C ATOM 724 O THR A 48 6.655 -10.573 3.672 1.00 0.00 O ATOM 725 CB THR A 48 4.321 -11.392 6.068 1.00 0.00 C ATOM 726 OG1 THR A 48 5.243 -11.949 6.986 1.00 0.00 O ATOM 727 CG2 THR A 48 2.938 -11.943 6.403 1.00 0.00 C ATOM 0 H THR A 48 6.579 -12.616 4.755 1.00 0.00 H new ATOM 0 HA THR A 48 3.847 -11.871 3.998 1.00 0.00 H new ATOM 0 HB THR A 48 4.308 -10.306 6.157 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.878 -12.782 7.352 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.696 -11.712 7.440 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.196 -11.488 5.747 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.933 -13.024 6.262 1.00 0.00 H new ATOM 735 N VAL A 49 4.829 -9.323 3.956 1.00 0.00 N ATOM 736 CA VAL A 49 5.495 -8.072 3.637 1.00 0.00 C ATOM 737 C VAL A 49 4.634 -6.929 4.168 1.00 0.00 C ATOM 738 O VAL A 49 3.421 -7.083 4.282 1.00 0.00 O ATOM 739 CB VAL A 49 5.781 -8.012 2.122 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.580 -8.491 1.306 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.223 -6.627 1.636 1.00 0.00 C ATOM 0 H VAL A 49 3.826 -9.230 4.119 1.00 0.00 H new ATOM 0 HA VAL A 49 6.469 -7.987 4.119 1.00 0.00 H new ATOM 0 HB VAL A 49 6.620 -8.689 1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.817 -8.435 0.243 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.347 -9.522 1.572 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.719 -7.858 1.520 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.406 -6.660 0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.439 -5.900 1.848 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.138 -6.335 2.152 1.00 0.00 H new ATOM 751 N ILE A 50 5.253 -5.807 4.543 1.00 0.00 N ATOM 752 CA ILE A 50 4.560 -4.617 5.009 1.00 0.00 C ATOM 753 C ILE A 50 4.998 -3.431 4.151 1.00 0.00 C ATOM 754 O ILE A 50 6.195 -3.216 3.944 1.00 0.00 O ATOM 755 CB ILE A 50 4.740 -4.435 6.533 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.929 -3.239 7.051 1.00 0.00 C ATOM 757 CG2 ILE A 50 6.200 -4.284 6.966 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.934 -3.139 8.578 1.00 0.00 C ATOM 0 H ILE A 50 6.268 -5.704 4.529 1.00 0.00 H new ATOM 0 HA ILE A 50 3.481 -4.709 4.881 1.00 0.00 H new ATOM 0 HB ILE A 50 4.365 -5.357 6.977 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.336 -2.320 6.629 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.901 -3.323 6.700 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.248 -4.160 8.048 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.759 -5.174 6.677 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.635 -3.410 6.481 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.345 -2.276 8.888 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.502 -4.045 9.003 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.959 -3.025 8.932 1.00 0.00 H new ATOM 770 N ILE A 51 4.011 -2.712 3.602 1.00 0.00 N ATOM 771 CA ILE A 51 4.235 -1.513 2.806 1.00 0.00 C ATOM 772 C ILE A 51 4.115 -0.307 3.730 1.00 0.00 C ATOM 773 O ILE A 51 3.219 -0.281 4.571 1.00 0.00 O ATOM 774 CB ILE A 51 3.265 -1.434 1.603 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.448 -0.098 0.858 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.791 -1.625 1.997 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.827 -0.098 -0.543 1.00 0.00 C ATOM 0 H ILE A 51 3.025 -2.955 3.703 1.00 0.00 H new ATOM 0 HA ILE A 51 5.234 -1.535 2.370 1.00 0.00 H new ATOM 0 HB ILE A 51 3.520 -2.263 0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.001 0.703 1.447 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.512 0.122 0.777 1.00 0.00 H new ATOM 0 HG21 ILE A 51 1.165 -1.558 1.107 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.662 -2.604 2.459 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.500 -0.849 2.705 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.991 0.871 -1.014 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.291 -0.878 -1.147 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.756 -0.288 -0.466 1.00 0.00 H new ATOM 789 N LYS A 52 5.006 0.674 3.558 1.00 0.00 N ATOM 790 CA LYS A 52 5.007 1.946 4.259 1.00 0.00 C ATOM 791 C LYS A 52 5.076 3.073 3.225 1.00 0.00 C ATOM 792 O LYS A 52 6.144 3.411 2.708 1.00 0.00 O ATOM 793 CB LYS A 52 6.156 1.981 5.282 1.00 0.00 C ATOM 794 CG LYS A 52 5.635 1.899 6.719 1.00 0.00 C ATOM 795 CD LYS A 52 6.747 1.646 7.741 1.00 0.00 C ATOM 796 CE LYS A 52 7.042 0.140 7.825 1.00 0.00 C ATOM 797 NZ LYS A 52 8.172 -0.177 8.718 1.00 0.00 N ATOM 0 H LYS A 52 5.777 0.592 2.895 1.00 0.00 H new ATOM 0 HA LYS A 52 4.089 2.082 4.831 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.837 1.151 5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.730 2.899 5.154 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.123 2.829 6.969 1.00 0.00 H new ATOM 0 HG3 LYS A 52 4.896 1.100 6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.648 2.187 7.453 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.448 2.023 8.719 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.151 -0.380 8.177 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.258 -0.239 6.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 8.197 -1.201 8.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 9.062 0.119 8.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 8.054 0.328 9.620 1.00 0.00 H new ATOM 811 N THR A 53 3.917 3.657 2.921 1.00 0.00 N ATOM 812 CA THR A 53 3.787 4.846 2.097 1.00 0.00 C ATOM 813 C THR A 53 4.272 6.041 2.914 1.00 0.00 C ATOM 814 O THR A 53 3.483 6.756 3.529 1.00 0.00 O ATOM 815 CB THR A 53 2.327 4.971 1.633 1.00 0.00 C ATOM 816 OG1 THR A 53 2.043 3.973 0.675 1.00 0.00 O ATOM 817 CG2 THR A 53 1.944 6.314 1.014 1.00 0.00 C ATOM 0 H THR A 53 3.021 3.301 3.253 1.00 0.00 H new ATOM 0 HA THR A 53 4.398 4.795 1.196 1.00 0.00 H new ATOM 0 HB THR A 53 1.744 4.864 2.548 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.111 4.055 0.383 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.894 6.294 0.722 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.103 7.109 1.743 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.561 6.499 0.135 1.00 0.00 H new ATOM 825 N GLN A 54 5.589 6.244 2.903 1.00 0.00 N ATOM 826 CA GLN A 54 6.223 7.418 3.469 1.00 0.00 C ATOM 827 C GLN A 54 6.185 8.548 2.440 1.00 0.00 C ATOM 828 O GLN A 54 6.815 8.466 1.385 1.00 0.00 O ATOM 829 CB GLN A 54 7.647 7.070 3.903 1.00 0.00 C ATOM 830 CG GLN A 54 7.646 6.069 5.069 1.00 0.00 C ATOM 831 CD GLN A 54 7.856 6.734 6.427 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.896 6.543 7.047 1.00 0.00 O ATOM 833 NE2 GLN A 54 6.897 7.515 6.916 1.00 0.00 N ATOM 0 H GLN A 54 6.249 5.583 2.493 1.00 0.00 H new ATOM 0 HA GLN A 54 5.689 7.758 4.356 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.194 6.649 3.060 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.171 7.978 4.201 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.698 5.530 5.077 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.431 5.330 4.907 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.039 7.662 6.385 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.020 7.967 7.822 1.00 0.00 H new ATOM 842 N SER A 55 5.422 9.596 2.746 1.00 0.00 N ATOM 843 CA SER A 55 5.322 10.811 1.956 1.00 0.00 C ATOM 844 C SER A 55 5.296 12.004 2.909 1.00 0.00 C ATOM 845 O SER A 55 5.477 11.834 4.115 1.00 0.00 O ATOM 846 CB SER A 55 4.059 10.744 1.089 1.00 0.00 C ATOM 847 OG SER A 55 3.996 11.833 0.190 1.00 0.00 O ATOM 0 H SER A 55 4.838 9.618 3.582 1.00 0.00 H new ATOM 0 HA SER A 55 6.177 10.921 1.289 1.00 0.00 H new ATOM 0 HB2 SER A 55 4.047 9.808 0.531 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.176 10.745 1.728 1.00 0.00 H new ATOM 0 HG SER A 55 3.306 11.661 -0.484 1.00 0.00 H new ATOM 853 N THR A 56 5.055 13.197 2.370 1.00 0.00 N ATOM 854 CA THR A 56 4.909 14.412 3.151 1.00 0.00 C ATOM 855 C THR A 56 3.468 14.475 3.664 1.00 0.00 C ATOM 856 O THR A 56 3.178 14.107 4.800 1.00 0.00 O ATOM 857 CB THR A 56 5.283 15.613 2.265 1.00 0.00 C ATOM 858 OG1 THR A 56 4.569 15.551 1.044 1.00 0.00 O ATOM 859 CG2 THR A 56 6.774 15.602 1.919 1.00 0.00 C ATOM 0 H THR A 56 4.955 13.343 1.366 1.00 0.00 H new ATOM 0 HA THR A 56 5.573 14.429 4.016 1.00 0.00 H new ATOM 0 HB THR A 56 5.037 16.517 2.822 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.062 16.380 0.919 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.008 16.462 1.292 1.00 0.00 H new ATOM 0 HG22 THR A 56 7.361 15.651 2.836 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.016 14.685 1.382 1.00 0.00 H new ATOM 867 N PHE A 57 2.556 14.918 2.800 1.00 0.00 N ATOM 868 CA PHE A 57 1.136 14.999 3.098 1.00 0.00 C ATOM 869 C PHE A 57 0.481 13.645 2.847 1.00 0.00 C ATOM 870 O PHE A 57 0.422 13.203 1.702 1.00 0.00 O ATOM 871 CB PHE A 57 0.479 16.090 2.246 1.00 0.00 C ATOM 872 CG PHE A 57 0.739 17.490 2.764 1.00 0.00 C ATOM 873 CD1 PHE A 57 -0.106 18.034 3.751 1.00 0.00 C ATOM 874 CD2 PHE A 57 1.863 18.215 2.333 1.00 0.00 C ATOM 875 CE1 PHE A 57 0.153 19.309 4.278 1.00 0.00 C ATOM 876 CE2 PHE A 57 2.121 19.493 2.862 1.00 0.00 C ATOM 877 CZ PHE A 57 1.266 20.041 3.831 1.00 0.00 C ATOM 0 H PHE A 57 2.792 15.235 1.859 1.00 0.00 H new ATOM 0 HA PHE A 57 1.001 15.262 4.147 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.847 16.014 1.223 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.597 15.916 2.211 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.956 17.468 4.103 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.529 17.791 1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.503 19.727 5.027 1.00 0.00 H new ATOM 0 HE2 PHE A 57 2.979 20.054 2.522 1.00 0.00 H new ATOM 0 HZ PHE A 57 1.463 21.024 4.232 1.00 0.00 H new ATOM 887 N LYS A 58 -0.051 13.036 3.915 1.00 0.00 N ATOM 888 CA LYS A 58 -0.703 11.729 3.937 1.00 0.00 C ATOM 889 C LYS A 58 0.371 10.640 4.001 1.00 0.00 C ATOM 890 O LYS A 58 1.364 10.701 3.283 1.00 0.00 O ATOM 891 CB LYS A 58 -1.659 11.544 2.740 1.00 0.00 C ATOM 892 CG LYS A 58 -2.755 10.488 2.968 1.00 0.00 C ATOM 893 CD LYS A 58 -3.915 10.945 3.871 1.00 0.00 C ATOM 894 CE LYS A 58 -5.056 11.664 3.128 1.00 0.00 C ATOM 895 NZ LYS A 58 -4.648 12.951 2.528 1.00 0.00 N ATOM 0 H LYS A 58 -0.035 13.471 4.837 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.330 11.654 4.826 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.132 12.500 2.515 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.076 11.263 1.863 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.161 10.192 2.001 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.299 9.601 3.407 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.324 10.075 4.384 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.521 11.612 4.638 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.437 11.010 2.343 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.877 11.840 3.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.494 13.505 2.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.069 13.483 3.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.093 12.772 1.667 1.00 0.00 H new ATOM 909 N ASN A 59 0.212 9.659 4.888 1.00 0.00 N ATOM 910 CA ASN A 59 1.039 8.457 4.960 1.00 0.00 C ATOM 911 C ASN A 59 0.057 7.313 5.189 1.00 0.00 C ATOM 912 O ASN A 59 -1.038 7.558 5.696 1.00 0.00 O ATOM 913 CB ASN A 59 2.036 8.515 6.131 1.00 0.00 C ATOM 914 CG ASN A 59 3.392 9.158 5.831 1.00 0.00 C ATOM 915 OD1 ASN A 59 4.426 8.657 6.264 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.423 10.279 5.118 1.00 0.00 N ATOM 0 H ASN A 59 -0.519 9.680 5.599 1.00 0.00 H new ATOM 0 HA ASN A 59 1.631 8.341 4.052 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.571 9.063 6.951 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.209 7.499 6.484 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.314 10.735 4.924 1.00 0.00 H new ATOM 0 HD22 ASN A 59 2.556 10.683 4.765 1.00 0.00 H new ATOM 923 N THR A 60 0.430 6.089 4.815 1.00 0.00 N ATOM 924 CA THR A 60 -0.361 4.884 5.043 1.00 0.00 C ATOM 925 C THR A 60 0.619 3.717 5.182 1.00 0.00 C ATOM 926 O THR A 60 1.721 3.781 4.631 1.00 0.00 O ATOM 927 CB THR A 60 -1.349 4.647 3.880 1.00 0.00 C ATOM 928 OG1 THR A 60 -0.730 4.911 2.635 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.603 5.524 3.972 1.00 0.00 C ATOM 0 H THR A 60 1.311 5.906 4.334 1.00 0.00 H new ATOM 0 HA THR A 60 -0.961 4.984 5.948 1.00 0.00 H new ATOM 0 HB THR A 60 -1.646 3.601 3.956 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.371 4.754 1.911 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.258 5.312 3.127 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.129 5.310 4.902 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.314 6.575 3.952 1.00 0.00 H new ATOM 937 N GLU A 61 0.240 2.657 5.901 1.00 0.00 N ATOM 938 CA GLU A 61 1.016 1.431 5.948 1.00 0.00 C ATOM 939 C GLU A 61 0.122 0.264 6.345 1.00 0.00 C ATOM 940 O GLU A 61 -0.788 0.463 7.144 1.00 0.00 O ATOM 941 CB GLU A 61 2.224 1.574 6.880 1.00 0.00 C ATOM 942 CG GLU A 61 1.952 1.914 8.345 1.00 0.00 C ATOM 943 CD GLU A 61 3.290 2.030 9.069 1.00 0.00 C ATOM 944 OE1 GLU A 61 3.910 0.963 9.294 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.720 3.176 9.296 1.00 0.00 O ATOM 0 H GLU A 61 -0.611 2.632 6.462 1.00 0.00 H new ATOM 0 HA GLU A 61 1.412 1.227 4.953 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.783 0.639 6.851 1.00 0.00 H new ATOM 0 HB3 GLU A 61 2.874 2.347 6.471 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.398 2.849 8.421 1.00 0.00 H new ATOM 0 HG3 GLU A 61 1.337 1.141 8.806 1.00 0.00 H new ATOM 952 N ILE A 62 0.358 -0.918 5.762 1.00 0.00 N ATOM 953 CA ILE A 62 -0.422 -2.131 5.996 1.00 0.00 C ATOM 954 C ILE A 62 0.468 -3.350 5.727 1.00 0.00 C ATOM 955 O ILE A 62 1.296 -3.340 4.811 1.00 0.00 O ATOM 956 CB ILE A 62 -1.699 -2.152 5.118 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.806 -1.175 5.568 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.310 -3.558 5.009 1.00 0.00 C ATOM 959 CD1 ILE A 62 -3.310 -1.381 7.006 1.00 0.00 C ATOM 0 H ILE A 62 1.119 -1.057 5.097 1.00 0.00 H new ATOM 0 HA ILE A 62 -0.756 -2.156 7.033 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.339 -1.820 4.144 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.431 -0.156 5.473 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.651 -1.268 4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.202 -3.520 4.384 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.583 -4.237 4.563 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.579 -3.916 6.003 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.085 -0.648 7.228 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.721 -2.386 7.107 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.482 -1.256 7.703 1.00 0.00 H new ATOM 971 N SER A 63 0.290 -4.395 6.541 1.00 0.00 N ATOM 972 CA SER A 63 0.921 -5.699 6.433 1.00 0.00 C ATOM 973 C SER A 63 0.057 -6.610 5.563 1.00 0.00 C ATOM 974 O SER A 63 -1.157 -6.640 5.759 1.00 0.00 O ATOM 975 CB SER A 63 0.993 -6.275 7.847 1.00 0.00 C ATOM 976 OG SER A 63 -0.277 -6.118 8.459 1.00 0.00 O ATOM 0 H SER A 63 -0.340 -4.342 7.341 1.00 0.00 H new ATOM 0 HA SER A 63 1.912 -5.620 5.986 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.270 -7.329 7.814 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.760 -5.762 8.427 1.00 0.00 H new ATOM 0 HG SER A 63 -0.980 -6.202 7.781 1.00 0.00 H new ATOM 982 N PHE A 64 0.662 -7.377 4.654 1.00 0.00 N ATOM 983 CA PHE A 64 -0.035 -8.309 3.784 1.00 0.00 C ATOM 984 C PHE A 64 0.760 -9.613 3.654 1.00 0.00 C ATOM 985 O PHE A 64 1.992 -9.618 3.689 1.00 0.00 O ATOM 986 CB PHE A 64 -0.363 -7.634 2.442 1.00 0.00 C ATOM 987 CG PHE A 64 0.799 -7.082 1.631 1.00 0.00 C ATOM 988 CD1 PHE A 64 1.426 -5.880 2.011 1.00 0.00 C ATOM 989 CD2 PHE A 64 1.184 -7.711 0.432 1.00 0.00 C ATOM 990 CE1 PHE A 64 2.480 -5.357 1.242 1.00 0.00 C ATOM 991 CE2 PHE A 64 2.189 -7.150 -0.372 1.00 0.00 C ATOM 992 CZ PHE A 64 2.865 -5.995 0.052 1.00 0.00 C ATOM 0 H PHE A 64 1.671 -7.363 4.504 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.993 -8.589 4.222 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.892 -8.358 1.822 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.055 -6.815 2.638 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.096 -5.358 2.897 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.704 -8.630 0.129 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.994 -4.464 1.567 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.442 -7.607 -1.317 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.679 -5.598 -0.536 1.00 0.00 H new ATOM 1002 N LYS A 65 0.030 -10.731 3.560 1.00 0.00 N ATOM 1003 CA LYS A 65 0.560 -12.084 3.493 1.00 0.00 C ATOM 1004 C LYS A 65 0.326 -12.594 2.072 1.00 0.00 C ATOM 1005 O LYS A 65 -0.796 -12.965 1.739 1.00 0.00 O ATOM 1006 CB LYS A 65 -0.144 -12.955 4.560 1.00 0.00 C ATOM 1007 CG LYS A 65 0.449 -14.355 4.828 1.00 0.00 C ATOM 1008 CD LYS A 65 0.916 -15.054 3.552 1.00 0.00 C ATOM 1009 CE LYS A 65 1.537 -16.437 3.750 1.00 0.00 C ATOM 1010 NZ LYS A 65 2.710 -16.566 2.865 1.00 0.00 N ATOM 0 H LYS A 65 -0.989 -10.708 3.528 1.00 0.00 H new ATOM 0 HA LYS A 65 1.628 -12.120 3.706 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.146 -12.403 5.500 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.185 -13.080 4.262 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.290 -14.263 5.515 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.300 -14.973 5.322 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.064 -15.150 2.878 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.645 -14.415 3.054 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.833 -16.572 4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.807 -17.214 3.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.048 -17.550 2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.443 -16.304 1.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.467 -15.936 3.198 1.00 0.00 H new ATOM 1024 N LEU A 66 1.387 -12.677 1.260 1.00 0.00 N ATOM 1025 CA LEU A 66 1.350 -13.364 -0.027 1.00 0.00 C ATOM 1026 C LEU A 66 0.747 -14.774 0.115 1.00 0.00 C ATOM 1027 O LEU A 66 1.393 -15.688 0.638 1.00 0.00 O ATOM 1028 CB LEU A 66 2.739 -13.395 -0.686 1.00 0.00 C ATOM 1029 CG LEU A 66 3.876 -13.928 0.209 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.690 -14.982 -0.552 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.805 -12.799 0.673 1.00 0.00 C ATOM 0 H LEU A 66 2.295 -12.267 1.482 1.00 0.00 H new ATOM 0 HA LEU A 66 0.696 -12.798 -0.691 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.685 -14.011 -1.583 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.994 -12.385 -1.008 1.00 0.00 H new ATOM 0 HG LEU A 66 3.421 -14.378 1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.491 -15.354 0.087 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.039 -15.809 -0.836 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.119 -14.533 -1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.594 -13.212 1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.250 -12.314 -0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.232 -12.068 1.243 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.501 -14.918 -0.338 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.286 -16.145 -0.351 1.00 0.00 C ATOM 1045 C GLY A 67 -2.475 -16.097 0.616 1.00 0.00 C ATOM 1046 O GLY A 67 -2.868 -17.140 1.132 1.00 0.00 O ATOM 0 H GLY A 67 -1.018 -14.130 -0.728 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.652 -16.327 -1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.643 -16.985 -0.089 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.050 -14.913 0.864 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.193 -14.708 1.755 1.00 0.00 C ATOM 1052 C VAL A 68 -5.033 -13.558 1.190 1.00 0.00 C ATOM 1053 O VAL A 68 -4.509 -12.750 0.414 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.690 -14.395 3.184 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.798 -13.972 4.159 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.962 -15.597 3.804 1.00 0.00 C ATOM 0 H VAL A 68 -2.721 -14.048 0.436 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.809 -15.605 1.814 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.011 -13.554 3.048 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.364 -13.771 5.138 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.286 -13.072 3.786 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.532 -14.773 4.246 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.623 -15.339 4.807 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.643 -16.446 3.858 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.102 -15.860 3.187 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.313 -13.473 1.596 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.121 -12.273 1.444 1.00 0.00 C ATOM 1068 C GLU A 69 -7.438 -11.632 2.797 1.00 0.00 C ATOM 1069 O GLU A 69 -7.748 -12.337 3.757 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.374 -12.510 0.592 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.401 -13.523 1.119 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.779 -13.281 0.514 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -10.858 -12.662 -0.570 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.765 -13.636 1.195 1.00 0.00 O ATOM 0 H GLU A 69 -6.809 -14.246 2.040 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.520 -11.554 0.888 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.880 -11.553 0.462 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.053 -12.838 -0.397 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.071 -14.535 0.884 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.461 -13.452 2.205 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.343 -10.300 2.871 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.530 -9.518 4.087 1.00 0.00 C ATOM 1083 C PHE A 70 -8.404 -8.297 3.781 1.00 0.00 C ATOM 1084 O PHE A 70 -8.230 -7.661 2.741 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.165 -9.125 4.672 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.275 -8.295 3.762 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.528 -8.908 2.742 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.191 -6.902 3.943 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.743 -8.127 1.877 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.395 -6.125 3.089 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.667 -6.737 2.055 1.00 0.00 C ATOM 0 H PHE A 70 -7.127 -9.723 2.058 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.045 -10.114 4.841 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.332 -8.568 5.594 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.630 -10.035 4.942 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.557 -9.981 2.623 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.742 -6.429 4.743 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.197 -8.598 1.073 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.342 -5.055 3.226 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.051 -6.140 1.399 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.374 -8.016 4.660 1.00 0.00 N ATOM 1102 CA ASP A 71 -10.315 -6.903 4.560 1.00 0.00 C ATOM 1103 C ASP A 71 -9.743 -5.722 5.336 1.00 0.00 C ATOM 1104 O ASP A 71 -9.544 -5.848 6.542 1.00 0.00 O ATOM 1105 CB ASP A 71 -11.674 -7.341 5.124 1.00 0.00 C ATOM 1106 CG ASP A 71 -12.713 -6.230 5.076 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -12.675 -5.424 4.126 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -13.580 -6.211 5.978 1.00 0.00 O ATOM 0 H ASP A 71 -9.528 -8.584 5.493 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.462 -6.604 3.522 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -12.038 -8.199 4.559 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -11.546 -7.670 6.155 1.00 0.00 H new ATOM 1113 N GLU A 72 -9.409 -4.620 4.655 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.650 -3.532 5.262 1.00 0.00 C ATOM 1115 C GLU A 72 -8.903 -2.226 4.512 1.00 0.00 C ATOM 1116 O GLU A 72 -9.366 -2.257 3.373 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.166 -3.935 5.282 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.217 -2.929 5.940 1.00 0.00 C ATOM 1119 CD GLU A 72 -6.624 -2.604 7.371 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -7.473 -1.696 7.509 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -6.101 -3.278 8.281 1.00 0.00 O ATOM 0 H GLU A 72 -9.656 -4.462 3.678 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.970 -3.357 6.289 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.074 -4.888 5.802 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.838 -4.099 4.255 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.204 -3.331 5.935 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.199 -2.011 5.352 1.00 0.00 H new ATOM 1128 N THR A 73 -8.645 -1.088 5.165 1.00 0.00 N ATOM 1129 CA THR A 73 -8.940 0.252 4.682 1.00 0.00 C ATOM 1130 C THR A 73 -7.686 1.127 4.612 1.00 0.00 C ATOM 1131 O THR A 73 -7.312 1.747 5.604 1.00 0.00 O ATOM 1132 CB THR A 73 -10.080 0.871 5.519 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.368 2.183 5.087 1.00 0.00 O ATOM 1134 CG2 THR A 73 -9.853 0.898 7.034 1.00 0.00 C ATOM 0 H THR A 73 -8.205 -1.083 6.085 1.00 0.00 H new ATOM 0 HA THR A 73 -9.292 0.188 3.653 1.00 0.00 H new ATOM 0 HB THR A 73 -10.920 0.198 5.346 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.094 2.554 5.630 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.714 1.353 7.523 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.723 -0.120 7.401 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.959 1.481 7.258 1.00 0.00 H new ATOM 1142 N THR A 74 -7.086 1.267 3.422 1.00 0.00 N ATOM 1143 CA THR A 74 -6.148 2.370 3.203 1.00 0.00 C ATOM 1144 C THR A 74 -6.958 3.610 2.830 1.00 0.00 C ATOM 1145 O THR A 74 -7.977 3.513 2.141 1.00 0.00 O ATOM 1146 CB THR A 74 -5.020 2.039 2.208 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.149 3.150 2.062 1.00 0.00 O ATOM 1148 CG2 THR A 74 -5.480 1.588 0.830 1.00 0.00 C ATOM 0 H THR A 74 -7.228 0.651 2.621 1.00 0.00 H new ATOM 0 HA THR A 74 -5.602 2.565 4.126 1.00 0.00 H new ATOM 0 HB THR A 74 -4.507 1.185 2.650 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.441 3.697 1.303 1.00 0.00 H new ATOM 0 HG21 THR A 74 -4.611 1.380 0.206 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.083 0.685 0.925 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.077 2.376 0.370 1.00 0.00 H new ATOM 1156 N ALA A 75 -6.512 4.775 3.308 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.170 6.054 3.083 1.00 0.00 C ATOM 1158 C ALA A 75 -7.509 6.239 1.605 1.00 0.00 C ATOM 1159 O ALA A 75 -8.589 6.722 1.268 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.267 7.186 3.579 1.00 0.00 C ATOM 0 H ALA A 75 -5.666 4.851 3.873 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.106 6.074 3.641 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.759 8.144 3.411 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.076 7.058 4.644 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.323 7.163 3.035 1.00 0.00 H new ATOM 1166 N ASP A 76 -6.584 5.841 0.731 1.00 0.00 N ATOM 1167 CA ASP A 76 -6.699 5.932 -0.707 1.00 0.00 C ATOM 1168 C ASP A 76 -7.042 4.579 -1.339 1.00 0.00 C ATOM 1169 O ASP A 76 -6.544 4.265 -2.415 1.00 0.00 O ATOM 1170 CB ASP A 76 -5.403 6.525 -1.267 1.00 0.00 C ATOM 1171 CG ASP A 76 -4.149 5.712 -0.956 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -4.196 4.887 -0.008 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -3.147 6.015 -1.650 1.00 0.00 O ATOM 0 H ASP A 76 -5.699 5.430 1.029 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.528 6.592 -0.963 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.500 6.621 -2.348 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.277 7.531 -0.868 1.00 0.00 H new ATOM 1178 N ASP A 77 -7.961 3.839 -0.713 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.797 2.834 -1.372 1.00 0.00 C ATOM 1180 C ASP A 77 -10.197 2.834 -0.761 1.00 0.00 C ATOM 1181 O ASP A 77 -11.170 2.648 -1.493 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.223 1.410 -1.312 1.00 0.00 C ATOM 1183 CG ASP A 77 -7.163 1.122 -2.369 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -7.440 1.422 -3.551 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -6.133 0.515 -1.994 1.00 0.00 O ATOM 0 H ASP A 77 -8.148 3.924 0.286 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.830 3.118 -2.424 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.791 1.245 -0.325 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.038 0.696 -1.426 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.280 3.033 0.563 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.420 2.766 1.445 1.00 0.00 C ATOM 1192 C ARG A 78 -11.318 1.300 1.882 1.00 0.00 C ATOM 1193 O ARG A 78 -10.304 0.659 1.606 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.789 3.130 0.832 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.864 4.604 0.387 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.858 4.814 -0.764 1.00 0.00 C ATOM 1197 NE ARG A 78 -13.382 4.120 -1.971 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.753 4.339 -3.241 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -14.724 5.204 -3.538 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -13.141 3.688 -4.232 1.00 0.00 N ATOM 0 H ARG A 78 -9.489 3.414 1.082 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.368 3.422 2.314 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.983 2.485 -0.025 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.574 2.934 1.562 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.157 5.223 1.235 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.874 4.938 0.075 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.841 4.436 -0.481 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -13.972 5.879 -0.968 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.689 3.386 -1.825 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -15.199 5.713 -2.793 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.991 5.356 -4.510 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.394 3.026 -4.022 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.421 3.852 -5.199 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.333 0.761 2.571 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.295 -0.633 2.992 1.00 0.00 C ATOM 1216 C LYS A 79 -12.498 -1.553 1.789 1.00 0.00 C ATOM 1217 O LYS A 79 -13.496 -1.429 1.080 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.291 -0.930 4.122 1.00 0.00 C ATOM 1219 CG LYS A 79 -12.790 -2.175 4.872 1.00 0.00 C ATOM 1220 CD LYS A 79 -13.777 -2.727 5.903 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.027 -3.306 5.226 1.00 0.00 C ATOM 1222 NZ LYS A 79 -15.554 -4.463 5.973 1.00 0.00 N ATOM 0 H LYS A 79 -13.176 1.266 2.842 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.307 -0.830 3.408 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.365 -0.079 4.800 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.288 -1.103 3.717 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -12.565 -2.957 4.146 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -11.855 -1.930 5.376 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.291 -3.501 6.496 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.068 -1.934 6.591 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.795 -2.536 5.156 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -14.784 -3.608 4.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -16.507 -4.695 5.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -14.927 -5.281 5.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -15.600 -4.231 6.986 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.550 -2.463 1.565 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.491 -3.345 0.412 1.00 0.00 C ATOM 1238 C VAL A 80 -10.896 -4.681 0.863 1.00 0.00 C ATOM 1239 O VAL A 80 -10.045 -4.689 1.757 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.625 -2.685 -0.679 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -11.207 -1.347 -1.155 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -9.195 -2.407 -0.196 1.00 0.00 C ATOM 0 H VAL A 80 -10.774 -2.607 2.211 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.483 -3.522 -0.003 1.00 0.00 H new ATOM 0 HB VAL A 80 -10.614 -3.404 -1.498 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.561 -0.922 -1.923 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.203 -1.510 -1.567 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -11.271 -0.658 -0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.624 -1.942 -0.999 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.225 -1.737 0.663 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.719 -3.345 0.092 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.311 -5.801 0.250 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.724 -7.100 0.538 1.00 0.00 C ATOM 1254 C LYS A 81 -9.607 -7.399 -0.459 1.00 0.00 C ATOM 1255 O LYS A 81 -9.839 -7.767 -1.609 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.774 -8.214 0.688 1.00 0.00 C ATOM 1257 CG LYS A 81 -11.193 -9.294 1.614 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.187 -10.389 2.012 1.00 0.00 C ATOM 1259 CE LYS A 81 -11.573 -11.194 3.171 1.00 0.00 C ATOM 1260 NZ LYS A 81 -12.313 -12.443 3.444 1.00 0.00 N ATOM 0 H LYS A 81 -12.054 -5.823 -0.449 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.260 -7.065 1.524 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.698 -7.813 1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.020 -8.639 -0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.339 -9.758 1.120 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.817 -8.816 2.518 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.137 -9.949 2.316 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.395 -11.041 1.164 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -10.536 -11.434 2.934 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -11.560 -10.579 4.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.056 -12.800 4.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.335 -12.255 3.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.069 -13.155 2.726 1.00 0.00 H new ATOM 1274 N SER A 82 -8.375 -7.210 0.001 1.00 0.00 N ATOM 1275 CA SER A 82 -7.164 -7.406 -0.765 1.00 0.00 C ATOM 1276 C SER A 82 -6.768 -8.873 -0.735 1.00 0.00 C ATOM 1277 O SER A 82 -6.424 -9.352 0.339 1.00 0.00 O ATOM 1278 CB SER A 82 -6.082 -6.552 -0.110 1.00 0.00 C ATOM 1279 OG SER A 82 -6.346 -5.190 -0.399 1.00 0.00 O ATOM 0 H SER A 82 -8.193 -6.904 0.957 1.00 0.00 H new ATOM 0 HA SER A 82 -7.305 -7.118 -1.807 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.072 -6.715 0.968 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.098 -6.835 -0.485 1.00 0.00 H new ATOM 0 HG SER A 82 -6.032 -4.981 -1.303 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.767 -9.553 -1.887 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.151 -10.864 -2.052 1.00 0.00 C ATOM 1287 C ILE A 83 -4.797 -10.661 -2.720 1.00 0.00 C ATOM 1288 O ILE A 83 -4.704 -10.002 -3.757 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.087 -11.851 -2.781 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -6.631 -13.320 -2.636 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.359 -11.498 -4.242 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -5.556 -13.800 -3.620 1.00 0.00 C ATOM 0 H ILE A 83 -7.201 -9.199 -2.739 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.981 -11.340 -1.086 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.042 -11.745 -2.266 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.255 -13.463 -1.623 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.505 -13.962 -2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.025 -12.242 -4.678 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.827 -10.515 -4.298 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.419 -11.484 -4.794 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.319 -14.845 -3.419 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -5.927 -13.702 -4.640 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -4.657 -13.195 -3.501 1.00 0.00 H new ATOM 1304 N VAL A 84 -3.738 -11.173 -2.093 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.381 -11.045 -2.598 1.00 0.00 C ATOM 1306 C VAL A 84 -1.802 -12.437 -2.835 1.00 0.00 C ATOM 1307 O VAL A 84 -1.982 -13.327 -2.003 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.525 -10.208 -1.629 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.976 -8.746 -1.626 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -1.599 -10.737 -0.198 1.00 0.00 C ATOM 0 H VAL A 84 -3.803 -11.690 -1.216 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.383 -10.515 -3.551 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.497 -10.283 -1.983 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -1.356 -8.176 -0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.875 -8.332 -2.629 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -3.018 -8.687 -1.312 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.981 -10.117 0.451 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -2.632 -10.707 0.148 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.237 -11.765 -0.171 1.00 0.00 H new ATOM 1320 N THR A 85 -1.088 -12.629 -3.945 1.00 0.00 N ATOM 1321 CA THR A 85 -0.217 -13.781 -4.128 1.00 0.00 C ATOM 1322 C THR A 85 0.872 -13.422 -5.140 1.00 0.00 C ATOM 1323 O THR A 85 0.957 -12.273 -5.575 1.00 0.00 O ATOM 1324 CB THR A 85 -1.012 -15.053 -4.479 1.00 0.00 C ATOM 1325 OG1 THR A 85 -0.148 -16.174 -4.430 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.673 -14.996 -5.857 1.00 0.00 C ATOM 0 H THR A 85 -1.100 -11.989 -4.739 1.00 0.00 H new ATOM 0 HA THR A 85 0.278 -14.027 -3.189 1.00 0.00 H new ATOM 0 HB THR A 85 -1.812 -15.135 -3.743 1.00 0.00 H new ATOM 0 HG1 THR A 85 -0.652 -16.985 -4.651 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.216 -15.924 -6.039 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.367 -14.156 -5.893 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.908 -14.867 -6.623 1.00 0.00 H new ATOM 1334 N LEU A 86 1.720 -14.393 -5.477 1.00 0.00 N ATOM 1335 CA LEU A 86 2.917 -14.209 -6.282 1.00 0.00 C ATOM 1336 C LEU A 86 2.945 -15.293 -7.363 1.00 0.00 C ATOM 1337 O LEU A 86 3.204 -16.452 -7.042 1.00 0.00 O ATOM 1338 CB LEU A 86 4.144 -14.239 -5.353 1.00 0.00 C ATOM 1339 CG LEU A 86 5.303 -13.345 -5.817 1.00 0.00 C ATOM 1340 CD1 LEU A 86 6.350 -13.287 -4.697 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.968 -13.818 -7.114 1.00 0.00 C ATOM 0 H LEU A 86 1.584 -15.361 -5.185 1.00 0.00 H new ATOM 0 HA LEU A 86 2.926 -13.245 -6.791 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.838 -13.929 -4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.501 -15.266 -5.273 1.00 0.00 H new ATOM 0 HG LEU A 86 4.886 -12.361 -6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.182 -12.656 -5.009 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.897 -12.872 -3.797 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.716 -14.292 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.777 -13.137 -7.378 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.370 -14.821 -6.972 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.230 -13.833 -7.916 1.00 0.00 H new ATOM 1353 N ASP A 87 2.653 -14.940 -8.621 1.00 0.00 N ATOM 1354 CA ASP A 87 2.652 -15.884 -9.737 1.00 0.00 C ATOM 1355 C ASP A 87 3.948 -15.719 -10.536 1.00 0.00 C ATOM 1356 O ASP A 87 4.267 -14.621 -10.985 1.00 0.00 O ATOM 1357 CB ASP A 87 1.377 -15.742 -10.589 1.00 0.00 C ATOM 1358 CG ASP A 87 1.511 -14.792 -11.774 1.00 0.00 C ATOM 1359 OD1 ASP A 87 1.947 -15.283 -12.838 1.00 0.00 O ATOM 1360 OD2 ASP A 87 1.147 -13.609 -11.607 1.00 0.00 O ATOM 0 H ASP A 87 2.410 -13.987 -8.891 1.00 0.00 H new ATOM 0 HA ASP A 87 2.629 -16.907 -9.360 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.091 -16.727 -10.959 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.565 -15.394 -9.950 1.00 0.00 H new ATOM 1365 N GLY A 88 4.746 -16.785 -10.646 1.00 0.00 N ATOM 1366 CA GLY A 88 6.030 -16.767 -11.336 1.00 0.00 C ATOM 1367 C GLY A 88 7.033 -15.829 -10.656 1.00 0.00 C ATOM 1368 O GLY A 88 7.892 -16.279 -9.902 1.00 0.00 O ATOM 0 H GLY A 88 4.511 -17.696 -10.251 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.440 -17.777 -11.366 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.882 -16.453 -12.369 1.00 0.00 H new ATOM 1372 N GLY A 89 6.917 -14.528 -10.930 1.00 0.00 N ATOM 1373 CA GLY A 89 7.696 -13.465 -10.306 1.00 0.00 C ATOM 1374 C GLY A 89 6.882 -12.172 -10.174 1.00 0.00 C ATOM 1375 O GLY A 89 7.454 -11.101 -9.979 1.00 0.00 O ATOM 0 H GLY A 89 6.252 -14.176 -11.619 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.029 -13.788 -9.320 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.591 -13.273 -10.898 1.00 0.00 H new ATOM 1379 N LYS A 90 5.552 -12.268 -10.278 1.00 0.00 N ATOM 1380 CA LYS A 90 4.624 -11.155 -10.312 1.00 0.00 C ATOM 1381 C LYS A 90 3.776 -11.199 -9.047 1.00 0.00 C ATOM 1382 O LYS A 90 3.037 -12.155 -8.824 1.00 0.00 O ATOM 1383 CB LYS A 90 3.754 -11.257 -11.578 1.00 0.00 C ATOM 1384 CG LYS A 90 3.830 -9.945 -12.353 1.00 0.00 C ATOM 1385 CD LYS A 90 3.023 -10.001 -13.650 1.00 0.00 C ATOM 1386 CE LYS A 90 3.034 -8.614 -14.315 1.00 0.00 C ATOM 1387 NZ LYS A 90 3.224 -8.706 -15.773 1.00 0.00 N ATOM 0 H LYS A 90 5.081 -13.170 -10.343 1.00 0.00 H new ATOM 0 HA LYS A 90 5.155 -10.204 -10.347 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.097 -12.082 -12.203 1.00 0.00 H new ATOM 0 HB3 LYS A 90 2.721 -11.472 -11.306 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.458 -9.133 -11.729 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.871 -9.719 -12.583 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.448 -10.744 -14.325 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.998 -10.309 -13.441 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.095 -8.102 -14.103 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.832 -8.010 -13.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.226 -7.751 -16.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.131 -9.172 -15.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.449 -9.261 -16.190 1.00 0.00 H new ATOM 1401 N LEU A 91 3.887 -10.166 -8.213 1.00 0.00 N ATOM 1402 CA LEU A 91 3.088 -10.006 -7.011 1.00 0.00 C ATOM 1403 C LEU A 91 1.727 -9.456 -7.435 1.00 0.00 C ATOM 1404 O LEU A 91 1.583 -8.257 -7.672 1.00 0.00 O ATOM 1405 CB LEU A 91 3.870 -9.128 -6.020 1.00 0.00 C ATOM 1406 CG LEU A 91 3.069 -8.365 -4.952 1.00 0.00 C ATOM 1407 CD1 LEU A 91 2.133 -9.239 -4.110 1.00 0.00 C ATOM 1408 CD2 LEU A 91 4.087 -7.679 -4.035 1.00 0.00 C ATOM 0 H LEU A 91 4.550 -9.405 -8.362 1.00 0.00 H new ATOM 0 HA LEU A 91 2.896 -10.942 -6.486 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.592 -9.763 -5.507 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.440 -8.399 -6.596 1.00 0.00 H new ATOM 0 HG LEU A 91 2.416 -7.661 -5.468 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.610 -8.617 -3.384 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.407 -9.726 -4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.716 -9.996 -3.586 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.561 -7.123 -3.259 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.726 -8.432 -3.573 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.700 -6.993 -4.620 1.00 0.00 H new ATOM 1420 N VAL A 92 0.733 -10.338 -7.556 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.622 -9.966 -7.927 1.00 0.00 C ATOM 1422 C VAL A 92 -1.385 -9.611 -6.651 1.00 0.00 C ATOM 1423 O VAL A 92 -1.701 -10.486 -5.846 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.300 -11.059 -8.786 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.424 -11.430 -9.988 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -1.642 -12.350 -8.034 1.00 0.00 C ATOM 0 H VAL A 92 0.853 -11.338 -7.396 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.616 -9.086 -8.571 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.241 -10.607 -9.099 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.922 -12.200 -10.577 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.263 -10.547 -10.607 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.536 -11.806 -9.636 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.113 -13.056 -8.718 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.729 -12.789 -7.632 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.327 -12.124 -7.217 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.657 -8.317 -6.449 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.619 -7.840 -5.467 1.00 0.00 C ATOM 1438 C HIS A 93 -3.917 -7.562 -6.217 1.00 0.00 C ATOM 1439 O HIS A 93 -4.030 -6.516 -6.852 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.077 -6.574 -4.784 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.051 -5.823 -3.901 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.997 -4.463 -3.653 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.140 -6.328 -3.242 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.029 -4.144 -2.854 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.738 -5.257 -2.599 1.00 0.00 N ATOM 0 H HIS A 93 -1.206 -7.567 -6.973 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.795 -8.576 -4.683 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.213 -6.853 -4.181 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.720 -5.893 -5.557 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -2.296 -3.816 -4.014 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.467 -7.357 -3.227 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.252 -3.156 -2.479 1.00 0.00 H new ATOM 1454 N VAL A 94 -4.887 -8.474 -6.138 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.246 -8.209 -6.592 1.00 0.00 C ATOM 1456 C VAL A 94 -7.004 -7.661 -5.383 1.00 0.00 C ATOM 1457 O VAL A 94 -6.733 -8.038 -4.242 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.878 -9.462 -7.222 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.331 -9.208 -7.645 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.072 -9.912 -8.448 1.00 0.00 C ATOM 0 H VAL A 94 -4.750 -9.411 -5.759 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.276 -7.471 -7.394 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.866 -10.245 -6.464 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.745 -10.115 -8.086 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.920 -8.927 -6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.361 -8.402 -8.378 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.533 -10.800 -8.881 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.059 -9.112 -9.188 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.051 -10.144 -8.147 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.878 -6.686 -5.607 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.442 -5.867 -4.554 1.00 0.00 C ATOM 1472 C GLN A 95 -9.945 -5.776 -4.777 1.00 0.00 C ATOM 1473 O GLN A 95 -10.412 -5.029 -5.634 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.707 -4.532 -4.578 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.143 -3.594 -3.455 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.242 -2.369 -3.439 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -7.091 -1.710 -4.459 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.605 -2.087 -2.309 1.00 0.00 N ATOM 0 H GLN A 95 -8.215 -6.444 -6.539 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.312 -6.283 -3.555 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.635 -4.712 -4.499 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.879 -4.046 -5.538 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.181 -3.294 -3.600 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.091 -4.109 -2.496 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -6.758 -2.661 -1.480 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.962 -1.296 -2.270 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.670 -6.598 -4.022 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.052 -6.974 -4.237 1.00 0.00 C ATOM 1489 C LYS A 96 -12.908 -6.304 -3.167 1.00 0.00 C ATOM 1490 O LYS A 96 -12.751 -6.626 -1.990 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.087 -8.509 -4.145 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.481 -9.146 -4.109 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.410 -10.662 -4.377 1.00 0.00 C ATOM 1494 CE LYS A 96 -12.335 -11.432 -3.587 1.00 0.00 C ATOM 1495 NZ LYS A 96 -12.440 -11.252 -2.127 1.00 0.00 N ATOM 0 H LYS A 96 -10.277 -7.044 -3.193 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.445 -6.657 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.544 -8.917 -4.997 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.547 -8.812 -3.248 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -13.940 -8.967 -3.137 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.119 -8.672 -4.855 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.383 -11.098 -4.150 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.232 -10.816 -5.441 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.413 -12.494 -3.821 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -11.349 -11.105 -3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -11.939 -12.026 -1.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.013 -10.343 -1.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.442 -11.260 -1.847 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.805 -5.385 -3.547 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.703 -4.748 -2.589 1.00 0.00 C ATOM 1511 C TRP A 97 -16.132 -5.256 -2.758 1.00 0.00 C ATOM 1512 O TRP A 97 -16.637 -5.934 -1.868 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.575 -3.224 -2.636 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.484 -2.566 -3.978 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.525 -2.165 -4.736 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.290 -2.105 -4.674 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.058 -1.545 -5.872 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.687 -1.447 -5.872 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.911 -2.136 -4.392 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.769 -0.851 -6.745 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -10.997 -1.423 -5.186 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.417 -0.805 -6.375 1.00 0.00 C ATOM 0 H TRP A 97 -13.924 -5.070 -4.510 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.403 -5.034 -1.581 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.434 -2.801 -2.114 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.688 -2.946 -2.067 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.566 -2.309 -4.489 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.656 -1.200 -6.623 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.551 -2.715 -3.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.096 -0.434 -7.686 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.964 -1.350 -4.880 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.701 -0.296 -7.003 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.788 -4.944 -3.882 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.199 -5.272 -4.070 1.00 0.00 C ATOM 1535 C ASN A 98 -18.660 -4.988 -5.497 1.00 0.00 C ATOM 1536 O ASN A 98 -18.746 -5.907 -6.304 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.122 -4.626 -3.012 1.00 0.00 C ATOM 1538 CG ASN A 98 -18.976 -3.114 -2.851 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -17.973 -2.622 -2.349 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -19.968 -2.347 -3.296 1.00 0.00 N ATOM 0 H ASN A 98 -16.360 -4.464 -4.674 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.286 -6.347 -3.912 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.157 -4.848 -3.273 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.928 -5.097 -2.049 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -19.900 -1.332 -3.222 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.796 -2.774 -3.711 1.00 0.00 H new ATOM 1547 N GLY A 99 -18.982 -3.733 -5.825 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.552 -3.403 -7.122 1.00 0.00 C ATOM 1549 C GLY A 99 -18.544 -3.653 -8.237 1.00 0.00 C ATOM 1550 O GLY A 99 -18.922 -3.965 -9.363 1.00 0.00 O ATOM 0 H GLY A 99 -18.855 -2.933 -5.205 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.447 -4.002 -7.294 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.861 -2.358 -7.133 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.259 -3.465 -7.923 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.158 -3.834 -8.783 1.00 0.00 C ATOM 1556 C GLN A 100 -15.032 -4.356 -7.892 1.00 0.00 C ATOM 1557 O GLN A 100 -15.190 -4.468 -6.670 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.668 -2.660 -9.658 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.623 -1.476 -9.865 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.471 -0.449 -8.747 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.333 -0.490 -7.730 1.00 0.00 O flip ATOM 1562 NE2 GLN A 100 -15.536 0.349 -8.780 1.00 0.00 N flip ATOM 0 H GLN A 100 -16.961 -3.043 -7.044 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.491 -4.603 -9.480 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.748 -2.275 -9.218 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.410 -3.058 -10.639 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.420 -1.005 -10.827 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.652 -1.835 -9.896 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -14.896 0.352 -9.574 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -15.401 1.008 -8.013 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.891 -4.595 -8.534 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.603 -4.838 -7.922 1.00 0.00 C ATOM 1573 C GLU A 101 -11.587 -3.935 -8.627 1.00 0.00 C ATOM 1574 O GLU A 101 -11.940 -3.199 -9.553 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.229 -6.320 -8.084 1.00 0.00 C ATOM 1576 CG GLU A 101 -13.405 -7.249 -7.741 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.977 -8.703 -7.579 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.753 -8.957 -7.608 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -13.897 -9.533 -7.415 1.00 0.00 O ATOM 0 H GLU A 101 -13.846 -4.624 -9.553 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.621 -4.615 -6.855 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.909 -6.504 -9.110 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -11.382 -6.553 -7.439 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.875 -6.908 -6.819 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.158 -7.181 -8.527 1.00 0.00 H new ATOM 1586 N THR A 102 -10.321 -4.016 -8.228 1.00 0.00 N ATOM 1587 CA THR A 102 -9.199 -3.503 -8.998 1.00 0.00 C ATOM 1588 C THR A 102 -8.015 -4.449 -8.821 1.00 0.00 C ATOM 1589 O THR A 102 -8.107 -5.440 -8.096 1.00 0.00 O ATOM 1590 CB THR A 102 -8.897 -2.051 -8.599 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.981 -1.442 -9.476 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.318 -1.928 -7.194 1.00 0.00 C ATOM 0 H THR A 102 -10.045 -4.447 -7.346 1.00 0.00 H new ATOM 0 HA THR A 102 -9.435 -3.471 -10.062 1.00 0.00 H new ATOM 0 HB THR A 102 -9.864 -1.550 -8.643 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.980 -1.920 -10.331 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.126 -0.879 -6.970 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.029 -2.329 -6.471 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.385 -2.488 -7.135 1.00 0.00 H new ATOM 1600 N SER A 103 -6.911 -4.151 -9.503 1.00 0.00 N ATOM 1601 CA SER A 103 -5.707 -4.953 -9.511 1.00 0.00 C ATOM 1602 C SER A 103 -4.507 -4.015 -9.420 1.00 0.00 C ATOM 1603 O SER A 103 -4.499 -2.965 -10.057 1.00 0.00 O ATOM 1604 CB SER A 103 -5.688 -5.818 -10.775 1.00 0.00 C ATOM 1605 OG SER A 103 -5.902 -5.037 -11.935 1.00 0.00 O ATOM 0 H SER A 103 -6.836 -3.315 -10.082 1.00 0.00 H new ATOM 0 HA SER A 103 -5.670 -5.631 -8.658 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.730 -6.332 -10.852 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.458 -6.586 -10.704 1.00 0.00 H new ATOM 0 HG SER A 103 -6.284 -4.171 -11.680 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.534 -4.387 -8.589 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.314 -3.659 -8.285 1.00 0.00 C ATOM 1613 C LEU A 104 -1.166 -4.656 -8.457 1.00 0.00 C ATOM 1614 O LEU A 104 -0.598 -5.122 -7.470 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.400 -3.153 -6.832 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.196 -1.846 -6.679 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.025 -1.837 -5.390 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.244 -0.639 -6.656 1.00 0.00 C ATOM 0 H LEU A 104 -3.586 -5.268 -8.077 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.162 -2.797 -8.935 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.862 -3.924 -6.215 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.391 -3.000 -6.449 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.869 -1.779 -7.534 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.573 -0.898 -5.317 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.730 -2.669 -5.405 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.362 -1.938 -4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.822 0.279 -6.547 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.555 -0.735 -5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.679 -0.603 -7.587 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.852 -5.039 -9.695 1.00 0.00 N ATOM 1631 CA VAL A 105 0.118 -6.103 -9.940 1.00 0.00 C ATOM 1632 C VAL A 105 1.530 -5.513 -10.008 1.00 0.00 C ATOM 1633 O VAL A 105 1.763 -4.572 -10.766 1.00 0.00 O ATOM 1634 CB VAL A 105 -0.283 -6.964 -11.150 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.453 -6.177 -12.445 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.771 -8.038 -11.403 1.00 0.00 C ATOM 0 H VAL A 105 -1.254 -4.630 -10.539 1.00 0.00 H new ATOM 0 HA VAL A 105 0.122 -6.802 -9.103 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.250 -7.392 -10.887 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.736 -6.856 -13.249 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.231 -5.425 -12.314 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.487 -5.686 -12.698 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.477 -8.641 -12.262 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.732 -7.564 -11.604 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.858 -8.676 -10.524 1.00 0.00 H new ATOM 1646 N ARG A 106 2.444 -6.034 -9.181 1.00 0.00 N ATOM 1647 CA ARG A 106 3.786 -5.509 -8.953 1.00 0.00 C ATOM 1648 C ARG A 106 4.836 -6.495 -9.463 1.00 0.00 C ATOM 1649 O ARG A 106 4.703 -7.698 -9.242 1.00 0.00 O ATOM 1650 CB ARG A 106 4.003 -5.292 -7.448 1.00 0.00 C ATOM 1651 CG ARG A 106 2.997 -4.310 -6.841 1.00 0.00 C ATOM 1652 CD ARG A 106 3.130 -4.270 -5.316 1.00 0.00 C ATOM 1653 NE ARG A 106 2.172 -3.324 -4.720 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.839 -3.287 -3.419 1.00 0.00 C ATOM 1655 NH1 ARG A 106 2.400 -4.145 -2.562 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.943 -2.395 -2.981 1.00 0.00 N ATOM 0 H ARG A 106 2.255 -6.871 -8.630 1.00 0.00 H new ATOM 0 HA ARG A 106 3.886 -4.565 -9.488 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.926 -6.249 -6.932 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.014 -4.920 -7.281 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.161 -3.314 -7.251 1.00 0.00 H new ATOM 0 HG3 ARG A 106 1.984 -4.604 -7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 106 2.962 -5.267 -4.908 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.146 -3.982 -5.045 1.00 0.00 H new ATOM 0 HE ARG A 106 1.728 -2.647 -5.341 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.081 -4.827 -2.896 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.148 -4.117 -1.574 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.512 -1.742 -3.635 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.691 -2.368 -1.993 1.00 0.00 H new ATOM 1670 N GLU A 107 5.896 -5.989 -10.098 1.00 0.00 N ATOM 1671 CA GLU A 107 7.020 -6.785 -10.573 1.00 0.00 C ATOM 1672 C GLU A 107 8.225 -5.856 -10.684 1.00 0.00 C ATOM 1673 O GLU A 107 8.036 -4.698 -11.045 1.00 0.00 O ATOM 1674 CB GLU A 107 6.635 -7.369 -11.938 1.00 0.00 C ATOM 1675 CG GLU A 107 7.724 -8.215 -12.609 1.00 0.00 C ATOM 1676 CD GLU A 107 7.239 -8.879 -13.901 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.159 -8.486 -14.407 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.957 -9.788 -14.363 1.00 0.00 O ATOM 0 H GLU A 107 5.995 -4.994 -10.298 1.00 0.00 H new ATOM 0 HA GLU A 107 7.266 -7.605 -9.899 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.743 -7.983 -11.816 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.369 -6.549 -12.606 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.585 -7.584 -12.830 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.062 -8.984 -11.914 1.00 0.00 H new ATOM 1685 N MET A 108 9.444 -6.329 -10.389 1.00 0.00 N ATOM 1686 CA MET A 108 10.660 -5.645 -10.813 1.00 0.00 C ATOM 1687 C MET A 108 11.332 -6.500 -11.874 1.00 0.00 C ATOM 1688 O MET A 108 11.755 -7.618 -11.592 1.00 0.00 O ATOM 1689 CB MET A 108 11.631 -5.348 -9.655 1.00 0.00 C ATOM 1690 CG MET A 108 12.781 -4.428 -10.123 1.00 0.00 C ATOM 1691 SD MET A 108 14.492 -4.929 -9.762 1.00 0.00 S ATOM 1692 CE MET A 108 14.631 -6.489 -10.669 1.00 0.00 C ATOM 0 H MET A 108 9.608 -7.184 -9.857 1.00 0.00 H new ATOM 0 HA MET A 108 10.382 -4.670 -11.213 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.091 -4.874 -8.835 1.00 0.00 H new ATOM 0 HB3 MET A 108 12.041 -6.282 -9.270 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.691 -4.308 -11.203 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.622 -3.446 -9.678 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.655 -6.857 -10.606 1.00 0.00 H new ATOM 0 HE2 MET A 108 13.954 -7.224 -10.234 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.368 -6.327 -11.714 1.00 0.00 H new ATOM 1702 N VAL A 109 11.498 -5.923 -13.059 1.00 0.00 N ATOM 1703 CA VAL A 109 12.501 -6.331 -14.023 1.00 0.00 C ATOM 1704 C VAL A 109 13.349 -5.086 -14.259 1.00 0.00 C ATOM 1705 O VAL A 109 12.982 -4.006 -13.786 1.00 0.00 O ATOM 1706 CB VAL A 109 11.853 -6.899 -15.296 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.281 -8.285 -14.997 1.00 0.00 C ATOM 1708 CG2 VAL A 109 10.720 -6.021 -15.831 1.00 0.00 C ATOM 0 H VAL A 109 10.924 -5.142 -13.378 1.00 0.00 H new ATOM 0 HA VAL A 109 13.127 -7.149 -13.666 1.00 0.00 H new ATOM 0 HB VAL A 109 12.634 -6.941 -16.055 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.821 -8.691 -15.898 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.083 -8.947 -14.670 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.531 -8.207 -14.210 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.302 -6.474 -16.730 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.941 -5.931 -15.074 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.109 -5.031 -16.070 1.00 0.00 H new ATOM 1718 N ASP A 110 14.504 -5.243 -14.909 1.00 0.00 N ATOM 1719 CA ASP A 110 15.491 -4.177 -14.987 1.00 0.00 C ATOM 1720 C ASP A 110 15.765 -3.677 -13.554 1.00 0.00 C ATOM 1721 O ASP A 110 16.055 -4.490 -12.672 1.00 0.00 O ATOM 1722 CB ASP A 110 14.998 -3.126 -15.999 1.00 0.00 C ATOM 1723 CG ASP A 110 15.969 -1.972 -16.180 1.00 0.00 C ATOM 1724 OD1 ASP A 110 16.957 -2.157 -16.918 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.703 -0.941 -15.523 1.00 0.00 O ATOM 0 H ASP A 110 14.774 -6.102 -15.388 1.00 0.00 H new ATOM 0 HA ASP A 110 16.459 -4.500 -15.371 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.832 -3.608 -16.962 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.036 -2.735 -15.668 1.00 0.00 H new ATOM 1730 N GLY A 111 15.607 -2.383 -13.278 1.00 0.00 N ATOM 1731 CA GLY A 111 15.880 -1.767 -11.990 1.00 0.00 C ATOM 1732 C GLY A 111 14.671 -1.005 -11.455 1.00 0.00 C ATOM 1733 O GLY A 111 14.817 -0.251 -10.494 1.00 0.00 O ATOM 0 H GLY A 111 15.273 -1.715 -13.973 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.170 -2.536 -11.274 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.725 -1.085 -12.086 1.00 0.00 H new ATOM 1737 N LYS A 112 13.480 -1.210 -12.036 1.00 0.00 N ATOM 1738 CA LYS A 112 12.266 -0.524 -11.620 1.00 0.00 C ATOM 1739 C LYS A 112 11.208 -1.556 -11.238 1.00 0.00 C ATOM 1740 O LYS A 112 10.910 -2.460 -12.016 1.00 0.00 O ATOM 1741 CB LYS A 112 11.756 0.416 -12.722 1.00 0.00 C ATOM 1742 CG LYS A 112 12.708 1.598 -12.965 1.00 0.00 C ATOM 1743 CD LYS A 112 12.046 2.641 -13.881 1.00 0.00 C ATOM 1744 CE LYS A 112 12.962 3.857 -14.102 1.00 0.00 C ATOM 1745 NZ LYS A 112 12.318 4.906 -14.927 1.00 0.00 N ATOM 0 H LYS A 112 13.340 -1.860 -12.809 1.00 0.00 H new ATOM 0 HA LYS A 112 12.487 0.094 -10.750 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.634 -0.146 -13.648 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.772 0.795 -12.447 1.00 0.00 H new ATOM 0 HG2 LYS A 112 12.976 2.058 -12.014 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.633 1.241 -13.419 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.807 2.184 -14.841 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.104 2.968 -13.441 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.241 4.278 -13.136 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.883 3.532 -14.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.735 5.831 -14.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 12.469 4.697 -15.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.298 4.927 -14.727 1.00 0.00 H new ATOM 1759 N LEU A 113 10.648 -1.419 -10.034 1.00 0.00 N ATOM 1760 CA LEU A 113 9.432 -2.096 -9.629 1.00 0.00 C ATOM 1761 C LEU A 113 8.294 -1.392 -10.358 1.00 0.00 C ATOM 1762 O LEU A 113 7.909 -0.286 -9.982 1.00 0.00 O ATOM 1763 CB LEU A 113 9.286 -2.056 -8.100 1.00 0.00 C ATOM 1764 CG LEU A 113 8.113 -2.872 -7.524 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.304 -3.004 -6.009 1.00 0.00 C ATOM 1766 CD2 LEU A 113 6.742 -2.233 -7.774 1.00 0.00 C ATOM 0 H LEU A 113 11.040 -0.822 -9.306 1.00 0.00 H new ATOM 0 HA LEU A 113 9.435 -3.154 -9.892 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.212 -2.420 -7.654 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.170 -1.017 -7.791 1.00 0.00 H new ATOM 0 HG LEU A 113 8.122 -3.837 -8.031 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.480 -3.580 -5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.245 -3.514 -5.804 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.322 -2.012 -5.557 1.00 0.00 H new ATOM 0 HD21 LEU A 113 5.963 -2.861 -7.341 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.711 -1.246 -7.312 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.576 -2.136 -8.847 1.00 0.00 H new ATOM 1778 N ILE A 114 7.783 -2.013 -11.416 1.00 0.00 N ATOM 1779 CA ILE A 114 6.608 -1.546 -12.120 1.00 0.00 C ATOM 1780 C ILE A 114 5.378 -2.113 -11.409 1.00 0.00 C ATOM 1781 O ILE A 114 5.301 -3.311 -11.131 1.00 0.00 O ATOM 1782 CB ILE A 114 6.694 -1.884 -13.622 1.00 0.00 C ATOM 1783 CG1 ILE A 114 6.751 -3.396 -13.910 1.00 0.00 C ATOM 1784 CG2 ILE A 114 7.918 -1.172 -14.222 1.00 0.00 C ATOM 1785 CD1 ILE A 114 6.806 -3.707 -15.408 1.00 0.00 C ATOM 0 H ILE A 114 8.183 -2.865 -11.809 1.00 0.00 H new ATOM 0 HA ILE A 114 6.532 -0.459 -12.093 1.00 0.00 H new ATOM 0 HB ILE A 114 5.776 -1.530 -14.091 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.627 -3.823 -13.421 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.876 -3.879 -13.474 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.989 -1.404 -15.285 1.00 0.00 H new ATOM 0 HG22 ILE A 114 7.812 -0.095 -14.092 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.821 -1.512 -13.715 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.845 -4.786 -15.554 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.917 -3.307 -15.896 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.695 -3.250 -15.842 1.00 0.00 H new ATOM 1797 N LEU A 115 4.442 -1.227 -11.064 1.00 0.00 N ATOM 1798 CA LEU A 115 3.152 -1.543 -10.485 1.00 0.00 C ATOM 1799 C LEU A 115 2.096 -1.117 -11.502 1.00 0.00 C ATOM 1800 O LEU A 115 1.924 0.077 -11.757 1.00 0.00 O ATOM 1801 CB LEU A 115 3.023 -0.849 -9.117 1.00 0.00 C ATOM 1802 CG LEU A 115 1.587 -0.641 -8.609 1.00 0.00 C ATOM 1803 CD1 LEU A 115 0.777 -1.931 -8.514 1.00 0.00 C ATOM 1804 CD2 LEU A 115 1.645 -0.024 -7.212 1.00 0.00 C ATOM 0 H LEU A 115 4.578 -0.224 -11.190 1.00 0.00 H new ATOM 0 HA LEU A 115 3.023 -2.607 -10.286 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.569 -1.437 -8.379 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.513 0.123 -9.175 1.00 0.00 H new ATOM 0 HG LEU A 115 1.092 0.006 -9.333 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.225 -1.705 -8.149 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.709 -2.391 -9.500 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.268 -2.619 -7.826 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.632 0.129 -6.839 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.181 -0.694 -6.540 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.163 0.934 -7.259 1.00 0.00 H new ATOM 1816 N THR A 116 1.406 -2.092 -12.099 1.00 0.00 N ATOM 1817 CA THR A 116 0.277 -1.841 -12.978 1.00 0.00 C ATOM 1818 C THR A 116 -0.982 -1.793 -12.111 1.00 0.00 C ATOM 1819 O THR A 116 -1.340 -2.788 -11.475 1.00 0.00 O ATOM 1820 CB THR A 116 0.188 -2.916 -14.072 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.480 -3.332 -14.463 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.548 -2.384 -15.304 1.00 0.00 C ATOM 0 H THR A 116 1.622 -3.082 -11.981 1.00 0.00 H new ATOM 0 HA THR A 116 0.394 -0.890 -13.498 1.00 0.00 H new ATOM 0 HB THR A 116 -0.363 -3.760 -13.658 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.406 -4.018 -15.159 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.597 -3.164 -16.063 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.558 -2.086 -15.024 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.013 -1.522 -15.703 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.619 -0.622 -12.060 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.847 -0.370 -11.327 1.00 0.00 C ATOM 1832 C LEU A 117 -3.984 -0.345 -12.355 1.00 0.00 C ATOM 1833 O LEU A 117 -4.028 0.572 -13.174 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.660 0.950 -10.560 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.936 1.557 -9.963 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -4.643 0.630 -8.972 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -3.600 2.862 -9.237 1.00 0.00 C ATOM 0 H LEU A 117 -1.275 0.204 -12.549 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.093 -1.134 -10.589 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.947 0.782 -9.753 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.213 1.681 -11.234 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.611 1.728 -10.802 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.537 1.122 -8.588 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.925 -0.294 -9.476 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.971 0.402 -8.145 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.510 3.288 -8.815 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.889 2.660 -8.436 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.161 3.568 -9.942 1.00 0.00 H new ATOM 1849 N THR A 118 -4.862 -1.353 -12.358 1.00 0.00 N ATOM 1850 CA THR A 118 -5.901 -1.537 -13.370 1.00 0.00 C ATOM 1851 C THR A 118 -7.254 -1.818 -12.707 1.00 0.00 C ATOM 1852 O THR A 118 -7.347 -2.654 -11.804 1.00 0.00 O ATOM 1853 CB THR A 118 -5.466 -2.654 -14.330 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.283 -2.252 -14.991 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.536 -2.980 -15.377 1.00 0.00 C ATOM 0 H THR A 118 -4.868 -2.078 -11.641 1.00 0.00 H new ATOM 0 HA THR A 118 -6.030 -0.624 -13.951 1.00 0.00 H new ATOM 0 HB THR A 118 -5.303 -3.554 -13.737 1.00 0.00 H new ATOM 0 HG1 THR A 118 -3.995 -2.959 -15.606 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.176 -3.776 -16.029 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.448 -3.305 -14.876 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.746 -2.091 -15.972 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.301 -1.099 -13.134 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.660 -1.163 -12.596 1.00 0.00 C ATOM 1865 C HIS A 119 -10.634 -1.450 -13.741 1.00 0.00 C ATOM 1866 O HIS A 119 -10.264 -1.371 -14.911 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.960 0.177 -11.893 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.401 0.493 -11.569 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.207 1.345 -12.298 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.115 0.058 -10.484 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.394 1.428 -11.668 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.359 0.659 -10.560 1.00 0.00 N ATOM 0 H HIS A 119 -8.216 -0.428 -13.898 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.768 -1.965 -11.866 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.394 0.201 -10.962 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.574 0.979 -12.522 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -11.949 1.826 -13.160 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.773 -0.622 -9.718 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.238 2.016 -11.997 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.890 -1.763 -13.402 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.997 -1.780 -14.347 1.00 0.00 C ATOM 1883 C GLY A 120 -13.160 -0.392 -14.968 1.00 0.00 C ATOM 1884 O GLY A 120 -13.938 0.420 -14.473 1.00 0.00 O ATOM 0 H GLY A 120 -12.162 -2.013 -12.452 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.812 -2.519 -15.126 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.917 -2.074 -13.841 1.00 0.00 H new ATOM 1888 N THR A 121 -12.372 -0.128 -16.009 1.00 0.00 N ATOM 1889 CA THR A 121 -12.106 1.161 -16.633 1.00 0.00 C ATOM 1890 C THR A 121 -10.972 1.867 -15.888 1.00 0.00 C ATOM 1891 O THR A 121 -10.917 1.819 -14.656 1.00 0.00 O ATOM 1892 CB THR A 121 -13.361 2.038 -16.845 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.260 2.644 -18.117 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.540 3.182 -15.837 1.00 0.00 C ATOM 0 H THR A 121 -11.861 -0.877 -16.475 1.00 0.00 H new ATOM 0 HA THR A 121 -11.774 0.972 -17.654 1.00 0.00 H new ATOM 0 HB THR A 121 -14.211 1.366 -16.727 1.00 0.00 H new ATOM 0 HG1 THR A 121 -14.048 3.205 -18.275 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.449 3.736 -16.073 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.617 2.771 -14.830 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.682 3.852 -15.891 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.095 2.518 -16.658 1.00 0.00 N ATOM 1903 CA ALA A 122 -8.916 3.252 -16.219 1.00 0.00 C ATOM 1904 C ALA A 122 -7.749 2.322 -15.863 1.00 0.00 C ATOM 1905 O ALA A 122 -7.935 1.213 -15.355 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.242 4.249 -15.102 1.00 0.00 C ATOM 0 H ALA A 122 -10.202 2.545 -17.672 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.579 3.844 -17.070 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.334 4.774 -14.806 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -9.977 4.970 -15.461 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.648 3.714 -14.244 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.533 2.802 -16.147 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.259 2.143 -15.885 1.00 0.00 C ATOM 1914 C VAL A 123 -4.304 3.203 -15.331 1.00 0.00 C ATOM 1915 O VAL A 123 -4.474 4.393 -15.597 1.00 0.00 O ATOM 1916 CB VAL A 123 -4.707 1.522 -17.184 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -3.322 0.889 -16.988 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -5.651 0.440 -17.716 1.00 0.00 C ATOM 0 H VAL A 123 -6.410 3.712 -16.591 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.377 1.334 -15.165 1.00 0.00 H new ATOM 0 HB VAL A 123 -4.624 2.342 -17.897 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -2.978 0.466 -17.932 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.618 1.651 -16.654 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.385 0.100 -16.239 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -5.240 0.017 -18.633 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -5.759 -0.347 -16.970 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -6.627 0.879 -17.925 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.304 2.816 -14.536 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.135 3.644 -14.272 1.00 0.00 C ATOM 1930 C CYS A 124 -0.909 2.747 -14.218 1.00 0.00 C ATOM 1931 O CYS A 124 -0.946 1.688 -13.593 1.00 0.00 O ATOM 1932 CB CYS A 124 -2.237 4.400 -12.944 1.00 0.00 C ATOM 1933 SG CYS A 124 -3.817 5.247 -12.786 1.00 0.00 S ATOM 0 H CYS A 124 -3.286 1.915 -14.058 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.066 4.381 -15.072 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -2.113 3.702 -12.116 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -1.426 5.125 -12.874 1.00 0.00 H new ATOM 0 HG CYS A 124 -4.445 5.209 -13.924 1.00 0.00 H new ATOM 1939 N THR A 125 0.181 3.200 -14.828 1.00 0.00 N ATOM 1940 CA THR A 125 1.511 2.702 -14.571 1.00 0.00 C ATOM 1941 C THR A 125 2.028 3.485 -13.362 1.00 0.00 C ATOM 1942 O THR A 125 1.927 4.712 -13.336 1.00 0.00 O ATOM 1943 CB THR A 125 2.334 2.963 -15.840 1.00 0.00 C ATOM 1944 OG1 THR A 125 2.003 4.238 -16.361 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.976 1.945 -16.926 1.00 0.00 C ATOM 0 H THR A 125 0.155 3.940 -15.529 1.00 0.00 H new ATOM 0 HA THR A 125 1.560 1.636 -14.348 1.00 0.00 H new ATOM 0 HB THR A 125 3.390 2.895 -15.577 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.900 4.876 -15.624 1.00 0.00 H new ATOM 0 HG21 THR A 125 2.568 2.143 -17.820 1.00 0.00 H new ATOM 0 HG22 THR A 125 2.189 0.939 -16.566 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.916 2.028 -17.167 1.00 0.00 H new ATOM 1953 N ARG A 126 2.515 2.798 -12.330 1.00 0.00 N ATOM 1954 CA ARG A 126 3.139 3.409 -11.167 1.00 0.00 C ATOM 1955 C ARG A 126 4.503 2.740 -11.041 1.00 0.00 C ATOM 1956 O ARG A 126 4.548 1.530 -10.843 1.00 0.00 O ATOM 1957 CB ARG A 126 2.244 3.150 -9.942 1.00 0.00 C ATOM 1958 CG ARG A 126 2.427 4.179 -8.819 1.00 0.00 C ATOM 1959 CD ARG A 126 1.621 3.746 -7.580 1.00 0.00 C ATOM 1960 NE ARG A 126 1.064 4.897 -6.849 1.00 0.00 N ATOM 1961 CZ ARG A 126 0.145 4.807 -5.871 1.00 0.00 C ATOM 1962 NH1 ARG A 126 -0.216 3.608 -5.400 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -0.417 5.912 -5.371 1.00 0.00 N ATOM 0 H ARG A 126 2.484 1.780 -12.282 1.00 0.00 H new ATOM 0 HA ARG A 126 3.261 4.489 -11.250 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.201 3.151 -10.258 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.457 2.155 -9.550 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.483 4.269 -8.564 1.00 0.00 H new ATOM 0 HG3 ARG A 126 2.095 5.161 -9.155 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.810 3.087 -7.889 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.264 3.171 -6.913 1.00 0.00 H new ATOM 0 HE ARG A 126 1.398 5.827 -7.102 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.206 2.762 -5.783 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -0.913 3.540 -4.658 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -0.149 6.828 -5.731 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.114 5.839 -4.629 1.00 0.00 H new ATOM 1977 N THR A 127 5.607 3.466 -11.228 1.00 0.00 N ATOM 1978 CA THR A 127 6.930 2.856 -11.211 1.00 0.00 C ATOM 1979 C THR A 127 7.729 3.351 -10.006 1.00 0.00 C ATOM 1980 O THR A 127 7.714 4.539 -9.669 1.00 0.00 O ATOM 1981 CB THR A 127 7.661 3.090 -12.535 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.005 4.439 -12.643 1.00 0.00 O ATOM 1983 CG2 THR A 127 6.796 2.722 -13.745 1.00 0.00 C ATOM 0 H THR A 127 5.607 4.473 -11.392 1.00 0.00 H new ATOM 0 HA THR A 127 6.819 1.777 -11.105 1.00 0.00 H new ATOM 0 HB THR A 127 8.546 2.453 -12.533 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.196 4.989 -12.579 1.00 0.00 H new ATOM 0 HG21 THR A 127 7.356 2.905 -14.662 1.00 0.00 H new ATOM 0 HG22 THR A 127 6.523 1.668 -13.690 1.00 0.00 H new ATOM 0 HG23 THR A 127 5.892 3.331 -13.745 1.00 0.00 H new ATOM 1991 N TYR A 128 8.410 2.409 -9.356 1.00 0.00 N ATOM 1992 CA TYR A 128 9.234 2.613 -8.185 1.00 0.00 C ATOM 1993 C TYR A 128 10.650 2.130 -8.494 1.00 0.00 C ATOM 1994 O TYR A 128 10.833 1.184 -9.252 1.00 0.00 O ATOM 1995 CB TYR A 128 8.593 1.869 -7.006 1.00 0.00 C ATOM 1996 CG TYR A 128 7.672 2.749 -6.183 1.00 0.00 C ATOM 1997 CD1 TYR A 128 8.229 3.660 -5.270 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.289 2.782 -6.441 1.00 0.00 C ATOM 1999 CE1 TYR A 128 7.425 4.622 -4.641 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.477 3.732 -5.794 1.00 0.00 C ATOM 2001 CZ TYR A 128 6.053 4.676 -4.926 1.00 0.00 C ATOM 2002 OH TYR A 128 5.284 5.668 -4.392 1.00 0.00 O ATOM 0 H TYR A 128 8.395 1.434 -9.655 1.00 0.00 H new ATOM 0 HA TYR A 128 9.302 3.666 -7.913 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.030 1.016 -7.384 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.379 1.472 -6.363 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.286 3.619 -5.050 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.851 2.079 -7.135 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.861 5.318 -3.940 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.411 3.736 -5.964 1.00 0.00 H new ATOM 0 HH TYR A 128 5.846 6.444 -4.188 1.00 0.00 H new ATOM 2012 N GLU A 129 11.647 2.799 -7.920 1.00 0.00 N ATOM 2013 CA GLU A 129 13.069 2.657 -8.192 1.00 0.00 C ATOM 2014 C GLU A 129 13.762 2.489 -6.840 1.00 0.00 C ATOM 2015 O GLU A 129 13.521 3.293 -5.943 1.00 0.00 O ATOM 2016 CB GLU A 129 13.485 3.960 -8.876 1.00 0.00 C ATOM 2017 CG GLU A 129 14.962 4.091 -9.240 1.00 0.00 C ATOM 2018 CD GLU A 129 15.182 5.489 -9.793 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.232 6.417 -8.952 1.00 0.00 O ATOM 2020 OE2 GLU A 129 15.209 5.621 -11.033 1.00 0.00 O ATOM 0 H GLU A 129 11.467 3.502 -7.204 1.00 0.00 H new ATOM 0 HA GLU A 129 13.324 1.807 -8.824 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.897 4.071 -9.787 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.219 4.790 -8.222 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.588 3.924 -8.363 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.241 3.340 -9.979 1.00 0.00 H new ATOM 2027 N LYS A 130 14.544 1.426 -6.631 1.00 0.00 N ATOM 2028 CA LYS A 130 15.067 1.140 -5.298 1.00 0.00 C ATOM 2029 C LYS A 130 16.044 2.238 -4.868 1.00 0.00 C ATOM 2030 O LYS A 130 17.094 2.391 -5.486 1.00 0.00 O ATOM 2031 CB LYS A 130 15.689 -0.261 -5.229 1.00 0.00 C ATOM 2032 CG LYS A 130 16.074 -0.579 -3.774 1.00 0.00 C ATOM 2033 CD LYS A 130 16.501 -2.034 -3.548 1.00 0.00 C ATOM 2034 CE LYS A 130 15.339 -3.005 -3.794 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.603 -4.342 -3.233 1.00 0.00 N ATOM 0 H LYS A 130 14.823 0.763 -7.354 1.00 0.00 H new ATOM 0 HA LYS A 130 14.239 1.140 -4.589 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.982 -1.003 -5.600 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.570 -0.312 -5.869 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.888 0.079 -3.472 1.00 0.00 H new ATOM 0 HG3 LYS A 130 15.226 -0.355 -3.127 1.00 0.00 H new ATOM 0 HD2 LYS A 130 17.329 -2.279 -4.214 1.00 0.00 H new ATOM 0 HD3 LYS A 130 16.866 -2.153 -2.528 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.429 -2.600 -3.351 1.00 0.00 H new ATOM 0 HE3 LYS A 130 15.160 -3.091 -4.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 14.896 -5.015 -3.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.554 -4.655 -3.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 15.546 -4.301 -2.195 1.00 0.00 H new ATOM 2049 N GLN A 131 15.716 2.976 -3.801 1.00 0.00 N ATOM 2050 CA GLN A 131 16.591 4.008 -3.260 1.00 0.00 C ATOM 2051 C GLN A 131 17.511 3.437 -2.178 1.00 0.00 C ATOM 2052 O GLN A 131 18.631 3.917 -2.020 1.00 0.00 O ATOM 2053 CB GLN A 131 15.811 5.252 -2.810 1.00 0.00 C ATOM 2054 CG GLN A 131 14.767 5.018 -1.712 1.00 0.00 C ATOM 2055 CD GLN A 131 14.139 6.334 -1.245 1.00 0.00 C ATOM 2056 OE1 GLN A 131 14.840 7.227 -0.782 1.00 0.00 O ATOM 2057 NE2 GLN A 131 12.820 6.473 -1.347 1.00 0.00 N ATOM 0 H GLN A 131 14.838 2.871 -3.293 1.00 0.00 H new ATOM 0 HA GLN A 131 17.240 4.355 -4.064 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.523 5.997 -2.456 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.309 5.678 -3.679 1.00 0.00 H new ATOM 0 HG2 GLN A 131 13.987 4.354 -2.085 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.235 4.516 -0.865 1.00 0.00 H new ATOM 0 HE21 GLN A 131 12.256 5.717 -1.735 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.373 7.336 -1.037 1.00 0.00 H new ATOM 2066 N ALA A 132 17.071 2.407 -1.443 1.00 0.00 N ATOM 2067 CA ALA A 132 17.931 1.721 -0.481 1.00 0.00 C ATOM 2068 C ALA A 132 17.467 0.286 -0.254 1.00 0.00 C ATOM 2069 O ALA A 132 16.344 -0.073 -0.607 1.00 0.00 O ATOM 2070 CB ALA A 132 17.984 2.495 0.841 1.00 0.00 C ATOM 2071 OXT ALA A 132 18.314 -0.618 0.353 1.00 0.00 O ATOM 0 H ALA A 132 16.124 2.033 -1.499 1.00 0.00 H new ATOM 0 HA ALA A 132 18.938 1.682 -0.895 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.629 1.969 1.545 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.381 3.494 0.662 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.980 2.573 1.258 1.00 0.00 H new