USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 992 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 29 LYS NZ :NH3+ 157:sc= 2.1 (180deg=0.0651) USER MOD Set 1.2: A 131 SER OG : rot -80:sc= 0.797 USER MOD Set 2.1: A 43 HIS : no HD1:sc= 0.951 K(o=0.95,f=-8.4!) USER MOD Set 2.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 12 SER OG : rot -88:sc= 0.531 USER MOD Set 3.2: A 40 SER OG : rot -95:sc= 1.31 USER MOD Set 4.1: A 11 ASN : amide:sc= -1.05 K(o=2.1,f=-4.5!) USER MOD Set 4.2: A 16 GLN : amide:sc= 1.74 K(o=2.1,f=-1.1) USER MOD Set 4.3: A 34 SER OG : rot -46:sc= 1.19 USER MOD Set 4.4: A 60 GLN : amide:sc= -0.931 K(o=2.1,f=1.6) USER MOD Set 4.5: A 62 SER OG : rot -170:sc= 1.19 USER MOD Set 5.1: A 8 SER OG : rot -64:sc= 1.18 USER MOD Set 5.2: A 15 SER OG : rot -179:sc= 2.3 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 157:sc= 2.4 (180deg=2.25) USER MOD Single : A 3 LYS NZ :NH3+ -172:sc= 1.33 (180deg=1.14) USER MOD Single : A 5 MET CE :methyl -171:sc= -2.2 (180deg=-2.61) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0.296 USER MOD Single : A 17 MET CE :methyl 167:sc= -0.0289 (180deg=-0.316) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -72:sc= 1.25 USER MOD Single : A 33 THR OG1 : rot 72:sc= 1.01 USER MOD Single : A 35 SER OG : rot -80:sc= 0.105 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0064 USER MOD Single : A 49 MET CE :methyl 174:sc= -0.387 (180deg=-0.459) USER MOD Single : A 50 MET CE :methyl -153:sc= -0.965 (180deg=-3.65!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.704 K(o=0.7,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -132:sc= 1.34 USER MOD Single : A 85 ASN : amide:sc=-0.00398 X(o=-0.004,f=-0.004) USER MOD Single : A 92 THR OG1 : rot -74:sc= 0.117 USER MOD Single : A 93 GLN : amide:sc= 0.901 K(o=0.9,f=-0.35) USER MOD Single : A 100 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.795 K(o=0.79,f=-0.087) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0602 USER MOD Single : A 114 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A 118 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.24) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 1.26 (180deg=1.26) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.480 -0.658 -0.065 1.00 0.00 N ATOM 2 CA MET A 1 1.375 -0.698 -1.272 1.00 0.00 C ATOM 3 C MET A 1 1.681 -2.149 -1.696 1.00 0.00 C ATOM 4 O MET A 1 2.108 -2.948 -0.869 1.00 0.00 O ATOM 5 CB MET A 1 2.695 0.082 -1.017 1.00 0.00 C ATOM 6 CG MET A 1 3.566 0.282 -2.268 1.00 0.00 C ATOM 7 SD MET A 1 5.200 0.994 -1.930 1.00 0.00 S ATOM 8 CE MET A 1 4.773 2.714 -1.531 1.00 0.00 C ATOM 0 H1 MET A 1 0.293 0.331 0.196 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.418 -1.135 -0.283 1.00 0.00 H new ATOM 0 H3 MET A 1 0.946 -1.143 0.729 1.00 0.00 H new ATOM 0 HA MET A 1 0.841 -0.212 -2.089 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.451 1.059 -0.599 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.278 -0.450 -0.265 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.697 -0.680 -2.764 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.037 0.931 -2.966 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.682 3.271 -1.302 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.272 3.172 -2.384 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.108 2.733 -0.667 1.00 0.00 H new ATOM 20 N LYS A 2 1.549 -2.490 -2.992 1.00 0.00 N ATOM 21 CA LYS A 2 1.952 -3.804 -3.555 1.00 0.00 C ATOM 22 C LYS A 2 3.441 -3.801 -3.934 1.00 0.00 C ATOM 23 O LYS A 2 3.803 -3.529 -5.073 1.00 0.00 O ATOM 24 CB LYS A 2 1.036 -4.183 -4.746 1.00 0.00 C ATOM 25 CG LYS A 2 -0.482 -4.070 -4.483 1.00 0.00 C ATOM 26 CD LYS A 2 -1.012 -4.900 -3.304 1.00 0.00 C ATOM 27 CE LYS A 2 -1.008 -6.406 -3.611 1.00 0.00 C ATOM 28 NZ LYS A 2 -1.426 -7.193 -2.421 1.00 0.00 N ATOM 0 H LYS A 2 1.156 -1.858 -3.689 1.00 0.00 H new ATOM 0 HA LYS A 2 1.824 -4.573 -2.793 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.288 -3.545 -5.593 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.260 -5.208 -5.042 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.725 -3.022 -4.306 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -1.013 -4.372 -5.386 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -0.401 -4.708 -2.422 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -2.026 -4.582 -3.064 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.681 -6.613 -4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.010 -6.715 -3.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.789 -8.118 -2.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.609 -7.332 -1.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.173 -6.680 -1.910 1.00 0.00 H new ATOM 42 N LYS A 3 4.320 -4.028 -2.955 1.00 0.00 N ATOM 43 CA LYS A 3 5.788 -3.980 -3.128 1.00 0.00 C ATOM 44 C LYS A 3 6.305 -5.183 -3.928 1.00 0.00 C ATOM 45 O LYS A 3 5.854 -6.312 -3.725 1.00 0.00 O ATOM 46 CB LYS A 3 6.467 -3.841 -1.746 1.00 0.00 C ATOM 47 CG LYS A 3 7.309 -2.563 -1.674 1.00 0.00 C ATOM 48 CD LYS A 3 7.886 -2.278 -0.277 1.00 0.00 C ATOM 49 CE LYS A 3 6.802 -1.779 0.693 1.00 0.00 C ATOM 50 NZ LYS A 3 7.382 -1.378 2.002 1.00 0.00 N ATOM 0 H LYS A 3 4.035 -4.254 -2.002 1.00 0.00 H new ATOM 0 HA LYS A 3 6.049 -3.102 -3.719 1.00 0.00 H new ATOM 0 HB2 LYS A 3 5.708 -3.825 -0.964 1.00 0.00 H new ATOM 0 HB3 LYS A 3 7.100 -4.709 -1.559 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.130 -2.639 -2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.695 -1.717 -1.983 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.341 -3.185 0.121 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.677 -1.532 -0.355 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.280 -0.931 0.251 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.062 -2.564 0.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 6.615 -1.176 2.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.972 -2.150 2.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 7.965 -0.526 1.877 1.00 0.00 H new ATOM 64 N VAL A 4 7.259 -4.932 -4.826 1.00 0.00 N ATOM 65 CA VAL A 4 7.778 -5.927 -5.792 1.00 0.00 C ATOM 66 C VAL A 4 9.237 -6.287 -5.503 1.00 0.00 C ATOM 67 O VAL A 4 10.001 -5.413 -5.106 1.00 0.00 O ATOM 68 CB VAL A 4 7.632 -5.418 -7.242 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.093 -6.450 -8.280 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.187 -5.057 -7.591 1.00 0.00 C ATOM 0 H VAL A 4 7.706 -4.019 -4.911 1.00 0.00 H new ATOM 0 HA VAL A 4 7.179 -6.830 -5.676 1.00 0.00 H new ATOM 0 HB VAL A 4 8.267 -4.533 -7.282 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.968 -6.039 -9.282 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.144 -6.689 -8.114 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.495 -7.356 -8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.139 -4.705 -8.621 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.555 -5.938 -7.479 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.837 -4.271 -6.922 1.00 0.00 H new ATOM 80 N MET A 5 9.643 -7.537 -5.751 1.00 0.00 N ATOM 81 CA MET A 5 11.046 -7.967 -5.734 1.00 0.00 C ATOM 82 C MET A 5 11.394 -8.810 -6.972 1.00 0.00 C ATOM 83 O MET A 5 10.791 -9.860 -7.185 1.00 0.00 O ATOM 84 CB MET A 5 11.372 -8.745 -4.441 1.00 0.00 C ATOM 85 CG MET A 5 12.852 -9.177 -4.411 1.00 0.00 C ATOM 86 SD MET A 5 13.998 -7.787 -4.532 1.00 0.00 S ATOM 87 CE MET A 5 14.156 -7.289 -2.806 1.00 0.00 C ATOM 0 H MET A 5 8.994 -8.292 -5.973 1.00 0.00 H new ATOM 0 HA MET A 5 11.661 -7.067 -5.759 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.154 -8.122 -3.573 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.732 -9.624 -4.371 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.047 -9.721 -3.487 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.040 -9.867 -5.233 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.703 -6.348 -2.747 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.164 -7.160 -2.372 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.696 -8.058 -2.253 1.00 0.00 H new ATOM 97 N PHE A 6 12.388 -8.402 -7.763 1.00 0.00 N ATOM 98 CA PHE A 6 12.972 -9.212 -8.846 1.00 0.00 C ATOM 99 C PHE A 6 14.231 -9.947 -8.377 1.00 0.00 C ATOM 100 O PHE A 6 15.098 -9.336 -7.756 1.00 0.00 O ATOM 101 CB PHE A 6 13.309 -8.347 -10.065 1.00 0.00 C ATOM 102 CG PHE A 6 12.167 -7.480 -10.540 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.131 -7.999 -11.340 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.116 -6.144 -10.111 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.020 -7.202 -11.647 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.003 -5.348 -10.408 1.00 0.00 C ATOM 107 CZ PHE A 6 9.945 -5.880 -11.174 1.00 0.00 C ATOM 0 H PHE A 6 12.821 -7.483 -7.671 1.00 0.00 H new ATOM 0 HA PHE A 6 12.222 -9.949 -9.132 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.158 -7.709 -9.821 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.623 -8.996 -10.882 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.192 -9.009 -11.716 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.939 -5.728 -9.549 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.219 -7.605 -12.249 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.955 -4.330 -10.052 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.080 -5.274 -11.397 1.00 0.00 H new ATOM 117 N VAL A 7 14.351 -11.234 -8.714 1.00 0.00 N ATOM 118 CA VAL A 7 15.383 -12.151 -8.195 1.00 0.00 C ATOM 119 C VAL A 7 16.111 -12.876 -9.332 1.00 0.00 C ATOM 120 O VAL A 7 15.473 -13.461 -10.202 1.00 0.00 O ATOM 121 CB VAL A 7 14.776 -13.159 -7.190 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.888 -13.888 -6.423 1.00 0.00 C ATOM 123 CG2 VAL A 7 13.892 -12.485 -6.130 1.00 0.00 C ATOM 0 H VAL A 7 13.717 -11.685 -9.374 1.00 0.00 H new ATOM 0 HA VAL A 7 16.121 -11.550 -7.664 1.00 0.00 H new ATOM 0 HB VAL A 7 14.175 -13.842 -7.790 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.444 -14.593 -5.721 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.522 -14.428 -7.127 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.489 -13.162 -5.876 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.494 -13.241 -5.453 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.486 -11.768 -5.564 1.00 0.00 H new ATOM 0 HG23 VAL A 7 13.068 -11.967 -6.620 1.00 0.00 H new ATOM 133 N SER A 8 17.449 -12.877 -9.326 1.00 0.00 N ATOM 134 CA SER A 8 18.294 -13.642 -10.280 1.00 0.00 C ATOM 135 C SER A 8 19.626 -14.075 -9.648 1.00 0.00 C ATOM 136 O SER A 8 19.875 -13.775 -8.483 1.00 0.00 O ATOM 137 CB SER A 8 18.514 -12.823 -11.567 1.00 0.00 C ATOM 138 OG SER A 8 19.032 -11.546 -11.272 1.00 0.00 O ATOM 0 H SER A 8 17.994 -12.341 -8.651 1.00 0.00 H new ATOM 0 HA SER A 8 17.765 -14.558 -10.542 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.200 -13.354 -12.227 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.570 -12.721 -12.103 1.00 0.00 H new ATOM 0 HG SER A 8 18.372 -11.036 -10.757 1.00 0.00 H new ATOM 144 N LYS A 9 20.504 -14.788 -10.379 1.00 0.00 N ATOM 145 CA LYS A 9 21.862 -15.119 -9.883 1.00 0.00 C ATOM 146 C LYS A 9 22.719 -13.855 -9.734 1.00 0.00 C ATOM 147 O LYS A 9 23.072 -13.498 -8.619 1.00 0.00 O ATOM 148 CB LYS A 9 22.495 -16.245 -10.731 1.00 0.00 C ATOM 149 CG LYS A 9 23.842 -16.716 -10.142 1.00 0.00 C ATOM 150 CD LYS A 9 24.364 -18.030 -10.745 1.00 0.00 C ATOM 151 CE LYS A 9 24.749 -17.906 -12.229 1.00 0.00 C ATOM 152 NZ LYS A 9 25.326 -19.181 -12.753 1.00 0.00 N ATOM 0 H LYS A 9 20.302 -15.147 -11.312 1.00 0.00 H new ATOM 0 HA LYS A 9 21.795 -15.527 -8.875 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.807 -17.089 -10.787 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.648 -15.891 -11.750 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.587 -15.936 -10.297 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.732 -16.841 -9.065 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.233 -18.362 -10.178 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.600 -18.800 -10.638 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.869 -17.636 -12.813 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.473 -17.100 -12.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.575 -19.063 -13.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.179 -19.424 -12.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.626 -19.944 -12.657 1.00 0.00 H new ATOM 166 N ARG A 10 22.972 -13.142 -10.837 1.00 0.00 N ATOM 167 CA ARG A 10 23.586 -11.794 -10.835 1.00 0.00 C ATOM 168 C ARG A 10 22.498 -10.747 -10.607 1.00 0.00 C ATOM 169 O ARG A 10 21.732 -10.477 -11.526 1.00 0.00 O ATOM 170 CB ARG A 10 24.280 -11.505 -12.195 1.00 0.00 C ATOM 171 CG ARG A 10 25.814 -11.636 -12.203 1.00 0.00 C ATOM 172 CD ARG A 10 26.342 -13.075 -12.238 1.00 0.00 C ATOM 173 NE ARG A 10 27.579 -13.148 -13.047 1.00 0.00 N ATOM 174 CZ ARG A 10 28.840 -13.087 -12.647 1.00 0.00 C ATOM 175 NH1 ARG A 10 29.199 -13.000 -11.402 1.00 0.00 N ATOM 176 NH2 ARG A 10 29.788 -13.112 -13.535 1.00 0.00 N ATOM 0 H ARG A 10 22.756 -13.483 -11.774 1.00 0.00 H new ATOM 0 HA ARG A 10 24.330 -11.752 -10.040 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.872 -12.186 -12.942 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.018 -10.494 -12.508 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.205 -11.101 -13.068 1.00 0.00 H new ATOM 0 HG3 ARG A 10 26.210 -11.141 -11.316 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.541 -13.421 -11.224 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.585 -13.737 -12.658 1.00 0.00 H new ATOM 0 HE ARG A 10 27.441 -13.261 -14.051 1.00 0.00 H new ATOM 0 HH11 ARG A 10 28.491 -12.975 -10.668 1.00 0.00 H new ATOM 0 HH12 ARG A 10 30.189 -12.956 -11.158 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.557 -13.178 -14.526 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.764 -13.066 -13.241 1.00 0.00 H new ATOM 190 N ASN A 11 22.477 -10.072 -9.458 1.00 0.00 N ATOM 191 CA ASN A 11 21.592 -8.906 -9.303 1.00 0.00 C ATOM 192 C ASN A 11 21.969 -7.810 -10.316 1.00 0.00 C ATOM 193 O ASN A 11 21.089 -7.143 -10.847 1.00 0.00 O ATOM 194 CB ASN A 11 21.639 -8.368 -7.864 1.00 0.00 C ATOM 195 CG ASN A 11 20.538 -7.343 -7.666 1.00 0.00 C ATOM 196 OD1 ASN A 11 19.431 -7.666 -7.306 1.00 0.00 O ATOM 197 ND2 ASN A 11 20.738 -6.081 -7.944 1.00 0.00 N ATOM 0 H ASN A 11 23.043 -10.299 -8.640 1.00 0.00 H new ATOM 0 HA ASN A 11 20.568 -9.221 -9.505 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.519 -9.187 -7.155 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.611 -7.915 -7.666 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.974 -5.411 -7.853 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.658 -5.766 -8.251 1.00 0.00 H new ATOM 204 N SER A 12 23.272 -7.686 -10.602 1.00 0.00 N ATOM 205 CA SER A 12 23.900 -6.776 -11.572 1.00 0.00 C ATOM 206 C SER A 12 23.271 -6.750 -12.965 1.00 0.00 C ATOM 207 O SER A 12 23.197 -5.679 -13.567 1.00 0.00 O ATOM 208 CB SER A 12 25.363 -7.186 -11.742 1.00 0.00 C ATOM 209 OG SER A 12 25.459 -8.527 -12.171 1.00 0.00 O ATOM 0 H SER A 12 23.967 -8.262 -10.127 1.00 0.00 H new ATOM 0 HA SER A 12 23.764 -5.778 -11.156 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.847 -6.532 -12.467 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.893 -7.062 -10.797 1.00 0.00 H new ATOM 0 HG SER A 12 25.475 -9.120 -11.391 1.00 0.00 H new ATOM 215 N SER A 13 22.830 -7.906 -13.476 1.00 0.00 N ATOM 216 CA SER A 13 22.179 -8.037 -14.781 1.00 0.00 C ATOM 217 C SER A 13 20.656 -8.061 -14.643 1.00 0.00 C ATOM 218 O SER A 13 20.027 -7.011 -14.588 1.00 0.00 O ATOM 219 CB SER A 13 22.791 -9.185 -15.598 1.00 0.00 C ATOM 220 OG SER A 13 22.531 -10.448 -14.995 1.00 0.00 O ATOM 0 H SER A 13 22.919 -8.794 -12.982 1.00 0.00 H new ATOM 0 HA SER A 13 22.381 -7.146 -15.376 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.383 -9.172 -16.609 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.867 -9.037 -15.687 1.00 0.00 H new ATOM 0 HG SER A 13 22.931 -11.159 -15.538 1.00 0.00 H new ATOM 226 N ARG A 14 20.036 -9.240 -14.530 1.00 0.00 N ATOM 227 CA ARG A 14 18.568 -9.411 -14.623 1.00 0.00 C ATOM 228 C ARG A 14 17.787 -8.587 -13.603 1.00 0.00 C ATOM 229 O ARG A 14 16.926 -7.809 -14.007 1.00 0.00 O ATOM 230 CB ARG A 14 18.194 -10.901 -14.548 1.00 0.00 C ATOM 231 CG ARG A 14 18.081 -11.574 -15.926 1.00 0.00 C ATOM 232 CD ARG A 14 19.423 -11.773 -16.641 1.00 0.00 C ATOM 233 NE ARG A 14 20.359 -12.608 -15.841 1.00 0.00 N ATOM 234 CZ ARG A 14 20.291 -13.912 -15.605 1.00 0.00 C ATOM 235 NH1 ARG A 14 19.387 -14.667 -16.150 1.00 0.00 N ATOM 236 NH2 ARG A 14 21.168 -14.489 -14.838 1.00 0.00 N ATOM 0 H ARG A 14 20.536 -10.115 -14.370 1.00 0.00 H new ATOM 0 HA ARG A 14 18.273 -9.020 -15.597 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.943 -11.426 -13.956 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.244 -11.003 -14.023 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.599 -12.544 -15.805 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.430 -10.971 -16.560 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.252 -12.245 -17.609 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.878 -10.802 -16.835 1.00 0.00 H new ATOM 0 HE ARG A 14 21.150 -12.118 -15.423 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.698 -14.261 -16.783 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.366 -15.666 -15.945 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.915 -13.939 -14.413 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.109 -15.492 -14.661 1.00 0.00 H new ATOM 250 N SER A 15 18.083 -8.706 -12.310 1.00 0.00 N ATOM 251 CA SER A 15 17.300 -7.992 -11.283 1.00 0.00 C ATOM 252 C SER A 15 17.422 -6.472 -11.427 1.00 0.00 C ATOM 253 O SER A 15 16.412 -5.788 -11.387 1.00 0.00 O ATOM 254 CB SER A 15 17.663 -8.431 -9.875 1.00 0.00 C ATOM 255 OG SER A 15 17.574 -9.828 -9.738 1.00 0.00 O ATOM 0 H SER A 15 18.845 -9.278 -11.945 1.00 0.00 H new ATOM 0 HA SER A 15 16.257 -8.261 -11.451 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.676 -8.104 -9.639 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.997 -7.950 -9.158 1.00 0.00 H new ATOM 0 HG SER A 15 17.806 -10.082 -8.820 1.00 0.00 H new ATOM 261 N GLN A 16 18.617 -5.936 -11.690 1.00 0.00 N ATOM 262 CA GLN A 16 18.860 -4.532 -12.064 1.00 0.00 C ATOM 263 C GLN A 16 18.168 -4.088 -13.360 1.00 0.00 C ATOM 264 O GLN A 16 17.614 -2.987 -13.404 1.00 0.00 O ATOM 265 CB GLN A 16 20.376 -4.340 -12.177 1.00 0.00 C ATOM 266 CG GLN A 16 21.018 -3.952 -10.843 1.00 0.00 C ATOM 267 CD GLN A 16 21.009 -2.451 -10.572 1.00 0.00 C ATOM 268 OE1 GLN A 16 20.208 -1.679 -11.089 1.00 0.00 O ATOM 269 NE2 GLN A 16 21.935 -2.002 -9.755 1.00 0.00 N ATOM 0 H GLN A 16 19.476 -6.484 -11.648 1.00 0.00 H new ATOM 0 HA GLN A 16 18.424 -3.903 -11.288 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.830 -5.262 -12.540 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.587 -3.568 -12.917 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.492 -4.461 -10.035 1.00 0.00 H new ATOM 0 HG3 GLN A 16 22.048 -4.309 -10.828 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.597 -2.650 -9.329 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.991 -1.005 -9.547 1.00 0.00 H new ATOM 278 N MET A 17 18.128 -4.928 -14.397 1.00 0.00 N ATOM 279 CA MET A 17 17.423 -4.607 -15.649 1.00 0.00 C ATOM 280 C MET A 17 15.914 -4.472 -15.404 1.00 0.00 C ATOM 281 O MET A 17 15.308 -3.472 -15.786 1.00 0.00 O ATOM 282 CB MET A 17 17.750 -5.647 -16.738 1.00 0.00 C ATOM 283 CG MET A 17 19.212 -5.539 -17.199 1.00 0.00 C ATOM 284 SD MET A 17 19.783 -6.923 -18.220 1.00 0.00 S ATOM 285 CE MET A 17 19.195 -6.359 -19.840 1.00 0.00 C ATOM 0 H MET A 17 18.578 -5.843 -14.397 1.00 0.00 H new ATOM 0 HA MET A 17 17.774 -3.641 -16.013 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.562 -6.649 -16.354 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.087 -5.503 -17.591 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.335 -4.614 -17.762 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.852 -5.464 -16.320 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.652 -6.964 -20.624 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.111 -6.460 -19.889 1.00 0.00 H new ATOM 0 HE3 MET A 17 19.469 -5.314 -19.983 1.00 0.00 H new ATOM 295 N ALA A 18 15.323 -5.412 -14.665 1.00 0.00 N ATOM 296 CA ALA A 18 13.932 -5.310 -14.222 1.00 0.00 C ATOM 297 C ALA A 18 13.715 -4.206 -13.177 1.00 0.00 C ATOM 298 O ALA A 18 12.630 -3.644 -13.135 1.00 0.00 O ATOM 299 CB ALA A 18 13.500 -6.674 -13.692 1.00 0.00 C ATOM 0 H ALA A 18 15.794 -6.263 -14.357 1.00 0.00 H new ATOM 0 HA ALA A 18 13.315 -5.023 -15.073 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.465 -6.622 -13.355 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.587 -7.417 -14.485 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.139 -6.959 -12.856 1.00 0.00 H new ATOM 305 N GLU A 19 14.727 -3.816 -12.395 1.00 0.00 N ATOM 306 CA GLU A 19 14.600 -2.742 -11.402 1.00 0.00 C ATOM 307 C GLU A 19 14.391 -1.435 -12.143 1.00 0.00 C ATOM 308 O GLU A 19 13.400 -0.746 -11.939 1.00 0.00 O ATOM 309 CB GLU A 19 15.868 -2.653 -10.531 1.00 0.00 C ATOM 310 CG GLU A 19 15.823 -1.586 -9.432 1.00 0.00 C ATOM 311 CD GLU A 19 15.097 -2.121 -8.196 1.00 0.00 C ATOM 312 OE1 GLU A 19 13.861 -2.289 -8.265 1.00 0.00 O ATOM 313 OE2 GLU A 19 15.786 -2.420 -7.188 1.00 0.00 O ATOM 0 H GLU A 19 15.656 -4.235 -12.432 1.00 0.00 H new ATOM 0 HA GLU A 19 13.755 -2.948 -10.745 1.00 0.00 H new ATOM 0 HB2 GLU A 19 16.041 -3.624 -10.067 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.722 -2.452 -11.178 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.837 -1.287 -9.165 1.00 0.00 H new ATOM 0 HG3 GLU A 19 15.315 -0.695 -9.802 1.00 0.00 H new ATOM 320 N GLY A 20 15.292 -1.139 -13.082 1.00 0.00 N ATOM 321 CA GLY A 20 15.240 0.082 -13.867 1.00 0.00 C ATOM 322 C GLY A 20 14.003 0.145 -14.756 1.00 0.00 C ATOM 323 O GLY A 20 13.334 1.170 -14.761 1.00 0.00 O ATOM 0 H GLY A 20 16.078 -1.746 -13.315 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.248 0.942 -13.198 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.134 0.152 -14.487 1.00 0.00 H new ATOM 327 N PHE A 21 13.620 -0.938 -15.442 1.00 0.00 N ATOM 328 CA PHE A 21 12.349 -0.956 -16.185 1.00 0.00 C ATOM 329 C PHE A 21 11.137 -0.806 -15.262 1.00 0.00 C ATOM 330 O PHE A 21 10.242 -0.036 -15.576 1.00 0.00 O ATOM 331 CB PHE A 21 12.238 -2.223 -17.061 1.00 0.00 C ATOM 332 CG PHE A 21 12.746 -2.080 -18.482 1.00 0.00 C ATOM 333 CD1 PHE A 21 12.107 -1.179 -19.352 1.00 0.00 C ATOM 334 CD2 PHE A 21 13.804 -2.873 -18.966 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.556 -1.026 -20.675 1.00 0.00 C ATOM 336 CE2 PHE A 21 14.245 -2.732 -20.291 1.00 0.00 C ATOM 337 CZ PHE A 21 13.624 -1.807 -21.146 1.00 0.00 C ATOM 0 H PHE A 21 14.160 -1.802 -15.500 1.00 0.00 H new ATOM 0 HA PHE A 21 12.349 -0.089 -16.845 1.00 0.00 H new ATOM 0 HB2 PHE A 21 12.789 -3.028 -16.576 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.192 -2.529 -17.096 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.265 -0.600 -19.001 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.278 -3.593 -18.315 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.081 -0.309 -21.328 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.064 -3.336 -20.654 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.967 -1.696 -22.164 1.00 0.00 H new ATOM 347 N ALA A 22 11.080 -1.483 -14.114 1.00 0.00 N ATOM 348 CA ALA A 22 9.866 -1.462 -13.283 1.00 0.00 C ATOM 349 C ALA A 22 9.717 -0.119 -12.568 1.00 0.00 C ATOM 350 O ALA A 22 8.617 0.419 -12.463 1.00 0.00 O ATOM 351 CB ALA A 22 9.882 -2.663 -12.336 1.00 0.00 C ATOM 0 H ALA A 22 11.844 -2.045 -13.739 1.00 0.00 H new ATOM 0 HA ALA A 22 8.979 -1.557 -13.910 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.984 -2.651 -11.718 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.910 -3.585 -12.917 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.763 -2.610 -11.696 1.00 0.00 H new ATOM 357 N LYS A 23 10.847 0.466 -12.167 1.00 0.00 N ATOM 358 CA LYS A 23 10.960 1.835 -11.666 1.00 0.00 C ATOM 359 C LYS A 23 10.502 2.809 -12.747 1.00 0.00 C ATOM 360 O LYS A 23 9.491 3.475 -12.572 1.00 0.00 O ATOM 361 CB LYS A 23 12.419 2.040 -11.228 1.00 0.00 C ATOM 362 CG LYS A 23 12.670 3.334 -10.456 1.00 0.00 C ATOM 363 CD LYS A 23 14.183 3.435 -10.191 1.00 0.00 C ATOM 364 CE LYS A 23 14.666 4.825 -9.764 1.00 0.00 C ATOM 365 NZ LYS A 23 14.200 5.216 -8.398 1.00 0.00 N ATOM 0 H LYS A 23 11.743 -0.021 -12.183 1.00 0.00 H new ATOM 0 HA LYS A 23 10.318 2.020 -10.805 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.721 1.196 -10.607 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.056 2.029 -12.112 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.324 4.194 -11.029 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.117 3.333 -9.517 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.451 2.718 -9.415 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.717 3.141 -11.095 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.755 4.848 -9.790 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.315 5.562 -10.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.559 6.164 -8.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 13.160 5.224 -8.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.556 4.532 -7.701 1.00 0.00 H new ATOM 379 N THR A 24 11.134 2.813 -13.920 1.00 0.00 N ATOM 380 CA THR A 24 10.751 3.750 -14.995 1.00 0.00 C ATOM 381 C THR A 24 9.355 3.525 -15.600 1.00 0.00 C ATOM 382 O THR A 24 8.836 4.436 -16.247 1.00 0.00 O ATOM 383 CB THR A 24 11.814 3.829 -16.091 1.00 0.00 C ATOM 384 OG1 THR A 24 12.027 2.577 -16.692 1.00 0.00 O ATOM 385 CG2 THR A 24 13.137 4.337 -15.531 1.00 0.00 C ATOM 0 H THR A 24 11.905 2.189 -14.156 1.00 0.00 H new ATOM 0 HA THR A 24 10.689 4.714 -14.490 1.00 0.00 H new ATOM 0 HB THR A 24 11.443 4.526 -16.842 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.500 1.990 -16.066 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.876 4.384 -16.330 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.995 5.332 -15.109 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.487 3.659 -14.753 1.00 0.00 H new ATOM 393 N LEU A 25 8.704 2.380 -15.340 1.00 0.00 N ATOM 394 CA LEU A 25 7.310 2.118 -15.729 1.00 0.00 C ATOM 395 C LEU A 25 6.280 2.355 -14.600 1.00 0.00 C ATOM 396 O LEU A 25 5.079 2.248 -14.858 1.00 0.00 O ATOM 397 CB LEU A 25 7.196 0.689 -16.314 1.00 0.00 C ATOM 398 CG LEU A 25 7.868 0.501 -17.689 1.00 0.00 C ATOM 399 CD1 LEU A 25 8.051 -0.990 -17.985 1.00 0.00 C ATOM 400 CD2 LEU A 25 7.020 1.107 -18.807 1.00 0.00 C ATOM 0 H LEU A 25 9.138 1.600 -14.847 1.00 0.00 H new ATOM 0 HA LEU A 25 7.052 2.851 -16.493 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.639 -0.014 -15.609 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.141 0.430 -16.402 1.00 0.00 H new ATOM 0 HG LEU A 25 8.833 1.006 -17.652 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.526 -1.112 -18.958 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.679 -1.439 -17.216 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.078 -1.482 -17.992 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.520 0.959 -19.764 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.045 0.621 -18.828 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.890 2.174 -18.627 1.00 0.00 H new ATOM 412 N GLY A 26 6.703 2.656 -13.361 1.00 0.00 N ATOM 413 CA GLY A 26 5.790 2.709 -12.202 1.00 0.00 C ATOM 414 C GLY A 26 6.271 3.419 -10.928 1.00 0.00 C ATOM 415 O GLY A 26 5.652 3.231 -9.884 1.00 0.00 O ATOM 0 H GLY A 26 7.675 2.867 -13.134 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.870 3.195 -12.526 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.533 1.684 -11.934 1.00 0.00 H new ATOM 419 N ALA A 27 7.334 4.229 -10.982 1.00 0.00 N ATOM 420 CA ALA A 27 8.014 4.820 -9.817 1.00 0.00 C ATOM 421 C ALA A 27 7.085 5.597 -8.853 1.00 0.00 C ATOM 422 O ALA A 27 7.294 5.574 -7.638 1.00 0.00 O ATOM 423 CB ALA A 27 9.126 5.746 -10.344 1.00 0.00 C ATOM 0 H ALA A 27 7.762 4.502 -11.867 1.00 0.00 H new ATOM 0 HA ALA A 27 8.411 3.999 -9.220 1.00 0.00 H new ATOM 0 HB1 ALA A 27 9.650 6.200 -9.503 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.831 5.166 -10.940 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.686 6.528 -10.963 1.00 0.00 H new ATOM 429 N GLY A 28 6.053 6.269 -9.382 1.00 0.00 N ATOM 430 CA GLY A 28 5.068 7.034 -8.597 1.00 0.00 C ATOM 431 C GLY A 28 3.901 6.212 -8.026 1.00 0.00 C ATOM 432 O GLY A 28 3.075 6.765 -7.297 1.00 0.00 O ATOM 0 H GLY A 28 5.874 6.298 -10.386 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.586 7.521 -7.771 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.660 7.824 -9.228 1.00 0.00 H new ATOM 436 N LYS A 29 3.798 4.915 -8.368 1.00 0.00 N ATOM 437 CA LYS A 29 2.625 4.058 -8.072 1.00 0.00 C ATOM 438 C LYS A 29 2.855 3.180 -6.844 1.00 0.00 C ATOM 439 O LYS A 29 2.145 3.284 -5.846 1.00 0.00 O ATOM 440 CB LYS A 29 2.255 3.209 -9.313 1.00 0.00 C ATOM 441 CG LYS A 29 2.139 3.997 -10.629 1.00 0.00 C ATOM 442 CD LYS A 29 1.227 5.230 -10.542 1.00 0.00 C ATOM 443 CE LYS A 29 -0.233 4.903 -10.187 1.00 0.00 C ATOM 444 NZ LYS A 29 -0.975 4.306 -11.332 1.00 0.00 N ATOM 0 H LYS A 29 4.538 4.420 -8.866 1.00 0.00 H new ATOM 0 HA LYS A 29 1.784 4.710 -7.836 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.007 2.430 -9.439 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.306 2.708 -9.122 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.134 4.316 -10.938 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.761 3.333 -11.406 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.628 5.914 -9.794 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.249 5.754 -11.497 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.253 4.212 -9.344 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.739 5.813 -9.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.783 3.758 -10.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.319 5.064 -11.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.341 3.678 -11.867 1.00 0.00 H new ATOM 458 N ILE A 30 3.875 2.330 -6.946 1.00 0.00 N ATOM 459 CA ILE A 30 4.342 1.378 -5.916 1.00 0.00 C ATOM 460 C ILE A 30 5.883 1.335 -5.886 1.00 0.00 C ATOM 461 O ILE A 30 6.534 1.881 -6.776 1.00 0.00 O ATOM 462 CB ILE A 30 3.702 -0.028 -6.104 1.00 0.00 C ATOM 463 CG1 ILE A 30 3.998 -0.747 -7.442 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.171 0.057 -5.970 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.406 -1.342 -7.574 1.00 0.00 C ATOM 0 H ILE A 30 4.437 2.277 -7.796 1.00 0.00 H new ATOM 0 HA ILE A 30 4.009 1.730 -4.940 1.00 0.00 H new ATOM 0 HB ILE A 30 4.171 -0.619 -5.318 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.270 -1.548 -7.573 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.843 -0.040 -8.257 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.738 -0.934 -6.104 1.00 0.00 H new ATOM 0 HG22 ILE A 30 1.913 0.435 -4.981 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.776 0.731 -6.730 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.508 -1.822 -8.547 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.147 -0.548 -7.481 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.565 -2.079 -6.787 1.00 0.00 H new ATOM 477 N ALA A 31 6.480 0.671 -4.887 1.00 0.00 N ATOM 478 CA ALA A 31 7.928 0.492 -4.807 1.00 0.00 C ATOM 479 C ALA A 31 8.355 -0.839 -5.414 1.00 0.00 C ATOM 480 O ALA A 31 7.896 -1.916 -5.023 1.00 0.00 O ATOM 481 CB ALA A 31 8.435 0.602 -3.370 1.00 0.00 C ATOM 0 H ALA A 31 5.969 0.245 -4.114 1.00 0.00 H new ATOM 0 HA ALA A 31 8.378 1.298 -5.386 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.516 0.463 -3.354 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.190 1.587 -2.972 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.961 -0.165 -2.757 1.00 0.00 H new ATOM 487 N VAL A 32 9.272 -0.744 -6.363 1.00 0.00 N ATOM 488 CA VAL A 32 9.988 -1.872 -6.933 1.00 0.00 C ATOM 489 C VAL A 32 11.313 -2.132 -6.210 1.00 0.00 C ATOM 490 O VAL A 32 11.898 -1.224 -5.612 1.00 0.00 O ATOM 491 CB VAL A 32 10.218 -1.614 -8.417 1.00 0.00 C ATOM 492 CG1 VAL A 32 8.867 -1.614 -9.142 1.00 0.00 C ATOM 493 CG2 VAL A 32 10.974 -0.315 -8.734 1.00 0.00 C ATOM 0 H VAL A 32 9.547 0.150 -6.771 1.00 0.00 H new ATOM 0 HA VAL A 32 9.383 -2.770 -6.806 1.00 0.00 H new ATOM 0 HB VAL A 32 10.862 -2.420 -8.768 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.024 -1.430 -10.205 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.383 -2.581 -9.009 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.232 -0.831 -8.728 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.091 -0.216 -9.813 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.412 0.536 -8.350 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.957 -0.342 -8.264 1.00 0.00 H new ATOM 503 N THR A 33 11.763 -3.387 -6.257 1.00 0.00 N ATOM 504 CA THR A 33 13.015 -3.820 -5.630 1.00 0.00 C ATOM 505 C THR A 33 13.693 -4.930 -6.430 1.00 0.00 C ATOM 506 O THR A 33 13.030 -5.748 -7.064 1.00 0.00 O ATOM 507 CB THR A 33 12.816 -4.288 -4.175 1.00 0.00 C ATOM 508 OG1 THR A 33 11.636 -3.785 -3.589 1.00 0.00 O ATOM 509 CG2 THR A 33 13.974 -3.834 -3.288 1.00 0.00 C ATOM 0 H THR A 33 11.265 -4.138 -6.735 1.00 0.00 H new ATOM 0 HA THR A 33 13.660 -2.941 -5.621 1.00 0.00 H new ATOM 0 HB THR A 33 12.759 -5.375 -4.234 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.858 -4.231 -3.984 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.807 -4.178 -2.267 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.907 -4.254 -3.664 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.035 -2.746 -3.299 1.00 0.00 H new ATOM 517 N SER A 34 15.017 -4.984 -6.368 1.00 0.00 N ATOM 518 CA SER A 34 15.883 -6.048 -6.890 1.00 0.00 C ATOM 519 C SER A 34 16.734 -6.726 -5.807 1.00 0.00 C ATOM 520 O SER A 34 17.272 -6.062 -4.914 1.00 0.00 O ATOM 521 CB SER A 34 16.793 -5.509 -7.995 1.00 0.00 C ATOM 522 OG SER A 34 17.535 -4.361 -7.625 1.00 0.00 O ATOM 0 H SER A 34 15.555 -4.240 -5.924 1.00 0.00 H new ATOM 0 HA SER A 34 15.214 -6.808 -7.295 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.486 -6.295 -8.296 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.185 -5.270 -8.867 1.00 0.00 H new ATOM 0 HG SER A 34 16.946 -3.723 -7.170 1.00 0.00 H new ATOM 528 N SER A 35 16.861 -8.052 -5.897 1.00 0.00 N ATOM 529 CA SER A 35 17.789 -8.860 -5.111 1.00 0.00 C ATOM 530 C SER A 35 18.323 -10.030 -5.937 1.00 0.00 C ATOM 531 O SER A 35 17.888 -10.276 -7.066 1.00 0.00 O ATOM 532 CB SER A 35 17.160 -9.339 -3.797 1.00 0.00 C ATOM 533 OG SER A 35 16.231 -10.388 -4.030 1.00 0.00 O ATOM 0 H SER A 35 16.300 -8.609 -6.542 1.00 0.00 H new ATOM 0 HA SER A 35 18.633 -8.225 -4.842 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.942 -9.684 -3.120 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.658 -8.506 -3.305 1.00 0.00 H new ATOM 0 HG SER A 35 15.382 -10.010 -4.342 1.00 0.00 H new ATOM 539 N GLY A 36 19.290 -10.777 -5.411 1.00 0.00 N ATOM 540 CA GLY A 36 19.703 -12.014 -6.064 1.00 0.00 C ATOM 541 C GLY A 36 20.708 -12.839 -5.277 1.00 0.00 C ATOM 542 O GLY A 36 21.096 -12.464 -4.172 1.00 0.00 O ATOM 0 H GLY A 36 19.793 -10.553 -4.552 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.819 -12.624 -6.251 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.133 -11.771 -7.035 1.00 0.00 H new ATOM 546 N LEU A 37 21.118 -13.979 -5.838 1.00 0.00 N ATOM 547 CA LEU A 37 22.077 -14.890 -5.186 1.00 0.00 C ATOM 548 C LEU A 37 23.454 -14.221 -4.996 1.00 0.00 C ATOM 549 O LEU A 37 24.159 -14.499 -4.026 1.00 0.00 O ATOM 550 CB LEU A 37 22.220 -16.201 -5.987 1.00 0.00 C ATOM 551 CG LEU A 37 20.914 -16.933 -6.371 1.00 0.00 C ATOM 552 CD1 LEU A 37 21.249 -18.258 -7.054 1.00 0.00 C ATOM 553 CD2 LEU A 37 20.015 -17.220 -5.171 1.00 0.00 C ATOM 0 H LEU A 37 20.800 -14.300 -6.752 1.00 0.00 H new ATOM 0 HA LEU A 37 21.682 -15.128 -4.198 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.767 -15.980 -6.904 1.00 0.00 H new ATOM 0 HB3 LEU A 37 22.835 -16.888 -5.406 1.00 0.00 H new ATOM 0 HG LEU A 37 20.371 -16.268 -7.042 1.00 0.00 H new ATOM 0 HD11 LEU A 37 20.326 -18.772 -7.324 1.00 0.00 H new ATOM 0 HD12 LEU A 37 21.834 -18.066 -7.954 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.826 -18.883 -6.373 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.115 -17.735 -5.506 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.549 -17.849 -4.458 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.739 -16.281 -4.691 1.00 0.00 H new ATOM 565 N GLU A 38 23.800 -13.303 -5.898 1.00 0.00 N ATOM 566 CA GLU A 38 24.939 -12.393 -5.829 1.00 0.00 C ATOM 567 C GLU A 38 24.427 -10.949 -5.890 1.00 0.00 C ATOM 568 O GLU A 38 23.756 -10.551 -6.844 1.00 0.00 O ATOM 569 CB GLU A 38 25.906 -12.716 -6.976 1.00 0.00 C ATOM 570 CG GLU A 38 27.264 -12.029 -6.792 1.00 0.00 C ATOM 571 CD GLU A 38 28.249 -12.429 -7.908 1.00 0.00 C ATOM 572 OE1 GLU A 38 27.845 -12.499 -9.093 1.00 0.00 O ATOM 573 OE2 GLU A 38 29.446 -12.666 -7.605 1.00 0.00 O ATOM 0 H GLU A 38 23.256 -13.168 -6.750 1.00 0.00 H new ATOM 0 HA GLU A 38 25.483 -12.514 -4.892 1.00 0.00 H new ATOM 0 HB2 GLU A 38 26.050 -13.795 -7.036 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.465 -12.401 -7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.130 -10.947 -6.793 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.682 -12.298 -5.822 1.00 0.00 H new ATOM 580 N SER A 39 24.772 -10.138 -4.888 1.00 0.00 N ATOM 581 CA SER A 39 24.474 -8.697 -4.800 1.00 0.00 C ATOM 582 C SER A 39 25.416 -7.864 -5.676 1.00 0.00 C ATOM 583 O SER A 39 25.952 -6.827 -5.277 1.00 0.00 O ATOM 584 CB SER A 39 24.512 -8.274 -3.334 1.00 0.00 C ATOM 585 OG SER A 39 25.750 -8.624 -2.726 1.00 0.00 O ATOM 0 H SER A 39 25.290 -10.477 -4.077 1.00 0.00 H new ATOM 0 HA SER A 39 23.474 -8.511 -5.191 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.360 -7.197 -3.260 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.693 -8.749 -2.795 1.00 0.00 H new ATOM 0 HG SER A 39 25.746 -8.339 -1.788 1.00 0.00 H new ATOM 591 N SER A 40 25.643 -8.364 -6.889 1.00 0.00 N ATOM 592 CA SER A 40 26.657 -7.889 -7.828 1.00 0.00 C ATOM 593 C SER A 40 26.430 -6.437 -8.288 1.00 0.00 C ATOM 594 O SER A 40 25.303 -5.936 -8.277 1.00 0.00 O ATOM 595 CB SER A 40 26.766 -8.876 -8.993 1.00 0.00 C ATOM 596 OG SER A 40 25.475 -9.245 -9.449 1.00 0.00 O ATOM 0 H SER A 40 25.102 -9.145 -7.260 1.00 0.00 H new ATOM 0 HA SER A 40 27.615 -7.856 -7.309 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.332 -8.425 -9.808 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.315 -9.763 -8.677 1.00 0.00 H new ATOM 0 HG SER A 40 25.202 -10.081 -9.017 1.00 0.00 H new ATOM 602 N ARG A 41 27.515 -5.761 -8.701 1.00 0.00 N ATOM 603 CA ARG A 41 27.576 -4.300 -8.985 1.00 0.00 C ATOM 604 C ARG A 41 26.723 -3.848 -10.179 1.00 0.00 C ATOM 605 O ARG A 41 26.151 -4.660 -10.883 1.00 0.00 O ATOM 606 CB ARG A 41 29.059 -3.886 -9.149 1.00 0.00 C ATOM 607 CG ARG A 41 29.711 -4.403 -10.451 1.00 0.00 C ATOM 608 CD ARG A 41 31.165 -3.924 -10.603 1.00 0.00 C ATOM 609 NE ARG A 41 32.061 -4.518 -9.584 1.00 0.00 N ATOM 610 CZ ARG A 41 33.315 -4.174 -9.340 1.00 0.00 C ATOM 611 NH1 ARG A 41 33.917 -3.228 -10.003 1.00 0.00 N ATOM 612 NH2 ARG A 41 33.998 -4.784 -8.414 1.00 0.00 N ATOM 0 H ARG A 41 28.410 -6.225 -8.855 1.00 0.00 H new ATOM 0 HA ARG A 41 27.132 -3.785 -8.133 1.00 0.00 H new ATOM 0 HB2 ARG A 41 29.127 -2.798 -9.127 1.00 0.00 H new ATOM 0 HB3 ARG A 41 29.627 -4.259 -8.297 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.687 -5.493 -10.460 1.00 0.00 H new ATOM 0 HG3 ARG A 41 29.127 -4.064 -11.307 1.00 0.00 H new ATOM 0 HD2 ARG A 41 31.528 -4.182 -11.598 1.00 0.00 H new ATOM 0 HD3 ARG A 41 31.198 -2.837 -10.523 1.00 0.00 H new ATOM 0 HE ARG A 41 31.672 -5.268 -9.013 1.00 0.00 H new ATOM 0 HH11 ARG A 41 33.420 -2.725 -10.738 1.00 0.00 H new ATOM 0 HH12 ARG A 41 34.885 -2.990 -9.787 1.00 0.00 H new ATOM 0 HH21 ARG A 41 33.567 -5.532 -7.871 1.00 0.00 H new ATOM 0 HH22 ARG A 41 34.964 -4.514 -8.231 1.00 0.00 H new ATOM 626 N VAL A 42 26.673 -2.554 -10.485 1.00 0.00 N ATOM 627 CA VAL A 42 26.067 -2.055 -11.733 1.00 0.00 C ATOM 628 C VAL A 42 26.863 -2.586 -12.944 1.00 0.00 C ATOM 629 O VAL A 42 28.027 -2.241 -13.131 1.00 0.00 O ATOM 630 CB VAL A 42 25.939 -0.520 -11.681 1.00 0.00 C ATOM 631 CG1 VAL A 42 24.855 -0.154 -10.663 1.00 0.00 C ATOM 632 CG2 VAL A 42 27.218 0.228 -11.270 1.00 0.00 C ATOM 0 H VAL A 42 27.047 -1.820 -9.884 1.00 0.00 H new ATOM 0 HA VAL A 42 25.051 -2.433 -11.848 1.00 0.00 H new ATOM 0 HB VAL A 42 25.704 -0.213 -12.700 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.752 0.930 -10.615 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.906 -0.595 -10.968 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.134 -0.536 -9.681 1.00 0.00 H new ATOM 0 HG21 VAL A 42 27.026 1.301 -11.263 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.523 -0.092 -10.274 1.00 0.00 H new ATOM 0 HG23 VAL A 42 28.014 0.006 -11.981 1.00 0.00 H new ATOM 642 N HIS A 43 26.270 -3.498 -13.726 1.00 0.00 N ATOM 643 CA HIS A 43 26.985 -4.253 -14.776 1.00 0.00 C ATOM 644 C HIS A 43 27.430 -3.355 -15.945 1.00 0.00 C ATOM 645 O HIS A 43 26.613 -2.566 -16.422 1.00 0.00 O ATOM 646 CB HIS A 43 26.101 -5.408 -15.275 1.00 0.00 C ATOM 647 CG HIS A 43 26.782 -6.354 -16.219 1.00 0.00 C ATOM 648 ND1 HIS A 43 26.973 -6.134 -17.583 1.00 0.00 N ATOM 649 CD2 HIS A 43 27.338 -7.546 -15.870 1.00 0.00 C ATOM 650 CE1 HIS A 43 27.645 -7.217 -18.023 1.00 0.00 C ATOM 651 NE2 HIS A 43 27.880 -8.071 -17.017 1.00 0.00 N ATOM 0 H HIS A 43 25.281 -3.737 -13.652 1.00 0.00 H new ATOM 0 HA HIS A 43 27.895 -4.659 -14.335 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.742 -5.971 -14.414 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.225 -4.989 -15.770 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.350 -7.991 -14.886 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.952 -7.375 -19.046 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.377 -8.959 -17.091 1.00 0.00 H new ATOM 659 N PRO A 44 28.671 -3.477 -16.456 1.00 0.00 N ATOM 660 CA PRO A 44 29.212 -2.581 -17.485 1.00 0.00 C ATOM 661 C PRO A 44 28.391 -2.559 -18.780 1.00 0.00 C ATOM 662 O PRO A 44 28.166 -1.490 -19.351 1.00 0.00 O ATOM 663 CB PRO A 44 30.639 -3.081 -17.747 1.00 0.00 C ATOM 664 CG PRO A 44 30.605 -4.542 -17.300 1.00 0.00 C ATOM 665 CD PRO A 44 29.676 -4.471 -16.097 1.00 0.00 C ATOM 0 HA PRO A 44 29.183 -1.550 -17.134 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.907 -2.992 -18.800 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.373 -2.507 -17.182 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.218 -5.200 -18.078 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.595 -4.912 -17.032 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.219 -5.439 -15.894 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.217 -4.179 -15.197 1.00 0.00 H new ATOM 673 N THR A 45 27.897 -3.721 -19.224 1.00 0.00 N ATOM 674 CA THR A 45 27.053 -3.823 -20.424 1.00 0.00 C ATOM 675 C THR A 45 25.628 -3.369 -20.118 1.00 0.00 C ATOM 676 O THR A 45 25.034 -2.660 -20.927 1.00 0.00 O ATOM 677 CB THR A 45 27.073 -5.248 -21.004 1.00 0.00 C ATOM 678 OG1 THR A 45 28.393 -5.751 -21.073 1.00 0.00 O ATOM 679 CG2 THR A 45 26.479 -5.325 -22.410 1.00 0.00 C ATOM 0 H THR A 45 28.069 -4.615 -18.764 1.00 0.00 H new ATOM 0 HA THR A 45 27.465 -3.159 -21.184 1.00 0.00 H new ATOM 0 HB THR A 45 26.463 -5.844 -20.325 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.378 -6.658 -21.443 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.520 -6.354 -22.767 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.442 -4.991 -22.386 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.051 -4.685 -23.082 1.00 0.00 H new ATOM 687 N ALA A 46 25.087 -3.676 -18.933 1.00 0.00 N ATOM 688 CA ALA A 46 23.749 -3.209 -18.557 1.00 0.00 C ATOM 689 C ALA A 46 23.671 -1.679 -18.448 1.00 0.00 C ATOM 690 O ALA A 46 22.719 -1.111 -18.967 1.00 0.00 O ATOM 691 CB ALA A 46 23.288 -3.892 -17.267 1.00 0.00 C ATOM 0 H ALA A 46 25.552 -4.242 -18.223 1.00 0.00 H new ATOM 0 HA ALA A 46 23.066 -3.491 -19.358 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.293 -3.534 -17.002 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.258 -4.971 -17.417 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.985 -3.657 -16.462 1.00 0.00 H new ATOM 697 N ILE A 47 24.664 -0.986 -17.868 1.00 0.00 N ATOM 698 CA ILE A 47 24.705 0.488 -17.837 1.00 0.00 C ATOM 699 C ILE A 47 24.493 1.062 -19.252 1.00 0.00 C ATOM 700 O ILE A 47 23.621 1.905 -19.432 1.00 0.00 O ATOM 701 CB ILE A 47 26.026 0.987 -17.200 1.00 0.00 C ATOM 702 CG1 ILE A 47 26.124 0.591 -15.708 1.00 0.00 C ATOM 703 CG2 ILE A 47 26.128 2.518 -17.286 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.557 0.640 -15.169 1.00 0.00 C ATOM 0 H ILE A 47 25.460 -1.429 -17.408 1.00 0.00 H new ATOM 0 HA ILE A 47 23.889 0.850 -17.211 1.00 0.00 H new ATOM 0 HB ILE A 47 26.837 0.518 -17.758 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.497 1.260 -15.118 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.727 -0.416 -15.578 1.00 0.00 H new ATOM 0 HG21 ILE A 47 27.063 2.846 -16.833 1.00 0.00 H new ATOM 0 HG22 ILE A 47 26.104 2.826 -18.331 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.290 2.969 -16.755 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.560 0.352 -14.118 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.183 -0.049 -15.736 1.00 0.00 H new ATOM 0 HD13 ILE A 47 27.949 1.652 -15.269 1.00 0.00 H new ATOM 716 N ALA A 48 25.190 0.535 -20.268 1.00 0.00 N ATOM 717 CA ALA A 48 25.005 0.931 -21.669 1.00 0.00 C ATOM 718 C ALA A 48 23.617 0.576 -22.226 1.00 0.00 C ATOM 719 O ALA A 48 22.865 1.455 -22.649 1.00 0.00 O ATOM 720 CB ALA A 48 26.106 0.274 -22.507 1.00 0.00 C ATOM 0 H ALA A 48 25.903 -0.183 -20.139 1.00 0.00 H new ATOM 0 HA ALA A 48 25.073 2.018 -21.722 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.985 0.557 -23.553 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.081 0.607 -22.152 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.036 -0.810 -22.414 1.00 0.00 H new ATOM 726 N MET A 49 23.259 -0.710 -22.229 1.00 0.00 N ATOM 727 CA MET A 49 22.035 -1.201 -22.883 1.00 0.00 C ATOM 728 C MET A 49 20.753 -0.713 -22.203 1.00 0.00 C ATOM 729 O MET A 49 19.696 -0.712 -22.828 1.00 0.00 O ATOM 730 CB MET A 49 22.024 -2.732 -22.925 1.00 0.00 C ATOM 731 CG MET A 49 23.248 -3.376 -23.591 1.00 0.00 C ATOM 732 SD MET A 49 23.525 -3.023 -25.344 1.00 0.00 S ATOM 733 CE MET A 49 24.596 -1.560 -25.255 1.00 0.00 C ATOM 0 H MET A 49 23.807 -1.444 -21.779 1.00 0.00 H new ATOM 0 HA MET A 49 22.050 -0.793 -23.894 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.946 -3.107 -21.905 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.129 -3.059 -23.454 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.135 -3.063 -23.040 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.165 -4.457 -23.474 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.934 -1.295 -26.257 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.039 -0.726 -24.828 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.460 -1.779 -24.627 1.00 0.00 H new ATOM 743 N MET A 50 20.827 -0.303 -20.940 1.00 0.00 N ATOM 744 CA MET A 50 19.703 0.268 -20.207 1.00 0.00 C ATOM 745 C MET A 50 19.663 1.798 -20.381 1.00 0.00 C ATOM 746 O MET A 50 18.589 2.349 -20.612 1.00 0.00 O ATOM 747 CB MET A 50 19.768 -0.206 -18.750 1.00 0.00 C ATOM 748 CG MET A 50 19.755 -1.738 -18.616 1.00 0.00 C ATOM 749 SD MET A 50 18.191 -2.549 -19.069 1.00 0.00 S ATOM 750 CE MET A 50 17.062 -1.771 -17.883 1.00 0.00 C ATOM 0 H MET A 50 21.684 -0.359 -20.389 1.00 0.00 H new ATOM 0 HA MET A 50 18.754 -0.085 -20.610 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.673 0.186 -18.286 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.923 0.209 -18.201 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.550 -2.147 -19.239 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.993 -1.997 -17.584 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.228 -2.443 -17.680 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.595 -1.564 -16.955 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.683 -0.838 -18.300 1.00 0.00 H new ATOM 760 N GLU A 51 20.806 2.492 -20.419 1.00 0.00 N ATOM 761 CA GLU A 51 20.872 3.915 -20.801 1.00 0.00 C ATOM 762 C GLU A 51 20.314 4.163 -22.219 1.00 0.00 C ATOM 763 O GLU A 51 19.603 5.149 -22.428 1.00 0.00 O ATOM 764 CB GLU A 51 22.325 4.407 -20.666 1.00 0.00 C ATOM 765 CG GLU A 51 22.541 5.850 -21.133 1.00 0.00 C ATOM 766 CD GLU A 51 23.964 6.335 -20.789 1.00 0.00 C ATOM 767 OE1 GLU A 51 24.928 5.964 -21.502 1.00 0.00 O ATOM 768 OE2 GLU A 51 24.126 7.121 -19.823 1.00 0.00 O ATOM 0 H GLU A 51 21.713 2.087 -20.187 1.00 0.00 H new ATOM 0 HA GLU A 51 20.237 4.488 -20.125 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.630 4.324 -19.623 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.976 3.749 -21.242 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.381 5.916 -22.209 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.806 6.503 -20.661 1.00 0.00 H new ATOM 775 N GLU A 52 20.537 3.238 -23.163 1.00 0.00 N ATOM 776 CA GLU A 52 19.941 3.271 -24.513 1.00 0.00 C ATOM 777 C GLU A 52 18.402 3.381 -24.506 1.00 0.00 C ATOM 778 O GLU A 52 17.832 4.015 -25.399 1.00 0.00 O ATOM 779 CB GLU A 52 20.323 1.996 -25.289 1.00 0.00 C ATOM 780 CG GLU A 52 21.741 2.041 -25.873 1.00 0.00 C ATOM 781 CD GLU A 52 22.108 0.761 -26.649 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.360 -0.250 -26.604 1.00 0.00 O ATOM 783 OE2 GLU A 52 23.164 0.749 -27.322 1.00 0.00 O ATOM 0 H GLU A 52 21.145 2.433 -23.012 1.00 0.00 H new ATOM 0 HA GLU A 52 20.339 4.166 -24.991 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.239 1.136 -24.625 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.609 1.845 -26.099 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.828 2.901 -26.537 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.457 2.189 -25.065 1.00 0.00 H new ATOM 790 N VAL A 53 17.730 2.794 -23.503 1.00 0.00 N ATOM 791 CA VAL A 53 16.258 2.846 -23.325 1.00 0.00 C ATOM 792 C VAL A 53 15.784 3.871 -22.273 1.00 0.00 C ATOM 793 O VAL A 53 14.614 3.861 -21.887 1.00 0.00 O ATOM 794 CB VAL A 53 15.645 1.443 -23.119 1.00 0.00 C ATOM 795 CG1 VAL A 53 15.751 0.624 -24.409 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.324 0.654 -21.997 1.00 0.00 C ATOM 0 H VAL A 53 18.199 2.257 -22.774 1.00 0.00 H new ATOM 0 HA VAL A 53 15.866 3.225 -24.269 1.00 0.00 H new ATOM 0 HB VAL A 53 14.604 1.606 -22.841 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.315 -0.363 -24.250 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.214 1.134 -25.209 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.800 0.517 -24.687 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.850 -0.323 -21.900 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.380 0.523 -22.232 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.226 1.199 -21.058 1.00 0.00 H new ATOM 806 N GLY A 54 16.654 4.787 -21.821 1.00 0.00 N ATOM 807 CA GLY A 54 16.322 5.832 -20.833 1.00 0.00 C ATOM 808 C GLY A 54 16.479 5.408 -19.367 1.00 0.00 C ATOM 809 O GLY A 54 15.915 6.050 -18.479 1.00 0.00 O ATOM 0 H GLY A 54 17.624 4.825 -22.135 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.957 6.699 -21.015 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.293 6.151 -20.995 1.00 0.00 H new ATOM 813 N ILE A 55 17.209 4.319 -19.116 1.00 0.00 N ATOM 814 CA ILE A 55 17.303 3.623 -17.824 1.00 0.00 C ATOM 815 C ILE A 55 18.776 3.473 -17.415 1.00 0.00 C ATOM 816 O ILE A 55 19.313 2.374 -17.354 1.00 0.00 O ATOM 817 CB ILE A 55 16.551 2.263 -17.911 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.144 2.407 -18.535 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.437 1.617 -16.518 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.375 1.099 -18.712 1.00 0.00 C ATOM 0 H ILE A 55 17.777 3.876 -19.838 1.00 0.00 H new ATOM 0 HA ILE A 55 16.820 4.207 -17.041 1.00 0.00 H new ATOM 0 HB ILE A 55 17.140 1.620 -18.565 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.553 3.076 -17.909 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.243 2.886 -19.509 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.908 0.667 -16.600 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.435 1.443 -16.115 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.887 2.282 -15.852 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.402 1.306 -19.156 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.937 0.432 -19.365 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.237 0.624 -17.741 1.00 0.00 H new ATOM 832 N ASP A 56 19.482 4.573 -17.165 1.00 0.00 N ATOM 833 CA ASP A 56 20.852 4.480 -16.641 1.00 0.00 C ATOM 834 C ASP A 56 20.864 3.823 -15.243 1.00 0.00 C ATOM 835 O ASP A 56 20.435 4.436 -14.261 1.00 0.00 O ATOM 836 CB ASP A 56 21.505 5.868 -16.624 1.00 0.00 C ATOM 837 CG ASP A 56 22.878 5.857 -15.927 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.531 4.788 -15.882 1.00 0.00 O ATOM 839 OD2 ASP A 56 23.289 6.920 -15.404 1.00 0.00 O ATOM 0 H ASP A 56 19.142 5.523 -17.311 1.00 0.00 H new ATOM 0 HA ASP A 56 21.439 3.841 -17.300 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.622 6.225 -17.647 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.846 6.571 -16.114 1.00 0.00 H new ATOM 844 N ILE A 57 21.370 2.583 -15.136 1.00 0.00 N ATOM 845 CA ILE A 57 21.447 1.858 -13.857 1.00 0.00 C ATOM 846 C ILE A 57 22.692 2.218 -13.037 1.00 0.00 C ATOM 847 O ILE A 57 22.817 1.726 -11.924 1.00 0.00 O ATOM 848 CB ILE A 57 21.342 0.322 -14.025 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.558 -0.289 -14.760 1.00 0.00 C ATOM 850 CG2 ILE A 57 20.026 -0.088 -14.708 1.00 0.00 C ATOM 851 CD1 ILE A 57 22.892 -1.709 -14.286 1.00 0.00 C ATOM 0 H ILE A 57 21.736 2.057 -15.930 1.00 0.00 H new ATOM 0 HA ILE A 57 20.573 2.192 -13.298 1.00 0.00 H new ATOM 0 HB ILE A 57 21.344 -0.089 -13.016 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.357 -0.307 -15.831 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.427 0.352 -14.610 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.990 -1.173 -14.808 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.183 0.249 -14.105 1.00 0.00 H new ATOM 0 HG23 ILE A 57 19.971 0.369 -15.696 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.754 -2.084 -14.838 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.123 -1.692 -13.221 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.037 -2.362 -14.461 1.00 0.00 H new ATOM 863 N SER A 58 23.624 3.034 -13.541 1.00 0.00 N ATOM 864 CA SER A 58 24.935 3.248 -12.905 1.00 0.00 C ATOM 865 C SER A 58 24.839 3.825 -11.472 1.00 0.00 C ATOM 866 O SER A 58 25.662 3.510 -10.612 1.00 0.00 O ATOM 867 CB SER A 58 25.785 4.136 -13.811 1.00 0.00 C ATOM 868 OG SER A 58 27.111 4.247 -13.322 1.00 0.00 O ATOM 0 H SER A 58 23.494 3.566 -14.401 1.00 0.00 H new ATOM 0 HA SER A 58 25.411 2.275 -12.786 1.00 0.00 H new ATOM 0 HB2 SER A 58 25.800 3.723 -14.819 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.336 5.127 -13.879 1.00 0.00 H new ATOM 0 HG SER A 58 27.634 4.819 -13.921 1.00 0.00 H new ATOM 874 N GLY A 59 23.792 4.614 -11.187 1.00 0.00 N ATOM 875 CA GLY A 59 23.467 5.128 -9.846 1.00 0.00 C ATOM 876 C GLY A 59 22.457 4.289 -9.040 1.00 0.00 C ATOM 877 O GLY A 59 22.027 4.726 -7.971 1.00 0.00 O ATOM 0 H GLY A 59 23.131 4.921 -11.900 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.390 5.203 -9.272 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.072 6.139 -9.949 1.00 0.00 H new ATOM 881 N GLN A 60 22.034 3.118 -9.541 1.00 0.00 N ATOM 882 CA GLN A 60 20.941 2.302 -8.985 1.00 0.00 C ATOM 883 C GLN A 60 21.461 1.147 -8.107 1.00 0.00 C ATOM 884 O GLN A 60 22.440 0.489 -8.456 1.00 0.00 O ATOM 885 CB GLN A 60 20.060 1.817 -10.153 1.00 0.00 C ATOM 886 CG GLN A 60 18.768 1.125 -9.689 1.00 0.00 C ATOM 887 CD GLN A 60 17.749 1.000 -10.816 1.00 0.00 C ATOM 888 OE1 GLN A 60 16.832 1.793 -10.945 1.00 0.00 O ATOM 889 NE2 GLN A 60 17.833 0.017 -11.677 1.00 0.00 N ATOM 0 H GLN A 60 22.456 2.699 -10.370 1.00 0.00 H new ATOM 0 HA GLN A 60 20.336 2.909 -8.312 1.00 0.00 H new ATOM 0 HB2 GLN A 60 19.803 2.668 -10.783 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.634 1.125 -10.770 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.006 0.133 -9.304 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.330 1.690 -8.866 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.587 -0.665 -11.600 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.144 -0.066 -12.425 1.00 0.00 H new ATOM 898 N THR A 61 20.788 0.862 -6.986 1.00 0.00 N ATOM 899 CA THR A 61 21.243 -0.129 -5.986 1.00 0.00 C ATOM 900 C THR A 61 21.145 -1.593 -6.433 1.00 0.00 C ATOM 901 O THR A 61 20.304 -1.947 -7.263 1.00 0.00 O ATOM 902 CB THR A 61 20.515 0.057 -4.645 1.00 0.00 C ATOM 903 OG1 THR A 61 21.210 -0.624 -3.623 1.00 0.00 O ATOM 904 CG2 THR A 61 19.055 -0.409 -4.636 1.00 0.00 C ATOM 0 H THR A 61 19.906 1.312 -6.740 1.00 0.00 H new ATOM 0 HA THR A 61 22.307 0.077 -5.867 1.00 0.00 H new ATOM 0 HB THR A 61 20.499 1.134 -4.476 1.00 0.00 H new ATOM 0 HG1 THR A 61 20.742 -0.500 -2.771 1.00 0.00 H new ATOM 0 HG21 THR A 61 18.625 -0.238 -3.649 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.490 0.152 -5.380 1.00 0.00 H new ATOM 0 HG23 THR A 61 19.011 -1.472 -4.872 1.00 0.00 H new ATOM 912 N SER A 62 21.970 -2.444 -5.817 1.00 0.00 N ATOM 913 CA SER A 62 21.920 -3.906 -5.913 1.00 0.00 C ATOM 914 C SER A 62 21.906 -4.540 -4.505 1.00 0.00 C ATOM 915 O SER A 62 22.600 -4.041 -3.617 1.00 0.00 O ATOM 916 CB SER A 62 23.137 -4.435 -6.680 1.00 0.00 C ATOM 917 OG SER A 62 23.002 -4.230 -8.081 1.00 0.00 O ATOM 0 H SER A 62 22.724 -2.119 -5.211 1.00 0.00 H new ATOM 0 HA SER A 62 21.007 -4.175 -6.444 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.038 -3.935 -6.324 1.00 0.00 H new ATOM 0 HB3 SER A 62 23.261 -5.499 -6.478 1.00 0.00 H new ATOM 0 HG SER A 62 23.707 -4.721 -8.553 1.00 0.00 H new ATOM 923 N ASP A 63 21.170 -5.641 -4.280 1.00 0.00 N ATOM 924 CA ASP A 63 20.964 -6.231 -2.933 1.00 0.00 C ATOM 925 C ASP A 63 21.051 -7.780 -2.920 1.00 0.00 C ATOM 926 O ASP A 63 20.745 -8.407 -3.939 1.00 0.00 O ATOM 927 CB ASP A 63 19.606 -5.754 -2.385 1.00 0.00 C ATOM 928 CG ASP A 63 19.597 -5.646 -0.852 1.00 0.00 C ATOM 929 OD1 ASP A 63 20.288 -4.752 -0.310 1.00 0.00 O ATOM 930 OD2 ASP A 63 18.891 -6.429 -0.179 1.00 0.00 O ATOM 0 H ASP A 63 20.697 -6.153 -5.024 1.00 0.00 H new ATOM 0 HA ASP A 63 21.775 -5.887 -2.292 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.364 -4.782 -2.816 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.826 -6.446 -2.702 1.00 0.00 H new ATOM 935 N PRO A 64 21.467 -8.442 -1.819 1.00 0.00 N ATOM 936 CA PRO A 64 21.520 -9.906 -1.752 1.00 0.00 C ATOM 937 C PRO A 64 20.192 -10.514 -1.260 1.00 0.00 C ATOM 938 O PRO A 64 19.488 -9.942 -0.425 1.00 0.00 O ATOM 939 CB PRO A 64 22.658 -10.240 -0.779 1.00 0.00 C ATOM 940 CG PRO A 64 22.608 -9.062 0.188 1.00 0.00 C ATOM 941 CD PRO A 64 22.155 -7.875 -0.664 1.00 0.00 C ATOM 0 HA PRO A 64 21.690 -10.327 -2.743 1.00 0.00 H new ATOM 0 HB2 PRO A 64 22.495 -11.191 -0.272 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.620 -10.310 -1.286 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.912 -9.251 1.005 1.00 0.00 H new ATOM 0 HG3 PRO A 64 23.584 -8.877 0.637 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.492 -7.221 -0.098 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.008 -7.272 -0.976 1.00 0.00 H new ATOM 949 N ILE A 65 19.899 -11.736 -1.699 1.00 0.00 N ATOM 950 CA ILE A 65 18.672 -12.492 -1.359 1.00 0.00 C ATOM 951 C ILE A 65 18.515 -12.820 0.145 1.00 0.00 C ATOM 952 O ILE A 65 17.412 -13.120 0.591 1.00 0.00 O ATOM 953 CB ILE A 65 18.620 -13.754 -2.250 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.241 -14.437 -2.222 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.736 -14.756 -1.891 1.00 0.00 C ATOM 956 CD1 ILE A 65 17.061 -15.509 -3.305 1.00 0.00 C ATOM 0 H ILE A 65 20.521 -12.253 -2.321 1.00 0.00 H new ATOM 0 HA ILE A 65 17.814 -11.851 -1.564 1.00 0.00 H new ATOM 0 HB ILE A 65 18.791 -13.412 -3.271 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.091 -14.893 -1.243 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.467 -13.679 -2.342 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.664 -15.629 -2.540 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.708 -14.282 -2.027 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.626 -15.067 -0.852 1.00 0.00 H new ATOM 0 HD11 ILE A 65 16.066 -15.946 -3.223 1.00 0.00 H new ATOM 0 HD12 ILE A 65 17.178 -15.055 -4.289 1.00 0.00 H new ATOM 0 HD13 ILE A 65 17.811 -16.289 -3.174 1.00 0.00 H new ATOM 968 N GLU A 66 19.592 -12.747 0.938 1.00 0.00 N ATOM 969 CA GLU A 66 19.564 -12.992 2.391 1.00 0.00 C ATOM 970 C GLU A 66 19.495 -11.707 3.247 1.00 0.00 C ATOM 971 O GLU A 66 19.288 -11.794 4.460 1.00 0.00 O ATOM 972 CB GLU A 66 20.751 -13.881 2.797 1.00 0.00 C ATOM 973 CG GLU A 66 20.694 -15.267 2.139 1.00 0.00 C ATOM 974 CD GLU A 66 21.777 -16.192 2.721 1.00 0.00 C ATOM 975 OE1 GLU A 66 22.930 -16.176 2.225 1.00 0.00 O ATOM 976 OE2 GLU A 66 21.491 -16.952 3.680 1.00 0.00 O ATOM 0 H GLU A 66 20.521 -12.513 0.587 1.00 0.00 H new ATOM 0 HA GLU A 66 18.632 -13.516 2.601 1.00 0.00 H new ATOM 0 HB2 GLU A 66 21.683 -13.388 2.520 1.00 0.00 H new ATOM 0 HB3 GLU A 66 20.762 -13.996 3.881 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.710 -15.709 2.295 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.833 -15.170 1.062 1.00 0.00 H new ATOM 983 N ASN A 67 19.631 -10.515 2.646 1.00 0.00 N ATOM 984 CA ASN A 67 19.371 -9.232 3.325 1.00 0.00 C ATOM 985 C ASN A 67 17.892 -8.831 3.211 1.00 0.00 C ATOM 986 O ASN A 67 17.304 -8.322 4.170 1.00 0.00 O ATOM 987 CB ASN A 67 20.272 -8.139 2.737 1.00 0.00 C ATOM 988 CG ASN A 67 19.977 -6.770 3.327 1.00 0.00 C ATOM 989 OD1 ASN A 67 20.219 -6.502 4.495 1.00 0.00 O ATOM 990 ND2 ASN A 67 19.436 -5.868 2.544 1.00 0.00 N ATOM 0 H ASN A 67 19.925 -10.411 1.675 1.00 0.00 H new ATOM 0 HA ASN A 67 19.600 -9.352 4.384 1.00 0.00 H new ATOM 0 HB2 ASN A 67 21.316 -8.394 2.920 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.138 -8.103 1.656 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.217 -4.941 2.909 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.235 -6.093 1.570 1.00 0.00 H new ATOM 997 N PHE A 68 17.288 -9.079 2.046 1.00 0.00 N ATOM 998 CA PHE A 68 15.859 -8.900 1.830 1.00 0.00 C ATOM 999 C PHE A 68 15.038 -9.974 2.574 1.00 0.00 C ATOM 1000 O PHE A 68 15.536 -11.061 2.882 1.00 0.00 O ATOM 1001 CB PHE A 68 15.596 -8.856 0.312 1.00 0.00 C ATOM 1002 CG PHE A 68 14.449 -9.697 -0.210 1.00 0.00 C ATOM 1003 CD1 PHE A 68 14.697 -11.017 -0.618 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.162 -9.148 -0.350 1.00 0.00 C ATOM 1005 CE1 PHE A 68 13.675 -11.774 -1.207 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.138 -9.908 -0.945 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.396 -11.221 -1.381 1.00 0.00 C ATOM 0 H PHE A 68 17.787 -9.413 1.221 1.00 0.00 H new ATOM 0 HA PHE A 68 15.525 -7.953 2.255 1.00 0.00 H new ATOM 0 HB2 PHE A 68 15.412 -7.819 0.030 1.00 0.00 H new ATOM 0 HB3 PHE A 68 16.506 -9.169 -0.199 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.677 -11.450 -0.478 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.960 -8.146 -0.002 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.872 -12.786 -1.528 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.153 -9.483 -1.067 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.613 -11.801 -1.848 1.00 0.00 H new ATOM 1017 N ASN A 69 13.764 -9.667 2.843 1.00 0.00 N ATOM 1018 CA ASN A 69 12.784 -10.632 3.350 1.00 0.00 C ATOM 1019 C ASN A 69 11.405 -10.408 2.713 1.00 0.00 C ATOM 1020 O ASN A 69 10.815 -9.344 2.879 1.00 0.00 O ATOM 1021 CB ASN A 69 12.760 -10.602 4.899 1.00 0.00 C ATOM 1022 CG ASN A 69 12.831 -9.218 5.543 1.00 0.00 C ATOM 1023 OD1 ASN A 69 13.723 -8.923 6.327 1.00 0.00 O ATOM 1024 ND2 ASN A 69 11.908 -8.324 5.264 1.00 0.00 N ATOM 0 H ASN A 69 13.381 -8.731 2.713 1.00 0.00 H new ATOM 0 HA ASN A 69 13.083 -11.639 3.058 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.848 -11.092 5.238 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.597 -11.196 5.267 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.943 -7.402 5.699 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.157 -8.553 4.613 1.00 0.00 H new ATOM 1031 N ALA A 70 10.852 -11.415 2.032 1.00 0.00 N ATOM 1032 CA ALA A 70 9.644 -11.285 1.201 1.00 0.00 C ATOM 1033 C ALA A 70 8.328 -10.987 1.959 1.00 0.00 C ATOM 1034 O ALA A 70 7.277 -10.865 1.337 1.00 0.00 O ATOM 1035 CB ALA A 70 9.509 -12.538 0.333 1.00 0.00 C ATOM 0 H ALA A 70 11.235 -12.361 2.040 1.00 0.00 H new ATOM 0 HA ALA A 70 9.791 -10.393 0.593 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.617 -12.456 -0.289 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.388 -12.636 -0.304 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.425 -13.417 0.973 1.00 0.00 H new ATOM 1041 N ASP A 71 8.368 -10.832 3.285 1.00 0.00 N ATOM 1042 CA ASP A 71 7.177 -10.569 4.111 1.00 0.00 C ATOM 1043 C ASP A 71 6.568 -9.181 3.821 1.00 0.00 C ATOM 1044 O ASP A 71 5.358 -8.985 3.946 1.00 0.00 O ATOM 1045 CB ASP A 71 7.565 -10.711 5.587 1.00 0.00 C ATOM 1046 CG ASP A 71 6.350 -10.563 6.520 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.487 -11.475 6.542 1.00 0.00 O ATOM 1048 OD2 ASP A 71 6.262 -9.550 7.254 1.00 0.00 O ATOM 0 H ASP A 71 9.232 -10.885 3.824 1.00 0.00 H new ATOM 0 HA ASP A 71 6.404 -11.297 3.863 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.029 -11.684 5.748 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.310 -9.957 5.840 1.00 0.00 H new ATOM 1053 N ASP A 72 7.404 -8.230 3.389 1.00 0.00 N ATOM 1054 CA ASP A 72 7.018 -6.864 3.015 1.00 0.00 C ATOM 1055 C ASP A 72 6.738 -6.696 1.500 1.00 0.00 C ATOM 1056 O ASP A 72 6.390 -5.604 1.049 1.00 0.00 O ATOM 1057 CB ASP A 72 8.116 -5.921 3.527 1.00 0.00 C ATOM 1058 CG ASP A 72 7.720 -4.437 3.522 1.00 0.00 C ATOM 1059 OD1 ASP A 72 6.600 -4.088 3.966 1.00 0.00 O ATOM 1060 OD2 ASP A 72 8.559 -3.590 3.135 1.00 0.00 O ATOM 0 H ASP A 72 8.405 -8.396 3.286 1.00 0.00 H new ATOM 0 HA ASP A 72 6.064 -6.615 3.481 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.385 -6.211 4.543 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.007 -6.050 2.912 1.00 0.00 H new ATOM 1065 N TYR A 73 6.893 -7.768 0.705 1.00 0.00 N ATOM 1066 CA TYR A 73 6.853 -7.757 -0.762 1.00 0.00 C ATOM 1067 C TYR A 73 5.903 -8.850 -1.286 1.00 0.00 C ATOM 1068 O TYR A 73 6.306 -9.991 -1.512 1.00 0.00 O ATOM 1069 CB TYR A 73 8.281 -7.905 -1.344 1.00 0.00 C ATOM 1070 CG TYR A 73 9.347 -7.018 -0.724 1.00 0.00 C ATOM 1071 CD1 TYR A 73 9.931 -7.416 0.493 1.00 0.00 C ATOM 1072 CD2 TYR A 73 9.766 -5.820 -1.337 1.00 0.00 C ATOM 1073 CE1 TYR A 73 10.901 -6.626 1.123 1.00 0.00 C ATOM 1074 CE2 TYR A 73 10.725 -5.006 -0.696 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.297 -5.404 0.533 1.00 0.00 C ATOM 1076 OH TYR A 73 12.228 -4.611 1.132 1.00 0.00 O ATOM 0 H TYR A 73 7.056 -8.701 1.084 1.00 0.00 H new ATOM 0 HA TYR A 73 6.461 -6.797 -1.097 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.591 -8.944 -1.233 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.240 -7.697 -2.413 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.626 -8.346 0.949 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.356 -5.526 -2.292 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.344 -6.949 2.054 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.024 -4.072 -1.149 1.00 0.00 H new ATOM 0 HH TYR A 73 12.378 -3.812 0.585 1.00 0.00 H new ATOM 1086 N ASP A 74 4.627 -8.501 -1.495 1.00 0.00 N ATOM 1087 CA ASP A 74 3.589 -9.445 -1.959 1.00 0.00 C ATOM 1088 C ASP A 74 3.901 -10.089 -3.323 1.00 0.00 C ATOM 1089 O ASP A 74 3.346 -11.138 -3.657 1.00 0.00 O ATOM 1090 CB ASP A 74 2.239 -8.713 -2.082 1.00 0.00 C ATOM 1091 CG ASP A 74 1.566 -8.351 -0.746 1.00 0.00 C ATOM 1092 OD1 ASP A 74 1.754 -9.060 0.269 1.00 0.00 O ATOM 1093 OD2 ASP A 74 0.789 -7.365 -0.741 1.00 0.00 O ATOM 0 H ASP A 74 4.279 -7.553 -1.348 1.00 0.00 H new ATOM 0 HA ASP A 74 3.556 -10.240 -1.214 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.391 -7.798 -2.654 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.556 -9.338 -2.657 1.00 0.00 H new ATOM 1098 N VAL A 75 4.769 -9.457 -4.120 1.00 0.00 N ATOM 1099 CA VAL A 75 5.021 -9.796 -5.521 1.00 0.00 C ATOM 1100 C VAL A 75 6.509 -10.098 -5.739 1.00 0.00 C ATOM 1101 O VAL A 75 7.328 -9.182 -5.718 1.00 0.00 O ATOM 1102 CB VAL A 75 4.528 -8.626 -6.397 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.672 -8.945 -7.881 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.058 -8.258 -6.133 1.00 0.00 C ATOM 0 H VAL A 75 5.332 -8.671 -3.796 1.00 0.00 H new ATOM 0 HA VAL A 75 4.477 -10.698 -5.802 1.00 0.00 H new ATOM 0 HB VAL A 75 5.158 -7.779 -6.125 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.316 -8.100 -8.471 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.720 -9.133 -8.113 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.083 -9.830 -8.122 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.769 -7.429 -6.779 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.424 -9.119 -6.343 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.938 -7.965 -5.090 1.00 0.00 H new ATOM 1114 N VAL A 76 6.882 -11.364 -5.957 1.00 0.00 N ATOM 1115 CA VAL A 76 8.291 -11.790 -6.106 1.00 0.00 C ATOM 1116 C VAL A 76 8.508 -12.556 -7.409 1.00 0.00 C ATOM 1117 O VAL A 76 7.797 -13.509 -7.702 1.00 0.00 O ATOM 1118 CB VAL A 76 8.788 -12.618 -4.903 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.299 -12.877 -5.021 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.539 -11.909 -3.566 1.00 0.00 C ATOM 0 H VAL A 76 6.215 -12.132 -6.037 1.00 0.00 H new ATOM 0 HA VAL A 76 8.885 -10.877 -6.139 1.00 0.00 H new ATOM 0 HB VAL A 76 8.227 -13.553 -4.920 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.636 -13.462 -4.165 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.503 -13.427 -5.940 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.831 -11.926 -5.042 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.906 -12.532 -2.750 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.063 -10.954 -3.558 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.470 -11.737 -3.439 1.00 0.00 H new ATOM 1130 N ILE A 77 9.488 -12.147 -8.214 1.00 0.00 N ATOM 1131 CA ILE A 77 9.703 -12.645 -9.576 1.00 0.00 C ATOM 1132 C ILE A 77 11.072 -13.310 -9.684 1.00 0.00 C ATOM 1133 O ILE A 77 12.083 -12.708 -9.334 1.00 0.00 O ATOM 1134 CB ILE A 77 9.592 -11.483 -10.595 1.00 0.00 C ATOM 1135 CG1 ILE A 77 8.156 -11.010 -10.905 1.00 0.00 C ATOM 1136 CG2 ILE A 77 10.202 -11.855 -11.959 1.00 0.00 C ATOM 1137 CD1 ILE A 77 7.329 -10.554 -9.705 1.00 0.00 C ATOM 0 H ILE A 77 10.171 -11.444 -7.933 1.00 0.00 H new ATOM 0 HA ILE A 77 8.935 -13.384 -9.803 1.00 0.00 H new ATOM 0 HB ILE A 77 10.133 -10.681 -10.093 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.211 -10.187 -11.617 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.625 -11.824 -11.399 1.00 0.00 H new ATOM 0 HG21 ILE A 77 10.103 -11.013 -12.644 1.00 0.00 H new ATOM 0 HG22 ILE A 77 11.257 -12.097 -11.832 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.678 -12.719 -12.368 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.340 -10.244 -10.042 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.231 -11.377 -8.997 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.826 -9.715 -9.219 1.00 0.00 H new ATOM 1149 N SER A 78 11.118 -14.513 -10.244 1.00 0.00 N ATOM 1150 CA SER A 78 12.342 -15.199 -10.653 1.00 0.00 C ATOM 1151 C SER A 78 12.637 -14.819 -12.106 1.00 0.00 C ATOM 1152 O SER A 78 11.797 -14.987 -12.990 1.00 0.00 O ATOM 1153 CB SER A 78 12.164 -16.708 -10.496 1.00 0.00 C ATOM 1154 OG SER A 78 13.167 -17.408 -11.197 1.00 0.00 O ATOM 0 H SER A 78 10.277 -15.058 -10.433 1.00 0.00 H new ATOM 0 HA SER A 78 13.183 -14.901 -10.027 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.199 -16.975 -9.440 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.182 -17.003 -10.866 1.00 0.00 H new ATOM 0 HG SER A 78 12.756 -18.116 -11.736 1.00 0.00 H new ATOM 1160 N LEU A 79 13.838 -14.300 -12.360 1.00 0.00 N ATOM 1161 CA LEU A 79 14.330 -13.879 -13.675 1.00 0.00 C ATOM 1162 C LEU A 79 15.332 -14.878 -14.278 1.00 0.00 C ATOM 1163 O LEU A 79 16.142 -14.526 -15.127 1.00 0.00 O ATOM 1164 CB LEU A 79 14.868 -12.439 -13.567 1.00 0.00 C ATOM 1165 CG LEU A 79 13.841 -11.361 -13.202 1.00 0.00 C ATOM 1166 CD1 LEU A 79 14.556 -10.021 -13.218 1.00 0.00 C ATOM 1167 CD2 LEU A 79 12.713 -11.276 -14.216 1.00 0.00 C ATOM 0 H LEU A 79 14.527 -14.154 -11.622 1.00 0.00 H new ATOM 0 HA LEU A 79 13.506 -13.876 -14.388 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.661 -12.424 -12.820 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.323 -12.170 -14.520 1.00 0.00 H new ATOM 0 HG LEU A 79 13.418 -11.611 -12.229 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.852 -9.230 -12.962 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.368 -10.033 -12.491 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.962 -9.837 -14.213 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.011 -10.499 -13.915 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.123 -11.034 -15.197 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.195 -12.234 -14.265 1.00 0.00 H new ATOM 1179 N CYS A 80 15.266 -16.130 -13.840 1.00 0.00 N ATOM 1180 CA CYS A 80 15.956 -17.291 -14.403 1.00 0.00 C ATOM 1181 C CYS A 80 14.907 -18.365 -14.746 1.00 0.00 C ATOM 1182 O CYS A 80 13.710 -18.138 -14.589 1.00 0.00 O ATOM 1183 CB CYS A 80 16.960 -17.805 -13.351 1.00 0.00 C ATOM 1184 SG CYS A 80 16.185 -18.308 -11.782 1.00 0.00 S ATOM 0 H CYS A 80 14.695 -16.380 -13.033 1.00 0.00 H new ATOM 0 HA CYS A 80 16.497 -17.035 -15.314 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.504 -18.654 -13.765 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.693 -17.024 -13.150 1.00 0.00 H new ATOM 1189 N GLY A 81 15.343 -19.535 -15.217 1.00 0.00 N ATOM 1190 CA GLY A 81 14.504 -20.741 -15.352 1.00 0.00 C ATOM 1191 C GLY A 81 14.735 -21.644 -14.128 1.00 0.00 C ATOM 1192 O GLY A 81 14.874 -22.860 -14.267 1.00 0.00 O ATOM 0 H GLY A 81 16.305 -19.680 -15.522 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.452 -20.463 -15.423 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.755 -21.275 -16.268 1.00 0.00 H new ATOM 1196 N CYS A 82 14.874 -21.026 -12.944 1.00 0.00 N ATOM 1197 CA CYS A 82 15.342 -21.655 -11.704 1.00 0.00 C ATOM 1198 C CYS A 82 14.560 -21.297 -10.423 1.00 0.00 C ATOM 1199 O CYS A 82 15.060 -21.539 -9.327 1.00 0.00 O ATOM 1200 CB CYS A 82 16.852 -21.356 -11.577 1.00 0.00 C ATOM 1201 SG CYS A 82 17.388 -19.729 -10.943 1.00 0.00 S ATOM 0 H CYS A 82 14.655 -20.037 -12.822 1.00 0.00 H new ATOM 0 HA CYS A 82 15.152 -22.725 -11.788 1.00 0.00 H new ATOM 0 HB2 CYS A 82 17.284 -22.119 -10.930 1.00 0.00 H new ATOM 0 HB3 CYS A 82 17.296 -21.486 -12.564 1.00 0.00 H new ATOM 1206 N GLY A 83 13.346 -20.743 -10.515 1.00 0.00 N ATOM 1207 CA GLY A 83 12.595 -20.211 -9.365 1.00 0.00 C ATOM 1208 C GLY A 83 12.391 -21.180 -8.192 1.00 0.00 C ATOM 1209 O GLY A 83 12.397 -20.751 -7.039 1.00 0.00 O ATOM 0 H GLY A 83 12.848 -20.649 -11.400 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.114 -19.327 -8.995 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.616 -19.883 -9.715 1.00 0.00 H new ATOM 1213 N VAL A 84 12.308 -22.491 -8.452 1.00 0.00 N ATOM 1214 CA VAL A 84 12.206 -23.534 -7.406 1.00 0.00 C ATOM 1215 C VAL A 84 13.482 -23.714 -6.562 1.00 0.00 C ATOM 1216 O VAL A 84 13.426 -24.310 -5.485 1.00 0.00 O ATOM 1217 CB VAL A 84 11.760 -24.890 -7.997 1.00 0.00 C ATOM 1218 CG1 VAL A 84 10.359 -24.793 -8.608 1.00 0.00 C ATOM 1219 CG2 VAL A 84 12.728 -25.442 -9.053 1.00 0.00 C ATOM 0 H VAL A 84 12.309 -22.868 -9.400 1.00 0.00 H new ATOM 0 HA VAL A 84 11.439 -23.168 -6.724 1.00 0.00 H new ATOM 0 HB VAL A 84 11.755 -25.584 -7.156 1.00 0.00 H new ATOM 0 HG11 VAL A 84 10.072 -25.762 -9.016 1.00 0.00 H new ATOM 0 HG12 VAL A 84 9.646 -24.498 -7.838 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.360 -24.050 -9.405 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.354 -26.396 -9.426 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.807 -24.735 -9.879 1.00 0.00 H new ATOM 0 HG23 VAL A 84 13.711 -25.588 -8.605 1.00 0.00 H new ATOM 1229 N ASN A 85 14.629 -23.187 -7.014 1.00 0.00 N ATOM 1230 CA ASN A 85 15.902 -23.186 -6.277 1.00 0.00 C ATOM 1231 C ASN A 85 16.011 -22.023 -5.259 1.00 0.00 C ATOM 1232 O ASN A 85 16.879 -22.052 -4.383 1.00 0.00 O ATOM 1233 CB ASN A 85 17.048 -23.167 -7.308 1.00 0.00 C ATOM 1234 CG ASN A 85 18.417 -23.380 -6.681 1.00 0.00 C ATOM 1235 OD1 ASN A 85 19.226 -22.470 -6.564 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.732 -24.593 -6.277 1.00 0.00 N ATOM 0 H ASN A 85 14.699 -22.737 -7.927 1.00 0.00 H new ATOM 0 HA ASN A 85 15.963 -24.089 -5.670 1.00 0.00 H new ATOM 0 HB2 ASN A 85 16.871 -23.943 -8.053 1.00 0.00 H new ATOM 0 HB3 ASN A 85 17.040 -22.212 -7.834 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.649 -24.772 -5.868 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.059 -25.353 -6.373 1.00 0.00 H new ATOM 1243 N LEU A 86 15.133 -21.014 -5.348 1.00 0.00 N ATOM 1244 CA LEU A 86 15.056 -19.915 -4.375 1.00 0.00 C ATOM 1245 C LEU A 86 14.533 -20.410 -3.001 1.00 0.00 C ATOM 1246 O LEU A 86 13.852 -21.443 -2.950 1.00 0.00 O ATOM 1247 CB LEU A 86 14.162 -18.786 -4.929 1.00 0.00 C ATOM 1248 CG LEU A 86 14.559 -18.220 -6.308 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.603 -17.080 -6.664 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.987 -17.679 -6.342 1.00 0.00 C ATOM 0 H LEU A 86 14.451 -20.937 -6.103 1.00 0.00 H new ATOM 0 HA LEU A 86 16.062 -19.525 -4.218 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.139 -19.158 -4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.159 -17.967 -4.210 1.00 0.00 H new ATOM 0 HG LEU A 86 14.500 -19.040 -7.023 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.872 -16.670 -7.637 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.582 -17.459 -6.700 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.673 -16.297 -5.909 1.00 0.00 H new ATOM 0 HD21 LEU A 86 16.207 -17.295 -7.338 1.00 0.00 H new ATOM 0 HD22 LEU A 86 16.089 -16.875 -5.613 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.685 -18.480 -6.100 1.00 0.00 H new ATOM 1262 N PRO A 87 14.799 -19.692 -1.888 1.00 0.00 N ATOM 1263 CA PRO A 87 14.253 -20.039 -0.572 1.00 0.00 C ATOM 1264 C PRO A 87 12.714 -20.099 -0.609 1.00 0.00 C ATOM 1265 O PRO A 87 12.100 -19.180 -1.159 1.00 0.00 O ATOM 1266 CB PRO A 87 14.757 -18.957 0.394 1.00 0.00 C ATOM 1267 CG PRO A 87 16.021 -18.441 -0.291 1.00 0.00 C ATOM 1268 CD PRO A 87 15.653 -18.521 -1.769 1.00 0.00 C ATOM 0 HA PRO A 87 14.580 -21.028 -0.252 1.00 0.00 H new ATOM 0 HB2 PRO A 87 14.021 -18.165 0.531 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.972 -19.367 1.381 1.00 0.00 H new ATOM 0 HG2 PRO A 87 16.260 -17.422 0.013 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.890 -19.056 -0.055 1.00 0.00 H new ATOM 0 HD2 PRO A 87 15.133 -17.620 -2.094 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.543 -18.618 -2.391 1.00 0.00 H new ATOM 1276 N PRO A 88 12.061 -21.143 -0.061 1.00 0.00 N ATOM 1277 CA PRO A 88 10.621 -21.343 -0.228 1.00 0.00 C ATOM 1278 C PRO A 88 9.775 -20.181 0.311 1.00 0.00 C ATOM 1279 O PRO A 88 8.778 -19.822 -0.313 1.00 0.00 O ATOM 1280 CB PRO A 88 10.297 -22.675 0.461 1.00 0.00 C ATOM 1281 CG PRO A 88 11.466 -22.898 1.420 1.00 0.00 C ATOM 1282 CD PRO A 88 12.638 -22.254 0.680 1.00 0.00 C ATOM 0 HA PRO A 88 10.364 -21.372 -1.287 1.00 0.00 H new ATOM 0 HB2 PRO A 88 9.348 -22.626 0.995 1.00 0.00 H new ATOM 0 HB3 PRO A 88 10.215 -23.487 -0.262 1.00 0.00 H new ATOM 0 HG2 PRO A 88 11.291 -22.428 2.388 1.00 0.00 H new ATOM 0 HG3 PRO A 88 11.639 -23.958 1.607 1.00 0.00 H new ATOM 0 HD2 PRO A 88 13.401 -21.908 1.377 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.119 -22.966 0.010 1.00 0.00 H new ATOM 1290 N GLU A 89 10.184 -19.507 1.390 1.00 0.00 N ATOM 1291 CA GLU A 89 9.483 -18.312 1.882 1.00 0.00 C ATOM 1292 C GLU A 89 9.527 -17.129 0.895 1.00 0.00 C ATOM 1293 O GLU A 89 8.584 -16.337 0.844 1.00 0.00 O ATOM 1294 CB GLU A 89 9.974 -17.904 3.286 1.00 0.00 C ATOM 1295 CG GLU A 89 11.492 -17.732 3.446 1.00 0.00 C ATOM 1296 CD GLU A 89 12.174 -19.046 3.874 1.00 0.00 C ATOM 1297 OE1 GLU A 89 12.525 -19.859 2.987 1.00 0.00 O ATOM 1298 OE2 GLU A 89 12.350 -19.276 5.096 1.00 0.00 O ATOM 0 H GLU A 89 11.000 -19.768 1.943 1.00 0.00 H new ATOM 0 HA GLU A 89 8.433 -18.592 1.965 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.491 -16.966 3.559 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.636 -18.656 4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.921 -17.390 2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 89 11.694 -16.959 4.187 1.00 0.00 H new ATOM 1305 N TRP A 90 10.564 -17.015 0.056 1.00 0.00 N ATOM 1306 CA TRP A 90 10.630 -16.029 -1.035 1.00 0.00 C ATOM 1307 C TRP A 90 9.824 -16.459 -2.283 1.00 0.00 C ATOM 1308 O TRP A 90 9.685 -15.677 -3.223 1.00 0.00 O ATOM 1309 CB TRP A 90 12.100 -15.703 -1.357 1.00 0.00 C ATOM 1310 CG TRP A 90 13.000 -15.257 -0.235 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.339 -15.175 -0.383 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.742 -14.823 1.152 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.923 -14.707 0.770 1.00 0.00 N ATOM 1314 CE2 TRP A 90 13.997 -14.517 1.764 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.605 -14.654 1.977 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.121 -14.111 3.100 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 11.714 -14.272 3.331 1.00 0.00 C ATOM 1318 CH2 TRP A 90 12.971 -14.018 3.900 1.00 0.00 C ATOM 0 H TRP A 90 11.390 -17.610 0.114 1.00 0.00 H new ATOM 0 HA TRP A 90 10.147 -15.114 -0.693 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.546 -16.591 -1.806 1.00 0.00 H new ATOM 0 HB3 TRP A 90 12.107 -14.923 -2.118 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.876 -15.440 -1.282 1.00 0.00 H new ATOM 0 HE1 TRP A 90 15.921 -14.524 0.874 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.624 -14.822 1.558 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.091 -13.872 3.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.823 -14.174 3.934 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.053 -13.753 4.944 1.00 0.00 H new ATOM 1329 N VAL A 91 9.251 -17.672 -2.286 1.00 0.00 N ATOM 1330 CA VAL A 91 8.413 -18.240 -3.353 1.00 0.00 C ATOM 1331 C VAL A 91 6.932 -18.232 -2.964 1.00 0.00 C ATOM 1332 O VAL A 91 6.089 -17.875 -3.784 1.00 0.00 O ATOM 1333 CB VAL A 91 8.895 -19.667 -3.706 1.00 0.00 C ATOM 1334 CG1 VAL A 91 7.952 -20.395 -4.668 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.298 -19.645 -4.327 1.00 0.00 C ATOM 0 H VAL A 91 9.366 -18.317 -1.504 1.00 0.00 H new ATOM 0 HA VAL A 91 8.514 -17.614 -4.239 1.00 0.00 H new ATOM 0 HB VAL A 91 8.910 -20.209 -2.760 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.344 -21.390 -4.878 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.965 -20.482 -4.214 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.875 -19.832 -5.598 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.607 -20.663 -4.563 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.283 -19.049 -5.240 1.00 0.00 H new ATOM 0 HG23 VAL A 91 11.002 -19.207 -3.620 1.00 0.00 H new ATOM 1345 N THR A 92 6.583 -18.568 -1.718 1.00 0.00 N ATOM 1346 CA THR A 92 5.187 -18.725 -1.248 1.00 0.00 C ATOM 1347 C THR A 92 4.510 -17.392 -0.876 1.00 0.00 C ATOM 1348 O THR A 92 3.919 -17.243 0.196 1.00 0.00 O ATOM 1349 CB THR A 92 5.091 -19.792 -0.136 1.00 0.00 C ATOM 1350 OG1 THR A 92 5.906 -19.465 0.975 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.530 -21.167 -0.657 1.00 0.00 C ATOM 0 H THR A 92 7.272 -18.744 -0.986 1.00 0.00 H new ATOM 0 HA THR A 92 4.608 -19.093 -2.095 1.00 0.00 H new ATOM 0 HB THR A 92 4.047 -19.821 0.175 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.846 -19.627 0.750 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.453 -21.901 0.145 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.886 -21.465 -1.485 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.563 -21.113 -1.002 1.00 0.00 H new ATOM 1359 N GLN A 93 4.608 -16.407 -1.771 1.00 0.00 N ATOM 1360 CA GLN A 93 3.986 -15.078 -1.674 1.00 0.00 C ATOM 1361 C GLN A 93 2.766 -14.945 -2.602 1.00 0.00 C ATOM 1362 O GLN A 93 2.493 -15.820 -3.426 1.00 0.00 O ATOM 1363 CB GLN A 93 5.048 -13.989 -1.932 1.00 0.00 C ATOM 1364 CG GLN A 93 6.213 -14.032 -0.928 1.00 0.00 C ATOM 1365 CD GLN A 93 5.774 -13.891 0.536 1.00 0.00 C ATOM 1366 OE1 GLN A 93 4.797 -13.233 0.871 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.462 -14.527 1.462 1.00 0.00 N ATOM 0 H GLN A 93 5.150 -16.517 -2.628 1.00 0.00 H new ATOM 0 HA GLN A 93 3.601 -14.943 -0.663 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.442 -14.106 -2.942 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.573 -13.009 -1.887 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.749 -14.973 -1.048 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.915 -13.233 -1.166 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.279 -15.080 1.201 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.178 -14.467 2.440 1.00 0.00 H new ATOM 1376 N GLU A 94 2.012 -13.852 -2.444 1.00 0.00 N ATOM 1377 CA GLU A 94 0.708 -13.657 -3.098 1.00 0.00 C ATOM 1378 C GLU A 94 0.792 -13.727 -4.636 1.00 0.00 C ATOM 1379 O GLU A 94 -0.094 -14.300 -5.276 1.00 0.00 O ATOM 1380 CB GLU A 94 0.114 -12.320 -2.627 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.383 -12.254 -2.921 1.00 0.00 C ATOM 1382 CD GLU A 94 -1.997 -10.955 -2.370 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -1.758 -9.871 -2.956 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -2.718 -11.002 -1.342 1.00 0.00 O ATOM 0 H GLU A 94 2.290 -13.068 -1.853 1.00 0.00 H new ATOM 0 HA GLU A 94 0.052 -14.477 -2.806 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.284 -12.199 -1.557 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.623 -11.496 -3.126 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.549 -12.311 -3.997 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.883 -13.114 -2.476 1.00 0.00 H new ATOM 1391 N ILE A 95 1.875 -13.201 -5.222 1.00 0.00 N ATOM 1392 CA ILE A 95 2.233 -13.372 -6.635 1.00 0.00 C ATOM 1393 C ILE A 95 3.685 -13.854 -6.714 1.00 0.00 C ATOM 1394 O ILE A 95 4.599 -13.150 -6.278 1.00 0.00 O ATOM 1395 CB ILE A 95 2.008 -12.074 -7.452 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.522 -11.644 -7.418 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.496 -12.260 -8.905 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.185 -10.388 -8.235 1.00 0.00 C ATOM 0 H ILE A 95 2.546 -12.628 -4.710 1.00 0.00 H new ATOM 0 HA ILE A 95 1.579 -14.120 -7.084 1.00 0.00 H new ATOM 0 HB ILE A 95 2.593 -11.277 -6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.087 -12.470 -7.784 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.234 -11.471 -6.381 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.331 -11.340 -9.465 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.560 -12.498 -8.904 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.943 -13.074 -9.373 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.879 -10.171 -8.146 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.761 -9.543 -7.857 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.434 -10.558 -9.282 1.00 0.00 H new ATOM 1410 N PHE A 96 3.898 -15.029 -7.315 1.00 0.00 N ATOM 1411 CA PHE A 96 5.222 -15.534 -7.680 1.00 0.00 C ATOM 1412 C PHE A 96 5.243 -16.008 -9.142 1.00 0.00 C ATOM 1413 O PHE A 96 4.295 -16.643 -9.609 1.00 0.00 O ATOM 1414 CB PHE A 96 5.732 -16.601 -6.697 1.00 0.00 C ATOM 1415 CG PHE A 96 7.119 -17.112 -7.045 1.00 0.00 C ATOM 1416 CD1 PHE A 96 8.257 -16.419 -6.594 1.00 0.00 C ATOM 1417 CD2 PHE A 96 7.278 -18.244 -7.868 1.00 0.00 C ATOM 1418 CE1 PHE A 96 9.544 -16.850 -6.959 1.00 0.00 C ATOM 1419 CE2 PHE A 96 8.564 -18.673 -8.240 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.696 -17.977 -7.785 1.00 0.00 C ATOM 0 H PHE A 96 3.141 -15.665 -7.565 1.00 0.00 H new ATOM 0 HA PHE A 96 5.927 -14.706 -7.601 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.747 -16.183 -5.691 1.00 0.00 H new ATOM 0 HB3 PHE A 96 5.035 -17.439 -6.684 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.141 -15.550 -5.963 1.00 0.00 H new ATOM 0 HD2 PHE A 96 6.409 -18.784 -8.214 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.414 -16.317 -6.606 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.682 -19.538 -8.876 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.684 -18.308 -8.070 1.00 0.00 H new ATOM 1430 N GLU A 97 6.320 -15.688 -9.867 1.00 0.00 N ATOM 1431 CA GLU A 97 6.483 -15.971 -11.303 1.00 0.00 C ATOM 1432 C GLU A 97 7.911 -16.425 -11.643 1.00 0.00 C ATOM 1433 O GLU A 97 8.863 -15.984 -11.006 1.00 0.00 O ATOM 1434 CB GLU A 97 6.164 -14.722 -12.147 1.00 0.00 C ATOM 1435 CG GLU A 97 4.784 -14.098 -11.888 1.00 0.00 C ATOM 1436 CD GLU A 97 4.441 -13.038 -12.952 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.306 -12.186 -13.265 1.00 0.00 O ATOM 1438 OE2 GLU A 97 3.303 -13.064 -13.484 1.00 0.00 O ATOM 0 H GLU A 97 7.126 -15.212 -9.463 1.00 0.00 H new ATOM 0 HA GLU A 97 5.787 -16.776 -11.538 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.928 -13.968 -11.957 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.234 -14.987 -13.202 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.023 -14.879 -11.891 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.769 -13.641 -10.898 1.00 0.00 H new ATOM 1445 N ASP A 98 8.072 -17.245 -12.688 1.00 0.00 N ATOM 1446 CA ASP A 98 9.372 -17.702 -13.209 1.00 0.00 C ATOM 1447 C ASP A 98 9.496 -17.338 -14.698 1.00 0.00 C ATOM 1448 O ASP A 98 8.909 -17.986 -15.566 1.00 0.00 O ATOM 1449 CB ASP A 98 9.514 -19.210 -12.950 1.00 0.00 C ATOM 1450 CG ASP A 98 10.945 -19.719 -13.188 1.00 0.00 C ATOM 1451 OD1 ASP A 98 11.855 -19.293 -12.436 1.00 0.00 O ATOM 1452 OD2 ASP A 98 11.141 -20.585 -14.073 1.00 0.00 O ATOM 0 H ASP A 98 7.281 -17.621 -13.211 1.00 0.00 H new ATOM 0 HA ASP A 98 10.191 -17.200 -12.694 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.221 -19.428 -11.923 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.827 -19.753 -13.599 1.00 0.00 H new ATOM 1457 N TRP A 99 10.212 -16.249 -14.999 1.00 0.00 N ATOM 1458 CA TRP A 99 10.254 -15.645 -16.340 1.00 0.00 C ATOM 1459 C TRP A 99 11.185 -16.363 -17.329 1.00 0.00 C ATOM 1460 O TRP A 99 11.204 -15.996 -18.501 1.00 0.00 O ATOM 1461 CB TRP A 99 10.602 -14.152 -16.231 1.00 0.00 C ATOM 1462 CG TRP A 99 9.575 -13.230 -15.633 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.449 -13.565 -14.956 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.609 -11.770 -15.622 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.815 -12.418 -14.514 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.528 -11.290 -14.832 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.468 -10.806 -16.181 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.379 -9.939 -14.504 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.353 -9.446 -15.836 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.339 -9.021 -14.959 1.00 0.00 C ATOM 0 H TRP A 99 10.785 -15.756 -14.314 1.00 0.00 H new ATOM 0 HA TRP A 99 9.255 -15.761 -16.761 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.514 -14.064 -15.641 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.834 -13.789 -17.232 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.100 -14.573 -14.788 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.926 -12.412 -14.013 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.227 -11.114 -16.885 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.540 -9.607 -13.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.046 -8.726 -16.246 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.299 -7.991 -14.636 1.00 0.00 H new ATOM 1481 N GLN A 100 11.936 -17.386 -16.901 1.00 0.00 N ATOM 1482 CA GLN A 100 12.732 -18.295 -17.751 1.00 0.00 C ATOM 1483 C GLN A 100 13.670 -17.606 -18.771 1.00 0.00 C ATOM 1484 O GLN A 100 13.864 -18.082 -19.892 1.00 0.00 O ATOM 1485 CB GLN A 100 11.887 -19.493 -18.248 1.00 0.00 C ATOM 1486 CG GLN A 100 10.563 -19.225 -18.983 1.00 0.00 C ATOM 1487 CD GLN A 100 10.723 -18.833 -20.455 1.00 0.00 C ATOM 1488 OE1 GLN A 100 10.777 -19.673 -21.344 1.00 0.00 O ATOM 1489 NE2 GLN A 100 10.780 -17.560 -20.783 1.00 0.00 N ATOM 0 H GLN A 100 12.012 -17.617 -15.910 1.00 0.00 H new ATOM 0 HA GLN A 100 13.489 -18.748 -17.111 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.517 -20.085 -18.912 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.661 -20.116 -17.383 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.941 -20.118 -18.923 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.028 -18.429 -18.464 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.737 -16.844 -20.058 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.867 -17.289 -21.762 1.00 0.00 H new ATOM 1498 N LEU A 101 14.274 -16.482 -18.354 1.00 0.00 N ATOM 1499 CA LEU A 101 15.254 -15.714 -19.138 1.00 0.00 C ATOM 1500 C LEU A 101 16.638 -16.394 -19.175 1.00 0.00 C ATOM 1501 O LEU A 101 17.007 -17.143 -18.267 1.00 0.00 O ATOM 1502 CB LEU A 101 15.396 -14.289 -18.555 1.00 0.00 C ATOM 1503 CG LEU A 101 14.118 -13.448 -18.399 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.494 -12.111 -17.774 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.439 -13.176 -19.732 1.00 0.00 C ATOM 0 H LEU A 101 14.089 -16.072 -17.439 1.00 0.00 H new ATOM 0 HA LEU A 101 14.881 -15.666 -20.161 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.863 -14.373 -17.574 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.087 -13.734 -19.190 1.00 0.00 H new ATOM 0 HG LEU A 101 13.423 -14.009 -17.774 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.599 -11.500 -17.656 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.949 -12.281 -16.798 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.203 -11.594 -18.420 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.542 -12.579 -19.568 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.123 -12.632 -20.384 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.165 -14.121 -20.200 1.00 0.00 H new ATOM 1517 N GLU A 102 17.433 -16.052 -20.189 1.00 0.00 N ATOM 1518 CA GLU A 102 18.852 -16.426 -20.312 1.00 0.00 C ATOM 1519 C GLU A 102 19.765 -15.434 -19.557 1.00 0.00 C ATOM 1520 O GLU A 102 19.355 -14.319 -19.223 1.00 0.00 O ATOM 1521 CB GLU A 102 19.177 -16.545 -21.813 1.00 0.00 C ATOM 1522 CG GLU A 102 20.545 -17.173 -22.111 1.00 0.00 C ATOM 1523 CD GLU A 102 20.635 -17.624 -23.585 1.00 0.00 C ATOM 1524 OE1 GLU A 102 20.845 -16.770 -24.481 1.00 0.00 O ATOM 1525 OE2 GLU A 102 20.495 -18.842 -23.856 1.00 0.00 O ATOM 0 H GLU A 102 17.103 -15.490 -20.974 1.00 0.00 H new ATOM 0 HA GLU A 102 19.042 -17.389 -19.839 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.403 -17.142 -22.295 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.140 -15.552 -22.261 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.335 -16.452 -21.898 1.00 0.00 H new ATOM 0 HG3 GLU A 102 20.708 -18.028 -21.454 1.00 0.00 H new ATOM 1532 N ASP A 103 21.006 -15.828 -19.256 1.00 0.00 N ATOM 1533 CA ASP A 103 22.023 -14.971 -18.633 1.00 0.00 C ATOM 1534 C ASP A 103 22.866 -14.207 -19.684 1.00 0.00 C ATOM 1535 O ASP A 103 23.478 -14.847 -20.543 1.00 0.00 O ATOM 1536 CB ASP A 103 22.882 -15.808 -17.669 1.00 0.00 C ATOM 1537 CG ASP A 103 23.692 -16.931 -18.353 1.00 0.00 C ATOM 1538 OD1 ASP A 103 23.081 -17.904 -18.857 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.944 -16.873 -18.323 1.00 0.00 O ATOM 0 H ASP A 103 21.341 -16.773 -19.442 1.00 0.00 H new ATOM 0 HA ASP A 103 21.522 -14.197 -18.052 1.00 0.00 H new ATOM 0 HB2 ASP A 103 23.572 -15.145 -17.146 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.233 -16.252 -16.914 1.00 0.00 H new ATOM 1544 N PRO A 104 22.906 -12.854 -19.653 1.00 0.00 N ATOM 1545 CA PRO A 104 23.506 -12.074 -20.745 1.00 0.00 C ATOM 1546 C PRO A 104 24.989 -11.702 -20.538 1.00 0.00 C ATOM 1547 O PRO A 104 25.674 -11.360 -21.501 1.00 0.00 O ATOM 1548 CB PRO A 104 22.613 -10.839 -20.822 1.00 0.00 C ATOM 1549 CG PRO A 104 22.314 -10.555 -19.351 1.00 0.00 C ATOM 1550 CD PRO A 104 22.110 -11.970 -18.799 1.00 0.00 C ATOM 0 HA PRO A 104 23.542 -12.654 -21.667 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.119 -10.002 -21.302 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.703 -11.031 -21.391 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.137 -10.038 -18.858 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.427 -9.934 -19.226 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.435 -12.034 -17.760 1.00 0.00 H new ATOM 0 HD3 PRO A 104 21.057 -12.250 -18.822 1.00 0.00 H new ATOM 1558 N ASP A 105 25.484 -11.759 -19.296 1.00 0.00 N ATOM 1559 CA ASP A 105 26.841 -11.393 -18.867 1.00 0.00 C ATOM 1560 C ASP A 105 27.943 -11.921 -19.808 1.00 0.00 C ATOM 1561 O ASP A 105 28.229 -13.123 -19.857 1.00 0.00 O ATOM 1562 CB ASP A 105 27.032 -11.918 -17.434 1.00 0.00 C ATOM 1563 CG ASP A 105 28.450 -11.685 -16.881 1.00 0.00 C ATOM 1564 OD1 ASP A 105 29.052 -10.627 -17.183 1.00 0.00 O ATOM 1565 OD2 ASP A 105 28.931 -12.548 -16.106 1.00 0.00 O ATOM 0 H ASP A 105 24.913 -12.082 -18.515 1.00 0.00 H new ATOM 0 HA ASP A 105 26.940 -10.308 -18.901 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.310 -11.432 -16.778 1.00 0.00 H new ATOM 0 HB3 ASP A 105 26.813 -12.986 -17.414 1.00 0.00 H new ATOM 1570 N GLY A 106 28.561 -11.006 -20.566 1.00 0.00 N ATOM 1571 CA GLY A 106 29.708 -11.285 -21.438 1.00 0.00 C ATOM 1572 C GLY A 106 29.404 -12.127 -22.685 1.00 0.00 C ATOM 1573 O GLY A 106 30.341 -12.541 -23.369 1.00 0.00 O ATOM 0 H GLY A 106 28.270 -10.029 -20.590 1.00 0.00 H new ATOM 0 HA2 GLY A 106 30.137 -10.336 -21.758 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.471 -11.798 -20.852 1.00 0.00 H new ATOM 1577 N GLN A 107 28.127 -12.398 -22.991 1.00 0.00 N ATOM 1578 CA GLN A 107 27.738 -13.244 -24.129 1.00 0.00 C ATOM 1579 C GLN A 107 27.806 -12.465 -25.452 1.00 0.00 C ATOM 1580 O GLN A 107 28.632 -12.763 -26.315 1.00 0.00 O ATOM 1581 CB GLN A 107 26.355 -13.887 -23.896 1.00 0.00 C ATOM 1582 CG GLN A 107 26.240 -14.693 -22.591 1.00 0.00 C ATOM 1583 CD GLN A 107 27.351 -15.727 -22.409 1.00 0.00 C ATOM 1584 OE1 GLN A 107 27.438 -16.720 -23.120 1.00 0.00 O ATOM 1585 NE2 GLN A 107 28.258 -15.526 -21.471 1.00 0.00 N ATOM 0 H GLN A 107 27.336 -12.038 -22.458 1.00 0.00 H new ATOM 0 HA GLN A 107 28.458 -14.059 -24.207 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.599 -13.102 -23.891 1.00 0.00 H new ATOM 0 HB3 GLN A 107 26.127 -14.544 -24.736 1.00 0.00 H new ATOM 0 HG2 GLN A 107 26.254 -14.004 -21.746 1.00 0.00 H new ATOM 0 HG3 GLN A 107 25.276 -15.201 -22.572 1.00 0.00 H new ATOM 0 HE21 GLN A 107 28.198 -14.703 -20.871 1.00 0.00 H new ATOM 0 HE22 GLN A 107 29.019 -16.194 -21.346 1.00 0.00 H new ATOM 1594 N SER A 108 26.940 -11.458 -25.589 1.00 0.00 N ATOM 1595 CA SER A 108 26.915 -10.465 -26.672 1.00 0.00 C ATOM 1596 C SER A 108 25.922 -9.362 -26.320 1.00 0.00 C ATOM 1597 O SER A 108 24.918 -9.623 -25.655 1.00 0.00 O ATOM 1598 CB SER A 108 26.503 -11.119 -28.001 1.00 0.00 C ATOM 1599 OG SER A 108 26.296 -10.146 -29.014 1.00 0.00 O ATOM 0 H SER A 108 26.195 -11.303 -24.910 1.00 0.00 H new ATOM 0 HA SER A 108 27.915 -10.046 -26.787 1.00 0.00 H new ATOM 0 HB2 SER A 108 27.276 -11.819 -28.319 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.590 -11.696 -27.857 1.00 0.00 H new ATOM 0 HG SER A 108 26.037 -10.592 -29.847 1.00 0.00 H new ATOM 1605 N LEU A 109 26.142 -8.143 -26.818 1.00 0.00 N ATOM 1606 CA LEU A 109 25.185 -7.037 -26.689 1.00 0.00 C ATOM 1607 C LEU A 109 23.839 -7.387 -27.343 1.00 0.00 C ATOM 1608 O LEU A 109 22.802 -6.986 -26.833 1.00 0.00 O ATOM 1609 CB LEU A 109 25.787 -5.737 -27.268 1.00 0.00 C ATOM 1610 CG LEU A 109 26.748 -5.008 -26.306 1.00 0.00 C ATOM 1611 CD1 LEU A 109 28.063 -5.743 -26.043 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.094 -3.620 -26.847 1.00 0.00 C ATOM 0 H LEU A 109 26.991 -7.892 -27.324 1.00 0.00 H new ATOM 0 HA LEU A 109 24.988 -6.870 -25.630 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.321 -5.974 -28.188 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.975 -5.061 -27.536 1.00 0.00 H new ATOM 0 HG LEU A 109 26.205 -4.955 -25.362 1.00 0.00 H new ATOM 0 HD11 LEU A 109 28.676 -5.158 -25.357 1.00 0.00 H new ATOM 0 HD12 LEU A 109 27.853 -6.717 -25.602 1.00 0.00 H new ATOM 0 HD13 LEU A 109 28.599 -5.878 -26.983 1.00 0.00 H new ATOM 0 HD21 LEU A 109 27.773 -3.119 -26.157 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.574 -3.718 -27.821 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.182 -3.032 -26.950 1.00 0.00 H new ATOM 1624 N GLU A 110 23.814 -8.232 -28.375 1.00 0.00 N ATOM 1625 CA GLU A 110 22.569 -8.744 -28.978 1.00 0.00 C ATOM 1626 C GLU A 110 21.744 -9.584 -27.990 1.00 0.00 C ATOM 1627 O GLU A 110 20.522 -9.444 -27.914 1.00 0.00 O ATOM 1628 CB GLU A 110 22.909 -9.608 -30.196 1.00 0.00 C ATOM 1629 CG GLU A 110 23.568 -8.809 -31.330 1.00 0.00 C ATOM 1630 CD GLU A 110 23.786 -9.699 -32.570 1.00 0.00 C ATOM 1631 OE1 GLU A 110 24.855 -10.349 -32.680 1.00 0.00 O ATOM 1632 OE2 GLU A 110 22.891 -9.756 -33.449 1.00 0.00 O ATOM 0 H GLU A 110 24.659 -8.586 -28.823 1.00 0.00 H new ATOM 0 HA GLU A 110 21.970 -7.880 -29.268 1.00 0.00 H new ATOM 0 HB2 GLU A 110 23.577 -10.413 -29.889 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.998 -10.075 -30.569 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.941 -7.957 -31.593 1.00 0.00 H new ATOM 0 HG3 GLU A 110 24.524 -8.408 -30.991 1.00 0.00 H new ATOM 1639 N VAL A 111 22.408 -10.411 -27.176 1.00 0.00 N ATOM 1640 CA VAL A 111 21.759 -11.221 -26.125 1.00 0.00 C ATOM 1641 C VAL A 111 21.308 -10.305 -24.990 1.00 0.00 C ATOM 1642 O VAL A 111 20.202 -10.443 -24.472 1.00 0.00 O ATOM 1643 CB VAL A 111 22.701 -12.329 -25.604 1.00 0.00 C ATOM 1644 CG1 VAL A 111 22.077 -13.153 -24.470 1.00 0.00 C ATOM 1645 CG2 VAL A 111 23.076 -13.305 -26.725 1.00 0.00 C ATOM 0 H VAL A 111 23.418 -10.542 -27.224 1.00 0.00 H new ATOM 0 HA VAL A 111 20.888 -11.719 -26.551 1.00 0.00 H new ATOM 0 HB VAL A 111 23.582 -11.808 -25.228 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.783 -13.916 -24.144 1.00 0.00 H new ATOM 0 HG12 VAL A 111 21.838 -12.497 -23.633 1.00 0.00 H new ATOM 0 HG13 VAL A 111 21.165 -13.632 -24.827 1.00 0.00 H new ATOM 0 HG21 VAL A 111 23.740 -14.074 -26.331 1.00 0.00 H new ATOM 0 HG22 VAL A 111 22.173 -13.772 -27.118 1.00 0.00 H new ATOM 0 HG23 VAL A 111 23.583 -12.764 -27.524 1.00 0.00 H new ATOM 1655 N PHE A 112 22.135 -9.311 -24.658 1.00 0.00 N ATOM 1656 CA PHE A 112 21.857 -8.324 -23.607 1.00 0.00 C ATOM 1657 C PHE A 112 20.622 -7.468 -23.941 1.00 0.00 C ATOM 1658 O PHE A 112 19.724 -7.325 -23.113 1.00 0.00 O ATOM 1659 CB PHE A 112 23.135 -7.496 -23.354 1.00 0.00 C ATOM 1660 CG PHE A 112 23.496 -7.338 -21.896 1.00 0.00 C ATOM 1661 CD1 PHE A 112 22.680 -6.583 -21.035 1.00 0.00 C ATOM 1662 CD2 PHE A 112 24.636 -7.988 -21.386 1.00 0.00 C ATOM 1663 CE1 PHE A 112 22.999 -6.491 -19.671 1.00 0.00 C ATOM 1664 CE2 PHE A 112 24.943 -7.902 -20.019 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.142 -7.137 -19.162 1.00 0.00 C ATOM 0 H PHE A 112 23.033 -9.165 -25.119 1.00 0.00 H new ATOM 0 HA PHE A 112 21.597 -8.832 -22.678 1.00 0.00 H new ATOM 0 HB2 PHE A 112 23.969 -7.969 -23.873 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.006 -6.507 -23.793 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.809 -6.075 -21.422 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.275 -8.554 -22.048 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.364 -5.922 -19.008 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.801 -8.428 -19.626 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.399 -7.043 -18.117 1.00 0.00 H new ATOM 1675 N ARG A 113 20.500 -6.990 -25.187 1.00 0.00 N ATOM 1676 CA ARG A 113 19.297 -6.290 -25.687 1.00 0.00 C ATOM 1677 C ARG A 113 18.094 -7.231 -25.815 1.00 0.00 C ATOM 1678 O ARG A 113 16.996 -6.838 -25.437 1.00 0.00 O ATOM 1679 CB ARG A 113 19.603 -5.571 -27.018 1.00 0.00 C ATOM 1680 CG ARG A 113 20.660 -4.462 -26.864 1.00 0.00 C ATOM 1681 CD ARG A 113 20.773 -3.622 -28.146 1.00 0.00 C ATOM 1682 NE ARG A 113 21.867 -2.628 -28.065 1.00 0.00 N ATOM 1683 CZ ARG A 113 22.930 -2.544 -28.845 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.232 -3.450 -29.736 1.00 0.00 N ATOM 1685 NH2 ARG A 113 23.721 -1.521 -28.748 1.00 0.00 N ATOM 0 H ARG A 113 21.237 -7.076 -25.887 1.00 0.00 H new ATOM 0 HA ARG A 113 19.022 -5.536 -24.950 1.00 0.00 H new ATOM 0 HB2 ARG A 113 19.952 -6.301 -27.749 1.00 0.00 H new ATOM 0 HB3 ARG A 113 18.683 -5.139 -27.413 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.396 -3.818 -26.026 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.627 -4.907 -26.631 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.945 -4.281 -28.997 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.829 -3.108 -28.327 1.00 0.00 H new ATOM 0 HE ARG A 113 21.792 -1.930 -27.325 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.635 -4.269 -29.853 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.065 -3.339 -30.314 1.00 0.00 H new ATOM 0 HH21 ARG A 113 23.522 -0.785 -28.071 1.00 0.00 H new ATOM 0 HH22 ARG A 113 24.543 -1.453 -29.349 1.00 0.00 H new ATOM 1699 N THR A 114 18.294 -8.486 -26.229 1.00 0.00 N ATOM 1700 CA THR A 114 17.215 -9.503 -26.289 1.00 0.00 C ATOM 1701 C THR A 114 16.572 -9.726 -24.919 1.00 0.00 C ATOM 1702 O THR A 114 15.350 -9.615 -24.798 1.00 0.00 O ATOM 1703 CB THR A 114 17.705 -10.843 -26.869 1.00 0.00 C ATOM 1704 OG1 THR A 114 18.109 -10.661 -28.208 1.00 0.00 O ATOM 1705 CG2 THR A 114 16.619 -11.927 -26.893 1.00 0.00 C ATOM 0 H THR A 114 19.203 -8.835 -26.533 1.00 0.00 H new ATOM 0 HA THR A 114 16.459 -9.103 -26.965 1.00 0.00 H new ATOM 0 HB THR A 114 18.520 -11.166 -26.221 1.00 0.00 H new ATOM 0 HG1 THR A 114 19.044 -10.369 -28.231 1.00 0.00 H new ATOM 0 HG21 THR A 114 17.030 -12.845 -27.313 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.272 -12.117 -25.877 1.00 0.00 H new ATOM 0 HG23 THR A 114 15.783 -11.591 -27.506 1.00 0.00 H new ATOM 1713 N VAL A 115 17.357 -9.944 -23.854 1.00 0.00 N ATOM 1714 CA VAL A 115 16.784 -10.095 -22.511 1.00 0.00 C ATOM 1715 C VAL A 115 16.218 -8.781 -21.974 1.00 0.00 C ATOM 1716 O VAL A 115 15.199 -8.831 -21.301 1.00 0.00 O ATOM 1717 CB VAL A 115 17.724 -10.815 -21.530 1.00 0.00 C ATOM 1718 CG1 VAL A 115 18.164 -12.180 -22.066 1.00 0.00 C ATOM 1719 CG2 VAL A 115 18.957 -10.008 -21.130 1.00 0.00 C ATOM 0 H VAL A 115 18.373 -10.019 -23.895 1.00 0.00 H new ATOM 0 HA VAL A 115 15.930 -10.764 -22.612 1.00 0.00 H new ATOM 0 HB VAL A 115 17.124 -10.946 -20.629 1.00 0.00 H new ATOM 0 HG11 VAL A 115 18.827 -12.658 -21.345 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.288 -12.808 -22.225 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.691 -12.047 -23.011 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.564 -10.591 -20.437 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.544 -9.775 -22.019 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.645 -9.081 -20.648 1.00 0.00 H new ATOM 1729 N ARG A 116 16.752 -7.604 -22.344 1.00 0.00 N ATOM 1730 CA ARG A 116 16.101 -6.303 -22.034 1.00 0.00 C ATOM 1731 C ARG A 116 14.703 -6.208 -22.659 1.00 0.00 C ATOM 1732 O ARG A 116 13.777 -5.795 -21.978 1.00 0.00 O ATOM 1733 CB ARG A 116 17.039 -5.103 -22.363 1.00 0.00 C ATOM 1734 CG ARG A 116 16.477 -4.067 -23.362 1.00 0.00 C ATOM 1735 CD ARG A 116 17.475 -2.960 -23.734 1.00 0.00 C ATOM 1736 NE ARG A 116 17.183 -2.444 -25.096 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.005 -1.781 -25.894 1.00 0.00 C ATOM 1738 NH1 ARG A 116 19.131 -1.320 -25.455 1.00 0.00 N ATOM 1739 NH2 ARG A 116 17.716 -1.575 -27.142 1.00 0.00 N ATOM 0 H ARG A 116 17.630 -7.519 -22.857 1.00 0.00 H new ATOM 0 HA ARG A 116 15.934 -6.248 -20.958 1.00 0.00 H new ATOM 0 HB2 ARG A 116 17.281 -4.589 -21.433 1.00 0.00 H new ATOM 0 HB3 ARG A 116 17.974 -5.496 -22.763 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.166 -4.583 -24.270 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.585 -3.610 -22.934 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.416 -2.148 -23.009 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.492 -3.349 -23.695 1.00 0.00 H new ATOM 0 HE ARG A 116 16.245 -2.620 -25.456 1.00 0.00 H new ATOM 0 HH11 ARG A 116 19.397 -1.465 -24.481 1.00 0.00 H new ATOM 0 HH12 ARG A 116 19.753 -0.811 -26.083 1.00 0.00 H new ATOM 0 HH21 ARG A 116 16.840 -1.927 -27.527 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.365 -1.061 -27.738 1.00 0.00 H new ATOM 1753 N GLY A 117 14.530 -6.643 -23.908 1.00 0.00 N ATOM 1754 CA GLY A 117 13.236 -6.632 -24.613 1.00 0.00 C ATOM 1755 C GLY A 117 12.209 -7.576 -23.981 1.00 0.00 C ATOM 1756 O GLY A 117 11.065 -7.189 -23.745 1.00 0.00 O ATOM 0 H GLY A 117 15.293 -7.019 -24.471 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.837 -5.618 -24.616 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.392 -6.916 -25.654 1.00 0.00 H new ATOM 1760 N GLN A 118 12.646 -8.784 -23.601 1.00 0.00 N ATOM 1761 CA GLN A 118 11.824 -9.723 -22.823 1.00 0.00 C ATOM 1762 C GLN A 118 11.451 -9.159 -21.450 1.00 0.00 C ATOM 1763 O GLN A 118 10.286 -9.187 -21.057 1.00 0.00 O ATOM 1764 CB GLN A 118 12.580 -11.045 -22.633 1.00 0.00 C ATOM 1765 CG GLN A 118 12.655 -11.845 -23.941 1.00 0.00 C ATOM 1766 CD GLN A 118 13.292 -13.210 -23.713 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.272 -13.595 -24.331 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.758 -13.981 -22.789 1.00 0.00 N ATOM 0 H GLN A 118 13.576 -9.138 -23.823 1.00 0.00 H new ATOM 0 HA GLN A 118 10.904 -9.889 -23.383 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.588 -10.840 -22.273 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.084 -11.642 -21.868 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.653 -11.972 -24.351 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.234 -11.289 -24.679 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.939 -13.663 -22.270 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.163 -14.896 -22.592 1.00 0.00 H new ATOM 1777 N VAL A 119 12.443 -8.614 -20.734 1.00 0.00 N ATOM 1778 CA VAL A 119 12.240 -8.009 -19.412 1.00 0.00 C ATOM 1779 C VAL A 119 11.256 -6.845 -19.514 1.00 0.00 C ATOM 1780 O VAL A 119 10.337 -6.799 -18.717 1.00 0.00 O ATOM 1781 CB VAL A 119 13.578 -7.553 -18.783 1.00 0.00 C ATOM 1782 CG1 VAL A 119 13.434 -6.608 -17.582 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.361 -8.760 -18.270 1.00 0.00 C ATOM 0 H VAL A 119 13.410 -8.580 -21.056 1.00 0.00 H new ATOM 0 HA VAL A 119 11.818 -8.767 -18.752 1.00 0.00 H new ATOM 0 HB VAL A 119 14.083 -7.021 -19.589 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.423 -6.342 -17.208 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.908 -5.705 -17.891 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.869 -7.105 -16.793 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.300 -8.424 -17.830 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.773 -9.281 -17.515 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.570 -9.437 -19.098 1.00 0.00 H new ATOM 1793 N LYS A 120 11.381 -5.949 -20.502 1.00 0.00 N ATOM 1794 CA LYS A 120 10.466 -4.812 -20.719 1.00 0.00 C ATOM 1795 C LYS A 120 9.005 -5.261 -20.781 1.00 0.00 C ATOM 1796 O LYS A 120 8.184 -4.781 -20.005 1.00 0.00 O ATOM 1797 CB LYS A 120 10.880 -4.060 -21.996 1.00 0.00 C ATOM 1798 CG LYS A 120 9.988 -2.834 -22.251 1.00 0.00 C ATOM 1799 CD LYS A 120 10.455 -2.060 -23.493 1.00 0.00 C ATOM 1800 CE LYS A 120 9.604 -0.809 -23.772 1.00 0.00 C ATOM 1801 NZ LYS A 120 8.225 -1.135 -24.241 1.00 0.00 N ATOM 0 H LYS A 120 12.135 -5.992 -21.188 1.00 0.00 H new ATOM 0 HA LYS A 120 10.544 -4.135 -19.868 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.919 -3.742 -21.910 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.823 -4.735 -22.850 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.955 -3.154 -22.385 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.008 -2.178 -21.381 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.496 -1.764 -23.361 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.419 -2.719 -24.361 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.541 -0.209 -22.864 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.103 -0.197 -24.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.699 -0.254 -24.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.279 -1.683 -25.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.735 -1.695 -23.515 1.00 0.00 H new ATOM 1815 N GLU A 121 8.693 -6.220 -21.653 1.00 0.00 N ATOM 1816 CA GLU A 121 7.323 -6.721 -21.831 1.00 0.00 C ATOM 1817 C GLU A 121 6.773 -7.368 -20.549 1.00 0.00 C ATOM 1818 O GLU A 121 5.662 -7.051 -20.121 1.00 0.00 O ATOM 1819 CB GLU A 121 7.304 -7.697 -23.018 1.00 0.00 C ATOM 1820 CG GLU A 121 5.885 -8.164 -23.373 1.00 0.00 C ATOM 1821 CD GLU A 121 5.897 -9.039 -24.640 1.00 0.00 C ATOM 1822 OE1 GLU A 121 6.078 -10.276 -24.529 1.00 0.00 O ATOM 1823 OE2 GLU A 121 5.719 -8.497 -25.759 1.00 0.00 O ATOM 0 H GLU A 121 9.379 -6.673 -22.257 1.00 0.00 H new ATOM 0 HA GLU A 121 6.662 -5.881 -22.045 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.753 -7.216 -23.887 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.920 -8.565 -22.781 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.464 -8.728 -22.540 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.241 -7.299 -23.530 1.00 0.00 H new ATOM 1830 N ARG A 122 7.566 -8.222 -19.888 1.00 0.00 N ATOM 1831 CA ARG A 122 7.146 -8.890 -18.644 1.00 0.00 C ATOM 1832 C ARG A 122 7.080 -7.939 -17.441 1.00 0.00 C ATOM 1833 O ARG A 122 6.173 -8.061 -16.624 1.00 0.00 O ATOM 1834 CB ARG A 122 8.037 -10.114 -18.387 1.00 0.00 C ATOM 1835 CG ARG A 122 7.714 -11.255 -19.365 1.00 0.00 C ATOM 1836 CD ARG A 122 8.483 -12.531 -19.016 1.00 0.00 C ATOM 1837 NE ARG A 122 7.961 -13.678 -19.788 1.00 0.00 N ATOM 1838 CZ ARG A 122 7.215 -14.681 -19.352 1.00 0.00 C ATOM 1839 NH1 ARG A 122 6.788 -14.747 -18.122 1.00 0.00 N ATOM 1840 NH2 ARG A 122 6.878 -15.645 -20.156 1.00 0.00 N ATOM 0 H ARG A 122 8.507 -8.469 -20.194 1.00 0.00 H new ATOM 0 HA ARG A 122 6.120 -9.234 -18.777 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.085 -9.831 -18.488 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.897 -10.460 -17.363 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.643 -11.458 -19.347 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.963 -10.946 -20.380 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.543 -12.394 -19.230 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.397 -12.734 -17.949 1.00 0.00 H new ATOM 0 HE ARG A 122 8.205 -13.699 -20.778 1.00 0.00 H new ATOM 0 HH11 ARG A 122 7.027 -14.010 -17.459 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.215 -15.536 -17.823 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.188 -15.631 -21.128 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.303 -16.416 -19.815 1.00 0.00 H new ATOM 1854 N VAL A 123 7.951 -6.933 -17.374 1.00 0.00 N ATOM 1855 CA VAL A 123 7.882 -5.849 -16.381 1.00 0.00 C ATOM 1856 C VAL A 123 6.628 -5.002 -16.584 1.00 0.00 C ATOM 1857 O VAL A 123 5.937 -4.751 -15.603 1.00 0.00 O ATOM 1858 CB VAL A 123 9.122 -4.948 -16.412 1.00 0.00 C ATOM 1859 CG1 VAL A 123 8.901 -3.710 -15.548 1.00 0.00 C ATOM 1860 CG2 VAL A 123 10.350 -5.636 -15.805 1.00 0.00 C ATOM 0 H VAL A 123 8.739 -6.842 -18.016 1.00 0.00 H new ATOM 0 HA VAL A 123 7.841 -6.328 -15.403 1.00 0.00 H new ATOM 0 HB VAL A 123 9.285 -4.707 -17.462 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.790 -3.080 -15.580 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.046 -3.150 -15.927 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.709 -4.014 -14.519 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.204 -4.960 -15.849 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.145 -5.896 -14.766 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.575 -6.542 -16.368 1.00 0.00 H new ATOM 1870 N GLU A 124 6.312 -4.571 -17.813 1.00 0.00 N ATOM 1871 CA GLU A 124 5.060 -3.853 -18.105 1.00 0.00 C ATOM 1872 C GLU A 124 3.869 -4.671 -17.604 1.00 0.00 C ATOM 1873 O GLU A 124 3.106 -4.200 -16.766 1.00 0.00 O ATOM 1874 CB GLU A 124 4.892 -3.582 -19.614 1.00 0.00 C ATOM 1875 CG GLU A 124 5.720 -2.401 -20.128 1.00 0.00 C ATOM 1876 CD GLU A 124 5.473 -2.136 -21.626 1.00 0.00 C ATOM 1877 OE1 GLU A 124 4.322 -1.810 -22.009 1.00 0.00 O ATOM 1878 OE2 GLU A 124 6.435 -2.216 -22.430 1.00 0.00 O ATOM 0 H GLU A 124 6.910 -4.708 -18.628 1.00 0.00 H new ATOM 0 HA GLU A 124 5.103 -2.892 -17.592 1.00 0.00 H new ATOM 0 HB2 GLU A 124 5.173 -4.478 -20.168 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.839 -3.394 -19.824 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.472 -1.507 -19.555 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.779 -2.601 -19.964 1.00 0.00 H new ATOM 1885 N ASN A 125 3.777 -5.927 -18.034 1.00 0.00 N ATOM 1886 CA ASN A 125 2.726 -6.863 -17.625 1.00 0.00 C ATOM 1887 C ASN A 125 2.622 -7.009 -16.093 1.00 0.00 C ATOM 1888 O ASN A 125 1.512 -7.110 -15.575 1.00 0.00 O ATOM 1889 CB ASN A 125 2.970 -8.235 -18.289 1.00 0.00 C ATOM 1890 CG ASN A 125 2.768 -8.268 -19.801 1.00 0.00 C ATOM 1891 OD1 ASN A 125 2.239 -7.355 -20.422 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.150 -9.357 -20.436 1.00 0.00 N ATOM 0 H ASN A 125 4.444 -6.334 -18.690 1.00 0.00 H new ATOM 0 HA ASN A 125 1.772 -6.456 -17.960 1.00 0.00 H new ATOM 0 HB2 ASN A 125 3.989 -8.552 -18.067 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.302 -8.966 -17.833 1.00 0.00 H new ATOM 0 HD21 ASN A 125 3.005 -9.438 -21.442 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.591 -10.119 -19.921 1.00 0.00 H new ATOM 1899 N LEU A 126 3.741 -6.997 -15.358 1.00 0.00 N ATOM 1900 CA LEU A 126 3.758 -7.132 -13.900 1.00 0.00 C ATOM 1901 C LEU A 126 3.370 -5.825 -13.189 1.00 0.00 C ATOM 1902 O LEU A 126 2.406 -5.796 -12.426 1.00 0.00 O ATOM 1903 CB LEU A 126 5.142 -7.670 -13.485 1.00 0.00 C ATOM 1904 CG LEU A 126 5.328 -8.129 -12.028 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.591 -6.976 -11.057 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.155 -8.972 -11.524 1.00 0.00 C ATOM 0 H LEU A 126 4.670 -6.892 -15.766 1.00 0.00 H new ATOM 0 HA LEU A 126 2.997 -7.845 -13.583 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.382 -8.512 -14.134 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.878 -6.892 -13.687 1.00 0.00 H new ATOM 0 HG LEU A 126 6.221 -8.754 -12.049 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.712 -7.370 -10.048 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.499 -6.451 -11.353 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.749 -6.284 -11.077 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.338 -9.269 -10.491 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.237 -8.386 -11.576 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.053 -9.862 -12.145 1.00 0.00 H new ATOM 1918 N ILE A 127 4.095 -4.730 -13.445 1.00 0.00 N ATOM 1919 CA ILE A 127 3.905 -3.432 -12.790 1.00 0.00 C ATOM 1920 C ILE A 127 2.545 -2.796 -13.137 1.00 0.00 C ATOM 1921 O ILE A 127 1.928 -2.155 -12.292 1.00 0.00 O ATOM 1922 CB ILE A 127 5.127 -2.543 -13.140 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.725 -1.816 -11.920 1.00 0.00 C ATOM 1924 CG2 ILE A 127 4.918 -1.581 -14.319 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.744 -0.927 -11.150 1.00 0.00 C ATOM 0 H ILE A 127 4.849 -4.723 -14.131 1.00 0.00 H new ATOM 0 HA ILE A 127 3.863 -3.553 -11.708 1.00 0.00 H new ATOM 0 HB ILE A 127 5.866 -3.267 -13.484 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.131 -2.561 -11.235 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.561 -1.202 -12.256 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.828 -1.005 -14.484 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.682 -2.152 -15.217 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.095 -0.903 -14.094 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.259 -0.459 -10.311 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.355 -0.154 -11.813 1.00 0.00 H new ATOM 0 HD13 ILE A 127 3.919 -1.534 -10.777 1.00 0.00 H new ATOM 1937 N ALA A 128 2.027 -3.022 -14.349 1.00 0.00 N ATOM 1938 CA ALA A 128 0.796 -2.380 -14.821 1.00 0.00 C ATOM 1939 C ALA A 128 -0.493 -2.997 -14.226 1.00 0.00 C ATOM 1940 O ALA A 128 -1.528 -2.328 -14.186 1.00 0.00 O ATOM 1941 CB ALA A 128 0.808 -2.361 -16.355 1.00 0.00 C ATOM 0 H ALA A 128 2.449 -3.654 -15.029 1.00 0.00 H new ATOM 0 HA ALA A 128 0.778 -1.353 -14.455 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.103 -1.886 -16.720 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.675 -1.801 -16.705 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.860 -3.383 -16.731 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.430 -4.225 -13.681 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.523 -4.857 -12.903 1.00 0.00 C ATOM 1949 C LYS A 129 -1.716 -4.240 -11.508 1.00 0.00 C ATOM 1950 O LYS A 129 -2.796 -4.352 -10.927 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.256 -6.367 -12.771 1.00 0.00 C ATOM 1952 CG LYS A 129 -1.476 -7.102 -14.094 1.00 0.00 C ATOM 1953 CD LYS A 129 -1.006 -8.559 -13.970 1.00 0.00 C ATOM 1954 CE LYS A 129 -0.869 -9.209 -15.350 1.00 0.00 C ATOM 1955 NZ LYS A 129 -2.188 -9.506 -15.988 1.00 0.00 N ATOM 0 H LYS A 129 0.394 -4.820 -13.767 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.446 -4.676 -13.454 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.232 -6.527 -12.433 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.913 -6.787 -12.009 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.532 -7.074 -14.364 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.929 -6.601 -14.893 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.048 -8.593 -13.451 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.716 -9.124 -13.366 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.297 -8.549 -16.002 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.301 -10.134 -15.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -2.033 -9.944 -16.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -2.727 -10.158 -15.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -2.723 -8.622 -16.107 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.673 -3.582 -10.986 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.619 -2.930 -9.662 1.00 0.00 C ATOM 1971 C ILE A 130 -0.467 -1.395 -9.770 1.00 0.00 C ATOM 1972 O ILE A 130 -0.048 -0.729 -8.822 1.00 0.00 O ATOM 1973 CB ILE A 130 0.437 -3.620 -8.759 1.00 0.00 C ATOM 1974 CG1 ILE A 130 1.849 -3.570 -9.387 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.002 -5.067 -8.465 1.00 0.00 C ATOM 1976 CD1 ILE A 130 2.948 -4.247 -8.564 1.00 0.00 C ATOM 0 H ILE A 130 0.203 -3.482 -11.498 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.579 -3.068 -9.165 1.00 0.00 H new ATOM 0 HB ILE A 130 0.496 -3.073 -7.818 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.810 -4.040 -10.370 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.124 -2.527 -9.544 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.746 -5.549 -7.831 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.961 -5.061 -7.955 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -0.087 -5.617 -9.402 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.900 -4.159 -9.087 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.023 -3.764 -7.590 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.704 -5.301 -8.429 1.00 0.00 H new ATOM 1988 N SER A 131 -0.825 -0.839 -10.936 1.00 0.00 N ATOM 1989 CA SER A 131 -0.856 0.594 -11.281 1.00 0.00 C ATOM 1990 C SER A 131 -2.290 1.144 -11.276 1.00 0.00 C ATOM 1991 O SER A 131 -2.534 2.172 -10.599 1.00 0.00 O ATOM 1992 CB SER A 131 -0.182 0.777 -12.639 1.00 0.00 C ATOM 1993 OG SER A 131 -0.028 2.160 -12.920 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.177 0.548 -11.932 1.00 0.00 O ATOM 0 H SER A 131 -1.122 -1.419 -11.721 1.00 0.00 H new ATOM 0 HA SER A 131 -0.312 1.164 -10.528 1.00 0.00 H new ATOM 0 HB2 SER A 131 0.791 0.286 -12.641 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.779 0.303 -13.418 1.00 0.00 H new ATOM 0 HG SER A 131 -0.876 2.523 -13.250 1.00 0.00 H new TER 2000 SER A 131