USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 773 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 92 GLN : amide:sc=-0.00931 X(o=1.4,f=1.3) USER MOD Set 1.2: A 96 SER OG : rot -110:sc= 0.757 USER MOD Set 1.3: A 100 SER OG : rot 180:sc= 0.669 USER MOD Set 2.1: A 37 GLN : amide:sc= -3.46! C(o=-3.5!,f=-5!) USER MOD Set 2.2: A 53 SER OG : rot 56:sc= 0.00175 USER MOD Set 3.1: A 25 GLN : amide:sc= -0.823 X(o=-2.5,f=-2.5) USER MOD Set 3.2: A 77 GLN : amide:sc= -1.63 K(o=-2.5,f=-6!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 32:sc= 0.308 USER MOD Single : A 6 SER OG : rot 62:sc= 1.1 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -72:sc= 0.453 USER MOD Single : A 13 ASN : amide:sc= -1.26 K(o=-1.3,f=0.061) USER MOD Single : A 14 SER OG : rot 49:sc= 1.2 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 46:sc= -2.57! USER MOD Single : A 24 GLN : amide:sc= -3.3! C(o=-3.3!,f=-3.4!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0943 K(o=-0.094,f=-2.3!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0404 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc=-0.00937 X(o=-0.0094,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.97 X(o=-0.97,f=-1.2) USER MOD Single : A 76 MET CE :methyl -179:sc= -4.73! (180deg=-4.74!) USER MOD Single : A 78 ASN : amide:sc= -0.29 K(o=-0.29,f=-1.5!) USER MOD Single : A 81 ASN : amide:sc= -0.155 K(o=-0.15,f=-2.1!) USER MOD Single : A 91 TYR OH : rot 73:sc= -1.44! USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.819 -14.372 -29.367 1.00 0.00 N ATOM 2 CA GLY A 1 24.029 -13.515 -28.212 1.00 0.00 C ATOM 3 C GLY A 1 23.667 -12.064 -28.533 1.00 0.00 C ATOM 4 O GLY A 1 24.537 -11.264 -28.873 1.00 0.00 O ATOM 0 H1 GLY A 1 24.072 -15.351 -29.123 1.00 0.00 H new ATOM 0 H2 GLY A 1 22.819 -14.333 -29.651 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.416 -14.046 -30.154 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.423 -13.869 -27.377 1.00 0.00 H new ATOM 0 HA3 GLY A 1 25.071 -13.572 -27.897 1.00 0.00 H new ATOM 8 N SER A 2 22.381 -11.768 -28.412 1.00 0.00 N ATOM 9 CA SER A 2 21.893 -10.427 -28.685 1.00 0.00 C ATOM 10 C SER A 2 20.366 -10.397 -28.593 1.00 0.00 C ATOM 11 O SER A 2 19.680 -11.027 -29.397 1.00 0.00 O ATOM 12 CB SER A 2 22.352 -9.943 -30.062 1.00 0.00 C ATOM 13 OG SER A 2 22.985 -8.668 -29.996 1.00 0.00 O ATOM 0 H SER A 2 21.662 -12.434 -28.129 1.00 0.00 H new ATOM 0 HA SER A 2 22.309 -9.753 -27.936 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.043 -10.669 -30.490 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.494 -9.887 -30.731 1.00 0.00 H new ATOM 0 HG SER A 2 23.265 -8.395 -30.895 1.00 0.00 H new ATOM 19 N SER A 3 19.879 -9.658 -27.607 1.00 0.00 N ATOM 20 CA SER A 3 18.446 -9.538 -27.400 1.00 0.00 C ATOM 21 C SER A 3 18.163 -8.591 -26.232 1.00 0.00 C ATOM 22 O SER A 3 17.860 -9.037 -25.127 1.00 0.00 O ATOM 23 CB SER A 3 17.810 -10.905 -27.141 1.00 0.00 C ATOM 24 OG SER A 3 16.404 -10.809 -26.932 1.00 0.00 O ATOM 0 H SER A 3 20.451 -9.137 -26.943 1.00 0.00 H new ATOM 0 HA SER A 3 18.003 -9.128 -28.308 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.006 -11.562 -27.988 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.276 -11.362 -26.268 1.00 0.00 H new ATOM 0 HG SER A 3 16.035 -11.703 -26.772 1.00 0.00 H new ATOM 30 N GLY A 4 18.273 -7.302 -26.517 1.00 0.00 N ATOM 31 CA GLY A 4 18.034 -6.289 -25.503 1.00 0.00 C ATOM 32 C GLY A 4 17.718 -4.936 -26.145 1.00 0.00 C ATOM 33 O GLY A 4 18.621 -4.232 -26.595 1.00 0.00 O ATOM 0 H GLY A 4 18.524 -6.936 -27.435 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.205 -6.596 -24.865 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.911 -6.196 -24.863 1.00 0.00 H new ATOM 37 N SER A 5 16.433 -4.613 -26.165 1.00 0.00 N ATOM 38 CA SER A 5 15.987 -3.357 -26.744 1.00 0.00 C ATOM 39 C SER A 5 14.468 -3.229 -26.609 1.00 0.00 C ATOM 40 O SER A 5 13.720 -3.941 -27.277 1.00 0.00 O ATOM 41 CB SER A 5 16.400 -3.249 -28.213 1.00 0.00 C ATOM 42 OG SER A 5 15.977 -4.380 -28.971 1.00 0.00 O ATOM 0 H SER A 5 15.687 -5.199 -25.790 1.00 0.00 H new ATOM 0 HA SER A 5 16.464 -2.542 -26.200 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.973 -2.343 -28.644 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.484 -3.153 -28.279 1.00 0.00 H new ATOM 0 HG SER A 5 15.137 -4.726 -28.602 1.00 0.00 H new ATOM 48 N SER A 6 14.058 -2.316 -25.740 1.00 0.00 N ATOM 49 CA SER A 6 12.642 -2.086 -25.509 1.00 0.00 C ATOM 50 C SER A 6 12.454 -1.126 -24.332 1.00 0.00 C ATOM 51 O SER A 6 13.335 -0.999 -23.483 1.00 0.00 O ATOM 52 CB SER A 6 11.906 -3.401 -25.246 1.00 0.00 C ATOM 53 OG SER A 6 11.254 -3.891 -26.414 1.00 0.00 O ATOM 0 H SER A 6 14.682 -1.727 -25.188 1.00 0.00 H new ATOM 0 HA SER A 6 12.217 -1.638 -26.407 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.614 -4.147 -24.886 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.170 -3.253 -24.455 1.00 0.00 H new ATOM 0 HG SER A 6 11.920 -4.070 -27.110 1.00 0.00 H new ATOM 59 N GLY A 7 11.299 -0.477 -24.319 1.00 0.00 N ATOM 60 CA GLY A 7 10.983 0.467 -23.260 1.00 0.00 C ATOM 61 C GLY A 7 10.524 1.807 -23.838 1.00 0.00 C ATOM 62 O GLY A 7 11.183 2.368 -24.712 1.00 0.00 O ATOM 0 H GLY A 7 10.571 -0.586 -25.025 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.201 0.055 -22.622 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.860 0.620 -22.631 1.00 0.00 H new ATOM 66 N LYS A 8 9.397 2.280 -23.328 1.00 0.00 N ATOM 67 CA LYS A 8 8.842 3.544 -23.783 1.00 0.00 C ATOM 68 C LYS A 8 7.899 4.097 -22.712 1.00 0.00 C ATOM 69 O LYS A 8 6.849 3.516 -22.445 1.00 0.00 O ATOM 70 CB LYS A 8 8.184 3.377 -25.154 1.00 0.00 C ATOM 71 CG LYS A 8 8.865 4.263 -26.200 1.00 0.00 C ATOM 72 CD LYS A 8 8.914 3.566 -27.561 1.00 0.00 C ATOM 73 CE LYS A 8 10.156 3.987 -28.348 1.00 0.00 C ATOM 74 NZ LYS A 8 10.795 2.809 -28.978 1.00 0.00 N ATOM 0 H LYS A 8 8.853 1.811 -22.604 1.00 0.00 H new ATOM 0 HA LYS A 8 9.634 4.280 -23.922 1.00 0.00 H new ATOM 0 HB2 LYS A 8 8.240 2.333 -25.464 1.00 0.00 H new ATOM 0 HB3 LYS A 8 7.127 3.633 -25.088 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.326 5.206 -26.290 1.00 0.00 H new ATOM 0 HG3 LYS A 8 9.877 4.504 -25.874 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.917 2.485 -27.420 1.00 0.00 H new ATOM 0 HD3 LYS A 8 8.018 3.810 -28.131 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.880 4.711 -29.114 1.00 0.00 H new ATOM 0 HE3 LYS A 8 10.865 4.481 -27.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 11.637 3.113 -29.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 11.076 2.131 -28.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 10.122 2.355 -29.628 1.00 0.00 H new ATOM 88 N PRO A 9 8.320 5.243 -22.113 1.00 0.00 N ATOM 89 CA PRO A 9 7.525 5.881 -21.077 1.00 0.00 C ATOM 90 C PRO A 9 6.315 6.599 -21.679 1.00 0.00 C ATOM 91 O PRO A 9 6.182 6.684 -22.899 1.00 0.00 O ATOM 92 CB PRO A 9 8.484 6.825 -20.370 1.00 0.00 C ATOM 93 CG PRO A 9 9.650 7.025 -21.325 1.00 0.00 C ATOM 94 CD PRO A 9 9.558 5.959 -22.404 1.00 0.00 C ATOM 0 HA PRO A 9 7.100 5.166 -20.373 1.00 0.00 H new ATOM 0 HB2 PRO A 9 8.000 7.774 -20.140 1.00 0.00 H new ATOM 0 HB3 PRO A 9 8.822 6.402 -19.424 1.00 0.00 H new ATOM 0 HG2 PRO A 9 9.614 8.020 -21.768 1.00 0.00 H new ATOM 0 HG3 PRO A 9 10.598 6.947 -20.792 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.534 6.404 -23.399 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.418 5.290 -22.375 1.00 0.00 H new ATOM 102 N GLU A 10 5.463 7.097 -20.795 1.00 0.00 N ATOM 103 CA GLU A 10 4.268 7.804 -21.223 1.00 0.00 C ATOM 104 C GLU A 10 3.599 8.487 -20.029 1.00 0.00 C ATOM 105 O GLU A 10 2.818 7.864 -19.311 1.00 0.00 O ATOM 106 CB GLU A 10 3.295 6.859 -21.931 1.00 0.00 C ATOM 107 CG GLU A 10 2.974 7.358 -23.341 1.00 0.00 C ATOM 108 CD GLU A 10 1.505 7.109 -23.689 1.00 0.00 C ATOM 109 OE1 GLU A 10 1.036 5.986 -23.402 1.00 0.00 O ATOM 110 OE2 GLU A 10 0.884 8.047 -24.234 1.00 0.00 O ATOM 0 H GLU A 10 5.577 7.025 -19.784 1.00 0.00 H new ATOM 0 HA GLU A 10 4.561 8.572 -21.938 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.727 5.860 -21.985 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.375 6.778 -21.352 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.193 8.423 -23.412 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.614 6.852 -24.064 1.00 0.00 H new ATOM 117 N PRO A 11 3.938 9.792 -19.848 1.00 0.00 N ATOM 118 CA PRO A 11 3.378 10.565 -18.753 1.00 0.00 C ATOM 119 C PRO A 11 1.924 10.947 -19.038 1.00 0.00 C ATOM 120 O PRO A 11 1.642 11.655 -20.003 1.00 0.00 O ATOM 121 CB PRO A 11 4.292 11.772 -18.616 1.00 0.00 C ATOM 122 CG PRO A 11 5.052 11.870 -19.929 1.00 0.00 C ATOM 123 CD PRO A 11 4.859 10.561 -20.678 1.00 0.00 C ATOM 0 HA PRO A 11 3.338 10.003 -17.820 1.00 0.00 H new ATOM 0 HB2 PRO A 11 3.716 12.679 -18.429 1.00 0.00 H new ATOM 0 HB3 PRO A 11 4.977 11.650 -17.777 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.683 12.707 -20.522 1.00 0.00 H new ATOM 0 HG3 PRO A 11 6.111 12.052 -19.745 1.00 0.00 H new ATOM 0 HD2 PRO A 11 4.448 10.731 -21.673 1.00 0.00 H new ATOM 0 HD3 PRO A 11 5.806 10.037 -20.810 1.00 0.00 H new ATOM 131 N THR A 12 1.039 10.460 -18.181 1.00 0.00 N ATOM 132 CA THR A 12 -0.379 10.740 -18.328 1.00 0.00 C ATOM 133 C THR A 12 -1.162 10.170 -17.144 1.00 0.00 C ATOM 134 O THR A 12 -1.902 9.199 -17.295 1.00 0.00 O ATOM 135 CB THR A 12 -0.833 10.186 -19.680 1.00 0.00 C ATOM 136 OG1 THR A 12 -2.247 10.359 -19.670 1.00 0.00 O ATOM 137 CG2 THR A 12 -0.643 8.671 -19.785 1.00 0.00 C ATOM 0 H THR A 12 1.277 9.873 -17.382 1.00 0.00 H new ATOM 0 HA THR A 12 -0.573 11.813 -18.318 1.00 0.00 H new ATOM 0 HB THR A 12 -0.278 10.678 -20.479 1.00 0.00 H new ATOM 0 HG1 THR A 12 -2.651 9.716 -19.051 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.981 8.329 -20.763 1.00 0.00 H new ATOM 0 HG22 THR A 12 0.412 8.427 -19.659 1.00 0.00 H new ATOM 0 HG23 THR A 12 -1.225 8.177 -19.007 1.00 0.00 H new ATOM 145 N ASN A 13 -0.972 10.797 -15.993 1.00 0.00 N ATOM 146 CA ASN A 13 -1.651 10.364 -14.783 1.00 0.00 C ATOM 147 C ASN A 13 -2.917 11.200 -14.587 1.00 0.00 C ATOM 148 O ASN A 13 -3.093 12.228 -15.240 1.00 0.00 O ATOM 149 CB ASN A 13 -0.762 10.557 -13.553 1.00 0.00 C ATOM 150 CG ASN A 13 -0.982 9.436 -12.536 1.00 0.00 C ATOM 151 OD1 ASN A 13 -0.331 8.404 -12.560 1.00 0.00 O ATOM 152 ND2 ASN A 13 -1.934 9.694 -11.644 1.00 0.00 N ATOM 0 H ASN A 13 -0.357 11.602 -15.872 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.891 9.306 -14.892 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.285 10.577 -13.856 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.979 11.520 -13.091 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.157 9.008 -10.923 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.441 10.578 -11.681 1.00 0.00 H new ATOM 159 N SER A 14 -3.765 10.728 -13.686 1.00 0.00 N ATOM 160 CA SER A 14 -5.010 11.420 -13.396 1.00 0.00 C ATOM 161 C SER A 14 -5.847 10.599 -12.412 1.00 0.00 C ATOM 162 O SER A 14 -6.835 9.977 -12.801 1.00 0.00 O ATOM 163 CB SER A 14 -5.804 11.685 -14.676 1.00 0.00 C ATOM 164 OG SER A 14 -5.549 12.984 -15.203 1.00 0.00 O ATOM 0 H SER A 14 -3.615 9.875 -13.147 1.00 0.00 H new ATOM 0 HA SER A 14 -4.770 12.383 -12.945 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.548 10.934 -15.423 1.00 0.00 H new ATOM 0 HB3 SER A 14 -6.869 11.580 -14.470 1.00 0.00 H new ATOM 0 HG SER A 14 -4.582 13.135 -15.248 1.00 0.00 H new ATOM 170 N SER A 15 -5.422 10.625 -11.158 1.00 0.00 N ATOM 171 CA SER A 15 -6.121 9.892 -10.116 1.00 0.00 C ATOM 172 C SER A 15 -6.291 8.429 -10.530 1.00 0.00 C ATOM 173 O SER A 15 -7.189 8.099 -11.302 1.00 0.00 O ATOM 174 CB SER A 15 -7.483 10.521 -9.818 1.00 0.00 C ATOM 175 OG SER A 15 -8.362 9.608 -9.166 1.00 0.00 O ATOM 0 H SER A 15 -4.602 11.142 -10.840 1.00 0.00 H new ATOM 0 HA SER A 15 -5.523 9.939 -9.206 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.346 11.402 -9.191 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.937 10.859 -10.749 1.00 0.00 H new ATOM 0 HG SER A 15 -9.220 10.048 -8.992 1.00 0.00 H new ATOM 181 N VAL A 16 -5.413 7.591 -9.998 1.00 0.00 N ATOM 182 CA VAL A 16 -5.455 6.171 -10.302 1.00 0.00 C ATOM 183 C VAL A 16 -6.601 5.520 -9.526 1.00 0.00 C ATOM 184 O VAL A 16 -7.245 6.169 -8.703 1.00 0.00 O ATOM 185 CB VAL A 16 -4.096 5.532 -10.008 1.00 0.00 C ATOM 186 CG1 VAL A 16 -3.007 6.123 -10.906 1.00 0.00 C ATOM 187 CG2 VAL A 16 -3.728 5.682 -8.530 1.00 0.00 C ATOM 0 H VAL A 16 -4.668 7.868 -9.358 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.651 6.014 -11.363 1.00 0.00 H new ATOM 0 HB VAL A 16 -4.172 4.467 -10.228 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -2.051 5.652 -10.677 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -3.259 5.942 -11.951 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -2.934 7.196 -10.731 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.758 5.219 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.680 6.740 -8.273 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.484 5.193 -7.915 1.00 0.00 H new ATOM 197 N GLU A 17 -6.822 4.246 -9.815 1.00 0.00 N ATOM 198 CA GLU A 17 -7.880 3.501 -9.154 1.00 0.00 C ATOM 199 C GLU A 17 -7.353 2.859 -7.869 1.00 0.00 C ATOM 200 O GLU A 17 -6.149 2.860 -7.618 1.00 0.00 O ATOM 201 CB GLU A 17 -8.475 2.447 -10.090 1.00 0.00 C ATOM 202 CG GLU A 17 -7.432 1.388 -10.456 1.00 0.00 C ATOM 203 CD GLU A 17 -8.102 0.127 -11.006 1.00 0.00 C ATOM 204 OE1 GLU A 17 -9.219 -0.175 -10.533 1.00 0.00 O ATOM 205 OE2 GLU A 17 -7.482 -0.507 -11.887 1.00 0.00 O ATOM 0 H GLU A 17 -6.286 3.711 -10.498 1.00 0.00 H new ATOM 0 HA GLU A 17 -8.677 4.196 -8.890 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.330 1.970 -9.610 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.845 2.927 -10.996 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -6.743 1.792 -11.198 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -6.840 1.136 -9.576 1.00 0.00 H new ATOM 212 N VAL A 18 -8.282 2.326 -7.088 1.00 0.00 N ATOM 213 CA VAL A 18 -7.927 1.682 -5.835 1.00 0.00 C ATOM 214 C VAL A 18 -8.703 0.371 -5.703 1.00 0.00 C ATOM 215 O VAL A 18 -9.897 0.320 -5.993 1.00 0.00 O ATOM 216 CB VAL A 18 -8.169 2.641 -4.667 1.00 0.00 C ATOM 217 CG1 VAL A 18 -8.167 1.891 -3.333 1.00 0.00 C ATOM 218 CG2 VAL A 18 -7.139 3.772 -4.663 1.00 0.00 C ATOM 0 H VAL A 18 -9.280 2.327 -7.299 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.866 1.434 -5.820 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.155 3.088 -4.799 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.341 2.595 -2.519 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -8.956 1.139 -3.337 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -7.202 1.404 -3.191 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.334 4.439 -3.823 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.138 3.352 -4.568 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.210 4.332 -5.595 1.00 0.00 H new ATOM 228 N SER A 19 -7.993 -0.659 -5.265 1.00 0.00 N ATOM 229 CA SER A 19 -8.600 -1.967 -5.090 1.00 0.00 C ATOM 230 C SER A 19 -9.230 -2.070 -3.700 1.00 0.00 C ATOM 231 O SER A 19 -8.770 -1.430 -2.757 1.00 0.00 O ATOM 232 CB SER A 19 -7.572 -3.082 -5.291 1.00 0.00 C ATOM 233 OG SER A 19 -7.898 -3.915 -6.401 1.00 0.00 O ATOM 0 H SER A 19 -7.002 -0.613 -5.026 1.00 0.00 H new ATOM 0 HA SER A 19 -9.378 -2.087 -5.844 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.586 -2.643 -5.444 1.00 0.00 H new ATOM 0 HB3 SER A 19 -7.514 -3.689 -4.387 1.00 0.00 H new ATOM 0 HG SER A 19 -7.217 -4.613 -6.497 1.00 0.00 H new ATOM 239 N PRO A 20 -10.302 -2.903 -3.616 1.00 0.00 N ATOM 240 CA PRO A 20 -11.001 -3.099 -2.357 1.00 0.00 C ATOM 241 C PRO A 20 -10.190 -3.990 -1.413 1.00 0.00 C ATOM 242 O PRO A 20 -10.519 -4.112 -0.234 1.00 0.00 O ATOM 243 CB PRO A 20 -12.341 -3.704 -2.740 1.00 0.00 C ATOM 244 CG PRO A 20 -12.163 -4.254 -4.146 1.00 0.00 C ATOM 245 CD PRO A 20 -10.876 -3.678 -4.713 1.00 0.00 C ATOM 0 HA PRO A 20 -11.143 -2.170 -1.806 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -12.626 -4.494 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -13.131 -2.954 -2.711 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -12.118 -5.343 -4.127 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -13.012 -3.981 -4.773 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.198 -4.467 -5.037 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.072 -3.049 -5.582 1.00 0.00 H new ATOM 253 N ASP A 21 -9.147 -4.589 -1.967 1.00 0.00 N ATOM 254 CA ASP A 21 -8.287 -5.465 -1.189 1.00 0.00 C ATOM 255 C ASP A 21 -6.955 -4.761 -0.924 1.00 0.00 C ATOM 256 O ASP A 21 -5.989 -5.393 -0.499 1.00 0.00 O ATOM 257 CB ASP A 21 -7.994 -6.762 -1.946 1.00 0.00 C ATOM 258 CG ASP A 21 -9.202 -7.392 -2.642 1.00 0.00 C ATOM 259 OD1 ASP A 21 -10.331 -6.973 -2.309 1.00 0.00 O ATOM 260 OD2 ASP A 21 -8.969 -8.279 -3.491 1.00 0.00 O ATOM 0 H ASP A 21 -8.877 -4.485 -2.945 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.799 -5.699 -0.256 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.226 -6.563 -2.694 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.578 -7.487 -1.247 1.00 0.00 H new ATOM 265 N ILE A 22 -6.946 -3.462 -1.187 1.00 0.00 N ATOM 266 CA ILE A 22 -5.748 -2.666 -0.982 1.00 0.00 C ATOM 267 C ILE A 22 -5.138 -3.010 0.379 1.00 0.00 C ATOM 268 O ILE A 22 -3.918 -3.013 0.533 1.00 0.00 O ATOM 269 CB ILE A 22 -6.058 -1.178 -1.158 1.00 0.00 C ATOM 270 CG1 ILE A 22 -4.848 -0.318 -0.785 1.00 0.00 C ATOM 271 CG2 ILE A 22 -7.308 -0.781 -0.370 1.00 0.00 C ATOM 272 CD1 ILE A 22 -3.951 -0.077 -2.001 1.00 0.00 C ATOM 0 H ILE A 22 -7.749 -2.941 -1.540 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.999 -2.904 -1.737 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.270 -0.996 -2.211 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.186 0.637 -0.383 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.276 -0.810 0.002 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.506 0.281 -0.512 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.161 -1.360 -0.725 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.149 -0.982 0.690 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.099 0.537 -1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -3.595 -1.033 -2.386 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.519 0.437 -2.776 1.00 0.00 H new ATOM 284 N TYR A 23 -6.016 -3.293 1.330 1.00 0.00 N ATOM 285 CA TYR A 23 -5.579 -3.638 2.672 1.00 0.00 C ATOM 286 C TYR A 23 -4.756 -4.927 2.667 1.00 0.00 C ATOM 287 O TYR A 23 -3.596 -4.930 3.078 1.00 0.00 O ATOM 288 CB TYR A 23 -6.855 -3.865 3.486 1.00 0.00 C ATOM 289 CG TYR A 23 -7.922 -2.787 3.283 1.00 0.00 C ATOM 290 CD1 TYR A 23 -7.858 -1.610 4.001 1.00 0.00 C ATOM 291 CD2 TYR A 23 -8.948 -2.992 2.384 1.00 0.00 C ATOM 292 CE1 TYR A 23 -8.863 -0.596 3.810 1.00 0.00 C ATOM 293 CE2 TYR A 23 -9.952 -1.978 2.193 1.00 0.00 C ATOM 294 CZ TYR A 23 -9.860 -0.830 2.916 1.00 0.00 C ATOM 295 OH TYR A 23 -10.808 0.128 2.736 1.00 0.00 O ATOM 0 H TYR A 23 -7.027 -3.290 1.198 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.953 -2.847 3.086 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.277 -4.834 3.219 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -6.596 -3.911 4.544 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.055 -1.449 4.705 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.998 -3.914 1.823 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.825 0.330 4.365 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.760 -2.126 1.492 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.376 1.002 2.639 1.00 0.00 H new ATOM 305 N GLN A 24 -5.388 -5.993 2.196 1.00 0.00 N ATOM 306 CA GLN A 24 -4.728 -7.286 2.131 1.00 0.00 C ATOM 307 C GLN A 24 -3.418 -7.175 1.348 1.00 0.00 C ATOM 308 O GLN A 24 -2.411 -7.768 1.731 1.00 0.00 O ATOM 309 CB GLN A 24 -5.648 -8.340 1.513 1.00 0.00 C ATOM 310 CG GLN A 24 -5.107 -9.751 1.756 1.00 0.00 C ATOM 311 CD GLN A 24 -3.840 -10.000 0.935 1.00 0.00 C ATOM 312 OE1 GLN A 24 -3.769 -9.710 -0.248 1.00 0.00 O ATOM 313 NE2 GLN A 24 -2.848 -10.554 1.626 1.00 0.00 N ATOM 0 H GLN A 24 -6.350 -5.987 1.856 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.495 -7.605 3.147 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.647 -8.251 1.940 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.742 -8.162 0.442 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -4.890 -9.884 2.816 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.867 -10.486 1.491 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -2.974 -10.771 2.615 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -1.961 -10.761 1.167 1.00 0.00 H new ATOM 322 N GLN A 25 -3.475 -6.411 0.267 1.00 0.00 N ATOM 323 CA GLN A 25 -2.305 -6.215 -0.572 1.00 0.00 C ATOM 324 C GLN A 25 -1.114 -5.760 0.274 1.00 0.00 C ATOM 325 O GLN A 25 -0.049 -6.374 0.234 1.00 0.00 O ATOM 326 CB GLN A 25 -2.596 -5.214 -1.692 1.00 0.00 C ATOM 327 CG GLN A 25 -3.570 -5.803 -2.714 1.00 0.00 C ATOM 328 CD GLN A 25 -3.876 -4.794 -3.824 1.00 0.00 C ATOM 329 OE1 GLN A 25 -3.033 -4.019 -4.243 1.00 0.00 O ATOM 330 NE2 GLN A 25 -5.127 -4.848 -4.274 1.00 0.00 N ATOM 0 H GLN A 25 -4.312 -5.921 -0.047 1.00 0.00 H new ATOM 0 HA GLN A 25 -2.052 -7.168 -1.037 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -3.015 -4.301 -1.269 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.666 -4.937 -2.188 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.145 -6.708 -3.147 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.495 -6.092 -2.215 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -5.783 -5.522 -3.879 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -5.430 -4.215 -5.014 1.00 0.00 H new ATOM 339 N VAL A 26 -1.335 -4.688 1.020 1.00 0.00 N ATOM 340 CA VAL A 26 -0.293 -4.144 1.875 1.00 0.00 C ATOM 341 C VAL A 26 0.331 -5.275 2.695 1.00 0.00 C ATOM 342 O VAL A 26 1.506 -5.596 2.523 1.00 0.00 O ATOM 343 CB VAL A 26 -0.862 -3.020 2.743 1.00 0.00 C ATOM 344 CG1 VAL A 26 0.215 -2.436 3.660 1.00 0.00 C ATOM 345 CG2 VAL A 26 -1.498 -1.929 1.880 1.00 0.00 C ATOM 0 H VAL A 26 -2.220 -4.181 1.050 1.00 0.00 H new ATOM 0 HA VAL A 26 0.502 -3.702 1.274 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.643 -3.446 3.373 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.216 -1.639 4.266 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.601 -3.219 4.312 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.028 -2.033 3.056 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -1.895 -1.142 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.746 -1.508 1.213 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -2.308 -2.358 1.289 1.00 0.00 H new ATOM 355 N ARG A 27 -0.484 -5.848 3.568 1.00 0.00 N ATOM 356 CA ARG A 27 -0.027 -6.937 4.415 1.00 0.00 C ATOM 357 C ARG A 27 0.846 -7.904 3.612 1.00 0.00 C ATOM 358 O ARG A 27 1.965 -8.216 4.015 1.00 0.00 O ATOM 359 CB ARG A 27 -1.208 -7.704 5.013 1.00 0.00 C ATOM 360 CG ARG A 27 -2.048 -6.799 5.917 1.00 0.00 C ATOM 361 CD ARG A 27 -3.537 -7.129 5.792 1.00 0.00 C ATOM 362 NE ARG A 27 -4.040 -7.689 7.066 1.00 0.00 N ATOM 363 CZ ARG A 27 -3.752 -8.920 7.511 1.00 0.00 C ATOM 364 NH1 ARG A 27 -2.963 -9.727 6.787 1.00 0.00 N ATOM 365 NH2 ARG A 27 -4.253 -9.345 8.679 1.00 0.00 N ATOM 0 H ARG A 27 -1.458 -5.579 3.707 1.00 0.00 H new ATOM 0 HA ARG A 27 0.557 -6.502 5.226 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.830 -8.103 4.212 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.841 -8.556 5.585 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -1.731 -6.919 6.953 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -1.879 -5.756 5.651 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -4.097 -6.230 5.534 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.693 -7.844 4.984 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.644 -7.102 7.641 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -2.582 -9.404 5.898 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -2.744 -10.664 7.126 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -4.854 -8.732 9.230 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -4.034 -10.282 9.017 1.00 0.00 H new ATOM 379 N ASP A 28 0.301 -8.351 2.490 1.00 0.00 N ATOM 380 CA ASP A 28 1.015 -9.275 1.627 1.00 0.00 C ATOM 381 C ASP A 28 2.332 -8.636 1.182 1.00 0.00 C ATOM 382 O ASP A 28 3.374 -9.290 1.180 1.00 0.00 O ATOM 383 CB ASP A 28 0.200 -9.601 0.374 1.00 0.00 C ATOM 384 CG ASP A 28 0.094 -11.090 0.041 1.00 0.00 C ATOM 385 OD1 ASP A 28 -0.327 -11.845 0.944 1.00 0.00 O ATOM 386 OD2 ASP A 28 0.436 -11.440 -1.109 1.00 0.00 O ATOM 0 H ASP A 28 -0.628 -8.090 2.159 1.00 0.00 H new ATOM 0 HA ASP A 28 1.193 -10.192 2.189 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -0.806 -9.199 0.498 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.646 -9.085 -0.476 1.00 0.00 H new ATOM 391 N GLU A 29 2.243 -7.366 0.816 1.00 0.00 N ATOM 392 CA GLU A 29 3.414 -6.632 0.369 1.00 0.00 C ATOM 393 C GLU A 29 4.479 -6.612 1.468 1.00 0.00 C ATOM 394 O GLU A 29 5.651 -6.877 1.207 1.00 0.00 O ATOM 395 CB GLU A 29 3.041 -5.211 -0.058 1.00 0.00 C ATOM 396 CG GLU A 29 4.178 -4.559 -0.847 1.00 0.00 C ATOM 397 CD GLU A 29 4.463 -5.330 -2.137 1.00 0.00 C ATOM 398 OE1 GLU A 29 3.818 -4.994 -3.153 1.00 0.00 O ATOM 399 OE2 GLU A 29 5.320 -6.238 -2.078 1.00 0.00 O ATOM 0 H GLU A 29 1.377 -6.826 0.820 1.00 0.00 H new ATOM 0 HA GLU A 29 3.827 -7.141 -0.502 1.00 0.00 H new ATOM 0 HB2 GLU A 29 2.138 -5.236 -0.668 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.814 -4.611 0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 29 3.915 -3.528 -1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.078 -4.525 -0.233 1.00 0.00 H new ATOM 406 N LEU A 30 4.032 -6.295 2.675 1.00 0.00 N ATOM 407 CA LEU A 30 4.931 -6.237 3.814 1.00 0.00 C ATOM 408 C LEU A 30 5.568 -7.612 4.026 1.00 0.00 C ATOM 409 O LEU A 30 6.778 -7.716 4.224 1.00 0.00 O ATOM 410 CB LEU A 30 4.201 -5.702 5.047 1.00 0.00 C ATOM 411 CG LEU A 30 3.406 -4.410 4.847 1.00 0.00 C ATOM 412 CD1 LEU A 30 2.465 -4.156 6.027 1.00 0.00 C ATOM 413 CD2 LEU A 30 4.340 -3.225 4.594 1.00 0.00 C ATOM 0 H LEU A 30 3.059 -6.076 2.888 1.00 0.00 H new ATOM 0 HA LEU A 30 5.742 -5.535 3.623 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.519 -6.473 5.404 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.935 -5.535 5.836 1.00 0.00 H new ATOM 0 HG LEU A 30 2.785 -4.526 3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.912 -3.232 5.859 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.765 -4.986 6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.047 -4.069 6.944 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.749 -2.319 4.455 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.005 -3.097 5.448 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.932 -3.413 3.698 1.00 0.00 H new ATOM 425 N LYS A 31 4.726 -8.633 3.977 1.00 0.00 N ATOM 426 CA LYS A 31 5.191 -9.997 4.161 1.00 0.00 C ATOM 427 C LYS A 31 6.087 -10.389 2.984 1.00 0.00 C ATOM 428 O LYS A 31 6.747 -11.427 3.020 1.00 0.00 O ATOM 429 CB LYS A 31 4.008 -10.943 4.375 1.00 0.00 C ATOM 430 CG LYS A 31 4.484 -12.319 4.846 1.00 0.00 C ATOM 431 CD LYS A 31 3.999 -13.420 3.901 1.00 0.00 C ATOM 432 CE LYS A 31 2.752 -14.110 4.457 1.00 0.00 C ATOM 433 NZ LYS A 31 3.083 -15.470 4.939 1.00 0.00 N ATOM 0 H LYS A 31 3.723 -8.543 3.812 1.00 0.00 H new ATOM 0 HA LYS A 31 5.797 -10.074 5.063 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.327 -10.518 5.112 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.448 -11.047 3.446 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.573 -12.333 4.898 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.114 -12.510 5.853 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.777 -12.993 2.923 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.791 -14.155 3.756 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.336 -13.520 5.274 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.986 -14.168 3.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.225 -15.924 5.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.459 -16.036 4.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.798 -15.407 5.692 1.00 0.00 H new ATOM 447 N ARG A 32 6.080 -9.539 1.968 1.00 0.00 N ATOM 448 CA ARG A 32 6.884 -9.783 0.783 1.00 0.00 C ATOM 449 C ARG A 32 8.261 -9.133 0.931 1.00 0.00 C ATOM 450 O ARG A 32 9.285 -9.792 0.754 1.00 0.00 O ATOM 451 CB ARG A 32 6.200 -9.231 -0.470 1.00 0.00 C ATOM 452 CG ARG A 32 6.260 -10.241 -1.618 1.00 0.00 C ATOM 453 CD ARG A 32 4.919 -10.958 -1.788 1.00 0.00 C ATOM 454 NE ARG A 32 5.135 -12.419 -1.878 1.00 0.00 N ATOM 455 CZ ARG A 32 5.616 -13.042 -2.963 1.00 0.00 C ATOM 456 NH1 ARG A 32 5.934 -12.335 -4.055 1.00 0.00 N ATOM 457 NH2 ARG A 32 5.778 -14.372 -2.955 1.00 0.00 N ATOM 0 H ARG A 32 5.530 -8.680 1.941 1.00 0.00 H new ATOM 0 HA ARG A 32 6.997 -10.862 0.677 1.00 0.00 H new ATOM 0 HB2 ARG A 32 5.161 -8.992 -0.246 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.683 -8.302 -0.773 1.00 0.00 H new ATOM 0 HG2 ARG A 32 6.523 -9.729 -2.544 1.00 0.00 H new ATOM 0 HG3 ARG A 32 7.045 -10.972 -1.424 1.00 0.00 H new ATOM 0 HD2 ARG A 32 4.266 -10.730 -0.946 1.00 0.00 H new ATOM 0 HD3 ARG A 32 4.417 -10.600 -2.687 1.00 0.00 H new ATOM 0 HE ARG A 32 4.903 -12.988 -1.063 1.00 0.00 H new ATOM 0 HH11 ARG A 32 5.810 -11.323 -4.061 1.00 0.00 H new ATOM 0 HH12 ARG A 32 6.300 -12.809 -4.881 1.00 0.00 H new ATOM 0 HH21 ARG A 32 5.535 -14.910 -2.123 1.00 0.00 H new ATOM 0 HH22 ARG A 32 6.144 -14.846 -3.781 1.00 0.00 H new ATOM 471 N ALA A 33 8.242 -7.849 1.256 1.00 0.00 N ATOM 472 CA ALA A 33 9.477 -7.103 1.430 1.00 0.00 C ATOM 473 C ALA A 33 9.956 -7.249 2.876 1.00 0.00 C ATOM 474 O ALA A 33 11.041 -6.785 3.224 1.00 0.00 O ATOM 475 CB ALA A 33 9.251 -5.642 1.036 1.00 0.00 C ATOM 0 H ALA A 33 7.391 -7.306 1.403 1.00 0.00 H new ATOM 0 HA ALA A 33 10.259 -7.498 0.782 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.177 -5.082 1.167 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.940 -5.590 -0.007 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.475 -5.211 1.668 1.00 0.00 H new ATOM 481 N SER A 34 9.124 -7.896 3.679 1.00 0.00 N ATOM 482 CA SER A 34 9.449 -8.109 5.079 1.00 0.00 C ATOM 483 C SER A 34 9.795 -6.776 5.745 1.00 0.00 C ATOM 484 O SER A 34 10.755 -6.690 6.508 1.00 0.00 O ATOM 485 CB SER A 34 10.609 -9.095 5.231 1.00 0.00 C ATOM 486 OG SER A 34 10.639 -9.688 6.527 1.00 0.00 O ATOM 0 H SER A 34 8.225 -8.280 3.387 1.00 0.00 H new ATOM 0 HA SER A 34 8.576 -8.538 5.571 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.522 -9.877 4.476 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.551 -8.578 5.047 1.00 0.00 H new ATOM 0 HG SER A 34 11.392 -10.312 6.584 1.00 0.00 H new ATOM 492 N VAL A 35 8.993 -5.769 5.432 1.00 0.00 N ATOM 493 CA VAL A 35 9.202 -4.444 5.990 1.00 0.00 C ATOM 494 C VAL A 35 8.130 -4.165 7.046 1.00 0.00 C ATOM 495 O VAL A 35 7.181 -4.933 7.190 1.00 0.00 O ATOM 496 CB VAL A 35 9.223 -3.401 4.870 1.00 0.00 C ATOM 497 CG1 VAL A 35 9.263 -4.073 3.496 1.00 0.00 C ATOM 498 CG2 VAL A 35 8.029 -2.452 4.982 1.00 0.00 C ATOM 0 H VAL A 35 8.197 -5.844 4.799 1.00 0.00 H new ATOM 0 HA VAL A 35 10.171 -4.388 6.487 1.00 0.00 H new ATOM 0 HB VAL A 35 10.132 -2.809 4.980 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.277 -3.310 2.718 1.00 0.00 H new ATOM 0 HG12 VAL A 35 10.160 -4.688 3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.381 -4.701 3.372 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.068 -1.721 4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.103 -3.022 4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.064 -1.935 5.941 1.00 0.00 H new ATOM 508 N SER A 36 8.319 -3.063 7.757 1.00 0.00 N ATOM 509 CA SER A 36 7.380 -2.673 8.796 1.00 0.00 C ATOM 510 C SER A 36 6.350 -1.694 8.229 1.00 0.00 C ATOM 511 O SER A 36 6.691 -0.821 7.432 1.00 0.00 O ATOM 512 CB SER A 36 8.106 -2.049 9.989 1.00 0.00 C ATOM 513 OG SER A 36 8.327 -2.993 11.033 1.00 0.00 O ATOM 0 H SER A 36 9.108 -2.428 7.634 1.00 0.00 H new ATOM 0 HA SER A 36 6.866 -3.568 9.147 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.062 -1.643 9.659 1.00 0.00 H new ATOM 0 HB3 SER A 36 7.520 -1.214 10.373 1.00 0.00 H new ATOM 0 HG SER A 36 8.794 -2.556 11.775 1.00 0.00 H new ATOM 519 N GLN A 37 5.111 -1.871 8.664 1.00 0.00 N ATOM 520 CA GLN A 37 4.029 -1.014 8.210 1.00 0.00 C ATOM 521 C GLN A 37 4.513 0.433 8.090 1.00 0.00 C ATOM 522 O GLN A 37 4.072 1.168 7.208 1.00 0.00 O ATOM 523 CB GLN A 37 2.822 -1.112 9.145 1.00 0.00 C ATOM 524 CG GLN A 37 1.840 -2.181 8.661 1.00 0.00 C ATOM 525 CD GLN A 37 0.696 -2.366 9.660 1.00 0.00 C ATOM 526 OE1 GLN A 37 0.298 -1.453 10.364 1.00 0.00 O ATOM 527 NE2 GLN A 37 0.191 -3.597 9.682 1.00 0.00 N ATOM 0 H GLN A 37 4.832 -2.595 9.326 1.00 0.00 H new ATOM 0 HA GLN A 37 3.712 -1.354 7.224 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.157 -1.351 10.154 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.318 -0.147 9.197 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.437 -1.896 7.689 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.365 -3.127 8.524 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.571 -4.315 9.066 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.576 -3.822 10.315 1.00 0.00 H new ATOM 536 N ALA A 38 5.414 0.798 8.990 1.00 0.00 N ATOM 537 CA ALA A 38 5.963 2.144 8.996 1.00 0.00 C ATOM 538 C ALA A 38 6.792 2.358 7.728 1.00 0.00 C ATOM 539 O ALA A 38 6.430 3.164 6.874 1.00 0.00 O ATOM 540 CB ALA A 38 6.782 2.355 10.271 1.00 0.00 C ATOM 0 H ALA A 38 5.778 0.186 9.720 1.00 0.00 H new ATOM 0 HA ALA A 38 5.163 2.885 8.995 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.194 3.364 10.276 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.141 2.221 11.142 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.596 1.631 10.305 1.00 0.00 H new ATOM 546 N VAL A 39 7.890 1.621 7.647 1.00 0.00 N ATOM 547 CA VAL A 39 8.774 1.719 6.497 1.00 0.00 C ATOM 548 C VAL A 39 7.936 1.842 5.224 1.00 0.00 C ATOM 549 O VAL A 39 8.189 2.712 4.391 1.00 0.00 O ATOM 550 CB VAL A 39 9.732 0.527 6.470 1.00 0.00 C ATOM 551 CG1 VAL A 39 10.262 0.282 5.055 1.00 0.00 C ATOM 552 CG2 VAL A 39 10.882 0.724 7.460 1.00 0.00 C ATOM 0 H VAL A 39 8.188 0.954 8.358 1.00 0.00 H new ATOM 0 HA VAL A 39 9.393 2.614 6.566 1.00 0.00 H new ATOM 0 HB VAL A 39 9.174 -0.358 6.777 1.00 0.00 H new ATOM 0 HG11 VAL A 39 10.941 -0.571 5.063 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.428 0.075 4.385 1.00 0.00 H new ATOM 0 HG13 VAL A 39 10.795 1.167 4.708 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.548 -0.138 7.420 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.438 1.624 7.198 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.481 0.826 8.468 1.00 0.00 H new ATOM 562 N PHE A 40 6.955 0.959 5.112 1.00 0.00 N ATOM 563 CA PHE A 40 6.078 0.958 3.953 1.00 0.00 C ATOM 564 C PHE A 40 5.223 2.226 3.911 1.00 0.00 C ATOM 565 O PHE A 40 5.323 3.015 2.973 1.00 0.00 O ATOM 566 CB PHE A 40 5.158 -0.258 4.090 1.00 0.00 C ATOM 567 CG PHE A 40 4.075 -0.343 3.012 1.00 0.00 C ATOM 568 CD1 PHE A 40 2.938 0.393 3.132 1.00 0.00 C ATOM 569 CD2 PHE A 40 4.251 -1.154 1.934 1.00 0.00 C ATOM 570 CE1 PHE A 40 1.933 0.313 2.131 1.00 0.00 C ATOM 571 CE2 PHE A 40 3.246 -1.233 0.934 1.00 0.00 C ATOM 572 CZ PHE A 40 2.108 -0.498 1.054 1.00 0.00 C ATOM 0 H PHE A 40 6.748 0.239 5.804 1.00 0.00 H new ATOM 0 HA PHE A 40 6.670 0.921 3.039 1.00 0.00 H new ATOM 0 HB2 PHE A 40 5.763 -1.164 4.055 1.00 0.00 H new ATOM 0 HB3 PHE A 40 4.680 -0.231 5.069 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.799 1.038 3.987 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.155 -1.738 1.839 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.029 0.897 2.226 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.385 -1.877 0.078 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.343 -0.559 0.294 1.00 0.00 H new ATOM 582 N ALA A 41 4.403 2.383 4.939 1.00 0.00 N ATOM 583 CA ALA A 41 3.532 3.543 5.032 1.00 0.00 C ATOM 584 C ALA A 41 4.326 4.802 4.678 1.00 0.00 C ATOM 585 O ALA A 41 3.757 5.790 4.217 1.00 0.00 O ATOM 586 CB ALA A 41 2.921 3.613 6.433 1.00 0.00 C ATOM 0 H ALA A 41 4.323 1.726 5.715 1.00 0.00 H new ATOM 0 HA ALA A 41 2.709 3.462 4.322 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.268 4.483 6.502 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.342 2.709 6.623 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.717 3.697 7.173 1.00 0.00 H new ATOM 592 N ARG A 42 5.629 4.725 4.908 1.00 0.00 N ATOM 593 CA ARG A 42 6.507 5.845 4.620 1.00 0.00 C ATOM 594 C ARG A 42 6.794 5.923 3.119 1.00 0.00 C ATOM 595 O ARG A 42 6.814 7.009 2.542 1.00 0.00 O ATOM 596 CB ARG A 42 7.829 5.719 5.379 1.00 0.00 C ATOM 597 CG ARG A 42 8.697 6.963 5.181 1.00 0.00 C ATOM 598 CD ARG A 42 7.946 8.227 5.606 1.00 0.00 C ATOM 599 NE ARG A 42 8.793 9.040 6.508 1.00 0.00 N ATOM 600 CZ ARG A 42 8.881 8.846 7.831 1.00 0.00 C ATOM 601 NH1 ARG A 42 8.176 7.867 8.414 1.00 0.00 N ATOM 602 NH2 ARG A 42 9.675 9.632 8.571 1.00 0.00 N ATOM 0 H ARG A 42 6.097 3.904 5.291 1.00 0.00 H new ATOM 0 HA ARG A 42 6.001 6.754 4.944 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.630 5.576 6.441 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.368 4.837 5.034 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.614 6.868 5.762 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.990 7.044 4.134 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.672 8.810 4.727 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.018 7.957 6.110 1.00 0.00 H new ATOM 0 HE ARG A 42 9.343 9.794 6.097 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.572 7.269 7.851 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.244 7.720 9.421 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.212 10.377 8.127 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.743 9.485 9.578 1.00 0.00 H new ATOM 616 N VAL A 43 7.007 4.756 2.529 1.00 0.00 N ATOM 617 CA VAL A 43 7.292 4.678 1.106 1.00 0.00 C ATOM 618 C VAL A 43 5.997 4.381 0.347 1.00 0.00 C ATOM 619 O VAL A 43 6.023 4.127 -0.856 1.00 0.00 O ATOM 620 CB VAL A 43 8.388 3.642 0.848 1.00 0.00 C ATOM 621 CG1 VAL A 43 9.602 3.893 1.744 1.00 0.00 C ATOM 622 CG2 VAL A 43 7.853 2.221 1.033 1.00 0.00 C ATOM 0 H VAL A 43 6.988 3.857 3.010 1.00 0.00 H new ATOM 0 HA VAL A 43 7.672 5.631 0.739 1.00 0.00 H new ATOM 0 HB VAL A 43 8.710 3.746 -0.188 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.366 3.143 1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.005 4.885 1.541 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.302 3.830 2.790 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.652 1.504 0.844 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.490 2.099 2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.035 2.046 0.334 1.00 0.00 H new ATOM 632 N ALA A 44 4.895 4.422 1.082 1.00 0.00 N ATOM 633 CA ALA A 44 3.593 4.160 0.493 1.00 0.00 C ATOM 634 C ALA A 44 2.860 5.486 0.276 1.00 0.00 C ATOM 635 O ALA A 44 2.467 5.805 -0.845 1.00 0.00 O ATOM 636 CB ALA A 44 2.810 3.201 1.391 1.00 0.00 C ATOM 0 H ALA A 44 4.877 4.633 2.080 1.00 0.00 H new ATOM 0 HA ALA A 44 3.701 3.680 -0.480 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.833 3.004 0.949 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.359 2.264 1.489 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.679 3.650 2.376 1.00 0.00 H new ATOM 642 N PHE A 45 2.700 6.222 1.366 1.00 0.00 N ATOM 643 CA PHE A 45 2.021 7.505 1.309 1.00 0.00 C ATOM 644 C PHE A 45 2.618 8.486 2.320 1.00 0.00 C ATOM 645 O PHE A 45 1.963 9.449 2.717 1.00 0.00 O ATOM 646 CB PHE A 45 0.555 7.252 1.665 1.00 0.00 C ATOM 647 CG PHE A 45 0.347 6.135 2.689 1.00 0.00 C ATOM 648 CD1 PHE A 45 0.566 4.840 2.336 1.00 0.00 C ATOM 649 CD2 PHE A 45 -0.057 6.437 3.952 1.00 0.00 C ATOM 650 CE1 PHE A 45 0.373 3.803 3.286 1.00 0.00 C ATOM 651 CE2 PHE A 45 -0.250 5.400 4.902 1.00 0.00 C ATOM 652 CZ PHE A 45 -0.031 4.104 4.550 1.00 0.00 C ATOM 0 H PHE A 45 3.029 5.954 2.294 1.00 0.00 H new ATOM 0 HA PHE A 45 2.128 7.939 0.315 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.122 8.173 2.055 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.009 7.003 0.755 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.887 4.601 1.333 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.231 7.465 4.232 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.547 2.775 3.005 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.571 5.640 5.905 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.178 3.315 5.273 1.00 0.00 H new ATOM 662 N ASN A 46 3.853 8.207 2.709 1.00 0.00 N ATOM 663 CA ASN A 46 4.545 9.053 3.667 1.00 0.00 C ATOM 664 C ASN A 46 3.753 9.088 4.975 1.00 0.00 C ATOM 665 O ASN A 46 3.252 10.138 5.374 1.00 0.00 O ATOM 666 CB ASN A 46 4.666 10.487 3.149 1.00 0.00 C ATOM 667 CG ASN A 46 5.733 11.262 3.925 1.00 0.00 C ATOM 668 OD1 ASN A 46 6.052 10.960 5.063 1.00 0.00 O ATOM 669 ND2 ASN A 46 6.265 12.276 3.247 1.00 0.00 N ATOM 0 H ASN A 46 4.393 7.407 2.378 1.00 0.00 H new ATOM 0 HA ASN A 46 5.542 8.641 3.822 1.00 0.00 H new ATOM 0 HB2 ASN A 46 4.919 10.474 2.089 1.00 0.00 H new ATOM 0 HB3 ASN A 46 3.705 10.993 3.241 1.00 0.00 H new ATOM 0 HD21 ASN A 46 6.986 12.855 3.678 1.00 0.00 H new ATOM 0 HD22 ASN A 46 5.952 12.474 2.297 1.00 0.00 H new ATOM 676 N ARG A 47 3.664 7.927 5.608 1.00 0.00 N ATOM 677 CA ARG A 47 2.941 7.812 6.863 1.00 0.00 C ATOM 678 C ARG A 47 3.657 6.838 7.801 1.00 0.00 C ATOM 679 O ARG A 47 4.613 6.176 7.401 1.00 0.00 O ATOM 680 CB ARG A 47 1.509 7.326 6.631 1.00 0.00 C ATOM 681 CG ARG A 47 0.537 8.505 6.549 1.00 0.00 C ATOM 682 CD ARG A 47 0.343 9.153 7.921 1.00 0.00 C ATOM 683 NE ARG A 47 -0.479 10.377 7.791 1.00 0.00 N ATOM 684 CZ ARG A 47 -0.001 11.566 7.401 1.00 0.00 C ATOM 685 NH1 ARG A 47 1.298 11.699 7.100 1.00 0.00 N ATOM 686 NH2 ARG A 47 -0.821 12.622 7.312 1.00 0.00 N ATOM 0 H ARG A 47 4.081 7.058 5.275 1.00 0.00 H new ATOM 0 HA ARG A 47 2.908 8.802 7.318 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.463 6.747 5.709 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.211 6.660 7.441 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.916 9.245 5.844 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.424 8.162 6.166 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -0.141 8.450 8.599 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.311 9.400 8.356 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.472 10.311 8.012 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.922 10.895 7.168 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.663 12.604 6.803 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.810 12.521 7.541 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.456 13.527 7.015 1.00 0.00 H new ATOM 700 N THR A 48 3.167 6.782 9.030 1.00 0.00 N ATOM 701 CA THR A 48 3.748 5.900 10.028 1.00 0.00 C ATOM 702 C THR A 48 2.973 4.582 10.091 1.00 0.00 C ATOM 703 O THR A 48 2.021 4.381 9.339 1.00 0.00 O ATOM 704 CB THR A 48 3.780 6.650 11.361 1.00 0.00 C ATOM 705 OG1 THR A 48 2.442 7.106 11.535 1.00 0.00 O ATOM 706 CG2 THR A 48 4.606 7.937 11.289 1.00 0.00 C ATOM 0 H THR A 48 2.374 7.333 9.358 1.00 0.00 H new ATOM 0 HA THR A 48 4.771 5.627 9.767 1.00 0.00 H new ATOM 0 HB THR A 48 4.189 5.999 12.134 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.372 7.602 12.377 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.596 8.431 12.261 1.00 0.00 H new ATOM 0 HG22 THR A 48 5.633 7.695 11.015 1.00 0.00 H new ATOM 0 HG23 THR A 48 4.178 8.603 10.540 1.00 0.00 H new ATOM 714 N GLN A 49 3.410 3.719 10.996 1.00 0.00 N ATOM 715 CA GLN A 49 2.770 2.426 11.167 1.00 0.00 C ATOM 716 C GLN A 49 1.476 2.577 11.970 1.00 0.00 C ATOM 717 O GLN A 49 0.414 2.138 11.532 1.00 0.00 O ATOM 718 CB GLN A 49 3.717 1.429 11.837 1.00 0.00 C ATOM 719 CG GLN A 49 2.944 0.243 12.419 1.00 0.00 C ATOM 720 CD GLN A 49 3.893 -0.758 13.081 1.00 0.00 C ATOM 721 OE1 GLN A 49 4.810 -0.401 13.801 1.00 0.00 O ATOM 722 NE2 GLN A 49 3.622 -2.029 12.797 1.00 0.00 N ATOM 0 H GLN A 49 4.200 3.890 11.619 1.00 0.00 H new ATOM 0 HA GLN A 49 2.520 2.033 10.181 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.447 1.071 11.111 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.275 1.928 12.629 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.219 0.600 13.150 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.381 -0.252 11.628 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.838 -2.259 12.186 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.198 -2.773 13.190 1.00 0.00 H new ATOM 731 N GLY A 50 1.608 3.199 13.133 1.00 0.00 N ATOM 732 CA GLY A 50 0.462 3.413 14.001 1.00 0.00 C ATOM 733 C GLY A 50 -0.771 3.818 13.191 1.00 0.00 C ATOM 734 O GLY A 50 -1.899 3.510 13.575 1.00 0.00 O ATOM 0 H GLY A 50 2.490 3.561 13.494 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.250 2.502 14.561 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.694 4.189 14.730 1.00 0.00 H new ATOM 738 N LEU A 51 -0.516 4.502 12.086 1.00 0.00 N ATOM 739 CA LEU A 51 -1.591 4.952 11.219 1.00 0.00 C ATOM 740 C LEU A 51 -1.996 3.813 10.282 1.00 0.00 C ATOM 741 O LEU A 51 -3.134 3.347 10.320 1.00 0.00 O ATOM 742 CB LEU A 51 -1.190 6.236 10.489 1.00 0.00 C ATOM 743 CG LEU A 51 -2.130 6.695 9.373 1.00 0.00 C ATOM 744 CD1 LEU A 51 -1.791 6.002 8.051 1.00 0.00 C ATOM 745 CD2 LEU A 51 -3.593 6.488 9.769 1.00 0.00 C ATOM 0 H LEU A 51 0.420 4.756 11.771 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.472 5.209 11.807 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.111 7.038 11.223 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.196 6.094 10.064 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.985 7.765 9.223 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.474 6.346 7.274 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.767 6.243 7.766 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.890 4.923 8.170 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.240 6.822 8.958 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.771 5.430 9.963 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.811 7.064 10.668 1.00 0.00 H new ATOM 757 N LEU A 52 -1.042 3.396 9.462 1.00 0.00 N ATOM 758 CA LEU A 52 -1.285 2.320 8.517 1.00 0.00 C ATOM 759 C LEU A 52 -2.001 1.172 9.231 1.00 0.00 C ATOM 760 O LEU A 52 -2.811 0.470 8.627 1.00 0.00 O ATOM 761 CB LEU A 52 0.019 1.902 7.834 1.00 0.00 C ATOM 762 CG LEU A 52 -0.031 0.600 7.032 1.00 0.00 C ATOM 763 CD1 LEU A 52 -1.122 0.658 5.961 1.00 0.00 C ATOM 764 CD2 LEU A 52 1.339 0.269 6.437 1.00 0.00 C ATOM 0 H LEU A 52 -0.099 3.784 9.433 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.943 2.657 7.716 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.330 2.705 7.166 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.791 1.806 8.597 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.290 -0.211 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.136 -0.280 5.405 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.091 0.813 6.436 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.917 1.482 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.275 -0.661 5.872 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.652 1.076 5.774 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.067 0.156 7.240 1.00 0.00 H new ATOM 776 N SER A 53 -1.677 1.017 10.506 1.00 0.00 N ATOM 777 CA SER A 53 -2.280 -0.034 11.309 1.00 0.00 C ATOM 778 C SER A 53 -3.788 0.197 11.427 1.00 0.00 C ATOM 779 O SER A 53 -4.583 -0.649 11.023 1.00 0.00 O ATOM 780 CB SER A 53 -1.642 -0.101 12.698 1.00 0.00 C ATOM 781 OG SER A 53 -1.374 -1.442 13.098 1.00 0.00 O ATOM 0 H SER A 53 -1.005 1.601 11.003 1.00 0.00 H new ATOM 0 HA SER A 53 -2.103 -0.988 10.812 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.713 0.470 12.698 1.00 0.00 H new ATOM 0 HB3 SER A 53 -2.305 0.368 13.425 1.00 0.00 H new ATOM 0 HG SER A 53 -0.816 -1.880 12.422 1.00 0.00 H new ATOM 787 N GLU A 54 -4.135 1.348 11.984 1.00 0.00 N ATOM 788 CA GLU A 54 -5.533 1.702 12.161 1.00 0.00 C ATOM 789 C GLU A 54 -6.291 1.547 10.841 1.00 0.00 C ATOM 790 O GLU A 54 -7.501 1.328 10.838 1.00 0.00 O ATOM 791 CB GLU A 54 -5.674 3.123 12.711 1.00 0.00 C ATOM 792 CG GLU A 54 -5.904 4.128 11.581 1.00 0.00 C ATOM 793 CD GLU A 54 -5.807 5.565 12.097 1.00 0.00 C ATOM 794 OE1 GLU A 54 -4.921 5.804 12.946 1.00 0.00 O ATOM 795 OE2 GLU A 54 -6.621 6.392 11.631 1.00 0.00 O ATOM 0 H GLU A 54 -3.472 2.047 12.319 1.00 0.00 H new ATOM 0 HA GLU A 54 -5.970 1.021 12.891 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.506 3.164 13.414 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -4.775 3.393 13.265 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.167 3.970 10.794 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.886 3.963 11.137 1.00 0.00 H new ATOM 802 N ILE A 55 -5.548 1.669 9.751 1.00 0.00 N ATOM 803 CA ILE A 55 -6.135 1.545 8.427 1.00 0.00 C ATOM 804 C ILE A 55 -6.372 0.066 8.116 1.00 0.00 C ATOM 805 O ILE A 55 -7.407 -0.296 7.558 1.00 0.00 O ATOM 806 CB ILE A 55 -5.269 2.261 7.389 1.00 0.00 C ATOM 807 CG1 ILE A 55 -5.158 3.754 7.703 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.792 2.011 5.973 1.00 0.00 C ATOM 809 CD1 ILE A 55 -4.155 4.438 6.771 1.00 0.00 C ATOM 0 H ILE A 55 -4.545 1.852 9.757 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.107 2.038 8.392 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.262 1.846 7.439 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.136 4.225 7.599 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.848 3.889 8.739 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.159 2.531 5.254 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.777 0.942 5.763 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.814 2.382 5.892 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.095 5.498 7.016 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.173 3.981 6.895 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -4.481 4.322 5.737 1.00 0.00 H new ATOM 821 N LEU A 56 -5.397 -0.749 8.489 1.00 0.00 N ATOM 822 CA LEU A 56 -5.487 -2.180 8.256 1.00 0.00 C ATOM 823 C LEU A 56 -6.449 -2.798 9.272 1.00 0.00 C ATOM 824 O LEU A 56 -6.883 -3.937 9.109 1.00 0.00 O ATOM 825 CB LEU A 56 -4.094 -2.813 8.265 1.00 0.00 C ATOM 826 CG LEU A 56 -3.101 -2.263 7.239 1.00 0.00 C ATOM 827 CD1 LEU A 56 -1.659 -2.484 7.698 1.00 0.00 C ATOM 828 CD2 LEU A 56 -3.358 -2.858 5.853 1.00 0.00 C ATOM 0 H LEU A 56 -4.540 -0.445 8.951 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.896 -2.380 7.266 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.666 -2.687 9.259 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.202 -3.885 8.098 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.253 -1.186 7.161 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.974 -2.084 6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.497 -1.975 8.648 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.476 -3.551 7.823 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.639 -2.450 5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.251 -3.942 5.897 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -4.368 -2.606 5.531 1.00 0.00 H new ATOM 840 N ARG A 57 -6.755 -2.019 10.300 1.00 0.00 N ATOM 841 CA ARG A 57 -7.658 -2.476 11.342 1.00 0.00 C ATOM 842 C ARG A 57 -9.091 -2.035 11.034 1.00 0.00 C ATOM 843 O ARG A 57 -10.026 -2.826 11.151 1.00 0.00 O ATOM 844 CB ARG A 57 -7.245 -1.925 12.709 1.00 0.00 C ATOM 845 CG ARG A 57 -6.007 -2.649 13.241 1.00 0.00 C ATOM 846 CD ARG A 57 -5.833 -2.409 14.742 1.00 0.00 C ATOM 847 NE ARG A 57 -4.513 -1.795 15.006 1.00 0.00 N ATOM 848 CZ ARG A 57 -3.935 -1.748 16.215 1.00 0.00 C ATOM 849 NH1 ARG A 57 -4.558 -2.278 17.276 1.00 0.00 N ATOM 850 NH2 ARG A 57 -2.735 -1.172 16.361 1.00 0.00 N ATOM 0 H ARG A 57 -6.393 -1.075 10.433 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.607 -3.564 11.371 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.040 -0.858 12.628 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.068 -2.038 13.414 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.096 -3.718 13.048 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.122 -2.302 12.709 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.626 -1.758 15.109 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -5.919 -3.352 15.282 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.012 -1.382 14.220 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.472 -2.717 17.164 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.119 -2.242 18.196 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.261 -0.769 15.553 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -2.295 -1.136 17.281 1.00 0.00 H new ATOM 864 N LYS A 58 -9.218 -0.774 10.647 1.00 0.00 N ATOM 865 CA LYS A 58 -10.520 -0.219 10.321 1.00 0.00 C ATOM 866 C LYS A 58 -10.866 -0.559 8.870 1.00 0.00 C ATOM 867 O LYS A 58 -12.018 -0.855 8.556 1.00 0.00 O ATOM 868 CB LYS A 58 -10.556 1.279 10.627 1.00 0.00 C ATOM 869 CG LYS A 58 -10.546 1.531 12.136 1.00 0.00 C ATOM 870 CD LYS A 58 -10.127 2.969 12.450 1.00 0.00 C ATOM 871 CE LYS A 58 -9.658 3.100 13.900 1.00 0.00 C ATOM 872 NZ LYS A 58 -10.614 3.915 14.683 1.00 0.00 N ATOM 0 H LYS A 58 -8.440 -0.121 10.552 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.292 -0.667 10.946 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -9.697 1.768 10.167 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.449 1.722 10.187 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.537 1.340 12.547 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -9.861 0.835 12.620 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.326 3.273 11.776 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.966 3.643 12.273 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.562 2.111 14.348 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.670 3.560 13.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.280 3.994 15.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.685 4.864 14.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.549 3.460 14.671 1.00 0.00 H new ATOM 886 N GLU A 59 -9.848 -0.505 8.024 1.00 0.00 N ATOM 887 CA GLU A 59 -10.030 -0.803 6.614 1.00 0.00 C ATOM 888 C GLU A 59 -11.142 0.068 6.026 1.00 0.00 C ATOM 889 O GLU A 59 -12.199 -0.438 5.651 1.00 0.00 O ATOM 890 CB GLU A 59 -10.327 -2.288 6.401 1.00 0.00 C ATOM 891 CG GLU A 59 -9.045 -3.121 6.484 1.00 0.00 C ATOM 892 CD GLU A 59 -9.149 -4.374 5.612 1.00 0.00 C ATOM 893 OE1 GLU A 59 -10.075 -4.407 4.774 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.298 -5.270 5.803 1.00 0.00 O ATOM 0 H GLU A 59 -8.894 -0.259 8.288 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.101 -0.573 6.092 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.038 -2.632 7.152 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.797 -2.433 5.428 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.195 -2.519 6.163 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.860 -3.408 7.519 1.00 0.00 H new ATOM 901 N GLU A 60 -10.867 1.363 5.965 1.00 0.00 N ATOM 902 CA GLU A 60 -11.831 2.309 5.429 1.00 0.00 C ATOM 903 C GLU A 60 -11.997 2.101 3.923 1.00 0.00 C ATOM 904 O GLU A 60 -11.125 2.475 3.141 1.00 0.00 O ATOM 905 CB GLU A 60 -11.419 3.748 5.743 1.00 0.00 C ATOM 906 CG GLU A 60 -11.687 4.089 7.210 1.00 0.00 C ATOM 907 CD GLU A 60 -11.643 2.832 8.081 1.00 0.00 C ATOM 908 OE1 GLU A 60 -10.527 2.291 8.240 1.00 0.00 O ATOM 909 OE2 GLU A 60 -12.725 2.440 8.569 1.00 0.00 O ATOM 0 H GLU A 60 -9.990 1.779 6.278 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.793 2.129 5.908 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.360 3.883 5.522 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -11.969 4.436 5.100 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -10.945 4.806 7.562 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.662 4.567 7.304 1.00 0.00 H new ATOM 916 N ASP A 61 -13.124 1.506 3.561 1.00 0.00 N ATOM 917 CA ASP A 61 -13.416 1.244 2.161 1.00 0.00 C ATOM 918 C ASP A 61 -13.052 2.476 1.330 1.00 0.00 C ATOM 919 O ASP A 61 -13.307 3.606 1.743 1.00 0.00 O ATOM 920 CB ASP A 61 -14.905 0.957 1.954 1.00 0.00 C ATOM 921 CG ASP A 61 -15.213 -0.301 1.140 1.00 0.00 C ATOM 922 OD1 ASP A 61 -14.294 -1.140 1.021 1.00 0.00 O ATOM 923 OD2 ASP A 61 -16.361 -0.396 0.655 1.00 0.00 O ATOM 0 H ASP A 61 -13.846 1.198 4.212 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.835 0.376 1.851 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -15.381 0.866 2.930 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.359 1.814 1.457 1.00 0.00 H new ATOM 928 N PRO A 62 -12.446 2.208 0.142 1.00 0.00 N ATOM 929 CA PRO A 62 -12.043 3.282 -0.751 1.00 0.00 C ATOM 930 C PRO A 62 -13.255 3.883 -1.465 1.00 0.00 C ATOM 931 O PRO A 62 -13.114 4.812 -2.260 1.00 0.00 O ATOM 932 CB PRO A 62 -11.046 2.646 -1.705 1.00 0.00 C ATOM 933 CG PRO A 62 -11.275 1.146 -1.610 1.00 0.00 C ATOM 934 CD PRO A 62 -12.127 0.883 -0.380 1.00 0.00 C ATOM 0 HA PRO A 62 -11.589 4.121 -0.224 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.200 3.001 -2.724 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.023 2.903 -1.429 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -11.775 0.778 -2.506 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.324 0.618 -1.536 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.031 0.330 -0.636 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.587 0.287 0.356 1.00 0.00 H new ATOM 942 N ARG A 63 -14.419 3.329 -1.157 1.00 0.00 N ATOM 943 CA ARG A 63 -15.654 3.799 -1.760 1.00 0.00 C ATOM 944 C ARG A 63 -16.268 4.915 -0.912 1.00 0.00 C ATOM 945 O ARG A 63 -16.874 5.843 -1.445 1.00 0.00 O ATOM 946 CB ARG A 63 -16.666 2.660 -1.902 1.00 0.00 C ATOM 947 CG ARG A 63 -16.103 1.531 -2.767 1.00 0.00 C ATOM 948 CD ARG A 63 -16.496 1.716 -4.234 1.00 0.00 C ATOM 949 NE ARG A 63 -16.677 0.397 -4.880 1.00 0.00 N ATOM 950 CZ ARG A 63 -17.067 0.230 -6.151 1.00 0.00 C ATOM 951 NH1 ARG A 63 -17.319 1.297 -6.920 1.00 0.00 N ATOM 952 NH2 ARG A 63 -17.204 -1.005 -6.653 1.00 0.00 N ATOM 0 H ARG A 63 -14.532 2.559 -0.498 1.00 0.00 H new ATOM 0 HA ARG A 63 -15.414 4.182 -2.752 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -16.924 2.273 -0.916 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -17.586 3.039 -2.347 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -15.017 1.507 -2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -16.474 0.572 -2.406 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -17.418 2.293 -4.302 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -15.726 2.283 -4.757 1.00 0.00 H new ATOM 0 HE ARG A 63 -16.493 -0.437 -4.323 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -17.214 2.237 -6.538 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -17.616 1.170 -7.888 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -17.011 -1.818 -6.068 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -17.501 -1.132 -7.621 1.00 0.00 H new ATOM 966 N THR A 64 -16.089 4.788 0.394 1.00 0.00 N ATOM 967 CA THR A 64 -16.617 5.774 1.322 1.00 0.00 C ATOM 968 C THR A 64 -15.476 6.518 2.017 1.00 0.00 C ATOM 969 O THR A 64 -15.675 7.606 2.555 1.00 0.00 O ATOM 970 CB THR A 64 -17.555 5.055 2.293 1.00 0.00 C ATOM 971 OG1 THR A 64 -16.679 4.302 3.128 1.00 0.00 O ATOM 972 CG2 THR A 64 -18.414 3.994 1.601 1.00 0.00 C ATOM 0 H THR A 64 -15.585 4.017 0.832 1.00 0.00 H new ATOM 0 HA THR A 64 -17.191 6.540 0.800 1.00 0.00 H new ATOM 0 HB THR A 64 -18.202 5.785 2.780 1.00 0.00 H new ATOM 0 HG1 THR A 64 -17.204 3.805 3.790 1.00 0.00 H new ATOM 0 HG21 THR A 64 -19.061 3.514 2.335 1.00 0.00 H new ATOM 0 HG22 THR A 64 -19.025 4.466 0.832 1.00 0.00 H new ATOM 0 HG23 THR A 64 -17.768 3.245 1.143 1.00 0.00 H new ATOM 980 N ALA A 65 -14.304 5.901 1.985 1.00 0.00 N ATOM 981 CA ALA A 65 -13.130 6.490 2.605 1.00 0.00 C ATOM 982 C ALA A 65 -13.079 7.983 2.275 1.00 0.00 C ATOM 983 O ALA A 65 -13.383 8.385 1.152 1.00 0.00 O ATOM 984 CB ALA A 65 -11.877 5.747 2.138 1.00 0.00 C ATOM 0 H ALA A 65 -14.143 4.998 1.539 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.180 6.393 3.690 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -10.997 6.190 2.604 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -11.949 4.697 2.423 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -11.791 5.824 1.054 1.00 0.00 H new ATOM 990 N SER A 66 -12.692 8.765 3.272 1.00 0.00 N ATOM 991 CA SER A 66 -12.597 10.205 3.101 1.00 0.00 C ATOM 992 C SER A 66 -11.388 10.550 2.229 1.00 0.00 C ATOM 993 O SER A 66 -10.422 9.791 2.173 1.00 0.00 O ATOM 994 CB SER A 66 -12.497 10.915 4.453 1.00 0.00 C ATOM 995 OG SER A 66 -13.732 11.514 4.834 1.00 0.00 O ATOM 0 H SER A 66 -12.440 8.429 4.201 1.00 0.00 H new ATOM 0 HA SER A 66 -13.504 10.551 2.606 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.190 10.200 5.216 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.723 11.681 4.404 1.00 0.00 H new ATOM 0 HG SER A 66 -13.627 11.955 5.703 1.00 0.00 H new ATOM 1001 N GLN A 67 -11.482 11.696 1.570 1.00 0.00 N ATOM 1002 CA GLN A 67 -10.408 12.151 0.704 1.00 0.00 C ATOM 1003 C GLN A 67 -9.054 11.959 1.391 1.00 0.00 C ATOM 1004 O GLN A 67 -8.133 11.391 0.808 1.00 0.00 O ATOM 1005 CB GLN A 67 -10.614 13.611 0.295 1.00 0.00 C ATOM 1006 CG GLN A 67 -10.987 13.719 -1.185 1.00 0.00 C ATOM 1007 CD GLN A 67 -11.226 15.176 -1.585 1.00 0.00 C ATOM 1008 OE1 GLN A 67 -10.321 15.993 -1.624 1.00 0.00 O ATOM 1009 NE2 GLN A 67 -12.493 15.455 -1.879 1.00 0.00 N ATOM 0 H GLN A 67 -12.285 12.323 1.619 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.421 11.549 -0.204 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -11.400 14.056 0.905 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -9.703 14.178 0.486 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -10.190 13.296 -1.796 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -11.884 13.132 -1.381 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -13.202 14.723 -1.826 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -12.756 16.400 -2.157 1.00 0.00 H new ATOM 1018 N SER A 68 -8.977 12.445 2.621 1.00 0.00 N ATOM 1019 CA SER A 68 -7.752 12.335 3.394 1.00 0.00 C ATOM 1020 C SER A 68 -7.204 10.909 3.306 1.00 0.00 C ATOM 1021 O SER A 68 -6.031 10.709 2.992 1.00 0.00 O ATOM 1022 CB SER A 68 -7.985 12.724 4.855 1.00 0.00 C ATOM 1023 OG SER A 68 -9.116 12.058 5.411 1.00 0.00 O ATOM 0 H SER A 68 -9.744 12.916 3.101 1.00 0.00 H new ATOM 0 HA SER A 68 -7.020 13.026 2.975 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.098 12.482 5.440 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.129 13.802 4.925 1.00 0.00 H new ATOM 0 HG SER A 68 -9.230 12.332 6.345 1.00 0.00 H new ATOM 1029 N LEU A 69 -8.079 9.954 3.587 1.00 0.00 N ATOM 1030 CA LEU A 69 -7.697 8.553 3.543 1.00 0.00 C ATOM 1031 C LEU A 69 -7.462 8.138 2.090 1.00 0.00 C ATOM 1032 O LEU A 69 -6.409 7.597 1.757 1.00 0.00 O ATOM 1033 CB LEU A 69 -8.734 7.692 4.268 1.00 0.00 C ATOM 1034 CG LEU A 69 -8.188 6.480 5.025 1.00 0.00 C ATOM 1035 CD1 LEU A 69 -9.199 5.977 6.058 1.00 0.00 C ATOM 1036 CD2 LEU A 69 -7.761 5.375 4.056 1.00 0.00 C ATOM 0 H LEU A 69 -9.051 10.123 3.846 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.759 8.397 4.075 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.272 8.324 4.974 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.461 7.341 3.536 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.298 6.792 5.571 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.786 5.115 6.582 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.411 6.770 6.775 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.121 5.687 5.554 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.377 4.525 4.620 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.620 5.059 3.463 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.982 5.753 3.394 1.00 0.00 H new ATOM 1048 N LEU A 70 -8.461 8.408 1.262 1.00 0.00 N ATOM 1049 CA LEU A 70 -8.376 8.069 -0.149 1.00 0.00 C ATOM 1050 C LEU A 70 -6.997 8.463 -0.681 1.00 0.00 C ATOM 1051 O LEU A 70 -6.360 7.691 -1.396 1.00 0.00 O ATOM 1052 CB LEU A 70 -9.537 8.700 -0.922 1.00 0.00 C ATOM 1053 CG LEU A 70 -10.708 7.771 -1.249 1.00 0.00 C ATOM 1054 CD1 LEU A 70 -11.897 8.561 -1.798 1.00 0.00 C ATOM 1055 CD2 LEU A 70 -10.273 6.654 -2.200 1.00 0.00 C ATOM 0 H LEU A 70 -9.333 8.857 1.541 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.477 6.993 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.917 9.542 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.148 9.105 -1.856 1.00 0.00 H new ATOM 0 HG LEU A 70 -11.036 7.296 -0.324 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -12.716 7.877 -2.022 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -12.225 9.288 -1.055 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -11.599 9.081 -2.708 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -11.124 6.008 -2.416 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.903 7.090 -3.128 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.481 6.067 -1.734 1.00 0.00 H new ATOM 1067 N VAL A 71 -6.576 9.664 -0.312 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.284 10.169 -0.743 1.00 0.00 C ATOM 1069 C VAL A 71 -4.208 9.119 -0.456 1.00 0.00 C ATOM 1070 O VAL A 71 -3.316 8.900 -1.273 1.00 0.00 O ATOM 1071 CB VAL A 71 -4.999 11.516 -0.075 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -3.493 11.770 0.025 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -5.699 12.655 -0.817 1.00 0.00 C ATOM 0 H VAL A 71 -7.107 10.302 0.281 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.284 10.348 -1.818 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.401 11.480 0.938 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.318 12.734 0.503 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.029 10.981 0.617 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.058 11.776 -0.974 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.480 13.601 -0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.341 12.693 -1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.776 12.484 -0.813 1.00 0.00 H new ATOM 1083 N ASN A 72 -4.329 8.499 0.709 1.00 0.00 N ATOM 1084 CA ASN A 72 -3.378 7.477 1.114 1.00 0.00 C ATOM 1085 C ASN A 72 -3.649 6.193 0.327 1.00 0.00 C ATOM 1086 O ASN A 72 -2.726 5.586 -0.213 1.00 0.00 O ATOM 1087 CB ASN A 72 -3.516 7.157 2.604 1.00 0.00 C ATOM 1088 CG ASN A 72 -3.688 8.436 3.426 1.00 0.00 C ATOM 1089 OD1 ASN A 72 -3.233 9.507 3.059 1.00 0.00 O ATOM 1090 ND2 ASN A 72 -4.369 8.265 4.556 1.00 0.00 N ATOM 0 H ASN A 72 -5.070 8.684 1.385 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.374 7.853 0.917 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -4.373 6.502 2.761 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.634 6.616 2.947 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -4.538 9.058 5.175 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.722 7.341 4.804 1.00 0.00 H new ATOM 1097 N LEU A 73 -4.919 5.818 0.288 1.00 0.00 N ATOM 1098 CA LEU A 73 -5.323 4.618 -0.423 1.00 0.00 C ATOM 1099 C LEU A 73 -4.852 4.708 -1.876 1.00 0.00 C ATOM 1100 O LEU A 73 -4.461 3.704 -2.470 1.00 0.00 O ATOM 1101 CB LEU A 73 -6.829 4.390 -0.278 1.00 0.00 C ATOM 1102 CG LEU A 73 -7.378 4.422 1.150 1.00 0.00 C ATOM 1103 CD1 LEU A 73 -8.899 4.261 1.156 1.00 0.00 C ATOM 1104 CD2 LEU A 73 -6.687 3.375 2.026 1.00 0.00 C ATOM 0 H LEU A 73 -5.682 6.325 0.738 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.848 3.739 0.013 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.349 5.148 -0.863 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -7.074 3.424 -0.719 1.00 0.00 H new ATOM 0 HG LEU A 73 -7.156 5.399 1.580 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.264 4.287 2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.353 5.074 0.589 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.166 3.307 0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -7.095 3.419 3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.856 2.382 1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.616 3.577 2.059 1.00 0.00 H new ATOM 1116 N ARG A 74 -4.906 5.921 -2.408 1.00 0.00 N ATOM 1117 CA ARG A 74 -4.489 6.156 -3.780 1.00 0.00 C ATOM 1118 C ARG A 74 -2.976 5.978 -3.913 1.00 0.00 C ATOM 1119 O ARG A 74 -2.502 5.340 -4.853 1.00 0.00 O ATOM 1120 CB ARG A 74 -4.873 7.564 -4.238 1.00 0.00 C ATOM 1121 CG ARG A 74 -6.315 7.601 -4.748 1.00 0.00 C ATOM 1122 CD ARG A 74 -6.832 9.039 -4.827 1.00 0.00 C ATOM 1123 NE ARG A 74 -8.109 9.078 -5.574 1.00 0.00 N ATOM 1124 CZ ARG A 74 -9.014 10.059 -5.465 1.00 0.00 C ATOM 1125 NH1 ARG A 74 -8.789 11.089 -4.637 1.00 0.00 N ATOM 1126 NH2 ARG A 74 -10.145 10.011 -6.182 1.00 0.00 N ATOM 0 H ARG A 74 -5.232 6.751 -1.913 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.000 5.429 -4.411 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.758 8.263 -3.410 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.196 7.891 -5.027 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.368 7.137 -5.733 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.954 7.017 -4.086 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -6.976 9.438 -3.823 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.094 9.673 -5.319 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.313 8.309 -6.212 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -7.929 11.125 -4.090 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.478 11.836 -4.554 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -10.317 9.227 -6.811 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.834 10.759 -6.098 1.00 0.00 H new ATOM 1140 N ALA A 75 -2.258 6.552 -2.959 1.00 0.00 N ATOM 1141 CA ALA A 75 -0.808 6.465 -2.958 1.00 0.00 C ATOM 1142 C ALA A 75 -0.389 4.999 -2.836 1.00 0.00 C ATOM 1143 O ALA A 75 0.349 4.488 -3.677 1.00 0.00 O ATOM 1144 CB ALA A 75 -0.245 7.328 -1.827 1.00 0.00 C ATOM 0 H ALA A 75 -2.654 7.079 -2.181 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.401 6.848 -3.894 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.843 7.263 -1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.546 8.365 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.630 6.972 -0.871 1.00 0.00 H new ATOM 1150 N MET A 76 -0.879 4.363 -1.782 1.00 0.00 N ATOM 1151 CA MET A 76 -0.565 2.965 -1.538 1.00 0.00 C ATOM 1152 C MET A 76 -0.693 2.143 -2.822 1.00 0.00 C ATOM 1153 O MET A 76 0.273 1.528 -3.269 1.00 0.00 O ATOM 1154 CB MET A 76 -1.514 2.406 -0.477 1.00 0.00 C ATOM 1155 CG MET A 76 -1.109 2.873 0.922 1.00 0.00 C ATOM 1156 SD MET A 76 -2.189 2.149 2.145 1.00 0.00 S ATOM 1157 CE MET A 76 -3.255 3.541 2.480 1.00 0.00 C ATOM 0 H MET A 76 -1.491 4.790 -1.087 1.00 0.00 H new ATOM 0 HA MET A 76 0.465 2.899 -1.187 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.533 2.727 -0.690 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.508 1.317 -0.516 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.076 2.590 1.124 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.158 3.960 0.980 1.00 0.00 H new ATOM 0 HE1 MET A 76 -3.984 3.266 3.242 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.657 4.380 2.836 1.00 0.00 H new ATOM 0 HE3 MET A 76 -3.776 3.829 1.567 1.00 0.00 H new ATOM 1167 N GLN A 77 -1.895 2.159 -3.380 1.00 0.00 N ATOM 1168 CA GLN A 77 -2.163 1.422 -4.603 1.00 0.00 C ATOM 1169 C GLN A 77 -1.179 1.838 -5.699 1.00 0.00 C ATOM 1170 O GLN A 77 -0.796 1.022 -6.536 1.00 0.00 O ATOM 1171 CB GLN A 77 -3.609 1.624 -5.060 1.00 0.00 C ATOM 1172 CG GLN A 77 -3.875 0.894 -6.378 1.00 0.00 C ATOM 1173 CD GLN A 77 -4.748 -0.342 -6.153 1.00 0.00 C ATOM 1174 OE1 GLN A 77 -5.792 -0.515 -6.760 1.00 0.00 O ATOM 1175 NE2 GLN A 77 -4.263 -1.190 -5.250 1.00 0.00 N ATOM 0 H GLN A 77 -2.694 2.671 -3.007 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.026 0.360 -4.401 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.291 1.257 -4.293 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.810 2.688 -5.183 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -4.367 1.569 -7.079 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.929 0.598 -6.831 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.382 -0.984 -4.778 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.772 -2.046 -5.029 1.00 0.00 H new ATOM 1184 N ASN A 78 -0.798 3.106 -5.657 1.00 0.00 N ATOM 1185 CA ASN A 78 0.135 3.640 -6.636 1.00 0.00 C ATOM 1186 C ASN A 78 1.536 3.100 -6.346 1.00 0.00 C ATOM 1187 O ASN A 78 2.327 2.890 -7.265 1.00 0.00 O ATOM 1188 CB ASN A 78 0.192 5.167 -6.566 1.00 0.00 C ATOM 1189 CG ASN A 78 -0.072 5.790 -7.938 1.00 0.00 C ATOM 1190 OD1 ASN A 78 0.082 5.163 -8.973 1.00 0.00 O ATOM 1191 ND2 ASN A 78 -0.478 7.055 -7.889 1.00 0.00 N ATOM 0 H ASN A 78 -1.118 3.779 -4.961 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.205 3.337 -7.626 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.546 5.529 -5.850 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.170 5.481 -6.202 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.681 7.559 -8.752 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.586 7.521 -6.988 1.00 0.00 H new ATOM 1198 N PHE A 79 1.802 2.891 -5.065 1.00 0.00 N ATOM 1199 CA PHE A 79 3.095 2.380 -4.643 1.00 0.00 C ATOM 1200 C PHE A 79 3.213 0.882 -4.931 1.00 0.00 C ATOM 1201 O PHE A 79 4.275 0.403 -5.326 1.00 0.00 O ATOM 1202 CB PHE A 79 3.194 2.606 -3.133 1.00 0.00 C ATOM 1203 CG PHE A 79 4.365 1.878 -2.470 1.00 0.00 C ATOM 1204 CD1 PHE A 79 5.633 2.344 -2.629 1.00 0.00 C ATOM 1205 CD2 PHE A 79 4.139 0.765 -1.722 1.00 0.00 C ATOM 1206 CE1 PHE A 79 6.720 1.669 -2.014 1.00 0.00 C ATOM 1207 CE2 PHE A 79 5.226 0.090 -1.107 1.00 0.00 C ATOM 1208 CZ PHE A 79 6.494 0.556 -1.266 1.00 0.00 C ATOM 0 H PHE A 79 1.144 3.066 -4.306 1.00 0.00 H new ATOM 0 HA PHE A 79 3.892 2.891 -5.184 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.289 3.675 -2.941 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.265 2.280 -2.665 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.813 3.228 -3.223 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.132 0.395 -1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.727 2.039 -2.140 1.00 0.00 H new ATOM 0 HE2 PHE A 79 5.046 -0.794 -0.513 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.321 0.042 -0.798 1.00 0.00 H new ATOM 1218 N LEU A 80 2.107 0.183 -4.721 1.00 0.00 N ATOM 1219 CA LEU A 80 2.072 -1.251 -4.953 1.00 0.00 C ATOM 1220 C LEU A 80 2.169 -1.523 -6.456 1.00 0.00 C ATOM 1221 O LEU A 80 2.448 -2.647 -6.870 1.00 0.00 O ATOM 1222 CB LEU A 80 0.839 -1.871 -4.294 1.00 0.00 C ATOM 1223 CG LEU A 80 0.735 -1.707 -2.776 1.00 0.00 C ATOM 1224 CD1 LEU A 80 -0.630 -2.175 -2.266 1.00 0.00 C ATOM 1225 CD2 LEU A 80 1.887 -2.421 -2.067 1.00 0.00 C ATOM 0 H LEU A 80 1.228 0.583 -4.393 1.00 0.00 H new ATOM 0 HA LEU A 80 2.930 -1.733 -4.485 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.050 -1.433 -4.748 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.824 -2.936 -4.526 1.00 0.00 H new ATOM 0 HG LEU A 80 0.820 -0.646 -2.541 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.678 -2.048 -1.184 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.416 -1.584 -2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.770 -3.227 -2.514 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.789 -2.289 -0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.858 -3.484 -2.306 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.836 -2.000 -2.399 1.00 0.00 H new ATOM 1237 N ASN A 81 1.932 -0.474 -7.231 1.00 0.00 N ATOM 1238 CA ASN A 81 1.989 -0.586 -8.678 1.00 0.00 C ATOM 1239 C ASN A 81 3.451 -0.596 -9.128 1.00 0.00 C ATOM 1240 O ASN A 81 3.793 -1.228 -10.126 1.00 0.00 O ATOM 1241 CB ASN A 81 1.296 0.602 -9.349 1.00 0.00 C ATOM 1242 CG ASN A 81 -0.215 0.377 -9.436 1.00 0.00 C ATOM 1243 OD1 ASN A 81 -0.719 -0.715 -9.235 1.00 0.00 O ATOM 1244 ND2 ASN A 81 -0.907 1.470 -9.746 1.00 0.00 N ATOM 0 H ASN A 81 1.700 0.457 -6.884 1.00 0.00 H new ATOM 0 HA ASN A 81 1.484 -1.508 -8.965 1.00 0.00 H new ATOM 0 HB2 ASN A 81 1.500 1.512 -8.785 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.704 0.748 -10.349 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.923 1.424 -9.828 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.422 2.354 -9.902 1.00 0.00 H new ATOM 1251 N LEU A 82 4.275 0.113 -8.370 1.00 0.00 N ATOM 1252 CA LEU A 82 5.693 0.194 -8.678 1.00 0.00 C ATOM 1253 C LEU A 82 6.228 -1.210 -8.968 1.00 0.00 C ATOM 1254 O LEU A 82 5.586 -2.204 -8.632 1.00 0.00 O ATOM 1255 CB LEU A 82 6.443 0.919 -7.559 1.00 0.00 C ATOM 1256 CG LEU A 82 6.407 2.448 -7.609 1.00 0.00 C ATOM 1257 CD1 LEU A 82 7.379 3.052 -6.593 1.00 0.00 C ATOM 1258 CD2 LEU A 82 6.670 2.957 -9.027 1.00 0.00 C ATOM 0 H LEU A 82 3.988 0.637 -7.543 1.00 0.00 H new ATOM 0 HA LEU A 82 5.855 0.789 -9.577 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.030 0.597 -6.603 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.485 0.599 -7.580 1.00 0.00 H new ATOM 0 HG LEU A 82 5.405 2.776 -7.331 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.334 4.140 -6.649 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.104 2.728 -5.589 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.392 2.719 -6.816 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.639 4.047 -9.034 1.00 0.00 H new ATOM 0 HD22 LEU A 82 7.652 2.620 -9.358 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.907 2.568 -9.701 1.00 0.00 H new ATOM 1270 N PRO A 83 7.429 -1.247 -9.605 1.00 0.00 N ATOM 1271 CA PRO A 83 8.058 -2.512 -9.944 1.00 0.00 C ATOM 1272 C PRO A 83 8.656 -3.177 -8.703 1.00 0.00 C ATOM 1273 O PRO A 83 9.351 -2.529 -7.921 1.00 0.00 O ATOM 1274 CB PRO A 83 9.101 -2.164 -10.993 1.00 0.00 C ATOM 1275 CG PRO A 83 9.338 -0.668 -10.865 1.00 0.00 C ATOM 1276 CD PRO A 83 8.217 -0.089 -10.017 1.00 0.00 C ATOM 0 HA PRO A 83 7.350 -3.243 -10.334 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.023 -2.721 -10.827 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.750 -2.420 -11.993 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.306 -0.473 -10.403 1.00 0.00 H new ATOM 0 HG3 PRO A 83 9.354 -0.199 -11.849 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.610 0.450 -9.155 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.614 0.618 -10.587 1.00 0.00 H new ATOM 1284 N GLU A 84 8.365 -4.461 -8.560 1.00 0.00 N ATOM 1285 CA GLU A 84 8.865 -5.221 -7.427 1.00 0.00 C ATOM 1286 C GLU A 84 10.344 -4.906 -7.189 1.00 0.00 C ATOM 1287 O GLU A 84 10.768 -4.729 -6.048 1.00 0.00 O ATOM 1288 CB GLU A 84 8.651 -6.722 -7.635 1.00 0.00 C ATOM 1289 CG GLU A 84 8.804 -7.098 -9.110 1.00 0.00 C ATOM 1290 CD GLU A 84 9.598 -8.396 -9.265 1.00 0.00 C ATOM 1291 OE1 GLU A 84 10.838 -8.324 -9.120 1.00 0.00 O ATOM 1292 OE2 GLU A 84 8.948 -9.432 -9.525 1.00 0.00 O ATOM 0 H GLU A 84 7.789 -4.995 -9.210 1.00 0.00 H new ATOM 0 HA GLU A 84 8.303 -4.927 -6.541 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.370 -7.282 -7.037 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.658 -7.003 -7.285 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.820 -7.213 -9.564 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.309 -6.293 -9.644 1.00 0.00 H new ATOM 1299 N VAL A 85 11.087 -4.847 -8.284 1.00 0.00 N ATOM 1300 CA VAL A 85 12.509 -4.557 -8.208 1.00 0.00 C ATOM 1301 C VAL A 85 12.715 -3.216 -7.501 1.00 0.00 C ATOM 1302 O VAL A 85 13.648 -3.061 -6.716 1.00 0.00 O ATOM 1303 CB VAL A 85 13.126 -4.596 -9.608 1.00 0.00 C ATOM 1304 CG1 VAL A 85 12.429 -5.638 -10.486 1.00 0.00 C ATOM 1305 CG2 VAL A 85 13.087 -3.213 -10.262 1.00 0.00 C ATOM 0 H VAL A 85 10.731 -4.995 -9.229 1.00 0.00 H new ATOM 0 HA VAL A 85 13.023 -5.317 -7.619 1.00 0.00 H new ATOM 0 HB VAL A 85 14.171 -4.890 -9.506 1.00 0.00 H new ATOM 0 HG11 VAL A 85 12.887 -5.645 -11.475 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.531 -6.624 -10.032 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.372 -5.388 -10.577 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.531 -3.268 -11.256 1.00 0.00 H new ATOM 0 HG22 VAL A 85 12.053 -2.879 -10.345 1.00 0.00 H new ATOM 0 HG23 VAL A 85 13.649 -2.506 -9.652 1.00 0.00 H new ATOM 1315 N GLU A 86 11.827 -2.281 -7.805 1.00 0.00 N ATOM 1316 CA GLU A 86 11.899 -0.958 -7.208 1.00 0.00 C ATOM 1317 C GLU A 86 11.550 -1.027 -5.720 1.00 0.00 C ATOM 1318 O GLU A 86 12.353 -0.641 -4.872 1.00 0.00 O ATOM 1319 CB GLU A 86 10.984 0.025 -7.941 1.00 0.00 C ATOM 1320 CG GLU A 86 11.757 0.803 -9.008 1.00 0.00 C ATOM 1321 CD GLU A 86 12.818 -0.079 -9.669 1.00 0.00 C ATOM 1322 OE1 GLU A 86 12.462 -0.745 -10.665 1.00 0.00 O ATOM 1323 OE2 GLU A 86 13.961 -0.068 -9.163 1.00 0.00 O ATOM 0 H GLU A 86 11.054 -2.413 -8.457 1.00 0.00 H new ATOM 0 HA GLU A 86 12.921 -0.593 -7.305 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.161 -0.517 -8.406 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.544 0.720 -7.226 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.066 1.175 -9.764 1.00 0.00 H new ATOM 0 HG3 GLU A 86 12.233 1.673 -8.556 1.00 0.00 H new ATOM 1330 N ARG A 87 10.351 -1.521 -5.449 1.00 0.00 N ATOM 1331 CA ARG A 87 9.886 -1.646 -4.078 1.00 0.00 C ATOM 1332 C ARG A 87 10.939 -2.353 -3.222 1.00 0.00 C ATOM 1333 O ARG A 87 11.171 -1.971 -2.076 1.00 0.00 O ATOM 1334 CB ARG A 87 8.574 -2.430 -4.011 1.00 0.00 C ATOM 1335 CG ARG A 87 7.584 -1.936 -5.068 1.00 0.00 C ATOM 1336 CD ARG A 87 6.141 -2.210 -4.640 1.00 0.00 C ATOM 1337 NE ARG A 87 5.648 -3.447 -5.286 1.00 0.00 N ATOM 1338 CZ ARG A 87 5.887 -4.682 -4.825 1.00 0.00 C ATOM 1339 NH1 ARG A 87 6.614 -4.853 -3.712 1.00 0.00 N ATOM 1340 NH2 ARG A 87 5.399 -5.746 -5.476 1.00 0.00 N ATOM 0 H ARG A 87 9.688 -1.839 -6.155 1.00 0.00 H new ATOM 0 HA ARG A 87 9.716 -0.641 -3.693 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.772 -3.491 -4.162 1.00 0.00 H new ATOM 0 HB3 ARG A 87 8.134 -2.326 -3.019 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.722 -0.867 -5.229 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.785 -2.430 -6.019 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.087 -2.310 -3.556 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.505 -1.368 -4.915 1.00 0.00 H new ATOM 0 HE ARG A 87 5.091 -3.353 -6.136 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.985 -4.043 -3.216 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.796 -5.793 -3.361 1.00 0.00 H new ATOM 0 HH21 ARG A 87 4.845 -5.616 -6.323 1.00 0.00 H new ATOM 0 HH22 ARG A 87 5.581 -6.686 -5.125 1.00 0.00 H new ATOM 1354 N ASP A 88 11.548 -3.371 -3.812 1.00 0.00 N ATOM 1355 CA ASP A 88 12.571 -4.134 -3.118 1.00 0.00 C ATOM 1356 C ASP A 88 13.651 -3.181 -2.601 1.00 0.00 C ATOM 1357 O ASP A 88 14.030 -3.241 -1.433 1.00 0.00 O ATOM 1358 CB ASP A 88 13.239 -5.141 -4.056 1.00 0.00 C ATOM 1359 CG ASP A 88 12.545 -6.501 -4.146 1.00 0.00 C ATOM 1360 OD1 ASP A 88 12.230 -7.049 -3.068 1.00 0.00 O ATOM 1361 OD2 ASP A 88 12.345 -6.962 -5.291 1.00 0.00 O ATOM 0 H ASP A 88 11.353 -3.685 -4.763 1.00 0.00 H new ATOM 0 HA ASP A 88 12.093 -4.668 -2.297 1.00 0.00 H new ATOM 0 HB2 ASP A 88 13.287 -4.708 -5.055 1.00 0.00 H new ATOM 0 HB3 ASP A 88 14.266 -5.296 -3.726 1.00 0.00 H new ATOM 1366 N ARG A 89 14.115 -2.323 -3.498 1.00 0.00 N ATOM 1367 CA ARG A 89 15.144 -1.358 -3.147 1.00 0.00 C ATOM 1368 C ARG A 89 14.573 -0.291 -2.211 1.00 0.00 C ATOM 1369 O ARG A 89 15.179 0.032 -1.190 1.00 0.00 O ATOM 1370 CB ARG A 89 15.711 -0.680 -4.396 1.00 0.00 C ATOM 1371 CG ARG A 89 17.131 -1.170 -4.688 1.00 0.00 C ATOM 1372 CD ARG A 89 17.552 -0.811 -6.115 1.00 0.00 C ATOM 1373 NE ARG A 89 18.920 -1.310 -6.380 1.00 0.00 N ATOM 1374 CZ ARG A 89 19.211 -2.586 -6.666 1.00 0.00 C ATOM 1375 NH1 ARG A 89 18.233 -3.500 -6.727 1.00 0.00 N ATOM 1376 NH2 ARG A 89 20.482 -2.949 -6.892 1.00 0.00 N ATOM 0 H ARG A 89 13.798 -2.276 -4.466 1.00 0.00 H new ATOM 0 HA ARG A 89 15.947 -1.897 -2.643 1.00 0.00 H new ATOM 0 HB2 ARG A 89 15.068 -0.888 -5.251 1.00 0.00 H new ATOM 0 HB3 ARG A 89 15.717 0.401 -4.257 1.00 0.00 H new ATOM 0 HG2 ARG A 89 17.827 -0.725 -3.977 1.00 0.00 H new ATOM 0 HG3 ARG A 89 17.182 -2.250 -4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 89 16.853 -1.246 -6.829 1.00 0.00 H new ATOM 0 HD3 ARG A 89 17.517 0.270 -6.252 1.00 0.00 H new ATOM 0 HE ARG A 89 19.689 -0.641 -6.343 1.00 0.00 H new ATOM 0 HH11 ARG A 89 17.266 -3.224 -6.556 1.00 0.00 H new ATOM 0 HH12 ARG A 89 18.456 -4.471 -6.945 1.00 0.00 H new ATOM 0 HH21 ARG A 89 21.227 -2.254 -6.846 1.00 0.00 H new ATOM 0 HH22 ARG A 89 20.704 -3.920 -7.110 1.00 0.00 H new ATOM 1390 N ILE A 90 13.415 0.227 -2.591 1.00 0.00 N ATOM 1391 CA ILE A 90 12.756 1.250 -1.798 1.00 0.00 C ATOM 1392 C ILE A 90 12.738 0.819 -0.330 1.00 0.00 C ATOM 1393 O ILE A 90 13.244 1.531 0.536 1.00 0.00 O ATOM 1394 CB ILE A 90 11.369 1.558 -2.366 1.00 0.00 C ATOM 1395 CG1 ILE A 90 11.474 2.207 -3.747 1.00 0.00 C ATOM 1396 CG2 ILE A 90 10.555 2.412 -1.391 1.00 0.00 C ATOM 1397 CD1 ILE A 90 10.176 2.027 -4.537 1.00 0.00 C ATOM 0 H ILE A 90 12.916 -0.043 -3.438 1.00 0.00 H new ATOM 0 HA ILE A 90 13.311 2.187 -1.848 1.00 0.00 H new ATOM 0 HB ILE A 90 10.835 0.616 -2.493 1.00 0.00 H new ATOM 0 HG12 ILE A 90 11.693 3.269 -3.638 1.00 0.00 H new ATOM 0 HG13 ILE A 90 12.304 1.765 -4.298 1.00 0.00 H new ATOM 0 HG21 ILE A 90 9.574 2.617 -1.819 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.436 1.876 -0.450 1.00 0.00 H new ATOM 0 HG23 ILE A 90 11.075 3.353 -1.210 1.00 0.00 H new ATOM 0 HD11 ILE A 90 10.277 2.497 -5.515 1.00 0.00 H new ATOM 0 HD12 ILE A 90 9.972 0.964 -4.665 1.00 0.00 H new ATOM 0 HD13 ILE A 90 9.352 2.491 -3.994 1.00 0.00 H new ATOM 1409 N TYR A 91 12.149 -0.344 -0.095 1.00 0.00 N ATOM 1410 CA TYR A 91 12.058 -0.879 1.253 1.00 0.00 C ATOM 1411 C TYR A 91 13.432 -0.908 1.925 1.00 0.00 C ATOM 1412 O TYR A 91 13.593 -0.413 3.040 1.00 0.00 O ATOM 1413 CB TYR A 91 11.546 -2.313 1.104 1.00 0.00 C ATOM 1414 CG TYR A 91 10.096 -2.410 0.627 1.00 0.00 C ATOM 1415 CD1 TYR A 91 9.121 -1.633 1.220 1.00 0.00 C ATOM 1416 CD2 TYR A 91 9.762 -3.274 -0.396 1.00 0.00 C ATOM 1417 CE1 TYR A 91 7.756 -1.724 0.771 1.00 0.00 C ATOM 1418 CE2 TYR A 91 8.397 -3.365 -0.845 1.00 0.00 C ATOM 1419 CZ TYR A 91 7.461 -2.586 -0.239 1.00 0.00 C ATOM 1420 OH TYR A 91 6.172 -2.672 -0.663 1.00 0.00 O ATOM 0 H TYR A 91 11.730 -0.931 -0.816 1.00 0.00 H new ATOM 0 HA TYR A 91 11.402 -0.262 1.867 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.186 -2.845 0.400 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.637 -2.822 2.064 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.382 -0.957 2.021 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.525 -3.882 -0.860 1.00 0.00 H new ATOM 0 HE1 TYR A 91 6.984 -1.121 1.226 1.00 0.00 H new ATOM 0 HE2 TYR A 91 8.122 -4.037 -1.645 1.00 0.00 H new ATOM 0 HH TYR A 91 5.941 -1.868 -1.173 1.00 0.00 H new ATOM 1430 N GLN A 92 14.389 -1.492 1.218 1.00 0.00 N ATOM 1431 CA GLN A 92 15.745 -1.591 1.733 1.00 0.00 C ATOM 1432 C GLN A 92 16.283 -0.202 2.081 1.00 0.00 C ATOM 1433 O GLN A 92 16.754 0.024 3.195 1.00 0.00 O ATOM 1434 CB GLN A 92 16.660 -2.299 0.732 1.00 0.00 C ATOM 1435 CG GLN A 92 18.132 -2.093 1.094 1.00 0.00 C ATOM 1436 CD GLN A 92 18.491 -2.841 2.380 1.00 0.00 C ATOM 1437 OE1 GLN A 92 18.111 -2.463 3.476 1.00 0.00 O ATOM 1438 NE2 GLN A 92 19.242 -3.921 2.185 1.00 0.00 N ATOM 0 H GLN A 92 14.253 -1.901 0.294 1.00 0.00 H new ATOM 0 HA GLN A 92 15.725 -2.190 2.644 1.00 0.00 H new ATOM 0 HB2 GLN A 92 16.432 -3.365 0.716 1.00 0.00 H new ATOM 0 HB3 GLN A 92 16.472 -1.917 -0.271 1.00 0.00 H new ATOM 0 HG2 GLN A 92 18.763 -2.443 0.277 1.00 0.00 H new ATOM 0 HG3 GLN A 92 18.334 -1.029 1.220 1.00 0.00 H new ATOM 0 HE21 GLN A 92 19.525 -4.181 1.240 1.00 0.00 H new ATOM 0 HE22 GLN A 92 19.535 -4.489 2.980 1.00 0.00 H new ATOM 1447 N ASP A 93 16.196 0.693 1.108 1.00 0.00 N ATOM 1448 CA ASP A 93 16.670 2.053 1.297 1.00 0.00 C ATOM 1449 C ASP A 93 16.151 2.587 2.634 1.00 0.00 C ATOM 1450 O ASP A 93 16.925 3.086 3.449 1.00 0.00 O ATOM 1451 CB ASP A 93 16.156 2.975 0.189 1.00 0.00 C ATOM 1452 CG ASP A 93 17.112 4.099 -0.212 1.00 0.00 C ATOM 1453 OD1 ASP A 93 18.235 3.762 -0.645 1.00 0.00 O ATOM 1454 OD2 ASP A 93 16.698 5.271 -0.077 1.00 0.00 O ATOM 0 H ASP A 93 15.804 0.502 0.186 1.00 0.00 H new ATOM 0 HA ASP A 93 17.760 2.037 1.276 1.00 0.00 H new ATOM 0 HB2 ASP A 93 15.938 2.372 -0.693 1.00 0.00 H new ATOM 0 HB3 ASP A 93 15.214 3.418 0.513 1.00 0.00 H new ATOM 1459 N GLU A 94 14.845 2.464 2.818 1.00 0.00 N ATOM 1460 CA GLU A 94 14.214 2.928 4.042 1.00 0.00 C ATOM 1461 C GLU A 94 14.962 2.387 5.262 1.00 0.00 C ATOM 1462 O GLU A 94 15.390 3.155 6.122 1.00 0.00 O ATOM 1463 CB GLU A 94 12.737 2.529 4.082 1.00 0.00 C ATOM 1464 CG GLU A 94 11.863 3.710 4.510 1.00 0.00 C ATOM 1465 CD GLU A 94 12.104 4.068 5.977 1.00 0.00 C ATOM 1466 OE1 GLU A 94 12.971 3.406 6.588 1.00 0.00 O ATOM 1467 OE2 GLU A 94 11.417 4.997 6.455 1.00 0.00 O ATOM 0 H GLU A 94 14.206 2.049 2.140 1.00 0.00 H new ATOM 0 HA GLU A 94 14.263 4.017 4.064 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.424 2.178 3.099 1.00 0.00 H new ATOM 0 HB3 GLU A 94 12.599 1.699 4.775 1.00 0.00 H new ATOM 0 HG2 GLU A 94 12.079 4.574 3.881 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.812 3.462 4.361 1.00 0.00 H new ATOM 1474 N ARG A 95 15.096 1.070 5.298 1.00 0.00 N ATOM 1475 CA ARG A 95 15.785 0.418 6.399 1.00 0.00 C ATOM 1476 C ARG A 95 17.220 0.937 6.510 1.00 0.00 C ATOM 1477 O ARG A 95 17.646 1.370 7.579 1.00 0.00 O ATOM 1478 CB ARG A 95 15.813 -1.100 6.209 1.00 0.00 C ATOM 1479 CG ARG A 95 14.406 -1.648 5.965 1.00 0.00 C ATOM 1480 CD ARG A 95 14.385 -3.174 6.073 1.00 0.00 C ATOM 1481 NE ARG A 95 15.526 -3.750 5.327 1.00 0.00 N ATOM 1482 CZ ARG A 95 15.911 -5.031 5.414 1.00 0.00 C ATOM 1483 NH1 ARG A 95 15.248 -5.877 6.214 1.00 0.00 N ATOM 1484 NH2 ARG A 95 16.958 -5.466 4.700 1.00 0.00 N ATOM 0 H ARG A 95 14.739 0.436 4.583 1.00 0.00 H new ATOM 0 HA ARG A 95 15.240 0.649 7.314 1.00 0.00 H new ATOM 0 HB2 ARG A 95 16.457 -1.353 5.366 1.00 0.00 H new ATOM 0 HB3 ARG A 95 16.243 -1.573 7.092 1.00 0.00 H new ATOM 0 HG2 ARG A 95 13.714 -1.219 6.690 1.00 0.00 H new ATOM 0 HG3 ARG A 95 14.060 -1.345 4.977 1.00 0.00 H new ATOM 0 HD2 ARG A 95 14.436 -3.473 7.120 1.00 0.00 H new ATOM 0 HD3 ARG A 95 13.447 -3.562 5.676 1.00 0.00 H new ATOM 0 HE ARG A 95 16.052 -3.134 4.708 1.00 0.00 H new ATOM 0 HH11 ARG A 95 14.450 -5.546 6.757 1.00 0.00 H new ATOM 0 HH12 ARG A 95 15.541 -6.852 6.280 1.00 0.00 H new ATOM 0 HH21 ARG A 95 17.462 -4.822 4.090 1.00 0.00 H new ATOM 0 HH22 ARG A 95 17.251 -6.441 4.766 1.00 0.00 H new ATOM 1498 N SER A 96 17.925 0.878 5.390 1.00 0.00 N ATOM 1499 CA SER A 96 19.303 1.337 5.348 1.00 0.00 C ATOM 1500 C SER A 96 19.423 2.697 6.038 1.00 0.00 C ATOM 1501 O SER A 96 20.190 2.850 6.988 1.00 0.00 O ATOM 1502 CB SER A 96 19.810 1.427 3.907 1.00 0.00 C ATOM 1503 OG SER A 96 19.857 0.150 3.276 1.00 0.00 O ATOM 0 H SER A 96 17.568 0.519 4.505 1.00 0.00 H new ATOM 0 HA SER A 96 19.921 0.612 5.878 1.00 0.00 H new ATOM 0 HB2 SER A 96 19.161 2.090 3.335 1.00 0.00 H new ATOM 0 HB3 SER A 96 20.805 1.871 3.900 1.00 0.00 H new ATOM 0 HG SER A 96 20.791 -0.118 3.149 1.00 0.00 H new ATOM 1509 N GLY A 97 18.653 3.650 5.535 1.00 0.00 N ATOM 1510 CA GLY A 97 18.663 4.992 6.091 1.00 0.00 C ATOM 1511 C GLY A 97 20.077 5.575 6.092 1.00 0.00 C ATOM 1512 O GLY A 97 20.621 5.896 5.036 1.00 0.00 O ATOM 0 H GLY A 97 18.018 3.519 4.748 1.00 0.00 H new ATOM 0 HA2 GLY A 97 18.001 5.635 5.510 1.00 0.00 H new ATOM 0 HA3 GLY A 97 18.274 4.971 7.109 1.00 0.00 H new ATOM 1516 N PRO A 98 20.648 5.697 7.320 1.00 0.00 N ATOM 1517 CA PRO A 98 21.989 6.236 7.472 1.00 0.00 C ATOM 1518 C PRO A 98 23.043 5.212 7.046 1.00 0.00 C ATOM 1519 O PRO A 98 23.817 4.731 7.872 1.00 0.00 O ATOM 1520 CB PRO A 98 22.095 6.621 8.938 1.00 0.00 C ATOM 1521 CG PRO A 98 20.987 5.862 9.650 1.00 0.00 C ATOM 1522 CD PRO A 98 20.035 5.327 8.592 1.00 0.00 C ATOM 0 HA PRO A 98 22.169 7.100 6.833 1.00 0.00 H new ATOM 0 HB2 PRO A 98 23.072 6.355 9.342 1.00 0.00 H new ATOM 0 HB3 PRO A 98 21.978 7.697 9.069 1.00 0.00 H new ATOM 0 HG2 PRO A 98 21.402 5.044 10.239 1.00 0.00 H new ATOM 0 HG3 PRO A 98 20.459 6.518 10.342 1.00 0.00 H new ATOM 0 HD2 PRO A 98 19.917 4.247 8.675 1.00 0.00 H new ATOM 0 HD3 PRO A 98 19.042 5.765 8.695 1.00 0.00 H new ATOM 1530 N SER A 99 23.039 4.908 5.756 1.00 0.00 N ATOM 1531 CA SER A 99 23.985 3.949 5.210 1.00 0.00 C ATOM 1532 C SER A 99 23.644 2.541 5.700 1.00 0.00 C ATOM 1533 O SER A 99 23.049 2.377 6.764 1.00 0.00 O ATOM 1534 CB SER A 99 25.421 4.312 5.595 1.00 0.00 C ATOM 1535 OG SER A 99 26.217 4.621 4.454 1.00 0.00 O ATOM 0 H SER A 99 22.396 5.309 5.073 1.00 0.00 H new ATOM 0 HA SER A 99 23.911 3.976 4.123 1.00 0.00 H new ATOM 0 HB2 SER A 99 25.410 5.166 6.272 1.00 0.00 H new ATOM 0 HB3 SER A 99 25.872 3.481 6.138 1.00 0.00 H new ATOM 0 HG SER A 99 27.126 4.849 4.741 1.00 0.00 H new ATOM 1541 N SER A 100 24.036 1.560 4.900 1.00 0.00 N ATOM 1542 CA SER A 100 23.780 0.170 5.239 1.00 0.00 C ATOM 1543 C SER A 100 24.856 -0.341 6.200 1.00 0.00 C ATOM 1544 O SER A 100 26.045 -0.119 5.980 1.00 0.00 O ATOM 1545 CB SER A 100 23.730 -0.703 3.984 1.00 0.00 C ATOM 1546 OG SER A 100 22.707 -0.286 3.084 1.00 0.00 O ATOM 0 H SER A 100 24.529 1.700 4.018 1.00 0.00 H new ATOM 0 HA SER A 100 22.808 0.111 5.728 1.00 0.00 H new ATOM 0 HB2 SER A 100 24.695 -0.666 3.478 1.00 0.00 H new ATOM 0 HB3 SER A 100 23.560 -1.741 4.271 1.00 0.00 H new ATOM 0 HG SER A 100 22.709 -0.867 2.295 1.00 0.00 H new ATOM 1552 N GLY A 101 24.399 -1.018 7.243 1.00 0.00 N ATOM 1553 CA GLY A 101 25.307 -1.563 8.238 1.00 0.00 C ATOM 1554 C GLY A 101 24.628 -2.663 9.056 1.00 0.00 C ATOM 1555 O GLY A 101 25.061 -2.974 10.165 1.00 0.00 O ATOM 0 H GLY A 101 23.412 -1.202 7.421 1.00 0.00 H new ATOM 0 HA2 GLY A 101 26.193 -1.965 7.746 1.00 0.00 H new ATOM 0 HA3 GLY A 101 25.645 -0.767 8.902 1.00 0.00 H new TER 1559 GLY A 101