USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 757 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 76 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 80 SER OG : rot 84:sc= 1.07 USER MOD Set 2.1: A 55 GLN : amide:sc= -2.46! C(o=-4.4!,f=-4.6!) USER MOD Set 2.2: A 56 MET CE :methyl 146:sc= -1.73! (180deg=-0.191) USER MOD Set 2.3: A 85 GLN : amide:sc= -0.227 K(o=-4.4,f=-5.5!) USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0633 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0955 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= -6.19! C(o=-6.2!,f=-10!) USER MOD Single : A 17 THR OG1 : rot 35:sc= 0.153 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.282 X(o=-0.28,f=-0.32) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 45:sc= 0.025 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 HIS :FLIP no HD1:sc= -4.85! C(o=-5.5!,f=-4.9!) USER MOD Single : A 44 LYS NZ :NH3+ -121:sc= -1.67! (180deg=-5.27!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.6 K(o=-0.6,f=-1.3) USER MOD Single : A 48 ASN : amide:sc=-0.00145 X(o=-0.0015,f=-0.17) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= -0.137 X(o=-0.14,f=-0.25) USER MOD Single : A 64 THR OG1 : rot -78:sc= 0.0791 USER MOD Single : A 69 LYS NZ :NH3+ -143:sc= -0.876 (180deg=-1.61!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= -0.594 K(o=-0.59,f=-2.1) USER MOD Single : A 89 MET CE :methyl -146:sc= -0.181 (180deg=-0.758) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 97 SER OG : rot -45:sc= 0.957 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -0.139 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.296 -26.653 -3.580 1.00 0.00 N ATOM 2 CA GLY A 1 -8.966 -26.695 -3.000 1.00 0.00 C ATOM 3 C GLY A 1 -8.994 -26.736 -1.485 1.00 0.00 C ATOM 4 O GLY A 1 -10.022 -27.051 -0.885 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.361 -27.348 -4.351 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.001 -26.880 -2.849 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.481 -25.701 -3.956 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.438 -27.572 -3.374 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.403 -25.820 -3.326 1.00 0.00 H new ATOM 8 N SER A 2 -7.862 -26.419 -0.865 1.00 0.00 N ATOM 9 CA SER A 2 -7.760 -26.426 0.590 1.00 0.00 C ATOM 10 C SER A 2 -7.595 -25.009 1.130 1.00 0.00 C ATOM 11 O SER A 2 -8.318 -24.589 2.033 1.00 0.00 O ATOM 12 CB SER A 2 -6.581 -27.294 1.035 1.00 0.00 C ATOM 13 OG SER A 2 -5.363 -26.824 0.481 1.00 0.00 O ATOM 0 H SER A 2 -7.003 -26.154 -1.347 1.00 0.00 H new ATOM 0 HA SER A 2 -8.683 -26.844 0.992 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.514 -27.292 2.123 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.749 -28.326 0.728 1.00 0.00 H new ATOM 0 HG SER A 2 -4.625 -27.394 0.782 1.00 0.00 H new ATOM 19 N SER A 3 -6.638 -24.276 0.569 1.00 0.00 N ATOM 20 CA SER A 3 -6.375 -22.907 0.997 1.00 0.00 C ATOM 21 C SER A 3 -5.818 -22.077 -0.156 1.00 0.00 C ATOM 22 O SER A 3 -4.826 -22.448 -0.781 1.00 0.00 O ATOM 23 CB SER A 3 -5.393 -22.896 2.170 1.00 0.00 C ATOM 24 OG SER A 3 -4.940 -21.582 2.444 1.00 0.00 O ATOM 0 H SER A 3 -6.033 -24.607 -0.182 1.00 0.00 H new ATOM 0 HA SER A 3 -7.318 -22.465 1.319 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.875 -23.310 3.056 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.542 -23.537 1.942 1.00 0.00 H new ATOM 0 HG SER A 3 -4.315 -21.602 3.199 1.00 0.00 H new ATOM 30 N GLY A 4 -6.466 -20.947 -0.430 1.00 0.00 N ATOM 31 CA GLY A 4 -6.021 -20.081 -1.506 1.00 0.00 C ATOM 32 C GLY A 4 -7.089 -19.874 -2.562 1.00 0.00 C ATOM 33 O GLY A 4 -7.636 -20.837 -3.099 1.00 0.00 O ATOM 0 H GLY A 4 -7.289 -20.617 0.074 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.730 -19.115 -1.094 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.133 -20.510 -1.970 1.00 0.00 H new ATOM 37 N SER A 5 -7.388 -18.613 -2.859 1.00 0.00 N ATOM 38 CA SER A 5 -8.402 -18.283 -3.854 1.00 0.00 C ATOM 39 C SER A 5 -7.755 -17.854 -5.167 1.00 0.00 C ATOM 40 O SER A 5 -6.974 -16.904 -5.207 1.00 0.00 O ATOM 41 CB SER A 5 -9.313 -17.169 -3.334 1.00 0.00 C ATOM 42 OG SER A 5 -10.377 -16.918 -4.234 1.00 0.00 O ATOM 0 H SER A 5 -6.943 -17.804 -2.425 1.00 0.00 H new ATOM 0 HA SER A 5 -9.000 -19.176 -4.038 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.715 -17.449 -2.360 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.732 -16.258 -3.190 1.00 0.00 H new ATOM 0 HG SER A 5 -10.945 -16.203 -3.878 1.00 0.00 H new ATOM 48 N SER A 6 -8.086 -18.565 -6.241 1.00 0.00 N ATOM 49 CA SER A 6 -7.535 -18.262 -7.557 1.00 0.00 C ATOM 50 C SER A 6 -8.527 -17.456 -8.389 1.00 0.00 C ATOM 51 O SER A 6 -9.723 -17.433 -8.100 1.00 0.00 O ATOM 52 CB SER A 6 -7.169 -19.554 -8.290 1.00 0.00 C ATOM 53 OG SER A 6 -8.317 -20.353 -8.520 1.00 0.00 O ATOM 0 H SER A 6 -8.732 -19.354 -6.225 1.00 0.00 H new ATOM 0 HA SER A 6 -6.634 -17.664 -7.417 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.693 -19.314 -9.241 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.443 -20.116 -7.703 1.00 0.00 H new ATOM 0 HG SER A 6 -8.057 -21.172 -8.991 1.00 0.00 H new ATOM 59 N GLY A 7 -8.022 -16.795 -9.427 1.00 0.00 N ATOM 60 CA GLY A 7 -8.876 -15.996 -10.285 1.00 0.00 C ATOM 61 C GLY A 7 -8.087 -15.171 -11.284 1.00 0.00 C ATOM 62 O GLY A 7 -7.160 -14.454 -10.909 1.00 0.00 O ATOM 0 H GLY A 7 -7.036 -16.799 -9.688 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.562 -16.652 -10.821 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.484 -15.332 -9.670 1.00 0.00 H new ATOM 66 N GLU A 8 -8.454 -15.275 -12.557 1.00 0.00 N ATOM 67 CA GLU A 8 -7.772 -14.534 -13.611 1.00 0.00 C ATOM 68 C GLU A 8 -8.629 -13.373 -14.102 1.00 0.00 C ATOM 69 O GLU A 8 -9.436 -13.509 -15.023 1.00 0.00 O ATOM 70 CB GLU A 8 -7.432 -15.462 -14.779 1.00 0.00 C ATOM 71 CG GLU A 8 -8.645 -16.145 -15.386 1.00 0.00 C ATOM 72 CD GLU A 8 -8.277 -17.366 -16.207 1.00 0.00 C ATOM 73 OE1 GLU A 8 -7.829 -18.368 -15.612 1.00 0.00 O ATOM 74 OE2 GLU A 8 -8.438 -17.319 -17.445 1.00 0.00 O ATOM 0 H GLU A 8 -9.219 -15.865 -12.883 1.00 0.00 H new ATOM 0 HA GLU A 8 -6.848 -14.130 -13.197 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -6.924 -14.887 -15.553 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -6.731 -16.223 -14.436 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -9.328 -16.440 -14.589 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.179 -15.435 -16.017 1.00 0.00 H new ATOM 81 N PRO A 9 -8.454 -12.200 -13.475 1.00 0.00 N ATOM 82 CA PRO A 9 -9.202 -10.991 -13.832 1.00 0.00 C ATOM 83 C PRO A 9 -8.794 -10.436 -15.192 1.00 0.00 C ATOM 84 O PRO A 9 -8.059 -11.081 -15.939 1.00 0.00 O ATOM 85 CB PRO A 9 -8.835 -10.006 -12.719 1.00 0.00 C ATOM 86 CG PRO A 9 -7.507 -10.467 -12.228 1.00 0.00 C ATOM 87 CD PRO A 9 -7.510 -11.964 -12.370 1.00 0.00 C ATOM 0 HA PRO A 9 -10.272 -11.183 -13.914 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.785 -8.984 -13.095 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.577 -10.016 -11.921 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -6.700 -10.021 -12.809 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -7.351 -10.174 -11.190 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.516 -12.348 -12.602 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -7.835 -12.454 -11.452 1.00 0.00 H new ATOM 95 N GLU A 10 -9.275 -9.237 -15.505 1.00 0.00 N ATOM 96 CA GLU A 10 -8.959 -8.596 -16.777 1.00 0.00 C ATOM 97 C GLU A 10 -8.792 -7.090 -16.600 1.00 0.00 C ATOM 98 O GLU A 10 -9.438 -6.478 -15.749 1.00 0.00 O ATOM 99 CB GLU A 10 -10.057 -8.883 -17.804 1.00 0.00 C ATOM 100 CG GLU A 10 -11.446 -8.988 -17.197 1.00 0.00 C ATOM 101 CD GLU A 10 -12.466 -9.548 -18.169 1.00 0.00 C ATOM 102 OE1 GLU A 10 -12.331 -10.728 -18.556 1.00 0.00 O ATOM 103 OE2 GLU A 10 -13.399 -8.807 -18.544 1.00 0.00 O ATOM 0 H GLU A 10 -9.884 -8.690 -14.896 1.00 0.00 H new ATOM 0 HA GLU A 10 -8.017 -9.008 -17.139 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.056 -8.092 -18.554 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.824 -9.814 -18.321 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.405 -9.624 -16.313 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.769 -8.001 -16.865 1.00 0.00 H new ATOM 110 N LYS A 11 -7.922 -6.499 -17.410 1.00 0.00 N ATOM 111 CA LYS A 11 -7.669 -5.064 -17.347 1.00 0.00 C ATOM 112 C LYS A 11 -7.069 -4.558 -18.654 1.00 0.00 C ATOM 113 O LYS A 11 -6.366 -5.291 -19.351 1.00 0.00 O ATOM 114 CB LYS A 11 -6.727 -4.743 -16.184 1.00 0.00 C ATOM 115 CG LYS A 11 -6.869 -3.324 -15.660 1.00 0.00 C ATOM 116 CD LYS A 11 -6.389 -3.210 -14.222 1.00 0.00 C ATOM 117 CE LYS A 11 -7.347 -3.895 -13.259 1.00 0.00 C ATOM 118 NZ LYS A 11 -7.180 -3.400 -11.865 1.00 0.00 N ATOM 0 H LYS A 11 -7.379 -6.992 -18.119 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.622 -4.560 -17.187 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.917 -5.443 -15.370 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.698 -4.901 -16.507 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.297 -2.643 -16.291 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.912 -3.015 -15.722 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.399 -3.657 -14.131 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.290 -2.158 -13.952 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.373 -3.724 -13.585 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.180 -4.972 -13.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.850 -3.891 -11.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.208 -3.586 -11.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.365 -2.377 -11.835 1.00 0.00 H new ATOM 132 N LEU A 12 -7.349 -3.302 -18.981 1.00 0.00 N ATOM 133 CA LEU A 12 -6.835 -2.697 -20.205 1.00 0.00 C ATOM 134 C LEU A 12 -6.999 -1.180 -20.174 1.00 0.00 C ATOM 135 O LEU A 12 -7.814 -0.649 -19.422 1.00 0.00 O ATOM 136 CB LEU A 12 -7.557 -3.274 -21.424 1.00 0.00 C ATOM 137 CG LEU A 12 -9.055 -2.982 -21.518 1.00 0.00 C ATOM 138 CD1 LEU A 12 -9.570 -3.275 -22.919 1.00 0.00 C ATOM 139 CD2 LEU A 12 -9.823 -3.794 -20.485 1.00 0.00 C ATOM 0 H LEU A 12 -7.929 -2.682 -18.416 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.772 -2.928 -20.276 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.075 -2.889 -22.323 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.417 -4.355 -21.426 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.212 -1.924 -21.309 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.638 -3.061 -22.966 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.042 -2.649 -23.639 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.399 -4.325 -23.157 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.887 -3.573 -20.567 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.658 -4.857 -20.662 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.474 -3.534 -19.485 1.00 0.00 H new ATOM 151 N GLY A 13 -6.218 -0.489 -20.999 1.00 0.00 N ATOM 152 CA GLY A 13 -6.293 0.959 -21.051 1.00 0.00 C ATOM 153 C GLY A 13 -5.071 1.626 -20.452 1.00 0.00 C ATOM 154 O GLY A 13 -4.091 0.957 -20.123 1.00 0.00 O ATOM 0 H GLY A 13 -5.535 -0.906 -21.632 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.405 1.277 -22.088 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.183 1.293 -20.518 1.00 0.00 H new ATOM 158 N GLN A 14 -5.128 2.946 -20.311 1.00 0.00 N ATOM 159 CA GLN A 14 -4.015 3.702 -19.748 1.00 0.00 C ATOM 160 C GLN A 14 -4.439 5.130 -19.419 1.00 0.00 C ATOM 161 O GLN A 14 -5.308 5.698 -20.081 1.00 0.00 O ATOM 162 CB GLN A 14 -2.838 3.719 -20.725 1.00 0.00 C ATOM 163 CG GLN A 14 -1.553 4.259 -20.119 1.00 0.00 C ATOM 164 CD GLN A 14 -1.505 5.774 -20.103 1.00 0.00 C ATOM 165 OE1 GLN A 14 -1.423 6.393 -19.042 1.00 0.00 O ATOM 166 NE2 GLN A 14 -1.557 6.380 -21.283 1.00 0.00 N ATOM 0 H GLN A 14 -5.932 3.514 -20.578 1.00 0.00 H new ATOM 0 HA GLN A 14 -3.705 3.213 -18.825 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -2.662 2.706 -21.086 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -3.104 4.325 -21.591 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -1.452 3.886 -19.100 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -0.702 3.879 -20.684 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -1.625 5.827 -22.138 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -1.529 7.398 -21.335 1.00 0.00 H new ATOM 175 N ALA A 15 -3.818 5.705 -18.394 1.00 0.00 N ATOM 176 CA ALA A 15 -4.131 7.066 -17.978 1.00 0.00 C ATOM 177 C ALA A 15 -2.947 7.705 -17.260 1.00 0.00 C ATOM 178 O ALA A 15 -2.180 7.024 -16.578 1.00 0.00 O ATOM 179 CB ALA A 15 -5.362 7.076 -17.084 1.00 0.00 C ATOM 0 H ALA A 15 -3.095 5.249 -17.837 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.341 7.654 -18.872 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.583 8.099 -16.781 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.212 6.667 -17.631 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.174 6.468 -16.199 1.00 0.00 H new ATOM 185 N LEU A 16 -2.804 9.016 -17.418 1.00 0.00 N ATOM 186 CA LEU A 16 -1.712 9.748 -16.783 1.00 0.00 C ATOM 187 C LEU A 16 -2.222 11.028 -16.130 1.00 0.00 C ATOM 188 O LEU A 16 -2.215 12.097 -16.741 1.00 0.00 O ATOM 189 CB LEU A 16 -0.632 10.084 -17.813 1.00 0.00 C ATOM 190 CG LEU A 16 -1.129 10.587 -19.168 1.00 0.00 C ATOM 191 CD1 LEU A 16 -0.036 11.368 -19.882 1.00 0.00 C ATOM 192 CD2 LEU A 16 -1.603 9.424 -20.028 1.00 0.00 C ATOM 0 H LEU A 16 -3.429 9.594 -17.979 1.00 0.00 H new ATOM 0 HA LEU A 16 -1.283 9.113 -16.008 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.026 10.841 -17.386 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.027 9.193 -17.979 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.973 11.255 -18.998 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.409 11.718 -20.845 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.257 12.224 -19.273 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.828 10.723 -20.040 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.953 9.801 -20.989 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.778 8.731 -20.189 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.418 8.906 -19.522 1.00 0.00 H new ATOM 204 N THR A 17 -2.662 10.913 -14.880 1.00 0.00 N ATOM 205 CA THR A 17 -3.175 12.061 -14.143 1.00 0.00 C ATOM 206 C THR A 17 -2.796 11.980 -12.668 1.00 0.00 C ATOM 207 O THR A 17 -3.038 10.969 -12.011 1.00 0.00 O ATOM 208 CB THR A 17 -4.707 12.168 -14.262 1.00 0.00 C ATOM 209 OG1 THR A 17 -5.325 11.017 -13.674 1.00 0.00 O ATOM 210 CG2 THR A 17 -5.130 12.288 -15.718 1.00 0.00 C ATOM 0 H THR A 17 -2.673 10.037 -14.358 1.00 0.00 H new ATOM 0 HA THR A 17 -2.722 12.948 -14.585 1.00 0.00 H new ATOM 0 HB THR A 17 -5.029 13.064 -13.732 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.801 10.725 -12.899 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.216 12.362 -15.776 1.00 0.00 H new ATOM 0 HG22 THR A 17 -4.681 13.180 -16.155 1.00 0.00 H new ATOM 0 HG23 THR A 17 -4.796 11.408 -16.268 1.00 0.00 H new ATOM 218 N GLU A 18 -2.200 13.052 -12.156 1.00 0.00 N ATOM 219 CA GLU A 18 -1.789 13.101 -10.758 1.00 0.00 C ATOM 220 C GLU A 18 -1.918 14.516 -10.201 1.00 0.00 C ATOM 221 O GLU A 18 -1.280 15.448 -10.691 1.00 0.00 O ATOM 222 CB GLU A 18 -0.346 12.613 -10.610 1.00 0.00 C ATOM 223 CG GLU A 18 -0.206 11.101 -10.666 1.00 0.00 C ATOM 224 CD GLU A 18 1.234 10.643 -10.535 1.00 0.00 C ATOM 225 OE1 GLU A 18 2.128 11.338 -11.060 1.00 0.00 O ATOM 226 OE2 GLU A 18 1.465 9.589 -9.906 1.00 0.00 O ATOM 0 H GLU A 18 -1.991 13.897 -12.688 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.448 12.444 -10.190 1.00 0.00 H new ATOM 0 HB2 GLU A 18 0.261 13.055 -11.400 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.054 12.972 -9.662 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.799 10.655 -9.868 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.615 10.737 -11.608 1.00 0.00 H new ATOM 233 N VAL A 19 -2.748 14.669 -9.174 1.00 0.00 N ATOM 234 CA VAL A 19 -2.961 15.969 -8.550 1.00 0.00 C ATOM 235 C VAL A 19 -1.635 16.658 -8.248 1.00 0.00 C ATOM 236 O VAL A 19 -0.618 16.000 -8.027 1.00 0.00 O ATOM 237 CB VAL A 19 -3.768 15.840 -7.245 1.00 0.00 C ATOM 238 CG1 VAL A 19 -3.214 14.715 -6.383 1.00 0.00 C ATOM 239 CG2 VAL A 19 -3.765 17.157 -6.484 1.00 0.00 C ATOM 0 H VAL A 19 -3.284 13.908 -8.757 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.527 16.572 -9.261 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.800 15.596 -7.499 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.797 14.639 -5.465 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.274 13.774 -6.930 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.173 14.925 -6.136 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -4.340 17.047 -5.565 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -2.739 17.434 -6.240 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.213 17.935 -7.102 1.00 0.00 H new ATOM 249 N TYR A 20 -1.654 17.986 -8.241 1.00 0.00 N ATOM 250 CA TYR A 20 -0.451 18.765 -7.968 1.00 0.00 C ATOM 251 C TYR A 20 -0.772 19.974 -7.095 1.00 0.00 C ATOM 252 O TYR A 20 -1.697 20.734 -7.383 1.00 0.00 O ATOM 253 CB TYR A 20 0.193 19.224 -9.277 1.00 0.00 C ATOM 254 CG TYR A 20 -0.795 19.786 -10.274 1.00 0.00 C ATOM 255 CD1 TYR A 20 -1.726 18.963 -10.899 1.00 0.00 C ATOM 256 CD2 TYR A 20 -0.799 21.138 -10.591 1.00 0.00 C ATOM 257 CE1 TYR A 20 -2.630 19.472 -11.810 1.00 0.00 C ATOM 258 CE2 TYR A 20 -1.701 21.656 -11.501 1.00 0.00 C ATOM 259 CZ TYR A 20 -2.614 20.818 -12.109 1.00 0.00 C ATOM 260 OH TYR A 20 -3.514 21.329 -13.015 1.00 0.00 O ATOM 0 H TYR A 20 -2.488 18.545 -8.421 1.00 0.00 H new ATOM 0 HA TYR A 20 0.250 18.127 -7.430 1.00 0.00 H new ATOM 0 HB2 TYR A 20 0.944 19.982 -9.056 1.00 0.00 H new ATOM 0 HB3 TYR A 20 0.714 18.381 -9.731 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -1.742 17.908 -10.668 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -0.085 21.796 -10.118 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.346 18.819 -12.286 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -1.692 22.710 -11.735 1.00 0.00 H new ATOM 0 HH TYR A 20 -3.369 22.293 -13.111 1.00 0.00 H new ATOM 270 N ALA A 21 -0.001 20.147 -6.027 1.00 0.00 N ATOM 271 CA ALA A 21 -0.200 21.265 -5.113 1.00 0.00 C ATOM 272 C ALA A 21 1.113 21.677 -4.455 1.00 0.00 C ATOM 273 O ALA A 21 2.175 21.143 -4.776 1.00 0.00 O ATOM 274 CB ALA A 21 -1.232 20.904 -4.055 1.00 0.00 C ATOM 0 H ALA A 21 0.768 19.527 -5.773 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.568 22.113 -5.690 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.371 21.748 -3.379 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.180 20.666 -4.538 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.886 20.039 -3.489 1.00 0.00 H new ATOM 280 N LYS A 22 1.033 22.629 -3.532 1.00 0.00 N ATOM 281 CA LYS A 22 2.215 23.113 -2.827 1.00 0.00 C ATOM 282 C LYS A 22 1.975 23.143 -1.321 1.00 0.00 C ATOM 283 O LYS A 22 2.701 23.805 -0.581 1.00 0.00 O ATOM 284 CB LYS A 22 2.592 24.511 -3.322 1.00 0.00 C ATOM 285 CG LYS A 22 1.525 25.558 -3.059 1.00 0.00 C ATOM 286 CD LYS A 22 0.537 25.650 -4.210 1.00 0.00 C ATOM 287 CE LYS A 22 -0.576 26.643 -3.911 1.00 0.00 C ATOM 288 NZ LYS A 22 -1.437 26.886 -5.102 1.00 0.00 N ATOM 0 H LYS A 22 0.162 23.081 -3.254 1.00 0.00 H new ATOM 0 HA LYS A 22 3.037 22.427 -3.033 1.00 0.00 H new ATOM 0 HB2 LYS A 22 3.519 24.820 -2.839 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.789 24.467 -4.393 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.992 25.313 -2.140 1.00 0.00 H new ATOM 0 HG3 LYS A 22 1.997 26.529 -2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 22 1.061 25.951 -5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 22 0.107 24.667 -4.401 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -1.188 26.267 -3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -0.142 27.586 -3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.183 27.568 -4.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.858 27.269 -5.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.872 25.991 -5.405 1.00 0.00 H new ATOM 302 N ALA A 23 0.952 22.421 -0.874 1.00 0.00 N ATOM 303 CA ALA A 23 0.620 22.362 0.544 1.00 0.00 C ATOM 304 C ALA A 23 1.813 21.893 1.368 1.00 0.00 C ATOM 305 O ALA A 23 2.362 20.818 1.128 1.00 0.00 O ATOM 306 CB ALA A 23 -0.573 21.445 0.769 1.00 0.00 C ATOM 0 H ALA A 23 0.339 21.869 -1.474 1.00 0.00 H new ATOM 0 HA ALA A 23 0.358 23.368 0.873 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.810 21.410 1.832 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -1.433 21.825 0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -0.332 20.442 0.418 1.00 0.00 H new ATOM 312 N ASN A 24 2.212 22.706 2.341 1.00 0.00 N ATOM 313 CA ASN A 24 3.342 22.373 3.201 1.00 0.00 C ATOM 314 C ASN A 24 2.865 21.931 4.580 1.00 0.00 C ATOM 315 O ASN A 24 3.433 22.320 5.600 1.00 0.00 O ATOM 316 CB ASN A 24 4.278 23.576 3.335 1.00 0.00 C ATOM 317 CG ASN A 24 5.619 23.201 3.937 1.00 0.00 C ATOM 318 OD1 ASN A 24 5.946 23.605 5.054 1.00 0.00 O ATOM 319 ND2 ASN A 24 6.402 22.424 3.198 1.00 0.00 N ATOM 0 H ASN A 24 1.770 23.600 2.554 1.00 0.00 H new ATOM 0 HA ASN A 24 3.885 21.547 2.742 1.00 0.00 H new ATOM 0 HB2 ASN A 24 4.436 24.021 2.353 1.00 0.00 H new ATOM 0 HB3 ASN A 24 3.803 24.335 3.957 1.00 0.00 H new ATOM 0 HD21 ASN A 24 7.316 22.138 3.550 1.00 0.00 H new ATOM 0 HD22 ASN A 24 6.090 22.113 2.278 1.00 0.00 H new ATOM 326 N SER A 25 1.817 21.113 4.603 1.00 0.00 N ATOM 327 CA SER A 25 1.260 20.619 5.857 1.00 0.00 C ATOM 328 C SER A 25 1.349 19.097 5.928 1.00 0.00 C ATOM 329 O SER A 25 0.752 18.390 5.117 1.00 0.00 O ATOM 330 CB SER A 25 -0.197 21.062 6.003 1.00 0.00 C ATOM 331 OG SER A 25 -0.574 21.133 7.367 1.00 0.00 O ATOM 0 H SER A 25 1.337 20.779 3.768 1.00 0.00 H new ATOM 0 HA SER A 25 1.844 21.040 6.676 1.00 0.00 H new ATOM 0 HB2 SER A 25 -0.333 22.036 5.534 1.00 0.00 H new ATOM 0 HB3 SER A 25 -0.848 20.362 5.479 1.00 0.00 H new ATOM 0 HG SER A 25 -1.509 21.420 7.434 1.00 0.00 H new ATOM 337 N PHE A 26 2.100 18.600 6.906 1.00 0.00 N ATOM 338 CA PHE A 26 2.270 17.162 7.084 1.00 0.00 C ATOM 339 C PHE A 26 0.984 16.417 6.739 1.00 0.00 C ATOM 340 O PHE A 26 -0.119 16.905 6.992 1.00 0.00 O ATOM 341 CB PHE A 26 2.683 16.851 8.524 1.00 0.00 C ATOM 342 CG PHE A 26 3.455 15.570 8.662 1.00 0.00 C ATOM 343 CD1 PHE A 26 4.715 15.441 8.100 1.00 0.00 C ATOM 344 CD2 PHE A 26 2.921 14.496 9.355 1.00 0.00 C ATOM 345 CE1 PHE A 26 5.426 14.263 8.225 1.00 0.00 C ATOM 346 CE2 PHE A 26 3.629 13.315 9.484 1.00 0.00 C ATOM 347 CZ PHE A 26 4.884 13.199 8.918 1.00 0.00 C ATOM 0 H PHE A 26 2.600 19.171 7.587 1.00 0.00 H new ATOM 0 HA PHE A 26 3.056 16.827 6.408 1.00 0.00 H new ATOM 0 HB2 PHE A 26 3.288 17.673 8.906 1.00 0.00 H new ATOM 0 HB3 PHE A 26 1.790 16.797 9.146 1.00 0.00 H new ATOM 0 HD1 PHE A 26 5.146 16.270 7.558 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.941 14.582 9.800 1.00 0.00 H new ATOM 0 HE1 PHE A 26 6.406 14.174 7.780 1.00 0.00 H new ATOM 0 HE2 PHE A 26 3.201 12.485 10.026 1.00 0.00 H new ATOM 0 HZ PHE A 26 5.440 12.278 9.017 1.00 0.00 H new ATOM 357 N THR A 27 1.132 15.229 6.160 1.00 0.00 N ATOM 358 CA THR A 27 -0.015 14.416 5.779 1.00 0.00 C ATOM 359 C THR A 27 0.160 12.972 6.233 1.00 0.00 C ATOM 360 O THR A 27 1.223 12.378 6.053 1.00 0.00 O ATOM 361 CB THR A 27 -0.240 14.439 4.255 1.00 0.00 C ATOM 362 OG1 THR A 27 -0.684 15.738 3.845 1.00 0.00 O ATOM 363 CG2 THR A 27 -1.263 13.393 3.842 1.00 0.00 C ATOM 0 H THR A 27 2.036 14.809 5.945 1.00 0.00 H new ATOM 0 HA THR A 27 -0.885 14.847 6.274 1.00 0.00 H new ATOM 0 HB THR A 27 0.707 14.208 3.767 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.141 16.424 4.287 1.00 0.00 H new ATOM 0 HG21 THR A 27 -1.404 13.429 2.762 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.907 12.403 4.129 1.00 0.00 H new ATOM 0 HG23 THR A 27 -2.212 13.596 4.339 1.00 0.00 H new ATOM 371 N VAL A 28 -0.892 12.410 6.822 1.00 0.00 N ATOM 372 CA VAL A 28 -0.854 11.033 7.301 1.00 0.00 C ATOM 373 C VAL A 28 -2.007 10.219 6.723 1.00 0.00 C ATOM 374 O VAL A 28 -3.172 10.470 7.029 1.00 0.00 O ATOM 375 CB VAL A 28 -0.917 10.972 8.839 1.00 0.00 C ATOM 376 CG1 VAL A 28 -0.878 9.528 9.317 1.00 0.00 C ATOM 377 CG2 VAL A 28 0.219 11.776 9.450 1.00 0.00 C ATOM 0 H VAL A 28 -1.780 12.887 6.979 1.00 0.00 H new ATOM 0 HA VAL A 28 0.092 10.607 6.967 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.859 11.412 9.166 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.923 9.504 10.406 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.730 8.986 8.906 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.047 9.059 8.982 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.159 11.722 10.537 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.173 11.367 9.118 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.140 12.816 9.133 1.00 0.00 H new ATOM 387 N SER A 29 -1.672 9.242 5.885 1.00 0.00 N ATOM 388 CA SER A 29 -2.681 8.392 5.262 1.00 0.00 C ATOM 389 C SER A 29 -2.356 6.918 5.478 1.00 0.00 C ATOM 390 O SER A 29 -1.191 6.534 5.572 1.00 0.00 O ATOM 391 CB SER A 29 -2.774 8.691 3.764 1.00 0.00 C ATOM 392 OG SER A 29 -1.702 8.093 3.056 1.00 0.00 O ATOM 0 H SER A 29 -0.712 9.020 5.622 1.00 0.00 H new ATOM 0 HA SER A 29 -3.642 8.607 5.729 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.722 8.321 3.374 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.763 9.769 3.604 1.00 0.00 H new ATOM 0 HG SER A 29 -1.786 8.298 2.101 1.00 0.00 H new ATOM 398 N SER A 30 -3.398 6.095 5.557 1.00 0.00 N ATOM 399 CA SER A 30 -3.226 4.662 5.766 1.00 0.00 C ATOM 400 C SER A 30 -3.656 3.877 4.530 1.00 0.00 C ATOM 401 O SER A 30 -4.473 4.345 3.737 1.00 0.00 O ATOM 402 CB SER A 30 -4.031 4.202 6.983 1.00 0.00 C ATOM 403 OG SER A 30 -5.415 4.443 6.798 1.00 0.00 O ATOM 0 H SER A 30 -4.369 6.396 5.479 1.00 0.00 H new ATOM 0 HA SER A 30 -2.168 4.471 5.946 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.863 3.139 7.153 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.683 4.726 7.873 1.00 0.00 H new ATOM 0 HG SER A 30 -5.908 4.139 7.588 1.00 0.00 H new ATOM 409 N VAL A 31 -3.100 2.681 4.374 1.00 0.00 N ATOM 410 CA VAL A 31 -3.425 1.828 3.237 1.00 0.00 C ATOM 411 C VAL A 31 -3.981 0.486 3.697 1.00 0.00 C ATOM 412 O VAL A 31 -3.359 -0.214 4.496 1.00 0.00 O ATOM 413 CB VAL A 31 -2.192 1.583 2.348 1.00 0.00 C ATOM 414 CG1 VAL A 31 -2.500 0.544 1.281 1.00 0.00 C ATOM 415 CG2 VAL A 31 -1.724 2.885 1.715 1.00 0.00 C ATOM 0 H VAL A 31 -2.421 2.280 5.021 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.184 2.352 2.656 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.386 1.199 2.974 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -1.617 0.384 0.663 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.783 -0.394 1.758 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.321 0.896 0.657 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.852 2.693 1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.525 3.300 1.103 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.460 3.596 2.498 1.00 0.00 H new ATOM 425 N ALA A 32 -5.156 0.132 3.187 1.00 0.00 N ATOM 426 CA ALA A 32 -5.795 -1.129 3.543 1.00 0.00 C ATOM 427 C ALA A 32 -4.960 -2.319 3.079 1.00 0.00 C ATOM 428 O ALA A 32 -5.019 -2.713 1.915 1.00 0.00 O ATOM 429 CB ALA A 32 -7.193 -1.199 2.948 1.00 0.00 C ATOM 0 H ALA A 32 -5.685 0.701 2.526 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.872 -1.174 4.629 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -7.658 -2.146 3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -7.794 -0.375 3.333 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -7.130 -1.126 1.862 1.00 0.00 H new ATOM 435 N ALA A 33 -4.184 -2.884 3.998 1.00 0.00 N ATOM 436 CA ALA A 33 -3.339 -4.029 3.682 1.00 0.00 C ATOM 437 C ALA A 33 -3.412 -5.085 4.780 1.00 0.00 C ATOM 438 O ALA A 33 -3.500 -4.775 5.969 1.00 0.00 O ATOM 439 CB ALA A 33 -1.900 -3.581 3.473 1.00 0.00 C ATOM 0 H ALA A 33 -4.123 -2.568 4.966 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.707 -4.477 2.759 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -1.280 -4.446 3.238 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -1.857 -2.869 2.649 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -1.531 -3.107 4.382 1.00 0.00 H new ATOM 445 N PRO A 34 -3.377 -6.364 4.377 1.00 0.00 N ATOM 446 CA PRO A 34 -3.439 -7.491 5.311 1.00 0.00 C ATOM 447 C PRO A 34 -2.172 -7.619 6.151 1.00 0.00 C ATOM 448 O PRO A 34 -1.200 -6.894 5.938 1.00 0.00 O ATOM 449 CB PRO A 34 -3.597 -8.705 4.393 1.00 0.00 C ATOM 450 CG PRO A 34 -2.998 -8.281 3.097 1.00 0.00 C ATOM 451 CD PRO A 34 -3.274 -6.807 2.976 1.00 0.00 C ATOM 0 HA PRO A 34 -4.248 -7.377 6.033 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -3.085 -9.577 4.799 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -4.646 -8.977 4.274 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -1.927 -8.480 3.079 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -3.439 -8.830 2.265 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -2.472 -6.290 2.449 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -4.194 -6.614 2.425 1.00 0.00 H new ATOM 459 N SER A 35 -2.190 -8.544 7.103 1.00 0.00 N ATOM 460 CA SER A 35 -1.043 -8.765 7.977 1.00 0.00 C ATOM 461 C SER A 35 -0.519 -10.191 7.836 1.00 0.00 C ATOM 462 O SER A 35 0.630 -10.478 8.174 1.00 0.00 O ATOM 463 CB SER A 35 -1.423 -8.490 9.433 1.00 0.00 C ATOM 464 OG SER A 35 -2.443 -9.371 9.868 1.00 0.00 O ATOM 0 H SER A 35 -2.986 -9.154 7.290 1.00 0.00 H new ATOM 0 HA SER A 35 -0.253 -8.075 7.679 1.00 0.00 H new ATOM 0 HB2 SER A 35 -0.545 -8.603 10.069 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.761 -7.459 9.536 1.00 0.00 H new ATOM 0 HG SER A 35 -2.667 -9.176 10.802 1.00 0.00 H new ATOM 470 N TRP A 36 -1.370 -11.080 7.338 1.00 0.00 N ATOM 471 CA TRP A 36 -0.995 -12.477 7.152 1.00 0.00 C ATOM 472 C TRP A 36 0.173 -12.603 6.180 1.00 0.00 C ATOM 473 O TRP A 36 0.850 -13.631 6.137 1.00 0.00 O ATOM 474 CB TRP A 36 -2.189 -13.285 6.641 1.00 0.00 C ATOM 475 CG TRP A 36 -2.838 -12.683 5.432 1.00 0.00 C ATOM 476 CD1 TRP A 36 -3.827 -11.741 5.416 1.00 0.00 C ATOM 477 CD2 TRP A 36 -2.546 -12.983 4.063 1.00 0.00 C ATOM 478 NE1 TRP A 36 -4.167 -11.438 4.119 1.00 0.00 N ATOM 479 CE2 TRP A 36 -3.395 -12.186 3.271 1.00 0.00 C ATOM 480 CE3 TRP A 36 -1.647 -13.845 3.429 1.00 0.00 C ATOM 481 CZ2 TRP A 36 -3.372 -12.229 1.879 1.00 0.00 C ATOM 482 CZ3 TRP A 36 -1.626 -13.887 2.048 1.00 0.00 C ATOM 483 CH2 TRP A 36 -2.482 -13.083 1.286 1.00 0.00 C ATOM 0 H TRP A 36 -2.325 -10.859 7.056 1.00 0.00 H new ATOM 0 HA TRP A 36 -0.684 -12.874 8.118 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -1.859 -14.296 6.402 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -2.929 -13.371 7.437 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -4.276 -11.299 6.293 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -4.879 -10.765 3.835 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -0.981 -14.467 4.008 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -4.033 -11.611 1.289 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -0.937 -14.552 1.548 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -2.439 -13.138 0.208 1.00 0.00 H new ATOM 494 N LEU A 37 0.407 -11.550 5.403 1.00 0.00 N ATOM 495 CA LEU A 37 1.494 -11.543 4.431 1.00 0.00 C ATOM 496 C LEU A 37 2.589 -10.566 4.847 1.00 0.00 C ATOM 497 O LEU A 37 3.375 -10.108 4.016 1.00 0.00 O ATOM 498 CB LEU A 37 0.964 -11.175 3.045 1.00 0.00 C ATOM 499 CG LEU A 37 -0.023 -10.007 2.994 1.00 0.00 C ATOM 500 CD1 LEU A 37 0.702 -8.686 3.196 1.00 0.00 C ATOM 501 CD2 LEU A 37 -0.779 -10.006 1.673 1.00 0.00 C ATOM 0 H LEU A 37 -0.142 -10.691 5.428 1.00 0.00 H new ATOM 0 HA LEU A 37 1.922 -12.545 4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.813 -10.936 2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.480 -12.053 2.618 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.744 -10.129 3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.016 -7.867 3.157 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.197 -8.688 4.167 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.445 -8.555 2.410 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.477 -9.169 1.654 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.072 -9.908 0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.331 -10.940 1.569 1.00 0.00 H new ATOM 513 N HIS A 38 2.636 -10.251 6.137 1.00 0.00 N ATOM 514 CA HIS A 38 3.636 -9.329 6.663 1.00 0.00 C ATOM 515 C HIS A 38 5.045 -9.870 6.436 1.00 0.00 C ATOM 516 O HIS A 38 5.949 -9.130 6.046 1.00 0.00 O ATOM 517 CB HIS A 38 3.405 -9.089 8.155 1.00 0.00 C ATOM 518 CG HIS A 38 2.432 -7.987 8.440 1.00 0.00 C ATOM 519 ND1 HIS A 38 1.922 -7.026 7.635 1.00 0.00 N flip ATOM 520 CD2 HIS A 38 1.873 -7.780 9.683 1.00 0.00 C flip ATOM 521 CE1 HIS A 38 1.070 -6.265 8.397 1.00 0.00 C flip ATOM 522 NE2 HIS A 38 1.058 -6.741 9.630 1.00 0.00 N flip ATOM 0 H HIS A 38 1.993 -10.621 6.838 1.00 0.00 H new ATOM 0 HA HIS A 38 3.538 -8.383 6.131 1.00 0.00 H new ATOM 0 HB2 HIS A 38 3.042 -10.010 8.611 1.00 0.00 H new ATOM 0 HB3 HIS A 38 4.358 -8.853 8.629 1.00 0.00 H new ATOM 0 HD2 HIS A 38 2.070 -8.374 10.563 1.00 0.00 H new ATOM 0 HE1 HIS A 38 0.502 -5.416 8.046 1.00 0.00 H new ATOM 0 HE2 HIS A 38 0.513 -6.370 10.408 1.00 0.00 H new ATOM 530 N ARG A 39 5.226 -11.163 6.682 1.00 0.00 N ATOM 531 CA ARG A 39 6.524 -11.801 6.506 1.00 0.00 C ATOM 532 C ARG A 39 7.000 -11.677 5.062 1.00 0.00 C ATOM 533 O ARG A 39 8.179 -11.866 4.767 1.00 0.00 O ATOM 534 CB ARG A 39 6.450 -13.276 6.905 1.00 0.00 C ATOM 535 CG ARG A 39 5.699 -14.140 5.904 1.00 0.00 C ATOM 536 CD ARG A 39 6.202 -15.575 5.920 1.00 0.00 C ATOM 537 NE ARG A 39 5.663 -16.331 7.047 1.00 0.00 N ATOM 538 CZ ARG A 39 5.958 -17.604 7.286 1.00 0.00 C ATOM 539 NH1 ARG A 39 6.783 -18.260 6.481 1.00 0.00 N ATOM 540 NH2 ARG A 39 5.428 -18.225 8.332 1.00 0.00 N ATOM 0 H ARG A 39 4.489 -11.790 7.004 1.00 0.00 H new ATOM 0 HA ARG A 39 7.240 -11.293 7.151 1.00 0.00 H new ATOM 0 HB2 ARG A 39 7.462 -13.664 7.020 1.00 0.00 H new ATOM 0 HB3 ARG A 39 5.965 -13.357 7.878 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.634 -14.124 6.135 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.815 -13.724 4.903 1.00 0.00 H new ATOM 0 HD2 ARG A 39 5.925 -16.067 4.988 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.291 -15.577 5.970 1.00 0.00 H new ATOM 0 HE ARG A 39 5.025 -15.856 7.686 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.193 -17.787 5.676 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.007 -19.237 6.667 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.793 -17.725 8.954 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.656 -19.202 8.514 1.00 0.00 H new ATOM 554 N PHE A 40 6.073 -11.357 4.164 1.00 0.00 N ATOM 555 CA PHE A 40 6.396 -11.209 2.751 1.00 0.00 C ATOM 556 C PHE A 40 6.476 -9.735 2.363 1.00 0.00 C ATOM 557 O PHE A 40 7.309 -9.342 1.545 1.00 0.00 O ATOM 558 CB PHE A 40 5.349 -11.918 1.889 1.00 0.00 C ATOM 559 CG PHE A 40 5.327 -13.408 2.078 1.00 0.00 C ATOM 560 CD1 PHE A 40 6.470 -14.163 1.872 1.00 0.00 C ATOM 561 CD2 PHE A 40 4.163 -14.053 2.462 1.00 0.00 C ATOM 562 CE1 PHE A 40 6.452 -15.534 2.045 1.00 0.00 C ATOM 563 CE2 PHE A 40 4.139 -15.424 2.637 1.00 0.00 C ATOM 564 CZ PHE A 40 5.286 -16.165 2.430 1.00 0.00 C ATOM 0 H PHE A 40 5.092 -11.195 4.391 1.00 0.00 H new ATOM 0 HA PHE A 40 7.370 -11.666 2.577 1.00 0.00 H new ATOM 0 HB2 PHE A 40 4.364 -11.515 2.124 1.00 0.00 H new ATOM 0 HB3 PHE A 40 5.543 -11.696 0.840 1.00 0.00 H new ATOM 0 HD1 PHE A 40 7.386 -13.675 1.573 1.00 0.00 H new ATOM 0 HD2 PHE A 40 3.264 -13.478 2.627 1.00 0.00 H new ATOM 0 HE1 PHE A 40 7.349 -16.111 1.879 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.225 -15.915 2.935 1.00 0.00 H new ATOM 0 HZ PHE A 40 5.271 -17.236 2.569 1.00 0.00 H new ATOM 574 N ILE A 41 5.605 -8.926 2.955 1.00 0.00 N ATOM 575 CA ILE A 41 5.578 -7.496 2.672 1.00 0.00 C ATOM 576 C ILE A 41 6.814 -6.801 3.232 1.00 0.00 C ATOM 577 O ILE A 41 7.344 -5.871 2.623 1.00 0.00 O ATOM 578 CB ILE A 41 4.319 -6.830 3.259 1.00 0.00 C ATOM 579 CG1 ILE A 41 3.963 -5.572 2.464 1.00 0.00 C ATOM 580 CG2 ILE A 41 4.534 -6.493 4.727 1.00 0.00 C ATOM 581 CD1 ILE A 41 2.527 -5.132 2.642 1.00 0.00 C ATOM 0 H ILE A 41 4.909 -9.235 3.633 1.00 0.00 H new ATOM 0 HA ILE A 41 5.564 -7.389 1.587 1.00 0.00 H new ATOM 0 HB ILE A 41 3.487 -7.531 3.185 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.624 -4.760 2.768 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.150 -5.755 1.406 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.636 -6.023 5.128 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.744 -7.407 5.283 1.00 0.00 H new ATOM 0 HG23 ILE A 41 5.376 -5.808 4.823 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.345 -4.235 2.050 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.859 -5.927 2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.340 -4.916 3.694 1.00 0.00 H new ATOM 593 N ILE A 42 7.270 -7.260 4.392 1.00 0.00 N ATOM 594 CA ILE A 42 8.446 -6.684 5.032 1.00 0.00 C ATOM 595 C ILE A 42 9.728 -7.169 4.363 1.00 0.00 C ATOM 596 O ILE A 42 10.573 -6.370 3.963 1.00 0.00 O ATOM 597 CB ILE A 42 8.498 -7.031 6.532 1.00 0.00 C ATOM 598 CG1 ILE A 42 7.354 -6.341 7.277 1.00 0.00 C ATOM 599 CG2 ILE A 42 9.842 -6.630 7.121 1.00 0.00 C ATOM 600 CD1 ILE A 42 7.094 -6.918 8.651 1.00 0.00 C ATOM 0 H ILE A 42 6.843 -8.029 4.908 1.00 0.00 H new ATOM 0 HA ILE A 42 8.368 -5.602 4.921 1.00 0.00 H new ATOM 0 HB ILE A 42 8.381 -8.109 6.646 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.582 -5.280 7.375 1.00 0.00 H new ATOM 0 HG13 ILE A 42 6.444 -6.418 6.681 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.864 -6.881 8.181 1.00 0.00 H new ATOM 0 HG22 ILE A 42 10.639 -7.164 6.605 1.00 0.00 H new ATOM 0 HG23 ILE A 42 9.987 -5.557 6.999 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.270 -6.381 9.121 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.834 -7.973 8.560 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.990 -6.817 9.264 1.00 0.00 H new ATOM 612 N GLY A 43 9.865 -8.486 4.246 1.00 0.00 N ATOM 613 CA GLY A 43 11.046 -9.057 3.624 1.00 0.00 C ATOM 614 C GLY A 43 11.894 -9.844 4.604 1.00 0.00 C ATOM 615 O GLY A 43 11.975 -9.500 5.783 1.00 0.00 O ATOM 0 H GLY A 43 9.180 -9.168 4.571 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.742 -9.709 2.805 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.646 -8.258 3.189 1.00 0.00 H new ATOM 619 N LYS A 44 12.527 -10.905 4.116 1.00 0.00 N ATOM 620 CA LYS A 44 13.373 -11.745 4.955 1.00 0.00 C ATOM 621 C LYS A 44 14.411 -10.905 5.694 1.00 0.00 C ATOM 622 O LYS A 44 14.487 -10.934 6.923 1.00 0.00 O ATOM 623 CB LYS A 44 14.073 -12.809 4.107 1.00 0.00 C ATOM 624 CG LYS A 44 15.134 -13.590 4.864 1.00 0.00 C ATOM 625 CD LYS A 44 14.555 -14.837 5.509 1.00 0.00 C ATOM 626 CE LYS A 44 14.057 -14.555 6.919 1.00 0.00 C ATOM 627 NZ LYS A 44 12.623 -14.156 6.931 1.00 0.00 N ATOM 0 H LYS A 44 12.470 -11.204 3.142 1.00 0.00 H new ATOM 0 HA LYS A 44 12.737 -12.237 5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 44 13.327 -13.505 3.723 1.00 0.00 H new ATOM 0 HB3 LYS A 44 14.534 -12.328 3.244 1.00 0.00 H new ATOM 0 HG2 LYS A 44 15.936 -13.871 4.182 1.00 0.00 H new ATOM 0 HG3 LYS A 44 15.577 -12.955 5.631 1.00 0.00 H new ATOM 0 HD2 LYS A 44 13.733 -15.215 4.900 1.00 0.00 H new ATOM 0 HD3 LYS A 44 15.314 -15.618 5.540 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.192 -15.443 7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 44 14.658 -13.763 7.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 12.529 -13.211 7.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 12.260 -14.137 5.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 12.077 -14.841 7.491 1.00 0.00 H new ATOM 641 N LYS A 45 15.207 -10.158 4.938 1.00 0.00 N ATOM 642 CA LYS A 45 16.238 -9.307 5.520 1.00 0.00 C ATOM 643 C LYS A 45 15.928 -7.833 5.280 1.00 0.00 C ATOM 644 O LYS A 45 16.809 -7.054 4.919 1.00 0.00 O ATOM 645 CB LYS A 45 17.607 -9.653 4.930 1.00 0.00 C ATOM 646 CG LYS A 45 18.773 -9.164 5.771 1.00 0.00 C ATOM 647 CD LYS A 45 20.107 -9.558 5.157 1.00 0.00 C ATOM 648 CE LYS A 45 21.268 -8.878 5.865 1.00 0.00 C ATOM 649 NZ LYS A 45 22.579 -9.465 5.469 1.00 0.00 N ATOM 0 H LYS A 45 15.158 -10.124 3.920 1.00 0.00 H new ATOM 0 HA LYS A 45 16.256 -9.486 6.595 1.00 0.00 H new ATOM 0 HB2 LYS A 45 17.681 -10.734 4.815 1.00 0.00 H new ATOM 0 HB3 LYS A 45 17.683 -9.221 3.932 1.00 0.00 H new ATOM 0 HG2 LYS A 45 18.723 -8.080 5.869 1.00 0.00 H new ATOM 0 HG3 LYS A 45 18.697 -9.579 6.776 1.00 0.00 H new ATOM 0 HD2 LYS A 45 20.229 -10.640 5.212 1.00 0.00 H new ATOM 0 HD3 LYS A 45 20.116 -9.290 4.101 1.00 0.00 H new ATOM 0 HE2 LYS A 45 21.262 -7.813 5.633 1.00 0.00 H new ATOM 0 HE3 LYS A 45 21.140 -8.970 6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 23.345 -8.975 5.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 22.595 -10.476 5.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 22.713 -9.355 4.444 1.00 0.00 H new ATOM 663 N GLY A 46 14.669 -7.458 5.486 1.00 0.00 N ATOM 664 CA GLY A 46 14.265 -6.077 5.288 1.00 0.00 C ATOM 665 C GLY A 46 14.769 -5.508 3.976 1.00 0.00 C ATOM 666 O GLY A 46 15.705 -4.708 3.959 1.00 0.00 O ATOM 0 H GLY A 46 13.922 -8.085 5.786 1.00 0.00 H new ATOM 0 HA2 GLY A 46 13.177 -6.012 5.315 1.00 0.00 H new ATOM 0 HA3 GLY A 46 14.640 -5.470 6.112 1.00 0.00 H new ATOM 670 N GLN A 47 14.149 -5.922 2.876 1.00 0.00 N ATOM 671 CA GLN A 47 14.542 -5.449 1.554 1.00 0.00 C ATOM 672 C GLN A 47 13.420 -4.646 0.907 1.00 0.00 C ATOM 673 O GLN A 47 13.623 -3.511 0.477 1.00 0.00 O ATOM 674 CB GLN A 47 14.921 -6.630 0.659 1.00 0.00 C ATOM 675 CG GLN A 47 15.927 -6.274 -0.425 1.00 0.00 C ATOM 676 CD GLN A 47 17.145 -5.557 0.123 1.00 0.00 C ATOM 677 OE1 GLN A 47 17.547 -5.775 1.266 1.00 0.00 O ATOM 678 NE2 GLN A 47 17.741 -4.696 -0.693 1.00 0.00 N ATOM 0 H GLN A 47 13.373 -6.584 2.874 1.00 0.00 H new ATOM 0 HA GLN A 47 15.408 -4.798 1.672 1.00 0.00 H new ATOM 0 HB2 GLN A 47 15.333 -7.427 1.278 1.00 0.00 H new ATOM 0 HB3 GLN A 47 14.019 -7.024 0.191 1.00 0.00 H new ATOM 0 HG2 GLN A 47 16.244 -7.184 -0.934 1.00 0.00 H new ATOM 0 HG3 GLN A 47 15.444 -5.643 -1.171 1.00 0.00 H new ATOM 0 HE21 GLN A 47 17.374 -4.546 -1.633 1.00 0.00 H new ATOM 0 HE22 GLN A 47 18.566 -4.184 -0.380 1.00 0.00 H new ATOM 687 N ASN A 48 12.233 -5.242 0.842 1.00 0.00 N ATOM 688 CA ASN A 48 11.078 -4.581 0.246 1.00 0.00 C ATOM 689 C ASN A 48 10.846 -3.214 0.881 1.00 0.00 C ATOM 690 O ASN A 48 10.553 -2.237 0.190 1.00 0.00 O ATOM 691 CB ASN A 48 9.829 -5.450 0.406 1.00 0.00 C ATOM 692 CG ASN A 48 9.941 -6.767 -0.336 1.00 0.00 C ATOM 693 OD1 ASN A 48 10.337 -6.805 -1.501 1.00 0.00 O ATOM 694 ND2 ASN A 48 9.593 -7.858 0.338 1.00 0.00 N ATOM 0 H ASN A 48 12.046 -6.181 1.195 1.00 0.00 H new ATOM 0 HA ASN A 48 11.279 -4.438 -0.816 1.00 0.00 H new ATOM 0 HB2 ASN A 48 9.660 -5.646 1.465 1.00 0.00 H new ATOM 0 HB3 ASN A 48 8.960 -4.903 0.040 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.649 -8.773 -0.109 1.00 0.00 H new ATOM 0 HD22 ASN A 48 9.270 -7.780 1.302 1.00 0.00 H new ATOM 701 N LEU A 49 10.976 -3.151 2.201 1.00 0.00 N ATOM 702 CA LEU A 49 10.782 -1.904 2.932 1.00 0.00 C ATOM 703 C LEU A 49 12.033 -1.033 2.866 1.00 0.00 C ATOM 704 O LEU A 49 11.958 0.156 2.557 1.00 0.00 O ATOM 705 CB LEU A 49 10.424 -2.193 4.390 1.00 0.00 C ATOM 706 CG LEU A 49 8.971 -2.587 4.660 1.00 0.00 C ATOM 707 CD1 LEU A 49 8.804 -3.057 6.096 1.00 0.00 C ATOM 708 CD2 LEU A 49 8.040 -1.420 4.367 1.00 0.00 C ATOM 0 H LEU A 49 11.215 -3.950 2.788 1.00 0.00 H new ATOM 0 HA LEU A 49 9.960 -1.363 2.464 1.00 0.00 H new ATOM 0 HB2 LEU A 49 11.069 -2.994 4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 49 10.655 -1.308 4.982 1.00 0.00 H new ATOM 0 HG LEU A 49 8.708 -3.411 3.997 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.764 -3.333 6.270 1.00 0.00 H new ATOM 0 HD12 LEU A 49 9.443 -3.922 6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 49 9.085 -2.253 6.777 1.00 0.00 H new ATOM 0 HD21 LEU A 49 7.010 -1.718 4.564 1.00 0.00 H new ATOM 0 HD22 LEU A 49 8.302 -0.576 5.005 1.00 0.00 H new ATOM 0 HD23 LEU A 49 8.139 -1.129 3.321 1.00 0.00 H new ATOM 720 N ALA A 50 13.182 -1.634 3.157 1.00 0.00 N ATOM 721 CA ALA A 50 14.449 -0.915 3.128 1.00 0.00 C ATOM 722 C ALA A 50 14.608 -0.137 1.826 1.00 0.00 C ATOM 723 O ALA A 50 15.311 0.873 1.775 1.00 0.00 O ATOM 724 CB ALA A 50 15.609 -1.882 3.311 1.00 0.00 C ATOM 0 H ALA A 50 13.261 -2.618 3.416 1.00 0.00 H new ATOM 0 HA ALA A 50 14.452 -0.201 3.951 1.00 0.00 H new ATOM 0 HB1 ALA A 50 16.549 -1.331 3.287 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.511 -2.391 4.270 1.00 0.00 H new ATOM 0 HB3 ALA A 50 15.599 -2.618 2.507 1.00 0.00 H new ATOM 730 N LYS A 51 13.952 -0.613 0.774 1.00 0.00 N ATOM 731 CA LYS A 51 14.018 0.038 -0.530 1.00 0.00 C ATOM 732 C LYS A 51 13.129 1.277 -0.566 1.00 0.00 C ATOM 733 O LYS A 51 13.607 2.388 -0.800 1.00 0.00 O ATOM 734 CB LYS A 51 13.598 -0.936 -1.632 1.00 0.00 C ATOM 735 CG LYS A 51 14.283 -0.682 -2.964 1.00 0.00 C ATOM 736 CD LYS A 51 13.623 0.457 -3.722 1.00 0.00 C ATOM 737 CE LYS A 51 14.362 0.769 -5.014 1.00 0.00 C ATOM 738 NZ LYS A 51 14.104 -0.257 -6.061 1.00 0.00 N ATOM 0 H LYS A 51 13.367 -1.449 0.798 1.00 0.00 H new ATOM 0 HA LYS A 51 15.049 0.347 -0.701 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.818 -1.954 -1.309 1.00 0.00 H new ATOM 0 HB3 LYS A 51 12.519 -0.871 -1.770 1.00 0.00 H new ATOM 0 HG2 LYS A 51 15.334 -0.447 -2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 51 14.253 -1.588 -3.569 1.00 0.00 H new ATOM 0 HD2 LYS A 51 12.589 0.195 -3.947 1.00 0.00 H new ATOM 0 HD3 LYS A 51 13.596 1.347 -3.093 1.00 0.00 H new ATOM 0 HE2 LYS A 51 14.054 1.748 -5.381 1.00 0.00 H new ATOM 0 HE3 LYS A 51 15.432 0.825 -4.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 14.625 -0.009 -6.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 14.421 -1.187 -5.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 13.086 -0.293 -6.269 1.00 0.00 H new ATOM 752 N ILE A 52 11.836 1.079 -0.332 1.00 0.00 N ATOM 753 CA ILE A 52 10.882 2.180 -0.335 1.00 0.00 C ATOM 754 C ILE A 52 11.370 3.332 0.539 1.00 0.00 C ATOM 755 O ILE A 52 11.529 4.459 0.069 1.00 0.00 O ATOM 756 CB ILE A 52 9.497 1.726 0.160 1.00 0.00 C ATOM 757 CG1 ILE A 52 8.977 0.571 -0.700 1.00 0.00 C ATOM 758 CG2 ILE A 52 8.519 2.891 0.137 1.00 0.00 C ATOM 759 CD1 ILE A 52 7.770 -0.124 -0.111 1.00 0.00 C ATOM 0 H ILE A 52 11.425 0.166 -0.138 1.00 0.00 H new ATOM 0 HA ILE A 52 10.796 2.521 -1.367 1.00 0.00 H new ATOM 0 HB ILE A 52 9.592 1.376 1.188 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.721 0.952 -1.689 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.776 -0.158 -0.836 1.00 0.00 H new ATOM 0 HG21 ILE A 52 7.544 2.555 0.490 1.00 0.00 H new ATOM 0 HG22 ILE A 52 8.885 3.686 0.786 1.00 0.00 H new ATOM 0 HG23 ILE A 52 8.426 3.268 -0.881 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.456 -0.931 -0.773 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.027 -0.535 0.865 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.956 0.592 -0.000 1.00 0.00 H new ATOM 771 N THR A 53 11.608 3.041 1.814 1.00 0.00 N ATOM 772 CA THR A 53 12.078 4.051 2.754 1.00 0.00 C ATOM 773 C THR A 53 13.282 4.801 2.198 1.00 0.00 C ATOM 774 O THR A 53 13.409 6.011 2.380 1.00 0.00 O ATOM 775 CB THR A 53 12.457 3.424 4.108 1.00 0.00 C ATOM 776 OG1 THR A 53 13.062 4.411 4.952 1.00 0.00 O ATOM 777 CG2 THR A 53 13.415 2.257 3.916 1.00 0.00 C ATOM 0 H THR A 53 11.483 2.113 2.220 1.00 0.00 H new ATOM 0 HA THR A 53 11.256 4.751 2.904 1.00 0.00 H new ATOM 0 HB THR A 53 11.547 3.052 4.579 1.00 0.00 H new ATOM 0 HG1 THR A 53 13.299 4.005 5.812 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.668 1.831 4.887 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.941 1.495 3.297 1.00 0.00 H new ATOM 0 HG23 THR A 53 14.323 2.609 3.426 1.00 0.00 H new ATOM 785 N GLN A 54 14.164 4.074 1.518 1.00 0.00 N ATOM 786 CA GLN A 54 15.359 4.672 0.935 1.00 0.00 C ATOM 787 C GLN A 54 14.990 5.693 -0.136 1.00 0.00 C ATOM 788 O GLN A 54 15.470 6.826 -0.118 1.00 0.00 O ATOM 789 CB GLN A 54 16.257 3.589 0.336 1.00 0.00 C ATOM 790 CG GLN A 54 17.453 4.141 -0.422 1.00 0.00 C ATOM 791 CD GLN A 54 18.631 4.441 0.484 1.00 0.00 C ATOM 792 OE1 GLN A 54 19.558 3.638 0.603 1.00 0.00 O ATOM 793 NE2 GLN A 54 18.602 5.601 1.128 1.00 0.00 N ATOM 0 H GLN A 54 14.073 3.071 1.358 1.00 0.00 H new ATOM 0 HA GLN A 54 15.901 5.185 1.729 1.00 0.00 H new ATOM 0 HB2 GLN A 54 16.613 2.940 1.136 1.00 0.00 H new ATOM 0 HB3 GLN A 54 15.665 2.969 -0.338 1.00 0.00 H new ATOM 0 HG2 GLN A 54 17.759 3.423 -1.183 1.00 0.00 H new ATOM 0 HG3 GLN A 54 17.159 5.052 -0.943 1.00 0.00 H new ATOM 0 HE21 GLN A 54 17.814 6.236 1.000 1.00 0.00 H new ATOM 0 HE22 GLN A 54 19.368 5.858 1.751 1.00 0.00 H new ATOM 802 N GLN A 55 14.136 5.283 -1.068 1.00 0.00 N ATOM 803 CA GLN A 55 13.704 6.163 -2.148 1.00 0.00 C ATOM 804 C GLN A 55 12.885 7.329 -1.606 1.00 0.00 C ATOM 805 O GLN A 55 12.930 8.435 -2.143 1.00 0.00 O ATOM 806 CB GLN A 55 12.880 5.380 -3.172 1.00 0.00 C ATOM 807 CG GLN A 55 12.992 5.925 -4.587 1.00 0.00 C ATOM 808 CD GLN A 55 13.147 7.433 -4.620 1.00 0.00 C ATOM 809 OE1 GLN A 55 14.262 7.954 -4.626 1.00 0.00 O ATOM 810 NE2 GLN A 55 12.025 8.143 -4.644 1.00 0.00 N ATOM 0 H GLN A 55 13.730 4.348 -1.097 1.00 0.00 H new ATOM 0 HA GLN A 55 14.594 6.563 -2.635 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.202 4.339 -3.166 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.833 5.391 -2.869 1.00 0.00 H new ATOM 0 HG2 GLN A 55 13.846 5.465 -5.083 1.00 0.00 H new ATOM 0 HG3 GLN A 55 12.104 5.642 -5.153 1.00 0.00 H new ATOM 0 HE21 GLN A 55 11.122 7.669 -4.638 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.067 9.162 -4.669 1.00 0.00 H new ATOM 819 N MET A 56 12.138 7.075 -0.536 1.00 0.00 N ATOM 820 CA MET A 56 11.310 8.106 0.079 1.00 0.00 C ATOM 821 C MET A 56 11.508 8.131 1.592 1.00 0.00 C ATOM 822 O MET A 56 10.724 7.566 2.354 1.00 0.00 O ATOM 823 CB MET A 56 9.835 7.869 -0.249 1.00 0.00 C ATOM 824 CG MET A 56 9.487 8.131 -1.705 1.00 0.00 C ATOM 825 SD MET A 56 8.107 7.124 -2.283 1.00 0.00 S ATOM 826 CE MET A 56 8.972 5.878 -3.234 1.00 0.00 C ATOM 0 H MET A 56 12.089 6.165 -0.078 1.00 0.00 H new ATOM 0 HA MET A 56 11.615 9.071 -0.326 1.00 0.00 H new ATOM 0 HB2 MET A 56 9.577 6.839 -0.002 1.00 0.00 H new ATOM 0 HB3 MET A 56 9.223 8.511 0.384 1.00 0.00 H new ATOM 0 HG2 MET A 56 9.240 9.185 -1.831 1.00 0.00 H new ATOM 0 HG3 MET A 56 10.361 7.932 -2.325 1.00 0.00 H new ATOM 0 HE1 MET A 56 8.448 4.926 -3.149 1.00 0.00 H new ATOM 0 HE2 MET A 56 9.009 6.180 -4.281 1.00 0.00 H new ATOM 0 HE3 MET A 56 9.987 5.769 -2.852 1.00 0.00 H new ATOM 836 N PRO A 57 12.581 8.801 2.038 1.00 0.00 N ATOM 837 CA PRO A 57 12.906 8.916 3.463 1.00 0.00 C ATOM 838 C PRO A 57 11.918 9.801 4.214 1.00 0.00 C ATOM 839 O PRO A 57 11.624 9.566 5.386 1.00 0.00 O ATOM 840 CB PRO A 57 14.298 9.551 3.458 1.00 0.00 C ATOM 841 CG PRO A 57 14.372 10.294 2.170 1.00 0.00 C ATOM 842 CD PRO A 57 13.559 9.499 1.186 1.00 0.00 C ATOM 0 HA PRO A 57 12.864 7.952 3.970 1.00 0.00 H new ATOM 0 HB2 PRO A 57 14.431 10.220 4.309 1.00 0.00 H new ATOM 0 HB3 PRO A 57 15.079 8.793 3.523 1.00 0.00 H new ATOM 0 HG2 PRO A 57 13.975 11.303 2.278 1.00 0.00 H new ATOM 0 HG3 PRO A 57 15.404 10.392 1.835 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.069 10.143 0.456 1.00 0.00 H new ATOM 0 HD3 PRO A 57 14.178 8.797 0.627 1.00 0.00 H new ATOM 850 N LYS A 58 11.409 10.822 3.532 1.00 0.00 N ATOM 851 CA LYS A 58 10.452 11.743 4.133 1.00 0.00 C ATOM 852 C LYS A 58 9.198 11.004 4.589 1.00 0.00 C ATOM 853 O LYS A 58 8.561 11.388 5.570 1.00 0.00 O ATOM 854 CB LYS A 58 10.075 12.842 3.137 1.00 0.00 C ATOM 855 CG LYS A 58 11.199 13.826 2.864 1.00 0.00 C ATOM 856 CD LYS A 58 11.276 14.898 3.938 1.00 0.00 C ATOM 857 CE LYS A 58 10.326 16.049 3.646 1.00 0.00 C ATOM 858 NZ LYS A 58 10.071 16.878 4.856 1.00 0.00 N ATOM 0 H LYS A 58 11.644 11.032 2.562 1.00 0.00 H new ATOM 0 HA LYS A 58 10.922 12.197 5.005 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.771 12.381 2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 58 9.211 13.386 3.519 1.00 0.00 H new ATOM 0 HG2 LYS A 58 12.148 13.291 2.814 1.00 0.00 H new ATOM 0 HG3 LYS A 58 11.045 14.294 1.892 1.00 0.00 H new ATOM 0 HD2 LYS A 58 11.034 14.462 4.907 1.00 0.00 H new ATOM 0 HD3 LYS A 58 12.297 15.275 4.005 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.745 16.675 2.859 1.00 0.00 H new ATOM 0 HE3 LYS A 58 9.382 15.654 3.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 9.419 17.652 4.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.647 16.286 5.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.968 17.276 5.200 1.00 0.00 H new ATOM 872 N VAL A 59 8.849 9.941 3.871 1.00 0.00 N ATOM 873 CA VAL A 59 7.672 9.147 4.204 1.00 0.00 C ATOM 874 C VAL A 59 8.017 8.042 5.195 1.00 0.00 C ATOM 875 O VAL A 59 8.973 7.290 4.996 1.00 0.00 O ATOM 876 CB VAL A 59 7.046 8.516 2.945 1.00 0.00 C ATOM 877 CG1 VAL A 59 5.874 7.624 3.321 1.00 0.00 C ATOM 878 CG2 VAL A 59 6.612 9.598 1.967 1.00 0.00 C ATOM 0 H VAL A 59 9.364 9.610 3.055 1.00 0.00 H new ATOM 0 HA VAL A 59 6.950 9.826 4.658 1.00 0.00 H new ATOM 0 HB VAL A 59 7.799 7.898 2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.445 7.187 2.419 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.220 6.828 3.980 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.116 8.216 3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.172 9.135 1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 59 5.875 10.244 2.443 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.478 10.191 1.673 1.00 0.00 H new ATOM 888 N HIS A 60 7.233 7.947 6.264 1.00 0.00 N ATOM 889 CA HIS A 60 7.455 6.931 7.287 1.00 0.00 C ATOM 890 C HIS A 60 6.450 5.791 7.148 1.00 0.00 C ATOM 891 O HIS A 60 5.241 6.019 7.097 1.00 0.00 O ATOM 892 CB HIS A 60 7.352 7.551 8.681 1.00 0.00 C ATOM 893 CG HIS A 60 8.653 8.081 9.200 1.00 0.00 C ATOM 894 ND1 HIS A 60 9.835 7.374 9.129 1.00 0.00 N ATOM 895 CD2 HIS A 60 8.955 9.257 9.796 1.00 0.00 C ATOM 896 CE1 HIS A 60 10.807 8.092 9.662 1.00 0.00 C ATOM 897 NE2 HIS A 60 10.299 9.239 10.074 1.00 0.00 N ATOM 0 H HIS A 60 6.439 8.561 6.445 1.00 0.00 H new ATOM 0 HA HIS A 60 8.458 6.526 7.151 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.623 8.361 8.656 1.00 0.00 H new ATOM 0 HB3 HIS A 60 6.972 6.802 9.375 1.00 0.00 H new ATOM 0 HD2 HIS A 60 8.267 10.061 10.013 1.00 0.00 H new ATOM 0 HE1 HIS A 60 11.841 7.792 9.746 1.00 0.00 H new ATOM 0 HE2 HIS A 60 10.821 9.990 10.526 1.00 0.00 H new ATOM 905 N ILE A 61 6.959 4.565 7.087 1.00 0.00 N ATOM 906 CA ILE A 61 6.106 3.390 6.954 1.00 0.00 C ATOM 907 C ILE A 61 5.859 2.734 8.309 1.00 0.00 C ATOM 908 O ILE A 61 6.786 2.547 9.096 1.00 0.00 O ATOM 909 CB ILE A 61 6.722 2.352 5.998 1.00 0.00 C ATOM 910 CG1 ILE A 61 7.068 3.002 4.657 1.00 0.00 C ATOM 911 CG2 ILE A 61 5.767 1.185 5.796 1.00 0.00 C ATOM 912 CD1 ILE A 61 8.077 2.219 3.847 1.00 0.00 C ATOM 0 H ILE A 61 7.957 4.359 7.128 1.00 0.00 H new ATOM 0 HA ILE A 61 5.158 3.734 6.541 1.00 0.00 H new ATOM 0 HB ILE A 61 7.641 1.971 6.443 1.00 0.00 H new ATOM 0 HG12 ILE A 61 6.155 3.117 4.072 1.00 0.00 H new ATOM 0 HG13 ILE A 61 7.458 4.003 4.838 1.00 0.00 H new ATOM 0 HG21 ILE A 61 6.217 0.460 5.118 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.567 0.709 6.756 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.832 1.549 5.370 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.274 2.739 2.910 1.00 0.00 H new ATOM 0 HD12 ILE A 61 9.004 2.126 4.412 1.00 0.00 H new ATOM 0 HD13 ILE A 61 7.681 1.226 3.634 1.00 0.00 H new ATOM 924 N GLU A 62 4.603 2.387 8.571 1.00 0.00 N ATOM 925 CA GLU A 62 4.235 1.750 9.831 1.00 0.00 C ATOM 926 C GLU A 62 3.371 0.517 9.585 1.00 0.00 C ATOM 927 O GLU A 62 2.553 0.491 8.665 1.00 0.00 O ATOM 928 CB GLU A 62 3.487 2.740 10.728 1.00 0.00 C ATOM 929 CG GLU A 62 3.022 2.136 12.042 1.00 0.00 C ATOM 930 CD GLU A 62 4.104 2.145 13.105 1.00 0.00 C ATOM 931 OE1 GLU A 62 4.991 1.266 13.055 1.00 0.00 O ATOM 932 OE2 GLU A 62 4.065 3.029 13.985 1.00 0.00 O ATOM 0 H GLU A 62 3.824 2.536 7.929 1.00 0.00 H new ATOM 0 HA GLU A 62 5.151 1.436 10.332 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.136 3.590 10.938 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.622 3.125 10.188 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.156 2.690 12.406 1.00 0.00 H new ATOM 0 HG3 GLU A 62 2.695 1.110 11.870 1.00 0.00 H new ATOM 939 N PHE A 63 3.560 -0.505 10.413 1.00 0.00 N ATOM 940 CA PHE A 63 2.799 -1.743 10.286 1.00 0.00 C ATOM 941 C PHE A 63 2.184 -2.143 11.623 1.00 0.00 C ATOM 942 O PHE A 63 2.894 -2.381 12.602 1.00 0.00 O ATOM 943 CB PHE A 63 3.699 -2.868 9.769 1.00 0.00 C ATOM 944 CG PHE A 63 3.775 -2.933 8.270 1.00 0.00 C ATOM 945 CD1 PHE A 63 2.781 -3.561 7.539 1.00 0.00 C ATOM 946 CD2 PHE A 63 4.843 -2.365 7.593 1.00 0.00 C ATOM 947 CE1 PHE A 63 2.849 -3.623 6.160 1.00 0.00 C ATOM 948 CE2 PHE A 63 4.917 -2.423 6.214 1.00 0.00 C ATOM 949 CZ PHE A 63 3.918 -3.052 5.497 1.00 0.00 C ATOM 0 H PHE A 63 4.233 -0.501 11.179 1.00 0.00 H new ATOM 0 HA PHE A 63 1.993 -1.574 9.572 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.703 -2.733 10.170 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.330 -3.821 10.148 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.942 -4.008 8.052 1.00 0.00 H new ATOM 0 HD2 PHE A 63 5.626 -1.872 8.149 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.068 -4.117 5.602 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.755 -1.977 5.698 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.973 -3.097 4.419 1.00 0.00 H new ATOM 959 N THR A 64 0.857 -2.215 11.660 1.00 0.00 N ATOM 960 CA THR A 64 0.144 -2.584 12.876 1.00 0.00 C ATOM 961 C THR A 64 0.119 -4.098 13.060 1.00 0.00 C ATOM 962 O THR A 64 0.180 -4.851 12.090 1.00 0.00 O ATOM 963 CB THR A 64 -1.303 -2.057 12.862 1.00 0.00 C ATOM 964 OG1 THR A 64 -1.979 -2.510 11.683 1.00 0.00 O ATOM 965 CG2 THR A 64 -1.324 -0.535 12.911 1.00 0.00 C ATOM 0 H THR A 64 0.254 -2.022 10.860 1.00 0.00 H new ATOM 0 HA THR A 64 0.681 -2.127 13.708 1.00 0.00 H new ATOM 0 HB THR A 64 -1.815 -2.442 13.744 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.705 -1.962 10.918 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.356 -0.185 12.900 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.835 -0.194 13.823 1.00 0.00 H new ATOM 0 HG23 THR A 64 -0.796 -0.136 12.045 1.00 0.00 H new ATOM 973 N GLU A 65 0.028 -4.535 14.312 1.00 0.00 N ATOM 974 CA GLU A 65 -0.006 -5.959 14.623 1.00 0.00 C ATOM 975 C GLU A 65 -1.405 -6.389 15.053 1.00 0.00 C ATOM 976 O GLU A 65 -1.570 -7.374 15.773 1.00 0.00 O ATOM 977 CB GLU A 65 1.003 -6.288 15.726 1.00 0.00 C ATOM 978 CG GLU A 65 0.722 -5.577 17.039 1.00 0.00 C ATOM 979 CD GLU A 65 1.324 -4.186 17.090 1.00 0.00 C ATOM 980 OE1 GLU A 65 2.569 -4.080 17.094 1.00 0.00 O ATOM 981 OE2 GLU A 65 0.552 -3.205 17.128 1.00 0.00 O ATOM 0 H GLU A 65 -0.023 -3.924 15.127 1.00 0.00 H new ATOM 0 HA GLU A 65 0.262 -6.508 13.720 1.00 0.00 H new ATOM 0 HB2 GLU A 65 1.003 -7.364 15.898 1.00 0.00 H new ATOM 0 HB3 GLU A 65 2.003 -6.020 15.384 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.356 -5.508 17.187 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.119 -6.171 17.862 1.00 0.00 H new ATOM 988 N GLY A 66 -2.412 -5.643 14.609 1.00 0.00 N ATOM 989 CA GLY A 66 -3.783 -5.962 14.959 1.00 0.00 C ATOM 990 C GLY A 66 -4.787 -5.213 14.106 1.00 0.00 C ATOM 991 O GLY A 66 -5.870 -5.723 13.818 1.00 0.00 O ATOM 0 H GLY A 66 -2.302 -4.823 14.013 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.944 -7.034 14.847 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.952 -5.722 16.009 1.00 0.00 H new ATOM 995 N GLU A 67 -4.430 -3.997 13.703 1.00 0.00 N ATOM 996 CA GLU A 67 -5.311 -3.175 12.881 1.00 0.00 C ATOM 997 C GLU A 67 -5.266 -3.622 11.423 1.00 0.00 C ATOM 998 O GLU A 67 -6.082 -3.193 10.606 1.00 0.00 O ATOM 999 CB GLU A 67 -4.916 -1.702 12.987 1.00 0.00 C ATOM 1000 CG GLU A 67 -5.364 -1.042 14.279 1.00 0.00 C ATOM 1001 CD GLU A 67 -6.812 -0.596 14.235 1.00 0.00 C ATOM 1002 OE1 GLU A 67 -7.702 -1.472 14.206 1.00 0.00 O ATOM 1003 OE2 GLU A 67 -7.056 0.629 14.229 1.00 0.00 O ATOM 0 H GLU A 67 -3.537 -3.560 13.932 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.329 -3.297 13.250 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.832 -1.619 12.903 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.344 -1.159 12.144 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.228 -1.740 15.105 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.728 -0.180 14.482 1.00 0.00 H new ATOM 1010 N ASP A 68 -4.309 -4.485 11.103 1.00 0.00 N ATOM 1011 CA ASP A 68 -4.157 -4.991 9.744 1.00 0.00 C ATOM 1012 C ASP A 68 -4.199 -3.851 8.731 1.00 0.00 C ATOM 1013 O ASP A 68 -4.982 -3.877 7.782 1.00 0.00 O ATOM 1014 CB ASP A 68 -5.255 -6.009 9.430 1.00 0.00 C ATOM 1015 CG ASP A 68 -6.542 -5.722 10.180 1.00 0.00 C ATOM 1016 OD1 ASP A 68 -6.664 -6.169 11.340 1.00 0.00 O ATOM 1017 OD2 ASP A 68 -7.426 -5.052 9.608 1.00 0.00 O ATOM 0 H ASP A 68 -3.626 -4.849 11.767 1.00 0.00 H new ATOM 0 HA ASP A 68 -3.186 -5.481 9.672 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -5.454 -6.006 8.358 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -4.904 -7.009 9.686 1.00 0.00 H new ATOM 1022 N LYS A 69 -3.351 -2.850 8.942 1.00 0.00 N ATOM 1023 CA LYS A 69 -3.289 -1.698 8.049 1.00 0.00 C ATOM 1024 C LYS A 69 -1.907 -1.054 8.086 1.00 0.00 C ATOM 1025 O LYS A 69 -1.138 -1.267 9.023 1.00 0.00 O ATOM 1026 CB LYS A 69 -4.354 -0.669 8.436 1.00 0.00 C ATOM 1027 CG LYS A 69 -4.007 0.125 9.683 1.00 0.00 C ATOM 1028 CD LYS A 69 -4.932 1.318 9.860 1.00 0.00 C ATOM 1029 CE LYS A 69 -5.053 1.717 11.323 1.00 0.00 C ATOM 1030 NZ LYS A 69 -3.720 1.850 11.974 1.00 0.00 N ATOM 0 H LYS A 69 -2.697 -2.813 9.724 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.481 -2.046 7.034 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.500 0.021 7.605 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -5.303 -1.182 8.594 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.074 -0.522 10.558 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.975 0.470 9.620 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -4.555 2.161 9.282 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.919 1.077 9.465 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.590 2.663 11.398 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.644 0.972 11.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.776 1.505 12.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.020 1.289 11.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.432 2.849 11.975 1.00 0.00 H new ATOM 1044 N ILE A 70 -1.600 -0.266 7.061 1.00 0.00 N ATOM 1045 CA ILE A 70 -0.312 0.410 6.978 1.00 0.00 C ATOM 1046 C ILE A 70 -0.476 1.922 7.091 1.00 0.00 C ATOM 1047 O ILE A 70 -1.107 2.555 6.243 1.00 0.00 O ATOM 1048 CB ILE A 70 0.414 0.081 5.660 1.00 0.00 C ATOM 1049 CG1 ILE A 70 0.564 -1.433 5.500 1.00 0.00 C ATOM 1050 CG2 ILE A 70 1.775 0.761 5.621 1.00 0.00 C ATOM 1051 CD1 ILE A 70 0.947 -1.857 4.099 1.00 0.00 C ATOM 0 H ILE A 70 -2.226 -0.080 6.277 1.00 0.00 H new ATOM 0 HA ILE A 70 0.288 0.048 7.813 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.183 0.458 4.829 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.320 -1.791 6.199 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.375 -1.914 5.773 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.276 0.519 4.684 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.645 1.841 5.695 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.381 0.411 6.457 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.036 -2.943 4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.180 -1.529 3.397 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.902 -1.405 3.830 1.00 0.00 H new ATOM 1063 N THR A 71 0.098 2.498 8.144 1.00 0.00 N ATOM 1064 CA THR A 71 0.015 3.936 8.367 1.00 0.00 C ATOM 1065 C THR A 71 1.226 4.653 7.781 1.00 0.00 C ATOM 1066 O THR A 71 2.369 4.266 8.025 1.00 0.00 O ATOM 1067 CB THR A 71 -0.085 4.265 9.869 1.00 0.00 C ATOM 1068 OG1 THR A 71 -1.296 3.726 10.409 1.00 0.00 O ATOM 1069 CG2 THR A 71 -0.049 5.769 10.096 1.00 0.00 C ATOM 0 H THR A 71 0.625 1.990 8.855 1.00 0.00 H new ATOM 0 HA THR A 71 -0.888 4.284 7.865 1.00 0.00 H new ATOM 0 HB THR A 71 0.770 3.816 10.375 1.00 0.00 H new ATOM 0 HG1 THR A 71 -1.351 3.938 11.364 1.00 0.00 H new ATOM 0 HG21 THR A 71 -0.121 5.978 11.163 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.887 6.173 9.710 1.00 0.00 H new ATOM 0 HG23 THR A 71 -0.887 6.235 9.578 1.00 0.00 H new ATOM 1077 N LEU A 72 0.968 5.701 7.006 1.00 0.00 N ATOM 1078 CA LEU A 72 2.036 6.475 6.385 1.00 0.00 C ATOM 1079 C LEU A 72 2.085 7.890 6.952 1.00 0.00 C ATOM 1080 O LEU A 72 1.064 8.439 7.363 1.00 0.00 O ATOM 1081 CB LEU A 72 1.841 6.527 4.869 1.00 0.00 C ATOM 1082 CG LEU A 72 2.161 5.240 4.107 1.00 0.00 C ATOM 1083 CD1 LEU A 72 3.623 4.862 4.288 1.00 0.00 C ATOM 1084 CD2 LEU A 72 1.254 4.109 4.566 1.00 0.00 C ATOM 0 H LEU A 72 0.028 6.034 6.793 1.00 0.00 H new ATOM 0 HA LEU A 72 2.983 5.982 6.606 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.805 6.798 4.665 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.465 7.327 4.470 1.00 0.00 H new ATOM 0 HG LEU A 72 1.981 5.414 3.046 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.832 3.944 3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.256 5.664 3.908 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.830 4.707 5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.496 3.201 4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.401 3.935 5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.214 4.379 4.382 1.00 0.00 H new ATOM 1096 N GLU A 73 3.278 8.476 6.967 1.00 0.00 N ATOM 1097 CA GLU A 73 3.458 9.828 7.481 1.00 0.00 C ATOM 1098 C GLU A 73 4.451 10.610 6.624 1.00 0.00 C ATOM 1099 O GLU A 73 5.541 10.128 6.323 1.00 0.00 O ATOM 1100 CB GLU A 73 3.945 9.785 8.931 1.00 0.00 C ATOM 1101 CG GLU A 73 2.984 9.082 9.876 1.00 0.00 C ATOM 1102 CD GLU A 73 3.543 8.939 11.277 1.00 0.00 C ATOM 1103 OE1 GLU A 73 4.754 8.658 11.407 1.00 0.00 O ATOM 1104 OE2 GLU A 73 2.772 9.105 12.245 1.00 0.00 O ATOM 0 H GLU A 73 4.134 8.036 6.629 1.00 0.00 H new ATOM 0 HA GLU A 73 2.493 10.334 7.442 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.910 9.280 8.966 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.106 10.804 9.282 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.048 9.640 9.918 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.749 8.094 9.480 1.00 0.00 H new ATOM 1111 N GLY A 74 4.061 11.819 6.234 1.00 0.00 N ATOM 1112 CA GLY A 74 4.926 12.648 5.414 1.00 0.00 C ATOM 1113 C GLY A 74 4.147 13.562 4.489 1.00 0.00 C ATOM 1114 O GLY A 74 2.930 13.706 4.604 1.00 0.00 O ATOM 0 H GLY A 74 3.162 12.240 6.471 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.566 13.249 6.060 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.581 12.009 4.821 1.00 0.00 H new ATOM 1118 N PRO A 75 4.857 14.200 3.546 1.00 0.00 N ATOM 1119 CA PRO A 75 4.244 15.116 2.579 1.00 0.00 C ATOM 1120 C PRO A 75 3.367 14.390 1.566 1.00 0.00 C ATOM 1121 O PRO A 75 3.802 13.433 0.924 1.00 0.00 O ATOM 1122 CB PRO A 75 5.449 15.755 1.884 1.00 0.00 C ATOM 1123 CG PRO A 75 6.544 14.755 2.029 1.00 0.00 C ATOM 1124 CD PRO A 75 6.311 14.075 3.350 1.00 0.00 C ATOM 0 HA PRO A 75 3.582 15.835 3.062 1.00 0.00 H new ATOM 0 HB2 PRO A 75 5.237 15.961 0.835 1.00 0.00 H new ATOM 0 HB3 PRO A 75 5.716 16.705 2.348 1.00 0.00 H new ATOM 0 HG2 PRO A 75 6.526 14.035 1.211 1.00 0.00 H new ATOM 0 HG3 PRO A 75 7.520 15.239 2.006 1.00 0.00 H new ATOM 0 HD2 PRO A 75 6.625 13.031 3.326 1.00 0.00 H new ATOM 0 HD3 PRO A 75 6.868 14.557 4.154 1.00 0.00 H new ATOM 1132 N THR A 76 2.127 14.848 1.427 1.00 0.00 N ATOM 1133 CA THR A 76 1.187 14.242 0.493 1.00 0.00 C ATOM 1134 C THR A 76 1.878 13.863 -0.813 1.00 0.00 C ATOM 1135 O THR A 76 1.570 12.834 -1.412 1.00 0.00 O ATOM 1136 CB THR A 76 0.012 15.188 0.183 1.00 0.00 C ATOM 1137 OG1 THR A 76 -0.732 14.694 -0.936 1.00 0.00 O ATOM 1138 CG2 THR A 76 0.513 16.593 -0.115 1.00 0.00 C ATOM 0 H THR A 76 1.750 15.638 1.951 1.00 0.00 H new ATOM 0 HA THR A 76 0.801 13.342 0.972 1.00 0.00 H new ATOM 0 HB THR A 76 -0.635 15.228 1.060 1.00 0.00 H new ATOM 0 HG1 THR A 76 -1.478 15.300 -1.126 1.00 0.00 H new ATOM 0 HG21 THR A 76 -0.335 17.243 -0.331 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.054 16.977 0.750 1.00 0.00 H new ATOM 0 HG23 THR A 76 1.179 16.567 -0.977 1.00 0.00 H new ATOM 1146 N GLU A 77 2.812 14.703 -1.247 1.00 0.00 N ATOM 1147 CA GLU A 77 3.546 14.455 -2.483 1.00 0.00 C ATOM 1148 C GLU A 77 4.178 13.067 -2.471 1.00 0.00 C ATOM 1149 O GLU A 77 3.911 12.243 -3.346 1.00 0.00 O ATOM 1150 CB GLU A 77 4.628 15.519 -2.683 1.00 0.00 C ATOM 1151 CG GLU A 77 5.373 15.389 -4.001 1.00 0.00 C ATOM 1152 CD GLU A 77 5.924 16.714 -4.492 1.00 0.00 C ATOM 1153 OE1 GLU A 77 6.209 17.587 -3.645 1.00 0.00 O ATOM 1154 OE2 GLU A 77 6.071 16.877 -5.721 1.00 0.00 O ATOM 0 H GLU A 77 3.078 15.560 -0.762 1.00 0.00 H new ATOM 0 HA GLU A 77 2.839 14.506 -3.311 1.00 0.00 H new ATOM 0 HB2 GLU A 77 4.169 16.506 -2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.343 15.456 -1.863 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.193 14.680 -3.883 1.00 0.00 H new ATOM 0 HG3 GLU A 77 4.702 14.977 -4.755 1.00 0.00 H new ATOM 1161 N ASP A 78 5.019 12.814 -1.474 1.00 0.00 N ATOM 1162 CA ASP A 78 5.690 11.526 -1.346 1.00 0.00 C ATOM 1163 C ASP A 78 4.717 10.451 -0.875 1.00 0.00 C ATOM 1164 O ASP A 78 4.649 9.364 -1.450 1.00 0.00 O ATOM 1165 CB ASP A 78 6.863 11.632 -0.370 1.00 0.00 C ATOM 1166 CG ASP A 78 7.804 12.769 -0.718 1.00 0.00 C ATOM 1167 OD1 ASP A 78 7.322 13.910 -0.878 1.00 0.00 O ATOM 1168 OD2 ASP A 78 9.022 12.517 -0.832 1.00 0.00 O ATOM 0 H ASP A 78 5.252 13.485 -0.742 1.00 0.00 H new ATOM 0 HA ASP A 78 6.069 11.243 -2.328 1.00 0.00 H new ATOM 0 HB2 ASP A 78 6.480 11.778 0.640 1.00 0.00 H new ATOM 0 HB3 ASP A 78 7.417 10.693 -0.369 1.00 0.00 H new ATOM 1173 N VAL A 79 3.964 10.759 0.176 1.00 0.00 N ATOM 1174 CA VAL A 79 2.993 9.820 0.724 1.00 0.00 C ATOM 1175 C VAL A 79 2.134 9.211 -0.377 1.00 0.00 C ATOM 1176 O VAL A 79 1.767 8.038 -0.316 1.00 0.00 O ATOM 1177 CB VAL A 79 2.076 10.499 1.759 1.00 0.00 C ATOM 1178 CG1 VAL A 79 1.059 9.509 2.303 1.00 0.00 C ATOM 1179 CG2 VAL A 79 2.901 11.102 2.887 1.00 0.00 C ATOM 0 H VAL A 79 4.008 11.653 0.665 1.00 0.00 H new ATOM 0 HA VAL A 79 3.561 9.030 1.216 1.00 0.00 H new ATOM 0 HB VAL A 79 1.534 11.305 1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.420 10.007 3.033 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.447 9.129 1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.579 8.680 2.782 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.237 11.578 3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.471 10.316 3.381 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.586 11.845 2.479 1.00 0.00 H new ATOM 1189 N SER A 80 1.816 10.017 -1.385 1.00 0.00 N ATOM 1190 CA SER A 80 0.996 9.558 -2.501 1.00 0.00 C ATOM 1191 C SER A 80 1.743 8.521 -3.334 1.00 0.00 C ATOM 1192 O SER A 80 1.143 7.588 -3.867 1.00 0.00 O ATOM 1193 CB SER A 80 0.592 10.741 -3.384 1.00 0.00 C ATOM 1194 OG SER A 80 -0.399 11.533 -2.752 1.00 0.00 O ATOM 0 H SER A 80 2.113 10.990 -1.452 1.00 0.00 H new ATOM 0 HA SER A 80 0.098 9.093 -2.093 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.468 11.353 -3.601 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.215 10.374 -4.339 1.00 0.00 H new ATOM 0 HG SER A 80 0.030 12.168 -2.141 1.00 0.00 H new ATOM 1200 N VAL A 81 3.057 8.690 -3.440 1.00 0.00 N ATOM 1201 CA VAL A 81 3.887 7.769 -4.206 1.00 0.00 C ATOM 1202 C VAL A 81 4.154 6.488 -3.422 1.00 0.00 C ATOM 1203 O VAL A 81 3.893 5.387 -3.906 1.00 0.00 O ATOM 1204 CB VAL A 81 5.233 8.412 -4.589 1.00 0.00 C ATOM 1205 CG1 VAL A 81 6.126 7.404 -5.297 1.00 0.00 C ATOM 1206 CG2 VAL A 81 5.008 9.639 -5.460 1.00 0.00 C ATOM 0 H VAL A 81 3.570 9.457 -3.005 1.00 0.00 H new ATOM 0 HA VAL A 81 3.336 7.528 -5.115 1.00 0.00 H new ATOM 0 HB VAL A 81 5.736 8.729 -3.676 1.00 0.00 H new ATOM 0 HG11 VAL A 81 7.072 7.877 -5.559 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.315 6.558 -4.636 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.632 7.054 -6.203 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.969 10.081 -5.721 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.483 9.348 -6.370 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.410 10.368 -4.914 1.00 0.00 H new ATOM 1216 N ALA A 82 4.674 6.641 -2.209 1.00 0.00 N ATOM 1217 CA ALA A 82 4.974 5.497 -1.357 1.00 0.00 C ATOM 1218 C ALA A 82 3.733 4.639 -1.134 1.00 0.00 C ATOM 1219 O ALA A 82 3.773 3.420 -1.298 1.00 0.00 O ATOM 1220 CB ALA A 82 5.540 5.965 -0.025 1.00 0.00 C ATOM 0 H ALA A 82 4.896 7.546 -1.794 1.00 0.00 H new ATOM 0 HA ALA A 82 5.721 4.885 -1.862 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.759 5.100 0.601 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.456 6.530 -0.197 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.811 6.601 0.477 1.00 0.00 H new ATOM 1226 N GLN A 83 2.633 5.283 -0.758 1.00 0.00 N ATOM 1227 CA GLN A 83 1.381 4.578 -0.511 1.00 0.00 C ATOM 1228 C GLN A 83 0.934 3.812 -1.752 1.00 0.00 C ATOM 1229 O GLN A 83 0.471 2.676 -1.658 1.00 0.00 O ATOM 1230 CB GLN A 83 0.291 5.563 -0.085 1.00 0.00 C ATOM 1231 CG GLN A 83 -0.362 6.288 -1.251 1.00 0.00 C ATOM 1232 CD GLN A 83 -1.521 7.165 -0.817 1.00 0.00 C ATOM 1233 OE1 GLN A 83 -1.334 8.325 -0.450 1.00 0.00 O ATOM 1234 NE2 GLN A 83 -2.728 6.613 -0.857 1.00 0.00 N ATOM 0 H GLN A 83 2.583 6.292 -0.618 1.00 0.00 H new ATOM 0 HA GLN A 83 1.549 3.863 0.294 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -0.475 5.025 0.473 1.00 0.00 H new ATOM 0 HB3 GLN A 83 0.722 6.299 0.594 1.00 0.00 H new ATOM 0 HG2 GLN A 83 0.384 6.902 -1.756 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -0.717 5.556 -1.976 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -2.837 5.648 -1.168 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -3.546 7.154 -0.577 1.00 0.00 H new ATOM 1243 N GLU A 84 1.076 4.442 -2.914 1.00 0.00 N ATOM 1244 CA GLU A 84 0.686 3.819 -4.173 1.00 0.00 C ATOM 1245 C GLU A 84 1.581 2.624 -4.490 1.00 0.00 C ATOM 1246 O GLU A 84 1.102 1.575 -4.919 1.00 0.00 O ATOM 1247 CB GLU A 84 0.754 4.836 -5.314 1.00 0.00 C ATOM 1248 CG GLU A 84 -0.064 4.442 -6.532 1.00 0.00 C ATOM 1249 CD GLU A 84 0.089 5.420 -7.680 1.00 0.00 C ATOM 1250 OE1 GLU A 84 -0.334 6.584 -7.527 1.00 0.00 O ATOM 1251 OE2 GLU A 84 0.631 5.021 -8.732 1.00 0.00 O ATOM 0 H GLU A 84 1.458 5.383 -3.009 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.340 3.466 -4.070 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.404 5.802 -4.949 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.794 4.965 -5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.240 3.449 -6.863 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.116 4.377 -6.253 1.00 0.00 H new ATOM 1258 N GLN A 85 2.881 2.793 -4.275 1.00 0.00 N ATOM 1259 CA GLN A 85 3.843 1.729 -4.538 1.00 0.00 C ATOM 1260 C GLN A 85 3.485 0.467 -3.761 1.00 0.00 C ATOM 1261 O GLN A 85 3.594 -0.645 -4.279 1.00 0.00 O ATOM 1262 CB GLN A 85 5.255 2.186 -4.170 1.00 0.00 C ATOM 1263 CG GLN A 85 5.902 3.073 -5.221 1.00 0.00 C ATOM 1264 CD GLN A 85 7.412 2.941 -5.249 1.00 0.00 C ATOM 1265 OE1 GLN A 85 7.961 1.889 -4.918 1.00 0.00 O ATOM 1266 NE2 GLN A 85 8.093 4.010 -5.644 1.00 0.00 N ATOM 0 H GLN A 85 3.293 3.656 -3.920 1.00 0.00 H new ATOM 0 HA GLN A 85 3.810 1.499 -5.603 1.00 0.00 H new ATOM 0 HB2 GLN A 85 5.218 2.726 -3.224 1.00 0.00 H new ATOM 0 HB3 GLN A 85 5.882 1.309 -4.012 1.00 0.00 H new ATOM 0 HG2 GLN A 85 5.501 2.819 -6.202 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.636 4.112 -5.027 1.00 0.00 H new ATOM 0 HE21 GLN A 85 7.597 4.861 -5.909 1.00 0.00 H new ATOM 0 HE22 GLN A 85 9.112 3.980 -5.682 1.00 0.00 H new ATOM 1275 N ILE A 86 3.059 0.646 -2.515 1.00 0.00 N ATOM 1276 CA ILE A 86 2.684 -0.479 -1.667 1.00 0.00 C ATOM 1277 C ILE A 86 1.362 -1.088 -2.116 1.00 0.00 C ATOM 1278 O ILE A 86 1.165 -2.301 -2.028 1.00 0.00 O ATOM 1279 CB ILE A 86 2.568 -0.055 -0.190 1.00 0.00 C ATOM 1280 CG1 ILE A 86 3.907 0.485 0.317 1.00 0.00 C ATOM 1281 CG2 ILE A 86 2.107 -1.228 0.661 1.00 0.00 C ATOM 1282 CD1 ILE A 86 3.918 0.779 1.800 1.00 0.00 C ATOM 0 H ILE A 86 2.965 1.559 -2.070 1.00 0.00 H new ATOM 0 HA ILE A 86 3.474 -1.224 -1.761 1.00 0.00 H new ATOM 0 HB ILE A 86 1.826 0.740 -0.113 1.00 0.00 H new ATOM 0 HG12 ILE A 86 4.690 -0.240 0.093 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.151 1.397 -0.228 1.00 0.00 H new ATOM 0 HG21 ILE A 86 2.029 -0.914 1.702 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.133 -1.570 0.312 1.00 0.00 H new ATOM 0 HG23 ILE A 86 2.828 -2.042 0.580 1.00 0.00 H new ATOM 0 HD11 ILE A 86 4.898 1.158 2.088 1.00 0.00 H new ATOM 0 HD12 ILE A 86 3.158 1.526 2.028 1.00 0.00 H new ATOM 0 HD13 ILE A 86 3.705 -0.135 2.354 1.00 0.00 H new ATOM 1294 N GLU A 87 0.458 -0.241 -2.597 1.00 0.00 N ATOM 1295 CA GLU A 87 -0.846 -0.698 -3.062 1.00 0.00 C ATOM 1296 C GLU A 87 -0.697 -1.746 -4.161 1.00 0.00 C ATOM 1297 O GLU A 87 -1.544 -2.624 -4.315 1.00 0.00 O ATOM 1298 CB GLU A 87 -1.672 0.482 -3.576 1.00 0.00 C ATOM 1299 CG GLU A 87 -2.350 1.278 -2.473 1.00 0.00 C ATOM 1300 CD GLU A 87 -3.723 0.738 -2.124 1.00 0.00 C ATOM 1301 OE1 GLU A 87 -3.798 -0.369 -1.554 1.00 0.00 O ATOM 1302 OE2 GLU A 87 -4.723 1.425 -2.421 1.00 0.00 O ATOM 0 H GLU A 87 0.605 0.765 -2.675 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.363 -1.154 -2.218 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.024 1.147 -4.146 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.432 0.110 -4.264 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.722 1.266 -1.582 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.441 2.319 -2.784 1.00 0.00 H new ATOM 1309 N GLY A 88 0.388 -1.645 -4.922 1.00 0.00 N ATOM 1310 CA GLY A 88 0.630 -2.589 -5.998 1.00 0.00 C ATOM 1311 C GLY A 88 1.133 -3.926 -5.494 1.00 0.00 C ATOM 1312 O GLY A 88 0.552 -4.969 -5.793 1.00 0.00 O ATOM 0 H GLY A 88 1.104 -0.927 -4.813 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.292 -2.739 -6.559 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.359 -2.167 -6.690 1.00 0.00 H new ATOM 1316 N MET A 89 2.218 -3.898 -4.726 1.00 0.00 N ATOM 1317 CA MET A 89 2.799 -5.119 -4.179 1.00 0.00 C ATOM 1318 C MET A 89 1.797 -5.847 -3.291 1.00 0.00 C ATOM 1319 O MET A 89 1.837 -7.072 -3.167 1.00 0.00 O ATOM 1320 CB MET A 89 4.064 -4.794 -3.383 1.00 0.00 C ATOM 1321 CG MET A 89 3.849 -3.748 -2.301 1.00 0.00 C ATOM 1322 SD MET A 89 5.390 -2.993 -1.748 1.00 0.00 S ATOM 1323 CE MET A 89 5.436 -3.529 -0.040 1.00 0.00 C ATOM 0 H MET A 89 2.712 -3.044 -4.469 1.00 0.00 H new ATOM 0 HA MET A 89 3.060 -5.773 -5.011 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.439 -5.708 -2.924 1.00 0.00 H new ATOM 0 HB3 MET A 89 4.835 -4.442 -4.069 1.00 0.00 H new ATOM 0 HG2 MET A 89 3.184 -2.972 -2.679 1.00 0.00 H new ATOM 0 HG3 MET A 89 3.349 -4.209 -1.449 1.00 0.00 H new ATOM 0 HE1 MET A 89 5.895 -2.753 0.573 1.00 0.00 H new ATOM 0 HE2 MET A 89 4.421 -3.715 0.310 1.00 0.00 H new ATOM 0 HE3 MET A 89 6.020 -4.446 0.038 1.00 0.00 H new ATOM 1333 N VAL A 90 0.897 -5.088 -2.674 1.00 0.00 N ATOM 1334 CA VAL A 90 -0.116 -5.661 -1.797 1.00 0.00 C ATOM 1335 C VAL A 90 -1.082 -6.545 -2.579 1.00 0.00 C ATOM 1336 O VAL A 90 -1.315 -7.699 -2.219 1.00 0.00 O ATOM 1337 CB VAL A 90 -0.916 -4.564 -1.070 1.00 0.00 C ATOM 1338 CG1 VAL A 90 -2.211 -5.130 -0.508 1.00 0.00 C ATOM 1339 CG2 VAL A 90 -0.076 -3.937 0.032 1.00 0.00 C ATOM 0 H VAL A 90 0.849 -4.073 -2.766 1.00 0.00 H new ATOM 0 HA VAL A 90 0.410 -6.266 -1.058 1.00 0.00 H new ATOM 0 HB VAL A 90 -1.171 -3.786 -1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -2.762 -4.340 0.002 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.817 -5.529 -1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.983 -5.928 0.199 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.656 -3.164 0.536 1.00 0.00 H new ATOM 0 HG22 VAL A 90 0.210 -4.704 0.752 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.821 -3.494 -0.401 1.00 0.00 H new ATOM 1349 N LYS A 91 -1.645 -5.995 -3.649 1.00 0.00 N ATOM 1350 CA LYS A 91 -2.584 -6.733 -4.485 1.00 0.00 C ATOM 1351 C LYS A 91 -1.904 -7.927 -5.146 1.00 0.00 C ATOM 1352 O LYS A 91 -2.464 -9.021 -5.200 1.00 0.00 O ATOM 1353 CB LYS A 91 -3.179 -5.814 -5.554 1.00 0.00 C ATOM 1354 CG LYS A 91 -4.000 -6.547 -6.600 1.00 0.00 C ATOM 1355 CD LYS A 91 -5.461 -6.647 -6.193 1.00 0.00 C ATOM 1356 CE LYS A 91 -6.186 -5.325 -6.390 1.00 0.00 C ATOM 1357 NZ LYS A 91 -7.654 -5.517 -6.558 1.00 0.00 N ATOM 0 H LYS A 91 -1.467 -5.039 -3.958 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.386 -7.103 -3.846 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.808 -5.067 -5.069 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.370 -5.277 -6.050 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -3.922 -6.027 -7.555 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -3.593 -7.547 -6.748 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -5.951 -7.423 -6.781 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -5.529 -6.948 -5.148 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -6.000 -4.678 -5.533 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -5.783 -4.817 -7.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.112 -4.593 -6.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -7.833 -6.114 -7.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -8.043 -5.979 -5.711 1.00 0.00 H new ATOM 1371 N ASP A 92 -0.694 -7.708 -5.648 1.00 0.00 N ATOM 1372 CA ASP A 92 0.064 -8.767 -6.304 1.00 0.00 C ATOM 1373 C ASP A 92 0.331 -9.921 -5.343 1.00 0.00 C ATOM 1374 O ASP A 92 0.206 -11.091 -5.710 1.00 0.00 O ATOM 1375 CB ASP A 92 1.388 -8.220 -6.841 1.00 0.00 C ATOM 1376 CG ASP A 92 2.228 -9.288 -7.510 1.00 0.00 C ATOM 1377 OD1 ASP A 92 1.645 -10.191 -8.145 1.00 0.00 O ATOM 1378 OD2 ASP A 92 3.471 -9.224 -7.397 1.00 0.00 O ATOM 0 H ASP A 92 -0.217 -6.807 -5.613 1.00 0.00 H new ATOM 0 HA ASP A 92 -0.531 -9.141 -7.137 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.185 -7.422 -7.555 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.954 -7.778 -6.021 1.00 0.00 H new ATOM 1383 N LEU A 93 0.698 -9.585 -4.111 1.00 0.00 N ATOM 1384 CA LEU A 93 0.982 -10.593 -3.096 1.00 0.00 C ATOM 1385 C LEU A 93 -0.256 -11.433 -2.799 1.00 0.00 C ATOM 1386 O LEU A 93 -0.168 -12.650 -2.636 1.00 0.00 O ATOM 1387 CB LEU A 93 1.480 -9.926 -1.812 1.00 0.00 C ATOM 1388 CG LEU A 93 2.932 -9.449 -1.823 1.00 0.00 C ATOM 1389 CD1 LEU A 93 3.233 -8.626 -0.580 1.00 0.00 C ATOM 1390 CD2 LEU A 93 3.882 -10.633 -1.924 1.00 0.00 C ATOM 0 H LEU A 93 0.806 -8.622 -3.791 1.00 0.00 H new ATOM 0 HA LEU A 93 1.760 -11.252 -3.482 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.839 -9.070 -1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.356 -10.630 -0.989 1.00 0.00 H new ATOM 0 HG LEU A 93 3.079 -8.815 -2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.271 -8.295 -0.605 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.576 -7.757 -0.551 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.068 -9.235 0.309 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.911 -10.274 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.733 -11.293 -1.069 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.683 -11.181 -2.845 1.00 0.00 H new ATOM 1402 N ILE A 94 -1.408 -10.775 -2.733 1.00 0.00 N ATOM 1403 CA ILE A 94 -2.664 -11.461 -2.460 1.00 0.00 C ATOM 1404 C ILE A 94 -3.055 -12.373 -3.616 1.00 0.00 C ATOM 1405 O ILE A 94 -3.392 -13.539 -3.415 1.00 0.00 O ATOM 1406 CB ILE A 94 -3.807 -10.461 -2.200 1.00 0.00 C ATOM 1407 CG1 ILE A 94 -3.488 -9.594 -0.980 1.00 0.00 C ATOM 1408 CG2 ILE A 94 -5.122 -11.201 -2.000 1.00 0.00 C ATOM 1409 CD1 ILE A 94 -4.332 -8.343 -0.892 1.00 0.00 C ATOM 0 H ILE A 94 -1.497 -9.768 -2.865 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.507 -12.062 -1.564 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.906 -9.811 -3.069 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -3.634 -10.185 -0.076 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -2.436 -9.311 -1.010 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.920 -10.482 -1.817 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -5.353 -11.780 -2.894 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.036 -11.872 -1.145 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.052 -7.777 -0.004 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.169 -7.731 -1.779 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -5.385 -8.618 -0.830 1.00 0.00 H new ATOM 1421 N ASN A 95 -3.007 -11.834 -4.830 1.00 0.00 N ATOM 1422 CA ASN A 95 -3.355 -12.600 -6.022 1.00 0.00 C ATOM 1423 C ASN A 95 -2.547 -13.892 -6.094 1.00 0.00 C ATOM 1424 O ASN A 95 -3.019 -14.903 -6.614 1.00 0.00 O ATOM 1425 CB ASN A 95 -3.112 -11.764 -7.280 1.00 0.00 C ATOM 1426 CG ASN A 95 -4.155 -10.679 -7.463 1.00 0.00 C ATOM 1427 OD1 ASN A 95 -4.948 -10.406 -6.561 1.00 0.00 O ATOM 1428 ND2 ASN A 95 -4.159 -10.052 -8.634 1.00 0.00 N ATOM 0 H ASN A 95 -2.731 -10.870 -5.015 1.00 0.00 H new ATOM 0 HA ASN A 95 -4.413 -12.856 -5.962 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -2.123 -11.308 -7.225 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -3.114 -12.417 -8.153 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.837 -9.312 -8.814 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.484 -10.311 -9.353 1.00 0.00 H new ATOM 1435 N ARG A 96 -1.328 -13.851 -5.567 1.00 0.00 N ATOM 1436 CA ARG A 96 -0.454 -15.018 -5.571 1.00 0.00 C ATOM 1437 C ARG A 96 -0.523 -15.754 -4.236 1.00 0.00 C ATOM 1438 O ARG A 96 0.502 -16.145 -3.677 1.00 0.00 O ATOM 1439 CB ARG A 96 0.989 -14.600 -5.860 1.00 0.00 C ATOM 1440 CG ARG A 96 1.588 -13.697 -4.794 1.00 0.00 C ATOM 1441 CD ARG A 96 2.923 -13.121 -5.237 1.00 0.00 C ATOM 1442 NE ARG A 96 4.040 -13.994 -4.887 1.00 0.00 N ATOM 1443 CZ ARG A 96 5.314 -13.655 -5.042 1.00 0.00 C ATOM 1444 NH1 ARG A 96 5.633 -12.467 -5.539 1.00 0.00 N ATOM 1445 NH2 ARG A 96 6.276 -14.504 -4.701 1.00 0.00 N ATOM 0 H ARG A 96 -0.923 -13.022 -5.132 1.00 0.00 H new ATOM 0 HA ARG A 96 -0.795 -15.693 -6.357 1.00 0.00 H new ATOM 0 HB2 ARG A 96 1.605 -15.494 -5.954 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.024 -14.086 -6.821 1.00 0.00 H new ATOM 0 HG2 ARG A 96 0.896 -12.885 -4.573 1.00 0.00 H new ATOM 0 HG3 ARG A 96 1.722 -14.261 -3.871 1.00 0.00 H new ATOM 0 HD2 ARG A 96 2.910 -12.964 -6.316 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.068 -12.145 -4.775 1.00 0.00 H new ATOM 0 HE ARG A 96 3.830 -14.915 -4.502 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.898 -11.811 -5.803 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.613 -12.210 -5.657 1.00 0.00 H new ATOM 0 HH21 ARG A 96 6.037 -15.419 -4.319 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.254 -14.241 -4.821 1.00 0.00 H new ATOM 1459 N SER A 97 -1.738 -15.938 -3.730 1.00 0.00 N ATOM 1460 CA SER A 97 -1.941 -16.622 -2.458 1.00 0.00 C ATOM 1461 C SER A 97 -2.675 -17.945 -2.665 1.00 0.00 C ATOM 1462 O SER A 97 -3.535 -18.321 -1.869 1.00 0.00 O ATOM 1463 CB SER A 97 -2.731 -15.733 -1.497 1.00 0.00 C ATOM 1464 OG SER A 97 -2.928 -16.378 -0.250 1.00 0.00 O ATOM 0 H SER A 97 -2.597 -15.623 -4.181 1.00 0.00 H new ATOM 0 HA SER A 97 -0.963 -16.832 -2.026 1.00 0.00 H new ATOM 0 HB2 SER A 97 -2.199 -14.794 -1.344 1.00 0.00 H new ATOM 0 HB3 SER A 97 -3.696 -15.484 -1.938 1.00 0.00 H new ATOM 0 HG SER A 97 -3.201 -17.307 -0.402 1.00 0.00 H new ATOM 1470 N GLY A 98 -2.327 -18.646 -3.740 1.00 0.00 N ATOM 1471 CA GLY A 98 -2.962 -19.918 -4.033 1.00 0.00 C ATOM 1472 C GLY A 98 -1.965 -20.977 -4.460 1.00 0.00 C ATOM 1473 O GLY A 98 -0.766 -20.722 -4.576 1.00 0.00 O ATOM 0 H GLY A 98 -1.617 -18.356 -4.413 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -3.500 -20.264 -3.150 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -3.701 -19.779 -4.822 1.00 0.00 H new ATOM 1477 N PRO A 99 -2.461 -22.200 -4.700 1.00 0.00 N ATOM 1478 CA PRO A 99 -1.623 -23.327 -5.120 1.00 0.00 C ATOM 1479 C PRO A 99 -1.091 -23.157 -6.539 1.00 0.00 C ATOM 1480 O PRO A 99 -0.267 -23.945 -7.000 1.00 0.00 O ATOM 1481 CB PRO A 99 -2.575 -24.523 -5.045 1.00 0.00 C ATOM 1482 CG PRO A 99 -3.934 -23.938 -5.216 1.00 0.00 C ATOM 1483 CD PRO A 99 -3.880 -22.575 -4.582 1.00 0.00 C ATOM 0 HA PRO A 99 -0.736 -23.431 -4.495 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -2.357 -25.252 -5.826 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -2.485 -25.041 -4.090 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -4.199 -23.868 -6.271 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -4.690 -24.561 -4.738 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -4.527 -21.866 -5.098 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -4.203 -22.603 -3.541 1.00 0.00 H new ATOM 1491 N SER A 100 -1.567 -22.122 -7.224 1.00 0.00 N ATOM 1492 CA SER A 100 -1.141 -21.851 -8.592 1.00 0.00 C ATOM 1493 C SER A 100 0.013 -20.853 -8.614 1.00 0.00 C ATOM 1494 O SER A 100 -0.201 -19.641 -8.632 1.00 0.00 O ATOM 1495 CB SER A 100 -2.312 -21.312 -9.416 1.00 0.00 C ATOM 1496 OG SER A 100 -1.958 -21.185 -10.782 1.00 0.00 O ATOM 0 H SER A 100 -2.247 -21.458 -6.854 1.00 0.00 H new ATOM 0 HA SER A 100 -0.797 -22.787 -9.032 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.167 -21.981 -9.319 1.00 0.00 H new ATOM 0 HB3 SER A 100 -2.620 -20.342 -9.025 1.00 0.00 H new ATOM 0 HG SER A 100 -2.723 -20.840 -11.288 1.00 0.00 H new ATOM 1502 N SER A 101 1.236 -21.372 -8.612 1.00 0.00 N ATOM 1503 CA SER A 101 2.426 -20.528 -8.627 1.00 0.00 C ATOM 1504 C SER A 101 2.585 -19.840 -9.979 1.00 0.00 C ATOM 1505 O SER A 101 2.851 -18.641 -10.051 1.00 0.00 O ATOM 1506 CB SER A 101 3.671 -21.359 -8.313 1.00 0.00 C ATOM 1507 OG SER A 101 4.009 -22.201 -9.402 1.00 0.00 O ATOM 0 H SER A 101 1.430 -22.373 -8.600 1.00 0.00 H new ATOM 0 HA SER A 101 2.309 -19.762 -7.861 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.507 -20.697 -8.088 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.494 -21.963 -7.423 1.00 0.00 H new ATOM 0 HG SER A 101 4.809 -22.721 -9.178 1.00 0.00 H new ATOM 1513 N GLY A 102 2.422 -20.610 -11.051 1.00 0.00 N ATOM 1514 CA GLY A 102 2.552 -20.059 -12.387 1.00 0.00 C ATOM 1515 C GLY A 102 1.244 -20.077 -13.151 1.00 0.00 C ATOM 1516 O GLY A 102 0.357 -19.263 -12.895 1.00 0.00 O ATOM 0 H GLY A 102 2.202 -21.605 -11.018 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.916 -19.034 -12.320 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.300 -20.627 -12.940 1.00 0.00 H new TER 1520 GLY A 102