USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 824 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 51 THR OG1 : rot -75:sc= 1.56 USER MOD Set 1.2: A 55 THR OG1 : rot 2:sc= 0.275 USER MOD Set 2.1: A 12 SER OG : rot 180:sc= 0.51 USER MOD Set 2.2: A 13 LYS NZ :NH3+ 162:sc= 0.558 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0622 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 39:sc= 0.957 USER MOD Single : A 14 CYS SG : rot 153:sc= -0.115 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.846 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -140:sc= -0.246 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 160:sc= -0.888 USER MOD Single : A 47 CYS SG : rot -70:sc= -0.834 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN :FLIP amide:sc= -0.294 F(o=-0.97,f=-0.29) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.354 USER MOD Single : A 69 TYR OH : rot -149:sc= 0.0982 USER MOD Single : A 73 TYR OH : rot -148:sc= 0.953 USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.459 USER MOD Single : A 77 LYS NZ :NH3+ 166:sc= -0.0031 (180deg=-0.0839) USER MOD Single : A 80 THR OG1 : rot -47:sc= 0.542 USER MOD Single : A 81 TYR OH : rot 24:sc= 1.18 USER MOD Single : A 84 TYR OH : rot 15:sc= -0.496 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.0047) USER MOD Single : A 95 SER OG : rot -132:sc= -0.67 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -51:sc= 0.172 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.32 K(o=-0.32,f=-1.3) USER MOD Single : A 117 CYS SG : rot 27:sc= 0.0028 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.100 -38.676 5.136 1.00 0.00 N ATOM 2 CA GLY A 1 -9.912 -37.846 5.059 1.00 0.00 C ATOM 3 C GLY A 1 -9.248 -37.907 3.697 1.00 0.00 C ATOM 4 O GLY A 1 -9.639 -37.191 2.776 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.516 -38.599 6.086 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.792 -38.358 4.428 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.844 -39.667 4.949 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.179 -36.813 5.283 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.201 -38.164 5.821 1.00 0.00 H new ATOM 8 N SER A 2 -8.241 -38.764 3.570 1.00 0.00 N ATOM 9 CA SER A 2 -7.517 -38.913 2.312 1.00 0.00 C ATOM 10 C SER A 2 -7.343 -37.563 1.623 1.00 0.00 C ATOM 11 O SER A 2 -7.496 -37.451 0.406 1.00 0.00 O ATOM 12 CB SER A 2 -8.257 -39.881 1.386 1.00 0.00 C ATOM 13 OG SER A 2 -9.564 -39.414 1.100 1.00 0.00 O ATOM 0 H SER A 2 -7.907 -39.366 4.322 1.00 0.00 H new ATOM 0 HA SER A 2 -6.529 -39.317 2.534 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.699 -40.000 0.458 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.313 -40.865 1.852 1.00 0.00 H new ATOM 0 HG SER A 2 -10.015 -40.049 0.506 1.00 0.00 H new ATOM 19 N SER A 3 -7.025 -36.541 2.410 1.00 0.00 N ATOM 20 CA SER A 3 -6.834 -35.197 1.877 1.00 0.00 C ATOM 21 C SER A 3 -5.390 -34.739 2.061 1.00 0.00 C ATOM 22 O SER A 3 -4.784 -34.964 3.109 1.00 0.00 O ATOM 23 CB SER A 3 -7.784 -34.213 2.563 1.00 0.00 C ATOM 24 OG SER A 3 -7.523 -32.882 2.155 1.00 0.00 O ATOM 0 H SER A 3 -6.894 -36.617 3.419 1.00 0.00 H new ATOM 0 HA SER A 3 -7.056 -35.222 0.810 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.815 -34.473 2.326 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.676 -34.293 3.645 1.00 0.00 H new ATOM 0 HG SER A 3 -8.145 -32.274 2.606 1.00 0.00 H new ATOM 30 N GLY A 4 -4.844 -34.095 1.035 1.00 0.00 N ATOM 31 CA GLY A 4 -3.476 -33.614 1.103 1.00 0.00 C ATOM 32 C GLY A 4 -3.383 -32.107 0.976 1.00 0.00 C ATOM 33 O GLY A 4 -3.025 -31.417 1.930 1.00 0.00 O ATOM 0 H GLY A 4 -5.324 -33.897 0.157 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.032 -33.924 2.049 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.891 -34.079 0.309 1.00 0.00 H new ATOM 37 N SER A 5 -3.704 -31.594 -0.208 1.00 0.00 N ATOM 38 CA SER A 5 -3.650 -30.158 -0.459 1.00 0.00 C ATOM 39 C SER A 5 -4.347 -29.809 -1.770 1.00 0.00 C ATOM 40 O SER A 5 -4.505 -30.659 -2.647 1.00 0.00 O ATOM 41 CB SER A 5 -2.197 -29.681 -0.496 1.00 0.00 C ATOM 42 OG SER A 5 -1.552 -30.101 -1.686 1.00 0.00 O ATOM 0 H SER A 5 -4.004 -32.151 -1.008 1.00 0.00 H new ATOM 0 HA SER A 5 -4.171 -29.651 0.354 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.166 -28.594 -0.426 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.661 -30.071 0.369 1.00 0.00 H new ATOM 0 HG SER A 5 -0.625 -29.782 -1.686 1.00 0.00 H new ATOM 48 N SER A 6 -4.760 -28.553 -1.897 1.00 0.00 N ATOM 49 CA SER A 6 -5.443 -28.091 -3.100 1.00 0.00 C ATOM 50 C SER A 6 -4.638 -26.996 -3.795 1.00 0.00 C ATOM 51 O SER A 6 -4.123 -27.192 -4.895 1.00 0.00 O ATOM 52 CB SER A 6 -6.839 -27.570 -2.751 1.00 0.00 C ATOM 53 OG SER A 6 -7.707 -28.634 -2.401 1.00 0.00 O ATOM 0 H SER A 6 -4.634 -27.837 -1.182 1.00 0.00 H new ATOM 0 HA SER A 6 -5.538 -28.936 -3.782 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.771 -26.865 -1.923 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.250 -27.025 -3.601 1.00 0.00 H new ATOM 0 HG SER A 6 -8.592 -28.275 -2.181 1.00 0.00 H new ATOM 59 N GLY A 7 -4.537 -25.841 -3.143 1.00 0.00 N ATOM 60 CA GLY A 7 -3.794 -24.732 -3.713 1.00 0.00 C ATOM 61 C GLY A 7 -4.603 -23.955 -4.731 1.00 0.00 C ATOM 62 O GLY A 7 -4.597 -22.723 -4.733 1.00 0.00 O ATOM 0 H GLY A 7 -4.956 -25.654 -2.232 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.480 -24.060 -2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.888 -25.111 -4.186 1.00 0.00 H new ATOM 66 N THR A 8 -5.304 -24.674 -5.603 1.00 0.00 N ATOM 67 CA THR A 8 -6.120 -24.045 -6.633 1.00 0.00 C ATOM 68 C THR A 8 -7.378 -23.427 -6.035 1.00 0.00 C ATOM 69 O THR A 8 -8.359 -24.122 -5.773 1.00 0.00 O ATOM 70 CB THR A 8 -6.525 -25.055 -7.723 1.00 0.00 C ATOM 71 OG1 THR A 8 -7.274 -26.128 -7.143 1.00 0.00 O ATOM 72 CG2 THR A 8 -5.297 -25.609 -8.430 1.00 0.00 C ATOM 0 H THR A 8 -5.322 -25.694 -5.616 1.00 0.00 H new ATOM 0 HA THR A 8 -5.512 -23.260 -7.084 1.00 0.00 H new ATOM 0 HB THR A 8 -7.143 -24.537 -8.456 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.872 -25.774 -6.452 1.00 0.00 H new ATOM 0 HG21 THR A 8 -5.608 -26.320 -9.195 1.00 0.00 H new ATOM 0 HG22 THR A 8 -4.746 -24.792 -8.896 1.00 0.00 H new ATOM 0 HG23 THR A 8 -4.656 -26.112 -7.706 1.00 0.00 H new ATOM 80 N GLY A 9 -7.346 -22.114 -5.825 1.00 0.00 N ATOM 81 CA GLY A 9 -8.490 -21.424 -5.260 1.00 0.00 C ATOM 82 C GLY A 9 -9.122 -20.453 -6.238 1.00 0.00 C ATOM 83 O GLY A 9 -9.235 -20.746 -7.428 1.00 0.00 O ATOM 0 H GLY A 9 -6.547 -21.516 -6.037 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.234 -22.156 -4.948 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -8.179 -20.884 -4.366 1.00 0.00 H new ATOM 87 N ASP A 10 -9.535 -19.295 -5.735 1.00 0.00 N ATOM 88 CA ASP A 10 -10.159 -18.278 -6.573 1.00 0.00 C ATOM 89 C ASP A 10 -9.680 -16.883 -6.183 1.00 0.00 C ATOM 90 O ASP A 10 -9.429 -16.608 -5.009 1.00 0.00 O ATOM 91 CB ASP A 10 -11.683 -18.356 -6.459 1.00 0.00 C ATOM 92 CG ASP A 10 -12.218 -19.733 -6.802 1.00 0.00 C ATOM 93 OD1 ASP A 10 -12.232 -20.605 -5.907 1.00 0.00 O ATOM 94 OD2 ASP A 10 -12.624 -19.939 -7.964 1.00 0.00 O ATOM 0 H ASP A 10 -9.449 -19.037 -4.752 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.869 -18.467 -7.606 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.983 -18.095 -5.444 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -12.133 -17.618 -7.124 1.00 0.00 H new ATOM 99 N ALA A 11 -9.554 -16.007 -7.174 1.00 0.00 N ATOM 100 CA ALA A 11 -9.105 -14.641 -6.933 1.00 0.00 C ATOM 101 C ALA A 11 -10.285 -13.678 -6.871 1.00 0.00 C ATOM 102 O ALA A 11 -10.310 -12.763 -6.048 1.00 0.00 O ATOM 103 CB ALA A 11 -8.126 -14.209 -8.015 1.00 0.00 C ATOM 0 H ALA A 11 -9.756 -16.219 -8.151 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.598 -14.616 -5.968 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.799 -13.187 -7.823 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.262 -14.874 -8.010 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.615 -14.256 -8.988 1.00 0.00 H new ATOM 109 N SER A 12 -11.263 -13.890 -7.748 1.00 0.00 N ATOM 110 CA SER A 12 -12.445 -13.038 -7.795 1.00 0.00 C ATOM 111 C SER A 12 -13.235 -13.131 -6.493 1.00 0.00 C ATOM 112 O SER A 12 -14.091 -12.293 -6.211 1.00 0.00 O ATOM 113 CB SER A 12 -13.336 -13.431 -8.976 1.00 0.00 C ATOM 114 OG SER A 12 -13.885 -14.724 -8.790 1.00 0.00 O ATOM 0 H SER A 12 -11.259 -14.644 -8.435 1.00 0.00 H new ATOM 0 HA SER A 12 -12.115 -12.007 -7.925 1.00 0.00 H new ATOM 0 HB2 SER A 12 -14.140 -12.703 -9.088 1.00 0.00 H new ATOM 0 HB3 SER A 12 -12.755 -13.408 -9.898 1.00 0.00 H new ATOM 0 HG SER A 12 -14.452 -14.952 -9.556 1.00 0.00 H new ATOM 120 N LYS A 13 -12.940 -14.157 -5.702 1.00 0.00 N ATOM 121 CA LYS A 13 -13.620 -14.362 -4.429 1.00 0.00 C ATOM 122 C LYS A 13 -12.970 -13.532 -3.326 1.00 0.00 C ATOM 123 O LYS A 13 -13.657 -12.978 -2.467 1.00 0.00 O ATOM 124 CB LYS A 13 -13.597 -15.845 -4.048 1.00 0.00 C ATOM 125 CG LYS A 13 -14.144 -16.759 -5.130 1.00 0.00 C ATOM 126 CD LYS A 13 -15.630 -16.531 -5.354 1.00 0.00 C ATOM 127 CE LYS A 13 -16.131 -17.283 -6.577 1.00 0.00 C ATOM 128 NZ LYS A 13 -15.991 -16.476 -7.821 1.00 0.00 N ATOM 0 H LYS A 13 -12.234 -14.860 -5.921 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.655 -14.038 -4.541 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.572 -16.137 -3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.178 -15.986 -3.137 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.604 -16.586 -6.061 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -13.973 -17.798 -4.850 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.186 -16.855 -4.474 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -15.821 -15.465 -5.477 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.575 -18.214 -6.684 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.178 -17.552 -6.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -16.048 -17.102 -8.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -16.755 -15.772 -7.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -15.072 -15.989 -7.817 1.00 0.00 H new ATOM 142 N CYS A 14 -11.645 -13.452 -3.356 1.00 0.00 N ATOM 143 CA CYS A 14 -10.902 -12.689 -2.358 1.00 0.00 C ATOM 144 C CYS A 14 -11.480 -11.285 -2.207 1.00 0.00 C ATOM 145 O CYS A 14 -12.181 -10.792 -3.091 1.00 0.00 O ATOM 146 CB CYS A 14 -9.425 -12.607 -2.744 1.00 0.00 C ATOM 147 SG CYS A 14 -8.507 -14.142 -2.479 1.00 0.00 S ATOM 0 H CYS A 14 -11.062 -13.906 -4.060 1.00 0.00 H new ATOM 0 HA CYS A 14 -10.991 -13.204 -1.402 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.350 -12.328 -3.795 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -8.954 -11.810 -2.168 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.501 -14.193 -3.301 1.00 0.00 H new ATOM 153 N LEU A 15 -11.182 -10.647 -1.081 1.00 0.00 N ATOM 154 CA LEU A 15 -11.672 -9.299 -0.812 1.00 0.00 C ATOM 155 C LEU A 15 -10.564 -8.420 -0.242 1.00 0.00 C ATOM 156 O LEU A 15 -9.605 -8.917 0.347 1.00 0.00 O ATOM 157 CB LEU A 15 -12.851 -9.349 0.160 1.00 0.00 C ATOM 158 CG LEU A 15 -14.238 -9.476 -0.471 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.614 -10.939 -0.645 1.00 0.00 C ATOM 160 CD2 LEU A 15 -15.278 -8.753 0.373 1.00 0.00 C ATOM 0 H LEU A 15 -10.603 -11.041 -0.339 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.005 -8.865 -1.755 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -12.703 -10.191 0.836 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -12.832 -8.445 0.769 1.00 0.00 H new ATOM 0 HG LEU A 15 -14.211 -9.009 -1.456 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.604 -11.009 -1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.886 -11.427 -1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.622 -11.431 0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -16.259 -8.855 -0.092 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -15.303 -9.189 1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.018 -7.697 0.445 1.00 0.00 H new ATOM 172 N ALA A 16 -10.704 -7.110 -0.420 1.00 0.00 N ATOM 173 CA ALA A 16 -9.718 -6.162 0.082 1.00 0.00 C ATOM 174 C ALA A 16 -10.383 -5.053 0.891 1.00 0.00 C ATOM 175 O ALA A 16 -11.098 -4.214 0.344 1.00 0.00 O ATOM 176 CB ALA A 16 -8.922 -5.570 -1.073 1.00 0.00 C ATOM 0 H ALA A 16 -11.491 -6.682 -0.908 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.037 -6.699 0.743 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.189 -4.863 -0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.408 -6.369 -1.608 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.598 -5.054 -1.754 1.00 0.00 H new ATOM 182 N THR A 17 -10.144 -5.058 2.199 1.00 0.00 N ATOM 183 CA THR A 17 -10.721 -4.055 3.085 1.00 0.00 C ATOM 184 C THR A 17 -9.639 -3.342 3.889 1.00 0.00 C ATOM 185 O THR A 17 -8.717 -3.975 4.403 1.00 0.00 O ATOM 186 CB THR A 17 -11.737 -4.682 4.056 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.155 -5.813 4.713 1.00 0.00 O ATOM 188 CG2 THR A 17 -12.998 -5.111 3.320 1.00 0.00 C ATOM 0 H THR A 17 -9.555 -5.746 2.668 1.00 0.00 H new ATOM 0 HA THR A 17 -11.234 -3.332 2.451 1.00 0.00 H new ATOM 0 HB THR A 17 -12.006 -3.930 4.798 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.808 -6.205 5.330 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.700 -5.551 4.028 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.456 -4.243 2.846 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.742 -5.847 2.558 1.00 0.00 H new ATOM 196 N GLY A 18 -9.758 -2.022 3.993 1.00 0.00 N ATOM 197 CA GLY A 18 -8.782 -1.246 4.737 1.00 0.00 C ATOM 198 C GLY A 18 -8.773 0.214 4.332 1.00 0.00 C ATOM 199 O GLY A 18 -9.202 0.580 3.237 1.00 0.00 O ATOM 0 H GLY A 18 -10.512 -1.476 3.576 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.997 -1.323 5.803 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.790 -1.670 4.581 1.00 0.00 H new ATOM 203 N PRO A 19 -8.274 1.077 5.229 1.00 0.00 N ATOM 204 CA PRO A 19 -8.200 2.521 4.981 1.00 0.00 C ATOM 205 C PRO A 19 -7.164 2.874 3.920 1.00 0.00 C ATOM 206 O PRO A 19 -7.234 3.935 3.300 1.00 0.00 O ATOM 207 CB PRO A 19 -7.789 3.092 6.341 1.00 0.00 C ATOM 208 CG PRO A 19 -7.077 1.975 7.023 1.00 0.00 C ATOM 209 CD PRO A 19 -7.745 0.712 6.553 1.00 0.00 C ATOM 0 HA PRO A 19 -9.141 2.919 4.602 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.142 3.962 6.226 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.658 3.415 6.914 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -6.017 1.974 6.768 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.145 2.073 8.107 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.039 -0.116 6.489 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -8.540 0.402 7.231 1.00 0.00 H new ATOM 217 N GLY A 20 -6.204 1.979 3.715 1.00 0.00 N ATOM 218 CA GLY A 20 -5.167 2.215 2.727 1.00 0.00 C ATOM 219 C GLY A 20 -5.672 2.058 1.307 1.00 0.00 C ATOM 220 O GLY A 20 -5.254 2.787 0.408 1.00 0.00 O ATOM 0 H GLY A 20 -6.125 1.094 4.215 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.767 3.220 2.858 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.344 1.520 2.896 1.00 0.00 H new ATOM 224 N ILE A 21 -6.574 1.102 1.104 1.00 0.00 N ATOM 225 CA ILE A 21 -7.136 0.851 -0.217 1.00 0.00 C ATOM 226 C ILE A 21 -8.346 1.741 -0.477 1.00 0.00 C ATOM 227 O ILE A 21 -9.017 1.610 -1.501 1.00 0.00 O ATOM 228 CB ILE A 21 -7.552 -0.622 -0.380 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.454 -1.053 0.779 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.322 -1.515 -0.461 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.214 -2.333 0.510 1.00 0.00 C ATOM 0 H ILE A 21 -6.930 0.489 1.838 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.355 1.082 -0.942 1.00 0.00 H new ATOM 0 HB ILE A 21 -8.113 -0.724 -1.309 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -7.845 -1.183 1.674 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.166 -0.255 0.991 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -6.633 -2.553 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.715 -1.221 -1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.736 -1.411 0.452 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -9.832 -2.577 1.374 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -9.850 -2.202 -0.366 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.508 -3.144 0.328 1.00 0.00 H new ATOM 243 N ALA A 22 -8.618 2.648 0.455 1.00 0.00 N ATOM 244 CA ALA A 22 -9.746 3.563 0.325 1.00 0.00 C ATOM 245 C ALA A 22 -9.575 4.475 -0.886 1.00 0.00 C ATOM 246 O ALA A 22 -8.484 4.979 -1.147 1.00 0.00 O ATOM 247 CB ALA A 22 -9.903 4.390 1.592 1.00 0.00 C ATOM 0 H ALA A 22 -8.073 2.769 1.309 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.649 2.970 0.177 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.749 5.069 1.481 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -10.078 3.727 2.440 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.995 4.967 1.765 1.00 0.00 H new ATOM 253 N SER A 23 -10.662 4.680 -1.622 1.00 0.00 N ATOM 254 CA SER A 23 -10.632 5.527 -2.810 1.00 0.00 C ATOM 255 C SER A 23 -9.738 6.744 -2.587 1.00 0.00 C ATOM 256 O SER A 23 -9.153 7.281 -3.527 1.00 0.00 O ATOM 257 CB SER A 23 -12.047 5.981 -3.174 1.00 0.00 C ATOM 258 OG SER A 23 -12.015 7.080 -4.070 1.00 0.00 O ATOM 0 H SER A 23 -11.574 4.272 -1.418 1.00 0.00 H new ATOM 0 HA SER A 23 -10.222 4.942 -3.633 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.593 5.154 -3.628 1.00 0.00 H new ATOM 0 HB3 SER A 23 -12.587 6.261 -2.269 1.00 0.00 H new ATOM 0 HG SER A 23 -12.931 7.351 -4.289 1.00 0.00 H new ATOM 264 N THR A 24 -9.636 7.173 -1.332 1.00 0.00 N ATOM 265 CA THR A 24 -8.815 8.325 -0.984 1.00 0.00 C ATOM 266 C THR A 24 -8.161 8.142 0.381 1.00 0.00 C ATOM 267 O THR A 24 -8.777 7.623 1.312 1.00 0.00 O ATOM 268 CB THR A 24 -9.644 9.623 -0.972 1.00 0.00 C ATOM 269 OG1 THR A 24 -10.710 9.515 -0.022 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.215 9.913 -2.351 1.00 0.00 C ATOM 0 H THR A 24 -10.112 6.739 -0.541 1.00 0.00 H new ATOM 0 HA THR A 24 -8.041 8.403 -1.748 1.00 0.00 H new ATOM 0 HB THR A 24 -8.987 10.445 -0.688 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.231 10.345 -0.019 1.00 0.00 H new ATOM 0 HG21 THR A 24 -10.797 10.834 -2.318 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.400 10.024 -3.066 1.00 0.00 H new ATOM 0 HG23 THR A 24 -10.858 9.089 -2.659 1.00 0.00 H new ATOM 278 N VAL A 25 -6.907 8.571 0.493 1.00 0.00 N ATOM 279 CA VAL A 25 -6.170 8.455 1.747 1.00 0.00 C ATOM 280 C VAL A 25 -5.459 9.759 2.088 1.00 0.00 C ATOM 281 O VAL A 25 -5.272 10.622 1.229 1.00 0.00 O ATOM 282 CB VAL A 25 -5.132 7.319 1.683 1.00 0.00 C ATOM 283 CG1 VAL A 25 -5.816 5.983 1.436 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.096 7.603 0.607 1.00 0.00 C ATOM 0 H VAL A 25 -6.381 9.001 -0.268 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.900 8.228 2.524 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.619 7.266 2.643 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.066 5.193 1.394 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.515 5.777 2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.357 6.021 0.491 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.371 6.790 0.576 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.590 7.685 -0.361 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.583 8.538 0.833 1.00 0.00 H new ATOM 294 N LYS A 26 -5.063 9.898 3.349 1.00 0.00 N ATOM 295 CA LYS A 26 -4.370 11.097 3.806 1.00 0.00 C ATOM 296 C LYS A 26 -2.864 10.866 3.866 1.00 0.00 C ATOM 297 O LYS A 26 -2.406 9.764 4.174 1.00 0.00 O ATOM 298 CB LYS A 26 -4.888 11.517 5.184 1.00 0.00 C ATOM 299 CG LYS A 26 -6.191 12.295 5.133 1.00 0.00 C ATOM 300 CD LYS A 26 -7.389 11.369 5.002 1.00 0.00 C ATOM 301 CE LYS A 26 -8.648 12.001 5.576 1.00 0.00 C ATOM 302 NZ LYS A 26 -9.299 12.922 4.603 1.00 0.00 N ATOM 0 H LYS A 26 -5.210 9.195 4.073 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.569 11.895 3.091 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.030 10.626 5.796 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.130 12.126 5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.292 12.897 6.036 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.170 12.986 4.290 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.549 11.126 3.952 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.183 10.431 5.518 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.350 11.218 5.861 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.398 12.550 6.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.153 13.332 5.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.638 13.684 4.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -9.561 12.393 3.747 1.00 0.00 H new ATOM 316 N THR A 27 -2.096 11.910 3.572 1.00 0.00 N ATOM 317 CA THR A 27 -0.642 11.821 3.593 1.00 0.00 C ATOM 318 C THR A 27 -0.093 12.114 4.985 1.00 0.00 C ATOM 319 O THR A 27 -0.745 12.772 5.794 1.00 0.00 O ATOM 320 CB THR A 27 -0.004 12.797 2.585 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.419 14.136 2.872 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.393 12.433 1.160 1.00 0.00 C ATOM 0 H THR A 27 -2.458 12.829 3.316 1.00 0.00 H new ATOM 0 HA THR A 27 -0.384 10.800 3.311 1.00 0.00 H new ATOM 0 HB THR A 27 1.080 12.726 2.678 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.008 14.751 2.229 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.069 13.135 0.466 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.050 11.423 0.936 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.477 12.479 1.056 1.00 0.00 H new ATOM 330 N GLY A 28 1.112 11.622 5.257 1.00 0.00 N ATOM 331 CA GLY A 28 1.728 11.843 6.552 1.00 0.00 C ATOM 332 C GLY A 28 1.446 10.718 7.527 1.00 0.00 C ATOM 333 O GLY A 28 2.256 10.436 8.410 1.00 0.00 O ATOM 0 H GLY A 28 1.672 11.075 4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.805 11.948 6.425 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.363 12.781 6.969 1.00 0.00 H new ATOM 337 N GLU A 29 0.293 10.074 7.370 1.00 0.00 N ATOM 338 CA GLU A 29 -0.092 8.975 8.247 1.00 0.00 C ATOM 339 C GLU A 29 0.227 7.628 7.604 1.00 0.00 C ATOM 340 O GLU A 29 0.515 7.552 6.410 1.00 0.00 O ATOM 341 CB GLU A 29 -1.586 9.054 8.573 1.00 0.00 C ATOM 342 CG GLU A 29 -1.989 10.345 9.267 1.00 0.00 C ATOM 343 CD GLU A 29 -3.300 10.219 10.018 1.00 0.00 C ATOM 344 OE1 GLU A 29 -4.360 10.179 9.358 1.00 0.00 O ATOM 345 OE2 GLU A 29 -3.266 10.161 11.265 1.00 0.00 O ATOM 0 H GLU A 29 -0.389 10.294 6.645 1.00 0.00 H new ATOM 0 HA GLU A 29 0.481 9.063 9.170 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.157 8.954 7.650 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.856 8.210 9.208 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.203 10.640 9.962 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.074 11.140 8.526 1.00 0.00 H new ATOM 352 N GLU A 30 0.174 6.569 8.406 1.00 0.00 N ATOM 353 CA GLU A 30 0.460 5.226 7.916 1.00 0.00 C ATOM 354 C GLU A 30 -0.811 4.384 7.864 1.00 0.00 C ATOM 355 O GLU A 30 -1.433 4.114 8.892 1.00 0.00 O ATOM 356 CB GLU A 30 1.500 4.544 8.807 1.00 0.00 C ATOM 357 CG GLU A 30 1.945 3.185 8.294 1.00 0.00 C ATOM 358 CD GLU A 30 3.276 2.749 8.874 1.00 0.00 C ATOM 359 OE1 GLU A 30 4.205 3.582 8.921 1.00 0.00 O ATOM 360 OE2 GLU A 30 3.389 1.574 9.282 1.00 0.00 O ATOM 0 H GLU A 30 -0.064 6.615 9.397 1.00 0.00 H new ATOM 0 HA GLU A 30 0.859 5.313 6.906 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.372 5.193 8.895 1.00 0.00 H new ATOM 0 HB3 GLU A 30 1.087 4.427 9.809 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.186 2.442 8.539 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.020 3.218 7.207 1.00 0.00 H new ATOM 367 N VAL A 31 -1.193 3.972 6.659 1.00 0.00 N ATOM 368 CA VAL A 31 -2.389 3.160 6.472 1.00 0.00 C ATOM 369 C VAL A 31 -2.094 1.683 6.705 1.00 0.00 C ATOM 370 O VAL A 31 -0.938 1.285 6.840 1.00 0.00 O ATOM 371 CB VAL A 31 -2.973 3.339 5.057 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.387 4.785 4.829 1.00 0.00 C ATOM 373 CG2 VAL A 31 -1.968 2.892 4.006 1.00 0.00 C ATOM 0 H VAL A 31 -0.691 4.188 5.798 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.120 3.501 7.205 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.861 2.713 4.967 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.797 4.892 3.825 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.143 5.067 5.562 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.518 5.434 4.937 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.397 3.025 3.013 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.061 3.490 4.093 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.726 1.840 4.158 1.00 0.00 H new ATOM 383 N GLY A 32 -3.148 0.875 6.751 1.00 0.00 N ATOM 384 CA GLY A 32 -2.980 -0.551 6.967 1.00 0.00 C ATOM 385 C GLY A 32 -4.216 -1.344 6.588 1.00 0.00 C ATOM 386 O GLY A 32 -5.183 -1.402 7.347 1.00 0.00 O ATOM 0 H GLY A 32 -4.115 1.181 6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.131 -0.906 6.383 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.744 -0.731 8.016 1.00 0.00 H new ATOM 390 N PHE A 33 -4.184 -1.956 5.408 1.00 0.00 N ATOM 391 CA PHE A 33 -5.310 -2.748 4.928 1.00 0.00 C ATOM 392 C PHE A 33 -5.005 -4.240 5.019 1.00 0.00 C ATOM 393 O PHE A 33 -3.859 -4.639 5.229 1.00 0.00 O ATOM 394 CB PHE A 33 -5.645 -2.372 3.483 1.00 0.00 C ATOM 395 CG PHE A 33 -4.550 -2.700 2.508 1.00 0.00 C ATOM 396 CD1 PHE A 33 -4.494 -3.944 1.903 1.00 0.00 C ATOM 397 CD2 PHE A 33 -3.577 -1.763 2.199 1.00 0.00 C ATOM 398 CE1 PHE A 33 -3.487 -4.249 1.006 1.00 0.00 C ATOM 399 CE2 PHE A 33 -2.567 -2.062 1.304 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.523 -3.306 0.705 1.00 0.00 C ATOM 0 H PHE A 33 -3.391 -1.918 4.768 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.170 -2.532 5.562 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.555 -2.891 3.183 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.856 -1.304 3.434 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -5.245 -4.685 2.134 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.608 -0.788 2.663 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.454 -5.223 0.541 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -1.813 -1.324 1.073 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.737 -3.541 0.003 1.00 0.00 H new ATOM 410 N VAL A 34 -6.039 -5.060 4.861 1.00 0.00 N ATOM 411 CA VAL A 34 -5.883 -6.509 4.925 1.00 0.00 C ATOM 412 C VAL A 34 -6.768 -7.203 3.896 1.00 0.00 C ATOM 413 O VAL A 34 -7.874 -6.749 3.607 1.00 0.00 O ATOM 414 CB VAL A 34 -6.222 -7.048 6.327 1.00 0.00 C ATOM 415 CG1 VAL A 34 -7.683 -6.788 6.659 1.00 0.00 C ATOM 416 CG2 VAL A 34 -5.902 -8.533 6.417 1.00 0.00 C ATOM 0 H VAL A 34 -6.994 -4.746 4.688 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.838 -6.725 4.704 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.609 -6.522 7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -7.905 -7.176 7.653 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.876 -5.715 6.636 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.317 -7.286 5.926 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -6.147 -8.898 7.414 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.489 -9.077 5.677 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -4.840 -8.689 6.225 1.00 0.00 H new ATOM 426 N VAL A 35 -6.273 -8.308 3.347 1.00 0.00 N ATOM 427 CA VAL A 35 -7.019 -9.067 2.352 1.00 0.00 C ATOM 428 C VAL A 35 -7.744 -10.247 2.989 1.00 0.00 C ATOM 429 O VAL A 35 -7.119 -11.223 3.402 1.00 0.00 O ATOM 430 CB VAL A 35 -6.096 -9.590 1.235 1.00 0.00 C ATOM 431 CG1 VAL A 35 -6.776 -10.705 0.457 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.685 -8.455 0.309 1.00 0.00 C ATOM 0 H VAL A 35 -5.358 -8.697 3.575 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.751 -8.385 1.919 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.195 -9.998 1.694 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.108 -11.061 -0.327 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.014 -11.527 1.132 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.694 -10.327 0.008 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.033 -8.842 -0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.574 -8.015 -0.143 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.153 -7.694 0.880 1.00 0.00 H new ATOM 442 N ASP A 36 -9.067 -10.149 3.067 1.00 0.00 N ATOM 443 CA ASP A 36 -9.878 -11.208 3.654 1.00 0.00 C ATOM 444 C ASP A 36 -10.385 -12.165 2.578 1.00 0.00 C ATOM 445 O ASP A 36 -10.923 -11.737 1.558 1.00 0.00 O ATOM 446 CB ASP A 36 -11.060 -10.611 4.419 1.00 0.00 C ATOM 447 CG ASP A 36 -11.492 -11.476 5.587 1.00 0.00 C ATOM 448 OD1 ASP A 36 -11.720 -12.685 5.375 1.00 0.00 O ATOM 449 OD2 ASP A 36 -11.603 -10.944 6.711 1.00 0.00 O ATOM 0 H ASP A 36 -9.600 -9.347 2.731 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.251 -11.768 4.348 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -10.789 -9.621 4.785 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.901 -10.480 3.738 1.00 0.00 H new ATOM 454 N ALA A 37 -10.206 -13.460 2.814 1.00 0.00 N ATOM 455 CA ALA A 37 -10.646 -14.476 1.865 1.00 0.00 C ATOM 456 C ALA A 37 -11.512 -15.528 2.550 1.00 0.00 C ATOM 457 O ALA A 37 -11.111 -16.123 3.551 1.00 0.00 O ATOM 458 CB ALA A 37 -9.445 -15.132 1.200 1.00 0.00 C ATOM 0 H ALA A 37 -9.760 -13.831 3.653 1.00 0.00 H new ATOM 0 HA ALA A 37 -11.249 -13.987 1.100 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.788 -15.888 0.494 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.865 -14.377 0.669 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.820 -15.602 1.960 1.00 0.00 H new ATOM 464 N LYS A 38 -12.703 -15.752 2.005 1.00 0.00 N ATOM 465 CA LYS A 38 -13.628 -16.732 2.562 1.00 0.00 C ATOM 466 C LYS A 38 -13.654 -18.000 1.713 1.00 0.00 C ATOM 467 O LYS A 38 -13.172 -19.052 2.133 1.00 0.00 O ATOM 468 CB LYS A 38 -15.035 -16.140 2.657 1.00 0.00 C ATOM 469 CG LYS A 38 -15.062 -14.720 3.196 1.00 0.00 C ATOM 470 CD LYS A 38 -15.280 -14.698 4.699 1.00 0.00 C ATOM 471 CE LYS A 38 -16.051 -13.461 5.133 1.00 0.00 C ATOM 472 NZ LYS A 38 -15.140 -12.352 5.530 1.00 0.00 N ATOM 0 H LYS A 38 -13.051 -15.268 1.177 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.282 -16.993 3.562 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.493 -16.153 1.668 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -15.645 -16.775 3.299 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.123 -14.221 2.956 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.856 -14.158 2.704 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -15.825 -15.592 5.002 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -14.316 -14.724 5.208 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.694 -13.129 4.318 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.702 -13.714 5.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.703 -11.527 5.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -14.544 -12.660 6.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -14.536 -12.093 4.724 1.00 0.00 H new ATOM 486 N THR A 39 -14.220 -17.892 0.515 1.00 0.00 N ATOM 487 CA THR A 39 -14.309 -19.028 -0.393 1.00 0.00 C ATOM 488 C THR A 39 -13.064 -19.132 -1.267 1.00 0.00 C ATOM 489 O THR A 39 -12.755 -20.199 -1.799 1.00 0.00 O ATOM 490 CB THR A 39 -15.551 -18.928 -1.299 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.373 -17.881 -2.261 1.00 0.00 O ATOM 492 CG2 THR A 39 -16.802 -18.660 -0.475 1.00 0.00 C ATOM 0 H THR A 39 -14.624 -17.029 0.151 1.00 0.00 H new ATOM 0 HA THR A 39 -14.391 -19.921 0.226 1.00 0.00 H new ATOM 0 HB THR A 39 -15.673 -19.879 -1.817 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.216 -17.394 -2.375 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.666 -18.593 -1.136 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.951 -19.473 0.236 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.687 -17.721 0.067 1.00 0.00 H new ATOM 500 N ALA A 40 -12.352 -18.020 -1.410 1.00 0.00 N ATOM 501 CA ALA A 40 -11.140 -17.987 -2.219 1.00 0.00 C ATOM 502 C ALA A 40 -10.356 -19.289 -2.085 1.00 0.00 C ATOM 503 O ALA A 40 -9.987 -19.907 -3.082 1.00 0.00 O ATOM 504 CB ALA A 40 -10.271 -16.803 -1.818 1.00 0.00 C ATOM 0 H ALA A 40 -12.594 -17.129 -0.976 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.432 -17.874 -3.263 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.369 -16.790 -2.430 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.826 -15.877 -1.969 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.995 -16.893 -0.767 1.00 0.00 H new ATOM 510 N GLY A 41 -10.106 -19.699 -0.844 1.00 0.00 N ATOM 511 CA GLY A 41 -9.367 -20.924 -0.605 1.00 0.00 C ATOM 512 C GLY A 41 -7.925 -20.665 -0.215 1.00 0.00 C ATOM 513 O GLY A 41 -7.653 -19.968 0.762 1.00 0.00 O ATOM 0 H GLY A 41 -10.402 -19.205 -0.002 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.857 -21.492 0.185 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -9.392 -21.541 -1.503 1.00 0.00 H new ATOM 517 N LYS A 42 -6.997 -21.230 -0.981 1.00 0.00 N ATOM 518 CA LYS A 42 -5.574 -21.058 -0.713 1.00 0.00 C ATOM 519 C LYS A 42 -4.910 -20.230 -1.809 1.00 0.00 C ATOM 520 O LYS A 42 -5.292 -20.307 -2.975 1.00 0.00 O ATOM 521 CB LYS A 42 -4.887 -22.420 -0.600 1.00 0.00 C ATOM 522 CG LYS A 42 -3.377 -22.330 -0.463 1.00 0.00 C ATOM 523 CD LYS A 42 -2.764 -23.681 -0.136 1.00 0.00 C ATOM 524 CE LYS A 42 -1.245 -23.613 -0.104 1.00 0.00 C ATOM 525 NZ LYS A 42 -0.653 -24.780 0.606 1.00 0.00 N ATOM 0 H LYS A 42 -7.205 -21.811 -1.793 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.469 -20.526 0.233 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.291 -22.951 0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.129 -23.014 -1.482 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.949 -21.950 -1.391 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.124 -21.616 0.321 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.134 -24.025 0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.081 -24.414 -0.878 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.862 -23.575 -1.124 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.933 -22.692 0.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.384 -24.697 0.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.999 -24.802 1.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.930 -25.658 0.122 1.00 0.00 H new ATOM 539 N GLY A 43 -3.913 -19.439 -1.425 1.00 0.00 N ATOM 540 CA GLY A 43 -3.211 -18.610 -2.388 1.00 0.00 C ATOM 541 C GLY A 43 -2.416 -17.501 -1.727 1.00 0.00 C ATOM 542 O GLY A 43 -2.709 -17.103 -0.600 1.00 0.00 O ATOM 0 H GLY A 43 -3.579 -19.357 -0.465 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.539 -19.233 -2.978 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.931 -18.174 -3.081 1.00 0.00 H new ATOM 546 N LYS A 44 -1.404 -17.002 -2.430 1.00 0.00 N ATOM 547 CA LYS A 44 -0.564 -15.932 -1.905 1.00 0.00 C ATOM 548 C LYS A 44 -1.053 -14.570 -2.386 1.00 0.00 C ATOM 549 O LYS A 44 -1.625 -14.451 -3.470 1.00 0.00 O ATOM 550 CB LYS A 44 0.890 -16.143 -2.333 1.00 0.00 C ATOM 551 CG LYS A 44 1.506 -17.419 -1.785 1.00 0.00 C ATOM 552 CD LYS A 44 1.051 -18.639 -2.568 1.00 0.00 C ATOM 553 CE LYS A 44 1.915 -19.853 -2.260 1.00 0.00 C ATOM 554 NZ LYS A 44 3.162 -19.868 -3.073 1.00 0.00 N ATOM 0 H LYS A 44 -1.146 -17.321 -3.364 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.625 -15.956 -0.817 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.940 -16.164 -3.422 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.485 -15.291 -2.003 1.00 0.00 H new ATOM 0 HG2 LYS A 44 2.593 -17.345 -1.824 1.00 0.00 H new ATOM 0 HG3 LYS A 44 1.232 -17.535 -0.737 1.00 0.00 H new ATOM 0 HD2 LYS A 44 0.011 -18.860 -2.327 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.092 -18.423 -3.636 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.172 -19.856 -1.201 1.00 0.00 H new ATOM 0 HE3 LYS A 44 1.345 -20.762 -2.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.723 -20.711 -2.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.917 -19.891 -4.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 3.719 -19.013 -2.871 1.00 0.00 H new ATOM 568 N VAL A 45 -0.823 -13.543 -1.575 1.00 0.00 N ATOM 569 CA VAL A 45 -1.238 -12.188 -1.919 1.00 0.00 C ATOM 570 C VAL A 45 -0.046 -11.238 -1.947 1.00 0.00 C ATOM 571 O VAL A 45 0.611 -11.016 -0.930 1.00 0.00 O ATOM 572 CB VAL A 45 -2.283 -11.652 -0.923 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.695 -10.234 -1.292 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.494 -12.571 -0.874 1.00 0.00 C ATOM 0 H VAL A 45 -0.351 -13.623 -0.674 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.684 -12.236 -2.912 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.833 -11.628 0.070 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.434 -9.872 -0.577 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.820 -9.584 -1.271 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.126 -10.229 -2.293 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.222 -12.176 -0.165 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -3.947 -12.630 -1.864 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -3.183 -13.567 -0.558 1.00 0.00 H new ATOM 584 N THR A 46 0.230 -10.679 -3.122 1.00 0.00 N ATOM 585 CA THR A 46 1.344 -9.753 -3.285 1.00 0.00 C ATOM 586 C THR A 46 0.848 -8.326 -3.485 1.00 0.00 C ATOM 587 O THR A 46 -0.159 -8.097 -4.156 1.00 0.00 O ATOM 588 CB THR A 46 2.232 -10.148 -4.481 1.00 0.00 C ATOM 589 OG1 THR A 46 1.488 -10.045 -5.699 1.00 0.00 O ATOM 590 CG2 THR A 46 2.757 -11.567 -4.319 1.00 0.00 C ATOM 0 H THR A 46 -0.303 -10.852 -3.974 1.00 0.00 H new ATOM 0 HA THR A 46 1.934 -9.805 -2.370 1.00 0.00 H new ATOM 0 HB THR A 46 3.081 -9.465 -4.516 1.00 0.00 H new ATOM 0 HG1 THR A 46 2.107 -9.979 -6.456 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.381 -11.824 -5.175 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.348 -11.634 -3.406 1.00 0.00 H new ATOM 0 HG23 THR A 46 1.918 -12.261 -4.260 1.00 0.00 H new ATOM 598 N CYS A 47 1.560 -7.371 -2.900 1.00 0.00 N ATOM 599 CA CYS A 47 1.192 -5.964 -3.013 1.00 0.00 C ATOM 600 C CYS A 47 2.341 -5.145 -3.594 1.00 0.00 C ATOM 601 O CYS A 47 3.512 -5.451 -3.367 1.00 0.00 O ATOM 602 CB CYS A 47 0.793 -5.407 -1.645 1.00 0.00 C ATOM 603 SG CYS A 47 0.678 -3.603 -1.587 1.00 0.00 S ATOM 0 H CYS A 47 2.396 -7.545 -2.342 1.00 0.00 H new ATOM 0 HA CYS A 47 0.340 -5.891 -3.689 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.169 -5.831 -1.359 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.520 -5.738 -0.904 1.00 0.00 H new ATOM 0 HG CYS A 47 1.869 -3.089 -1.676 1.00 0.00 H new ATOM 609 N THR A 48 1.998 -4.104 -4.346 1.00 0.00 N ATOM 610 CA THR A 48 3.000 -3.243 -4.961 1.00 0.00 C ATOM 611 C THR A 48 2.506 -1.805 -5.057 1.00 0.00 C ATOM 612 O THR A 48 1.635 -1.490 -5.868 1.00 0.00 O ATOM 613 CB THR A 48 3.378 -3.739 -6.369 1.00 0.00 C ATOM 614 OG1 THR A 48 3.880 -5.079 -6.300 1.00 0.00 O ATOM 615 CG2 THR A 48 4.425 -2.833 -7.000 1.00 0.00 C ATOM 0 H THR A 48 1.034 -3.837 -4.544 1.00 0.00 H new ATOM 0 HA THR A 48 3.882 -3.279 -4.322 1.00 0.00 H new ATOM 0 HB THR A 48 2.481 -3.719 -6.988 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.116 -5.387 -7.200 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.676 -3.204 -7.994 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.030 -1.820 -7.080 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.321 -2.825 -6.379 1.00 0.00 H new ATOM 623 N VAL A 49 3.067 -0.934 -4.224 1.00 0.00 N ATOM 624 CA VAL A 49 2.685 0.473 -4.217 1.00 0.00 C ATOM 625 C VAL A 49 3.453 1.257 -5.275 1.00 0.00 C ATOM 626 O VAL A 49 4.679 1.360 -5.220 1.00 0.00 O ATOM 627 CB VAL A 49 2.931 1.114 -2.839 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.455 2.558 -2.828 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.244 0.310 -1.747 1.00 0.00 C ATOM 0 H VAL A 49 3.788 -1.178 -3.545 1.00 0.00 H new ATOM 0 HA VAL A 49 1.619 0.513 -4.443 1.00 0.00 H new ATOM 0 HB VAL A 49 4.003 1.109 -2.643 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.637 2.994 -1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.998 3.126 -3.583 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.388 2.591 -3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.429 0.778 -0.780 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.171 0.281 -1.937 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.639 -0.706 -1.740 1.00 0.00 H new ATOM 639 N LEU A 50 2.724 1.810 -6.239 1.00 0.00 N ATOM 640 CA LEU A 50 3.336 2.587 -7.311 1.00 0.00 C ATOM 641 C LEU A 50 3.096 4.079 -7.108 1.00 0.00 C ATOM 642 O LEU A 50 1.966 4.558 -7.220 1.00 0.00 O ATOM 643 CB LEU A 50 2.780 2.149 -8.667 1.00 0.00 C ATOM 644 CG LEU A 50 3.715 2.323 -9.863 1.00 0.00 C ATOM 645 CD1 LEU A 50 3.393 1.305 -10.946 1.00 0.00 C ATOM 646 CD2 LEU A 50 3.616 3.738 -10.416 1.00 0.00 C ATOM 0 H LEU A 50 1.709 1.734 -6.300 1.00 0.00 H new ATOM 0 HA LEU A 50 4.410 2.405 -7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.500 1.098 -8.600 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.866 2.710 -8.861 1.00 0.00 H new ATOM 0 HG LEU A 50 4.738 2.155 -9.526 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.069 1.445 -11.789 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.514 0.298 -10.547 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.364 1.442 -11.279 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.289 3.844 -11.267 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.592 3.933 -10.736 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.896 4.452 -9.641 1.00 0.00 H new ATOM 658 N THR A 51 4.165 4.811 -6.811 1.00 0.00 N ATOM 659 CA THR A 51 4.070 6.249 -6.594 1.00 0.00 C ATOM 660 C THR A 51 3.816 6.988 -7.903 1.00 0.00 C ATOM 661 O THR A 51 4.223 6.551 -8.979 1.00 0.00 O ATOM 662 CB THR A 51 5.353 6.805 -5.945 1.00 0.00 C ATOM 663 OG1 THR A 51 6.485 6.518 -6.774 1.00 0.00 O ATOM 664 CG2 THR A 51 5.564 6.205 -4.564 1.00 0.00 C ATOM 0 H THR A 51 5.107 4.431 -6.715 1.00 0.00 H new ATOM 0 HA THR A 51 3.229 6.411 -5.919 1.00 0.00 H new ATOM 0 HB THR A 51 5.244 7.885 -5.842 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.721 5.571 -6.689 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.475 6.612 -4.126 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.714 6.450 -3.927 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.654 5.122 -4.648 1.00 0.00 H new ATOM 672 N PRO A 52 3.127 8.135 -7.811 1.00 0.00 N ATOM 673 CA PRO A 52 2.803 8.958 -8.980 1.00 0.00 C ATOM 674 C PRO A 52 4.035 9.633 -9.573 1.00 0.00 C ATOM 675 O PRO A 52 3.937 10.384 -10.543 1.00 0.00 O ATOM 676 CB PRO A 52 1.839 10.007 -8.419 1.00 0.00 C ATOM 677 CG PRO A 52 2.177 10.096 -6.971 1.00 0.00 C ATOM 678 CD PRO A 52 2.610 8.716 -6.561 1.00 0.00 C ATOM 0 HA PRO A 52 2.384 8.364 -9.793 1.00 0.00 H new ATOM 0 HB2 PRO A 52 1.968 10.969 -8.915 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.801 9.709 -8.566 1.00 0.00 H new ATOM 0 HG2 PRO A 52 2.972 10.821 -6.800 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.316 10.424 -6.389 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.376 8.749 -5.786 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.778 8.136 -6.162 1.00 0.00 H new ATOM 686 N ASP A 53 5.195 9.359 -8.984 1.00 0.00 N ATOM 687 CA ASP A 53 6.447 9.938 -9.456 1.00 0.00 C ATOM 688 C ASP A 53 7.057 9.084 -10.563 1.00 0.00 C ATOM 689 O ASP A 53 7.831 9.575 -11.384 1.00 0.00 O ATOM 690 CB ASP A 53 7.437 10.078 -8.298 1.00 0.00 C ATOM 691 CG ASP A 53 8.434 11.198 -8.521 1.00 0.00 C ATOM 692 OD1 ASP A 53 8.069 12.372 -8.300 1.00 0.00 O ATOM 693 OD2 ASP A 53 9.581 10.900 -8.916 1.00 0.00 O ATOM 0 H ASP A 53 5.293 8.740 -8.179 1.00 0.00 H new ATOM 0 HA ASP A 53 6.232 10.927 -9.861 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.888 10.263 -7.375 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.974 9.138 -8.167 1.00 0.00 H new ATOM 698 N GLY A 54 6.705 7.802 -10.577 1.00 0.00 N ATOM 699 CA GLY A 54 7.229 6.900 -11.587 1.00 0.00 C ATOM 700 C GLY A 54 8.199 5.888 -11.013 1.00 0.00 C ATOM 701 O GLY A 54 9.007 5.308 -11.739 1.00 0.00 O ATOM 0 H GLY A 54 6.067 7.372 -9.908 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.402 6.375 -12.065 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.730 7.479 -12.363 1.00 0.00 H new ATOM 705 N THR A 55 8.124 5.674 -9.702 1.00 0.00 N ATOM 706 CA THR A 55 9.004 4.727 -9.029 1.00 0.00 C ATOM 707 C THR A 55 8.214 3.793 -8.120 1.00 0.00 C ATOM 708 O THR A 55 7.165 4.164 -7.595 1.00 0.00 O ATOM 709 CB THR A 55 10.076 5.452 -8.195 1.00 0.00 C ATOM 710 OG1 THR A 55 9.452 6.319 -7.242 1.00 0.00 O ATOM 711 CG2 THR A 55 11.004 6.260 -9.090 1.00 0.00 C ATOM 0 H THR A 55 7.462 6.145 -9.085 1.00 0.00 H new ATOM 0 HA THR A 55 9.494 4.142 -9.808 1.00 0.00 H new ATOM 0 HB THR A 55 10.666 4.700 -7.671 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.478 6.237 -7.313 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.753 6.763 -8.478 1.00 0.00 H new ATOM 0 HG22 THR A 55 11.500 5.594 -9.796 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.425 7.003 -9.638 1.00 0.00 H new ATOM 719 N GLU A 56 8.726 2.579 -7.938 1.00 0.00 N ATOM 720 CA GLU A 56 8.068 1.592 -7.091 1.00 0.00 C ATOM 721 C GLU A 56 8.493 1.753 -5.635 1.00 0.00 C ATOM 722 O GLU A 56 9.607 2.193 -5.349 1.00 0.00 O ATOM 723 CB GLU A 56 8.388 0.177 -7.574 1.00 0.00 C ATOM 724 CG GLU A 56 7.811 -0.145 -8.943 1.00 0.00 C ATOM 725 CD GLU A 56 8.712 0.304 -10.077 1.00 0.00 C ATOM 726 OE1 GLU A 56 8.917 1.527 -10.224 1.00 0.00 O ATOM 727 OE2 GLU A 56 9.212 -0.568 -10.818 1.00 0.00 O ATOM 0 H GLU A 56 9.594 2.256 -8.366 1.00 0.00 H new ATOM 0 HA GLU A 56 6.992 1.755 -7.157 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.470 0.049 -7.606 1.00 0.00 H new ATOM 0 HB3 GLU A 56 8.004 -0.541 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 56 7.645 -1.220 -9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.838 0.336 -9.045 1.00 0.00 H new ATOM 734 N ALA A 57 7.600 1.393 -4.719 1.00 0.00 N ATOM 735 CA ALA A 57 7.884 1.496 -3.293 1.00 0.00 C ATOM 736 C ALA A 57 7.851 0.125 -2.627 1.00 0.00 C ATOM 737 O ALA A 57 7.595 -0.887 -3.279 1.00 0.00 O ATOM 738 CB ALA A 57 6.890 2.434 -2.624 1.00 0.00 C ATOM 0 H ALA A 57 6.674 1.027 -4.939 1.00 0.00 H new ATOM 0 HA ALA A 57 8.888 1.904 -3.176 1.00 0.00 H new ATOM 0 HB1 ALA A 57 7.114 2.502 -1.559 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.964 3.424 -3.074 1.00 0.00 H new ATOM 0 HB3 ALA A 57 5.879 2.049 -2.759 1.00 0.00 H new ATOM 744 N GLU A 58 8.113 0.099 -1.324 1.00 0.00 N ATOM 745 CA GLU A 58 8.115 -1.150 -0.570 1.00 0.00 C ATOM 746 C GLU A 58 6.867 -1.262 0.301 1.00 0.00 C ATOM 747 O GLU A 58 6.485 -0.310 0.983 1.00 0.00 O ATOM 748 CB GLU A 58 9.369 -1.243 0.302 1.00 0.00 C ATOM 749 CG GLU A 58 10.653 -1.401 -0.494 1.00 0.00 C ATOM 750 CD GLU A 58 11.805 -1.910 0.352 1.00 0.00 C ATOM 751 OE1 GLU A 58 11.869 -3.134 0.591 1.00 0.00 O ATOM 752 OE2 GLU A 58 12.641 -1.084 0.775 1.00 0.00 O ATOM 0 H GLU A 58 8.326 0.928 -0.769 1.00 0.00 H new ATOM 0 HA GLU A 58 8.115 -1.975 -1.283 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.441 -0.346 0.917 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.267 -2.089 0.982 1.00 0.00 H new ATOM 0 HG2 GLU A 58 10.481 -2.091 -1.320 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.925 -0.441 -0.932 1.00 0.00 H new ATOM 759 N ALA A 59 6.235 -2.430 0.272 1.00 0.00 N ATOM 760 CA ALA A 59 5.031 -2.668 1.058 1.00 0.00 C ATOM 761 C ALA A 59 5.185 -3.905 1.937 1.00 0.00 C ATOM 762 O ALA A 59 5.323 -5.021 1.437 1.00 0.00 O ATOM 763 CB ALA A 59 3.824 -2.816 0.144 1.00 0.00 C ATOM 0 H ALA A 59 6.537 -3.227 -0.288 1.00 0.00 H new ATOM 0 HA ALA A 59 4.877 -1.808 1.709 1.00 0.00 H new ATOM 0 HB1 ALA A 59 2.932 -2.993 0.745 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.694 -1.903 -0.438 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.980 -3.657 -0.531 1.00 0.00 H new ATOM 769 N ASP A 60 5.161 -3.698 3.250 1.00 0.00 N ATOM 770 CA ASP A 60 5.298 -4.797 4.199 1.00 0.00 C ATOM 771 C ASP A 60 4.047 -5.671 4.203 1.00 0.00 C ATOM 772 O ASP A 60 2.924 -5.166 4.200 1.00 0.00 O ATOM 773 CB ASP A 60 5.560 -4.254 5.604 1.00 0.00 C ATOM 774 CG ASP A 60 7.002 -3.826 5.801 1.00 0.00 C ATOM 775 OD1 ASP A 60 7.873 -4.713 5.918 1.00 0.00 O ATOM 776 OD2 ASP A 60 7.259 -2.604 5.837 1.00 0.00 O ATOM 0 H ASP A 60 5.048 -2.780 3.681 1.00 0.00 H new ATOM 0 HA ASP A 60 6.145 -5.409 3.890 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.903 -3.404 5.790 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.308 -5.019 6.339 1.00 0.00 H new ATOM 781 N VAL A 61 4.250 -6.984 4.207 1.00 0.00 N ATOM 782 CA VAL A 61 3.139 -7.928 4.211 1.00 0.00 C ATOM 783 C VAL A 61 3.272 -8.928 5.354 1.00 0.00 C ATOM 784 O VAL A 61 4.361 -9.438 5.623 1.00 0.00 O ATOM 785 CB VAL A 61 3.051 -8.697 2.879 1.00 0.00 C ATOM 786 CG1 VAL A 61 1.777 -9.527 2.824 1.00 0.00 C ATOM 787 CG2 VAL A 61 3.121 -7.734 1.703 1.00 0.00 C ATOM 0 H VAL A 61 5.173 -7.418 4.208 1.00 0.00 H new ATOM 0 HA VAL A 61 2.228 -7.344 4.346 1.00 0.00 H new ATOM 0 HB VAL A 61 3.901 -9.376 2.815 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.733 -10.063 1.876 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.773 -10.243 3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.911 -8.871 2.911 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.057 -8.294 0.770 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.292 -7.029 1.760 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.064 -7.188 1.735 1.00 0.00 H new ATOM 797 N ILE A 62 2.158 -9.205 6.023 1.00 0.00 N ATOM 798 CA ILE A 62 2.150 -10.145 7.137 1.00 0.00 C ATOM 799 C ILE A 62 1.025 -11.164 6.988 1.00 0.00 C ATOM 800 O ILE A 62 -0.154 -10.807 6.994 1.00 0.00 O ATOM 801 CB ILE A 62 1.995 -9.420 8.485 1.00 0.00 C ATOM 802 CG1 ILE A 62 3.095 -8.369 8.653 1.00 0.00 C ATOM 803 CG2 ILE A 62 2.031 -10.420 9.632 1.00 0.00 C ATOM 804 CD1 ILE A 62 2.766 -7.041 8.007 1.00 0.00 C ATOM 0 H ILE A 62 1.249 -8.792 5.813 1.00 0.00 H new ATOM 0 HA ILE A 62 3.110 -10.661 7.121 1.00 0.00 H new ATOM 0 HB ILE A 62 1.030 -8.914 8.500 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.276 -8.212 9.716 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.021 -8.753 8.225 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.920 -9.892 10.579 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.216 -11.134 9.518 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.983 -10.951 9.622 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.590 -6.345 8.166 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.613 -7.185 6.937 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.857 -6.635 8.452 1.00 0.00 H new ATOM 816 N GLU A 63 1.396 -12.433 6.856 1.00 0.00 N ATOM 817 CA GLU A 63 0.416 -13.504 6.707 1.00 0.00 C ATOM 818 C GLU A 63 -0.209 -13.860 8.053 1.00 0.00 C ATOM 819 O GLU A 63 0.403 -13.673 9.103 1.00 0.00 O ATOM 820 CB GLU A 63 1.071 -14.743 6.094 1.00 0.00 C ATOM 821 CG GLU A 63 2.134 -14.419 5.056 1.00 0.00 C ATOM 822 CD GLU A 63 2.411 -15.582 4.123 1.00 0.00 C ATOM 823 OE1 GLU A 63 1.506 -16.423 3.939 1.00 0.00 O ATOM 824 OE2 GLU A 63 3.531 -15.650 3.577 1.00 0.00 O ATOM 0 H GLU A 63 2.367 -12.745 6.849 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.372 -13.151 6.041 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.521 -15.337 6.889 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.300 -15.360 5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.814 -13.557 4.471 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.057 -14.136 5.562 1.00 0.00 H new ATOM 831 N ASN A 64 -1.434 -14.373 8.011 1.00 0.00 N ATOM 832 CA ASN A 64 -2.145 -14.754 9.227 1.00 0.00 C ATOM 833 C ASN A 64 -2.736 -16.155 9.095 1.00 0.00 C ATOM 834 O ASN A 64 -3.121 -16.576 8.005 1.00 0.00 O ATOM 835 CB ASN A 64 -3.256 -13.747 9.531 1.00 0.00 C ATOM 836 CG ASN A 64 -2.737 -12.510 10.238 1.00 0.00 C ATOM 837 OD1 ASN A 64 -2.310 -11.520 9.463 1.00 0.00 O flip ATOM 838 ND2 ASN A 64 -2.720 -12.446 11.467 1.00 0.00 N flip ATOM 0 H ASN A 64 -1.955 -14.535 7.149 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.430 -14.756 10.050 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.741 -13.453 8.600 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -4.016 -14.224 10.150 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.058 -13.231 12.023 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.368 -11.608 11.929 1.00 0.00 H new ATOM 845 N GLU A 65 -2.803 -16.870 10.213 1.00 0.00 N ATOM 846 CA GLU A 65 -3.347 -18.223 10.222 1.00 0.00 C ATOM 847 C GLU A 65 -4.792 -18.232 9.730 1.00 0.00 C ATOM 848 O GLU A 65 -5.362 -19.290 9.465 1.00 0.00 O ATOM 849 CB GLU A 65 -3.273 -18.818 11.629 1.00 0.00 C ATOM 850 CG GLU A 65 -1.888 -19.321 12.005 1.00 0.00 C ATOM 851 CD GLU A 65 -1.383 -20.398 11.065 1.00 0.00 C ATOM 852 OE1 GLU A 65 -2.089 -21.412 10.891 1.00 0.00 O ATOM 853 OE2 GLU A 65 -0.281 -20.224 10.502 1.00 0.00 O ATOM 0 H GLU A 65 -2.488 -16.536 11.124 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.747 -18.832 9.546 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.584 -18.063 12.351 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.982 -19.642 11.704 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -1.189 -18.485 12.002 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.912 -19.713 13.022 1.00 0.00 H new ATOM 860 N ASP A 66 -5.378 -17.046 9.611 1.00 0.00 N ATOM 861 CA ASP A 66 -6.755 -16.916 9.152 1.00 0.00 C ATOM 862 C ASP A 66 -6.805 -16.689 7.644 1.00 0.00 C ATOM 863 O ASP A 66 -7.717 -16.038 7.134 1.00 0.00 O ATOM 864 CB ASP A 66 -7.451 -15.763 9.877 1.00 0.00 C ATOM 865 CG ASP A 66 -8.129 -16.210 11.157 1.00 0.00 C ATOM 866 OD1 ASP A 66 -7.416 -16.447 12.155 1.00 0.00 O ATOM 867 OD2 ASP A 66 -9.373 -16.323 11.161 1.00 0.00 O ATOM 0 H ASP A 66 -4.920 -16.160 9.826 1.00 0.00 H new ATOM 0 HA ASP A 66 -7.277 -17.845 9.380 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.720 -14.988 10.108 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -8.191 -15.315 9.214 1.00 0.00 H new ATOM 872 N GLY A 67 -5.818 -17.229 6.935 1.00 0.00 N ATOM 873 CA GLY A 67 -5.768 -17.073 5.494 1.00 0.00 C ATOM 874 C GLY A 67 -5.945 -15.630 5.060 1.00 0.00 C ATOM 875 O GLY A 67 -6.769 -15.330 4.195 1.00 0.00 O ATOM 0 H GLY A 67 -5.052 -17.772 7.334 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.813 -17.446 5.124 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.547 -17.684 5.038 1.00 0.00 H new ATOM 879 N THR A 68 -5.171 -14.734 5.664 1.00 0.00 N ATOM 880 CA THR A 68 -5.249 -13.315 5.337 1.00 0.00 C ATOM 881 C THR A 68 -3.859 -12.694 5.252 1.00 0.00 C ATOM 882 O THR A 68 -2.860 -13.339 5.571 1.00 0.00 O ATOM 883 CB THR A 68 -6.079 -12.543 6.380 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.903 -13.125 7.676 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.555 -12.555 6.010 1.00 0.00 C ATOM 0 H THR A 68 -4.484 -14.965 6.381 1.00 0.00 H new ATOM 0 HA THR A 68 -5.739 -13.241 4.366 1.00 0.00 H new ATOM 0 HB THR A 68 -5.731 -11.510 6.397 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.433 -12.627 8.333 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.123 -12.004 6.760 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.690 -12.085 5.036 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.911 -13.584 5.969 1.00 0.00 H new ATOM 893 N TYR A 69 -3.803 -11.439 4.821 1.00 0.00 N ATOM 894 CA TYR A 69 -2.534 -10.732 4.692 1.00 0.00 C ATOM 895 C TYR A 69 -2.694 -9.258 5.046 1.00 0.00 C ATOM 896 O TYR A 69 -3.553 -8.565 4.499 1.00 0.00 O ATOM 897 CB TYR A 69 -1.992 -10.869 3.268 1.00 0.00 C ATOM 898 CG TYR A 69 -1.672 -12.294 2.876 1.00 0.00 C ATOM 899 CD1 TYR A 69 -2.667 -13.148 2.415 1.00 0.00 C ATOM 900 CD2 TYR A 69 -0.377 -12.786 2.968 1.00 0.00 C ATOM 901 CE1 TYR A 69 -2.380 -14.451 2.057 1.00 0.00 C ATOM 902 CE2 TYR A 69 -0.079 -14.088 2.610 1.00 0.00 C ATOM 903 CZ TYR A 69 -1.085 -14.916 2.156 1.00 0.00 C ATOM 904 OH TYR A 69 -0.793 -16.213 1.801 1.00 0.00 O ATOM 0 H TYR A 69 -4.621 -10.890 4.555 1.00 0.00 H new ATOM 0 HA TYR A 69 -1.825 -11.180 5.388 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.724 -10.465 2.569 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -1.091 -10.263 3.171 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.682 -12.787 2.335 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.412 -12.140 3.325 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -3.165 -15.102 1.702 1.00 0.00 H new ATOM 0 HE2 TYR A 69 0.934 -14.454 2.685 1.00 0.00 H new ATOM 0 HH TYR A 69 -0.045 -16.540 2.343 1.00 0.00 H new ATOM 914 N ASP A 70 -1.861 -8.783 5.967 1.00 0.00 N ATOM 915 CA ASP A 70 -1.908 -7.390 6.395 1.00 0.00 C ATOM 916 C ASP A 70 -0.792 -6.582 5.739 1.00 0.00 C ATOM 917 O ASP A 70 0.379 -6.962 5.794 1.00 0.00 O ATOM 918 CB ASP A 70 -1.792 -7.298 7.917 1.00 0.00 C ATOM 919 CG ASP A 70 -3.008 -7.862 8.624 1.00 0.00 C ATOM 920 OD1 ASP A 70 -3.080 -9.099 8.787 1.00 0.00 O ATOM 921 OD2 ASP A 70 -3.888 -7.068 9.017 1.00 0.00 O ATOM 0 H ASP A 70 -1.146 -9.343 6.431 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.866 -6.973 6.085 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.903 -7.837 8.244 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.658 -6.256 8.206 1.00 0.00 H new ATOM 926 N ILE A 71 -1.163 -5.467 5.117 1.00 0.00 N ATOM 927 CA ILE A 71 -0.193 -4.607 4.450 1.00 0.00 C ATOM 928 C ILE A 71 -0.350 -3.156 4.893 1.00 0.00 C ATOM 929 O ILE A 71 -1.463 -2.634 4.962 1.00 0.00 O ATOM 930 CB ILE A 71 -0.333 -4.682 2.918 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.220 -6.133 2.445 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.721 -3.816 2.247 1.00 0.00 C ATOM 933 CD1 ILE A 71 -0.917 -6.394 1.128 1.00 0.00 C ATOM 0 H ILE A 71 -2.127 -5.139 5.061 1.00 0.00 H new ATOM 0 HA ILE A 71 0.796 -4.967 4.734 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.316 -4.304 2.638 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.834 -6.394 2.347 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.642 -6.789 3.207 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.609 -3.880 1.165 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.597 -2.781 2.564 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.714 -4.166 2.530 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.796 -7.442 0.854 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.978 -6.165 1.226 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.480 -5.764 0.354 1.00 0.00 H new ATOM 945 N PHE A 72 0.772 -2.510 5.192 1.00 0.00 N ATOM 946 CA PHE A 72 0.759 -1.118 5.627 1.00 0.00 C ATOM 947 C PHE A 72 1.722 -0.279 4.792 1.00 0.00 C ATOM 948 O PHE A 72 2.760 -0.765 4.343 1.00 0.00 O ATOM 949 CB PHE A 72 1.134 -1.022 7.107 1.00 0.00 C ATOM 950 CG PHE A 72 0.461 -2.054 7.965 1.00 0.00 C ATOM 951 CD1 PHE A 72 0.824 -3.388 7.880 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.537 -1.690 8.855 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.206 -4.341 8.668 1.00 0.00 C ATOM 954 CE2 PHE A 72 -1.158 -2.639 9.646 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.787 -3.966 9.551 1.00 0.00 C ATOM 0 H PHE A 72 1.701 -2.928 5.141 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.249 -0.728 5.488 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.214 -1.127 7.207 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.874 -0.030 7.476 1.00 0.00 H new ATOM 0 HD1 PHE A 72 1.599 -3.687 7.190 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.833 -0.654 8.932 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.500 -5.378 8.593 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.933 -2.343 10.338 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.273 -4.709 10.166 1.00 0.00 H new ATOM 965 N TYR A 73 1.367 0.985 4.584 1.00 0.00 N ATOM 966 CA TYR A 73 2.196 1.893 3.800 1.00 0.00 C ATOM 967 C TYR A 73 1.821 3.347 4.073 1.00 0.00 C ATOM 968 O TYR A 73 0.659 3.662 4.331 1.00 0.00 O ATOM 969 CB TYR A 73 2.053 1.588 2.308 1.00 0.00 C ATOM 970 CG TYR A 73 0.768 2.109 1.706 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.628 3.451 1.373 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.305 1.260 1.467 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.544 3.932 0.822 1.00 0.00 C ATOM 974 CE2 TYR A 73 -1.480 1.731 0.914 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.595 3.069 0.595 1.00 0.00 C ATOM 976 OH TYR A 73 -2.763 3.543 0.045 1.00 0.00 O ATOM 0 H TYR A 73 0.511 1.403 4.948 1.00 0.00 H new ATOM 0 HA TYR A 73 3.234 1.744 4.096 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.898 2.023 1.774 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.103 0.509 2.159 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.450 4.130 1.548 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.219 0.213 1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.636 4.978 0.570 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.304 1.056 0.732 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.522 3.033 0.398 1.00 0.00 H new ATOM 986 N THR A 74 2.814 4.229 4.012 1.00 0.00 N ATOM 987 CA THR A 74 2.590 5.649 4.253 1.00 0.00 C ATOM 988 C THR A 74 2.855 6.467 2.995 1.00 0.00 C ATOM 989 O THR A 74 3.756 6.153 2.217 1.00 0.00 O ATOM 990 CB THR A 74 3.484 6.174 5.392 1.00 0.00 C ATOM 991 OG1 THR A 74 3.258 5.412 6.583 1.00 0.00 O ATOM 992 CG2 THR A 74 3.206 7.645 5.664 1.00 0.00 C ATOM 0 H THR A 74 3.781 3.985 3.798 1.00 0.00 H new ATOM 0 HA THR A 74 1.545 5.760 4.542 1.00 0.00 H new ATOM 0 HB THR A 74 4.525 6.068 5.086 1.00 0.00 H new ATOM 0 HG1 THR A 74 3.831 5.751 7.302 1.00 0.00 H new ATOM 0 HG21 THR A 74 3.849 7.993 6.472 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.407 8.226 4.764 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.162 7.771 5.951 1.00 0.00 H new ATOM 1000 N ALA A 75 2.067 7.519 2.801 1.00 0.00 N ATOM 1001 CA ALA A 75 2.218 8.385 1.638 1.00 0.00 C ATOM 1002 C ALA A 75 2.931 9.681 2.009 1.00 0.00 C ATOM 1003 O ALA A 75 2.318 10.607 2.538 1.00 0.00 O ATOM 1004 CB ALA A 75 0.860 8.684 1.022 1.00 0.00 C ATOM 0 H ALA A 75 1.316 7.793 3.435 1.00 0.00 H new ATOM 0 HA ALA A 75 2.830 7.862 0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.989 9.332 0.155 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.388 7.752 0.712 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.229 9.183 1.757 1.00 0.00 H new ATOM 1010 N ALA A 76 4.229 9.739 1.728 1.00 0.00 N ATOM 1011 CA ALA A 76 5.024 10.923 2.031 1.00 0.00 C ATOM 1012 C ALA A 76 4.425 12.167 1.381 1.00 0.00 C ATOM 1013 O ALA A 76 4.266 13.201 2.029 1.00 0.00 O ATOM 1014 CB ALA A 76 6.461 10.725 1.571 1.00 0.00 C ATOM 0 H ALA A 76 4.752 8.980 1.291 1.00 0.00 H new ATOM 0 HA ALA A 76 5.016 11.070 3.111 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.044 11.617 1.803 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.892 9.866 2.085 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.478 10.551 0.495 1.00 0.00 H new ATOM 1020 N LYS A 77 4.096 12.059 0.098 1.00 0.00 N ATOM 1021 CA LYS A 77 3.514 13.173 -0.639 1.00 0.00 C ATOM 1022 C LYS A 77 2.226 12.751 -1.339 1.00 0.00 C ATOM 1023 O LYS A 77 2.022 11.580 -1.661 1.00 0.00 O ATOM 1024 CB LYS A 77 4.515 13.709 -1.667 1.00 0.00 C ATOM 1025 CG LYS A 77 5.749 14.337 -1.044 1.00 0.00 C ATOM 1026 CD LYS A 77 5.413 15.634 -0.328 1.00 0.00 C ATOM 1027 CE LYS A 77 6.626 16.546 -0.226 1.00 0.00 C ATOM 1028 NZ LYS A 77 6.955 17.179 -1.534 1.00 0.00 N ATOM 0 H LYS A 77 4.223 11.210 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 77 3.276 13.962 0.074 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.824 12.893 -2.321 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.018 14.449 -2.294 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.198 13.637 -0.339 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.491 14.530 -1.819 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.614 16.149 -0.861 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.038 15.412 0.671 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.436 17.322 0.515 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.483 15.972 0.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 7.623 17.962 -1.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 7.387 16.472 -2.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.085 17.546 -1.971 1.00 0.00 H new ATOM 1042 N PRO A 78 1.338 13.726 -1.582 1.00 0.00 N ATOM 1043 CA PRO A 78 0.056 13.478 -2.248 1.00 0.00 C ATOM 1044 C PRO A 78 0.226 13.131 -3.723 1.00 0.00 C ATOM 1045 O PRO A 78 1.324 13.225 -4.271 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.687 14.808 -2.094 1.00 0.00 C ATOM 1047 CG PRO A 78 0.389 15.828 -1.951 1.00 0.00 C ATOM 1048 CD PRO A 78 1.515 15.143 -1.226 1.00 0.00 C ATOM 0 HA PRO A 78 -0.470 12.627 -1.815 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -1.315 15.014 -2.961 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.341 14.798 -1.222 1.00 0.00 H new ATOM 0 HG2 PRO A 78 0.716 16.190 -2.926 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.034 16.694 -1.392 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.487 15.519 -1.546 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.452 15.298 -0.149 1.00 0.00 H new ATOM 1056 N GLY A 79 -0.869 12.729 -4.363 1.00 0.00 N ATOM 1057 CA GLY A 79 -0.819 12.375 -5.768 1.00 0.00 C ATOM 1058 C GLY A 79 -1.670 11.163 -6.092 1.00 0.00 C ATOM 1059 O GLY A 79 -2.616 10.849 -5.369 1.00 0.00 O ATOM 0 H GLY A 79 -1.789 12.643 -3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.157 13.222 -6.365 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.214 12.176 -6.053 1.00 0.00 H new ATOM 1063 N THR A 80 -1.338 10.482 -7.184 1.00 0.00 N ATOM 1064 CA THR A 80 -2.082 9.301 -7.604 1.00 0.00 C ATOM 1065 C THR A 80 -1.266 8.032 -7.385 1.00 0.00 C ATOM 1066 O THR A 80 -0.313 7.761 -8.116 1.00 0.00 O ATOM 1067 CB THR A 80 -2.485 9.389 -9.088 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.108 10.651 -9.352 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.436 8.260 -9.458 1.00 0.00 C ATOM 0 H THR A 80 -0.558 10.728 -7.794 1.00 0.00 H new ATOM 0 HA THR A 80 -2.984 9.261 -6.993 1.00 0.00 H new ATOM 0 HB THR A 80 -1.583 9.296 -9.693 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.784 10.832 -8.666 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.707 8.343 -10.511 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.948 7.301 -9.283 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.335 8.326 -8.846 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.646 7.256 -6.375 1.00 0.00 N ATOM 1078 CA TYR A 81 -0.949 6.015 -6.060 1.00 0.00 C ATOM 1079 C TYR A 81 -1.702 4.810 -6.616 1.00 0.00 C ATOM 1080 O TYR A 81 -2.932 4.781 -6.623 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.780 5.871 -4.547 1.00 0.00 C ATOM 1082 CG TYR A 81 0.251 6.809 -3.961 1.00 0.00 C ATOM 1083 CD1 TYR A 81 0.207 8.174 -4.222 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.270 6.331 -3.147 1.00 0.00 C ATOM 1085 CE1 TYR A 81 1.146 9.034 -3.689 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.214 7.184 -2.608 1.00 0.00 C ATOM 1087 CZ TYR A 81 2.148 8.535 -2.883 1.00 0.00 C ATOM 1088 OH TYR A 81 3.088 9.388 -2.350 1.00 0.00 O ATOM 0 H TYR A 81 -2.433 7.465 -5.761 1.00 0.00 H new ATOM 0 HA TYR A 81 0.035 6.052 -6.527 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.740 6.052 -4.064 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.496 4.844 -4.318 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.576 8.568 -4.853 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.325 5.274 -2.932 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.096 10.092 -3.902 1.00 0.00 H new ATOM 0 HE2 TYR A 81 2.999 6.796 -1.975 1.00 0.00 H new ATOM 0 HH TYR A 81 2.716 10.293 -2.299 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.953 3.816 -7.081 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.547 2.607 -7.639 1.00 0.00 C ATOM 1100 C VAL A 82 -1.054 1.364 -6.906 1.00 0.00 C ATOM 1101 O VAL A 82 0.143 1.075 -6.888 1.00 0.00 O ATOM 1102 CB VAL A 82 -1.228 2.464 -9.138 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.755 1.141 -9.673 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.808 3.634 -9.919 1.00 0.00 C ATOM 0 H VAL A 82 0.067 3.824 -7.082 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.626 2.698 -7.512 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.145 2.473 -9.264 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.520 1.058 -10.734 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.288 0.318 -9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.836 1.098 -9.536 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.573 3.517 -10.977 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.890 3.658 -9.788 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.377 4.566 -9.552 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.984 0.633 -6.301 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.645 -0.580 -5.568 1.00 0.00 C ATOM 1116 C ILE A 83 -2.036 -1.827 -6.354 1.00 0.00 C ATOM 1117 O ILE A 83 -3.203 -2.013 -6.700 1.00 0.00 O ATOM 1118 CB ILE A 83 -2.335 -0.617 -4.191 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.883 0.570 -3.338 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -2.033 -1.929 -3.483 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.845 0.912 -2.221 1.00 0.00 C ATOM 0 H ILE A 83 -2.978 0.860 -6.304 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.565 -0.569 -5.424 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.413 -0.545 -4.339 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.906 0.348 -2.910 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.759 1.442 -3.980 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.527 -1.940 -2.512 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.399 -2.760 -4.086 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.956 -2.028 -3.344 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -2.461 1.763 -1.658 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.817 1.166 -2.643 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.950 0.055 -1.556 1.00 0.00 H new ATOM 1133 N TYR A 84 -1.054 -2.677 -6.632 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.295 -3.905 -7.378 1.00 0.00 C ATOM 1135 C TYR A 84 -1.443 -5.095 -6.435 1.00 0.00 C ATOM 1136 O TYR A 84 -0.553 -5.383 -5.635 1.00 0.00 O ATOM 1137 CB TYR A 84 -0.155 -4.160 -8.364 1.00 0.00 C ATOM 1138 CG TYR A 84 0.058 -3.033 -9.349 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -0.967 -2.616 -10.190 1.00 0.00 C ATOM 1140 CD2 TYR A 84 1.283 -2.386 -9.439 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -0.777 -1.587 -11.091 1.00 0.00 C ATOM 1142 CE2 TYR A 84 1.482 -1.354 -10.337 1.00 0.00 C ATOM 1143 CZ TYR A 84 0.449 -0.959 -11.161 1.00 0.00 C ATOM 1144 OH TYR A 84 0.643 0.068 -12.057 1.00 0.00 O ATOM 0 H TYR A 84 -0.083 -2.538 -6.352 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.226 -3.786 -7.933 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.767 -4.323 -7.806 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.361 -5.078 -8.914 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.928 -3.105 -10.138 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.094 -2.694 -8.796 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.584 -1.276 -11.737 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.441 -0.860 -10.393 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.225 0.383 -12.387 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.575 -5.785 -6.535 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.841 -6.946 -5.693 1.00 0.00 C ATOM 1156 C VAL A 85 -3.242 -8.154 -6.533 1.00 0.00 C ATOM 1157 O VAL A 85 -3.910 -8.015 -7.557 1.00 0.00 O ATOM 1158 CB VAL A 85 -3.953 -6.653 -4.669 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -3.940 -7.690 -3.556 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.800 -5.249 -4.103 1.00 0.00 C ATOM 0 H VAL A 85 -3.323 -5.560 -7.191 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.917 -7.169 -5.160 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.916 -6.712 -5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.732 -7.467 -2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.102 -8.681 -3.980 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.976 -7.666 -3.048 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.594 -5.059 -3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.832 -5.159 -3.610 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.864 -4.522 -4.912 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.831 -9.338 -6.091 1.00 0.00 N ATOM 1171 CA ARG A 86 -3.147 -10.570 -6.802 1.00 0.00 C ATOM 1172 C ARG A 86 -3.312 -11.733 -5.828 1.00 0.00 C ATOM 1173 O ARG A 86 -2.944 -11.633 -4.657 1.00 0.00 O ATOM 1174 CB ARG A 86 -2.051 -10.894 -7.819 1.00 0.00 C ATOM 1175 CG ARG A 86 -0.836 -11.572 -7.209 1.00 0.00 C ATOM 1176 CD ARG A 86 0.262 -11.782 -8.240 1.00 0.00 C ATOM 1177 NE ARG A 86 1.512 -12.222 -7.628 1.00 0.00 N ATOM 1178 CZ ARG A 86 2.657 -12.335 -8.292 1.00 0.00 C ATOM 1179 NH1 ARG A 86 2.709 -12.041 -9.584 1.00 0.00 N ATOM 1180 NH2 ARG A 86 3.752 -12.743 -7.664 1.00 0.00 N ATOM 0 H ARG A 86 -2.278 -9.470 -5.244 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.090 -10.423 -7.329 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.465 -11.539 -8.594 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.735 -9.972 -8.307 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.454 -10.966 -6.388 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.128 -12.533 -6.787 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.064 -12.522 -8.971 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.432 -10.852 -8.783 1.00 0.00 H new ATOM 0 HE ARG A 86 1.506 -12.456 -6.635 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.869 -11.727 -10.070 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.589 -12.128 -10.092 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.715 -12.970 -6.670 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.631 -12.829 -8.175 1.00 0.00 H new ATOM 1194 N PHE A 87 -3.865 -12.836 -6.319 1.00 0.00 N ATOM 1195 CA PHE A 87 -4.080 -14.018 -5.492 1.00 0.00 C ATOM 1196 C PHE A 87 -3.600 -15.277 -6.208 1.00 0.00 C ATOM 1197 O PHE A 87 -4.294 -15.819 -7.067 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.561 -14.154 -5.135 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.868 -15.367 -4.302 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -5.414 -15.460 -2.996 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -6.610 -16.413 -4.826 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -5.695 -16.575 -2.230 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -6.894 -17.531 -4.064 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.436 -17.611 -2.764 1.00 0.00 C ATOM 0 H PHE A 87 -4.173 -12.937 -7.286 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.502 -13.900 -4.575 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.880 -13.262 -4.595 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.146 -14.197 -6.054 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -4.835 -14.653 -2.573 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.971 -16.354 -5.842 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.335 -16.636 -1.214 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -7.473 -18.340 -4.485 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.657 -18.482 -2.166 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.406 -15.737 -5.847 1.00 0.00 N ATOM 1215 CA GLY A 88 -1.851 -16.928 -6.465 1.00 0.00 C ATOM 1216 C GLY A 88 -1.525 -16.722 -7.931 1.00 0.00 C ATOM 1217 O GLY A 88 -1.599 -17.658 -8.727 1.00 0.00 O ATOM 0 H GLY A 88 -1.813 -15.306 -5.138 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.946 -17.222 -5.933 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.561 -17.749 -6.366 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.165 -15.495 -8.289 1.00 0.00 N ATOM 1222 CA GLY A 89 -0.833 -15.191 -9.669 1.00 0.00 C ATOM 1223 C GLY A 89 -2.036 -14.729 -10.467 1.00 0.00 C ATOM 1224 O GLY A 89 -2.068 -14.861 -11.690 1.00 0.00 O ATOM 0 H GLY A 89 -1.097 -14.704 -7.648 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.066 -14.417 -9.693 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.407 -16.077 -10.140 1.00 0.00 H new ATOM 1228 N VAL A 90 -3.032 -14.188 -9.772 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.245 -13.706 -10.423 1.00 0.00 C ATOM 1230 C VAL A 90 -4.564 -12.276 -10.001 1.00 0.00 C ATOM 1231 O VAL A 90 -4.663 -11.976 -8.812 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.452 -14.606 -10.099 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -6.727 -14.020 -10.684 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -5.218 -16.018 -10.617 1.00 0.00 C ATOM 0 H VAL A 90 -3.023 -14.073 -8.759 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.059 -13.733 -11.497 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.566 -14.655 -9.016 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.569 -14.670 -10.445 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.900 -13.031 -10.261 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -6.627 -13.939 -11.766 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.081 -16.640 -10.379 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.077 -15.990 -11.697 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.328 -16.436 -10.146 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.723 -11.397 -10.984 1.00 0.00 N ATOM 1245 CA ASP A 91 -5.032 -9.997 -10.715 1.00 0.00 C ATOM 1246 C ASP A 91 -6.519 -9.815 -10.426 1.00 0.00 C ATOM 1247 O ASP A 91 -7.323 -9.640 -11.343 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.620 -9.125 -11.903 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.789 -7.645 -11.619 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -3.839 -7.031 -11.091 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -5.870 -7.101 -11.927 1.00 0.00 O ATOM 0 H ASP A 91 -4.643 -11.629 -11.974 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.469 -9.688 -9.834 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.579 -9.327 -12.155 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.217 -9.396 -12.774 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.878 -9.860 -9.147 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.267 -9.699 -8.738 1.00 0.00 C ATOM 1258 C ILE A 92 -8.971 -8.643 -9.583 1.00 0.00 C ATOM 1259 O ILE A 92 -8.341 -7.774 -10.186 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.374 -9.309 -7.252 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.227 -8.375 -6.864 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.373 -10.552 -6.375 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.360 -7.800 -5.471 1.00 0.00 C ATOM 0 H ILE A 92 -6.226 -10.007 -8.377 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.754 -10.663 -8.888 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.315 -8.782 -7.097 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.286 -8.920 -6.935 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.177 -7.557 -7.583 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.449 -10.259 -5.328 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.222 -11.183 -6.638 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.447 -11.106 -6.530 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.512 -7.147 -5.264 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.284 -7.227 -5.401 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.380 -8.611 -4.743 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.310 -8.717 -9.627 1.00 0.00 N ATOM 1276 CA PRO A 93 -11.129 -7.773 -10.393 1.00 0.00 C ATOM 1277 C PRO A 93 -11.127 -6.375 -9.782 1.00 0.00 C ATOM 1278 O PRO A 93 -11.810 -5.475 -10.268 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.530 -8.383 -10.326 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.528 -9.201 -9.081 1.00 0.00 C ATOM 1281 CD PRO A 93 -11.126 -9.725 -8.933 1.00 0.00 C ATOM 0 HA PRO A 93 -10.755 -7.640 -11.408 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.297 -7.610 -10.290 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.737 -8.997 -11.203 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.813 -8.599 -8.218 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.245 -10.019 -9.150 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.841 -9.820 -7.885 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -11.016 -10.711 -9.384 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.356 -6.203 -8.714 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.265 -4.914 -8.036 1.00 0.00 C ATOM 1291 C ASN A 94 -8.935 -4.231 -8.339 1.00 0.00 C ATOM 1292 O ASN A 94 -8.738 -3.061 -8.013 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.426 -5.097 -6.525 1.00 0.00 C ATOM 1294 CG ASN A 94 -11.576 -6.021 -6.174 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -11.377 -7.071 -5.562 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.785 -5.634 -6.561 1.00 0.00 N ATOM 0 H ASN A 94 -9.785 -6.939 -8.299 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.070 -4.279 -8.406 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.501 -5.498 -6.110 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -10.589 -4.125 -6.059 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.597 -6.215 -6.353 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.902 -4.756 -7.066 1.00 0.00 H new ATOM 1303 N SER A 95 -8.025 -4.972 -8.965 1.00 0.00 N ATOM 1304 CA SER A 95 -6.713 -4.440 -9.310 1.00 0.00 C ATOM 1305 C SER A 95 -6.689 -3.942 -10.751 1.00 0.00 C ATOM 1306 O SER A 95 -7.299 -4.526 -11.646 1.00 0.00 O ATOM 1307 CB SER A 95 -5.637 -5.509 -9.110 1.00 0.00 C ATOM 1308 OG SER A 95 -4.401 -4.926 -8.737 1.00 0.00 O ATOM 0 H SER A 95 -8.173 -5.942 -9.243 1.00 0.00 H new ATOM 0 HA SER A 95 -6.506 -3.598 -8.650 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.957 -6.212 -8.341 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.511 -6.079 -10.031 1.00 0.00 H new ATOM 0 HG SER A 95 -3.682 -5.306 -9.284 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.968 -2.835 -10.983 1.00 0.00 N ATOM 1315 CA PRO A 96 -5.238 -2.131 -9.924 1.00 0.00 C ATOM 1316 C PRO A 96 -6.172 -1.435 -8.940 1.00 0.00 C ATOM 1317 O PRO A 96 -7.389 -1.423 -9.127 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.407 -1.100 -10.693 1.00 0.00 C ATOM 1319 CG PRO A 96 -5.160 -0.872 -11.958 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.809 -2.185 -12.295 1.00 0.00 C ATOM 0 HA PRO A 96 -4.642 -2.812 -9.317 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.299 -0.176 -10.125 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.402 -1.471 -10.892 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.907 -0.088 -11.832 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.492 -0.550 -12.757 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.769 -2.043 -12.792 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.188 -2.780 -12.965 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.595 -0.855 -7.893 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.376 -0.156 -6.879 1.00 0.00 C ATOM 1330 C PHE A 97 -6.083 1.341 -6.902 1.00 0.00 C ATOM 1331 O PHE A 97 -5.036 1.788 -6.431 1.00 0.00 O ATOM 1332 CB PHE A 97 -6.075 -0.726 -5.492 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.910 -1.924 -5.140 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -6.833 -3.084 -5.894 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.774 -1.889 -4.057 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -7.601 -4.188 -5.574 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.543 -2.991 -3.733 1.00 0.00 C ATOM 1338 CZ PHE A 97 -8.457 -4.141 -4.493 1.00 0.00 C ATOM 0 H PHE A 97 -4.589 -0.855 -7.724 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.432 -0.304 -7.104 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.021 -1.001 -5.442 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.237 0.052 -4.746 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -6.165 -3.126 -6.742 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.847 -0.992 -3.460 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -7.531 -5.086 -6.170 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.211 -2.953 -2.885 1.00 0.00 H new ATOM 0 HZ PHE A 97 -9.059 -5.002 -4.242 1.00 0.00 H new ATOM 1348 N THR A 98 -7.014 2.112 -7.452 1.00 0.00 N ATOM 1349 CA THR A 98 -6.857 3.558 -7.539 1.00 0.00 C ATOM 1350 C THR A 98 -6.917 4.201 -6.158 1.00 0.00 C ATOM 1351 O THR A 98 -7.941 4.141 -5.478 1.00 0.00 O ATOM 1352 CB THR A 98 -7.940 4.190 -8.434 1.00 0.00 C ATOM 1353 OG1 THR A 98 -7.871 3.633 -9.752 1.00 0.00 O ATOM 1354 CG2 THR A 98 -7.769 5.700 -8.506 1.00 0.00 C ATOM 0 H THR A 98 -7.887 1.759 -7.845 1.00 0.00 H new ATOM 0 HA THR A 98 -5.878 3.743 -7.982 1.00 0.00 H new ATOM 0 HB THR A 98 -8.915 3.972 -7.998 1.00 0.00 H new ATOM 0 HG1 THR A 98 -8.563 4.038 -10.315 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.545 6.124 -9.143 1.00 0.00 H new ATOM 0 HG22 THR A 98 -7.850 6.124 -7.505 1.00 0.00 H new ATOM 0 HG23 THR A 98 -6.789 5.936 -8.921 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.813 4.819 -5.749 1.00 0.00 N ATOM 1363 CA VAL A 99 -5.740 5.475 -4.449 1.00 0.00 C ATOM 1364 C VAL A 99 -5.203 6.896 -4.580 1.00 0.00 C ATOM 1365 O VAL A 99 -4.081 7.106 -5.040 1.00 0.00 O ATOM 1366 CB VAL A 99 -4.847 4.688 -3.472 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -4.786 5.388 -2.122 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.352 3.262 -3.320 1.00 0.00 C ATOM 0 H VAL A 99 -4.957 4.879 -6.300 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.755 5.508 -4.054 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.837 4.650 -3.880 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.151 4.817 -1.445 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -4.374 6.389 -2.249 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.790 5.460 -1.704 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -4.709 2.720 -2.626 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.371 3.276 -2.934 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.338 2.766 -4.290 1.00 0.00 H new ATOM 1378 N MET A 100 -6.011 7.868 -4.172 1.00 0.00 N ATOM 1379 CA MET A 100 -5.616 9.270 -4.242 1.00 0.00 C ATOM 1380 C MET A 100 -5.153 9.774 -2.879 1.00 0.00 C ATOM 1381 O MET A 100 -5.879 9.673 -1.890 1.00 0.00 O ATOM 1382 CB MET A 100 -6.780 10.126 -4.746 1.00 0.00 C ATOM 1383 CG MET A 100 -6.341 11.430 -5.390 1.00 0.00 C ATOM 1384 SD MET A 100 -5.418 11.174 -6.918 1.00 0.00 S ATOM 1385 CE MET A 100 -6.276 12.293 -8.023 1.00 0.00 C ATOM 0 H MET A 100 -6.943 7.711 -3.789 1.00 0.00 H new ATOM 0 HA MET A 100 -4.784 9.352 -4.942 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.358 9.550 -5.469 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.445 10.348 -3.911 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.219 12.041 -5.599 1.00 0.00 H new ATOM 0 HG3 MET A 100 -5.724 11.988 -4.686 1.00 0.00 H new ATOM 0 HE1 MET A 100 -5.820 12.248 -9.012 1.00 0.00 H new ATOM 0 HE2 MET A 100 -7.324 12.003 -8.093 1.00 0.00 H new ATOM 0 HE3 MET A 100 -6.206 13.310 -7.637 1.00 0.00 H new ATOM 1395 N ALA A 101 -3.941 10.314 -2.833 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.381 10.835 -1.591 1.00 0.00 C ATOM 1397 C ALA A 101 -3.700 12.317 -1.425 1.00 0.00 C ATOM 1398 O ALA A 101 -3.458 13.120 -2.327 1.00 0.00 O ATOM 1399 CB ALA A 101 -1.878 10.608 -1.553 1.00 0.00 C ATOM 0 H ALA A 101 -3.326 10.403 -3.642 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.838 10.297 -0.761 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.474 11.002 -0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -1.670 9.540 -1.616 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.411 11.119 -2.395 1.00 0.00 H new ATOM 1405 N THR A 102 -4.243 12.675 -0.265 1.00 0.00 N ATOM 1406 CA THR A 102 -4.595 14.060 0.019 1.00 0.00 C ATOM 1407 C THR A 102 -3.934 14.542 1.305 1.00 0.00 C ATOM 1408 O THR A 102 -3.844 13.801 2.284 1.00 0.00 O ATOM 1409 CB THR A 102 -6.121 14.238 0.140 1.00 0.00 C ATOM 1410 OG1 THR A 102 -6.624 13.434 1.213 1.00 0.00 O ATOM 1411 CG2 THR A 102 -6.815 13.853 -1.158 1.00 0.00 C ATOM 0 H THR A 102 -4.448 12.024 0.493 1.00 0.00 H new ATOM 0 HA THR A 102 -4.233 14.657 -0.818 1.00 0.00 H new ATOM 0 HB THR A 102 -6.327 15.288 0.346 1.00 0.00 H new ATOM 0 HG1 THR A 102 -6.298 12.515 1.114 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.891 13.987 -1.049 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.451 14.486 -1.967 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.601 12.810 -1.390 1.00 0.00 H new ATOM 1419 N ASP A 103 -3.476 15.789 1.297 1.00 0.00 N ATOM 1420 CA ASP A 103 -2.825 16.372 2.464 1.00 0.00 C ATOM 1421 C ASP A 103 -3.840 16.652 3.569 1.00 0.00 C ATOM 1422 O ASP A 103 -3.470 16.944 4.705 1.00 0.00 O ATOM 1423 CB ASP A 103 -2.101 17.664 2.080 1.00 0.00 C ATOM 1424 CG ASP A 103 -3.047 18.843 1.956 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -4.186 18.641 1.486 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -2.647 19.965 2.327 1.00 0.00 O ATOM 0 H ASP A 103 -3.544 16.416 0.495 1.00 0.00 H new ATOM 0 HA ASP A 103 -2.095 15.654 2.838 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -1.342 17.888 2.829 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -1.581 17.518 1.133 1.00 0.00 H new ATOM 1431 N GLY A 104 -5.121 16.561 3.226 1.00 0.00 N ATOM 1432 CA GLY A 104 -6.169 16.809 4.198 1.00 0.00 C ATOM 1433 C GLY A 104 -5.963 18.108 4.953 1.00 0.00 C ATOM 1434 O GLY A 104 -5.024 18.852 4.676 1.00 0.00 O ATOM 0 H GLY A 104 -5.452 16.320 2.292 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.133 16.837 3.690 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.206 15.982 4.907 1.00 0.00 H new ATOM 1438 N GLU A 105 -6.847 18.381 5.909 1.00 0.00 N ATOM 1439 CA GLU A 105 -6.759 19.601 6.703 1.00 0.00 C ATOM 1440 C GLU A 105 -5.343 19.803 7.234 1.00 0.00 C ATOM 1441 O GLU A 105 -4.882 19.064 8.105 1.00 0.00 O ATOM 1442 CB GLU A 105 -7.749 19.549 7.868 1.00 0.00 C ATOM 1443 CG GLU A 105 -7.796 18.202 8.568 1.00 0.00 C ATOM 1444 CD GLU A 105 -8.217 18.314 10.021 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -7.351 18.612 10.869 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -9.414 18.104 10.309 1.00 0.00 O ATOM 0 H GLU A 105 -7.631 17.775 6.152 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.011 20.443 6.058 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.483 20.317 8.594 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.745 19.792 7.498 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.491 17.547 8.042 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.813 17.734 8.513 1.00 0.00 H new ATOM 1453 N VAL A 106 -4.656 20.810 6.703 1.00 0.00 N ATOM 1454 CA VAL A 106 -3.293 21.110 7.122 1.00 0.00 C ATOM 1455 C VAL A 106 -3.234 21.423 8.614 1.00 0.00 C ATOM 1456 O VAL A 106 -3.965 22.279 9.111 1.00 0.00 O ATOM 1457 CB VAL A 106 -2.714 22.302 6.337 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -2.646 21.980 4.852 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -3.543 23.554 6.581 1.00 0.00 C ATOM 0 H VAL A 106 -5.022 21.432 5.982 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.695 20.222 6.915 1.00 0.00 H new ATOM 0 HB VAL A 106 -1.700 22.490 6.691 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -2.235 22.833 4.313 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -2.007 21.111 4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.648 21.765 4.480 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -3.119 24.386 6.019 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -4.569 23.381 6.255 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -3.536 23.794 7.644 1.00 0.00 H new ATOM 1469 N THR A 107 -2.356 20.721 9.325 1.00 0.00 N ATOM 1470 CA THR A 107 -2.200 20.922 10.760 1.00 0.00 C ATOM 1471 C THR A 107 -0.799 21.419 11.097 1.00 0.00 C ATOM 1472 O THR A 107 0.180 21.016 10.470 1.00 0.00 O ATOM 1473 CB THR A 107 -2.473 19.623 11.541 1.00 0.00 C ATOM 1474 OG1 THR A 107 -1.581 18.592 11.106 1.00 0.00 O ATOM 1475 CG2 THR A 107 -3.913 19.170 11.350 1.00 0.00 C ATOM 0 H THR A 107 -1.742 20.008 8.930 1.00 0.00 H new ATOM 0 HA THR A 107 -2.930 21.676 11.055 1.00 0.00 H new ATOM 0 HB THR A 107 -2.308 19.821 12.600 1.00 0.00 H new ATOM 0 HG1 THR A 107 -1.761 17.770 11.609 1.00 0.00 H new ATOM 0 HG21 THR A 107 -4.083 18.251 11.911 1.00 0.00 H new ATOM 0 HG22 THR A 107 -4.589 19.945 11.711 1.00 0.00 H new ATOM 0 HG23 THR A 107 -4.100 18.989 10.292 1.00 0.00 H new ATOM 1483 N ALA A 108 -0.710 22.297 12.091 1.00 0.00 N ATOM 1484 CA ALA A 108 0.572 22.847 12.513 1.00 0.00 C ATOM 1485 C ALA A 108 1.487 21.753 13.055 1.00 0.00 C ATOM 1486 O ALA A 108 1.055 20.894 13.824 1.00 0.00 O ATOM 1487 CB ALA A 108 0.363 23.930 13.560 1.00 0.00 C ATOM 0 H ALA A 108 -1.511 22.643 12.619 1.00 0.00 H new ATOM 0 HA ALA A 108 1.054 23.289 11.641 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.329 24.332 13.866 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.246 24.730 13.139 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.144 23.505 14.426 1.00 0.00 H new ATOM 1493 N VAL A 109 2.752 21.792 12.649 1.00 0.00 N ATOM 1494 CA VAL A 109 3.727 20.804 13.094 1.00 0.00 C ATOM 1495 C VAL A 109 5.017 21.475 13.555 1.00 0.00 C ATOM 1496 O VAL A 109 5.345 22.577 13.118 1.00 0.00 O ATOM 1497 CB VAL A 109 4.057 19.797 11.976 1.00 0.00 C ATOM 1498 CG1 VAL A 109 4.233 20.513 10.646 1.00 0.00 C ATOM 1499 CG2 VAL A 109 5.302 18.997 12.331 1.00 0.00 C ATOM 0 H VAL A 109 3.125 22.497 12.013 1.00 0.00 H new ATOM 0 HA VAL A 109 3.278 20.271 13.932 1.00 0.00 H new ATOM 0 HB VAL A 109 3.223 19.103 11.878 1.00 0.00 H new ATOM 0 HG11 VAL A 109 4.466 19.785 9.869 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.312 21.036 10.389 1.00 0.00 H new ATOM 0 HG13 VAL A 109 5.048 21.232 10.725 1.00 0.00 H new ATOM 0 HG21 VAL A 109 5.521 18.290 11.531 1.00 0.00 H new ATOM 0 HG22 VAL A 109 6.146 19.675 12.458 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.132 18.452 13.260 1.00 0.00 H new ATOM 1509 N GLU A 110 5.744 20.801 14.441 1.00 0.00 N ATOM 1510 CA GLU A 110 6.997 21.332 14.961 1.00 0.00 C ATOM 1511 C GLU A 110 7.969 20.204 15.298 1.00 0.00 C ATOM 1512 O GLU A 110 7.582 19.039 15.367 1.00 0.00 O ATOM 1513 CB GLU A 110 6.739 22.185 16.205 1.00 0.00 C ATOM 1514 CG GLU A 110 6.202 21.392 17.385 1.00 0.00 C ATOM 1515 CD GLU A 110 7.292 20.644 18.129 1.00 0.00 C ATOM 1516 OE1 GLU A 110 8.294 21.283 18.514 1.00 0.00 O ATOM 1517 OE2 GLU A 110 7.141 19.420 18.327 1.00 0.00 O ATOM 0 H GLU A 110 5.486 19.887 14.813 1.00 0.00 H new ATOM 0 HA GLU A 110 7.445 21.956 14.188 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.668 22.674 16.499 1.00 0.00 H new ATOM 0 HB3 GLU A 110 6.029 22.973 15.954 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.696 22.069 18.073 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.455 20.681 17.031 1.00 0.00 H new ATOM 1524 N GLU A 111 9.233 20.562 15.504 1.00 0.00 N ATOM 1525 CA GLU A 111 10.260 19.579 15.832 1.00 0.00 C ATOM 1526 C GLU A 111 11.483 20.255 16.444 1.00 0.00 C ATOM 1527 O GLU A 111 11.587 21.481 16.457 1.00 0.00 O ATOM 1528 CB GLU A 111 10.668 18.799 14.581 1.00 0.00 C ATOM 1529 CG GLU A 111 11.237 17.423 14.879 1.00 0.00 C ATOM 1530 CD GLU A 111 11.075 16.459 13.720 1.00 0.00 C ATOM 1531 OE1 GLU A 111 11.439 16.832 12.585 1.00 0.00 O ATOM 1532 OE2 GLU A 111 10.584 15.334 13.947 1.00 0.00 O ATOM 0 H GLU A 111 9.570 21.523 15.450 1.00 0.00 H new ATOM 0 HA GLU A 111 9.844 18.887 16.564 1.00 0.00 H new ATOM 0 HB2 GLU A 111 9.799 18.691 13.932 1.00 0.00 H new ATOM 0 HB3 GLU A 111 11.409 19.377 14.028 1.00 0.00 H new ATOM 0 HG2 GLU A 111 12.295 17.517 15.123 1.00 0.00 H new ATOM 0 HG3 GLU A 111 10.742 17.013 15.759 1.00 0.00 H new ATOM 1539 N ALA A 112 12.407 19.446 16.951 1.00 0.00 N ATOM 1540 CA ALA A 112 13.624 19.964 17.564 1.00 0.00 C ATOM 1541 C ALA A 112 14.864 19.454 16.837 1.00 0.00 C ATOM 1542 O ALA A 112 15.470 18.453 17.221 1.00 0.00 O ATOM 1543 CB ALA A 112 13.678 19.582 19.036 1.00 0.00 C ATOM 0 H ALA A 112 12.336 18.428 16.949 1.00 0.00 H new ATOM 0 HA ALA A 112 13.608 21.051 17.483 1.00 0.00 H new ATOM 0 HB1 ALA A 112 14.592 19.975 19.481 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.814 20.000 19.552 1.00 0.00 H new ATOM 0 HB3 ALA A 112 13.667 18.496 19.131 1.00 0.00 H new ATOM 1549 N PRO A 113 15.253 20.158 15.764 1.00 0.00 N ATOM 1550 CA PRO A 113 16.424 19.795 14.961 1.00 0.00 C ATOM 1551 C PRO A 113 17.734 20.027 15.709 1.00 0.00 C ATOM 1552 O PRO A 113 18.082 21.162 16.034 1.00 0.00 O ATOM 1553 CB PRO A 113 16.328 20.726 13.751 1.00 0.00 C ATOM 1554 CG PRO A 113 15.551 21.901 14.237 1.00 0.00 C ATOM 1555 CD PRO A 113 14.578 21.362 15.251 1.00 0.00 C ATOM 0 HA PRO A 113 16.428 18.736 14.702 1.00 0.00 H new ATOM 0 HB2 PRO A 113 17.317 21.023 13.401 1.00 0.00 H new ATOM 0 HB3 PRO A 113 15.827 20.238 12.915 1.00 0.00 H new ATOM 0 HG2 PRO A 113 16.209 22.646 14.685 1.00 0.00 H new ATOM 0 HG3 PRO A 113 15.028 22.390 13.415 1.00 0.00 H new ATOM 0 HD2 PRO A 113 14.384 22.083 16.045 1.00 0.00 H new ATOM 0 HD3 PRO A 113 13.617 21.121 14.797 1.00 0.00 H new ATOM 1563 N VAL A 114 18.455 18.944 15.979 1.00 0.00 N ATOM 1564 CA VAL A 114 19.727 19.030 16.687 1.00 0.00 C ATOM 1565 C VAL A 114 20.849 19.464 15.750 1.00 0.00 C ATOM 1566 O VAL A 114 20.932 19.006 14.612 1.00 0.00 O ATOM 1567 CB VAL A 114 20.103 17.682 17.331 1.00 0.00 C ATOM 1568 CG1 VAL A 114 19.092 17.301 18.402 1.00 0.00 C ATOM 1569 CG2 VAL A 114 20.205 16.596 16.271 1.00 0.00 C ATOM 0 H VAL A 114 18.180 17.997 15.718 1.00 0.00 H new ATOM 0 HA VAL A 114 19.603 19.777 17.471 1.00 0.00 H new ATOM 0 HB VAL A 114 21.078 17.786 17.807 1.00 0.00 H new ATOM 0 HG11 VAL A 114 19.374 16.346 18.846 1.00 0.00 H new ATOM 0 HG12 VAL A 114 19.074 18.069 19.175 1.00 0.00 H new ATOM 0 HG13 VAL A 114 18.102 17.214 17.954 1.00 0.00 H new ATOM 0 HG21 VAL A 114 20.471 15.650 16.743 1.00 0.00 H new ATOM 0 HG22 VAL A 114 19.246 16.491 15.764 1.00 0.00 H new ATOM 0 HG23 VAL A 114 20.971 16.867 15.545 1.00 0.00 H new ATOM 1579 N ASN A 115 21.711 20.349 16.240 1.00 0.00 N ATOM 1580 CA ASN A 115 22.831 20.845 15.446 1.00 0.00 C ATOM 1581 C ASN A 115 24.037 19.919 15.568 1.00 0.00 C ATOM 1582 O ASN A 115 24.180 19.197 16.553 1.00 0.00 O ATOM 1583 CB ASN A 115 23.211 22.258 15.892 1.00 0.00 C ATOM 1584 CG ASN A 115 23.119 22.436 17.395 1.00 0.00 C ATOM 1585 OD1 ASN A 115 23.449 21.528 18.159 1.00 0.00 O ATOM 1586 ND2 ASN A 115 22.670 23.608 17.826 1.00 0.00 N ATOM 0 H ASN A 115 21.656 20.737 17.182 1.00 0.00 H new ATOM 0 HA ASN A 115 22.521 20.871 14.401 1.00 0.00 H new ATOM 0 HB2 ASN A 115 24.227 22.478 15.565 1.00 0.00 H new ATOM 0 HB3 ASN A 115 22.556 22.979 15.403 1.00 0.00 H new ATOM 0 HD21 ASN A 115 22.587 23.785 18.827 1.00 0.00 H new ATOM 0 HD22 ASN A 115 22.408 24.331 17.156 1.00 0.00 H new ATOM 1593 N ALA A 116 24.901 19.947 14.559 1.00 0.00 N ATOM 1594 CA ALA A 116 26.096 19.114 14.554 1.00 0.00 C ATOM 1595 C ALA A 116 27.236 19.782 15.316 1.00 0.00 C ATOM 1596 O ALA A 116 27.241 21.001 15.499 1.00 0.00 O ATOM 1597 CB ALA A 116 26.521 18.808 13.125 1.00 0.00 C ATOM 0 H ALA A 116 24.795 20.538 13.734 1.00 0.00 H new ATOM 0 HA ALA A 116 25.857 18.178 15.059 1.00 0.00 H new ATOM 0 HB1 ALA A 116 27.415 18.185 13.137 1.00 0.00 H new ATOM 0 HB2 ALA A 116 25.717 18.280 12.612 1.00 0.00 H new ATOM 0 HB3 ALA A 116 26.735 19.740 12.602 1.00 0.00 H new ATOM 1603 N CYS A 117 28.199 18.980 15.755 1.00 0.00 N ATOM 1604 CA CYS A 117 29.344 19.494 16.499 1.00 0.00 C ATOM 1605 C CYS A 117 30.648 19.183 15.772 1.00 0.00 C ATOM 1606 O CYS A 117 30.802 18.136 15.143 1.00 0.00 O ATOM 1607 CB CYS A 117 29.374 18.897 17.906 1.00 0.00 C ATOM 1608 SG CYS A 117 29.459 17.091 17.940 1.00 0.00 S ATOM 0 H CYS A 117 28.210 17.971 15.609 1.00 0.00 H new ATOM 0 HA CYS A 117 29.241 20.576 16.575 1.00 0.00 H new ATOM 0 HB2 CYS A 117 30.233 19.301 18.442 1.00 0.00 H new ATOM 0 HB3 CYS A 117 28.482 19.218 18.445 1.00 0.00 H new ATOM 0 HG CYS A 117 30.026 16.663 16.852 1.00 0.00 H new ATOM 1614 N PRO A 118 31.610 20.114 15.859 1.00 0.00 N ATOM 1615 CA PRO A 118 32.918 19.962 15.215 1.00 0.00 C ATOM 1616 C PRO A 118 33.767 18.882 15.875 1.00 0.00 C ATOM 1617 O PRO A 118 33.308 18.185 16.781 1.00 0.00 O ATOM 1618 CB PRO A 118 33.564 21.337 15.396 1.00 0.00 C ATOM 1619 CG PRO A 118 32.904 21.910 16.603 1.00 0.00 C ATOM 1620 CD PRO A 118 31.495 21.386 16.591 1.00 0.00 C ATOM 0 HA PRO A 118 32.827 19.653 14.174 1.00 0.00 H new ATOM 0 HB2 PRO A 118 34.642 21.253 15.537 1.00 0.00 H new ATOM 0 HB3 PRO A 118 33.405 21.967 14.521 1.00 0.00 H new ATOM 0 HG2 PRO A 118 33.425 21.610 17.512 1.00 0.00 H new ATOM 0 HG3 PRO A 118 32.916 23.000 16.574 1.00 0.00 H new ATOM 0 HD2 PRO A 118 31.114 21.235 17.601 1.00 0.00 H new ATOM 0 HD3 PRO A 118 30.814 22.076 16.093 1.00 0.00 H new ATOM 1628 N SER A 119 35.008 18.748 15.417 1.00 0.00 N ATOM 1629 CA SER A 119 35.921 17.751 15.962 1.00 0.00 C ATOM 1630 C SER A 119 37.330 18.320 16.099 1.00 0.00 C ATOM 1631 O SER A 119 37.629 19.396 15.582 1.00 0.00 O ATOM 1632 CB SER A 119 35.945 16.509 15.069 1.00 0.00 C ATOM 1633 OG SER A 119 36.428 16.820 13.774 1.00 0.00 O ATOM 0 H SER A 119 35.404 19.318 14.669 1.00 0.00 H new ATOM 0 HA SER A 119 35.564 17.471 16.953 1.00 0.00 H new ATOM 0 HB2 SER A 119 36.576 15.744 15.522 1.00 0.00 H new ATOM 0 HB3 SER A 119 34.941 16.091 14.995 1.00 0.00 H new ATOM 0 HG SER A 119 36.435 16.009 13.224 1.00 0.00 H new ATOM 1639 N GLY A 120 38.192 17.589 16.798 1.00 0.00 N ATOM 1640 CA GLY A 120 39.560 18.036 16.991 1.00 0.00 C ATOM 1641 C GLY A 120 40.560 17.185 16.234 1.00 0.00 C ATOM 1642 O GLY A 120 41.189 16.285 16.792 1.00 0.00 O ATOM 0 H GLY A 120 37.968 16.695 17.235 1.00 0.00 H new ATOM 0 HA2 GLY A 120 39.650 19.072 16.666 1.00 0.00 H new ATOM 0 HA3 GLY A 120 39.800 18.014 18.054 1.00 0.00 H new ATOM 1646 N PRO A 121 40.717 17.465 14.931 1.00 0.00 N ATOM 1647 CA PRO A 121 41.646 16.729 14.070 1.00 0.00 C ATOM 1648 C PRO A 121 43.104 17.018 14.409 1.00 0.00 C ATOM 1649 O PRO A 121 43.484 18.168 14.629 1.00 0.00 O ATOM 1650 CB PRO A 121 41.311 17.242 12.667 1.00 0.00 C ATOM 1651 CG PRO A 121 40.730 18.597 12.888 1.00 0.00 C ATOM 1652 CD PRO A 121 40.000 18.524 14.201 1.00 0.00 C ATOM 0 HA PRO A 121 41.537 15.650 14.182 1.00 0.00 H new ATOM 0 HB2 PRO A 121 42.201 17.290 12.040 1.00 0.00 H new ATOM 0 HB3 PRO A 121 40.602 16.584 12.164 1.00 0.00 H new ATOM 0 HG2 PRO A 121 41.511 19.357 12.917 1.00 0.00 H new ATOM 0 HG3 PRO A 121 40.052 18.868 12.079 1.00 0.00 H new ATOM 0 HD2 PRO A 121 40.035 19.474 14.734 1.00 0.00 H new ATOM 0 HD3 PRO A 121 38.948 18.275 14.063 1.00 0.00 H new ATOM 1660 N SER A 122 43.917 15.967 14.448 1.00 0.00 N ATOM 1661 CA SER A 122 45.334 16.108 14.763 1.00 0.00 C ATOM 1662 C SER A 122 46.166 16.223 13.490 1.00 0.00 C ATOM 1663 O SER A 122 45.646 16.092 12.382 1.00 0.00 O ATOM 1664 CB SER A 122 45.814 14.917 15.594 1.00 0.00 C ATOM 1665 OG SER A 122 45.201 14.904 16.871 1.00 0.00 O ATOM 0 H SER A 122 43.619 15.009 14.265 1.00 0.00 H new ATOM 0 HA SER A 122 45.462 17.022 15.343 1.00 0.00 H new ATOM 0 HB2 SER A 122 45.587 13.989 15.069 1.00 0.00 H new ATOM 0 HB3 SER A 122 46.897 14.962 15.708 1.00 0.00 H new ATOM 0 HG SER A 122 45.524 14.132 17.381 1.00 0.00 H new ATOM 1671 N SER A 123 47.461 16.471 13.656 1.00 0.00 N ATOM 1672 CA SER A 123 48.365 16.608 12.520 1.00 0.00 C ATOM 1673 C SER A 123 48.325 15.362 11.641 1.00 0.00 C ATOM 1674 O SER A 123 47.992 14.271 12.104 1.00 0.00 O ATOM 1675 CB SER A 123 49.795 16.857 13.006 1.00 0.00 C ATOM 1676 OG SER A 123 49.926 18.153 13.562 1.00 0.00 O ATOM 0 H SER A 123 47.908 16.581 14.566 1.00 0.00 H new ATOM 0 HA SER A 123 48.036 17.461 11.927 1.00 0.00 H new ATOM 0 HB2 SER A 123 50.064 16.109 13.752 1.00 0.00 H new ATOM 0 HB3 SER A 123 50.490 16.743 12.174 1.00 0.00 H new ATOM 0 HG SER A 123 50.848 18.287 13.866 1.00 0.00 H new ATOM 1682 N GLY A 124 48.666 15.533 10.366 1.00 0.00 N ATOM 1683 CA GLY A 124 48.663 14.415 9.441 1.00 0.00 C ATOM 1684 C GLY A 124 48.128 14.796 8.075 1.00 0.00 C ATOM 1685 O GLY A 124 48.898 15.031 7.143 1.00 0.00 O ATOM 0 H GLY A 124 48.944 16.426 9.958 1.00 0.00 H new ATOM 0 HA2 GLY A 124 49.678 14.031 9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 124 48.057 13.608 9.853 1.00 0.00 H new TER 1689 GLY A 124