USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 930 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 57 TYR OH : rot -44:sc= 1.01 USER MOD Set 1.2: A 97 GLN : amide:sc= -3.43! C(o=-2.5!,f=-11!) USER MOD Set 1.3: A 107 MET CE :methyl -153:sc= -0.0311 (180deg=-1.41) USER MOD Set 2.1: A 87 THR OG1 : rot 112:sc= 0.472 USER MOD Set 2.2: A 92 TYR OH : rot 180:sc= 0.274 USER MOD Set 3.1: A 40 ASN : amide:sc= -0.0599 K(o=-2.3,f=-4.1!) USER MOD Set 3.2: A 80 THR OG1 : rot -82:sc= 0.439 USER MOD Set 3.3: A 82 GLN :FLIP amide:sc= -2.65! C(o=-6.1!,f=-2.3!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00705 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.027 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 12 THR OG1 : rot -145:sc= 0.449 USER MOD Single : A 13 THR OG1 : rot 76:sc= 0.826 USER MOD Single : A 19 THR OG1 : rot -53:sc= 0.943 USER MOD Single : A 20 SER OG : rot -100:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -168:sc= -0.814 (180deg=-1.14) USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.165 USER MOD Single : A 29 SER OG : rot 160:sc= -0.201 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0916) USER MOD Single : A 35 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.124) USER MOD Single : A 36 THR OG1 : rot -4:sc= -2.7 USER MOD Single : A 42 GLN : amide:sc= -1.54 K(o=-1.5,f=-4.2!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.64) USER MOD Single : A 50 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.604) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 15:sc= -0.63 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc=0.000251 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -0.0648 X(o=-0.065,f=0) USER MOD Single : A 67 HIS :FLIP no HD1:sc= -0.525 F(o=-2.2,f=-0.52) USER MOD Single : A 77 ASN : amide:sc= -2.76! C(o=-2.8!,f=-3.5!) USER MOD Single : A 81 HIS : no HD1:sc= 0.0225 K(o=0.023,f=-0.54) USER MOD Single : A 84 GLN : amide:sc= -0.129 K(o=-0.13,f=-1.8) USER MOD Single : A 90 THR OG1 : rot 68:sc= 1.19 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.833 K(o=-0.83,f=-8.9!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot -87:sc= 0.128 USER MOD Single : A 112 GLN : amide:sc= -0.109 K(o=-0.11,f=-1.9!) USER MOD Single : A 115 THR OG1 : rot -160:sc= 0.386 USER MOD Single : A 117 LYS NZ :NH3+ -121:sc= -2.38! (180deg=-5.36!) 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 116:sc= 0.709 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -33.415 -0.661 -17.728 1.00 0.00 N ATOM 2 CA GLY A 1 -32.313 -1.143 -16.917 1.00 0.00 C ATOM 3 C GLY A 1 -32.529 -2.561 -16.429 1.00 0.00 C ATOM 4 O GLY A 1 -31.740 -3.456 -16.733 1.00 0.00 O ATOM 0 H1 GLY A 1 -33.219 0.313 -18.037 1.00 0.00 H new ATOM 0 H2 GLY A 1 -33.526 -1.273 -18.562 1.00 0.00 H new ATOM 0 H3 GLY A 1 -34.291 -0.677 -17.168 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -31.392 -1.098 -17.498 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -32.181 -0.483 -16.060 1.00 0.00 H new ATOM 8 N SER A 2 -33.599 -2.768 -15.669 1.00 0.00 N ATOM 9 CA SER A 2 -33.914 -4.087 -15.133 1.00 0.00 C ATOM 10 C SER A 2 -35.420 -4.261 -14.967 1.00 0.00 C ATOM 11 O SER A 2 -36.193 -3.332 -15.202 1.00 0.00 O ATOM 12 CB SER A 2 -33.214 -4.295 -13.789 1.00 0.00 C ATOM 13 OG SER A 2 -33.161 -5.670 -13.449 1.00 0.00 O ATOM 0 H SER A 2 -34.263 -2.038 -15.410 1.00 0.00 H new ATOM 0 HA SER A 2 -33.556 -4.834 -15.841 1.00 0.00 H new ATOM 0 HB2 SER A 2 -32.203 -3.889 -13.835 1.00 0.00 H new ATOM 0 HB3 SER A 2 -33.743 -3.745 -13.011 1.00 0.00 H new ATOM 0 HG SER A 2 -32.707 -5.777 -12.587 1.00 0.00 H new ATOM 19 N SER A 3 -35.830 -5.458 -14.560 1.00 0.00 N ATOM 20 CA SER A 3 -37.244 -5.757 -14.366 1.00 0.00 C ATOM 21 C SER A 3 -37.536 -6.077 -12.903 1.00 0.00 C ATOM 22 O SER A 3 -36.919 -6.964 -12.315 1.00 0.00 O ATOM 23 CB SER A 3 -37.665 -6.932 -15.251 1.00 0.00 C ATOM 24 OG SER A 3 -37.427 -6.651 -16.619 1.00 0.00 O ATOM 0 H SER A 3 -35.203 -6.237 -14.358 1.00 0.00 H new ATOM 0 HA SER A 3 -37.818 -4.875 -14.648 1.00 0.00 H new ATOM 0 HB2 SER A 3 -37.115 -7.827 -14.959 1.00 0.00 H new ATOM 0 HB3 SER A 3 -38.723 -7.145 -15.099 1.00 0.00 H new ATOM 0 HG SER A 3 -37.703 -7.418 -17.163 1.00 0.00 H new ATOM 30 N GLY A 4 -38.482 -5.346 -12.321 1.00 0.00 N ATOM 31 CA GLY A 4 -38.839 -5.565 -10.932 1.00 0.00 C ATOM 32 C GLY A 4 -39.707 -4.455 -10.374 1.00 0.00 C ATOM 33 O GLY A 4 -39.631 -3.312 -10.825 1.00 0.00 O ATOM 0 H GLY A 4 -39.007 -4.606 -12.787 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -39.366 -6.515 -10.841 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -37.931 -5.646 -10.335 1.00 0.00 H new ATOM 37 N SER A 5 -40.536 -4.791 -9.391 1.00 0.00 N ATOM 38 CA SER A 5 -41.427 -3.814 -8.774 1.00 0.00 C ATOM 39 C SER A 5 -40.711 -3.051 -7.664 1.00 0.00 C ATOM 40 O SER A 5 -39.545 -3.312 -7.368 1.00 0.00 O ATOM 41 CB SER A 5 -42.669 -4.509 -8.212 1.00 0.00 C ATOM 42 OG SER A 5 -43.716 -3.580 -7.991 1.00 0.00 O ATOM 0 H SER A 5 -40.610 -5.732 -9.004 1.00 0.00 H new ATOM 0 HA SER A 5 -41.733 -3.102 -9.541 1.00 0.00 H new ATOM 0 HB2 SER A 5 -43.003 -5.280 -8.906 1.00 0.00 H new ATOM 0 HB3 SER A 5 -42.418 -5.009 -7.276 1.00 0.00 H new ATOM 0 HG SER A 5 -44.499 -4.049 -7.634 1.00 0.00 H new ATOM 48 N SER A 6 -41.418 -2.105 -7.054 1.00 0.00 N ATOM 49 CA SER A 6 -40.850 -1.300 -5.979 1.00 0.00 C ATOM 50 C SER A 6 -41.808 -1.222 -4.794 1.00 0.00 C ATOM 51 O SER A 6 -43.026 -1.240 -4.964 1.00 0.00 O ATOM 52 CB SER A 6 -40.529 0.108 -6.483 1.00 0.00 C ATOM 53 OG SER A 6 -39.652 0.064 -7.596 1.00 0.00 O ATOM 0 H SER A 6 -42.385 -1.877 -7.286 1.00 0.00 H new ATOM 0 HA SER A 6 -39.928 -1.779 -5.648 1.00 0.00 H new ATOM 0 HB2 SER A 6 -41.452 0.617 -6.763 1.00 0.00 H new ATOM 0 HB3 SER A 6 -40.075 0.690 -5.681 1.00 0.00 H new ATOM 0 HG SER A 6 -39.464 0.976 -7.900 1.00 0.00 H new ATOM 59 N GLY A 7 -41.246 -1.137 -3.592 1.00 0.00 N ATOM 60 CA GLY A 7 -42.064 -1.058 -2.395 1.00 0.00 C ATOM 61 C GLY A 7 -41.266 -0.646 -1.174 1.00 0.00 C ATOM 62 O GLY A 7 -41.306 0.512 -0.758 1.00 0.00 O ATOM 0 H GLY A 7 -40.240 -1.121 -3.426 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -42.871 -0.343 -2.556 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -42.529 -2.027 -2.212 1.00 0.00 H new ATOM 66 N THR A 8 -40.539 -1.597 -0.595 1.00 0.00 N ATOM 67 CA THR A 8 -39.731 -1.329 0.587 1.00 0.00 C ATOM 68 C THR A 8 -38.364 -0.773 0.204 1.00 0.00 C ATOM 69 O THR A 8 -37.394 -1.519 0.076 1.00 0.00 O ATOM 70 CB THR A 8 -39.536 -2.600 1.435 1.00 0.00 C ATOM 71 OG1 THR A 8 -40.804 -3.209 1.703 1.00 0.00 O ATOM 72 CG2 THR A 8 -38.838 -2.273 2.747 1.00 0.00 C ATOM 0 H THR A 8 -40.494 -2.561 -0.927 1.00 0.00 H new ATOM 0 HA THR A 8 -40.270 -0.587 1.176 1.00 0.00 H new ATOM 0 HB THR A 8 -38.912 -3.294 0.872 1.00 0.00 H new ATOM 0 HG1 THR A 8 -40.671 -4.017 2.241 1.00 0.00 H new ATOM 0 HG21 THR A 8 -38.711 -3.186 3.329 1.00 0.00 H new ATOM 0 HG22 THR A 8 -37.861 -1.836 2.540 1.00 0.00 H new ATOM 0 HG23 THR A 8 -39.441 -1.563 3.313 1.00 0.00 H new ATOM 80 N ALA A 9 -38.295 0.542 0.024 1.00 0.00 N ATOM 81 CA ALA A 9 -37.045 1.198 -0.342 1.00 0.00 C ATOM 82 C ALA A 9 -36.190 1.475 0.890 1.00 0.00 C ATOM 83 O ALA A 9 -35.655 2.572 1.053 1.00 0.00 O ATOM 84 CB ALA A 9 -37.328 2.491 -1.092 1.00 0.00 C ATOM 0 H ALA A 9 -39.089 1.174 0.126 1.00 0.00 H new ATOM 0 HA ALA A 9 -36.488 0.526 -0.995 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -36.386 2.970 -1.359 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -37.892 2.270 -1.998 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -37.908 3.160 -0.457 1.00 0.00 H new ATOM 90 N HIS A 10 -36.065 0.473 1.755 1.00 0.00 N ATOM 91 CA HIS A 10 -35.273 0.609 2.972 1.00 0.00 C ATOM 92 C HIS A 10 -33.820 0.218 2.722 1.00 0.00 C ATOM 93 O HIS A 10 -33.290 -0.686 3.368 1.00 0.00 O ATOM 94 CB HIS A 10 -35.862 -0.256 4.088 1.00 0.00 C ATOM 95 CG HIS A 10 -37.026 0.378 4.785 1.00 0.00 C ATOM 96 ND1 HIS A 10 -37.083 0.546 6.153 1.00 0.00 N ATOM 97 CD2 HIS A 10 -38.181 0.886 4.297 1.00 0.00 C ATOM 98 CE1 HIS A 10 -38.224 1.129 6.475 1.00 0.00 C ATOM 99 NE2 HIS A 10 -38.908 1.347 5.367 1.00 0.00 N ATOM 0 H HIS A 10 -36.502 -0.441 1.636 1.00 0.00 H new ATOM 0 HA HIS A 10 -35.301 1.654 3.279 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -36.177 -1.212 3.668 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -35.083 -0.470 4.820 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -38.476 0.922 3.259 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -38.543 1.384 7.475 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -39.827 1.786 5.314 1.00 0.00 H new ATOM 108 N GLY A 11 -33.181 0.905 1.780 1.00 0.00 N ATOM 109 CA GLY A 11 -31.795 0.613 1.461 1.00 0.00 C ATOM 110 C GLY A 11 -31.658 -0.429 0.369 1.00 0.00 C ATOM 111 O GLY A 11 -32.599 -0.674 -0.388 1.00 0.00 O ATOM 0 H GLY A 11 -33.598 1.658 1.232 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -31.297 1.530 1.148 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -31.285 0.263 2.359 1.00 0.00 H new ATOM 115 N THR A 12 -30.483 -1.044 0.284 1.00 0.00 N ATOM 116 CA THR A 12 -30.225 -2.063 -0.726 1.00 0.00 C ATOM 117 C THR A 12 -30.464 -3.462 -0.168 1.00 0.00 C ATOM 118 O THR A 12 -30.268 -3.710 1.022 1.00 0.00 O ATOM 119 CB THR A 12 -28.782 -1.975 -1.257 1.00 0.00 C ATOM 120 OG1 THR A 12 -28.412 -3.211 -1.877 1.00 0.00 O ATOM 121 CG2 THR A 12 -27.810 -1.653 -0.133 1.00 0.00 C ATOM 0 H THR A 12 -29.695 -0.854 0.903 1.00 0.00 H new ATOM 0 HA THR A 12 -30.918 -1.878 -1.546 1.00 0.00 H new ATOM 0 HB THR A 12 -28.738 -1.173 -1.994 1.00 0.00 H new ATOM 0 HG1 THR A 12 -27.460 -3.384 -1.719 1.00 0.00 H new ATOM 0 HG21 THR A 12 -26.798 -1.596 -0.533 1.00 0.00 H new ATOM 0 HG22 THR A 12 -28.077 -0.696 0.316 1.00 0.00 H new ATOM 0 HG23 THR A 12 -27.858 -2.435 0.624 1.00 0.00 H new ATOM 129 N THR A 13 -30.889 -4.375 -1.036 1.00 0.00 N ATOM 130 CA THR A 13 -31.155 -5.749 -0.631 1.00 0.00 C ATOM 131 C THR A 13 -29.889 -6.596 -0.693 1.00 0.00 C ATOM 132 O THR A 13 -29.818 -7.669 -0.093 1.00 0.00 O ATOM 133 CB THR A 13 -32.236 -6.397 -1.517 1.00 0.00 C ATOM 134 OG1 THR A 13 -31.731 -6.592 -2.843 1.00 0.00 O ATOM 135 CG2 THR A 13 -33.485 -5.531 -1.567 1.00 0.00 C ATOM 0 H THR A 13 -31.056 -4.187 -2.024 1.00 0.00 H new ATOM 0 HA THR A 13 -31.513 -5.711 0.398 1.00 0.00 H new ATOM 0 HB THR A 13 -32.499 -7.362 -1.084 1.00 0.00 H new ATOM 0 HG1 THR A 13 -31.124 -7.361 -2.852 1.00 0.00 H new ATOM 0 HG21 THR A 13 -34.234 -6.009 -2.198 1.00 0.00 H new ATOM 0 HG22 THR A 13 -33.884 -5.409 -0.560 1.00 0.00 H new ATOM 0 HG23 THR A 13 -33.234 -4.553 -1.979 1.00 0.00 H new ATOM 143 N PHE A 14 -28.891 -6.107 -1.420 1.00 0.00 N ATOM 144 CA PHE A 14 -27.626 -6.819 -1.560 1.00 0.00 C ATOM 145 C PHE A 14 -26.527 -5.884 -2.056 1.00 0.00 C ATOM 146 O PHE A 14 -26.798 -4.907 -2.753 1.00 0.00 O ATOM 147 CB PHE A 14 -27.784 -7.997 -2.525 1.00 0.00 C ATOM 148 CG PHE A 14 -28.502 -7.639 -3.795 1.00 0.00 C ATOM 149 CD1 PHE A 14 -27.912 -6.802 -4.728 1.00 0.00 C ATOM 150 CD2 PHE A 14 -29.767 -8.140 -4.055 1.00 0.00 C ATOM 151 CE1 PHE A 14 -28.571 -6.471 -5.897 1.00 0.00 C ATOM 152 CE2 PHE A 14 -30.431 -7.813 -5.223 1.00 0.00 C ATOM 153 CZ PHE A 14 -29.831 -6.978 -6.145 1.00 0.00 C ATOM 0 H PHE A 14 -28.933 -5.220 -1.922 1.00 0.00 H new ATOM 0 HA PHE A 14 -27.340 -7.198 -0.579 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -26.797 -8.388 -2.773 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -28.328 -8.797 -2.023 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -26.926 -6.404 -4.540 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -30.240 -8.794 -3.337 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -28.101 -5.816 -6.616 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -31.417 -8.210 -5.414 1.00 0.00 H new ATOM 0 HZ PHE A 14 -30.347 -6.722 -7.059 1.00 0.00 H new ATOM 163 N GLU A 15 -25.286 -6.193 -1.691 1.00 0.00 N ATOM 164 CA GLU A 15 -24.147 -5.379 -2.098 1.00 0.00 C ATOM 165 C GLU A 15 -23.200 -6.176 -2.991 1.00 0.00 C ATOM 166 O GLU A 15 -23.148 -7.405 -2.919 1.00 0.00 O ATOM 167 CB GLU A 15 -23.394 -4.865 -0.869 1.00 0.00 C ATOM 168 CG GLU A 15 -23.909 -3.532 -0.353 1.00 0.00 C ATOM 169 CD GLU A 15 -23.665 -3.348 1.133 1.00 0.00 C ATOM 170 OE1 GLU A 15 -24.453 -3.890 1.936 1.00 0.00 O ATOM 171 OE2 GLU A 15 -22.685 -2.661 1.491 1.00 0.00 O ATOM 0 H GLU A 15 -25.045 -7.000 -1.115 1.00 0.00 H new ATOM 0 HA GLU A 15 -24.525 -4.529 -2.666 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -23.467 -5.606 -0.073 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -22.337 -4.765 -1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -23.424 -2.723 -0.900 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -24.978 -3.457 -0.554 1.00 0.00 H new ATOM 178 N LEU A 16 -22.455 -5.469 -3.833 1.00 0.00 N ATOM 179 CA LEU A 16 -21.510 -6.110 -4.741 1.00 0.00 C ATOM 180 C LEU A 16 -20.112 -5.521 -4.577 1.00 0.00 C ATOM 181 O LEU A 16 -19.869 -4.365 -4.922 1.00 0.00 O ATOM 182 CB LEU A 16 -21.976 -5.950 -6.189 1.00 0.00 C ATOM 183 CG LEU A 16 -23.183 -6.792 -6.602 1.00 0.00 C ATOM 184 CD1 LEU A 16 -22.808 -8.264 -6.675 1.00 0.00 C ATOM 185 CD2 LEU A 16 -24.338 -6.581 -5.634 1.00 0.00 C ATOM 0 H LEU A 16 -22.487 -4.452 -3.906 1.00 0.00 H new ATOM 0 HA LEU A 16 -21.469 -7.171 -4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -22.215 -4.900 -6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -21.143 -6.198 -6.847 1.00 0.00 H new ATOM 0 HG LEU A 16 -23.503 -6.471 -7.593 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -23.680 -8.847 -6.970 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -22.014 -8.401 -7.409 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -22.461 -8.600 -5.698 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -25.188 -7.188 -5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -24.030 -6.874 -4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -24.625 -5.529 -5.633 1.00 0.00 H new ATOM 197 N VAL A 17 -19.195 -6.326 -4.049 1.00 0.00 N ATOM 198 CA VAL A 17 -17.820 -5.886 -3.842 1.00 0.00 C ATOM 199 C VAL A 17 -17.271 -5.195 -5.084 1.00 0.00 C ATOM 200 O VAL A 17 -17.700 -5.453 -6.209 1.00 0.00 O ATOM 201 CB VAL A 17 -16.902 -7.068 -3.477 1.00 0.00 C ATOM 202 CG1 VAL A 17 -17.196 -7.557 -2.067 1.00 0.00 C ATOM 203 CG2 VAL A 17 -17.060 -8.196 -4.485 1.00 0.00 C ATOM 0 H VAL A 17 -19.379 -7.286 -3.757 1.00 0.00 H new ATOM 0 HA VAL A 17 -17.835 -5.178 -3.013 1.00 0.00 H new ATOM 0 HB VAL A 17 -15.868 -6.725 -3.509 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -16.538 -8.392 -1.827 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -17.027 -6.746 -1.358 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -18.234 -7.883 -2.004 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -16.404 -9.023 -4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -18.095 -8.539 -4.488 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -16.795 -7.836 -5.479 1.00 0.00 H new ATOM 213 N PRO A 18 -16.299 -4.295 -4.880 1.00 0.00 N ATOM 214 CA PRO A 18 -15.668 -3.548 -5.972 1.00 0.00 C ATOM 215 C PRO A 18 -14.796 -4.435 -6.854 1.00 0.00 C ATOM 216 O PRO A 18 -13.619 -4.653 -6.562 1.00 0.00 O ATOM 217 CB PRO A 18 -14.811 -2.509 -5.244 1.00 0.00 C ATOM 218 CG PRO A 18 -14.526 -3.119 -3.915 1.00 0.00 C ATOM 219 CD PRO A 18 -15.739 -3.937 -3.566 1.00 0.00 C ATOM 0 HA PRO A 18 -16.405 -3.114 -6.647 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -13.891 -2.302 -5.790 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -15.340 -1.562 -5.140 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -13.633 -3.743 -3.955 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -14.344 -2.350 -3.164 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -15.474 -4.822 -2.988 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -16.450 -3.367 -2.968 1.00 0.00 H new ATOM 227 N THR A 19 -15.380 -4.946 -7.933 1.00 0.00 N ATOM 228 CA THR A 19 -14.656 -5.810 -8.857 1.00 0.00 C ATOM 229 C THR A 19 -13.862 -4.991 -9.869 1.00 0.00 C ATOM 230 O THR A 19 -13.657 -5.420 -11.004 1.00 0.00 O ATOM 231 CB THR A 19 -15.613 -6.751 -9.613 1.00 0.00 C ATOM 232 OG1 THR A 19 -14.864 -7.671 -10.415 1.00 0.00 O ATOM 233 CG2 THR A 19 -16.565 -5.959 -10.496 1.00 0.00 C ATOM 0 H THR A 19 -16.353 -4.776 -8.189 1.00 0.00 H new ATOM 0 HA THR A 19 -13.969 -6.407 -8.258 1.00 0.00 H new ATOM 0 HB THR A 19 -16.199 -7.304 -8.879 1.00 0.00 H new ATOM 0 HG1 THR A 19 -14.245 -7.175 -10.991 1.00 0.00 H new ATOM 0 HG21 THR A 19 -17.231 -6.645 -11.020 1.00 0.00 H new ATOM 0 HG22 THR A 19 -17.155 -5.281 -9.879 1.00 0.00 H new ATOM 0 HG23 THR A 19 -15.993 -5.383 -11.223 1.00 0.00 H new ATOM 241 N SER A 20 -13.417 -3.811 -9.449 1.00 0.00 N ATOM 242 CA SER A 20 -12.648 -2.931 -10.321 1.00 0.00 C ATOM 243 C SER A 20 -11.464 -2.325 -9.573 1.00 0.00 C ATOM 244 O SER A 20 -11.554 -1.977 -8.395 1.00 0.00 O ATOM 245 CB SER A 20 -13.541 -1.818 -10.874 1.00 0.00 C ATOM 246 OG SER A 20 -14.073 -1.024 -9.827 1.00 0.00 O ATOM 0 H SER A 20 -13.576 -3.443 -8.511 1.00 0.00 H new ATOM 0 HA SER A 20 -12.266 -3.526 -11.151 1.00 0.00 H new ATOM 0 HB2 SER A 20 -12.966 -1.190 -11.555 1.00 0.00 H new ATOM 0 HB3 SER A 20 -14.355 -2.254 -11.453 1.00 0.00 H new ATOM 0 HG SER A 20 -14.994 -1.302 -9.642 1.00 0.00 H new ATOM 252 N PRO A 21 -10.327 -2.194 -10.272 1.00 0.00 N ATOM 253 CA PRO A 21 -9.104 -1.629 -9.696 1.00 0.00 C ATOM 254 C PRO A 21 -9.226 -0.133 -9.428 1.00 0.00 C ATOM 255 O PRO A 21 -10.009 0.574 -10.063 1.00 0.00 O ATOM 256 CB PRO A 21 -8.049 -1.895 -10.772 1.00 0.00 C ATOM 257 CG PRO A 21 -8.819 -1.986 -12.044 1.00 0.00 C ATOM 258 CD PRO A 21 -10.149 -2.587 -11.680 1.00 0.00 C ATOM 0 HA PRO A 21 -8.867 -2.072 -8.729 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -7.313 -1.092 -10.812 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.504 -2.818 -10.572 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.946 -1.002 -12.495 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.297 -2.606 -12.773 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -10.950 -2.200 -12.310 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.146 -3.671 -11.797 1.00 0.00 H new ATOM 266 N PRO A 22 -8.434 0.363 -8.466 1.00 0.00 N ATOM 267 CA PRO A 22 -8.435 1.781 -8.093 1.00 0.00 C ATOM 268 C PRO A 22 -7.835 2.667 -9.180 1.00 0.00 C ATOM 269 O PRO A 22 -7.201 2.177 -10.115 1.00 0.00 O ATOM 270 CB PRO A 22 -7.565 1.817 -6.834 1.00 0.00 C ATOM 271 CG PRO A 22 -6.672 0.631 -6.956 1.00 0.00 C ATOM 272 CD PRO A 22 -7.476 -0.421 -7.668 1.00 0.00 C ATOM 0 HA PRO A 22 -9.445 2.162 -7.941 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -6.990 2.741 -6.777 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -8.173 1.763 -5.931 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -5.770 0.878 -7.516 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -6.353 0.280 -5.975 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -6.847 -1.049 -8.299 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -7.984 -1.082 -6.966 1.00 0.00 H new ATOM 280 N LYS A 23 -8.038 3.973 -9.051 1.00 0.00 N ATOM 281 CA LYS A 23 -7.516 4.929 -10.021 1.00 0.00 C ATOM 282 C LYS A 23 -6.565 5.917 -9.353 1.00 0.00 C ATOM 283 O LYS A 23 -6.467 5.967 -8.127 1.00 0.00 O ATOM 284 CB LYS A 23 -8.665 5.684 -10.692 1.00 0.00 C ATOM 285 CG LYS A 23 -9.881 4.818 -10.972 1.00 0.00 C ATOM 286 CD LYS A 23 -10.806 5.467 -11.989 1.00 0.00 C ATOM 287 CE LYS A 23 -11.459 6.720 -11.429 1.00 0.00 C ATOM 288 NZ LYS A 23 -12.745 6.416 -10.742 1.00 0.00 N ATOM 0 H LYS A 23 -8.561 4.395 -8.283 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.962 4.375 -10.779 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.962 6.517 -10.055 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -8.309 6.111 -11.630 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.558 3.845 -11.341 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -10.425 4.642 -10.044 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.241 5.720 -12.886 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -11.577 4.756 -12.287 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.778 7.202 -10.728 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -11.638 7.429 -12.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -13.256 7.302 -10.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -13.326 5.803 -11.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.552 5.931 -9.843 1.00 0.00 H new ATOM 302 N ASP A 24 -5.869 6.703 -10.167 1.00 0.00 N ATOM 303 CA ASP A 24 -4.928 7.692 -9.655 1.00 0.00 C ATOM 304 C ASP A 24 -3.853 7.028 -8.800 1.00 0.00 C ATOM 305 O ASP A 24 -3.530 7.504 -7.712 1.00 0.00 O ATOM 306 CB ASP A 24 -5.665 8.753 -8.837 1.00 0.00 C ATOM 307 CG ASP A 24 -6.627 9.569 -9.679 1.00 0.00 C ATOM 308 OD1 ASP A 24 -7.583 8.980 -10.226 1.00 0.00 O ATOM 309 OD2 ASP A 24 -6.424 10.796 -9.790 1.00 0.00 O ATOM 0 H ASP A 24 -5.939 6.674 -11.184 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.445 8.172 -10.506 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.214 8.268 -8.030 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.938 9.419 -8.373 1.00 0.00 H new ATOM 314 N VAL A 25 -3.304 5.925 -9.299 1.00 0.00 N ATOM 315 CA VAL A 25 -2.266 5.196 -8.581 1.00 0.00 C ATOM 316 C VAL A 25 -0.907 5.863 -8.753 1.00 0.00 C ATOM 317 O VAL A 25 -0.300 5.797 -9.823 1.00 0.00 O ATOM 318 CB VAL A 25 -2.173 3.735 -9.061 1.00 0.00 C ATOM 319 CG1 VAL A 25 -0.983 3.037 -8.421 1.00 0.00 C ATOM 320 CG2 VAL A 25 -3.465 2.991 -8.756 1.00 0.00 C ATOM 0 H VAL A 25 -3.561 5.517 -10.198 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.542 5.208 -7.527 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.026 3.734 -10.141 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.934 2.006 -8.772 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.065 3.558 -8.695 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.096 3.046 -7.337 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.382 1.961 -9.102 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.645 3.000 -7.681 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.295 3.479 -9.267 1.00 0.00 H new ATOM 330 N THR A 26 -0.431 6.507 -7.691 1.00 0.00 N ATOM 331 CA THR A 26 0.857 7.187 -7.724 1.00 0.00 C ATOM 332 C THR A 26 1.717 6.795 -6.528 1.00 0.00 C ATOM 333 O THR A 26 1.206 6.566 -5.431 1.00 0.00 O ATOM 334 CB THR A 26 0.684 8.718 -7.737 1.00 0.00 C ATOM 335 OG1 THR A 26 -0.199 9.120 -6.684 1.00 0.00 O ATOM 336 CG2 THR A 26 0.133 9.189 -9.075 1.00 0.00 C ATOM 0 H THR A 26 -0.919 6.571 -6.798 1.00 0.00 H new ATOM 0 HA THR A 26 1.354 6.877 -8.643 1.00 0.00 H new ATOM 0 HB THR A 26 1.662 9.173 -7.584 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.302 10.094 -6.698 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.019 10.273 -9.060 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.821 8.907 -9.872 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.837 8.725 -9.253 1.00 0.00 H new ATOM 344 N VAL A 27 3.026 6.719 -6.745 1.00 0.00 N ATOM 345 CA VAL A 27 3.958 6.356 -5.684 1.00 0.00 C ATOM 346 C VAL A 27 5.141 7.316 -5.639 1.00 0.00 C ATOM 347 O VAL A 27 6.035 7.257 -6.482 1.00 0.00 O ATOM 348 CB VAL A 27 4.483 4.920 -5.866 1.00 0.00 C ATOM 349 CG1 VAL A 27 5.638 4.649 -4.913 1.00 0.00 C ATOM 350 CG2 VAL A 27 3.362 3.912 -5.658 1.00 0.00 C ATOM 0 H VAL A 27 3.465 6.904 -7.647 1.00 0.00 H new ATOM 0 HA VAL A 27 3.408 6.418 -4.745 1.00 0.00 H new ATOM 0 HB VAL A 27 4.852 4.813 -6.886 1.00 0.00 H new ATOM 0 HG11 VAL A 27 5.996 3.629 -5.056 1.00 0.00 H new ATOM 0 HG12 VAL A 27 6.448 5.350 -5.115 1.00 0.00 H new ATOM 0 HG13 VAL A 27 5.298 4.773 -3.885 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.751 2.903 -5.791 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.961 4.017 -4.650 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.570 4.094 -6.384 1.00 0.00 H new ATOM 360 N VAL A 28 5.139 8.202 -4.647 1.00 0.00 N ATOM 361 CA VAL A 28 6.214 9.175 -4.490 1.00 0.00 C ATOM 362 C VAL A 28 7.117 8.812 -3.317 1.00 0.00 C ATOM 363 O VAL A 28 6.860 7.846 -2.598 1.00 0.00 O ATOM 364 CB VAL A 28 5.657 10.595 -4.275 1.00 0.00 C ATOM 365 CG1 VAL A 28 4.834 11.034 -5.476 1.00 0.00 C ATOM 366 CG2 VAL A 28 4.829 10.655 -3.000 1.00 0.00 C ATOM 0 H VAL A 28 4.406 8.266 -3.941 1.00 0.00 H new ATOM 0 HA VAL A 28 6.796 9.156 -5.411 1.00 0.00 H new ATOM 0 HB VAL A 28 6.496 11.283 -4.169 1.00 0.00 H new ATOM 0 HG11 VAL A 28 4.449 12.039 -5.305 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.461 11.032 -6.367 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.001 10.346 -5.617 1.00 0.00 H new ATOM 0 HG21 VAL A 28 4.443 11.665 -2.864 1.00 0.00 H new ATOM 0 HG22 VAL A 28 3.996 9.956 -3.074 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.453 10.387 -2.148 1.00 0.00 H new ATOM 376 N SER A 29 8.176 9.593 -3.129 1.00 0.00 N ATOM 377 CA SER A 29 9.120 9.352 -2.044 1.00 0.00 C ATOM 378 C SER A 29 9.095 10.497 -1.037 1.00 0.00 C ATOM 379 O SER A 29 8.996 11.666 -1.410 1.00 0.00 O ATOM 380 CB SER A 29 10.535 9.178 -2.600 1.00 0.00 C ATOM 381 OG SER A 29 10.682 7.919 -3.235 1.00 0.00 O ATOM 0 H SER A 29 8.402 10.398 -3.714 1.00 0.00 H new ATOM 0 HA SER A 29 8.822 8.436 -1.534 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.750 9.975 -3.312 1.00 0.00 H new ATOM 0 HB3 SER A 29 11.261 9.268 -1.792 1.00 0.00 H new ATOM 0 HG SER A 29 11.448 7.948 -3.845 1.00 0.00 H new ATOM 387 N LYS A 30 9.185 10.153 0.243 1.00 0.00 N ATOM 388 CA LYS A 30 9.174 11.150 1.307 1.00 0.00 C ATOM 389 C LYS A 30 10.278 12.182 1.097 1.00 0.00 C ATOM 390 O LYS A 30 11.316 11.882 0.508 1.00 0.00 O ATOM 391 CB LYS A 30 9.345 10.475 2.669 1.00 0.00 C ATOM 392 CG LYS A 30 9.225 11.432 3.842 1.00 0.00 C ATOM 393 CD LYS A 30 7.794 11.520 4.347 1.00 0.00 C ATOM 394 CE LYS A 30 7.745 11.872 5.826 1.00 0.00 C ATOM 395 NZ LYS A 30 6.473 12.554 6.192 1.00 0.00 N ATOM 0 H LYS A 30 9.266 9.190 0.569 1.00 0.00 H new ATOM 0 HA LYS A 30 8.212 11.662 1.281 1.00 0.00 H new ATOM 0 HB2 LYS A 30 8.595 9.691 2.773 1.00 0.00 H new ATOM 0 HB3 LYS A 30 10.321 9.990 2.705 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.877 11.101 4.650 1.00 0.00 H new ATOM 0 HG3 LYS A 30 9.567 12.422 3.541 1.00 0.00 H new ATOM 0 HD2 LYS A 30 7.251 12.272 3.775 1.00 0.00 H new ATOM 0 HD3 LYS A 30 7.290 10.568 4.182 1.00 0.00 H new ATOM 0 HE2 LYS A 30 7.854 10.964 6.419 1.00 0.00 H new ATOM 0 HE3 LYS A 30 8.588 12.518 6.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 6.479 12.777 7.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 6.381 13.434 5.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 5.670 11.928 5.980 1.00 0.00 H new ATOM 409 N GLU A 31 10.047 13.397 1.585 1.00 0.00 N ATOM 410 CA GLU A 31 11.024 14.471 1.451 1.00 0.00 C ATOM 411 C GLU A 31 12.061 14.406 2.567 1.00 0.00 C ATOM 412 O GLU A 31 11.804 14.827 3.694 1.00 0.00 O ATOM 413 CB GLU A 31 10.324 15.832 1.469 1.00 0.00 C ATOM 414 CG GLU A 31 11.231 16.988 1.085 1.00 0.00 C ATOM 415 CD GLU A 31 10.465 18.271 0.826 1.00 0.00 C ATOM 416 OE1 GLU A 31 9.670 18.301 -0.137 1.00 0.00 O ATOM 417 OE2 GLU A 31 10.659 19.243 1.585 1.00 0.00 O ATOM 0 H GLU A 31 9.193 13.662 2.076 1.00 0.00 H new ATOM 0 HA GLU A 31 11.535 14.345 0.496 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.476 15.804 0.785 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.923 16.012 2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.955 17.157 1.882 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.796 16.720 0.192 1.00 0.00 H new ATOM 424 N GLY A 32 13.237 13.874 2.245 1.00 0.00 N ATOM 425 CA GLY A 32 14.296 13.762 3.231 1.00 0.00 C ATOM 426 C GLY A 32 14.524 12.331 3.677 1.00 0.00 C ATOM 427 O GLY A 32 15.645 11.949 4.012 1.00 0.00 O ATOM 0 H GLY A 32 13.475 13.519 1.319 1.00 0.00 H new ATOM 0 HA2 GLY A 32 15.221 14.161 2.814 1.00 0.00 H new ATOM 0 HA3 GLY A 32 14.047 14.374 4.098 1.00 0.00 H new ATOM 431 N LYS A 33 13.459 11.538 3.682 1.00 0.00 N ATOM 432 CA LYS A 33 13.547 10.141 4.091 1.00 0.00 C ATOM 433 C LYS A 33 13.384 9.212 2.891 1.00 0.00 C ATOM 434 O LYS A 33 12.280 8.989 2.394 1.00 0.00 O ATOM 435 CB LYS A 33 12.479 9.827 5.141 1.00 0.00 C ATOM 436 CG LYS A 33 12.570 8.417 5.699 1.00 0.00 C ATOM 437 CD LYS A 33 13.955 8.124 6.251 1.00 0.00 C ATOM 438 CE LYS A 33 13.903 7.104 7.377 1.00 0.00 C ATOM 439 NZ LYS A 33 15.026 7.281 8.339 1.00 0.00 N ATOM 0 H LYS A 33 12.524 11.839 3.407 1.00 0.00 H new ATOM 0 HA LYS A 33 14.533 9.977 4.525 1.00 0.00 H new ATOM 0 HB2 LYS A 33 12.567 10.540 5.961 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.493 9.971 4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 33 11.828 8.288 6.487 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.330 7.698 4.915 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.595 7.752 5.451 1.00 0.00 H new ATOM 0 HD3 LYS A 33 14.405 9.047 6.616 1.00 0.00 H new ATOM 0 HE2 LYS A 33 12.954 7.195 7.906 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.939 6.098 6.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 15.045 6.480 9.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 15.926 7.321 7.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 14.893 8.166 8.869 1.00 0.00 H new ATOM 453 N PRO A 34 14.508 8.656 2.416 1.00 0.00 N ATOM 454 CA PRO A 34 14.515 7.741 1.270 1.00 0.00 C ATOM 455 C PRO A 34 13.873 6.398 1.598 1.00 0.00 C ATOM 456 O PRO A 34 13.191 5.803 0.762 1.00 0.00 O ATOM 457 CB PRO A 34 16.005 7.562 0.969 1.00 0.00 C ATOM 458 CG PRO A 34 16.689 7.835 2.264 1.00 0.00 C ATOM 459 CD PRO A 34 15.859 8.877 2.959 1.00 0.00 C ATOM 0 HA PRO A 34 13.941 8.133 0.431 1.00 0.00 H new ATOM 0 HB2 PRO A 34 16.219 6.554 0.613 1.00 0.00 H new ATOM 0 HB3 PRO A 34 16.338 8.251 0.193 1.00 0.00 H new ATOM 0 HG2 PRO A 34 16.762 6.929 2.866 1.00 0.00 H new ATOM 0 HG3 PRO A 34 17.706 8.191 2.101 1.00 0.00 H new ATOM 0 HD2 PRO A 34 15.882 8.753 4.042 1.00 0.00 H new ATOM 0 HD3 PRO A 34 16.218 9.884 2.746 1.00 0.00 H new ATOM 467 N LYS A 35 14.094 5.923 2.819 1.00 0.00 N ATOM 468 CA LYS A 35 13.535 4.650 3.259 1.00 0.00 C ATOM 469 C LYS A 35 12.022 4.748 3.424 1.00 0.00 C ATOM 470 O LYS A 35 11.343 3.742 3.631 1.00 0.00 O ATOM 471 CB LYS A 35 14.176 4.218 4.580 1.00 0.00 C ATOM 472 CG LYS A 35 15.624 3.780 4.439 1.00 0.00 C ATOM 473 CD LYS A 35 16.400 3.998 5.727 1.00 0.00 C ATOM 474 CE LYS A 35 16.933 5.420 5.822 1.00 0.00 C ATOM 475 NZ LYS A 35 18.261 5.560 5.164 1.00 0.00 N ATOM 0 H LYS A 35 14.657 6.401 3.522 1.00 0.00 H new ATOM 0 HA LYS A 35 13.752 3.903 2.495 1.00 0.00 H new ATOM 0 HB2 LYS A 35 14.123 5.045 5.288 1.00 0.00 H new ATOM 0 HB3 LYS A 35 13.597 3.398 5.004 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.661 2.726 4.165 1.00 0.00 H new ATOM 0 HG3 LYS A 35 16.096 4.337 3.630 1.00 0.00 H new ATOM 0 HD2 LYS A 35 15.755 3.792 6.581 1.00 0.00 H new ATOM 0 HD3 LYS A 35 17.230 3.293 5.777 1.00 0.00 H new ATOM 0 HE2 LYS A 35 16.224 6.105 5.358 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.015 5.708 6.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 18.935 5.987 5.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 18.606 4.622 4.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 18.171 6.169 4.326 1.00 0.00 H new ATOM 489 N THR A 36 11.498 5.966 3.329 1.00 0.00 N ATOM 490 CA THR A 36 10.066 6.195 3.467 1.00 0.00 C ATOM 491 C THR A 36 9.454 6.665 2.152 1.00 0.00 C ATOM 492 O THR A 36 10.060 7.449 1.421 1.00 0.00 O ATOM 493 CB THR A 36 9.766 7.238 4.561 1.00 0.00 C ATOM 494 OG1 THR A 36 10.306 6.803 5.814 1.00 0.00 O ATOM 495 CG2 THR A 36 8.268 7.463 4.699 1.00 0.00 C ATOM 0 H THR A 36 12.045 6.810 3.157 1.00 0.00 H new ATOM 0 HA THR A 36 9.620 5.242 3.752 1.00 0.00 H new ATOM 0 HB THR A 36 10.233 8.179 4.272 1.00 0.00 H new ATOM 0 HG1 THR A 36 10.690 5.907 5.711 1.00 0.00 H new ATOM 0 HG21 THR A 36 8.081 8.203 5.477 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.865 7.823 3.752 1.00 0.00 H new ATOM 0 HG23 THR A 36 7.782 6.525 4.967 1.00 0.00 H new ATOM 503 N ILE A 37 8.252 6.182 1.858 1.00 0.00 N ATOM 504 CA ILE A 37 7.559 6.554 0.631 1.00 0.00 C ATOM 505 C ILE A 37 6.056 6.666 0.861 1.00 0.00 C ATOM 506 O ILE A 37 5.505 6.022 1.755 1.00 0.00 O ATOM 507 CB ILE A 37 7.821 5.537 -0.495 1.00 0.00 C ATOM 508 CG1 ILE A 37 7.223 4.176 -0.131 1.00 0.00 C ATOM 509 CG2 ILE A 37 9.314 5.412 -0.759 1.00 0.00 C ATOM 510 CD1 ILE A 37 6.817 3.353 -1.333 1.00 0.00 C ATOM 0 H ILE A 37 7.738 5.532 2.453 1.00 0.00 H new ATOM 0 HA ILE A 37 7.951 7.525 0.330 1.00 0.00 H new ATOM 0 HB ILE A 37 7.340 5.893 -1.406 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.950 3.614 0.455 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.351 4.330 0.505 1.00 0.00 H new ATOM 0 HG21 ILE A 37 9.483 4.689 -1.557 1.00 0.00 H new ATOM 0 HG22 ILE A 37 9.713 6.382 -1.056 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.817 5.075 0.148 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.402 2.402 -0.999 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.066 3.895 -1.908 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.690 3.168 -1.959 1.00 0.00 H new ATOM 522 N ILE A 38 5.397 7.485 0.049 1.00 0.00 N ATOM 523 CA ILE A 38 3.957 7.678 0.162 1.00 0.00 C ATOM 524 C ILE A 38 3.235 7.173 -1.083 1.00 0.00 C ATOM 525 O ILE A 38 3.644 7.456 -2.209 1.00 0.00 O ATOM 526 CB ILE A 38 3.603 9.161 0.381 1.00 0.00 C ATOM 527 CG1 ILE A 38 4.395 9.728 1.561 1.00 0.00 C ATOM 528 CG2 ILE A 38 2.108 9.320 0.613 1.00 0.00 C ATOM 529 CD1 ILE A 38 5.748 10.282 1.171 1.00 0.00 C ATOM 0 H ILE A 38 5.838 8.026 -0.695 1.00 0.00 H new ATOM 0 HA ILE A 38 3.629 7.103 1.028 1.00 0.00 H new ATOM 0 HB ILE A 38 3.873 9.720 -0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.811 10.517 2.034 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.533 8.944 2.305 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.874 10.373 0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.564 8.950 -0.256 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.814 8.751 1.495 1.00 0.00 H new ATOM 0 HD11 ILE A 38 6.253 10.667 2.057 1.00 0.00 H new ATOM 0 HD12 ILE A 38 6.350 9.491 0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 38 5.617 11.088 0.450 1.00 0.00 H new ATOM 541 N VAL A 39 2.157 6.425 -0.872 1.00 0.00 N ATOM 542 CA VAL A 39 1.375 5.882 -1.977 1.00 0.00 C ATOM 543 C VAL A 39 -0.049 6.426 -1.961 1.00 0.00 C ATOM 544 O VAL A 39 -0.809 6.175 -1.027 1.00 0.00 O ATOM 545 CB VAL A 39 1.327 4.344 -1.927 1.00 0.00 C ATOM 546 CG1 VAL A 39 0.436 3.802 -3.035 1.00 0.00 C ATOM 547 CG2 VAL A 39 2.729 3.763 -2.027 1.00 0.00 C ATOM 0 H VAL A 39 1.805 6.181 0.054 1.00 0.00 H new ATOM 0 HA VAL A 39 1.869 6.192 -2.898 1.00 0.00 H new ATOM 0 HB VAL A 39 0.902 4.042 -0.970 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.414 2.713 -2.984 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.575 4.192 -2.913 1.00 0.00 H new ATOM 0 HG13 VAL A 39 0.830 4.112 -4.003 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.675 2.675 -1.990 1.00 0.00 H new ATOM 0 HG22 VAL A 39 3.185 4.072 -2.968 1.00 0.00 H new ATOM 0 HG23 VAL A 39 3.333 4.125 -1.195 1.00 0.00 H new ATOM 557 N ASN A 40 -0.404 7.171 -3.002 1.00 0.00 N ATOM 558 CA ASN A 40 -1.738 7.751 -3.108 1.00 0.00 C ATOM 559 C ASN A 40 -2.577 6.999 -4.137 1.00 0.00 C ATOM 560 O ASN A 40 -2.042 6.336 -5.025 1.00 0.00 O ATOM 561 CB ASN A 40 -1.646 9.229 -3.491 1.00 0.00 C ATOM 562 CG ASN A 40 -0.722 10.007 -2.574 1.00 0.00 C ATOM 563 OD1 ASN A 40 -1.105 10.392 -1.470 1.00 0.00 O ATOM 564 ND2 ASN A 40 0.503 10.242 -3.030 1.00 0.00 N ATOM 0 H ASN A 40 0.213 7.388 -3.785 1.00 0.00 H new ATOM 0 HA ASN A 40 -2.223 7.665 -2.136 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -1.290 9.314 -4.518 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -2.641 9.672 -3.461 1.00 0.00 H new ATOM 0 HD21 ASN A 40 1.169 10.761 -2.458 1.00 0.00 H new ATOM 0 HD22 ASN A 40 0.778 9.904 -3.952 1.00 0.00 H new ATOM 571 N TRP A 41 -3.895 7.108 -4.010 1.00 0.00 N ATOM 572 CA TRP A 41 -4.809 6.439 -4.929 1.00 0.00 C ATOM 573 C TRP A 41 -6.208 7.038 -4.839 1.00 0.00 C ATOM 574 O TRP A 41 -6.466 7.908 -4.007 1.00 0.00 O ATOM 575 CB TRP A 41 -4.862 4.940 -4.627 1.00 0.00 C ATOM 576 CG TRP A 41 -5.468 4.625 -3.293 1.00 0.00 C ATOM 577 CD1 TRP A 41 -6.796 4.475 -3.011 1.00 0.00 C ATOM 578 CD2 TRP A 41 -4.768 4.421 -2.061 1.00 0.00 C ATOM 579 NE1 TRP A 41 -6.964 4.192 -1.677 1.00 0.00 N ATOM 580 CE2 TRP A 41 -5.735 4.152 -1.072 1.00 0.00 C ATOM 581 CE3 TRP A 41 -3.420 4.438 -1.696 1.00 0.00 C ATOM 582 CZ2 TRP A 41 -5.394 3.904 0.255 1.00 0.00 C ATOM 583 CZ3 TRP A 41 -3.082 4.192 -0.379 1.00 0.00 C ATOM 584 CH2 TRP A 41 -4.066 3.927 0.583 1.00 0.00 C ATOM 0 H TRP A 41 -4.354 7.653 -3.280 1.00 0.00 H new ATOM 0 HA TRP A 41 -4.437 6.586 -5.943 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -5.436 4.440 -5.407 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -3.852 4.533 -4.665 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.596 4.566 -3.731 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -7.859 4.037 -1.212 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.655 4.640 -2.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -6.151 3.701 0.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -2.043 4.204 -0.086 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -3.770 3.737 1.604 1.00 0.00 H new ATOM 595 N GLN A 42 -7.105 6.568 -5.699 1.00 0.00 N ATOM 596 CA GLN A 42 -8.478 7.060 -5.714 1.00 0.00 C ATOM 597 C GLN A 42 -9.462 5.919 -5.954 1.00 0.00 C ATOM 598 O GLN A 42 -9.124 4.888 -6.535 1.00 0.00 O ATOM 599 CB GLN A 42 -8.646 8.130 -6.794 1.00 0.00 C ATOM 600 CG GLN A 42 -7.974 9.450 -6.453 1.00 0.00 C ATOM 601 CD GLN A 42 -8.591 10.124 -5.243 1.00 0.00 C ATOM 602 OE1 GLN A 42 -9.806 10.084 -5.049 1.00 0.00 O ATOM 603 NE2 GLN A 42 -7.754 10.747 -4.421 1.00 0.00 N ATOM 0 H GLN A 42 -6.907 5.848 -6.394 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.691 7.500 -4.740 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -8.236 7.755 -7.732 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -9.709 8.305 -6.958 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -6.914 9.276 -6.266 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -8.041 10.120 -7.311 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -6.754 10.755 -4.621 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.111 11.218 -3.590 1.00 0.00 H new ATOM 612 N PRO A 43 -10.709 6.107 -5.497 1.00 0.00 N ATOM 613 CA PRO A 43 -11.767 5.104 -5.651 1.00 0.00 C ATOM 614 C PRO A 43 -12.217 4.953 -7.100 1.00 0.00 C ATOM 615 O PRO A 43 -12.258 5.916 -7.866 1.00 0.00 O ATOM 616 CB PRO A 43 -12.907 5.658 -4.792 1.00 0.00 C ATOM 617 CG PRO A 43 -12.673 7.129 -4.755 1.00 0.00 C ATOM 618 CD PRO A 43 -11.181 7.312 -4.795 1.00 0.00 C ATOM 0 HA PRO A 43 -11.433 4.110 -5.353 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.879 5.423 -5.225 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -12.892 5.229 -3.790 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.149 7.621 -5.603 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.096 7.569 -3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -10.902 8.222 -5.326 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.758 7.385 -3.793 1.00 0.00 H new ATOM 626 N PRO A 44 -12.562 3.717 -7.487 1.00 0.00 N ATOM 627 CA PRO A 44 -13.016 3.411 -8.847 1.00 0.00 C ATOM 628 C PRO A 44 -14.393 3.995 -9.144 1.00 0.00 C ATOM 629 O PRO A 44 -15.203 4.192 -8.238 1.00 0.00 O ATOM 630 CB PRO A 44 -13.068 1.881 -8.868 1.00 0.00 C ATOM 631 CG PRO A 44 -13.264 1.489 -7.444 1.00 0.00 C ATOM 632 CD PRO A 44 -12.538 2.522 -6.627 1.00 0.00 C ATOM 0 HA PRO A 44 -12.357 3.839 -9.602 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -13.885 1.521 -9.494 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.148 1.459 -9.272 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.323 1.463 -7.189 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -12.866 0.492 -7.255 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -13.036 2.703 -5.674 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -11.518 2.211 -6.400 1.00 0.00 H new ATOM 640 N SER A 45 -14.653 4.268 -10.418 1.00 0.00 N ATOM 641 CA SER A 45 -15.932 4.833 -10.834 1.00 0.00 C ATOM 642 C SER A 45 -17.070 3.852 -10.570 1.00 0.00 C ATOM 643 O SER A 45 -18.119 4.229 -10.049 1.00 0.00 O ATOM 644 CB SER A 45 -15.893 5.199 -12.319 1.00 0.00 C ATOM 645 OG SER A 45 -16.762 6.283 -12.599 1.00 0.00 O ATOM 0 H SER A 45 -13.995 4.107 -11.181 1.00 0.00 H new ATOM 0 HA SER A 45 -16.110 5.736 -10.249 1.00 0.00 H new ATOM 0 HB2 SER A 45 -14.875 5.462 -12.606 1.00 0.00 H new ATOM 0 HB3 SER A 45 -16.180 4.335 -12.918 1.00 0.00 H new ATOM 0 HG SER A 45 -16.718 6.499 -13.554 1.00 0.00 H new ATOM 651 N GLU A 46 -16.853 2.592 -10.933 1.00 0.00 N ATOM 652 CA GLU A 46 -17.861 1.557 -10.736 1.00 0.00 C ATOM 653 C GLU A 46 -18.462 1.641 -9.336 1.00 0.00 C ATOM 654 O GLU A 46 -19.671 1.806 -9.177 1.00 0.00 O ATOM 655 CB GLU A 46 -17.251 0.171 -10.958 1.00 0.00 C ATOM 656 CG GLU A 46 -17.304 -0.293 -12.404 1.00 0.00 C ATOM 657 CD GLU A 46 -17.271 -1.803 -12.534 1.00 0.00 C ATOM 658 OE1 GLU A 46 -18.314 -2.443 -12.283 1.00 0.00 O ATOM 659 OE2 GLU A 46 -16.203 -2.345 -12.887 1.00 0.00 O ATOM 0 H GLU A 46 -15.989 2.263 -11.365 1.00 0.00 H new ATOM 0 HA GLU A 46 -18.656 1.718 -11.464 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.213 0.183 -10.627 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -17.776 -0.552 -10.334 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -18.212 0.088 -12.871 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.462 0.133 -12.949 1.00 0.00 H new ATOM 666 N ALA A 47 -17.608 1.527 -8.324 1.00 0.00 N ATOM 667 CA ALA A 47 -18.053 1.592 -6.937 1.00 0.00 C ATOM 668 C ALA A 47 -19.433 0.965 -6.774 1.00 0.00 C ATOM 669 O ALA A 47 -20.348 1.586 -6.234 1.00 0.00 O ATOM 670 CB ALA A 47 -18.066 3.035 -6.454 1.00 0.00 C ATOM 0 H ALA A 47 -16.604 1.389 -8.439 1.00 0.00 H new ATOM 0 HA ALA A 47 -17.350 1.023 -6.328 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -18.400 3.069 -5.417 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -17.061 3.452 -6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -18.746 3.620 -7.073 1.00 0.00 H new ATOM 676 N ASN A 48 -19.577 -0.270 -7.244 1.00 0.00 N ATOM 677 CA ASN A 48 -20.847 -0.981 -7.151 1.00 0.00 C ATOM 678 C ASN A 48 -21.582 -0.614 -5.866 1.00 0.00 C ATOM 679 O ASN A 48 -22.810 -0.550 -5.837 1.00 0.00 O ATOM 680 CB ASN A 48 -20.615 -2.492 -7.206 1.00 0.00 C ATOM 681 CG ASN A 48 -20.061 -2.943 -8.544 1.00 0.00 C ATOM 682 OD1 ASN A 48 -20.420 -2.405 -9.591 1.00 0.00 O ATOM 683 ND2 ASN A 48 -19.180 -3.937 -8.514 1.00 0.00 N ATOM 0 H ASN A 48 -18.830 -0.799 -7.693 1.00 0.00 H new ATOM 0 HA ASN A 48 -21.464 -0.685 -7.999 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -19.924 -2.780 -6.414 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -21.555 -3.009 -7.012 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -18.772 -4.284 -9.382 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -18.911 -4.354 -7.623 1.00 0.00 H new ATOM 690 N GLY A 49 -20.821 -0.374 -4.803 1.00 0.00 N ATOM 691 CA GLY A 49 -21.417 -0.016 -3.529 1.00 0.00 C ATOM 692 C GLY A 49 -20.708 1.147 -2.863 1.00 0.00 C ATOM 693 O GLY A 49 -20.455 2.173 -3.494 1.00 0.00 O ATOM 0 H GLY A 49 -19.802 -0.421 -4.801 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -22.465 0.241 -3.681 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -21.394 -0.880 -2.865 1.00 0.00 H new ATOM 697 N LYS A 50 -20.387 0.987 -1.583 1.00 0.00 N ATOM 698 CA LYS A 50 -19.704 2.032 -0.830 1.00 0.00 C ATOM 699 C LYS A 50 -18.282 1.606 -0.476 1.00 0.00 C ATOM 700 O LYS A 50 -17.827 0.535 -0.878 1.00 0.00 O ATOM 701 CB LYS A 50 -20.481 2.361 0.446 1.00 0.00 C ATOM 702 CG LYS A 50 -20.673 1.168 1.367 1.00 0.00 C ATOM 703 CD LYS A 50 -20.970 1.604 2.791 1.00 0.00 C ATOM 704 CE LYS A 50 -22.458 1.835 3.005 1.00 0.00 C ATOM 705 NZ LYS A 50 -22.884 3.181 2.533 1.00 0.00 N ATOM 0 H LYS A 50 -20.589 0.144 -1.046 1.00 0.00 H new ATOM 0 HA LYS A 50 -19.653 2.922 -1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -19.956 3.147 0.988 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -21.458 2.760 0.174 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -21.491 0.550 0.997 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -19.775 0.550 1.355 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -20.615 0.844 3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -20.423 2.520 3.014 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -23.024 1.069 2.476 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -22.693 1.730 4.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -23.730 3.481 3.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -22.116 3.864 2.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -23.104 3.139 1.517 1.00 0.00 H new ATOM 719 N ILE A 51 -17.587 2.450 0.279 1.00 0.00 N ATOM 720 CA ILE A 51 -16.219 2.158 0.689 1.00 0.00 C ATOM 721 C ILE A 51 -16.048 2.328 2.195 1.00 0.00 C ATOM 722 O ILE A 51 -16.702 3.167 2.815 1.00 0.00 O ATOM 723 CB ILE A 51 -15.209 3.067 -0.036 1.00 0.00 C ATOM 724 CG1 ILE A 51 -15.373 2.940 -1.553 1.00 0.00 C ATOM 725 CG2 ILE A 51 -13.788 2.716 0.379 1.00 0.00 C ATOM 726 CD1 ILE A 51 -15.218 1.524 -2.061 1.00 0.00 C ATOM 0 H ILE A 51 -17.949 3.341 0.619 1.00 0.00 H new ATOM 0 HA ILE A 51 -16.023 1.121 0.418 1.00 0.00 H new ATOM 0 HB ILE A 51 -15.405 4.101 0.247 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -16.357 3.313 -1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.637 3.576 -2.044 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -13.086 3.367 -0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -13.679 2.852 1.455 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -13.580 1.678 0.121 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -15.347 1.510 -3.143 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -14.224 1.154 -1.809 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -15.971 0.887 -1.598 1.00 0.00 H new ATOM 738 N THR A 52 -15.163 1.525 2.778 1.00 0.00 N ATOM 739 CA THR A 52 -14.905 1.586 4.211 1.00 0.00 C ATOM 740 C THR A 52 -13.410 1.659 4.498 1.00 0.00 C ATOM 741 O THR A 52 -12.986 2.248 5.491 1.00 0.00 O ATOM 742 CB THR A 52 -15.497 0.365 4.941 1.00 0.00 C ATOM 743 OG1 THR A 52 -14.798 -0.823 4.554 1.00 0.00 O ATOM 744 CG2 THR A 52 -16.978 0.214 4.628 1.00 0.00 C ATOM 0 H THR A 52 -14.613 0.825 2.280 1.00 0.00 H new ATOM 0 HA THR A 52 -15.388 2.491 4.581 1.00 0.00 H new ATOM 0 HB THR A 52 -15.383 0.519 6.014 1.00 0.00 H new ATOM 0 HG1 THR A 52 -15.179 -1.594 5.023 1.00 0.00 H new ATOM 0 HG21 THR A 52 -17.374 -0.654 5.154 1.00 0.00 H new ATOM 0 HG22 THR A 52 -17.511 1.108 4.951 1.00 0.00 H new ATOM 0 HG23 THR A 52 -17.111 0.080 3.555 1.00 0.00 H new ATOM 752 N GLY A 53 -12.613 1.057 3.620 1.00 0.00 N ATOM 753 CA GLY A 53 -11.173 1.066 3.796 1.00 0.00 C ATOM 754 C GLY A 53 -10.434 0.579 2.565 1.00 0.00 C ATOM 755 O GLY A 53 -11.048 0.296 1.536 1.00 0.00 O ATOM 0 H GLY A 53 -12.940 0.563 2.790 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.846 2.078 4.035 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.910 0.436 4.646 1.00 0.00 H new ATOM 759 N TYR A 54 -9.114 0.483 2.669 1.00 0.00 N ATOM 760 CA TYR A 54 -8.290 0.032 1.554 1.00 0.00 C ATOM 761 C TYR A 54 -7.144 -0.848 2.044 1.00 0.00 C ATOM 762 O TYR A 54 -6.797 -0.833 3.226 1.00 0.00 O ATOM 763 CB TYR A 54 -7.734 1.231 0.785 1.00 0.00 C ATOM 764 CG TYR A 54 -8.803 2.096 0.156 1.00 0.00 C ATOM 765 CD1 TYR A 54 -9.547 2.983 0.924 1.00 0.00 C ATOM 766 CD2 TYR A 54 -9.068 2.027 -1.206 1.00 0.00 C ATOM 767 CE1 TYR A 54 -10.525 3.774 0.354 1.00 0.00 C ATOM 768 CE2 TYR A 54 -10.043 2.815 -1.785 1.00 0.00 C ATOM 769 CZ TYR A 54 -10.769 3.687 -1.001 1.00 0.00 C ATOM 770 OH TYR A 54 -11.742 4.475 -1.573 1.00 0.00 O ATOM 0 H TYR A 54 -8.591 0.712 3.514 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.918 -0.559 0.887 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -7.137 1.841 1.463 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.063 0.872 0.004 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.357 3.055 1.985 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -8.501 1.345 -1.823 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.096 4.457 0.966 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -10.236 2.749 -2.846 1.00 0.00 H new ATOM 0 HH TYR A 54 -11.991 5.190 -0.951 1.00 0.00 H new ATOM 780 N ILE A 55 -6.561 -1.614 1.128 1.00 0.00 N ATOM 781 CA ILE A 55 -5.453 -2.499 1.465 1.00 0.00 C ATOM 782 C ILE A 55 -4.350 -2.424 0.415 1.00 0.00 C ATOM 783 O ILE A 55 -4.621 -2.441 -0.786 1.00 0.00 O ATOM 784 CB ILE A 55 -5.921 -3.960 1.600 1.00 0.00 C ATOM 785 CG1 ILE A 55 -6.924 -4.094 2.747 1.00 0.00 C ATOM 786 CG2 ILE A 55 -4.729 -4.879 1.821 1.00 0.00 C ATOM 787 CD1 ILE A 55 -7.658 -5.417 2.758 1.00 0.00 C ATOM 0 H ILE A 55 -6.838 -1.639 0.147 1.00 0.00 H new ATOM 0 HA ILE A 55 -5.060 -2.162 2.424 1.00 0.00 H new ATOM 0 HB ILE A 55 -6.416 -4.255 0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.399 -3.972 3.694 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.651 -3.285 2.679 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.075 -5.908 1.915 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.048 -4.801 0.974 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -4.209 -4.587 2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -8.352 -5.441 3.598 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.212 -5.534 1.826 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.940 -6.231 2.857 1.00 0.00 H new ATOM 799 N ILE A 56 -3.107 -2.344 0.876 1.00 0.00 N ATOM 800 CA ILE A 56 -1.962 -2.270 -0.024 1.00 0.00 C ATOM 801 C ILE A 56 -1.040 -3.470 0.160 1.00 0.00 C ATOM 802 O ILE A 56 -0.844 -3.950 1.276 1.00 0.00 O ATOM 803 CB ILE A 56 -1.155 -0.977 0.197 1.00 0.00 C ATOM 804 CG1 ILE A 56 -2.022 0.248 -0.099 1.00 0.00 C ATOM 805 CG2 ILE A 56 0.091 -0.975 -0.677 1.00 0.00 C ATOM 806 CD1 ILE A 56 -1.419 1.547 0.391 1.00 0.00 C ATOM 0 H ILE A 56 -2.866 -2.329 1.867 1.00 0.00 H new ATOM 0 HA ILE A 56 -2.358 -2.272 -1.040 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.843 -0.934 1.241 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -2.186 0.316 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -2.999 0.112 0.365 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.651 -0.055 -0.510 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.715 -1.831 -0.422 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.200 -1.037 -1.726 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.087 2.373 0.147 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.280 1.499 1.471 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.455 1.706 -0.092 1.00 0.00 H new ATOM 818 N TYR A 57 -0.475 -3.950 -0.943 1.00 0.00 N ATOM 819 CA TYR A 57 0.427 -5.095 -0.904 1.00 0.00 C ATOM 820 C TYR A 57 1.815 -4.712 -1.407 1.00 0.00 C ATOM 821 O TYR A 57 1.953 -3.996 -2.399 1.00 0.00 O ATOM 822 CB TYR A 57 -0.135 -6.242 -1.746 1.00 0.00 C ATOM 823 CG TYR A 57 -1.543 -6.640 -1.365 1.00 0.00 C ATOM 824 CD1 TYR A 57 -2.641 -5.982 -1.904 1.00 0.00 C ATOM 825 CD2 TYR A 57 -1.774 -7.673 -0.466 1.00 0.00 C ATOM 826 CE1 TYR A 57 -3.930 -6.342 -1.559 1.00 0.00 C ATOM 827 CE2 TYR A 57 -3.059 -8.041 -0.116 1.00 0.00 C ATOM 828 CZ TYR A 57 -4.133 -7.372 -0.665 1.00 0.00 C ATOM 829 OH TYR A 57 -5.415 -7.734 -0.317 1.00 0.00 O ATOM 0 H TYR A 57 -0.626 -3.564 -1.875 1.00 0.00 H new ATOM 0 HA TYR A 57 0.514 -5.422 0.132 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.120 -5.951 -2.796 1.00 0.00 H new ATOM 0 HB3 TYR A 57 0.518 -7.109 -1.646 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.485 -5.175 -2.605 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -0.935 -8.198 -0.033 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -4.773 -5.820 -1.987 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -3.221 -8.848 0.583 1.00 0.00 H new ATOM 0 HH TYR A 57 -5.950 -6.929 -0.155 1.00 0.00 H new ATOM 839 N TYR A 58 2.841 -5.194 -0.715 1.00 0.00 N ATOM 840 CA TYR A 58 4.220 -4.902 -1.089 1.00 0.00 C ATOM 841 C TYR A 58 5.145 -6.050 -0.698 1.00 0.00 C ATOM 842 O TYR A 58 4.995 -6.649 0.368 1.00 0.00 O ATOM 843 CB TYR A 58 4.687 -3.606 -0.424 1.00 0.00 C ATOM 844 CG TYR A 58 5.104 -3.783 1.019 1.00 0.00 C ATOM 845 CD1 TYR A 58 6.319 -4.371 1.345 1.00 0.00 C ATOM 846 CD2 TYR A 58 4.282 -3.359 2.057 1.00 0.00 C ATOM 847 CE1 TYR A 58 6.704 -4.535 2.662 1.00 0.00 C ATOM 848 CE2 TYR A 58 4.659 -3.517 3.376 1.00 0.00 C ATOM 849 CZ TYR A 58 5.870 -4.106 3.674 1.00 0.00 C ATOM 850 OH TYR A 58 6.250 -4.266 4.987 1.00 0.00 O ATOM 0 H TYR A 58 2.744 -5.789 0.108 1.00 0.00 H new ATOM 0 HA TYR A 58 4.259 -4.781 -2.172 1.00 0.00 H new ATOM 0 HB2 TYR A 58 5.526 -3.199 -0.989 1.00 0.00 H new ATOM 0 HB3 TYR A 58 3.883 -2.872 -0.474 1.00 0.00 H new ATOM 0 HD1 TYR A 58 6.975 -4.706 0.555 1.00 0.00 H new ATOM 0 HD2 TYR A 58 3.332 -2.898 1.828 1.00 0.00 H new ATOM 0 HE1 TYR A 58 7.652 -4.996 2.898 1.00 0.00 H new ATOM 0 HE2 TYR A 58 4.009 -3.181 4.170 1.00 0.00 H new ATOM 0 HH TYR A 58 5.551 -3.911 5.575 1.00 0.00 H new ATOM 860 N SER A 59 6.104 -6.352 -1.568 1.00 0.00 N ATOM 861 CA SER A 59 7.053 -7.430 -1.317 1.00 0.00 C ATOM 862 C SER A 59 8.264 -7.313 -2.237 1.00 0.00 C ATOM 863 O SER A 59 8.133 -6.985 -3.417 1.00 0.00 O ATOM 864 CB SER A 59 6.378 -8.789 -1.513 1.00 0.00 C ATOM 865 OG SER A 59 7.336 -9.830 -1.576 1.00 0.00 O ATOM 0 H SER A 59 6.244 -5.865 -2.453 1.00 0.00 H new ATOM 0 HA SER A 59 7.394 -7.348 -0.285 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.686 -8.977 -0.692 1.00 0.00 H new ATOM 0 HB3 SER A 59 5.789 -8.777 -2.430 1.00 0.00 H new ATOM 0 HG SER A 59 6.879 -10.688 -1.700 1.00 0.00 H new ATOM 871 N THR A 60 9.445 -7.585 -1.689 1.00 0.00 N ATOM 872 CA THR A 60 10.680 -7.510 -2.459 1.00 0.00 C ATOM 873 C THR A 60 10.547 -8.249 -3.786 1.00 0.00 C ATOM 874 O THR A 60 11.129 -7.846 -4.793 1.00 0.00 O ATOM 875 CB THR A 60 11.868 -8.098 -1.674 1.00 0.00 C ATOM 876 OG1 THR A 60 11.584 -9.450 -1.295 1.00 0.00 O ATOM 877 CG2 THR A 60 12.159 -7.269 -0.432 1.00 0.00 C ATOM 0 H THR A 60 9.571 -7.859 -0.715 1.00 0.00 H new ATOM 0 HA THR A 60 10.868 -6.454 -2.652 1.00 0.00 H new ATOM 0 HB THR A 60 12.746 -8.079 -2.319 1.00 0.00 H new ATOM 0 HG1 THR A 60 12.345 -9.817 -0.798 1.00 0.00 H new ATOM 0 HG21 THR A 60 13.002 -7.703 0.106 1.00 0.00 H new ATOM 0 HG22 THR A 60 12.403 -6.248 -0.725 1.00 0.00 H new ATOM 0 HG23 THR A 60 11.281 -7.261 0.214 1.00 0.00 H new ATOM 885 N ASP A 61 9.777 -9.332 -3.780 1.00 0.00 N ATOM 886 CA ASP A 61 9.567 -10.127 -4.984 1.00 0.00 C ATOM 887 C ASP A 61 8.277 -9.716 -5.688 1.00 0.00 C ATOM 888 O ASP A 61 7.409 -9.076 -5.093 1.00 0.00 O ATOM 889 CB ASP A 61 9.520 -11.616 -4.636 1.00 0.00 C ATOM 890 CG ASP A 61 9.967 -12.494 -5.789 1.00 0.00 C ATOM 891 OD1 ASP A 61 11.185 -12.747 -5.904 1.00 0.00 O ATOM 892 OD2 ASP A 61 9.099 -12.928 -6.575 1.00 0.00 O ATOM 0 H ASP A 61 9.288 -9.679 -2.955 1.00 0.00 H new ATOM 0 HA ASP A 61 10.403 -9.946 -5.660 1.00 0.00 H new ATOM 0 HB2 ASP A 61 10.157 -11.804 -3.771 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.504 -11.887 -4.349 1.00 0.00 H new ATOM 897 N VAL A 62 8.159 -10.086 -6.959 1.00 0.00 N ATOM 898 CA VAL A 62 6.976 -9.755 -7.744 1.00 0.00 C ATOM 899 C VAL A 62 6.227 -11.014 -8.166 1.00 0.00 C ATOM 900 O VAL A 62 4.997 -11.042 -8.180 1.00 0.00 O ATOM 901 CB VAL A 62 7.345 -8.945 -9.001 1.00 0.00 C ATOM 902 CG1 VAL A 62 8.317 -9.725 -9.873 1.00 0.00 C ATOM 903 CG2 VAL A 62 6.093 -8.575 -9.783 1.00 0.00 C ATOM 0 H VAL A 62 8.868 -10.615 -7.467 1.00 0.00 H new ATOM 0 HA VAL A 62 6.332 -9.149 -7.106 1.00 0.00 H new ATOM 0 HB VAL A 62 7.835 -8.023 -8.687 1.00 0.00 H new ATOM 0 HG11 VAL A 62 8.566 -9.137 -10.756 1.00 0.00 H new ATOM 0 HG12 VAL A 62 9.225 -9.934 -9.308 1.00 0.00 H new ATOM 0 HG13 VAL A 62 7.857 -10.664 -10.180 1.00 0.00 H new ATOM 0 HG21 VAL A 62 6.372 -8.003 -10.668 1.00 0.00 H new ATOM 0 HG22 VAL A 62 5.572 -9.483 -10.087 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.436 -7.974 -9.155 1.00 0.00 H new ATOM 913 N ASN A 63 6.978 -12.055 -8.510 1.00 0.00 N ATOM 914 CA ASN A 63 6.386 -13.319 -8.934 1.00 0.00 C ATOM 915 C ASN A 63 5.882 -14.113 -7.732 1.00 0.00 C ATOM 916 O ASN A 63 5.262 -15.165 -7.886 1.00 0.00 O ATOM 917 CB ASN A 63 7.406 -14.149 -9.715 1.00 0.00 C ATOM 918 CG ASN A 63 7.907 -13.431 -10.954 1.00 0.00 C ATOM 919 OD1 ASN A 63 7.218 -13.375 -11.973 1.00 0.00 O ATOM 920 ND2 ASN A 63 9.112 -12.879 -10.872 1.00 0.00 N ATOM 0 H ASN A 63 7.998 -12.048 -8.504 1.00 0.00 H new ATOM 0 HA ASN A 63 5.539 -13.095 -9.582 1.00 0.00 H new ATOM 0 HB2 ASN A 63 8.251 -14.384 -9.068 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.953 -15.097 -10.006 1.00 0.00 H new ATOM 0 HD21 ASN A 63 9.502 -12.384 -11.674 1.00 0.00 H new ATOM 0 HD22 ASN A 63 9.648 -12.950 -10.007 1.00 0.00 H new ATOM 927 N ALA A 64 6.152 -13.601 -6.536 1.00 0.00 N ATOM 928 CA ALA A 64 5.724 -14.260 -5.308 1.00 0.00 C ATOM 929 C ALA A 64 4.203 -14.347 -5.233 1.00 0.00 C ATOM 930 O ALA A 64 3.496 -13.533 -5.826 1.00 0.00 O ATOM 931 CB ALA A 64 6.273 -13.523 -4.095 1.00 0.00 C ATOM 0 H ALA A 64 6.665 -12.732 -6.391 1.00 0.00 H new ATOM 0 HA ALA A 64 6.120 -15.276 -5.313 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.946 -14.026 -3.185 1.00 0.00 H new ATOM 0 HB2 ALA A 64 7.362 -13.517 -4.135 1.00 0.00 H new ATOM 0 HB3 ALA A 64 5.905 -12.497 -4.095 1.00 0.00 H new ATOM 937 N GLU A 65 3.707 -15.340 -4.502 1.00 0.00 N ATOM 938 CA GLU A 65 2.270 -15.533 -4.352 1.00 0.00 C ATOM 939 C GLU A 65 1.690 -14.543 -3.346 1.00 0.00 C ATOM 940 O GLU A 65 2.259 -14.323 -2.276 1.00 0.00 O ATOM 941 CB GLU A 65 1.969 -16.966 -3.905 1.00 0.00 C ATOM 942 CG GLU A 65 2.040 -17.982 -5.033 1.00 0.00 C ATOM 943 CD GLU A 65 1.307 -19.268 -4.705 1.00 0.00 C ATOM 944 OE1 GLU A 65 1.642 -19.899 -3.681 1.00 0.00 O ATOM 945 OE2 GLU A 65 0.398 -19.644 -5.474 1.00 0.00 O ATOM 0 H GLU A 65 4.279 -16.023 -4.005 1.00 0.00 H new ATOM 0 HA GLU A 65 1.803 -15.356 -5.321 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.676 -17.251 -3.126 1.00 0.00 H new ATOM 0 HB3 GLU A 65 0.974 -16.998 -3.460 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.615 -17.546 -5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 65 3.084 -18.208 -5.249 1.00 0.00 H new ATOM 952 N ILE A 66 0.555 -13.948 -3.697 1.00 0.00 N ATOM 953 CA ILE A 66 -0.103 -12.982 -2.826 1.00 0.00 C ATOM 954 C ILE A 66 0.072 -13.358 -1.358 1.00 0.00 C ATOM 955 O ILE A 66 0.142 -12.490 -0.488 1.00 0.00 O ATOM 956 CB ILE A 66 -1.606 -12.872 -3.141 1.00 0.00 C ATOM 957 CG1 ILE A 66 -2.197 -11.622 -2.484 1.00 0.00 C ATOM 958 CG2 ILE A 66 -2.339 -14.120 -2.671 1.00 0.00 C ATOM 959 CD1 ILE A 66 -1.765 -10.332 -3.144 1.00 0.00 C ATOM 0 H ILE A 66 0.072 -14.118 -4.579 1.00 0.00 H new ATOM 0 HA ILE A 66 0.369 -12.017 -3.011 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.730 -12.786 -4.220 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.285 -11.687 -2.510 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.904 -11.600 -1.434 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.400 -14.027 -2.901 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.933 -14.994 -3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.210 -14.234 -1.595 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.221 -9.488 -2.627 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.680 -10.244 -3.095 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.082 -10.333 -4.187 1.00 0.00 H new ATOM 971 N HIS A 67 0.142 -14.658 -1.090 1.00 0.00 N ATOM 972 CA HIS A 67 0.311 -15.150 0.273 1.00 0.00 C ATOM 973 C HIS A 67 1.514 -14.491 0.942 1.00 0.00 C ATOM 974 O HIS A 67 1.409 -13.967 2.052 1.00 0.00 O ATOM 975 CB HIS A 67 0.482 -16.669 0.272 1.00 0.00 C ATOM 976 CG HIS A 67 -0.335 -17.363 -0.774 1.00 0.00 C ATOM 977 ND1 HIS A 67 -1.510 -17.019 -1.352 1.00 0.00 N flip ATOM 978 CD2 HIS A 67 0.034 -18.563 -1.344 1.00 0.00 C flip ATOM 979 CE1 HIS A 67 -1.825 -18.007 -2.252 1.00 0.00 C flip ATOM 980 NE2 HIS A 67 -0.877 -18.927 -2.229 1.00 0.00 N flip ATOM 0 H HIS A 67 0.084 -15.390 -1.798 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.584 -14.894 0.840 1.00 0.00 H new ATOM 0 HB2 HIS A 67 1.534 -16.908 0.117 1.00 0.00 H new ATOM 0 HB3 HIS A 67 0.208 -17.058 1.253 1.00 0.00 H new ATOM 0 HD2 HIS A 67 0.928 -19.119 -1.104 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.705 -18.029 -2.877 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -0.853 -19.774 -2.797 1.00 0.00 H new ATOM 989 N ASP A 68 2.654 -14.523 0.262 1.00 0.00 N ATOM 990 CA ASP A 68 3.877 -13.930 0.791 1.00 0.00 C ATOM 991 C ASP A 68 3.737 -12.415 0.912 1.00 0.00 C ATOM 992 O ASP A 68 4.264 -11.806 1.844 1.00 0.00 O ATOM 993 CB ASP A 68 5.066 -14.274 -0.106 1.00 0.00 C ATOM 994 CG ASP A 68 5.453 -15.737 -0.018 1.00 0.00 C ATOM 995 OD1 ASP A 68 6.176 -16.103 0.932 1.00 0.00 O ATOM 996 OD2 ASP A 68 5.035 -16.516 -0.900 1.00 0.00 O ATOM 0 H ASP A 68 2.757 -14.953 -0.657 1.00 0.00 H new ATOM 0 HA ASP A 68 4.051 -14.342 1.785 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.821 -14.027 -1.139 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.920 -13.658 0.175 1.00 0.00 H new ATOM 1001 N TRP A 69 3.026 -11.814 -0.034 1.00 0.00 N ATOM 1002 CA TRP A 69 2.818 -10.371 -0.034 1.00 0.00 C ATOM 1003 C TRP A 69 2.223 -9.907 1.291 1.00 0.00 C ATOM 1004 O TRP A 69 1.279 -10.509 1.803 1.00 0.00 O ATOM 1005 CB TRP A 69 1.900 -9.967 -1.189 1.00 0.00 C ATOM 1006 CG TRP A 69 2.548 -10.092 -2.535 1.00 0.00 C ATOM 1007 CD1 TRP A 69 2.926 -11.248 -3.158 1.00 0.00 C ATOM 1008 CD2 TRP A 69 2.896 -9.024 -3.421 1.00 0.00 C ATOM 1009 NE1 TRP A 69 3.488 -10.961 -4.378 1.00 0.00 N ATOM 1010 CE2 TRP A 69 3.481 -9.604 -4.564 1.00 0.00 C ATOM 1011 CE3 TRP A 69 2.770 -7.633 -3.362 1.00 0.00 C ATOM 1012 CZ2 TRP A 69 3.937 -8.841 -5.636 1.00 0.00 C ATOM 1013 CZ3 TRP A 69 3.223 -6.877 -4.426 1.00 0.00 C ATOM 1014 CH2 TRP A 69 3.800 -7.482 -5.551 1.00 0.00 C ATOM 0 H TRP A 69 2.583 -12.304 -0.812 1.00 0.00 H new ATOM 0 HA TRP A 69 3.787 -9.889 -0.164 1.00 0.00 H new ATOM 0 HB2 TRP A 69 1.004 -10.588 -1.166 1.00 0.00 H new ATOM 0 HB3 TRP A 69 1.577 -8.936 -1.044 1.00 0.00 H new ATOM 0 HD1 TRP A 69 2.801 -12.241 -2.751 1.00 0.00 H new ATOM 0 HE1 TRP A 69 3.852 -11.648 -5.039 1.00 0.00 H new ATOM 0 HE3 TRP A 69 2.326 -7.158 -2.500 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 4.383 -9.305 -6.503 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 3.131 -5.802 -4.390 1.00 0.00 H new ATOM 0 HH2 TRP A 69 4.143 -6.863 -6.367 1.00 0.00 H new ATOM 1025 N VAL A 70 2.780 -8.833 1.841 1.00 0.00 N ATOM 1026 CA VAL A 70 2.303 -8.288 3.107 1.00 0.00 C ATOM 1027 C VAL A 70 1.000 -7.519 2.917 1.00 0.00 C ATOM 1028 O VAL A 70 0.750 -6.955 1.852 1.00 0.00 O ATOM 1029 CB VAL A 70 3.349 -7.355 3.746 1.00 0.00 C ATOM 1030 CG1 VAL A 70 3.422 -6.037 2.990 1.00 0.00 C ATOM 1031 CG2 VAL A 70 3.025 -7.119 5.214 1.00 0.00 C ATOM 0 H VAL A 70 3.562 -8.323 1.430 1.00 0.00 H new ATOM 0 HA VAL A 70 2.129 -9.134 3.771 1.00 0.00 H new ATOM 0 HB VAL A 70 4.325 -7.836 3.685 1.00 0.00 H new ATOM 0 HG11 VAL A 70 4.166 -5.391 3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.704 -6.227 1.954 1.00 0.00 H new ATOM 0 HG13 VAL A 70 2.448 -5.547 3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 70 3.774 -6.458 5.650 1.00 0.00 H new ATOM 0 HG22 VAL A 70 2.041 -6.659 5.300 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.028 -8.071 5.745 1.00 0.00 H new ATOM 1041 N ILE A 71 0.174 -7.500 3.958 1.00 0.00 N ATOM 1042 CA ILE A 71 -1.103 -6.799 3.906 1.00 0.00 C ATOM 1043 C ILE A 71 -1.065 -5.526 4.745 1.00 0.00 C ATOM 1044 O ILE A 71 -0.974 -5.581 5.971 1.00 0.00 O ATOM 1045 CB ILE A 71 -2.256 -7.692 4.401 1.00 0.00 C ATOM 1046 CG1 ILE A 71 -2.412 -8.912 3.491 1.00 0.00 C ATOM 1047 CG2 ILE A 71 -3.553 -6.898 4.459 1.00 0.00 C ATOM 1048 CD1 ILE A 71 -3.249 -10.016 4.099 1.00 0.00 C ATOM 0 H ILE A 71 0.366 -7.962 4.847 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.278 -6.539 2.862 1.00 0.00 H new ATOM 0 HB ILE A 71 -2.021 -8.040 5.407 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.866 -8.598 2.551 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.424 -9.306 3.252 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -4.359 -7.542 4.811 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -3.435 -6.058 5.144 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -3.795 -6.524 3.464 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.317 -10.849 3.399 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.785 -10.357 5.024 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -4.249 -9.639 4.312 1.00 0.00 H new ATOM 1060 N GLU A 72 -1.136 -4.380 4.074 1.00 0.00 N ATOM 1061 CA GLU A 72 -1.111 -3.092 4.759 1.00 0.00 C ATOM 1062 C GLU A 72 -2.491 -2.441 4.744 1.00 0.00 C ATOM 1063 O GLU A 72 -2.804 -1.609 3.893 1.00 0.00 O ATOM 1064 CB GLU A 72 -0.089 -2.161 4.103 1.00 0.00 C ATOM 1065 CG GLU A 72 1.303 -2.266 4.704 1.00 0.00 C ATOM 1066 CD GLU A 72 1.288 -2.230 6.220 1.00 0.00 C ATOM 1067 OE1 GLU A 72 0.593 -1.360 6.785 1.00 0.00 O ATOM 1068 OE2 GLU A 72 1.972 -3.071 6.840 1.00 0.00 O ATOM 0 H GLU A 72 -1.211 -4.317 3.059 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.822 -3.266 5.795 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -0.034 -2.388 3.038 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.438 -1.132 4.192 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.770 -3.193 4.371 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.919 -1.447 4.331 1.00 0.00 H new ATOM 1075 N PRO A 73 -3.338 -2.829 5.710 1.00 0.00 N ATOM 1076 CA PRO A 73 -4.699 -2.297 5.830 1.00 0.00 C ATOM 1077 C PRO A 73 -4.713 -0.836 6.269 1.00 0.00 C ATOM 1078 O PRO A 73 -4.057 -0.464 7.242 1.00 0.00 O ATOM 1079 CB PRO A 73 -5.333 -3.184 6.904 1.00 0.00 C ATOM 1080 CG PRO A 73 -4.184 -3.678 7.714 1.00 0.00 C ATOM 1081 CD PRO A 73 -3.032 -3.817 6.758 1.00 0.00 C ATOM 0 HA PRO A 73 -5.229 -2.313 4.878 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.037 -2.621 7.517 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.888 -4.010 6.459 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.943 -2.980 8.516 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.419 -4.633 8.183 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.079 -3.606 7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.966 -4.826 6.352 1.00 0.00 H new ATOM 1089 N VAL A 74 -5.464 -0.013 5.545 1.00 0.00 N ATOM 1090 CA VAL A 74 -5.565 1.407 5.861 1.00 0.00 C ATOM 1091 C VAL A 74 -6.854 1.712 6.616 1.00 0.00 C ATOM 1092 O VAL A 74 -7.924 1.214 6.266 1.00 0.00 O ATOM 1093 CB VAL A 74 -5.512 2.271 4.587 1.00 0.00 C ATOM 1094 CG1 VAL A 74 -5.655 3.745 4.934 1.00 0.00 C ATOM 1095 CG2 VAL A 74 -4.220 2.017 3.825 1.00 0.00 C ATOM 0 H VAL A 74 -6.012 -0.305 4.735 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.711 1.652 6.493 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.347 1.992 3.945 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -5.615 4.339 4.021 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -6.610 3.910 5.433 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -4.843 4.043 5.597 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -4.199 2.636 2.928 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -3.369 2.267 4.458 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -4.165 0.966 3.542 1.00 0.00 H new ATOM 1105 N VAL A 75 -6.745 2.535 7.654 1.00 0.00 N ATOM 1106 CA VAL A 75 -7.902 2.908 8.459 1.00 0.00 C ATOM 1107 C VAL A 75 -8.413 4.293 8.077 1.00 0.00 C ATOM 1108 O VAL A 75 -7.711 5.068 7.428 1.00 0.00 O ATOM 1109 CB VAL A 75 -7.569 2.893 9.962 1.00 0.00 C ATOM 1110 CG1 VAL A 75 -7.181 1.492 10.409 1.00 0.00 C ATOM 1111 CG2 VAL A 75 -6.460 3.887 10.273 1.00 0.00 C ATOM 0 H VAL A 75 -5.867 2.956 7.957 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.678 2.169 8.259 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.459 3.192 10.516 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.949 1.501 11.474 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.010 0.808 10.224 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.306 1.161 9.850 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.238 3.863 11.340 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.565 3.622 9.710 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.781 4.890 9.992 1.00 0.00 H new ATOM 1121 N GLY A 76 -9.641 4.599 8.485 1.00 0.00 N ATOM 1122 CA GLY A 76 -10.225 5.891 8.177 1.00 0.00 C ATOM 1123 C GLY A 76 -10.444 6.089 6.690 1.00 0.00 C ATOM 1124 O GLY A 76 -10.344 7.206 6.184 1.00 0.00 O ATOM 0 H GLY A 76 -10.242 3.975 9.023 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.178 5.989 8.698 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.574 6.680 8.553 1.00 0.00 H new ATOM 1128 N ASN A 77 -10.742 5.000 5.988 1.00 0.00 N ATOM 1129 CA ASN A 77 -10.973 5.059 4.549 1.00 0.00 C ATOM 1130 C ASN A 77 -10.002 6.028 3.881 1.00 0.00 C ATOM 1131 O ASN A 77 -10.391 6.815 3.018 1.00 0.00 O ATOM 1132 CB ASN A 77 -12.414 5.483 4.260 1.00 0.00 C ATOM 1133 CG ASN A 77 -12.824 6.712 5.047 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -12.304 7.806 4.826 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -13.761 6.538 5.972 1.00 0.00 N ATOM 0 H ASN A 77 -10.829 4.067 6.392 1.00 0.00 H new ATOM 0 HA ASN A 77 -10.805 4.064 4.138 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -12.524 5.684 3.194 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -13.087 4.660 4.500 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -14.077 7.329 6.533 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -14.165 5.613 6.121 1.00 0.00 H new ATOM 1142 N ARG A 78 -8.738 5.965 4.286 1.00 0.00 N ATOM 1143 CA ARG A 78 -7.712 6.837 3.728 1.00 0.00 C ATOM 1144 C ARG A 78 -7.338 6.400 2.314 1.00 0.00 C ATOM 1145 O ARG A 78 -7.395 5.215 1.984 1.00 0.00 O ATOM 1146 CB ARG A 78 -6.469 6.834 4.620 1.00 0.00 C ATOM 1147 CG ARG A 78 -5.702 8.145 4.599 1.00 0.00 C ATOM 1148 CD ARG A 78 -6.205 9.103 5.668 1.00 0.00 C ATOM 1149 NE ARG A 78 -5.303 10.235 5.857 1.00 0.00 N ATOM 1150 CZ ARG A 78 -4.089 10.128 6.387 1.00 0.00 C ATOM 1151 NH1 ARG A 78 -3.635 8.945 6.778 1.00 0.00 N ATOM 1152 NH2 ARG A 78 -3.327 11.205 6.527 1.00 0.00 N ATOM 0 H ARG A 78 -8.400 5.319 4.999 1.00 0.00 H new ATOM 0 HA ARG A 78 -8.115 7.849 3.683 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -6.768 6.614 5.645 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.806 6.030 4.302 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.641 7.949 4.755 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -5.800 8.609 3.618 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.193 9.470 5.390 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.317 8.568 6.611 1.00 0.00 H new ATOM 0 HE ARG A 78 -5.622 11.159 5.566 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -4.218 8.115 6.672 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.703 8.865 7.184 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -3.673 12.117 6.228 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -2.395 11.121 6.934 1.00 0.00 H new ATOM 1166 N LEU A 79 -6.956 7.365 1.485 1.00 0.00 N ATOM 1167 CA LEU A 79 -6.573 7.081 0.106 1.00 0.00 C ATOM 1168 C LEU A 79 -5.059 7.153 -0.064 1.00 0.00 C ATOM 1169 O LEU A 79 -4.541 7.042 -1.176 1.00 0.00 O ATOM 1170 CB LEU A 79 -7.252 8.066 -0.846 1.00 0.00 C ATOM 1171 CG LEU A 79 -8.781 8.045 -0.855 1.00 0.00 C ATOM 1172 CD1 LEU A 79 -9.328 9.308 -1.502 1.00 0.00 C ATOM 1173 CD2 LEU A 79 -9.293 6.808 -1.579 1.00 0.00 C ATOM 0 H LEU A 79 -6.903 8.350 1.743 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.900 6.069 -0.135 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.924 9.073 -0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.900 7.864 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.131 8.009 0.177 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -10.418 9.276 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.990 10.180 -0.942 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.969 9.375 -2.529 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.383 6.810 -1.576 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -8.933 6.814 -2.608 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -8.930 5.914 -1.073 1.00 0.00 H new ATOM 1185 N THR A 80 -4.352 7.338 1.047 1.00 0.00 N ATOM 1186 CA THR A 80 -2.897 7.424 1.021 1.00 0.00 C ATOM 1187 C THR A 80 -2.279 6.637 2.172 1.00 0.00 C ATOM 1188 O THR A 80 -2.878 6.508 3.240 1.00 0.00 O ATOM 1189 CB THR A 80 -2.419 8.886 1.099 1.00 0.00 C ATOM 1190 OG1 THR A 80 -0.997 8.929 1.265 1.00 0.00 O ATOM 1191 CG2 THR A 80 -3.092 9.615 2.253 1.00 0.00 C ATOM 0 H THR A 80 -4.764 7.431 1.976 1.00 0.00 H new ATOM 0 HA THR A 80 -2.572 6.993 0.074 1.00 0.00 H new ATOM 0 HB THR A 80 -2.691 9.384 0.168 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.774 8.799 2.210 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.739 10.646 2.288 1.00 0.00 H new ATOM 0 HG22 THR A 80 -4.172 9.607 2.108 1.00 0.00 H new ATOM 0 HG23 THR A 80 -2.848 9.116 3.191 1.00 0.00 H new ATOM 1199 N HIS A 81 -1.078 6.114 1.947 1.00 0.00 N ATOM 1200 CA HIS A 81 -0.379 5.340 2.967 1.00 0.00 C ATOM 1201 C HIS A 81 1.123 5.604 2.914 1.00 0.00 C ATOM 1202 O HIS A 81 1.679 5.862 1.847 1.00 0.00 O ATOM 1203 CB HIS A 81 -0.653 3.848 2.782 1.00 0.00 C ATOM 1204 CG HIS A 81 -0.405 3.036 4.016 1.00 0.00 C ATOM 1205 ND1 HIS A 81 -1.000 3.310 5.230 1.00 0.00 N ATOM 1206 CD2 HIS A 81 0.378 1.950 4.219 1.00 0.00 C ATOM 1207 CE1 HIS A 81 -0.592 2.430 6.126 1.00 0.00 C ATOM 1208 NE2 HIS A 81 0.244 1.593 5.539 1.00 0.00 N ATOM 0 H HIS A 81 -0.569 6.212 1.069 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.751 5.651 3.943 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -1.689 3.713 2.470 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -0.025 3.469 1.975 1.00 0.00 H new ATOM 0 HD2 HIS A 81 0.993 1.457 3.481 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -0.891 2.400 7.163 1.00 0.00 H new ATOM 0 HE2 HIS A 81 0.714 0.809 5.992 1.00 0.00 H new ATOM 1217 N GLN A 82 1.771 5.540 4.072 1.00 0.00 N ATOM 1218 CA GLN A 82 3.208 5.773 4.157 1.00 0.00 C ATOM 1219 C GLN A 82 3.929 4.544 4.700 1.00 0.00 C ATOM 1220 O GLN A 82 3.499 3.947 5.688 1.00 0.00 O ATOM 1221 CB GLN A 82 3.498 6.983 5.047 1.00 0.00 C ATOM 1222 CG GLN A 82 2.740 8.236 4.636 1.00 0.00 C ATOM 1223 CD GLN A 82 1.240 8.087 4.790 1.00 0.00 C ATOM 1224 OE1 GLN A 82 0.506 8.343 3.714 1.00 0.00 O flip ATOM 1225 NE2 GLN A 82 0.745 7.745 5.865 1.00 0.00 N flip ATOM 0 H GLN A 82 1.324 5.329 4.964 1.00 0.00 H new ATOM 0 HA GLN A 82 3.577 5.973 3.151 1.00 0.00 H new ATOM 0 HB2 GLN A 82 3.243 6.735 6.077 1.00 0.00 H new ATOM 0 HB3 GLN A 82 4.568 7.192 5.025 1.00 0.00 H new ATOM 0 HG2 GLN A 82 3.082 9.077 5.239 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.973 8.473 3.598 1.00 0.00 H new ATOM 0 HE21 GLN A 82 1.347 7.558 6.667 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -0.267 7.649 5.953 1.00 0.00 H new ATOM 1234 N ILE A 83 5.025 4.171 4.049 1.00 0.00 N ATOM 1235 CA ILE A 83 5.805 3.013 4.467 1.00 0.00 C ATOM 1236 C ILE A 83 7.260 3.392 4.720 1.00 0.00 C ATOM 1237 O ILE A 83 7.979 3.780 3.799 1.00 0.00 O ATOM 1238 CB ILE A 83 5.754 1.890 3.415 1.00 0.00 C ATOM 1239 CG1 ILE A 83 4.303 1.528 3.093 1.00 0.00 C ATOM 1240 CG2 ILE A 83 6.513 0.667 3.908 1.00 0.00 C ATOM 1241 CD1 ILE A 83 4.160 0.607 1.902 1.00 0.00 C ATOM 0 H ILE A 83 5.393 4.654 3.230 1.00 0.00 H new ATOM 0 HA ILE A 83 5.360 2.651 5.394 1.00 0.00 H new ATOM 0 HB ILE A 83 6.231 2.246 2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.853 1.053 3.965 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.742 2.443 2.904 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.468 -0.118 3.153 1.00 0.00 H new ATOM 0 HG22 ILE A 83 7.554 0.934 4.092 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.062 0.307 4.833 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.105 0.393 1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.580 1.087 1.018 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.692 -0.324 2.096 1.00 0.00 H new ATOM 1253 N GLN A 84 7.688 3.275 5.973 1.00 0.00 N ATOM 1254 CA GLN A 84 9.058 3.605 6.346 1.00 0.00 C ATOM 1255 C GLN A 84 9.856 2.343 6.658 1.00 0.00 C ATOM 1256 O GLN A 84 9.311 1.240 6.668 1.00 0.00 O ATOM 1257 CB GLN A 84 9.069 4.542 7.555 1.00 0.00 C ATOM 1258 CG GLN A 84 7.915 4.307 8.517 1.00 0.00 C ATOM 1259 CD GLN A 84 8.250 4.712 9.939 1.00 0.00 C ATOM 1260 OE1 GLN A 84 9.368 4.503 10.410 1.00 0.00 O ATOM 1261 NE2 GLN A 84 7.279 5.295 10.632 1.00 0.00 N ATOM 0 H GLN A 84 7.106 2.954 6.747 1.00 0.00 H new ATOM 0 HA GLN A 84 9.526 4.109 5.501 1.00 0.00 H new ATOM 0 HB2 GLN A 84 10.010 4.418 8.092 1.00 0.00 H new ATOM 0 HB3 GLN A 84 9.035 5.574 7.205 1.00 0.00 H new ATOM 0 HG2 GLN A 84 7.044 4.869 8.179 1.00 0.00 H new ATOM 0 HG3 GLN A 84 7.640 3.252 8.499 1.00 0.00 H new ATOM 0 HE21 GLN A 84 6.367 5.449 10.202 1.00 0.00 H new ATOM 0 HE22 GLN A 84 7.445 5.589 11.594 1.00 0.00 H new ATOM 1270 N GLU A 85 11.149 2.515 6.913 1.00 0.00 N ATOM 1271 CA GLU A 85 12.022 1.389 7.225 1.00 0.00 C ATOM 1272 C GLU A 85 12.078 0.405 6.059 1.00 0.00 C ATOM 1273 O GLU A 85 11.931 -0.803 6.244 1.00 0.00 O ATOM 1274 CB GLU A 85 11.536 0.673 8.487 1.00 0.00 C ATOM 1275 CG GLU A 85 11.224 1.614 9.639 1.00 0.00 C ATOM 1276 CD GLU A 85 10.733 0.883 10.873 1.00 0.00 C ATOM 1277 OE1 GLU A 85 11.580 0.376 11.638 1.00 0.00 O ATOM 1278 OE2 GLU A 85 9.503 0.817 11.074 1.00 0.00 O ATOM 0 H GLU A 85 11.615 3.422 6.910 1.00 0.00 H new ATOM 0 HA GLU A 85 13.025 1.777 7.399 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.642 0.098 8.247 1.00 0.00 H new ATOM 0 HB3 GLU A 85 12.297 -0.039 8.806 1.00 0.00 H new ATOM 0 HG2 GLU A 85 12.119 2.183 9.891 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.468 2.332 9.322 1.00 0.00 H new ATOM 1285 N LEU A 86 12.292 0.932 4.859 1.00 0.00 N ATOM 1286 CA LEU A 86 12.368 0.102 3.661 1.00 0.00 C ATOM 1287 C LEU A 86 13.807 -0.013 3.169 1.00 0.00 C ATOM 1288 O LEU A 86 14.723 0.565 3.753 1.00 0.00 O ATOM 1289 CB LEU A 86 11.483 0.684 2.557 1.00 0.00 C ATOM 1290 CG LEU A 86 9.976 0.633 2.808 1.00 0.00 C ATOM 1291 CD1 LEU A 86 9.224 1.332 1.686 1.00 0.00 C ATOM 1292 CD2 LEU A 86 9.507 -0.808 2.949 1.00 0.00 C ATOM 0 H LEU A 86 12.416 1.930 4.689 1.00 0.00 H new ATOM 0 HA LEU A 86 12.011 -0.896 3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 86 11.770 1.724 2.399 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.695 0.151 1.630 1.00 0.00 H new ATOM 0 HG LEU A 86 9.765 1.156 3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 86 8.153 1.286 1.882 1.00 0.00 H new ATOM 0 HD12 LEU A 86 9.538 2.374 1.632 1.00 0.00 H new ATOM 0 HD13 LEU A 86 9.441 0.838 0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.432 -0.825 3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 86 9.732 -1.355 2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 86 10.021 -1.278 3.788 1.00 0.00 H new ATOM 1304 N THR A 87 13.998 -0.762 2.087 1.00 0.00 N ATOM 1305 CA THR A 87 15.325 -0.952 1.514 1.00 0.00 C ATOM 1306 C THR A 87 15.582 0.036 0.382 1.00 0.00 C ATOM 1307 O THR A 87 14.659 0.435 -0.329 1.00 0.00 O ATOM 1308 CB THR A 87 15.506 -2.386 0.981 1.00 0.00 C ATOM 1309 OG1 THR A 87 15.177 -3.334 2.002 1.00 0.00 O ATOM 1310 CG2 THR A 87 16.936 -2.612 0.513 1.00 0.00 C ATOM 0 H THR A 87 13.251 -1.247 1.590 1.00 0.00 H new ATOM 0 HA THR A 87 16.043 -0.777 2.315 1.00 0.00 H new ATOM 0 HB THR A 87 14.836 -2.522 0.132 1.00 0.00 H new ATOM 0 HG1 THR A 87 14.359 -3.813 1.753 1.00 0.00 H new ATOM 0 HG21 THR A 87 17.040 -3.631 0.141 1.00 0.00 H new ATOM 0 HG22 THR A 87 17.173 -1.908 -0.285 1.00 0.00 H new ATOM 0 HG23 THR A 87 17.620 -2.459 1.347 1.00 0.00 H new ATOM 1318 N LEU A 88 16.841 0.427 0.219 1.00 0.00 N ATOM 1319 CA LEU A 88 17.220 1.369 -0.829 1.00 0.00 C ATOM 1320 C LEU A 88 17.769 0.635 -2.048 1.00 0.00 C ATOM 1321 O LEU A 88 18.044 -0.564 -1.991 1.00 0.00 O ATOM 1322 CB LEU A 88 18.262 2.357 -0.301 1.00 0.00 C ATOM 1323 CG LEU A 88 17.853 3.171 0.927 1.00 0.00 C ATOM 1324 CD1 LEU A 88 19.050 3.916 1.496 1.00 0.00 C ATOM 1325 CD2 LEU A 88 16.736 4.143 0.574 1.00 0.00 C ATOM 0 H LEU A 88 17.617 0.107 0.799 1.00 0.00 H new ATOM 0 HA LEU A 88 16.328 1.918 -1.130 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.169 1.803 -0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 88 18.516 3.050 -1.103 1.00 0.00 H new ATOM 0 HG LEU A 88 17.483 2.484 1.688 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.740 4.490 2.369 1.00 0.00 H new ATOM 0 HD12 LEU A 88 19.819 3.201 1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 88 19.450 4.592 0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 88 16.457 4.714 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 88 17.079 4.825 -0.204 1.00 0.00 H new ATOM 0 HD23 LEU A 88 15.870 3.587 0.213 1.00 0.00 H new ATOM 1337 N ASP A 89 17.930 1.363 -3.147 1.00 0.00 N ATOM 1338 CA ASP A 89 18.450 0.782 -4.380 1.00 0.00 C ATOM 1339 C ASP A 89 17.890 -0.620 -4.599 1.00 0.00 C ATOM 1340 O ASP A 89 18.630 -1.556 -4.901 1.00 0.00 O ATOM 1341 CB ASP A 89 19.978 0.734 -4.340 1.00 0.00 C ATOM 1342 CG ASP A 89 20.573 0.175 -5.618 1.00 0.00 C ATOM 1343 OD1 ASP A 89 20.282 0.729 -6.699 1.00 0.00 O ATOM 1344 OD2 ASP A 89 21.330 -0.814 -5.536 1.00 0.00 O ATOM 0 H ASP A 89 17.708 2.357 -3.210 1.00 0.00 H new ATOM 0 HA ASP A 89 18.135 1.413 -5.211 1.00 0.00 H new ATOM 0 HB2 ASP A 89 20.366 1.739 -4.171 1.00 0.00 H new ATOM 0 HB3 ASP A 89 20.298 0.123 -3.496 1.00 0.00 H new ATOM 1349 N THR A 90 16.577 -0.758 -4.443 1.00 0.00 N ATOM 1350 CA THR A 90 15.917 -2.045 -4.621 1.00 0.00 C ATOM 1351 C THR A 90 14.526 -1.872 -5.221 1.00 0.00 C ATOM 1352 O THR A 90 13.716 -1.075 -4.749 1.00 0.00 O ATOM 1353 CB THR A 90 15.798 -2.805 -3.287 1.00 0.00 C ATOM 1354 OG1 THR A 90 17.093 -2.968 -2.698 1.00 0.00 O ATOM 1355 CG2 THR A 90 15.155 -4.168 -3.495 1.00 0.00 C ATOM 0 H THR A 90 15.950 0.007 -4.194 1.00 0.00 H new ATOM 0 HA THR A 90 16.535 -2.625 -5.306 1.00 0.00 H new ATOM 0 HB THR A 90 15.166 -2.221 -2.618 1.00 0.00 H new ATOM 0 HG1 THR A 90 17.440 -2.093 -2.424 1.00 0.00 H new ATOM 0 HG21 THR A 90 15.082 -4.686 -2.539 1.00 0.00 H new ATOM 0 HG22 THR A 90 14.157 -4.039 -3.915 1.00 0.00 H new ATOM 0 HG23 THR A 90 15.764 -4.757 -4.181 1.00 0.00 H new ATOM 1363 N PRO A 91 14.241 -2.636 -6.286 1.00 0.00 N ATOM 1364 CA PRO A 91 12.947 -2.586 -6.972 1.00 0.00 C ATOM 1365 C PRO A 91 11.820 -3.170 -6.127 1.00 0.00 C ATOM 1366 O PRO A 91 11.746 -4.383 -5.927 1.00 0.00 O ATOM 1367 CB PRO A 91 13.175 -3.438 -8.223 1.00 0.00 C ATOM 1368 CG PRO A 91 14.276 -4.370 -7.851 1.00 0.00 C ATOM 1369 CD PRO A 91 15.160 -3.608 -6.901 1.00 0.00 C ATOM 0 HA PRO A 91 12.639 -1.563 -7.187 1.00 0.00 H new ATOM 0 HB2 PRO A 91 12.273 -3.982 -8.501 1.00 0.00 H new ATOM 0 HB3 PRO A 91 13.451 -2.820 -9.078 1.00 0.00 H new ATOM 0 HG2 PRO A 91 13.882 -5.271 -7.380 1.00 0.00 H new ATOM 0 HG3 PRO A 91 14.833 -4.688 -8.732 1.00 0.00 H new ATOM 0 HD2 PRO A 91 15.609 -4.264 -6.155 1.00 0.00 H new ATOM 0 HD3 PRO A 91 15.978 -3.113 -7.423 1.00 0.00 H new ATOM 1377 N TYR A 92 10.944 -2.302 -5.635 1.00 0.00 N ATOM 1378 CA TYR A 92 9.821 -2.732 -4.811 1.00 0.00 C ATOM 1379 C TYR A 92 8.501 -2.566 -5.557 1.00 0.00 C ATOM 1380 O TYR A 92 8.224 -1.509 -6.124 1.00 0.00 O ATOM 1381 CB TYR A 92 9.785 -1.935 -3.505 1.00 0.00 C ATOM 1382 CG TYR A 92 10.565 -2.579 -2.381 1.00 0.00 C ATOM 1383 CD1 TYR A 92 11.954 -2.602 -2.398 1.00 0.00 C ATOM 1384 CD2 TYR A 92 9.913 -3.163 -1.302 1.00 0.00 C ATOM 1385 CE1 TYR A 92 12.671 -3.190 -1.373 1.00 0.00 C ATOM 1386 CE2 TYR A 92 10.621 -3.751 -0.273 1.00 0.00 C ATOM 1387 CZ TYR A 92 12.000 -3.763 -0.313 1.00 0.00 C ATOM 1388 OH TYR A 92 12.710 -4.348 0.710 1.00 0.00 O ATOM 0 H TYR A 92 10.990 -1.295 -5.793 1.00 0.00 H new ATOM 0 HA TYR A 92 9.957 -3.789 -4.581 1.00 0.00 H new ATOM 0 HB2 TYR A 92 10.183 -0.937 -3.687 1.00 0.00 H new ATOM 0 HB3 TYR A 92 8.748 -1.812 -3.193 1.00 0.00 H new ATOM 0 HD1 TYR A 92 12.482 -2.153 -3.226 1.00 0.00 H new ATOM 0 HD2 TYR A 92 8.834 -3.157 -1.268 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.751 -3.201 -1.402 1.00 0.00 H new ATOM 0 HE2 TYR A 92 10.098 -4.199 0.559 1.00 0.00 H new ATOM 0 HH TYR A 92 12.088 -4.703 1.379 1.00 0.00 H new ATOM 1398 N TYR A 93 7.690 -3.618 -5.553 1.00 0.00 N ATOM 1399 CA TYR A 93 6.400 -3.592 -6.231 1.00 0.00 C ATOM 1400 C TYR A 93 5.265 -3.373 -5.235 1.00 0.00 C ATOM 1401 O TYR A 93 5.121 -4.120 -4.266 1.00 0.00 O ATOM 1402 CB TYR A 93 6.176 -4.896 -6.997 1.00 0.00 C ATOM 1403 CG TYR A 93 7.403 -5.386 -7.732 1.00 0.00 C ATOM 1404 CD1 TYR A 93 8.354 -6.171 -7.091 1.00 0.00 C ATOM 1405 CD2 TYR A 93 7.613 -5.064 -9.067 1.00 0.00 C ATOM 1406 CE1 TYR A 93 9.477 -6.620 -7.758 1.00 0.00 C ATOM 1407 CE2 TYR A 93 8.733 -5.509 -9.742 1.00 0.00 C ATOM 1408 CZ TYR A 93 9.662 -6.286 -9.083 1.00 0.00 C ATOM 1409 OH TYR A 93 10.779 -6.732 -9.752 1.00 0.00 O ATOM 0 H TYR A 93 7.904 -4.500 -5.087 1.00 0.00 H new ATOM 0 HA TYR A 93 6.406 -2.761 -6.936 1.00 0.00 H new ATOM 0 HB2 TYR A 93 5.850 -5.666 -6.298 1.00 0.00 H new ATOM 0 HB3 TYR A 93 5.367 -4.752 -7.713 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.212 -6.435 -6.053 1.00 0.00 H new ATOM 0 HD2 TYR A 93 6.888 -4.455 -9.586 1.00 0.00 H new ATOM 0 HE1 TYR A 93 10.206 -7.229 -7.245 1.00 0.00 H new ATOM 0 HE2 TYR A 93 8.880 -5.250 -10.780 1.00 0.00 H new ATOM 0 HH TYR A 93 10.757 -6.409 -10.677 1.00 0.00 H new ATOM 1419 N PHE A 94 4.462 -2.343 -5.480 1.00 0.00 N ATOM 1420 CA PHE A 94 3.339 -2.024 -4.605 1.00 0.00 C ATOM 1421 C PHE A 94 2.011 -2.230 -5.327 1.00 0.00 C ATOM 1422 O PHE A 94 1.930 -2.108 -6.550 1.00 0.00 O ATOM 1423 CB PHE A 94 3.445 -0.580 -4.111 1.00 0.00 C ATOM 1424 CG PHE A 94 4.777 -0.252 -3.498 1.00 0.00 C ATOM 1425 CD1 PHE A 94 5.047 -0.580 -2.179 1.00 0.00 C ATOM 1426 CD2 PHE A 94 5.759 0.383 -4.241 1.00 0.00 C ATOM 1427 CE1 PHE A 94 6.271 -0.278 -1.613 1.00 0.00 C ATOM 1428 CE2 PHE A 94 6.985 0.686 -3.681 1.00 0.00 C ATOM 1429 CZ PHE A 94 7.241 0.354 -2.365 1.00 0.00 C ATOM 0 H PHE A 94 4.568 -1.715 -6.277 1.00 0.00 H new ATOM 0 HA PHE A 94 3.375 -2.698 -3.749 1.00 0.00 H new ATOM 0 HB2 PHE A 94 3.262 0.096 -4.947 1.00 0.00 H new ATOM 0 HB3 PHE A 94 2.661 -0.397 -3.376 1.00 0.00 H new ATOM 0 HD1 PHE A 94 4.293 -1.077 -1.587 1.00 0.00 H new ATOM 0 HD2 PHE A 94 5.564 0.644 -5.271 1.00 0.00 H new ATOM 0 HE1 PHE A 94 6.469 -0.536 -0.583 1.00 0.00 H new ATOM 0 HE2 PHE A 94 7.742 1.181 -4.271 1.00 0.00 H new ATOM 0 HZ PHE A 94 8.199 0.589 -1.925 1.00 0.00 H new ATOM 1439 N LYS A 95 0.971 -2.545 -4.563 1.00 0.00 N ATOM 1440 CA LYS A 95 -0.354 -2.769 -5.127 1.00 0.00 C ATOM 1441 C LYS A 95 -1.434 -2.162 -4.236 1.00 0.00 C ATOM 1442 O LYS A 95 -1.354 -2.238 -3.009 1.00 0.00 O ATOM 1443 CB LYS A 95 -0.609 -4.267 -5.307 1.00 0.00 C ATOM 1444 CG LYS A 95 0.305 -4.921 -6.328 1.00 0.00 C ATOM 1445 CD LYS A 95 -0.195 -6.301 -6.722 1.00 0.00 C ATOM 1446 CE LYS A 95 0.341 -7.375 -5.788 1.00 0.00 C ATOM 1447 NZ LYS A 95 -0.167 -8.727 -6.148 1.00 0.00 N ATOM 0 H LYS A 95 1.021 -2.651 -3.550 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.394 -2.281 -6.101 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -0.483 -4.766 -4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -1.645 -4.417 -5.611 1.00 0.00 H new ATOM 0 HG2 LYS A 95 0.372 -4.290 -7.215 1.00 0.00 H new ATOM 0 HG3 LYS A 95 1.312 -5.001 -5.918 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -1.285 -6.313 -6.705 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.110 -6.521 -7.745 1.00 0.00 H new ATOM 0 HE2 LYS A 95 1.430 -7.375 -5.822 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.055 -7.141 -4.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.221 -9.431 -5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -1.205 -8.734 -6.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 0.128 -8.962 -7.117 1.00 0.00 H new ATOM 1461 N ILE A 96 -2.442 -1.563 -4.860 1.00 0.00 N ATOM 1462 CA ILE A 96 -3.538 -0.946 -4.124 1.00 0.00 C ATOM 1463 C ILE A 96 -4.874 -1.584 -4.490 1.00 0.00 C ATOM 1464 O ILE A 96 -5.114 -1.920 -5.649 1.00 0.00 O ATOM 1465 CB ILE A 96 -3.615 0.568 -4.390 1.00 0.00 C ATOM 1466 CG1 ILE A 96 -2.240 1.212 -4.197 1.00 0.00 C ATOM 1467 CG2 ILE A 96 -4.642 1.216 -3.475 1.00 0.00 C ATOM 1468 CD1 ILE A 96 -2.015 2.429 -5.067 1.00 0.00 C ATOM 0 H ILE A 96 -2.522 -1.492 -5.874 1.00 0.00 H new ATOM 0 HA ILE A 96 -3.337 -1.110 -3.065 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.928 0.725 -5.422 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -2.125 1.497 -3.151 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.468 0.473 -4.413 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.684 2.287 -3.676 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.622 0.774 -3.657 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.358 1.053 -2.436 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.021 2.833 -4.877 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.098 2.146 -6.116 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.764 3.186 -4.835 1.00 0.00 H new ATOM 1480 N GLN A 97 -5.740 -1.744 -3.495 1.00 0.00 N ATOM 1481 CA GLN A 97 -7.053 -2.340 -3.714 1.00 0.00 C ATOM 1482 C GLN A 97 -8.128 -1.589 -2.935 1.00 0.00 C ATOM 1483 O GLN A 97 -7.824 -0.734 -2.104 1.00 0.00 O ATOM 1484 CB GLN A 97 -7.043 -3.813 -3.301 1.00 0.00 C ATOM 1485 CG GLN A 97 -7.458 -4.043 -1.857 1.00 0.00 C ATOM 1486 CD GLN A 97 -7.598 -5.514 -1.517 1.00 0.00 C ATOM 1487 OE1 GLN A 97 -7.101 -5.975 -0.489 1.00 0.00 O ATOM 1488 NE2 GLN A 97 -8.277 -6.259 -2.381 1.00 0.00 N ATOM 0 H GLN A 97 -5.557 -1.470 -2.530 1.00 0.00 H new ATOM 0 HA GLN A 97 -7.284 -2.269 -4.777 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.713 -4.370 -3.956 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.042 -4.217 -3.451 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -6.721 -3.589 -1.194 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -8.406 -3.539 -1.671 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.672 -5.835 -3.220 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.404 -7.256 -2.205 1.00 0.00 H new ATOM 1497 N ALA A 98 -9.387 -1.914 -3.211 1.00 0.00 N ATOM 1498 CA ALA A 98 -10.507 -1.271 -2.536 1.00 0.00 C ATOM 1499 C ALA A 98 -11.432 -2.304 -1.902 1.00 0.00 C ATOM 1500 O ALA A 98 -11.901 -3.225 -2.572 1.00 0.00 O ATOM 1501 CB ALA A 98 -11.280 -0.396 -3.512 1.00 0.00 C ATOM 0 H ALA A 98 -9.656 -2.619 -3.897 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.107 -0.643 -1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.114 0.078 -2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.619 0.372 -3.914 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.662 -1.010 -4.328 1.00 0.00 H new ATOM 1507 N ARG A 99 -11.691 -2.146 -0.608 1.00 0.00 N ATOM 1508 CA ARG A 99 -12.559 -3.067 0.116 1.00 0.00 C ATOM 1509 C ARG A 99 -13.699 -2.317 0.798 1.00 0.00 C ATOM 1510 O ARG A 99 -13.519 -1.200 1.280 1.00 0.00 O ATOM 1511 CB ARG A 99 -11.754 -3.848 1.156 1.00 0.00 C ATOM 1512 CG ARG A 99 -12.564 -4.246 2.379 1.00 0.00 C ATOM 1513 CD ARG A 99 -11.692 -4.912 3.433 1.00 0.00 C ATOM 1514 NE ARG A 99 -12.486 -5.602 4.445 1.00 0.00 N ATOM 1515 CZ ARG A 99 -13.133 -4.978 5.423 1.00 0.00 C ATOM 1516 NH1 ARG A 99 -13.080 -3.657 5.520 1.00 0.00 N ATOM 1517 NH2 ARG A 99 -13.836 -5.676 6.306 1.00 0.00 N ATOM 0 H ARG A 99 -11.312 -1.389 -0.039 1.00 0.00 H new ATOM 0 HA ARG A 99 -12.986 -3.766 -0.603 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -11.350 -4.747 0.690 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -10.904 -3.244 1.474 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -13.040 -3.363 2.804 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -13.362 -4.927 2.082 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.021 -5.624 2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.067 -4.160 3.914 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.547 -6.619 4.399 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.541 -3.117 4.843 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.578 -3.180 6.272 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -13.880 -6.693 6.234 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -14.332 -5.196 7.057 1.00 0.00 H new ATOM 1531 N ASN A 100 -14.873 -2.940 0.833 1.00 0.00 N ATOM 1532 CA ASN A 100 -16.043 -2.331 1.454 1.00 0.00 C ATOM 1533 C ASN A 100 -16.659 -3.268 2.489 1.00 0.00 C ATOM 1534 O ASN A 100 -16.141 -4.355 2.743 1.00 0.00 O ATOM 1535 CB ASN A 100 -17.083 -1.973 0.391 1.00 0.00 C ATOM 1536 CG ASN A 100 -17.506 -3.174 -0.432 1.00 0.00 C ATOM 1537 OD1 ASN A 100 -17.034 -4.290 -0.210 1.00 0.00 O ATOM 1538 ND2 ASN A 100 -18.401 -2.952 -1.387 1.00 0.00 N ATOM 0 H ASN A 100 -15.039 -3.866 0.439 1.00 0.00 H new ATOM 0 HA ASN A 100 -15.722 -1.420 1.959 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -17.959 -1.541 0.875 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -16.674 -1.209 -0.270 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -18.724 -3.722 -1.972 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -18.765 -2.011 -1.536 1.00 0.00 H new ATOM 1545 N SER A 101 -17.768 -2.838 3.082 1.00 0.00 N ATOM 1546 CA SER A 101 -18.454 -3.636 4.092 1.00 0.00 C ATOM 1547 C SER A 101 -18.424 -5.117 3.725 1.00 0.00 C ATOM 1548 O SER A 101 -18.223 -5.977 4.582 1.00 0.00 O ATOM 1549 CB SER A 101 -19.901 -3.166 4.248 1.00 0.00 C ATOM 1550 OG SER A 101 -20.653 -4.081 5.027 1.00 0.00 O ATOM 0 H SER A 101 -18.211 -1.941 2.881 1.00 0.00 H new ATOM 0 HA SER A 101 -17.933 -3.504 5.040 1.00 0.00 H new ATOM 0 HB2 SER A 101 -19.919 -2.183 4.718 1.00 0.00 H new ATOM 0 HB3 SER A 101 -20.360 -3.058 3.265 1.00 0.00 H new ATOM 0 HG SER A 101 -21.574 -3.757 5.113 1.00 0.00 H new ATOM 1556 N LYS A 102 -18.627 -5.407 2.444 1.00 0.00 N ATOM 1557 CA LYS A 102 -18.623 -6.782 1.961 1.00 0.00 C ATOM 1558 C LYS A 102 -17.225 -7.386 2.050 1.00 0.00 C ATOM 1559 O LYS A 102 -16.955 -8.227 2.906 1.00 0.00 O ATOM 1560 CB LYS A 102 -19.123 -6.838 0.515 1.00 0.00 C ATOM 1561 CG LYS A 102 -20.610 -6.562 0.375 1.00 0.00 C ATOM 1562 CD LYS A 102 -21.442 -7.767 0.782 1.00 0.00 C ATOM 1563 CE LYS A 102 -21.559 -8.772 -0.354 1.00 0.00 C ATOM 1564 NZ LYS A 102 -22.071 -10.088 0.120 1.00 0.00 N ATOM 0 H LYS A 102 -18.796 -4.707 1.722 1.00 0.00 H new ATOM 0 HA LYS A 102 -19.293 -7.365 2.594 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -18.570 -6.112 -0.080 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.904 -7.822 0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -20.882 -5.706 0.993 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -20.836 -6.295 -0.657 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -20.989 -8.247 1.649 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -22.437 -7.439 1.083 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -22.226 -8.378 -1.121 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -20.583 -8.908 -0.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -22.136 -10.745 -0.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -21.421 -10.477 0.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -23.013 -9.962 0.542 1.00 0.00 H new ATOM 1578 N GLY A 103 -16.339 -6.951 1.159 1.00 0.00 N ATOM 1579 CA GLY A 103 -14.980 -7.459 1.156 1.00 0.00 C ATOM 1580 C GLY A 103 -14.061 -6.651 0.261 1.00 0.00 C ATOM 1581 O GLY A 103 -14.256 -5.449 0.084 1.00 0.00 O ATOM 0 H GLY A 103 -16.538 -6.256 0.440 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -14.590 -7.451 2.174 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -14.984 -8.497 0.825 1.00 0.00 H new ATOM 1585 N MET A 104 -13.056 -7.312 -0.303 1.00 0.00 N ATOM 1586 CA MET A 104 -12.103 -6.647 -1.185 1.00 0.00 C ATOM 1587 C MET A 104 -12.313 -7.074 -2.634 1.00 0.00 C ATOM 1588 O MET A 104 -13.092 -7.983 -2.916 1.00 0.00 O ATOM 1589 CB MET A 104 -10.670 -6.960 -0.751 1.00 0.00 C ATOM 1590 CG MET A 104 -10.532 -7.238 0.737 1.00 0.00 C ATOM 1591 SD MET A 104 -10.730 -8.984 1.139 1.00 0.00 S ATOM 1592 CE MET A 104 -9.056 -9.417 1.604 1.00 0.00 C ATOM 0 H MET A 104 -12.880 -8.307 -0.165 1.00 0.00 H new ATOM 0 HA MET A 104 -12.270 -5.572 -1.114 1.00 0.00 H new ATOM 0 HB2 MET A 104 -10.311 -7.825 -1.309 1.00 0.00 H new ATOM 0 HB3 MET A 104 -10.027 -6.121 -1.016 1.00 0.00 H new ATOM 0 HG2 MET A 104 -9.553 -6.900 1.076 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.276 -6.657 1.282 1.00 0.00 H new ATOM 0 HE1 MET A 104 -9.016 -10.471 1.880 1.00 0.00 H new ATOM 0 HE2 MET A 104 -8.387 -9.237 0.763 1.00 0.00 H new ATOM 0 HE3 MET A 104 -8.745 -8.807 2.452 1.00 0.00 H new ATOM 1602 N GLY A 105 -11.612 -6.412 -3.549 1.00 0.00 N ATOM 1603 CA GLY A 105 -11.737 -6.737 -4.958 1.00 0.00 C ATOM 1604 C GLY A 105 -10.406 -7.092 -5.591 1.00 0.00 C ATOM 1605 O GLY A 105 -9.441 -7.436 -4.907 1.00 0.00 O ATOM 0 H GLY A 105 -10.960 -5.656 -3.340 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -12.426 -7.573 -5.075 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -12.172 -5.889 -5.486 1.00 0.00 H new ATOM 1609 N PRO A 106 -10.342 -7.012 -6.928 1.00 0.00 N ATOM 1610 CA PRO A 106 -9.125 -7.325 -7.683 1.00 0.00 C ATOM 1611 C PRO A 106 -8.028 -6.287 -7.470 1.00 0.00 C ATOM 1612 O PRO A 106 -8.305 -5.094 -7.354 1.00 0.00 O ATOM 1613 CB PRO A 106 -9.597 -7.314 -9.139 1.00 0.00 C ATOM 1614 CG PRO A 106 -10.790 -6.421 -9.143 1.00 0.00 C ATOM 1615 CD PRO A 106 -11.453 -6.609 -7.807 1.00 0.00 C ATOM 0 HA PRO A 106 -8.684 -8.272 -7.371 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -8.819 -6.939 -9.805 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -9.852 -8.317 -9.480 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -10.498 -5.381 -9.291 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -11.469 -6.680 -9.955 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -11.926 -5.690 -7.461 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -12.230 -7.372 -7.848 1.00 0.00 H new ATOM 1623 N MET A 107 -6.783 -6.750 -7.422 1.00 0.00 N ATOM 1624 CA MET A 107 -5.645 -5.860 -7.225 1.00 0.00 C ATOM 1625 C MET A 107 -5.168 -5.286 -8.555 1.00 0.00 C ATOM 1626 O MET A 107 -5.280 -5.931 -9.597 1.00 0.00 O ATOM 1627 CB MET A 107 -4.499 -6.607 -6.538 1.00 0.00 C ATOM 1628 CG MET A 107 -4.765 -6.912 -5.073 1.00 0.00 C ATOM 1629 SD MET A 107 -3.918 -8.400 -4.509 1.00 0.00 S ATOM 1630 CE MET A 107 -5.152 -9.097 -3.414 1.00 0.00 C ATOM 0 H MET A 107 -6.537 -7.735 -7.517 1.00 0.00 H new ATOM 0 HA MET A 107 -5.966 -5.036 -6.588 1.00 0.00 H new ATOM 0 HB2 MET A 107 -4.316 -7.542 -7.068 1.00 0.00 H new ATOM 0 HB3 MET A 107 -3.589 -6.012 -6.618 1.00 0.00 H new ATOM 0 HG2 MET A 107 -4.446 -6.065 -4.466 1.00 0.00 H new ATOM 0 HG3 MET A 107 -5.838 -7.029 -4.919 1.00 0.00 H new ATOM 0 HE1 MET A 107 -4.662 -9.701 -2.650 1.00 0.00 H new ATOM 0 HE2 MET A 107 -5.711 -8.292 -2.937 1.00 0.00 H new ATOM 0 HE3 MET A 107 -5.836 -9.723 -3.988 1.00 0.00 H new ATOM 1640 N SER A 108 -4.635 -4.068 -8.512 1.00 0.00 N ATOM 1641 CA SER A 108 -4.145 -3.405 -9.715 1.00 0.00 C ATOM 1642 C SER A 108 -2.795 -3.977 -10.138 1.00 0.00 C ATOM 1643 O SER A 108 -2.170 -4.734 -9.396 1.00 0.00 O ATOM 1644 CB SER A 108 -4.022 -1.899 -9.478 1.00 0.00 C ATOM 1645 OG SER A 108 -3.342 -1.627 -8.265 1.00 0.00 O ATOM 0 H SER A 108 -4.532 -3.521 -7.657 1.00 0.00 H new ATOM 0 HA SER A 108 -4.862 -3.582 -10.516 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.487 -1.439 -10.309 1.00 0.00 H new ATOM 0 HB3 SER A 108 -5.015 -1.450 -9.451 1.00 0.00 H new ATOM 0 HG SER A 108 -3.985 -1.613 -7.526 1.00 0.00 H new ATOM 1651 N GLU A 109 -2.353 -3.607 -11.336 1.00 0.00 N ATOM 1652 CA GLU A 109 -1.078 -4.084 -11.859 1.00 0.00 C ATOM 1653 C GLU A 109 0.065 -3.732 -10.910 1.00 0.00 C ATOM 1654 O GLU A 109 0.033 -2.701 -10.239 1.00 0.00 O ATOM 1655 CB GLU A 109 -0.812 -3.484 -13.241 1.00 0.00 C ATOM 1656 CG GLU A 109 -0.405 -2.020 -13.201 1.00 0.00 C ATOM 1657 CD GLU A 109 -1.592 -1.082 -13.300 1.00 0.00 C ATOM 1658 OE1 GLU A 109 -2.535 -1.397 -14.056 1.00 0.00 O ATOM 1659 OE2 GLU A 109 -1.578 -0.033 -12.623 1.00 0.00 O ATOM 0 H GLU A 109 -2.858 -2.979 -11.962 1.00 0.00 H new ATOM 0 HA GLU A 109 -1.133 -5.169 -11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -0.026 -4.058 -13.732 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -1.709 -3.586 -13.851 1.00 0.00 H new ATOM 0 HG2 GLU A 109 0.134 -1.822 -12.274 1.00 0.00 H new ATOM 0 HG3 GLU A 109 0.284 -1.816 -14.020 1.00 0.00 H new ATOM 1666 N ALA A 110 1.073 -4.596 -10.862 1.00 0.00 N ATOM 1667 CA ALA A 110 2.227 -4.376 -9.998 1.00 0.00 C ATOM 1668 C ALA A 110 2.940 -3.076 -10.354 1.00 0.00 C ATOM 1669 O ALA A 110 3.499 -2.942 -11.443 1.00 0.00 O ATOM 1670 CB ALA A 110 3.188 -5.551 -10.092 1.00 0.00 C ATOM 0 H ALA A 110 1.114 -5.455 -11.411 1.00 0.00 H new ATOM 0 HA ALA A 110 1.871 -4.294 -8.971 1.00 0.00 H new ATOM 0 HB1 ALA A 110 4.045 -5.373 -9.442 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.679 -6.463 -9.780 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.530 -5.660 -11.121 1.00 0.00 H new ATOM 1676 N VAL A 111 2.916 -2.121 -9.431 1.00 0.00 N ATOM 1677 CA VAL A 111 3.560 -0.831 -9.648 1.00 0.00 C ATOM 1678 C VAL A 111 5.037 -0.885 -9.271 1.00 0.00 C ATOM 1679 O VAL A 111 5.385 -0.903 -8.091 1.00 0.00 O ATOM 1680 CB VAL A 111 2.875 0.283 -8.835 1.00 0.00 C ATOM 1681 CG1 VAL A 111 3.550 1.622 -9.088 1.00 0.00 C ATOM 1682 CG2 VAL A 111 1.393 0.352 -9.171 1.00 0.00 C ATOM 0 H VAL A 111 2.457 -2.216 -8.525 1.00 0.00 H new ATOM 0 HA VAL A 111 3.466 -0.605 -10.710 1.00 0.00 H new ATOM 0 HB VAL A 111 2.974 0.049 -7.775 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.052 2.397 -8.505 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.598 1.563 -8.793 1.00 0.00 H new ATOM 0 HG13 VAL A 111 3.485 1.868 -10.148 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.924 1.144 -8.588 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.270 0.562 -10.233 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.921 -0.601 -8.933 1.00 0.00 H new ATOM 1692 N GLN A 112 5.899 -0.909 -10.282 1.00 0.00 N ATOM 1693 CA GLN A 112 7.339 -0.961 -10.056 1.00 0.00 C ATOM 1694 C GLN A 112 7.896 0.431 -9.775 1.00 0.00 C ATOM 1695 O GLN A 112 7.914 1.292 -10.655 1.00 0.00 O ATOM 1696 CB GLN A 112 8.045 -1.571 -11.268 1.00 0.00 C ATOM 1697 CG GLN A 112 9.532 -1.800 -11.054 1.00 0.00 C ATOM 1698 CD GLN A 112 10.112 -2.815 -12.019 1.00 0.00 C ATOM 1699 OE1 GLN A 112 9.379 -3.585 -12.642 1.00 0.00 O ATOM 1700 NE2 GLN A 112 11.433 -2.823 -12.149 1.00 0.00 N ATOM 0 H GLN A 112 5.626 -0.893 -11.265 1.00 0.00 H new ATOM 0 HA GLN A 112 7.522 -1.589 -9.184 1.00 0.00 H new ATOM 0 HB2 GLN A 112 7.571 -2.521 -11.514 1.00 0.00 H new ATOM 0 HB3 GLN A 112 7.907 -0.914 -12.127 1.00 0.00 H new ATOM 0 HG2 GLN A 112 10.061 -0.854 -11.167 1.00 0.00 H new ATOM 0 HG3 GLN A 112 9.700 -2.139 -10.032 1.00 0.00 H new ATOM 0 HE21 GLN A 112 12.002 -2.167 -11.614 1.00 0.00 H new ATOM 0 HE22 GLN A 112 11.879 -3.485 -12.784 1.00 0.00 H new ATOM 1709 N PHE A 113 8.349 0.644 -8.544 1.00 0.00 N ATOM 1710 CA PHE A 113 8.906 1.932 -8.147 1.00 0.00 C ATOM 1711 C PHE A 113 10.282 1.757 -7.512 1.00 0.00 C ATOM 1712 O PHE A 113 10.404 1.246 -6.399 1.00 0.00 O ATOM 1713 CB PHE A 113 7.966 2.638 -7.168 1.00 0.00 C ATOM 1714 CG PHE A 113 8.519 3.926 -6.628 1.00 0.00 C ATOM 1715 CD1 PHE A 113 9.407 3.922 -5.564 1.00 0.00 C ATOM 1716 CD2 PHE A 113 8.151 5.140 -7.185 1.00 0.00 C ATOM 1717 CE1 PHE A 113 9.918 5.105 -5.066 1.00 0.00 C ATOM 1718 CE2 PHE A 113 8.660 6.326 -6.690 1.00 0.00 C ATOM 1719 CZ PHE A 113 9.543 6.309 -5.629 1.00 0.00 C ATOM 0 H PHE A 113 8.341 -0.058 -7.804 1.00 0.00 H new ATOM 0 HA PHE A 113 9.014 2.545 -9.042 1.00 0.00 H new ATOM 0 HB2 PHE A 113 7.019 2.840 -7.668 1.00 0.00 H new ATOM 0 HB3 PHE A 113 7.751 1.967 -6.336 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.703 2.983 -5.119 1.00 0.00 H new ATOM 0 HD2 PHE A 113 7.459 5.160 -8.014 1.00 0.00 H new ATOM 0 HE1 PHE A 113 10.610 5.088 -4.237 1.00 0.00 H new ATOM 0 HE2 PHE A 113 8.367 7.266 -7.133 1.00 0.00 H new ATOM 0 HZ PHE A 113 9.940 7.235 -5.240 1.00 0.00 H new ATOM 1729 N ARG A 114 11.317 2.184 -8.229 1.00 0.00 N ATOM 1730 CA ARG A 114 12.685 2.073 -7.737 1.00 0.00 C ATOM 1731 C ARG A 114 12.931 3.050 -6.591 1.00 0.00 C ATOM 1732 O ARG A 114 12.844 4.266 -6.766 1.00 0.00 O ATOM 1733 CB ARG A 114 13.679 2.338 -8.869 1.00 0.00 C ATOM 1734 CG ARG A 114 15.056 1.742 -8.622 1.00 0.00 C ATOM 1735 CD ARG A 114 15.989 1.990 -9.797 1.00 0.00 C ATOM 1736 NE ARG A 114 16.227 3.414 -10.016 1.00 0.00 N ATOM 1737 CZ ARG A 114 15.449 4.181 -10.772 1.00 0.00 C ATOM 1738 NH1 ARG A 114 14.389 3.664 -11.376 1.00 0.00 N ATOM 1739 NH2 ARG A 114 15.731 5.469 -10.923 1.00 0.00 N ATOM 0 H ARG A 114 11.234 2.610 -9.152 1.00 0.00 H new ATOM 0 HA ARG A 114 12.830 1.059 -7.365 1.00 0.00 H new ATOM 0 HB2 ARG A 114 13.277 1.931 -9.797 1.00 0.00 H new ATOM 0 HB3 ARG A 114 13.778 3.414 -9.010 1.00 0.00 H new ATOM 0 HG2 ARG A 114 15.484 2.175 -7.718 1.00 0.00 H new ATOM 0 HG3 ARG A 114 14.964 0.670 -8.449 1.00 0.00 H new ATOM 0 HD2 ARG A 114 16.939 1.487 -9.618 1.00 0.00 H new ATOM 0 HD3 ARG A 114 15.561 1.551 -10.698 1.00 0.00 H new ATOM 0 HE ARG A 114 17.034 3.843 -9.564 1.00 0.00 H new ATOM 0 HH11 ARG A 114 14.169 2.675 -11.261 1.00 0.00 H new ATOM 0 HH12 ARG A 114 13.793 4.255 -11.956 1.00 0.00 H new ATOM 0 HH21 ARG A 114 16.545 5.871 -10.459 1.00 0.00 H new ATOM 0 HH22 ARG A 114 15.133 6.057 -11.504 1.00 0.00 H new ATOM 1753 N THR A 115 13.239 2.510 -5.416 1.00 0.00 N ATOM 1754 CA THR A 115 13.496 3.332 -4.240 1.00 0.00 C ATOM 1755 C THR A 115 14.603 4.345 -4.510 1.00 0.00 C ATOM 1756 O THR A 115 15.530 4.098 -5.282 1.00 0.00 O ATOM 1757 CB THR A 115 13.890 2.469 -3.026 1.00 0.00 C ATOM 1758 OG1 THR A 115 14.983 1.611 -3.370 1.00 0.00 O ATOM 1759 CG2 THR A 115 12.712 1.634 -2.551 1.00 0.00 C ATOM 0 H THR A 115 13.317 1.506 -5.253 1.00 0.00 H new ATOM 0 HA THR A 115 12.570 3.861 -4.015 1.00 0.00 H new ATOM 0 HB THR A 115 14.192 3.134 -2.217 1.00 0.00 H new ATOM 0 HG1 THR A 115 15.025 0.865 -2.736 1.00 0.00 H new ATOM 0 HG21 THR A 115 13.014 1.033 -1.693 1.00 0.00 H new ATOM 0 HG22 THR A 115 11.892 2.292 -2.262 1.00 0.00 H new ATOM 0 HG23 THR A 115 12.383 0.977 -3.356 1.00 0.00 H new ATOM 1767 N PRO A 116 14.507 5.515 -3.859 1.00 0.00 N ATOM 1768 CA PRO A 116 15.492 6.589 -4.012 1.00 0.00 C ATOM 1769 C PRO A 116 16.836 6.237 -3.383 1.00 0.00 C ATOM 1770 O PRO A 116 17.111 5.073 -3.090 1.00 0.00 O ATOM 1771 CB PRO A 116 14.850 7.767 -3.277 1.00 0.00 C ATOM 1772 CG PRO A 116 13.935 7.140 -2.282 1.00 0.00 C ATOM 1773 CD PRO A 116 13.429 5.877 -2.924 1.00 0.00 C ATOM 0 HA PRO A 116 15.713 6.792 -5.060 1.00 0.00 H new ATOM 0 HB2 PRO A 116 15.602 8.386 -2.788 1.00 0.00 H new ATOM 0 HB3 PRO A 116 14.304 8.413 -3.965 1.00 0.00 H new ATOM 0 HG2 PRO A 116 14.460 6.922 -1.352 1.00 0.00 H new ATOM 0 HG3 PRO A 116 13.111 7.809 -2.034 1.00 0.00 H new ATOM 0 HD2 PRO A 116 13.256 5.093 -2.187 1.00 0.00 H new ATOM 0 HD3 PRO A 116 12.485 6.040 -3.443 1.00 0.00 H new ATOM 1781 N LYS A 117 17.671 7.250 -3.176 1.00 0.00 N ATOM 1782 CA LYS A 117 18.986 7.048 -2.579 1.00 0.00 C ATOM 1783 C LYS A 117 19.345 8.204 -1.651 1.00 0.00 C ATOM 1784 O LYS A 117 18.954 9.347 -1.888 1.00 0.00 O ATOM 1785 CB LYS A 117 20.048 6.908 -3.671 1.00 0.00 C ATOM 1786 CG LYS A 117 19.876 5.668 -4.532 1.00 0.00 C ATOM 1787 CD LYS A 117 20.684 4.499 -3.994 1.00 0.00 C ATOM 1788 CE LYS A 117 20.130 4.002 -2.668 1.00 0.00 C ATOM 1789 NZ LYS A 117 20.753 4.701 -1.510 1.00 0.00 N ATOM 0 H LYS A 117 17.460 8.219 -3.413 1.00 0.00 H new ATOM 0 HA LYS A 117 18.954 6.130 -1.992 1.00 0.00 H new ATOM 0 HB2 LYS A 117 20.019 7.791 -4.310 1.00 0.00 H new ATOM 0 HB3 LYS A 117 21.034 6.884 -3.206 1.00 0.00 H new ATOM 0 HG2 LYS A 117 18.822 5.395 -4.572 1.00 0.00 H new ATOM 0 HG3 LYS A 117 20.187 5.887 -5.553 1.00 0.00 H new ATOM 0 HD2 LYS A 117 20.677 3.686 -4.720 1.00 0.00 H new ATOM 0 HD3 LYS A 117 21.723 4.802 -3.865 1.00 0.00 H new ATOM 0 HE2 LYS A 117 19.051 4.153 -2.646 1.00 0.00 H new ATOM 0 HE3 LYS A 117 20.303 2.929 -2.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 21.216 4.004 -0.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 21.460 5.382 -1.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 20.019 5.206 -0.973 1.00 0.00 H new ATOM 1803 N ALA A 118 20.092 7.900 -0.595 1.00 0.00 N ATOM 1804 CA ALA A 118 20.507 8.914 0.366 1.00 0.00 C ATOM 1805 C ALA A 118 21.529 9.866 -0.247 1.00 0.00 C ATOM 1806 O ALA A 118 22.637 9.460 -0.598 1.00 0.00 O ATOM 1807 CB ALA A 118 21.077 8.257 1.614 1.00 0.00 C ATOM 0 H ALA A 118 20.422 6.959 -0.383 1.00 0.00 H new ATOM 0 HA ALA A 118 19.628 9.496 0.644 1.00 0.00 H new ATOM 0 HB1 ALA A 118 21.383 9.026 2.323 1.00 0.00 H new ATOM 0 HB2 ALA A 118 20.317 7.624 2.071 1.00 0.00 H new ATOM 0 HB3 ALA A 118 21.940 7.649 1.343 1.00 0.00 H new ATOM 1813 N SER A 119 21.148 11.133 -0.375 1.00 0.00 N ATOM 1814 CA SER A 119 22.030 12.142 -0.950 1.00 0.00 C ATOM 1815 C SER A 119 22.468 13.149 0.109 1.00 0.00 C ATOM 1816 O SER A 119 21.767 14.123 0.383 1.00 0.00 O ATOM 1817 CB SER A 119 21.329 12.867 -2.101 1.00 0.00 C ATOM 1818 OG SER A 119 22.270 13.417 -3.006 1.00 0.00 O ATOM 0 H SER A 119 20.235 11.485 -0.088 1.00 0.00 H new ATOM 0 HA SER A 119 22.916 11.637 -1.334 1.00 0.00 H new ATOM 0 HB2 SER A 119 20.676 12.172 -2.629 1.00 0.00 H new ATOM 0 HB3 SER A 119 20.696 13.660 -1.703 1.00 0.00 H new ATOM 0 HG SER A 119 21.797 13.873 -3.733 1.00 0.00 H new ATOM 1824 N GLY A 120 23.633 12.906 0.702 1.00 0.00 N ATOM 1825 CA GLY A 120 24.145 13.800 1.725 1.00 0.00 C ATOM 1826 C GLY A 120 23.876 13.290 3.127 1.00 0.00 C ATOM 1827 O GLY A 120 22.854 12.659 3.397 1.00 0.00 O ATOM 0 H GLY A 120 24.231 12.107 0.493 1.00 0.00 H new ATOM 0 HA2 GLY A 120 25.219 13.927 1.588 1.00 0.00 H new ATOM 0 HA3 GLY A 120 23.689 14.783 1.605 1.00 0.00 H new ATOM 1831 N PRO A 121 24.812 13.563 4.049 1.00 0.00 N ATOM 1832 CA PRO A 121 24.694 13.135 5.446 1.00 0.00 C ATOM 1833 C PRO A 121 23.599 13.889 6.193 1.00 0.00 C ATOM 1834 O PRO A 121 23.219 13.513 7.302 1.00 0.00 O ATOM 1835 CB PRO A 121 26.068 13.467 6.035 1.00 0.00 C ATOM 1836 CG PRO A 121 26.591 14.568 5.180 1.00 0.00 C ATOM 1837 CD PRO A 121 26.056 14.310 3.799 1.00 0.00 C ATOM 0 HA PRO A 121 24.422 12.083 5.528 1.00 0.00 H new ATOM 0 HB2 PRO A 121 25.987 13.779 7.076 1.00 0.00 H new ATOM 0 HB3 PRO A 121 26.728 12.600 6.012 1.00 0.00 H new ATOM 0 HG2 PRO A 121 26.263 15.539 5.550 1.00 0.00 H new ATOM 0 HG3 PRO A 121 27.681 14.578 5.181 1.00 0.00 H new ATOM 0 HD2 PRO A 121 25.866 15.239 3.262 1.00 0.00 H new ATOM 0 HD3 PRO A 121 26.758 13.732 3.198 1.00 0.00 H new ATOM 1845 N SER A 122 23.094 14.953 5.578 1.00 0.00 N ATOM 1846 CA SER A 122 22.044 15.762 6.186 1.00 0.00 C ATOM 1847 C SER A 122 20.664 15.235 5.805 1.00 0.00 C ATOM 1848 O SER A 122 20.435 14.829 4.665 1.00 0.00 O ATOM 1849 CB SER A 122 22.182 17.223 5.755 1.00 0.00 C ATOM 1850 OG SER A 122 21.039 17.974 6.127 1.00 0.00 O ATOM 0 H SER A 122 23.395 15.275 4.658 1.00 0.00 H new ATOM 0 HA SER A 122 22.152 15.699 7.269 1.00 0.00 H new ATOM 0 HB2 SER A 122 23.071 17.658 6.211 1.00 0.00 H new ATOM 0 HB3 SER A 122 22.320 17.276 4.675 1.00 0.00 H new ATOM 0 HG SER A 122 21.152 18.905 5.842 1.00 0.00 H new ATOM 1856 N SER A 123 19.747 15.245 6.767 1.00 0.00 N ATOM 1857 CA SER A 123 18.389 14.766 6.535 1.00 0.00 C ATOM 1858 C SER A 123 17.502 15.039 7.745 1.00 0.00 C ATOM 1859 O SER A 123 17.876 14.748 8.881 1.00 0.00 O ATOM 1860 CB SER A 123 18.401 13.268 6.224 1.00 0.00 C ATOM 1861 OG SER A 123 17.116 12.818 5.832 1.00 0.00 O ATOM 0 H SER A 123 19.920 15.580 7.715 1.00 0.00 H new ATOM 0 HA SER A 123 17.981 15.304 5.680 1.00 0.00 H new ATOM 0 HB2 SER A 123 19.119 13.064 5.430 1.00 0.00 H new ATOM 0 HB3 SER A 123 18.731 12.714 7.102 1.00 0.00 H new ATOM 0 HG SER A 123 17.148 12.503 4.904 1.00 0.00 H new ATOM 1867 N GLY A 124 16.324 15.600 7.493 1.00 0.00 N ATOM 1868 CA GLY A 124 15.401 15.904 8.571 1.00 0.00 C ATOM 1869 C GLY A 124 14.563 17.135 8.288 1.00 0.00 C ATOM 1870 O GLY A 124 14.828 18.211 8.824 1.00 0.00 O ATOM 0 H GLY A 124 15.992 15.850 6.561 1.00 0.00 H new ATOM 0 HA2 GLY A 124 14.743 15.050 8.733 1.00 0.00 H new ATOM 0 HA3 GLY A 124 15.962 16.054 9.494 1.00 0.00 H new TER 1874 GLY A 124