USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 919 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 6:sc= 1.1 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HD1:sc= -0.503 X(o=-0.5,f=-0.012) USER MOD Single : A 16 GLN : amide:sc= -0.449 X(o=-0.45,f=-0.76) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.0093) USER MOD Single : A 23 HIS : no HD1:sc=-0.000614 K(o=-0.00061,f=-2.1!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 57:sc= -0.46 USER MOD Single : A 37 ASN : amide:sc= -0.0975 X(o=-0.097,f=-0.44) USER MOD Single : A 39 THR OG1 : rot 2:sc= 1.3 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 160:sc= -0.0315 (180deg=-0.278) USER MOD Single : A 47 ASN : amide:sc= -2.8! C(o=-2.8!,f=-3.6!) USER MOD Single : A 48 SER OG : rot 180:sc= -0.505 USER MOD Single : A 53 TYR OH : rot 165:sc= -0.0424 USER MOD Single : A 57 MET CE :methyl -130:sc=-0.00275 (180deg=-0.172) USER MOD Single : A 58 SER OG : rot 80:sc= 0.47 USER MOD Single : A 60 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.3!) USER MOD Single : A 61 ASN : amide:sc= -0.0864 K(o=-0.086,f=-1.5!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.0187 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 20:sc= 0.568 USER MOD Single : A 90 GLN : amide:sc= -2.16 K(o=-2.2,f=-2.8) USER MOD Single : A 94 CYS SG : rot -122:sc= -2.27! USER MOD Single : A 97 ASN : amide:sc= -10.7! C(o=-11!,f=-22!) USER MOD Single : A 101 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.023) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 SER OG : rot 177:sc= -1.14 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -99:sc= 0.495 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 34:sc= 1.11 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.386 -19.497 15.545 1.00 0.00 N ATOM 2 CA GLY A 1 3.380 -20.340 14.361 1.00 0.00 C ATOM 3 C GLY A 1 4.802 -20.747 13.971 1.00 0.00 C ATOM 4 O GLY A 1 5.471 -20.040 13.219 1.00 0.00 O ATOM 0 H1 GLY A 1 2.410 -19.234 15.789 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.814 -20.016 16.338 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.939 -18.637 15.356 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.781 -21.231 14.548 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.910 -19.808 13.534 1.00 0.00 H new ATOM 8 N SER A 2 5.223 -21.886 14.501 1.00 0.00 N ATOM 9 CA SER A 2 6.554 -22.397 14.218 1.00 0.00 C ATOM 10 C SER A 2 6.491 -23.902 13.950 1.00 0.00 C ATOM 11 O SER A 2 5.626 -24.595 14.482 1.00 0.00 O ATOM 12 CB SER A 2 7.513 -22.104 15.374 1.00 0.00 C ATOM 13 OG SER A 2 7.751 -20.707 15.529 1.00 0.00 O ATOM 0 H SER A 2 4.666 -22.470 15.125 1.00 0.00 H new ATOM 0 HA SER A 2 6.933 -21.892 13.329 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.100 -22.506 16.299 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.459 -22.616 15.199 1.00 0.00 H new ATOM 0 HG SER A 2 8.366 -20.561 16.278 1.00 0.00 H new ATOM 19 N SER A 3 7.419 -24.362 13.124 1.00 0.00 N ATOM 20 CA SER A 3 7.480 -25.772 12.778 1.00 0.00 C ATOM 21 C SER A 3 8.934 -26.250 12.782 1.00 0.00 C ATOM 22 O SER A 3 9.857 -25.440 12.854 1.00 0.00 O ATOM 23 CB SER A 3 6.840 -26.032 11.413 1.00 0.00 C ATOM 24 OG SER A 3 5.576 -26.681 11.531 1.00 0.00 O ATOM 0 H SER A 3 8.135 -23.783 12.684 1.00 0.00 H new ATOM 0 HA SER A 3 6.918 -26.332 13.526 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.714 -25.086 10.885 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.508 -26.647 10.810 1.00 0.00 H new ATOM 0 HG SER A 3 5.199 -26.828 10.638 1.00 0.00 H new ATOM 30 N GLY A 4 9.092 -27.563 12.704 1.00 0.00 N ATOM 31 CA GLY A 4 10.417 -28.158 12.698 1.00 0.00 C ATOM 32 C GLY A 4 11.258 -27.612 11.542 1.00 0.00 C ATOM 33 O GLY A 4 10.718 -27.079 10.574 1.00 0.00 O ATOM 0 H GLY A 4 8.324 -28.232 12.644 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.916 -27.952 13.645 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.333 -29.241 12.611 1.00 0.00 H new ATOM 37 N SER A 5 12.567 -27.764 11.681 1.00 0.00 N ATOM 38 CA SER A 5 13.488 -27.294 10.660 1.00 0.00 C ATOM 39 C SER A 5 14.247 -28.476 10.056 1.00 0.00 C ATOM 40 O SER A 5 14.411 -29.509 10.702 1.00 0.00 O ATOM 41 CB SER A 5 14.469 -26.269 11.234 1.00 0.00 C ATOM 42 OG SER A 5 13.905 -24.962 11.288 1.00 0.00 O ATOM 0 H SER A 5 13.012 -28.206 12.485 1.00 0.00 H new ATOM 0 HA SER A 5 12.910 -26.804 9.876 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.769 -26.576 12.236 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.371 -26.249 10.623 1.00 0.00 H new ATOM 0 HG SER A 5 14.561 -24.338 11.662 1.00 0.00 H new ATOM 48 N SER A 6 14.691 -28.284 8.822 1.00 0.00 N ATOM 49 CA SER A 6 15.430 -29.322 8.123 1.00 0.00 C ATOM 50 C SER A 6 16.075 -28.745 6.861 1.00 0.00 C ATOM 51 O SER A 6 15.382 -28.427 5.896 1.00 0.00 O ATOM 52 CB SER A 6 14.520 -30.499 7.764 1.00 0.00 C ATOM 53 OG SER A 6 14.224 -31.310 8.898 1.00 0.00 O ATOM 0 H SER A 6 14.553 -27.426 8.289 1.00 0.00 H new ATOM 0 HA SER A 6 16.212 -29.692 8.786 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.591 -30.122 7.336 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.000 -31.108 6.998 1.00 0.00 H new ATOM 0 HG SER A 6 14.597 -30.895 9.703 1.00 0.00 H new ATOM 59 N GLY A 7 17.394 -28.628 6.909 1.00 0.00 N ATOM 60 CA GLY A 7 18.140 -28.095 5.782 1.00 0.00 C ATOM 61 C GLY A 7 19.598 -28.557 5.822 1.00 0.00 C ATOM 62 O GLY A 7 19.919 -29.557 6.463 1.00 0.00 O ATOM 0 H GLY A 7 17.965 -28.893 7.711 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.678 -28.419 4.849 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.099 -27.006 5.797 1.00 0.00 H new ATOM 66 N ARG A 8 20.442 -27.805 5.130 1.00 0.00 N ATOM 67 CA ARG A 8 21.859 -28.125 5.079 1.00 0.00 C ATOM 68 C ARG A 8 22.694 -26.883 5.398 1.00 0.00 C ATOM 69 O ARG A 8 22.177 -25.767 5.404 1.00 0.00 O ATOM 70 CB ARG A 8 22.254 -28.656 3.700 1.00 0.00 C ATOM 71 CG ARG A 8 21.816 -27.693 2.595 1.00 0.00 C ATOM 72 CD ARG A 8 20.864 -28.380 1.614 1.00 0.00 C ATOM 73 NE ARG A 8 21.493 -28.472 0.278 1.00 0.00 N ATOM 74 CZ ARG A 8 21.815 -27.411 -0.475 1.00 0.00 C ATOM 75 NH1 ARG A 8 21.569 -26.172 -0.027 1.00 0.00 N ATOM 76 NH2 ARG A 8 22.383 -27.589 -1.676 1.00 0.00 N ATOM 0 H ARG A 8 20.172 -26.976 4.601 1.00 0.00 H new ATOM 0 HA ARG A 8 22.052 -28.898 5.822 1.00 0.00 H new ATOM 0 HB2 ARG A 8 23.334 -28.798 3.657 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.798 -29.633 3.538 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.325 -26.826 3.037 1.00 0.00 H new ATOM 0 HG3 ARG A 8 22.692 -27.325 2.060 1.00 0.00 H new ATOM 0 HD2 ARG A 8 20.613 -29.377 1.976 1.00 0.00 H new ATOM 0 HD3 ARG A 8 19.931 -27.820 1.548 1.00 0.00 H new ATOM 0 HE ARG A 8 21.694 -29.401 -0.093 1.00 0.00 H new ATOM 0 HH11 ARG A 8 21.137 -26.037 0.887 1.00 0.00 H new ATOM 0 HH12 ARG A 8 21.814 -25.364 -0.600 1.00 0.00 H new ATOM 0 HH21 ARG A 8 22.570 -28.532 -2.017 1.00 0.00 H new ATOM 0 HH22 ARG A 8 22.628 -26.782 -2.249 1.00 0.00 H new ATOM 90 N SER A 9 23.972 -27.120 5.656 1.00 0.00 N ATOM 91 CA SER A 9 24.884 -26.035 5.975 1.00 0.00 C ATOM 92 C SER A 9 25.386 -25.376 4.688 1.00 0.00 C ATOM 93 O SER A 9 25.120 -25.867 3.592 1.00 0.00 O ATOM 94 CB SER A 9 26.065 -26.535 6.810 1.00 0.00 C ATOM 95 OG SER A 9 26.031 -26.027 8.141 1.00 0.00 O ATOM 0 H SER A 9 24.397 -28.047 5.651 1.00 0.00 H new ATOM 0 HA SER A 9 24.342 -25.297 6.566 1.00 0.00 H new ATOM 0 HB2 SER A 9 26.054 -27.625 6.837 1.00 0.00 H new ATOM 0 HB3 SER A 9 26.998 -26.238 6.332 1.00 0.00 H new ATOM 0 HG SER A 9 26.800 -26.370 8.642 1.00 0.00 H new ATOM 101 N ALA A 10 26.102 -24.276 4.864 1.00 0.00 N ATOM 102 CA ALA A 10 26.643 -23.546 3.731 1.00 0.00 C ATOM 103 C ALA A 10 27.560 -22.431 4.238 1.00 0.00 C ATOM 104 O ALA A 10 27.647 -22.194 5.442 1.00 0.00 O ATOM 105 CB ALA A 10 25.494 -23.010 2.873 1.00 0.00 C ATOM 0 H ALA A 10 26.320 -23.872 5.775 1.00 0.00 H new ATOM 0 HA ALA A 10 27.241 -24.204 3.101 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.900 -22.462 2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 10 24.890 -23.843 2.513 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.873 -22.343 3.472 1.00 0.00 H new ATOM 111 N HIS A 11 28.222 -21.778 3.294 1.00 0.00 N ATOM 112 CA HIS A 11 29.130 -20.694 3.631 1.00 0.00 C ATOM 113 C HIS A 11 28.492 -19.355 3.256 1.00 0.00 C ATOM 114 O HIS A 11 27.670 -19.289 2.344 1.00 0.00 O ATOM 115 CB HIS A 11 30.495 -20.906 2.973 1.00 0.00 C ATOM 116 CG HIS A 11 30.537 -20.531 1.511 1.00 0.00 C ATOM 117 ND1 HIS A 11 30.023 -21.342 0.514 1.00 0.00 N ATOM 118 CD2 HIS A 11 31.036 -19.425 0.888 1.00 0.00 C ATOM 119 CE1 HIS A 11 30.210 -20.742 -0.652 1.00 0.00 C ATOM 120 NE2 HIS A 11 30.839 -19.554 -0.418 1.00 0.00 N ATOM 0 H HIS A 11 28.148 -21.978 2.297 1.00 0.00 H new ATOM 0 HA HIS A 11 29.307 -20.683 4.706 1.00 0.00 H new ATOM 0 HB2 HIS A 11 31.241 -20.319 3.510 1.00 0.00 H new ATOM 0 HB3 HIS A 11 30.778 -21.953 3.077 1.00 0.00 H new ATOM 0 HD2 HIS A 11 31.511 -18.586 1.375 1.00 0.00 H new ATOM 0 HE1 HIS A 11 29.916 -21.126 -1.618 1.00 0.00 H new ATOM 0 HE2 HIS A 11 31.113 -18.877 -1.130 1.00 0.00 H new ATOM 128 N LEU A 12 28.897 -18.321 3.978 1.00 0.00 N ATOM 129 CA LEU A 12 28.375 -16.987 3.733 1.00 0.00 C ATOM 130 C LEU A 12 26.859 -16.991 3.942 1.00 0.00 C ATOM 131 O LEU A 12 26.262 -18.043 4.161 1.00 0.00 O ATOM 132 CB LEU A 12 28.804 -16.490 2.351 1.00 0.00 C ATOM 133 CG LEU A 12 29.953 -15.479 2.329 1.00 0.00 C ATOM 134 CD1 LEU A 12 30.838 -15.683 1.098 1.00 0.00 C ATOM 135 CD2 LEU A 12 29.424 -14.047 2.424 1.00 0.00 C ATOM 0 H LEU A 12 29.581 -18.380 4.733 1.00 0.00 H new ATOM 0 HA LEU A 12 28.794 -16.277 4.446 1.00 0.00 H new ATOM 0 HB2 LEU A 12 29.093 -17.352 1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 12 27.939 -16.038 1.865 1.00 0.00 H new ATOM 0 HG LEU A 12 30.577 -15.650 3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 12 31.647 -14.952 1.106 1.00 0.00 H new ATOM 0 HD12 LEU A 12 31.258 -16.689 1.114 1.00 0.00 H new ATOM 0 HD13 LEU A 12 30.241 -15.553 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 12 30.260 -13.348 2.406 1.00 0.00 H new ATOM 0 HD22 LEU A 12 28.765 -13.846 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 12 28.869 -13.925 3.354 1.00 0.00 H new ATOM 147 N ARG A 13 26.281 -15.801 3.868 1.00 0.00 N ATOM 148 CA ARG A 13 24.847 -15.654 4.046 1.00 0.00 C ATOM 149 C ARG A 13 24.120 -15.887 2.720 1.00 0.00 C ATOM 150 O ARG A 13 24.638 -15.551 1.656 1.00 0.00 O ATOM 151 CB ARG A 13 24.497 -14.260 4.572 1.00 0.00 C ATOM 152 CG ARG A 13 25.162 -14.003 5.926 1.00 0.00 C ATOM 153 CD ARG A 13 26.047 -12.755 5.874 1.00 0.00 C ATOM 154 NE ARG A 13 26.579 -12.456 7.222 1.00 0.00 N ATOM 155 CZ ARG A 13 27.502 -13.199 7.847 1.00 0.00 C ATOM 156 NH1 ARG A 13 28.000 -14.290 7.250 1.00 0.00 N ATOM 157 NH2 ARG A 13 27.926 -12.851 9.070 1.00 0.00 N ATOM 0 H ARG A 13 26.780 -14.930 3.687 1.00 0.00 H new ATOM 0 HA ARG A 13 24.526 -16.397 4.776 1.00 0.00 H new ATOM 0 HB2 ARG A 13 24.820 -13.505 3.855 1.00 0.00 H new ATOM 0 HB3 ARG A 13 23.416 -14.165 4.670 1.00 0.00 H new ATOM 0 HG2 ARG A 13 24.398 -13.879 6.693 1.00 0.00 H new ATOM 0 HG3 ARG A 13 25.762 -14.867 6.210 1.00 0.00 H new ATOM 0 HD2 ARG A 13 26.869 -12.911 5.176 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.472 -11.906 5.504 1.00 0.00 H new ATOM 0 HE ARG A 13 26.220 -11.633 7.706 1.00 0.00 H new ATOM 0 HH11 ARG A 13 27.676 -14.555 6.320 1.00 0.00 H new ATOM 0 HH12 ARG A 13 28.703 -14.856 7.726 1.00 0.00 H new ATOM 0 HH21 ARG A 13 27.546 -12.021 9.524 1.00 0.00 H new ATOM 0 HH22 ARG A 13 28.629 -13.416 9.546 1.00 0.00 H new ATOM 171 N VAL A 14 22.931 -16.463 2.826 1.00 0.00 N ATOM 172 CA VAL A 14 22.128 -16.745 1.649 1.00 0.00 C ATOM 173 C VAL A 14 21.144 -15.597 1.420 1.00 0.00 C ATOM 174 O VAL A 14 20.443 -15.183 2.342 1.00 0.00 O ATOM 175 CB VAL A 14 21.439 -18.103 1.799 1.00 0.00 C ATOM 176 CG1 VAL A 14 20.171 -17.983 2.648 1.00 0.00 C ATOM 177 CG2 VAL A 14 21.127 -18.714 0.432 1.00 0.00 C ATOM 0 H VAL A 14 22.505 -16.742 3.710 1.00 0.00 H new ATOM 0 HA VAL A 14 22.760 -16.812 0.763 1.00 0.00 H new ATOM 0 HB VAL A 14 22.127 -18.772 2.316 1.00 0.00 H new ATOM 0 HG11 VAL A 14 19.700 -18.962 2.739 1.00 0.00 H new ATOM 0 HG12 VAL A 14 20.431 -17.611 3.639 1.00 0.00 H new ATOM 0 HG13 VAL A 14 19.478 -17.290 2.171 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.638 -19.679 0.568 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.467 -18.047 -0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 14 22.054 -18.852 -0.125 1.00 0.00 H new ATOM 187 N ARG A 15 21.123 -15.114 0.186 1.00 0.00 N ATOM 188 CA ARG A 15 20.236 -14.022 -0.175 1.00 0.00 C ATOM 189 C ARG A 15 18.868 -14.564 -0.592 1.00 0.00 C ATOM 190 O ARG A 15 18.637 -14.840 -1.768 1.00 0.00 O ATOM 191 CB ARG A 15 20.820 -13.195 -1.323 1.00 0.00 C ATOM 192 CG ARG A 15 21.809 -12.152 -0.799 1.00 0.00 C ATOM 193 CD ARG A 15 22.183 -11.152 -1.895 1.00 0.00 C ATOM 194 NE ARG A 15 23.640 -11.205 -2.153 1.00 0.00 N ATOM 195 CZ ARG A 15 24.229 -12.102 -2.955 1.00 0.00 C ATOM 196 NH1 ARG A 15 23.490 -13.027 -3.583 1.00 0.00 N ATOM 197 NH2 ARG A 15 25.557 -12.074 -3.130 1.00 0.00 N ATOM 0 H ARG A 15 21.706 -15.459 -0.576 1.00 0.00 H new ATOM 0 HA ARG A 15 20.125 -13.382 0.700 1.00 0.00 H new ATOM 0 HB2 ARG A 15 21.322 -13.854 -2.032 1.00 0.00 H new ATOM 0 HB3 ARG A 15 20.015 -12.698 -1.864 1.00 0.00 H new ATOM 0 HG2 ARG A 15 21.371 -11.623 0.047 1.00 0.00 H new ATOM 0 HG3 ARG A 15 22.707 -12.649 -0.433 1.00 0.00 H new ATOM 0 HD2 ARG A 15 21.635 -11.380 -2.809 1.00 0.00 H new ATOM 0 HD3 ARG A 15 21.895 -10.145 -1.594 1.00 0.00 H new ATOM 0 HE ARG A 15 24.233 -10.515 -1.691 1.00 0.00 H new ATOM 0 HH11 ARG A 15 22.479 -13.048 -3.450 1.00 0.00 H new ATOM 0 HH12 ARG A 15 23.939 -13.710 -4.194 1.00 0.00 H new ATOM 0 HH21 ARG A 15 26.120 -11.370 -2.653 1.00 0.00 H new ATOM 0 HH22 ARG A 15 26.005 -12.757 -3.741 1.00 0.00 H new ATOM 211 N GLN A 16 17.995 -14.701 0.396 1.00 0.00 N ATOM 212 CA GLN A 16 16.656 -15.206 0.147 1.00 0.00 C ATOM 213 C GLN A 16 15.690 -14.046 -0.106 1.00 0.00 C ATOM 214 O GLN A 16 15.861 -12.960 0.445 1.00 0.00 O ATOM 215 CB GLN A 16 16.173 -16.077 1.309 1.00 0.00 C ATOM 216 CG GLN A 16 15.632 -17.416 0.802 1.00 0.00 C ATOM 217 CD GLN A 16 16.731 -18.226 0.112 1.00 0.00 C ATOM 218 OE1 GLN A 16 16.874 -18.221 -1.100 1.00 0.00 O ATOM 219 NE2 GLN A 16 17.496 -18.921 0.948 1.00 0.00 N ATOM 0 H GLN A 16 18.190 -14.471 1.370 1.00 0.00 H new ATOM 0 HA GLN A 16 16.685 -15.831 -0.745 1.00 0.00 H new ATOM 0 HB2 GLN A 16 16.995 -16.252 2.003 1.00 0.00 H new ATOM 0 HB3 GLN A 16 15.394 -15.552 1.863 1.00 0.00 H new ATOM 0 HG2 GLN A 16 15.224 -17.987 1.636 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.813 -17.241 0.105 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.322 -18.880 1.952 1.00 0.00 H new ATOM 0 HE22 GLN A 16 18.257 -19.495 0.585 1.00 0.00 H new ATOM 228 N LEU A 17 14.697 -14.317 -0.940 1.00 0.00 N ATOM 229 CA LEU A 17 13.704 -13.310 -1.273 1.00 0.00 C ATOM 230 C LEU A 17 12.808 -13.062 -0.058 1.00 0.00 C ATOM 231 O LEU A 17 12.489 -13.990 0.683 1.00 0.00 O ATOM 232 CB LEU A 17 12.934 -13.712 -2.532 1.00 0.00 C ATOM 233 CG LEU A 17 13.722 -13.668 -3.843 1.00 0.00 C ATOM 234 CD1 LEU A 17 12.887 -14.210 -5.004 1.00 0.00 C ATOM 235 CD2 LEU A 17 14.244 -12.256 -4.122 1.00 0.00 C ATOM 0 H LEU A 17 14.559 -15.219 -1.395 1.00 0.00 H new ATOM 0 HA LEU A 17 14.188 -12.363 -1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 17 12.554 -14.724 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 17 12.068 -13.057 -2.629 1.00 0.00 H new ATOM 0 HG LEU A 17 14.591 -14.318 -3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.471 -14.167 -5.923 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.607 -15.243 -4.800 1.00 0.00 H new ATOM 0 HD13 LEU A 17 11.987 -13.606 -5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 17 14.800 -12.252 -5.059 1.00 0.00 H new ATOM 0 HD22 LEU A 17 13.404 -11.566 -4.196 1.00 0.00 H new ATOM 0 HD23 LEU A 17 14.900 -11.943 -3.310 1.00 0.00 H new ATOM 247 N PRO A 18 12.417 -11.770 0.115 1.00 0.00 N ATOM 248 CA PRO A 18 11.565 -11.388 1.227 1.00 0.00 C ATOM 249 C PRO A 18 10.120 -11.830 0.987 1.00 0.00 C ATOM 250 O PRO A 18 9.789 -12.326 -0.089 1.00 0.00 O ATOM 251 CB PRO A 18 11.714 -9.880 1.338 1.00 0.00 C ATOM 252 CG PRO A 18 12.274 -9.418 0.002 1.00 0.00 C ATOM 253 CD PRO A 18 12.776 -10.644 -0.743 1.00 0.00 C ATOM 0 HA PRO A 18 11.850 -11.872 2.161 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.754 -9.407 1.544 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.383 -9.613 2.156 1.00 0.00 H new ATOM 0 HG2 PRO A 18 11.505 -8.907 -0.578 1.00 0.00 H new ATOM 0 HG3 PRO A 18 13.085 -8.705 0.154 1.00 0.00 H new ATOM 0 HD2 PRO A 18 12.310 -10.730 -1.725 1.00 0.00 H new ATOM 0 HD3 PRO A 18 13.853 -10.596 -0.904 1.00 0.00 H new ATOM 261 N HIS A 19 9.297 -11.634 2.008 1.00 0.00 N ATOM 262 CA HIS A 19 7.895 -12.006 1.921 1.00 0.00 C ATOM 263 C HIS A 19 7.038 -10.746 1.778 1.00 0.00 C ATOM 264 O HIS A 19 7.449 -9.662 2.188 1.00 0.00 O ATOM 265 CB HIS A 19 7.487 -12.868 3.117 1.00 0.00 C ATOM 266 CG HIS A 19 7.589 -14.353 2.867 1.00 0.00 C ATOM 267 ND1 HIS A 19 6.543 -15.228 3.109 1.00 0.00 N ATOM 268 CD2 HIS A 19 8.621 -15.109 2.394 1.00 0.00 C ATOM 269 CE1 HIS A 19 6.940 -16.451 2.793 1.00 0.00 C ATOM 270 NE2 HIS A 19 8.228 -16.376 2.350 1.00 0.00 N ATOM 0 H HIS A 19 9.575 -11.223 2.899 1.00 0.00 H new ATOM 0 HA HIS A 19 7.731 -12.618 1.034 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.115 -12.609 3.969 1.00 0.00 H new ATOM 0 HB3 HIS A 19 6.461 -12.626 3.393 1.00 0.00 H new ATOM 0 HD2 HIS A 19 9.593 -14.739 2.104 1.00 0.00 H new ATOM 0 HE1 HIS A 19 6.348 -17.351 2.872 1.00 0.00 H new ATOM 0 HE2 HIS A 19 8.795 -17.164 2.037 1.00 0.00 H new ATOM 278 N ALA A 20 5.864 -10.932 1.194 1.00 0.00 N ATOM 279 CA ALA A 20 4.945 -9.825 0.991 1.00 0.00 C ATOM 280 C ALA A 20 4.502 -9.279 2.351 1.00 0.00 C ATOM 281 O ALA A 20 4.676 -9.939 3.374 1.00 0.00 O ATOM 282 CB ALA A 20 3.764 -10.290 0.137 1.00 0.00 C ATOM 0 H ALA A 20 5.528 -11.833 0.855 1.00 0.00 H new ATOM 0 HA ALA A 20 5.436 -9.014 0.454 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.075 -9.459 -0.015 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.129 -10.640 -0.829 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.245 -11.103 0.645 1.00 0.00 H new ATOM 288 N PRO A 21 3.925 -8.049 2.316 1.00 0.00 N ATOM 289 CA PRO A 21 3.456 -7.407 3.532 1.00 0.00 C ATOM 290 C PRO A 21 2.153 -8.044 4.020 1.00 0.00 C ATOM 291 O PRO A 21 1.297 -8.410 3.216 1.00 0.00 O ATOM 292 CB PRO A 21 3.301 -5.940 3.169 1.00 0.00 C ATOM 293 CG PRO A 21 3.240 -5.891 1.651 1.00 0.00 C ATOM 294 CD PRO A 21 3.703 -7.238 1.122 1.00 0.00 C ATOM 0 HA PRO A 21 4.150 -7.525 4.365 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.396 -5.522 3.610 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.139 -5.354 3.545 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.225 -5.678 1.317 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.876 -5.092 1.269 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.952 -7.687 0.472 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.616 -7.140 0.534 1.00 0.00 H new ATOM 302 N GLU A 22 2.042 -8.155 5.336 1.00 0.00 N ATOM 303 CA GLU A 22 0.858 -8.740 5.941 1.00 0.00 C ATOM 304 C GLU A 22 -0.056 -7.642 6.488 1.00 0.00 C ATOM 305 O GLU A 22 0.269 -6.459 6.404 1.00 0.00 O ATOM 306 CB GLU A 22 1.238 -9.736 7.039 1.00 0.00 C ATOM 307 CG GLU A 22 1.173 -11.174 6.521 1.00 0.00 C ATOM 308 CD GLU A 22 0.878 -12.154 7.659 1.00 0.00 C ATOM 309 OE1 GLU A 22 -0.065 -11.864 8.427 1.00 0.00 O ATOM 310 OE2 GLU A 22 1.603 -13.169 7.735 1.00 0.00 O ATOM 0 H GLU A 22 2.753 -7.849 6.000 1.00 0.00 H new ATOM 0 HA GLU A 22 0.314 -9.288 5.172 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.244 -9.520 7.398 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.565 -9.621 7.888 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.400 -11.255 5.757 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.118 -11.436 6.046 1.00 0.00 H new ATOM 317 N HIS A 23 -1.182 -8.074 7.037 1.00 0.00 N ATOM 318 CA HIS A 23 -2.146 -7.142 7.599 1.00 0.00 C ATOM 319 C HIS A 23 -2.237 -5.900 6.710 1.00 0.00 C ATOM 320 O HIS A 23 -2.101 -4.777 7.190 1.00 0.00 O ATOM 321 CB HIS A 23 -1.796 -6.807 9.050 1.00 0.00 C ATOM 322 CG HIS A 23 -2.917 -7.069 10.028 1.00 0.00 C ATOM 323 ND1 HIS A 23 -4.000 -6.220 10.172 1.00 0.00 N ATOM 324 CD2 HIS A 23 -3.111 -8.094 10.907 1.00 0.00 C ATOM 325 CE1 HIS A 23 -4.803 -6.720 11.100 1.00 0.00 C ATOM 326 NE2 HIS A 23 -4.250 -7.881 11.554 1.00 0.00 N ATOM 0 H HIS A 23 -1.449 -9.056 7.105 1.00 0.00 H new ATOM 0 HA HIS A 23 -3.133 -7.604 7.622 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.925 -7.391 9.347 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -1.512 -5.756 9.111 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.450 -8.936 11.052 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -5.732 -6.285 11.437 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -4.647 -8.486 12.273 1.00 0.00 H new ATOM 334 N PRO A 24 -2.474 -6.152 5.394 1.00 0.00 N ATOM 335 CA PRO A 24 -2.585 -5.067 4.433 1.00 0.00 C ATOM 336 C PRO A 24 -3.928 -4.347 4.573 1.00 0.00 C ATOM 337 O PRO A 24 -4.825 -4.534 3.752 1.00 0.00 O ATOM 338 CB PRO A 24 -2.403 -5.725 3.075 1.00 0.00 C ATOM 339 CG PRO A 24 -2.660 -7.208 3.292 1.00 0.00 C ATOM 340 CD PRO A 24 -2.641 -7.470 4.789 1.00 0.00 C ATOM 0 HA PRO A 24 -1.837 -4.289 4.588 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.098 -5.311 2.344 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.397 -5.555 2.690 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.622 -7.495 2.866 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.898 -7.805 2.790 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.565 -7.943 5.120 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.825 -8.138 5.064 1.00 0.00 H new ATOM 348 N VAL A 25 -4.023 -3.538 5.618 1.00 0.00 N ATOM 349 CA VAL A 25 -5.241 -2.788 5.875 1.00 0.00 C ATOM 350 C VAL A 25 -5.088 -1.370 5.323 1.00 0.00 C ATOM 351 O VAL A 25 -4.118 -0.680 5.634 1.00 0.00 O ATOM 352 CB VAL A 25 -5.567 -2.816 7.370 1.00 0.00 C ATOM 353 CG1 VAL A 25 -7.026 -2.432 7.621 1.00 0.00 C ATOM 354 CG2 VAL A 25 -5.249 -4.185 7.975 1.00 0.00 C ATOM 0 H VAL A 25 -3.277 -3.385 6.296 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.087 -3.246 5.363 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.937 -2.076 7.864 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.231 -2.460 8.691 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.208 -1.426 7.243 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.681 -3.136 7.108 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.490 -4.178 9.038 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.841 -4.951 7.474 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.189 -4.403 7.845 1.00 0.00 H new ATOM 364 N ALA A 26 -6.060 -0.976 4.514 1.00 0.00 N ATOM 365 CA ALA A 26 -6.046 0.348 3.916 1.00 0.00 C ATOM 366 C ALA A 26 -7.287 1.121 4.367 1.00 0.00 C ATOM 367 O ALA A 26 -8.412 0.661 4.177 1.00 0.00 O ATOM 368 CB ALA A 26 -5.960 0.220 2.394 1.00 0.00 C ATOM 0 H ALA A 26 -6.863 -1.551 4.258 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.171 0.908 4.246 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.950 1.213 1.945 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.046 -0.310 2.124 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.823 -0.335 2.026 1.00 0.00 H new ATOM 374 N THR A 27 -7.040 2.281 4.957 1.00 0.00 N ATOM 375 CA THR A 27 -8.123 3.122 5.437 1.00 0.00 C ATOM 376 C THR A 27 -7.890 4.578 5.029 1.00 0.00 C ATOM 377 O THR A 27 -6.747 5.024 4.933 1.00 0.00 O ATOM 378 CB THR A 27 -8.239 2.926 6.950 1.00 0.00 C ATOM 379 OG1 THR A 27 -6.942 2.486 7.343 1.00 0.00 O ATOM 380 CG2 THR A 27 -9.157 1.760 7.321 1.00 0.00 C ATOM 0 H THR A 27 -6.105 2.658 5.114 1.00 0.00 H new ATOM 0 HA THR A 27 -9.073 2.839 4.984 1.00 0.00 H new ATOM 0 HB THR A 27 -8.614 3.842 7.407 1.00 0.00 H new ATOM 0 HG1 THR A 27 -6.927 2.336 8.311 1.00 0.00 H new ATOM 0 HG21 THR A 27 -9.204 1.665 8.406 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.157 1.945 6.929 1.00 0.00 H new ATOM 0 HG23 THR A 27 -8.765 0.838 6.893 1.00 0.00 H new ATOM 388 N LEU A 28 -8.991 5.279 4.799 1.00 0.00 N ATOM 389 CA LEU A 28 -8.920 6.675 4.404 1.00 0.00 C ATOM 390 C LEU A 28 -8.050 7.440 5.403 1.00 0.00 C ATOM 391 O LEU A 28 -7.503 6.851 6.334 1.00 0.00 O ATOM 392 CB LEU A 28 -10.325 7.257 4.240 1.00 0.00 C ATOM 393 CG LEU A 28 -10.815 7.433 2.801 1.00 0.00 C ATOM 394 CD1 LEU A 28 -12.289 7.840 2.769 1.00 0.00 C ATOM 395 CD2 LEU A 28 -9.931 8.422 2.038 1.00 0.00 C ATOM 0 H LEU A 28 -9.937 4.906 4.879 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.444 6.771 3.428 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.028 6.611 4.766 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.354 8.228 4.734 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.736 6.472 2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -12.611 7.958 1.735 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.890 7.069 3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -12.418 8.784 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.301 8.529 1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.955 9.391 2.536 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.906 8.051 2.015 1.00 0.00 H new ATOM 407 N SER A 29 -7.949 8.742 5.175 1.00 0.00 N ATOM 408 CA SER A 29 -7.155 9.594 6.044 1.00 0.00 C ATOM 409 C SER A 29 -8.064 10.321 7.037 1.00 0.00 C ATOM 410 O SER A 29 -7.588 10.884 8.022 1.00 0.00 O ATOM 411 CB SER A 29 -6.341 10.603 5.232 1.00 0.00 C ATOM 412 OG SER A 29 -4.938 10.398 5.377 1.00 0.00 O ATOM 0 H SER A 29 -8.404 9.227 4.401 1.00 0.00 H new ATOM 0 HA SER A 29 -6.456 8.964 6.595 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.612 10.524 4.179 1.00 0.00 H new ATOM 0 HB3 SER A 29 -6.594 11.614 5.551 1.00 0.00 H new ATOM 0 HG SER A 29 -4.454 11.061 4.842 1.00 0.00 H new ATOM 418 N THR A 30 -9.355 10.286 6.743 1.00 0.00 N ATOM 419 CA THR A 30 -10.335 10.935 7.597 1.00 0.00 C ATOM 420 C THR A 30 -9.796 12.274 8.105 1.00 0.00 C ATOM 421 O THR A 30 -9.804 12.535 9.307 1.00 0.00 O ATOM 422 CB THR A 30 -10.701 9.963 8.720 1.00 0.00 C ATOM 423 OG1 THR A 30 -9.482 9.281 9.000 1.00 0.00 O ATOM 424 CG2 THR A 30 -11.648 8.856 8.251 1.00 0.00 C ATOM 0 H THR A 30 -9.745 9.818 5.925 1.00 0.00 H new ATOM 0 HA THR A 30 -11.244 11.174 7.045 1.00 0.00 H new ATOM 0 HB THR A 30 -11.163 10.513 9.540 1.00 0.00 H new ATOM 0 HG1 THR A 30 -8.789 9.933 9.235 1.00 0.00 H new ATOM 0 HG21 THR A 30 -11.876 8.194 9.086 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.571 9.300 7.878 1.00 0.00 H new ATOM 0 HG23 THR A 30 -11.173 8.284 7.454 1.00 0.00 H new ATOM 432 N VAL A 31 -9.342 13.088 7.163 1.00 0.00 N ATOM 433 CA VAL A 31 -8.800 14.394 7.500 1.00 0.00 C ATOM 434 C VAL A 31 -8.298 15.076 6.226 1.00 0.00 C ATOM 435 O VAL A 31 -8.636 16.229 5.960 1.00 0.00 O ATOM 436 CB VAL A 31 -7.715 14.250 8.569 1.00 0.00 C ATOM 437 CG1 VAL A 31 -6.332 14.554 7.990 1.00 0.00 C ATOM 438 CG2 VAL A 31 -8.013 15.143 9.775 1.00 0.00 C ATOM 0 H VAL A 31 -9.338 12.869 6.167 1.00 0.00 H new ATOM 0 HA VAL A 31 -9.575 15.031 7.927 1.00 0.00 H new ATOM 0 HB VAL A 31 -7.715 13.215 8.910 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -5.579 14.444 8.770 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.117 13.860 7.178 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.314 15.575 7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -7.227 15.022 10.520 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -8.053 16.184 9.456 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -8.972 14.860 10.210 1.00 0.00 H new ATOM 448 N GLU A 32 -7.498 14.336 5.472 1.00 0.00 N ATOM 449 CA GLU A 32 -6.946 14.856 4.233 1.00 0.00 C ATOM 450 C GLU A 32 -7.892 14.564 3.066 1.00 0.00 C ATOM 451 O GLU A 32 -8.827 13.777 3.203 1.00 0.00 O ATOM 452 CB GLU A 32 -5.554 14.278 3.968 1.00 0.00 C ATOM 453 CG GLU A 32 -4.482 15.365 4.064 1.00 0.00 C ATOM 454 CD GLU A 32 -3.217 14.830 4.739 1.00 0.00 C ATOM 455 OE1 GLU A 32 -3.285 14.596 5.966 1.00 0.00 O ATOM 456 OE2 GLU A 32 -2.212 14.667 4.015 1.00 0.00 O ATOM 0 H GLU A 32 -7.219 13.381 5.696 1.00 0.00 H new ATOM 0 HA GLU A 32 -6.843 15.937 4.330 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.341 13.488 4.688 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.528 13.823 2.978 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -4.239 15.730 3.066 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -4.869 16.213 4.629 1.00 0.00 H new ATOM 463 N ARG A 33 -7.615 15.214 1.945 1.00 0.00 N ATOM 464 CA ARG A 33 -8.430 15.033 0.756 1.00 0.00 C ATOM 465 C ARG A 33 -8.413 13.568 0.317 1.00 0.00 C ATOM 466 O ARG A 33 -8.469 12.666 1.152 1.00 0.00 O ATOM 467 CB ARG A 33 -7.927 15.908 -0.394 1.00 0.00 C ATOM 468 CG ARG A 33 -7.602 17.321 0.093 1.00 0.00 C ATOM 469 CD ARG A 33 -8.380 18.369 -0.705 1.00 0.00 C ATOM 470 NE ARG A 33 -7.623 19.640 -0.745 1.00 0.00 N ATOM 471 CZ ARG A 33 -8.139 20.809 -1.149 1.00 0.00 C ATOM 472 NH1 ARG A 33 -9.416 20.876 -1.550 1.00 0.00 N ATOM 473 NH2 ARG A 33 -7.378 21.912 -1.151 1.00 0.00 N ATOM 0 H ARG A 33 -6.838 15.866 1.835 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.449 15.329 1.005 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -7.038 15.458 -0.836 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -8.683 15.955 -1.178 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.846 17.410 1.152 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.532 17.506 -0.004 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -8.556 18.009 -1.719 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -9.357 18.532 -0.251 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.648 19.625 -0.446 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.996 20.037 -1.548 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -9.808 21.766 -1.857 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.406 21.862 -0.845 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.770 22.802 -1.458 1.00 0.00 H new ATOM 487 N ARG A 34 -8.335 13.375 -0.991 1.00 0.00 N ATOM 488 CA ARG A 34 -8.310 12.034 -1.550 1.00 0.00 C ATOM 489 C ARG A 34 -7.023 11.314 -1.145 1.00 0.00 C ATOM 490 O ARG A 34 -6.253 10.881 -2.001 1.00 0.00 O ATOM 491 CB ARG A 34 -8.406 12.072 -3.077 1.00 0.00 C ATOM 492 CG ARG A 34 -9.678 12.793 -3.528 1.00 0.00 C ATOM 493 CD ARG A 34 -9.357 14.194 -4.052 1.00 0.00 C ATOM 494 NE ARG A 34 -10.513 14.731 -4.803 1.00 0.00 N ATOM 495 CZ ARG A 34 -10.534 15.936 -5.390 1.00 0.00 C ATOM 496 NH1 ARG A 34 -9.462 16.736 -5.315 1.00 0.00 N ATOM 497 NH2 ARG A 34 -11.628 16.340 -6.050 1.00 0.00 N ATOM 0 H ARG A 34 -8.288 14.125 -1.680 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.171 11.495 -1.156 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.532 12.578 -3.488 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -8.401 11.056 -3.471 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.172 12.213 -4.308 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -10.376 12.864 -2.693 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -9.114 14.855 -3.220 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -8.479 14.158 -4.697 1.00 0.00 H new ATOM 0 HE ARG A 34 -11.346 14.148 -4.879 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -8.630 16.428 -4.811 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -9.478 17.653 -5.762 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -12.444 15.731 -6.106 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -11.645 17.257 -6.497 1.00 0.00 H new ATOM 511 N ALA A 35 -6.828 11.208 0.162 1.00 0.00 N ATOM 512 CA ALA A 35 -5.647 10.548 0.691 1.00 0.00 C ATOM 513 C ALA A 35 -6.074 9.329 1.511 1.00 0.00 C ATOM 514 O ALA A 35 -6.987 9.416 2.331 1.00 0.00 O ATOM 515 CB ALA A 35 -4.829 11.546 1.513 1.00 0.00 C ATOM 0 H ALA A 35 -7.468 11.568 0.870 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.010 10.194 -0.119 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.943 11.051 1.910 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.526 12.378 0.878 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.435 11.921 2.338 1.00 0.00 H new ATOM 521 N ILE A 36 -5.393 8.220 1.262 1.00 0.00 N ATOM 522 CA ILE A 36 -5.690 6.984 1.967 1.00 0.00 C ATOM 523 C ILE A 36 -4.470 6.565 2.788 1.00 0.00 C ATOM 524 O ILE A 36 -3.342 6.614 2.300 1.00 0.00 O ATOM 525 CB ILE A 36 -6.172 5.911 0.988 1.00 0.00 C ATOM 526 CG1 ILE A 36 -7.360 6.413 0.165 1.00 0.00 C ATOM 527 CG2 ILE A 36 -6.492 4.606 1.720 1.00 0.00 C ATOM 528 CD1 ILE A 36 -7.732 5.410 -0.928 1.00 0.00 C ATOM 0 H ILE A 36 -4.636 8.151 0.582 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.511 7.133 2.669 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.363 5.698 0.289 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.216 6.578 0.819 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.114 7.374 -0.287 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.832 3.860 1.002 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.596 4.242 2.224 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -7.276 4.785 2.456 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.579 5.791 -1.498 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -6.881 5.266 -1.594 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.001 4.457 -0.471 1.00 0.00 H new ATOM 540 N ASN A 37 -4.737 6.161 4.021 1.00 0.00 N ATOM 541 CA ASN A 37 -3.674 5.732 4.915 1.00 0.00 C ATOM 542 C ASN A 37 -3.485 4.220 4.787 1.00 0.00 C ATOM 543 O ASN A 37 -4.349 3.445 5.196 1.00 0.00 O ATOM 544 CB ASN A 37 -4.021 6.044 6.372 1.00 0.00 C ATOM 545 CG ASN A 37 -2.996 6.999 6.988 1.00 0.00 C ATOM 546 OD1 ASN A 37 -1.805 6.917 6.738 1.00 0.00 O ATOM 547 ND2 ASN A 37 -3.524 7.907 7.804 1.00 0.00 N ATOM 0 H ASN A 37 -5.674 6.122 4.422 1.00 0.00 H new ATOM 0 HA ASN A 37 -2.765 6.266 4.639 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.015 6.488 6.426 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -4.053 5.119 6.948 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -2.923 8.590 8.264 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -4.530 7.920 7.970 1.00 0.00 H new ATOM 554 N LEU A 38 -2.349 3.844 4.218 1.00 0.00 N ATOM 555 CA LEU A 38 -2.035 2.437 4.031 1.00 0.00 C ATOM 556 C LEU A 38 -1.253 1.928 5.243 1.00 0.00 C ATOM 557 O LEU A 38 -0.338 2.597 5.722 1.00 0.00 O ATOM 558 CB LEU A 38 -1.314 2.221 2.699 1.00 0.00 C ATOM 559 CG LEU A 38 -1.735 0.986 1.901 1.00 0.00 C ATOM 560 CD1 LEU A 38 -0.978 -0.257 2.374 1.00 0.00 C ATOM 561 CD2 LEU A 38 -3.251 0.789 1.955 1.00 0.00 C ATOM 0 H LEU A 38 -1.635 4.489 3.880 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.950 1.847 3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.471 3.102 2.077 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.244 2.155 2.894 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.468 1.147 0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.296 -1.121 1.790 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.093 -0.103 2.241 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.191 -0.433 3.428 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.524 -0.096 1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.564 0.659 2.991 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.747 1.663 1.533 1.00 0.00 H new ATOM 573 N THR A 39 -1.641 0.749 5.705 1.00 0.00 N ATOM 574 CA THR A 39 -0.987 0.142 6.853 1.00 0.00 C ATOM 575 C THR A 39 -0.828 -1.364 6.641 1.00 0.00 C ATOM 576 O THR A 39 -1.808 -2.069 6.405 1.00 0.00 O ATOM 577 CB THR A 39 -1.797 0.498 8.101 1.00 0.00 C ATOM 578 OG1 THR A 39 -3.075 -0.087 7.864 1.00 0.00 O ATOM 579 CG2 THR A 39 -2.087 1.997 8.204 1.00 0.00 C ATOM 0 H THR A 39 -2.400 0.197 5.306 1.00 0.00 H new ATOM 0 HA THR A 39 0.024 0.529 6.983 1.00 0.00 H new ATOM 0 HB THR A 39 -1.256 0.171 8.989 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.065 -0.558 7.005 1.00 0.00 H new ATOM 0 HG21 THR A 39 -2.664 2.195 9.107 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.147 2.547 8.246 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.657 2.318 7.332 1.00 0.00 H new ATOM 587 N TRP A 40 0.415 -1.814 6.733 1.00 0.00 N ATOM 588 CA TRP A 40 0.716 -3.225 6.554 1.00 0.00 C ATOM 589 C TRP A 40 1.681 -3.646 7.663 1.00 0.00 C ATOM 590 O TRP A 40 2.118 -2.817 8.459 1.00 0.00 O ATOM 591 CB TRP A 40 1.262 -3.496 5.151 1.00 0.00 C ATOM 592 CG TRP A 40 2.584 -2.786 4.850 1.00 0.00 C ATOM 593 CD1 TRP A 40 3.827 -3.270 4.978 1.00 0.00 C ATOM 594 CD2 TRP A 40 2.744 -1.438 4.362 1.00 0.00 C ATOM 595 NE1 TRP A 40 4.773 -2.335 4.610 1.00 0.00 N ATOM 596 CE2 TRP A 40 4.094 -1.186 4.223 1.00 0.00 C ATOM 597 CE3 TRP A 40 1.781 -0.463 4.047 1.00 0.00 C ATOM 598 CZ2 TRP A 40 4.603 0.036 3.768 1.00 0.00 C ATOM 599 CZ3 TRP A 40 2.306 0.753 3.593 1.00 0.00 C ATOM 600 CH2 TRP A 40 3.662 1.022 3.448 1.00 0.00 C ATOM 0 H TRP A 40 1.226 -1.227 6.929 1.00 0.00 H new ATOM 0 HA TRP A 40 -0.190 -3.826 6.634 1.00 0.00 H new ATOM 0 HB2 TRP A 40 1.402 -4.570 5.028 1.00 0.00 H new ATOM 0 HB3 TRP A 40 0.519 -3.185 4.417 1.00 0.00 H new ATOM 0 HD1 TRP A 40 4.059 -4.266 5.325 1.00 0.00 H new ATOM 0 HE1 TRP A 40 5.785 -2.464 4.620 1.00 0.00 H new ATOM 0 HE3 TRP A 40 0.720 -0.638 4.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 5.664 0.209 3.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 1.608 1.537 3.338 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.988 1.987 3.090 1.00 0.00 H new ATOM 611 N THR A 41 1.987 -4.936 7.680 1.00 0.00 N ATOM 612 CA THR A 41 2.893 -5.478 8.678 1.00 0.00 C ATOM 613 C THR A 41 4.269 -5.739 8.063 1.00 0.00 C ATOM 614 O THR A 41 4.385 -5.942 6.855 1.00 0.00 O ATOM 615 CB THR A 41 2.246 -6.729 9.274 1.00 0.00 C ATOM 616 OG1 THR A 41 1.274 -6.219 10.183 1.00 0.00 O ATOM 617 CG2 THR A 41 3.208 -7.520 10.162 1.00 0.00 C ATOM 0 H THR A 41 1.623 -5.621 7.018 1.00 0.00 H new ATOM 0 HA THR A 41 3.063 -4.767 9.486 1.00 0.00 H new ATOM 0 HB THR A 41 1.886 -7.369 8.469 1.00 0.00 H new ATOM 0 HG1 THR A 41 0.805 -6.965 10.613 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.698 -8.398 10.559 1.00 0.00 H new ATOM 0 HG22 THR A 41 4.070 -7.836 9.574 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.543 -6.891 10.987 1.00 0.00 H new ATOM 625 N LYS A 42 5.278 -5.726 8.922 1.00 0.00 N ATOM 626 CA LYS A 42 6.642 -5.959 8.478 1.00 0.00 C ATOM 627 C LYS A 42 6.869 -7.463 8.313 1.00 0.00 C ATOM 628 O LYS A 42 6.857 -8.207 9.292 1.00 0.00 O ATOM 629 CB LYS A 42 7.636 -5.287 9.427 1.00 0.00 C ATOM 630 CG LYS A 42 8.873 -4.800 8.670 1.00 0.00 C ATOM 631 CD LYS A 42 10.015 -5.813 8.777 1.00 0.00 C ATOM 632 CE LYS A 42 11.362 -5.155 8.470 1.00 0.00 C ATOM 633 NZ LYS A 42 11.770 -4.267 9.582 1.00 0.00 N ATOM 0 H LYS A 42 5.178 -5.558 9.923 1.00 0.00 H new ATOM 0 HA LYS A 42 6.809 -5.502 7.503 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.156 -4.445 9.926 1.00 0.00 H new ATOM 0 HB3 LYS A 42 7.934 -5.990 10.204 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.622 -4.639 7.622 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.195 -3.839 9.072 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.035 -6.240 9.780 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.842 -6.636 8.084 1.00 0.00 H new ATOM 0 HE2 LYS A 42 12.120 -5.922 8.312 1.00 0.00 H new ATOM 0 HE3 LYS A 42 11.291 -4.581 7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.795 -4.099 9.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.266 -3.360 9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 11.536 -4.717 10.490 1.00 0.00 H new ATOM 647 N PRO A 43 7.078 -7.875 7.034 1.00 0.00 N ATOM 648 CA PRO A 43 7.308 -9.277 6.728 1.00 0.00 C ATOM 649 C PRO A 43 8.721 -9.701 7.132 1.00 0.00 C ATOM 650 O PRO A 43 9.519 -8.876 7.574 1.00 0.00 O ATOM 651 CB PRO A 43 7.055 -9.401 5.234 1.00 0.00 C ATOM 652 CG PRO A 43 7.147 -7.989 4.678 1.00 0.00 C ATOM 653 CD PRO A 43 7.099 -7.022 5.850 1.00 0.00 C ATOM 0 HA PRO A 43 6.650 -9.943 7.286 1.00 0.00 H new ATOM 0 HB2 PRO A 43 7.792 -10.054 4.766 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.074 -9.835 5.038 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.071 -7.860 4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 43 6.324 -7.796 3.990 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.966 -6.361 5.854 1.00 0.00 H new ATOM 0 HD3 PRO A 43 6.214 -6.387 5.804 1.00 0.00 H new ATOM 661 N PHE A 44 8.989 -10.988 6.965 1.00 0.00 N ATOM 662 CA PHE A 44 10.292 -11.532 7.307 1.00 0.00 C ATOM 663 C PHE A 44 11.257 -11.427 6.124 1.00 0.00 C ATOM 664 O PHE A 44 10.933 -11.846 5.014 1.00 0.00 O ATOM 665 CB PHE A 44 10.085 -13.009 7.650 1.00 0.00 C ATOM 666 CG PHE A 44 11.385 -13.798 7.816 1.00 0.00 C ATOM 667 CD1 PHE A 44 12.145 -14.092 6.728 1.00 0.00 C ATOM 668 CD2 PHE A 44 11.781 -14.204 9.053 1.00 0.00 C ATOM 669 CE1 PHE A 44 13.352 -14.824 6.882 1.00 0.00 C ATOM 670 CE2 PHE A 44 12.987 -14.936 9.207 1.00 0.00 C ATOM 671 CZ PHE A 44 13.748 -15.231 8.119 1.00 0.00 C ATOM 0 H PHE A 44 8.326 -11.670 6.597 1.00 0.00 H new ATOM 0 HA PHE A 44 10.719 -10.976 8.142 1.00 0.00 H new ATOM 0 HB2 PHE A 44 9.509 -13.080 8.573 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.488 -13.473 6.865 1.00 0.00 H new ATOM 0 HD1 PHE A 44 11.831 -13.769 5.747 1.00 0.00 H new ATOM 0 HD2 PHE A 44 11.178 -13.969 9.917 1.00 0.00 H new ATOM 0 HE1 PHE A 44 13.956 -15.058 6.018 1.00 0.00 H new ATOM 0 HE2 PHE A 44 13.301 -15.259 10.189 1.00 0.00 H new ATOM 0 HZ PHE A 44 14.666 -15.788 8.237 1.00 0.00 H new ATOM 681 N ASP A 45 12.424 -10.864 6.403 1.00 0.00 N ATOM 682 CA ASP A 45 13.439 -10.698 5.376 1.00 0.00 C ATOM 683 C ASP A 45 14.151 -12.033 5.148 1.00 0.00 C ATOM 684 O ASP A 45 14.537 -12.706 6.104 1.00 0.00 O ATOM 685 CB ASP A 45 14.488 -9.669 5.800 1.00 0.00 C ATOM 686 CG ASP A 45 15.556 -10.192 6.762 1.00 0.00 C ATOM 687 OD1 ASP A 45 15.167 -10.583 7.883 1.00 0.00 O ATOM 688 OD2 ASP A 45 16.738 -10.189 6.354 1.00 0.00 O ATOM 0 H ASP A 45 12.689 -10.517 7.325 1.00 0.00 H new ATOM 0 HA ASP A 45 12.945 -10.356 4.466 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.981 -9.286 4.907 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.980 -8.826 6.269 1.00 0.00 H new ATOM 693 N GLY A 46 14.305 -12.377 3.878 1.00 0.00 N ATOM 694 CA GLY A 46 14.964 -13.619 3.513 1.00 0.00 C ATOM 695 C GLY A 46 16.304 -13.762 4.239 1.00 0.00 C ATOM 696 O GLY A 46 16.622 -14.832 4.757 1.00 0.00 O ATOM 0 H GLY A 46 13.984 -11.817 3.088 1.00 0.00 H new ATOM 0 HA2 GLY A 46 14.320 -14.463 3.761 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.125 -13.646 2.435 1.00 0.00 H new ATOM 700 N ASN A 47 17.053 -12.669 4.252 1.00 0.00 N ATOM 701 CA ASN A 47 18.350 -12.660 4.906 1.00 0.00 C ATOM 702 C ASN A 47 18.909 -11.236 4.901 1.00 0.00 C ATOM 703 O ASN A 47 19.504 -10.795 5.883 1.00 0.00 O ATOM 704 CB ASN A 47 19.344 -13.560 4.169 1.00 0.00 C ATOM 705 CG ASN A 47 20.033 -14.524 5.137 1.00 0.00 C ATOM 706 OD1 ASN A 47 19.537 -14.828 6.209 1.00 0.00 O ATOM 707 ND2 ASN A 47 21.201 -14.987 4.700 1.00 0.00 N ATOM 0 H ASN A 47 16.786 -11.784 3.820 1.00 0.00 H new ATOM 0 HA ASN A 47 18.217 -13.026 5.924 1.00 0.00 H new ATOM 0 HB2 ASN A 47 18.824 -14.125 3.396 1.00 0.00 H new ATOM 0 HB3 ASN A 47 20.092 -12.947 3.667 1.00 0.00 H new ATOM 0 HD21 ASN A 47 21.738 -15.637 5.273 1.00 0.00 H new ATOM 0 HD22 ASN A 47 21.559 -14.692 3.792 1.00 0.00 H new ATOM 714 N SER A 48 18.697 -10.555 3.784 1.00 0.00 N ATOM 715 CA SER A 48 19.171 -9.189 3.639 1.00 0.00 C ATOM 716 C SER A 48 18.068 -8.207 4.038 1.00 0.00 C ATOM 717 O SER A 48 16.889 -8.555 4.028 1.00 0.00 O ATOM 718 CB SER A 48 19.632 -8.916 2.206 1.00 0.00 C ATOM 719 OG SER A 48 20.931 -8.332 2.165 1.00 0.00 O ATOM 0 H SER A 48 18.203 -10.924 2.971 1.00 0.00 H new ATOM 0 HA SER A 48 20.027 -9.052 4.300 1.00 0.00 H new ATOM 0 HB2 SER A 48 19.636 -9.849 1.643 1.00 0.00 H new ATOM 0 HB3 SER A 48 18.920 -8.251 1.717 1.00 0.00 H new ATOM 0 HG SER A 48 21.190 -8.175 1.233 1.00 0.00 H new ATOM 725 N PRO A 49 18.503 -6.966 4.388 1.00 0.00 N ATOM 726 CA PRO A 49 17.566 -5.931 4.790 1.00 0.00 C ATOM 727 C PRO A 49 16.821 -5.366 3.579 1.00 0.00 C ATOM 728 O PRO A 49 17.371 -5.305 2.480 1.00 0.00 O ATOM 729 CB PRO A 49 18.412 -4.891 5.505 1.00 0.00 C ATOM 730 CG PRO A 49 19.846 -5.151 5.074 1.00 0.00 C ATOM 731 CD PRO A 49 19.892 -6.519 4.411 1.00 0.00 C ATOM 0 HA PRO A 49 16.781 -6.306 5.446 1.00 0.00 H new ATOM 0 HB2 PRO A 49 18.100 -3.882 5.236 1.00 0.00 H new ATOM 0 HB3 PRO A 49 18.307 -4.979 6.586 1.00 0.00 H new ATOM 0 HG2 PRO A 49 20.182 -4.379 4.381 1.00 0.00 H new ATOM 0 HG3 PRO A 49 20.515 -5.121 5.934 1.00 0.00 H new ATOM 0 HD2 PRO A 49 20.305 -6.457 3.404 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.521 -7.210 4.972 1.00 0.00 H new ATOM 739 N LEU A 50 15.581 -4.966 3.820 1.00 0.00 N ATOM 740 CA LEU A 50 14.755 -4.408 2.763 1.00 0.00 C ATOM 741 C LEU A 50 15.448 -3.177 2.177 1.00 0.00 C ATOM 742 O LEU A 50 16.112 -2.433 2.897 1.00 0.00 O ATOM 743 CB LEU A 50 13.341 -4.132 3.278 1.00 0.00 C ATOM 744 CG LEU A 50 12.602 -5.327 3.883 1.00 0.00 C ATOM 745 CD1 LEU A 50 11.242 -4.904 4.443 1.00 0.00 C ATOM 746 CD2 LEU A 50 12.475 -6.465 2.869 1.00 0.00 C ATOM 0 H LEU A 50 15.128 -5.017 4.733 1.00 0.00 H new ATOM 0 HA LEU A 50 14.639 -5.125 1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.397 -3.346 4.031 1.00 0.00 H new ATOM 0 HB3 LEU A 50 12.745 -3.741 2.453 1.00 0.00 H new ATOM 0 HG LEU A 50 13.191 -5.705 4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.737 -5.772 4.867 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.386 -4.153 5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.633 -4.486 3.642 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.946 -7.302 3.325 1.00 0.00 H new ATOM 0 HD22 LEU A 50 11.920 -6.116 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 50 13.469 -6.789 2.560 1.00 0.00 H new ATOM 758 N ILE A 51 15.269 -2.999 0.876 1.00 0.00 N ATOM 759 CA ILE A 51 15.869 -1.871 0.185 1.00 0.00 C ATOM 760 C ILE A 51 14.789 -0.830 -0.116 1.00 0.00 C ATOM 761 O ILE A 51 15.016 0.369 0.040 1.00 0.00 O ATOM 762 CB ILE A 51 16.629 -2.344 -1.055 1.00 0.00 C ATOM 763 CG1 ILE A 51 17.971 -2.971 -0.670 1.00 0.00 C ATOM 764 CG2 ILE A 51 16.797 -1.206 -2.063 1.00 0.00 C ATOM 765 CD1 ILE A 51 18.722 -3.463 -1.909 1.00 0.00 C ATOM 0 H ILE A 51 14.717 -3.618 0.282 1.00 0.00 H new ATOM 0 HA ILE A 51 16.611 -1.387 0.820 1.00 0.00 H new ATOM 0 HB ILE A 51 16.038 -3.120 -1.541 1.00 0.00 H new ATOM 0 HG12 ILE A 51 18.579 -2.239 -0.139 1.00 0.00 H new ATOM 0 HG13 ILE A 51 17.805 -3.804 0.013 1.00 0.00 H new ATOM 0 HG21 ILE A 51 17.341 -1.570 -2.935 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.816 -0.845 -2.372 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.355 -0.391 -1.602 1.00 0.00 H new ATOM 0 HD11 ILE A 51 19.672 -3.904 -1.607 1.00 0.00 H new ATOM 0 HD12 ILE A 51 18.122 -4.212 -2.425 1.00 0.00 H new ATOM 0 HD13 ILE A 51 18.908 -2.624 -2.579 1.00 0.00 H new ATOM 777 N ARG A 52 13.636 -1.326 -0.541 1.00 0.00 N ATOM 778 CA ARG A 52 12.520 -0.454 -0.865 1.00 0.00 C ATOM 779 C ARG A 52 11.243 -1.275 -1.057 1.00 0.00 C ATOM 780 O ARG A 52 11.285 -2.504 -1.051 1.00 0.00 O ATOM 781 CB ARG A 52 12.799 0.347 -2.139 1.00 0.00 C ATOM 782 CG ARG A 52 12.445 -0.465 -3.386 1.00 0.00 C ATOM 783 CD ARG A 52 13.028 0.181 -4.644 1.00 0.00 C ATOM 784 NE ARG A 52 14.501 0.035 -4.652 1.00 0.00 N ATOM 785 CZ ARG A 52 15.143 -1.086 -5.006 1.00 0.00 C ATOM 786 NH1 ARG A 52 14.447 -2.167 -5.383 1.00 0.00 N ATOM 787 NH2 ARG A 52 16.482 -1.127 -4.982 1.00 0.00 N ATOM 0 H ARG A 52 13.451 -2.321 -0.668 1.00 0.00 H new ATOM 0 HA ARG A 52 12.389 0.239 -0.034 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.221 1.271 -2.126 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.851 0.630 -2.172 1.00 0.00 H new ATOM 0 HG2 ARG A 52 12.827 -1.481 -3.284 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.362 -0.540 -3.480 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.603 -0.286 -5.533 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.759 1.237 -4.679 1.00 0.00 H new ATOM 0 HE ARG A 52 15.062 0.839 -4.370 1.00 0.00 H new ATOM 0 HH11 ARG A 52 13.428 -2.137 -5.401 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.937 -3.020 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.012 -0.305 -4.694 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.971 -1.981 -5.252 1.00 0.00 H new ATOM 801 N TYR A 53 10.139 -0.562 -1.222 1.00 0.00 N ATOM 802 CA TYR A 53 8.852 -1.209 -1.415 1.00 0.00 C ATOM 803 C TYR A 53 8.145 -0.665 -2.657 1.00 0.00 C ATOM 804 O TYR A 53 8.128 0.544 -2.887 1.00 0.00 O ATOM 805 CB TYR A 53 8.019 -0.869 -0.178 1.00 0.00 C ATOM 806 CG TYR A 53 7.960 -1.990 0.861 1.00 0.00 C ATOM 807 CD1 TYR A 53 8.969 -2.120 1.794 1.00 0.00 C ATOM 808 CD2 TYR A 53 6.899 -2.872 0.866 1.00 0.00 C ATOM 809 CE1 TYR A 53 8.914 -3.175 2.773 1.00 0.00 C ATOM 810 CE2 TYR A 53 6.844 -3.927 1.844 1.00 0.00 C ATOM 811 CZ TYR A 53 7.854 -4.027 2.749 1.00 0.00 C ATOM 812 OH TYR A 53 7.802 -5.024 3.673 1.00 0.00 O ATOM 0 H TYR A 53 10.109 0.458 -1.226 1.00 0.00 H new ATOM 0 HA TYR A 53 8.979 -2.283 -1.551 1.00 0.00 H new ATOM 0 HB2 TYR A 53 8.431 0.025 0.290 1.00 0.00 H new ATOM 0 HB3 TYR A 53 7.004 -0.625 -0.492 1.00 0.00 H new ATOM 0 HD1 TYR A 53 9.800 -1.430 1.790 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.110 -2.771 0.136 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.696 -3.287 3.509 1.00 0.00 H new ATOM 0 HE2 TYR A 53 6.019 -4.624 1.859 1.00 0.00 H new ATOM 0 HH TYR A 53 6.897 -5.400 3.698 1.00 0.00 H new ATOM 822 N ILE A 54 7.578 -1.582 -3.427 1.00 0.00 N ATOM 823 CA ILE A 54 6.871 -1.209 -4.640 1.00 0.00 C ATOM 824 C ILE A 54 5.364 -1.327 -4.404 1.00 0.00 C ATOM 825 O ILE A 54 4.813 -2.426 -4.426 1.00 0.00 O ATOM 826 CB ILE A 54 7.374 -2.032 -5.828 1.00 0.00 C ATOM 827 CG1 ILE A 54 8.894 -1.928 -5.963 1.00 0.00 C ATOM 828 CG2 ILE A 54 6.654 -1.630 -7.117 1.00 0.00 C ATOM 829 CD1 ILE A 54 9.443 -3.040 -6.859 1.00 0.00 C ATOM 0 H ILE A 54 7.594 -2.583 -3.234 1.00 0.00 H new ATOM 0 HA ILE A 54 7.073 -0.169 -4.894 1.00 0.00 H new ATOM 0 HB ILE A 54 7.139 -3.080 -5.642 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.160 -0.956 -6.379 1.00 0.00 H new ATOM 0 HG13 ILE A 54 9.355 -1.990 -4.977 1.00 0.00 H new ATOM 0 HG21 ILE A 54 7.030 -2.230 -7.946 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.583 -1.799 -7.003 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.835 -0.575 -7.321 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.526 -2.942 -6.938 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.197 -4.010 -6.427 1.00 0.00 H new ATOM 0 HD13 ILE A 54 8.998 -2.961 -7.851 1.00 0.00 H new ATOM 841 N LEU A 55 4.740 -0.179 -4.184 1.00 0.00 N ATOM 842 CA LEU A 55 3.308 -0.139 -3.944 1.00 0.00 C ATOM 843 C LEU A 55 2.575 -0.004 -5.280 1.00 0.00 C ATOM 844 O LEU A 55 2.889 0.878 -6.078 1.00 0.00 O ATOM 845 CB LEU A 55 2.963 0.962 -2.939 1.00 0.00 C ATOM 846 CG LEU A 55 1.513 1.449 -2.949 1.00 0.00 C ATOM 847 CD1 LEU A 55 0.605 0.483 -2.183 1.00 0.00 C ATOM 848 CD2 LEU A 55 1.410 2.878 -2.413 1.00 0.00 C ATOM 0 H LEU A 55 5.201 0.731 -4.167 1.00 0.00 H new ATOM 0 HA LEU A 55 2.972 -1.070 -3.488 1.00 0.00 H new ATOM 0 HB2 LEU A 55 3.197 0.599 -1.938 1.00 0.00 H new ATOM 0 HB3 LEU A 55 3.613 1.816 -3.128 1.00 0.00 H new ATOM 0 HG LEU A 55 1.166 1.467 -3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.420 0.852 -2.205 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.646 -0.502 -2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.942 0.410 -1.149 1.00 0.00 H new ATOM 0 HD21 LEU A 55 0.369 3.199 -2.431 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.782 2.910 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.006 3.544 -3.036 1.00 0.00 H new ATOM 860 N GLU A 56 1.611 -0.890 -5.482 1.00 0.00 N ATOM 861 CA GLU A 56 0.831 -0.881 -6.708 1.00 0.00 C ATOM 862 C GLU A 56 -0.653 -0.684 -6.391 1.00 0.00 C ATOM 863 O GLU A 56 -1.235 -1.453 -5.628 1.00 0.00 O ATOM 864 CB GLU A 56 1.055 -2.164 -7.511 1.00 0.00 C ATOM 865 CG GLU A 56 2.229 -2.007 -8.479 1.00 0.00 C ATOM 866 CD GLU A 56 2.525 -3.324 -9.200 1.00 0.00 C ATOM 867 OE1 GLU A 56 3.333 -4.103 -8.650 1.00 0.00 O ATOM 868 OE2 GLU A 56 1.936 -3.522 -10.285 1.00 0.00 O ATOM 0 H GLU A 56 1.352 -1.619 -4.817 1.00 0.00 H new ATOM 0 HA GLU A 56 1.166 -0.045 -7.322 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.248 -2.994 -6.831 1.00 0.00 H new ATOM 0 HB3 GLU A 56 0.151 -2.412 -8.067 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.001 -1.231 -9.210 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.114 -1.680 -7.933 1.00 0.00 H new ATOM 875 N MET A 57 -1.222 0.350 -6.993 1.00 0.00 N ATOM 876 CA MET A 57 -2.627 0.657 -6.785 1.00 0.00 C ATOM 877 C MET A 57 -3.457 0.287 -8.015 1.00 0.00 C ATOM 878 O MET A 57 -2.974 0.371 -9.143 1.00 0.00 O ATOM 879 CB MET A 57 -2.785 2.150 -6.493 1.00 0.00 C ATOM 880 CG MET A 57 -4.260 2.556 -6.495 1.00 0.00 C ATOM 881 SD MET A 57 -4.404 4.335 -6.484 1.00 0.00 S ATOM 882 CE MET A 57 -4.098 4.682 -8.208 1.00 0.00 C ATOM 0 H MET A 57 -0.736 0.986 -7.625 1.00 0.00 H new ATOM 0 HA MET A 57 -2.986 0.072 -5.938 1.00 0.00 H new ATOM 0 HB2 MET A 57 -2.341 2.384 -5.525 1.00 0.00 H new ATOM 0 HB3 MET A 57 -2.244 2.730 -7.241 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.757 2.148 -7.375 1.00 0.00 H new ATOM 0 HG3 MET A 57 -4.762 2.137 -5.623 1.00 0.00 H new ATOM 0 HE1 MET A 57 -3.339 5.460 -8.293 1.00 0.00 H new ATOM 0 HE2 MET A 57 -3.748 3.777 -8.705 1.00 0.00 H new ATOM 0 HE3 MET A 57 -5.020 5.021 -8.680 1.00 0.00 H new ATOM 892 N SER A 58 -4.693 -0.115 -7.756 1.00 0.00 N ATOM 893 CA SER A 58 -5.596 -0.499 -8.829 1.00 0.00 C ATOM 894 C SER A 58 -6.861 0.360 -8.780 1.00 0.00 C ATOM 895 O SER A 58 -7.677 0.219 -7.870 1.00 0.00 O ATOM 896 CB SER A 58 -5.957 -1.982 -8.740 1.00 0.00 C ATOM 897 OG SER A 58 -7.248 -2.250 -9.281 1.00 0.00 O ATOM 0 H SER A 58 -5.091 -0.183 -6.819 1.00 0.00 H new ATOM 0 HA SER A 58 -5.089 -0.333 -9.779 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.211 -2.570 -9.275 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.927 -2.301 -7.698 1.00 0.00 H new ATOM 0 HG SER A 58 -7.189 -2.302 -10.258 1.00 0.00 H new ATOM 903 N GLU A 59 -6.985 1.232 -9.770 1.00 0.00 N ATOM 904 CA GLU A 59 -8.137 2.113 -9.851 1.00 0.00 C ATOM 905 C GLU A 59 -9.354 1.349 -10.378 1.00 0.00 C ATOM 906 O GLU A 59 -9.560 1.262 -11.588 1.00 0.00 O ATOM 907 CB GLU A 59 -7.835 3.332 -10.725 1.00 0.00 C ATOM 908 CG GLU A 59 -8.834 4.459 -10.459 1.00 0.00 C ATOM 909 CD GLU A 59 -8.562 5.659 -11.368 1.00 0.00 C ATOM 910 OE1 GLU A 59 -9.123 5.663 -12.485 1.00 0.00 O ATOM 911 OE2 GLU A 59 -7.799 6.545 -10.926 1.00 0.00 O ATOM 0 H GLU A 59 -6.306 1.347 -10.523 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.365 2.474 -8.848 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.823 3.684 -10.526 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.873 3.048 -11.777 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.849 4.097 -10.623 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.771 4.767 -9.415 1.00 0.00 H new ATOM 918 N ASN A 60 -10.127 0.815 -9.444 1.00 0.00 N ATOM 919 CA ASN A 60 -11.317 0.061 -9.799 1.00 0.00 C ATOM 920 C ASN A 60 -10.922 -1.118 -10.689 1.00 0.00 C ATOM 921 O ASN A 60 -10.546 -2.178 -10.191 1.00 0.00 O ATOM 922 CB ASN A 60 -12.307 0.930 -10.578 1.00 0.00 C ATOM 923 CG ASN A 60 -13.228 1.699 -9.627 1.00 0.00 C ATOM 924 OD1 ASN A 60 -14.078 1.137 -8.955 1.00 0.00 O ATOM 925 ND2 ASN A 60 -13.012 3.011 -9.608 1.00 0.00 N ATOM 0 H ASN A 60 -9.952 0.890 -8.442 1.00 0.00 H new ATOM 0 HA ASN A 60 -11.786 -0.283 -8.877 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -11.762 1.632 -11.209 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -12.904 0.303 -11.240 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.574 3.612 -9.005 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.284 3.417 -10.196 1.00 0.00 H new ATOM 932 N ASN A 61 -11.021 -0.895 -11.992 1.00 0.00 N ATOM 933 CA ASN A 61 -10.679 -1.927 -12.956 1.00 0.00 C ATOM 934 C ASN A 61 -9.373 -1.549 -13.658 1.00 0.00 C ATOM 935 O ASN A 61 -9.186 -1.855 -14.835 1.00 0.00 O ATOM 936 CB ASN A 61 -11.766 -2.066 -14.023 1.00 0.00 C ATOM 937 CG ASN A 61 -12.916 -2.943 -13.522 1.00 0.00 C ATOM 938 OD1 ASN A 61 -12.738 -3.853 -12.729 1.00 0.00 O ATOM 939 ND2 ASN A 61 -14.103 -2.620 -14.028 1.00 0.00 N ATOM 0 H ASN A 61 -11.333 -0.015 -12.402 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.578 -2.870 -12.419 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.146 -1.080 -14.291 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.340 -2.500 -14.927 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.934 -3.146 -13.756 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -14.183 -1.846 -14.688 1.00 0.00 H new ATOM 946 N ALA A 62 -8.504 -0.889 -12.907 1.00 0.00 N ATOM 947 CA ALA A 62 -7.221 -0.467 -13.443 1.00 0.00 C ATOM 948 C ALA A 62 -6.155 -1.503 -13.082 1.00 0.00 C ATOM 949 O ALA A 62 -6.237 -2.144 -12.035 1.00 0.00 O ATOM 950 CB ALA A 62 -6.881 0.928 -12.913 1.00 0.00 C ATOM 0 H ALA A 62 -8.663 -0.636 -11.932 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.262 -0.403 -14.530 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -5.919 1.245 -13.315 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.653 1.633 -13.222 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.829 0.901 -11.825 1.00 0.00 H new ATOM 956 N PRO A 63 -5.154 -1.639 -13.992 1.00 0.00 N ATOM 957 CA PRO A 63 -4.074 -2.588 -13.780 1.00 0.00 C ATOM 958 C PRO A 63 -3.092 -2.073 -12.725 1.00 0.00 C ATOM 959 O PRO A 63 -2.848 -0.871 -12.633 1.00 0.00 O ATOM 960 CB PRO A 63 -3.435 -2.769 -15.147 1.00 0.00 C ATOM 961 CG PRO A 63 -3.878 -1.574 -15.976 1.00 0.00 C ATOM 962 CD PRO A 63 -5.024 -0.897 -15.242 1.00 0.00 C ATOM 0 HA PRO A 63 -4.424 -3.543 -13.389 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.349 -2.808 -15.068 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -3.755 -3.704 -15.607 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -3.050 -0.879 -16.116 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -4.196 -1.894 -16.968 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -4.809 0.155 -15.057 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.945 -0.937 -15.824 1.00 0.00 H new ATOM 970 N TRP A 64 -2.555 -3.009 -11.956 1.00 0.00 N ATOM 971 CA TRP A 64 -1.606 -2.665 -10.911 1.00 0.00 C ATOM 972 C TRP A 64 -0.621 -1.644 -11.485 1.00 0.00 C ATOM 973 O TRP A 64 0.220 -1.986 -12.315 1.00 0.00 O ATOM 974 CB TRP A 64 -0.917 -3.916 -10.363 1.00 0.00 C ATOM 975 CG TRP A 64 -1.883 -4.967 -9.812 1.00 0.00 C ATOM 976 CD1 TRP A 64 -2.108 -6.205 -10.275 1.00 0.00 C ATOM 977 CD2 TRP A 64 -2.752 -4.822 -8.669 1.00 0.00 C ATOM 978 NE1 TRP A 64 -3.053 -6.865 -9.517 1.00 0.00 N ATOM 979 CE2 TRP A 64 -3.457 -5.997 -8.509 1.00 0.00 C ATOM 980 CE3 TRP A 64 -2.935 -3.733 -7.798 1.00 0.00 C ATOM 981 CZ2 TRP A 64 -4.394 -6.196 -7.488 1.00 0.00 C ATOM 982 CZ3 TRP A 64 -3.875 -3.948 -6.783 1.00 0.00 C ATOM 983 CH2 TRP A 64 -4.593 -5.125 -6.608 1.00 0.00 C ATOM 0 H TRP A 64 -2.759 -4.005 -12.036 1.00 0.00 H new ATOM 0 HA TRP A 64 -2.116 -2.216 -10.059 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -0.320 -4.366 -11.156 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -0.227 -3.622 -9.572 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -1.612 -6.632 -11.134 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -3.393 -7.815 -9.668 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.393 -2.805 -7.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -4.934 -7.125 -7.385 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -4.055 -3.142 -6.087 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -5.301 -5.213 -5.797 1.00 0.00 H new ATOM 994 N THR A 65 -0.758 -0.411 -11.019 1.00 0.00 N ATOM 995 CA THR A 65 0.109 0.662 -11.475 1.00 0.00 C ATOM 996 C THR A 65 1.078 1.073 -10.364 1.00 0.00 C ATOM 997 O THR A 65 0.656 1.570 -9.321 1.00 0.00 O ATOM 998 CB THR A 65 -0.776 1.809 -11.966 1.00 0.00 C ATOM 999 OG1 THR A 65 0.022 2.469 -12.944 1.00 0.00 O ATOM 1000 CG2 THR A 65 -1.004 2.873 -10.890 1.00 0.00 C ATOM 0 H THR A 65 -1.457 -0.131 -10.330 1.00 0.00 H new ATOM 0 HA THR A 65 0.736 0.338 -12.306 1.00 0.00 H new ATOM 0 HB THR A 65 -1.737 1.412 -12.294 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.477 3.226 -13.316 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.638 3.664 -11.290 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.491 2.419 -10.027 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.046 3.294 -10.586 1.00 0.00 H new ATOM 1008 N VAL A 66 2.357 0.852 -10.627 1.00 0.00 N ATOM 1009 CA VAL A 66 3.389 1.193 -9.662 1.00 0.00 C ATOM 1010 C VAL A 66 3.284 2.680 -9.314 1.00 0.00 C ATOM 1011 O VAL A 66 3.738 3.533 -10.075 1.00 0.00 O ATOM 1012 CB VAL A 66 4.765 0.803 -10.207 1.00 0.00 C ATOM 1013 CG1 VAL A 66 5.877 1.245 -9.254 1.00 0.00 C ATOM 1014 CG2 VAL A 66 4.840 -0.701 -10.478 1.00 0.00 C ATOM 0 H VAL A 66 2.703 0.441 -11.494 1.00 0.00 H new ATOM 0 HA VAL A 66 3.249 0.631 -8.738 1.00 0.00 H new ATOM 0 HB VAL A 66 4.910 1.322 -11.154 1.00 0.00 H new ATOM 0 HG11 VAL A 66 6.844 0.956 -9.665 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.843 2.328 -9.133 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.737 0.767 -8.285 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.828 -0.952 -10.865 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.663 -1.247 -9.551 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.082 -0.977 -11.212 1.00 0.00 H new ATOM 1024 N LEU A 67 2.682 2.944 -8.164 1.00 0.00 N ATOM 1025 CA LEU A 67 2.511 4.313 -7.706 1.00 0.00 C ATOM 1026 C LEU A 67 3.810 4.795 -7.058 1.00 0.00 C ATOM 1027 O LEU A 67 4.380 5.802 -7.476 1.00 0.00 O ATOM 1028 CB LEU A 67 1.290 4.423 -6.792 1.00 0.00 C ATOM 1029 CG LEU A 67 0.705 5.826 -6.620 1.00 0.00 C ATOM 1030 CD1 LEU A 67 0.269 6.407 -7.967 1.00 0.00 C ATOM 1031 CD2 LEU A 67 -0.437 5.824 -5.601 1.00 0.00 C ATOM 0 H LEU A 67 2.307 2.234 -7.536 1.00 0.00 H new ATOM 0 HA LEU A 67 2.310 4.975 -8.549 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.509 3.771 -7.182 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.562 4.041 -5.808 1.00 0.00 H new ATOM 0 HG LEU A 67 1.487 6.475 -6.226 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.143 7.405 -7.817 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.130 6.467 -8.633 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.490 5.764 -8.412 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.835 6.834 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.228 5.156 -5.942 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.063 5.481 -4.636 1.00 0.00 H new ATOM 1043 N LEU A 68 4.241 4.053 -6.049 1.00 0.00 N ATOM 1044 CA LEU A 68 5.463 4.393 -5.339 1.00 0.00 C ATOM 1045 C LEU A 68 6.506 3.299 -5.577 1.00 0.00 C ATOM 1046 O LEU A 68 6.356 2.177 -5.096 1.00 0.00 O ATOM 1047 CB LEU A 68 5.169 4.650 -3.860 1.00 0.00 C ATOM 1048 CG LEU A 68 5.510 6.049 -3.342 1.00 0.00 C ATOM 1049 CD1 LEU A 68 5.100 6.206 -1.876 1.00 0.00 C ATOM 1050 CD2 LEU A 68 6.991 6.368 -3.560 1.00 0.00 C ATOM 0 H LEU A 68 3.766 3.218 -5.706 1.00 0.00 H new ATOM 0 HA LEU A 68 5.881 5.323 -5.724 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.109 4.467 -3.683 1.00 0.00 H new ATOM 0 HB3 LEU A 68 5.721 3.920 -3.268 1.00 0.00 H new ATOM 0 HG LEU A 68 4.936 6.776 -3.917 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.353 7.209 -1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.025 6.050 -1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.629 5.471 -1.270 1.00 0.00 H new ATOM 0 HD21 LEU A 68 7.207 7.368 -3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.602 5.639 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.220 6.324 -4.625 1.00 0.00 H new ATOM 1062 N ALA A 69 7.541 3.665 -6.319 1.00 0.00 N ATOM 1063 CA ALA A 69 8.609 2.730 -6.627 1.00 0.00 C ATOM 1064 C ALA A 69 9.535 2.603 -5.416 1.00 0.00 C ATOM 1065 O ALA A 69 9.591 1.552 -4.780 1.00 0.00 O ATOM 1066 CB ALA A 69 9.351 3.196 -7.881 1.00 0.00 C ATOM 0 H ALA A 69 7.662 4.597 -6.716 1.00 0.00 H new ATOM 0 HA ALA A 69 8.203 1.741 -6.837 1.00 0.00 H new ATOM 0 HB1 ALA A 69 10.152 2.494 -8.112 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.656 3.241 -8.719 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.774 4.185 -7.707 1.00 0.00 H new ATOM 1072 N SER A 70 10.240 3.689 -5.133 1.00 0.00 N ATOM 1073 CA SER A 70 11.160 3.713 -4.009 1.00 0.00 C ATOM 1074 C SER A 70 10.418 4.115 -2.733 1.00 0.00 C ATOM 1075 O SER A 70 10.058 5.279 -2.561 1.00 0.00 O ATOM 1076 CB SER A 70 12.324 4.670 -4.271 1.00 0.00 C ATOM 1077 OG SER A 70 12.391 5.068 -5.638 1.00 0.00 O ATOM 0 H SER A 70 10.192 4.559 -5.663 1.00 0.00 H new ATOM 0 HA SER A 70 11.570 2.711 -3.882 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.216 5.553 -3.641 1.00 0.00 H new ATOM 0 HB3 SER A 70 13.260 4.189 -3.987 1.00 0.00 H new ATOM 0 HG SER A 70 13.146 5.680 -5.764 1.00 0.00 H new ATOM 1083 N VAL A 71 10.212 3.130 -1.871 1.00 0.00 N ATOM 1084 CA VAL A 71 9.519 3.367 -0.616 1.00 0.00 C ATOM 1085 C VAL A 71 10.444 3.005 0.548 1.00 0.00 C ATOM 1086 O VAL A 71 11.334 2.169 0.401 1.00 0.00 O ATOM 1087 CB VAL A 71 8.198 2.595 -0.593 1.00 0.00 C ATOM 1088 CG1 VAL A 71 7.682 2.434 0.838 1.00 0.00 C ATOM 1089 CG2 VAL A 71 7.152 3.272 -1.481 1.00 0.00 C ATOM 0 H VAL A 71 10.513 2.166 -2.017 1.00 0.00 H new ATOM 0 HA VAL A 71 9.265 4.422 -0.513 1.00 0.00 H new ATOM 0 HB VAL A 71 8.385 1.599 -0.995 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.742 1.882 0.826 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.416 1.888 1.430 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.519 3.417 1.279 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.223 2.703 -1.447 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.971 4.285 -1.122 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.516 3.310 -2.508 1.00 0.00 H new ATOM 1099 N ASP A 72 10.201 3.652 1.678 1.00 0.00 N ATOM 1100 CA ASP A 72 11.001 3.408 2.866 1.00 0.00 C ATOM 1101 C ASP A 72 10.703 2.004 3.397 1.00 0.00 C ATOM 1102 O ASP A 72 9.545 1.649 3.609 1.00 0.00 O ATOM 1103 CB ASP A 72 10.665 4.412 3.971 1.00 0.00 C ATOM 1104 CG ASP A 72 11.783 5.401 4.308 1.00 0.00 C ATOM 1105 OD1 ASP A 72 11.987 6.326 3.492 1.00 0.00 O ATOM 1106 OD2 ASP A 72 12.408 5.209 5.373 1.00 0.00 O ATOM 0 H ASP A 72 9.462 4.345 1.796 1.00 0.00 H new ATOM 0 HA ASP A 72 12.051 3.510 2.592 1.00 0.00 H new ATOM 0 HB2 ASP A 72 9.780 4.975 3.673 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.403 3.861 4.874 1.00 0.00 H new ATOM 1111 N PRO A 73 11.798 1.223 3.601 1.00 0.00 N ATOM 1112 CA PRO A 73 11.666 -0.134 4.103 1.00 0.00 C ATOM 1113 C PRO A 73 11.342 -0.137 5.598 1.00 0.00 C ATOM 1114 O PRO A 73 10.810 -1.115 6.120 1.00 0.00 O ATOM 1115 CB PRO A 73 12.992 -0.803 3.781 1.00 0.00 C ATOM 1116 CG PRO A 73 13.979 0.326 3.534 1.00 0.00 C ATOM 1117 CD PRO A 73 13.185 1.610 3.361 1.00 0.00 C ATOM 0 HA PRO A 73 10.840 -0.675 3.641 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.321 -1.436 4.605 1.00 0.00 H new ATOM 0 HB3 PRO A 73 12.903 -1.443 2.903 1.00 0.00 H new ATOM 0 HG2 PRO A 73 14.673 0.416 4.370 1.00 0.00 H new ATOM 0 HG3 PRO A 73 14.576 0.124 2.645 1.00 0.00 H new ATOM 0 HD2 PRO A 73 13.510 2.375 4.066 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.313 2.023 2.361 1.00 0.00 H new ATOM 1125 N LYS A 74 11.677 0.970 6.246 1.00 0.00 N ATOM 1126 CA LYS A 74 11.429 1.107 7.671 1.00 0.00 C ATOM 1127 C LYS A 74 10.022 1.668 7.887 1.00 0.00 C ATOM 1128 O LYS A 74 9.671 2.063 8.998 1.00 0.00 O ATOM 1129 CB LYS A 74 12.530 1.941 8.329 1.00 0.00 C ATOM 1130 CG LYS A 74 13.914 1.374 8.005 1.00 0.00 C ATOM 1131 CD LYS A 74 14.847 1.482 9.213 1.00 0.00 C ATOM 1132 CE LYS A 74 14.994 2.937 9.663 1.00 0.00 C ATOM 1133 NZ LYS A 74 15.282 3.003 11.114 1.00 0.00 N ATOM 0 H LYS A 74 12.118 1.780 5.810 1.00 0.00 H new ATOM 0 HA LYS A 74 11.464 0.133 8.159 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.466 2.973 7.983 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.383 1.957 9.409 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.822 0.330 7.704 1.00 0.00 H new ATOM 0 HG3 LYS A 74 14.343 1.913 7.160 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.456 0.881 10.034 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.826 1.075 8.959 1.00 0.00 H new ATOM 0 HE2 LYS A 74 15.797 3.418 9.104 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.079 3.487 9.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.379 3.997 11.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.502 2.563 11.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.167 2.496 11.316 1.00 0.00 H new ATOM 1147 N ALA A 75 9.254 1.684 6.808 1.00 0.00 N ATOM 1148 CA ALA A 75 7.892 2.189 6.865 1.00 0.00 C ATOM 1149 C ALA A 75 6.915 1.041 6.609 1.00 0.00 C ATOM 1150 O ALA A 75 7.144 0.210 5.730 1.00 0.00 O ATOM 1151 CB ALA A 75 7.728 3.330 5.859 1.00 0.00 C ATOM 0 H ALA A 75 9.549 1.355 5.888 1.00 0.00 H new ATOM 0 HA ALA A 75 7.674 2.592 7.854 1.00 0.00 H new ATOM 0 HB1 ALA A 75 6.707 3.709 5.902 1.00 0.00 H new ATOM 0 HB2 ALA A 75 8.423 4.133 6.103 1.00 0.00 H new ATOM 0 HB3 ALA A 75 7.937 2.962 4.854 1.00 0.00 H new ATOM 1157 N THR A 76 5.846 1.030 7.391 1.00 0.00 N ATOM 1158 CA THR A 76 4.833 -0.004 7.260 1.00 0.00 C ATOM 1159 C THR A 76 3.503 0.607 6.812 1.00 0.00 C ATOM 1160 O THR A 76 2.495 -0.092 6.719 1.00 0.00 O ATOM 1161 CB THR A 76 4.741 -0.748 8.593 1.00 0.00 C ATOM 1162 OG1 THR A 76 4.901 0.274 9.573 1.00 0.00 O ATOM 1163 CG2 THR A 76 5.933 -1.678 8.828 1.00 0.00 C ATOM 0 H THR A 76 5.659 1.721 8.118 1.00 0.00 H new ATOM 0 HA THR A 76 5.101 -0.725 6.487 1.00 0.00 H new ATOM 0 HB THR A 76 3.818 -1.326 8.622 1.00 0.00 H new ATOM 0 HG1 THR A 76 4.853 -0.121 10.469 1.00 0.00 H new ATOM 0 HG21 THR A 76 5.818 -2.181 9.788 1.00 0.00 H new ATOM 0 HG22 THR A 76 5.977 -2.421 8.032 1.00 0.00 H new ATOM 0 HG23 THR A 76 6.854 -1.095 8.832 1.00 0.00 H new ATOM 1171 N SER A 77 3.544 1.904 6.547 1.00 0.00 N ATOM 1172 CA SER A 77 2.355 2.617 6.111 1.00 0.00 C ATOM 1173 C SER A 77 2.738 3.712 5.113 1.00 0.00 C ATOM 1174 O SER A 77 3.823 4.284 5.200 1.00 0.00 O ATOM 1175 CB SER A 77 1.608 3.221 7.301 1.00 0.00 C ATOM 1176 OG SER A 77 2.495 3.831 8.234 1.00 0.00 O ATOM 0 H SER A 77 4.382 2.480 6.626 1.00 0.00 H new ATOM 0 HA SER A 77 1.689 1.906 5.622 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.893 3.962 6.942 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.034 2.442 7.802 1.00 0.00 H new ATOM 0 HG SER A 77 1.980 4.206 8.978 1.00 0.00 H new ATOM 1182 N VAL A 78 1.825 3.971 4.189 1.00 0.00 N ATOM 1183 CA VAL A 78 2.053 4.987 3.176 1.00 0.00 C ATOM 1184 C VAL A 78 0.725 5.666 2.833 1.00 0.00 C ATOM 1185 O VAL A 78 -0.338 5.061 2.963 1.00 0.00 O ATOM 1186 CB VAL A 78 2.739 4.366 1.957 1.00 0.00 C ATOM 1187 CG1 VAL A 78 1.774 3.465 1.184 1.00 0.00 C ATOM 1188 CG2 VAL A 78 3.326 5.449 1.048 1.00 0.00 C ATOM 0 H VAL A 78 0.926 3.495 4.121 1.00 0.00 H new ATOM 0 HA VAL A 78 2.725 5.758 3.553 1.00 0.00 H new ATOM 0 HB VAL A 78 3.561 3.746 2.315 1.00 0.00 H new ATOM 0 HG11 VAL A 78 2.287 3.037 0.323 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.425 2.663 1.834 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.922 4.053 0.843 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.808 4.981 0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.528 6.106 0.703 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.061 6.031 1.604 1.00 0.00 H new ATOM 1198 N THR A 79 0.830 6.914 2.401 1.00 0.00 N ATOM 1199 CA THR A 79 -0.349 7.682 2.039 1.00 0.00 C ATOM 1200 C THR A 79 -0.479 7.774 0.517 1.00 0.00 C ATOM 1201 O THR A 79 0.496 8.060 -0.176 1.00 0.00 O ATOM 1202 CB THR A 79 -0.253 9.047 2.724 1.00 0.00 C ATOM 1203 OG1 THR A 79 -0.204 8.735 4.114 1.00 0.00 O ATOM 1204 CG2 THR A 79 -1.534 9.870 2.572 1.00 0.00 C ATOM 0 H THR A 79 1.713 7.412 2.294 1.00 0.00 H new ATOM 0 HA THR A 79 -1.260 7.193 2.383 1.00 0.00 H new ATOM 0 HB THR A 79 0.587 9.603 2.308 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.139 9.564 4.633 1.00 0.00 H new ATOM 0 HG21 THR A 79 -1.412 10.829 3.076 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.734 10.039 1.514 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.369 9.329 3.018 1.00 0.00 H new ATOM 1212 N VAL A 80 -1.691 7.527 0.043 1.00 0.00 N ATOM 1213 CA VAL A 80 -1.960 7.579 -1.384 1.00 0.00 C ATOM 1214 C VAL A 80 -2.797 8.821 -1.696 1.00 0.00 C ATOM 1215 O VAL A 80 -4.008 8.829 -1.480 1.00 0.00 O ATOM 1216 CB VAL A 80 -2.628 6.279 -1.838 1.00 0.00 C ATOM 1217 CG1 VAL A 80 -2.975 6.331 -3.327 1.00 0.00 C ATOM 1218 CG2 VAL A 80 -1.745 5.070 -1.522 1.00 0.00 C ATOM 0 H VAL A 80 -2.497 7.290 0.621 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.029 7.664 -1.945 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.559 6.169 -1.282 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.448 5.395 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.660 7.158 -3.512 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -2.064 6.477 -3.908 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.243 4.159 -1.855 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.791 5.171 -2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.572 5.017 -0.447 1.00 0.00 H new ATOM 1228 N LYS A 81 -2.118 9.841 -2.200 1.00 0.00 N ATOM 1229 CA LYS A 81 -2.784 11.086 -2.544 1.00 0.00 C ATOM 1230 C LYS A 81 -3.051 11.118 -4.050 1.00 0.00 C ATOM 1231 O LYS A 81 -2.538 10.282 -4.793 1.00 0.00 O ATOM 1232 CB LYS A 81 -1.977 12.283 -2.037 1.00 0.00 C ATOM 1233 CG LYS A 81 -1.352 11.985 -0.673 1.00 0.00 C ATOM 1234 CD LYS A 81 -0.342 13.067 -0.284 1.00 0.00 C ATOM 1235 CE LYS A 81 0.298 12.758 1.071 1.00 0.00 C ATOM 1236 NZ LYS A 81 1.768 12.650 0.937 1.00 0.00 N ATOM 0 H LYS A 81 -1.114 9.831 -2.378 1.00 0.00 H new ATOM 0 HA LYS A 81 -3.752 11.150 -2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -1.194 12.528 -2.754 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -2.624 13.157 -1.961 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -2.134 11.924 0.084 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -0.858 11.014 -0.700 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.432 13.138 -1.048 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.839 14.036 -0.243 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.049 13.543 1.785 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -0.106 11.827 1.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 2.187 12.440 1.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.001 11.886 0.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 2.151 13.549 0.580 1.00 0.00 H new ATOM 1250 N GLY A 82 -3.853 12.090 -4.457 1.00 0.00 N ATOM 1251 CA GLY A 82 -4.194 12.242 -5.861 1.00 0.00 C ATOM 1252 C GLY A 82 -5.246 11.214 -6.284 1.00 0.00 C ATOM 1253 O GLY A 82 -5.247 10.755 -7.425 1.00 0.00 O ATOM 0 H GLY A 82 -4.277 12.781 -3.838 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.571 13.249 -6.040 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.299 12.124 -6.471 1.00 0.00 H new ATOM 1257 N LEU A 83 -6.115 10.882 -5.340 1.00 0.00 N ATOM 1258 CA LEU A 83 -7.169 9.916 -5.601 1.00 0.00 C ATOM 1259 C LEU A 83 -8.438 10.656 -6.028 1.00 0.00 C ATOM 1260 O LEU A 83 -8.579 11.852 -5.775 1.00 0.00 O ATOM 1261 CB LEU A 83 -7.369 9.002 -4.390 1.00 0.00 C ATOM 1262 CG LEU A 83 -6.671 7.642 -4.455 1.00 0.00 C ATOM 1263 CD1 LEU A 83 -5.250 7.780 -5.006 1.00 0.00 C ATOM 1264 CD2 LEU A 83 -6.692 6.949 -3.091 1.00 0.00 C ATOM 0 H LEU A 83 -6.111 11.264 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.889 9.260 -6.425 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.018 9.527 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.438 8.834 -4.259 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.224 7.007 -5.147 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.777 6.799 -5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.289 8.201 -6.011 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.671 8.439 -4.359 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.190 5.985 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.177 7.571 -2.359 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.724 6.797 -2.776 1.00 0.00 H new ATOM 1276 N VAL A 84 -9.330 9.915 -6.669 1.00 0.00 N ATOM 1277 CA VAL A 84 -10.582 10.486 -7.134 1.00 0.00 C ATOM 1278 C VAL A 84 -11.708 10.081 -6.180 1.00 0.00 C ATOM 1279 O VAL A 84 -11.758 8.941 -5.722 1.00 0.00 O ATOM 1280 CB VAL A 84 -10.844 10.063 -8.582 1.00 0.00 C ATOM 1281 CG1 VAL A 84 -12.251 10.470 -9.025 1.00 0.00 C ATOM 1282 CG2 VAL A 84 -9.785 10.641 -9.522 1.00 0.00 C ATOM 0 H VAL A 84 -9.210 8.924 -6.877 1.00 0.00 H new ATOM 0 HA VAL A 84 -10.530 11.575 -7.131 1.00 0.00 H new ATOM 0 HB VAL A 84 -10.778 8.976 -8.631 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.412 10.158 -10.057 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -12.988 9.990 -8.382 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -12.356 11.552 -8.952 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -9.994 10.325 -10.544 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.805 11.729 -9.467 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -8.800 10.281 -9.226 1.00 0.00 H new ATOM 1292 N PRO A 85 -12.606 11.063 -5.902 1.00 0.00 N ATOM 1293 CA PRO A 85 -13.728 10.821 -5.010 1.00 0.00 C ATOM 1294 C PRO A 85 -14.806 9.983 -5.701 1.00 0.00 C ATOM 1295 O PRO A 85 -15.063 10.156 -6.891 1.00 0.00 O ATOM 1296 CB PRO A 85 -14.216 12.203 -4.608 1.00 0.00 C ATOM 1297 CG PRO A 85 -13.654 13.162 -5.645 1.00 0.00 C ATOM 1298 CD PRO A 85 -12.578 12.426 -6.426 1.00 0.00 C ATOM 0 HA PRO A 85 -13.449 10.241 -4.130 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -15.305 12.242 -4.589 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.871 12.463 -3.608 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.443 13.506 -6.314 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -13.238 14.046 -5.162 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -12.784 12.443 -7.496 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -11.600 12.885 -6.282 1.00 0.00 H new ATOM 1306 N ALA A 86 -15.407 9.094 -4.924 1.00 0.00 N ATOM 1307 CA ALA A 86 -16.451 8.229 -5.446 1.00 0.00 C ATOM 1308 C ALA A 86 -15.834 7.219 -6.414 1.00 0.00 C ATOM 1309 O ALA A 86 -16.338 7.024 -7.519 1.00 0.00 O ATOM 1310 CB ALA A 86 -17.537 9.081 -6.106 1.00 0.00 C ATOM 0 H ALA A 86 -15.191 8.954 -3.937 1.00 0.00 H new ATOM 0 HA ALA A 86 -16.922 7.667 -4.640 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -18.320 8.432 -6.498 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -17.964 9.761 -5.369 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -17.101 9.657 -6.922 1.00 0.00 H new ATOM 1316 N ARG A 87 -14.751 6.602 -5.965 1.00 0.00 N ATOM 1317 CA ARG A 87 -14.059 5.616 -6.778 1.00 0.00 C ATOM 1318 C ARG A 87 -13.309 4.624 -5.886 1.00 0.00 C ATOM 1319 O ARG A 87 -12.792 4.998 -4.834 1.00 0.00 O ATOM 1320 CB ARG A 87 -13.068 6.286 -7.731 1.00 0.00 C ATOM 1321 CG ARG A 87 -13.799 7.022 -8.855 1.00 0.00 C ATOM 1322 CD ARG A 87 -12.939 7.087 -10.118 1.00 0.00 C ATOM 1323 NE ARG A 87 -13.683 7.765 -11.203 1.00 0.00 N ATOM 1324 CZ ARG A 87 -13.269 7.823 -12.476 1.00 0.00 C ATOM 1325 NH1 ARG A 87 -12.114 7.244 -12.832 1.00 0.00 N ATOM 1326 NH2 ARG A 87 -14.009 8.460 -13.393 1.00 0.00 N ATOM 0 H ARG A 87 -14.335 6.766 -5.048 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.808 5.086 -7.366 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.444 6.988 -7.178 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.403 5.535 -8.156 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -14.738 6.515 -9.076 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -14.051 8.031 -8.530 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -12.013 7.624 -9.910 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -12.661 6.081 -10.431 1.00 0.00 H new ATOM 0 HE ARG A 87 -14.567 8.217 -10.967 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -11.550 6.759 -12.134 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.799 7.288 -13.801 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -14.888 8.901 -13.122 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -13.694 8.504 -14.362 1.00 0.00 H new ATOM 1340 N SER A 88 -13.273 3.380 -6.339 1.00 0.00 N ATOM 1341 CA SER A 88 -12.595 2.332 -5.595 1.00 0.00 C ATOM 1342 C SER A 88 -11.089 2.396 -5.857 1.00 0.00 C ATOM 1343 O SER A 88 -10.660 2.757 -6.952 1.00 0.00 O ATOM 1344 CB SER A 88 -13.141 0.952 -5.966 1.00 0.00 C ATOM 1345 OG SER A 88 -14.503 0.795 -5.581 1.00 0.00 O ATOM 0 H SER A 88 -13.702 3.074 -7.212 1.00 0.00 H new ATOM 0 HA SER A 88 -12.780 2.492 -4.533 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.049 0.803 -7.042 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.537 0.182 -5.485 1.00 0.00 H new ATOM 0 HG SER A 88 -14.814 -0.098 -5.837 1.00 0.00 H new ATOM 1351 N TYR A 89 -10.327 2.039 -4.834 1.00 0.00 N ATOM 1352 CA TYR A 89 -8.878 2.050 -4.939 1.00 0.00 C ATOM 1353 C TYR A 89 -8.260 0.911 -4.127 1.00 0.00 C ATOM 1354 O TYR A 89 -8.564 0.748 -2.947 1.00 0.00 O ATOM 1355 CB TYR A 89 -8.423 3.387 -4.349 1.00 0.00 C ATOM 1356 CG TYR A 89 -8.515 4.562 -5.324 1.00 0.00 C ATOM 1357 CD1 TYR A 89 -7.801 4.537 -6.504 1.00 0.00 C ATOM 1358 CD2 TYR A 89 -9.313 5.647 -5.023 1.00 0.00 C ATOM 1359 CE1 TYR A 89 -7.887 5.643 -7.422 1.00 0.00 C ATOM 1360 CE2 TYR A 89 -9.400 6.753 -5.941 1.00 0.00 C ATOM 1361 CZ TYR A 89 -8.683 6.696 -7.095 1.00 0.00 C ATOM 1362 OH TYR A 89 -8.765 7.741 -7.962 1.00 0.00 O ATOM 0 H TYR A 89 -10.686 1.740 -3.927 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.568 1.923 -5.976 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -9.029 3.609 -3.470 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.392 3.290 -4.009 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -7.177 3.687 -6.739 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -9.872 5.667 -4.099 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -7.332 5.636 -8.349 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.021 7.608 -5.718 1.00 0.00 H new ATOM 0 HH TYR A 89 -8.475 7.451 -8.852 1.00 0.00 H new ATOM 1372 N GLN A 90 -7.402 0.150 -4.793 1.00 0.00 N ATOM 1373 CA GLN A 90 -6.738 -0.970 -4.148 1.00 0.00 C ATOM 1374 C GLN A 90 -5.256 -0.656 -3.933 1.00 0.00 C ATOM 1375 O GLN A 90 -4.696 0.205 -4.610 1.00 0.00 O ATOM 1376 CB GLN A 90 -6.915 -2.254 -4.961 1.00 0.00 C ATOM 1377 CG GLN A 90 -8.175 -3.006 -4.530 1.00 0.00 C ATOM 1378 CD GLN A 90 -8.391 -4.252 -5.392 1.00 0.00 C ATOM 1379 OE1 GLN A 90 -7.753 -4.450 -6.413 1.00 0.00 O ATOM 1380 NE2 GLN A 90 -9.324 -5.077 -4.926 1.00 0.00 N ATOM 0 H GLN A 90 -7.152 0.288 -5.772 1.00 0.00 H new ATOM 0 HA GLN A 90 -7.200 -1.130 -3.174 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.977 -2.011 -6.022 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -6.043 -2.894 -4.831 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -8.090 -3.294 -3.482 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -9.041 -2.349 -4.611 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -9.821 -4.851 -4.064 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -9.543 -5.936 -5.430 1.00 0.00 H new ATOM 1389 N PHE A 91 -4.664 -1.371 -2.988 1.00 0.00 N ATOM 1390 CA PHE A 91 -3.258 -1.180 -2.676 1.00 0.00 C ATOM 1391 C PHE A 91 -2.578 -2.516 -2.367 1.00 0.00 C ATOM 1392 O PHE A 91 -3.134 -3.349 -1.654 1.00 0.00 O ATOM 1393 CB PHE A 91 -3.193 -0.289 -1.433 1.00 0.00 C ATOM 1394 CG PHE A 91 -3.713 1.132 -1.658 1.00 0.00 C ATOM 1395 CD1 PHE A 91 -3.276 1.855 -2.724 1.00 0.00 C ATOM 1396 CD2 PHE A 91 -4.612 1.672 -0.793 1.00 0.00 C ATOM 1397 CE1 PHE A 91 -3.759 3.174 -2.933 1.00 0.00 C ATOM 1398 CE2 PHE A 91 -5.095 2.991 -1.002 1.00 0.00 C ATOM 1399 CZ PHE A 91 -4.658 3.714 -2.068 1.00 0.00 C ATOM 0 H PHE A 91 -5.132 -2.084 -2.428 1.00 0.00 H new ATOM 0 HA PHE A 91 -2.746 -0.730 -3.527 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.771 -0.754 -0.635 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.160 -0.237 -1.090 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -2.562 1.426 -3.411 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.959 1.098 0.053 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.412 3.748 -3.779 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -5.809 3.420 -0.315 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.025 4.717 -2.227 1.00 0.00 H new ATOM 1409 N ARG A 92 -1.385 -2.677 -2.920 1.00 0.00 N ATOM 1410 CA ARG A 92 -0.623 -3.897 -2.713 1.00 0.00 C ATOM 1411 C ARG A 92 0.862 -3.648 -2.982 1.00 0.00 C ATOM 1412 O ARG A 92 1.272 -3.498 -4.132 1.00 0.00 O ATOM 1413 CB ARG A 92 -1.119 -5.018 -3.628 1.00 0.00 C ATOM 1414 CG ARG A 92 -1.277 -4.522 -5.067 1.00 0.00 C ATOM 1415 CD ARG A 92 -1.343 -5.695 -6.047 1.00 0.00 C ATOM 1416 NE ARG A 92 -0.476 -5.427 -7.217 1.00 0.00 N ATOM 1417 CZ ARG A 92 -0.041 -6.371 -8.062 1.00 0.00 C ATOM 1418 NH1 ARG A 92 -0.389 -7.651 -7.872 1.00 0.00 N ATOM 1419 NH2 ARG A 92 0.742 -6.036 -9.096 1.00 0.00 N ATOM 0 H ARG A 92 -0.927 -1.983 -3.511 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.761 -4.202 -1.676 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.417 -5.851 -3.602 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.074 -5.395 -3.262 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.183 -3.922 -5.151 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -0.440 -3.874 -5.326 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -1.025 -6.612 -5.551 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -2.371 -5.849 -6.374 1.00 0.00 H new ATOM 0 HE ARG A 92 -0.192 -4.463 -7.390 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -0.985 -7.906 -7.084 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.058 -8.370 -8.515 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.007 -5.062 -9.240 1.00 0.00 H new ATOM 0 HH22 ARG A 92 1.073 -6.755 -9.739 1.00 0.00 H new ATOM 1433 N LEU A 93 1.629 -3.612 -1.902 1.00 0.00 N ATOM 1434 CA LEU A 93 3.060 -3.383 -2.007 1.00 0.00 C ATOM 1435 C LEU A 93 3.801 -4.699 -1.762 1.00 0.00 C ATOM 1436 O LEU A 93 3.247 -5.628 -1.177 1.00 0.00 O ATOM 1437 CB LEU A 93 3.492 -2.251 -1.073 1.00 0.00 C ATOM 1438 CG LEU A 93 3.045 -2.376 0.385 1.00 0.00 C ATOM 1439 CD1 LEU A 93 4.069 -1.743 1.328 1.00 0.00 C ATOM 1440 CD2 LEU A 93 1.645 -1.791 0.582 1.00 0.00 C ATOM 0 H LEU A 93 1.286 -3.738 -0.950 1.00 0.00 H new ATOM 0 HA LEU A 93 3.320 -3.052 -3.012 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.580 -2.185 -1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.107 -1.312 -1.471 1.00 0.00 H new ATOM 0 HG LEU A 93 2.989 -3.435 0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.727 -1.845 2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.029 -2.246 1.213 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.181 -0.686 1.086 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.352 -1.893 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.650 -0.736 0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.935 -2.327 -0.048 1.00 0.00 H new ATOM 1452 N CYS A 94 5.043 -4.736 -2.223 1.00 0.00 N ATOM 1453 CA CYS A 94 5.866 -5.922 -2.061 1.00 0.00 C ATOM 1454 C CYS A 94 7.167 -5.514 -1.366 1.00 0.00 C ATOM 1455 O CYS A 94 7.410 -4.328 -1.144 1.00 0.00 O ATOM 1456 CB CYS A 94 6.128 -6.616 -3.399 1.00 0.00 C ATOM 1457 SG CYS A 94 6.867 -5.433 -4.583 1.00 0.00 S ATOM 0 H CYS A 94 5.499 -3.964 -2.709 1.00 0.00 H new ATOM 0 HA CYS A 94 5.339 -6.651 -1.445 1.00 0.00 H new ATOM 0 HB2 CYS A 94 6.798 -7.464 -3.253 1.00 0.00 H new ATOM 0 HB3 CYS A 94 5.196 -7.012 -3.802 1.00 0.00 H new ATOM 0 HG CYS A 94 6.120 -5.357 -5.644 1.00 0.00 H new ATOM 1463 N ALA A 95 7.968 -6.518 -1.042 1.00 0.00 N ATOM 1464 CA ALA A 95 9.237 -6.278 -0.377 1.00 0.00 C ATOM 1465 C ALA A 95 10.378 -6.494 -1.372 1.00 0.00 C ATOM 1466 O ALA A 95 10.454 -7.537 -2.019 1.00 0.00 O ATOM 1467 CB ALA A 95 9.352 -7.188 0.848 1.00 0.00 C ATOM 0 H ALA A 95 7.763 -7.500 -1.228 1.00 0.00 H new ATOM 0 HA ALA A 95 9.297 -5.248 -0.025 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.304 -7.008 1.347 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.535 -6.975 1.537 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.299 -8.230 0.533 1.00 0.00 H new ATOM 1473 N VAL A 96 11.238 -5.490 -1.465 1.00 0.00 N ATOM 1474 CA VAL A 96 12.372 -5.557 -2.371 1.00 0.00 C ATOM 1475 C VAL A 96 13.656 -5.252 -1.597 1.00 0.00 C ATOM 1476 O VAL A 96 13.728 -4.261 -0.872 1.00 0.00 O ATOM 1477 CB VAL A 96 12.151 -4.615 -3.557 1.00 0.00 C ATOM 1478 CG1 VAL A 96 13.182 -4.869 -4.658 1.00 0.00 C ATOM 1479 CG2 VAL A 96 10.726 -4.743 -4.099 1.00 0.00 C ATOM 0 H VAL A 96 11.172 -4.626 -0.928 1.00 0.00 H new ATOM 0 HA VAL A 96 12.472 -6.561 -2.784 1.00 0.00 H new ATOM 0 HB VAL A 96 12.285 -3.593 -3.203 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.003 -4.187 -5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.184 -4.704 -4.263 1.00 0.00 H new ATOM 0 HG13 VAL A 96 13.095 -5.898 -5.008 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.595 -4.063 -4.941 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.553 -5.767 -4.429 1.00 0.00 H new ATOM 0 HG23 VAL A 96 10.014 -4.490 -3.314 1.00 0.00 H new ATOM 1489 N ASN A 97 14.639 -6.122 -1.778 1.00 0.00 N ATOM 1490 CA ASN A 97 15.917 -5.958 -1.106 1.00 0.00 C ATOM 1491 C ASN A 97 17.049 -6.207 -2.104 1.00 0.00 C ATOM 1492 O ASN A 97 16.802 -6.391 -3.295 1.00 0.00 O ATOM 1493 CB ASN A 97 16.069 -6.960 0.041 1.00 0.00 C ATOM 1494 CG ASN A 97 15.322 -8.259 -0.264 1.00 0.00 C ATOM 1495 OD1 ASN A 97 14.722 -8.429 -1.313 1.00 0.00 O ATOM 1496 ND2 ASN A 97 15.392 -9.164 0.708 1.00 0.00 N ATOM 0 H ASN A 97 14.576 -6.943 -2.380 1.00 0.00 H new ATOM 0 HA ASN A 97 15.961 -4.944 -0.708 1.00 0.00 H new ATOM 0 HB2 ASN A 97 17.125 -7.173 0.205 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.685 -6.524 0.963 1.00 0.00 H new ATOM 0 HD21 ASN A 97 14.926 -10.065 0.600 1.00 0.00 H new ATOM 0 HD22 ASN A 97 15.911 -8.957 1.561 1.00 0.00 H new ATOM 1503 N ASP A 98 18.267 -6.205 -1.582 1.00 0.00 N ATOM 1504 CA ASP A 98 19.438 -6.428 -2.413 1.00 0.00 C ATOM 1505 C ASP A 98 19.273 -7.745 -3.175 1.00 0.00 C ATOM 1506 O ASP A 98 19.550 -7.812 -4.371 1.00 0.00 O ATOM 1507 CB ASP A 98 20.705 -6.530 -1.562 1.00 0.00 C ATOM 1508 CG ASP A 98 22.008 -6.649 -2.355 1.00 0.00 C ATOM 1509 OD1 ASP A 98 22.347 -5.661 -3.041 1.00 0.00 O ATOM 1510 OD2 ASP A 98 22.636 -7.726 -2.257 1.00 0.00 O ATOM 0 H ASP A 98 18.468 -6.052 -0.594 1.00 0.00 H new ATOM 0 HA ASP A 98 19.531 -5.586 -3.099 1.00 0.00 H new ATOM 0 HB2 ASP A 98 20.766 -5.650 -0.921 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.616 -7.396 -0.906 1.00 0.00 H new ATOM 1515 N VAL A 99 18.823 -8.759 -2.451 1.00 0.00 N ATOM 1516 CA VAL A 99 18.618 -10.069 -3.044 1.00 0.00 C ATOM 1517 C VAL A 99 17.718 -9.933 -4.273 1.00 0.00 C ATOM 1518 O VAL A 99 17.978 -10.546 -5.308 1.00 0.00 O ATOM 1519 CB VAL A 99 18.058 -11.035 -1.997 1.00 0.00 C ATOM 1520 CG1 VAL A 99 18.813 -10.907 -0.673 1.00 0.00 C ATOM 1521 CG2 VAL A 99 16.557 -10.816 -1.797 1.00 0.00 C ATOM 0 H VAL A 99 18.595 -8.700 -1.459 1.00 0.00 H new ATOM 0 HA VAL A 99 19.566 -10.488 -3.381 1.00 0.00 H new ATOM 0 HB VAL A 99 18.202 -12.050 -2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.395 -11.604 0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 99 19.867 -11.136 -0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 99 18.716 -9.889 -0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 99 16.184 -11.515 -1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 99 16.380 -9.795 -1.460 1.00 0.00 H new ATOM 0 HG23 VAL A 99 16.036 -10.982 -2.740 1.00 0.00 H new ATOM 1531 N GLY A 100 16.679 -9.126 -4.120 1.00 0.00 N ATOM 1532 CA GLY A 100 15.739 -8.901 -5.206 1.00 0.00 C ATOM 1533 C GLY A 100 14.364 -8.503 -4.667 1.00 0.00 C ATOM 1534 O GLY A 100 14.261 -7.916 -3.591 1.00 0.00 O ATOM 0 H GLY A 100 16.467 -8.619 -3.260 1.00 0.00 H new ATOM 0 HA2 GLY A 100 16.117 -8.117 -5.862 1.00 0.00 H new ATOM 0 HA3 GLY A 100 15.650 -9.805 -5.808 1.00 0.00 H new ATOM 1538 N LYS A 101 13.341 -8.840 -5.439 1.00 0.00 N ATOM 1539 CA LYS A 101 11.976 -8.525 -5.052 1.00 0.00 C ATOM 1540 C LYS A 101 11.224 -9.823 -4.753 1.00 0.00 C ATOM 1541 O LYS A 101 11.425 -10.831 -5.428 1.00 0.00 O ATOM 1542 CB LYS A 101 11.305 -7.656 -6.118 1.00 0.00 C ATOM 1543 CG LYS A 101 9.815 -7.476 -5.819 1.00 0.00 C ATOM 1544 CD LYS A 101 8.997 -7.437 -7.111 1.00 0.00 C ATOM 1545 CE LYS A 101 9.587 -6.433 -8.104 1.00 0.00 C ATOM 1546 NZ LYS A 101 8.509 -5.679 -8.781 1.00 0.00 N ATOM 0 H LYS A 101 13.430 -9.328 -6.330 1.00 0.00 H new ATOM 0 HA LYS A 101 11.965 -7.932 -4.137 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.792 -6.682 -6.158 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.430 -8.115 -7.099 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.466 -8.293 -5.188 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.662 -6.553 -5.259 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.975 -8.429 -7.562 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.966 -7.167 -6.885 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.249 -5.742 -7.582 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.192 -6.957 -8.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.921 -5.063 -9.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.845 -6.345 -9.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.002 -5.097 -8.084 1.00 0.00 H new ATOM 1560 N GLY A 102 10.372 -9.755 -3.740 1.00 0.00 N ATOM 1561 CA GLY A 102 9.588 -10.912 -3.342 1.00 0.00 C ATOM 1562 C GLY A 102 8.225 -10.916 -4.037 1.00 0.00 C ATOM 1563 O GLY A 102 8.139 -11.150 -5.242 1.00 0.00 O ATOM 0 H GLY A 102 10.208 -8.916 -3.183 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.129 -11.825 -3.590 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.449 -10.907 -2.261 1.00 0.00 H new ATOM 1567 N GLN A 103 7.194 -10.654 -3.248 1.00 0.00 N ATOM 1568 CA GLN A 103 5.839 -10.624 -3.772 1.00 0.00 C ATOM 1569 C GLN A 103 5.053 -9.469 -3.147 1.00 0.00 C ATOM 1570 O GLN A 103 5.505 -8.859 -2.180 1.00 0.00 O ATOM 1571 CB GLN A 103 5.131 -11.960 -3.537 1.00 0.00 C ATOM 1572 CG GLN A 103 4.914 -12.210 -2.043 1.00 0.00 C ATOM 1573 CD GLN A 103 5.484 -13.567 -1.627 1.00 0.00 C ATOM 1574 OE1 GLN A 103 6.662 -13.715 -1.345 1.00 0.00 O ATOM 1575 NE2 GLN A 103 4.586 -14.547 -1.603 1.00 0.00 N ATOM 0 H GLN A 103 7.269 -10.460 -2.249 1.00 0.00 H new ATOM 0 HA GLN A 103 5.890 -10.462 -4.849 1.00 0.00 H new ATOM 0 HB2 GLN A 103 4.171 -11.963 -4.053 1.00 0.00 H new ATOM 0 HB3 GLN A 103 5.724 -12.770 -3.963 1.00 0.00 H new ATOM 0 HG2 GLN A 103 5.391 -11.418 -1.465 1.00 0.00 H new ATOM 0 HG3 GLN A 103 3.849 -12.174 -1.815 1.00 0.00 H new ATOM 0 HE21 GLN A 103 3.615 -14.355 -1.851 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.868 -15.491 -1.337 1.00 0.00 H new ATOM 1584 N PHE A 104 3.892 -9.204 -3.727 1.00 0.00 N ATOM 1585 CA PHE A 104 3.039 -8.134 -3.239 1.00 0.00 C ATOM 1586 C PHE A 104 1.917 -8.685 -2.357 1.00 0.00 C ATOM 1587 O PHE A 104 1.586 -9.867 -2.434 1.00 0.00 O ATOM 1588 CB PHE A 104 2.422 -7.459 -4.466 1.00 0.00 C ATOM 1589 CG PHE A 104 3.447 -6.812 -5.400 1.00 0.00 C ATOM 1590 CD1 PHE A 104 4.334 -7.588 -6.078 1.00 0.00 C ATOM 1591 CD2 PHE A 104 3.469 -5.461 -5.554 1.00 0.00 C ATOM 1592 CE1 PHE A 104 5.285 -6.988 -6.946 1.00 0.00 C ATOM 1593 CE2 PHE A 104 4.419 -4.861 -6.422 1.00 0.00 C ATOM 1594 CZ PHE A 104 5.307 -5.637 -7.099 1.00 0.00 C ATOM 0 H PHE A 104 3.522 -9.712 -4.530 1.00 0.00 H new ATOM 0 HA PHE A 104 3.624 -7.436 -2.641 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.851 -8.199 -5.027 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.717 -6.697 -4.133 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.316 -8.661 -5.957 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.764 -4.845 -5.016 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.990 -7.604 -7.484 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.436 -3.788 -6.545 1.00 0.00 H new ATOM 0 HZ PHE A 104 6.030 -5.180 -7.758 1.00 0.00 H new ATOM 1604 N SER A 105 1.362 -7.802 -1.539 1.00 0.00 N ATOM 1605 CA SER A 105 0.284 -8.186 -0.644 1.00 0.00 C ATOM 1606 C SER A 105 -1.037 -8.247 -1.412 1.00 0.00 C ATOM 1607 O SER A 105 -1.182 -7.613 -2.456 1.00 0.00 O ATOM 1608 CB SER A 105 0.171 -7.212 0.531 1.00 0.00 C ATOM 1609 OG SER A 105 0.391 -5.862 0.129 1.00 0.00 O ATOM 0 H SER A 105 1.639 -6.822 -1.478 1.00 0.00 H new ATOM 0 HA SER A 105 0.509 -9.174 -0.242 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.818 -7.300 0.981 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.895 -7.484 1.299 1.00 0.00 H new ATOM 0 HG SER A 105 0.262 -5.267 0.897 1.00 0.00 H new ATOM 1615 N LYS A 106 -1.968 -9.014 -0.864 1.00 0.00 N ATOM 1616 CA LYS A 106 -3.273 -9.166 -1.485 1.00 0.00 C ATOM 1617 C LYS A 106 -3.930 -7.791 -1.623 1.00 0.00 C ATOM 1618 O LYS A 106 -3.532 -6.839 -0.955 1.00 0.00 O ATOM 1619 CB LYS A 106 -4.121 -10.177 -0.710 1.00 0.00 C ATOM 1620 CG LYS A 106 -4.780 -9.523 0.505 1.00 0.00 C ATOM 1621 CD LYS A 106 -6.090 -8.836 0.115 1.00 0.00 C ATOM 1622 CE LYS A 106 -7.284 -9.503 0.801 1.00 0.00 C ATOM 1623 NZ LYS A 106 -7.457 -8.972 2.172 1.00 0.00 N ATOM 0 H LYS A 106 -1.845 -9.537 0.003 1.00 0.00 H new ATOM 0 HA LYS A 106 -3.171 -9.574 -2.490 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.888 -10.592 -1.365 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.495 -11.008 -0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.974 -10.277 1.268 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.099 -8.793 0.944 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.049 -7.783 0.392 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -6.218 -8.877 -0.967 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.189 -9.328 0.220 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -7.133 -10.582 0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -8.271 -9.435 2.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.599 -9.161 2.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.622 -7.946 2.129 1.00 0.00 H new ATOM 1637 N ASP A 107 -4.926 -7.732 -2.495 1.00 0.00 N ATOM 1638 CA ASP A 107 -5.642 -6.490 -2.730 1.00 0.00 C ATOM 1639 C ASP A 107 -6.329 -6.049 -1.435 1.00 0.00 C ATOM 1640 O ASP A 107 -7.380 -6.576 -1.076 1.00 0.00 O ATOM 1641 CB ASP A 107 -6.721 -6.669 -3.800 1.00 0.00 C ATOM 1642 CG ASP A 107 -7.572 -7.933 -3.654 1.00 0.00 C ATOM 1643 OD1 ASP A 107 -8.566 -7.864 -2.900 1.00 0.00 O ATOM 1644 OD2 ASP A 107 -7.208 -8.939 -4.300 1.00 0.00 O ATOM 0 H ASP A 107 -5.254 -8.524 -3.047 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.921 -5.745 -3.066 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.380 -5.801 -3.779 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.242 -6.682 -4.779 1.00 0.00 H new ATOM 1649 N THR A 108 -5.705 -5.088 -0.770 1.00 0.00 N ATOM 1650 CA THR A 108 -6.243 -4.571 0.477 1.00 0.00 C ATOM 1651 C THR A 108 -7.758 -4.386 0.368 1.00 0.00 C ATOM 1652 O THR A 108 -8.281 -4.140 -0.718 1.00 0.00 O ATOM 1653 CB THR A 108 -5.496 -3.279 0.814 1.00 0.00 C ATOM 1654 OG1 THR A 108 -5.540 -2.526 -0.395 1.00 0.00 O ATOM 1655 CG2 THR A 108 -4.003 -3.511 1.054 1.00 0.00 C ATOM 0 H THR A 108 -4.832 -4.654 -1.071 1.00 0.00 H new ATOM 0 HA THR A 108 -6.091 -5.275 1.295 1.00 0.00 H new ATOM 0 HB THR A 108 -5.940 -2.825 1.700 1.00 0.00 H new ATOM 0 HG1 THR A 108 -4.690 -2.624 -0.872 1.00 0.00 H new ATOM 0 HG21 THR A 108 -3.521 -2.562 1.289 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.871 -4.201 1.887 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.552 -3.935 0.157 1.00 0.00 H new ATOM 1663 N GLU A 109 -8.421 -4.512 1.509 1.00 0.00 N ATOM 1664 CA GLU A 109 -9.865 -4.362 1.556 1.00 0.00 C ATOM 1665 C GLU A 109 -10.317 -3.272 0.582 1.00 0.00 C ATOM 1666 O GLU A 109 -9.939 -2.111 0.725 1.00 0.00 O ATOM 1667 CB GLU A 109 -10.339 -4.057 2.978 1.00 0.00 C ATOM 1668 CG GLU A 109 -11.565 -4.898 3.340 1.00 0.00 C ATOM 1669 CD GLU A 109 -12.505 -4.126 4.268 1.00 0.00 C ATOM 1670 OE1 GLU A 109 -12.805 -2.960 3.930 1.00 0.00 O ATOM 1671 OE2 GLU A 109 -12.902 -4.718 5.294 1.00 0.00 O ATOM 0 H GLU A 109 -7.984 -4.716 2.408 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.319 -5.305 1.252 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -9.534 -4.259 3.685 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.582 -2.998 3.065 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -12.097 -5.182 2.432 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.247 -5.821 3.825 1.00 0.00 H new ATOM 1678 N ARG A 110 -11.121 -3.685 -0.387 1.00 0.00 N ATOM 1679 CA ARG A 110 -11.629 -2.758 -1.384 1.00 0.00 C ATOM 1680 C ARG A 110 -11.930 -1.402 -0.744 1.00 0.00 C ATOM 1681 O ARG A 110 -12.991 -1.214 -0.149 1.00 0.00 O ATOM 1682 CB ARG A 110 -12.901 -3.299 -2.041 1.00 0.00 C ATOM 1683 CG ARG A 110 -13.027 -2.803 -3.483 1.00 0.00 C ATOM 1684 CD ARG A 110 -14.495 -2.606 -3.868 1.00 0.00 C ATOM 1685 NE ARG A 110 -14.825 -3.439 -5.046 1.00 0.00 N ATOM 1686 CZ ARG A 110 -14.917 -4.776 -5.019 1.00 0.00 C ATOM 1687 NH1 ARG A 110 -14.705 -5.439 -3.874 1.00 0.00 N ATOM 1688 NH2 ARG A 110 -15.221 -5.449 -6.137 1.00 0.00 N ATOM 0 H ARG A 110 -11.433 -4.649 -0.503 1.00 0.00 H new ATOM 0 HA ARG A 110 -10.861 -2.639 -2.148 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -12.886 -4.389 -2.028 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -13.773 -2.985 -1.467 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -12.488 -1.862 -3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -12.563 -3.520 -4.160 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -15.139 -2.875 -3.030 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -14.683 -1.556 -4.091 1.00 0.00 H new ATOM 0 HE ARG A 110 -14.993 -2.966 -5.934 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -14.474 -4.926 -3.023 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -14.775 -6.456 -3.853 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -15.382 -4.944 -7.008 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -15.291 -6.466 -6.117 1.00 0.00 H new ATOM 1702 N VAL A 111 -10.978 -0.492 -0.887 1.00 0.00 N ATOM 1703 CA VAL A 111 -11.128 0.842 -0.329 1.00 0.00 C ATOM 1704 C VAL A 111 -11.716 1.771 -1.393 1.00 0.00 C ATOM 1705 O VAL A 111 -11.284 1.754 -2.545 1.00 0.00 O ATOM 1706 CB VAL A 111 -9.788 1.333 0.220 1.00 0.00 C ATOM 1707 CG1 VAL A 111 -9.906 2.760 0.760 1.00 0.00 C ATOM 1708 CG2 VAL A 111 -9.253 0.383 1.293 1.00 0.00 C ATOM 0 H VAL A 111 -10.100 -0.652 -1.381 1.00 0.00 H new ATOM 0 HA VAL A 111 -11.822 0.830 0.511 1.00 0.00 H new ATOM 0 HB VAL A 111 -9.073 1.344 -0.603 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -8.939 3.085 1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.220 3.428 -0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.643 2.785 1.563 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.299 0.756 1.666 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -9.966 0.324 2.115 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -9.112 -0.609 0.863 1.00 0.00 H new ATOM 1718 N SER A 112 -12.692 2.561 -0.970 1.00 0.00 N ATOM 1719 CA SER A 112 -13.343 3.496 -1.872 1.00 0.00 C ATOM 1720 C SER A 112 -13.300 4.907 -1.283 1.00 0.00 C ATOM 1721 O SER A 112 -13.450 5.084 -0.075 1.00 0.00 O ATOM 1722 CB SER A 112 -14.789 3.079 -2.147 1.00 0.00 C ATOM 1723 OG SER A 112 -15.559 4.149 -2.688 1.00 0.00 O ATOM 0 H SER A 112 -13.048 2.573 -0.014 1.00 0.00 H new ATOM 0 HA SER A 112 -12.805 3.489 -2.820 1.00 0.00 H new ATOM 0 HB2 SER A 112 -14.798 2.239 -2.841 1.00 0.00 H new ATOM 0 HB3 SER A 112 -15.249 2.733 -1.221 1.00 0.00 H new ATOM 0 HG SER A 112 -16.475 3.843 -2.851 1.00 0.00 H new ATOM 1729 N LEU A 113 -13.096 5.876 -2.164 1.00 0.00 N ATOM 1730 CA LEU A 113 -13.032 7.266 -1.746 1.00 0.00 C ATOM 1731 C LEU A 113 -14.447 7.846 -1.702 1.00 0.00 C ATOM 1732 O LEU A 113 -15.346 7.350 -2.378 1.00 0.00 O ATOM 1733 CB LEU A 113 -12.073 8.051 -2.643 1.00 0.00 C ATOM 1734 CG LEU A 113 -11.017 8.892 -1.922 1.00 0.00 C ATOM 1735 CD1 LEU A 113 -9.615 8.322 -2.145 1.00 0.00 C ATOM 1736 CD2 LEU A 113 -11.111 10.362 -2.335 1.00 0.00 C ATOM 0 H LEU A 113 -12.973 5.726 -3.165 1.00 0.00 H new ATOM 0 HA LEU A 113 -12.624 7.343 -0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -11.562 7.346 -3.299 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -12.661 8.711 -3.280 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.216 8.845 -0.851 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -8.884 8.939 -1.622 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -9.571 7.303 -1.761 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.389 8.318 -3.211 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -10.350 10.937 -1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -10.952 10.449 -3.410 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -12.098 10.749 -2.082 1.00 0.00 H new ATOM 1748 N PRO A 114 -14.604 8.916 -0.878 1.00 0.00 N ATOM 1749 CA PRO A 114 -15.894 9.570 -0.736 1.00 0.00 C ATOM 1750 C PRO A 114 -16.213 10.425 -1.964 1.00 0.00 C ATOM 1751 O PRO A 114 -15.306 10.906 -2.642 1.00 0.00 O ATOM 1752 CB PRO A 114 -15.785 10.384 0.542 1.00 0.00 C ATOM 1753 CG PRO A 114 -14.297 10.527 0.820 1.00 0.00 C ATOM 1754 CD PRO A 114 -13.561 9.531 -0.061 1.00 0.00 C ATOM 0 HA PRO A 114 -16.720 8.861 -0.671 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -16.256 11.360 0.425 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -16.290 9.884 1.368 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -13.965 11.543 0.607 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -14.085 10.336 1.872 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -12.814 10.027 -0.681 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -13.036 8.786 0.537 1.00 0.00 H new ATOM 1762 N GLU A 115 -17.504 10.588 -2.213 1.00 0.00 N ATOM 1763 CA GLU A 115 -17.953 11.376 -3.348 1.00 0.00 C ATOM 1764 C GLU A 115 -17.612 12.853 -3.137 1.00 0.00 C ATOM 1765 O GLU A 115 -17.311 13.270 -2.020 1.00 0.00 O ATOM 1766 CB GLU A 115 -19.453 11.189 -3.586 1.00 0.00 C ATOM 1767 CG GLU A 115 -19.802 11.379 -5.063 1.00 0.00 C ATOM 1768 CD GLU A 115 -21.179 10.792 -5.381 1.00 0.00 C ATOM 1769 OE1 GLU A 115 -21.289 9.548 -5.341 1.00 0.00 O ATOM 1770 OE2 GLU A 115 -22.090 11.602 -5.658 1.00 0.00 O ATOM 0 H GLU A 115 -18.253 10.188 -1.648 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.430 11.026 -4.238 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -19.755 10.193 -3.263 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -20.012 11.903 -2.982 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -19.790 12.441 -5.310 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.046 10.899 -5.684 1.00 0.00 H new ATOM 1777 N SER A 116 -17.669 13.602 -4.228 1.00 0.00 N ATOM 1778 CA SER A 116 -17.370 15.023 -4.176 1.00 0.00 C ATOM 1779 C SER A 116 -18.661 15.835 -4.301 1.00 0.00 C ATOM 1780 O SER A 116 -19.171 16.029 -5.403 1.00 0.00 O ATOM 1781 CB SER A 116 -16.385 15.419 -5.278 1.00 0.00 C ATOM 1782 OG SER A 116 -16.947 15.262 -6.578 1.00 0.00 O ATOM 0 H SER A 116 -17.918 13.252 -5.153 1.00 0.00 H new ATOM 0 HA SER A 116 -16.904 15.239 -3.215 1.00 0.00 H new ATOM 0 HB2 SER A 116 -16.081 16.456 -5.137 1.00 0.00 H new ATOM 0 HB3 SER A 116 -15.485 14.809 -5.196 1.00 0.00 H new ATOM 0 HG SER A 116 -17.904 15.469 -6.548 1.00 0.00 H new ATOM 1788 N GLY A 117 -19.151 16.287 -3.156 1.00 0.00 N ATOM 1789 CA GLY A 117 -20.372 17.074 -3.124 1.00 0.00 C ATOM 1790 C GLY A 117 -20.861 17.268 -1.687 1.00 0.00 C ATOM 1791 O GLY A 117 -20.292 16.706 -0.753 1.00 0.00 O ATOM 0 H GLY A 117 -18.725 16.123 -2.244 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -20.195 18.045 -3.586 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -21.145 16.577 -3.711 1.00 0.00 H new ATOM 1795 N PRO A 118 -21.939 18.087 -1.553 1.00 0.00 N ATOM 1796 CA PRO A 118 -22.511 18.362 -0.246 1.00 0.00 C ATOM 1797 C PRO A 118 -23.314 17.164 0.265 1.00 0.00 C ATOM 1798 O PRO A 118 -24.349 16.819 -0.302 1.00 0.00 O ATOM 1799 CB PRO A 118 -23.361 19.607 -0.443 1.00 0.00 C ATOM 1800 CG PRO A 118 -23.606 19.711 -1.940 1.00 0.00 C ATOM 1801 CD PRO A 118 -22.639 18.769 -2.637 1.00 0.00 C ATOM 0 HA PRO A 118 -21.752 18.531 0.518 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -24.302 19.528 0.102 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -22.849 20.493 -0.068 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -24.636 19.445 -2.178 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -23.454 20.735 -2.281 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -23.167 18.060 -3.275 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -21.944 19.316 -3.275 1.00 0.00 H new ATOM 1809 N SER A 119 -22.805 16.563 1.330 1.00 0.00 N ATOM 1810 CA SER A 119 -23.462 15.411 1.924 1.00 0.00 C ATOM 1811 C SER A 119 -23.518 14.262 0.915 1.00 0.00 C ATOM 1812 O SER A 119 -23.701 14.490 -0.280 1.00 0.00 O ATOM 1813 CB SER A 119 -24.872 15.766 2.402 1.00 0.00 C ATOM 1814 OG SER A 119 -24.931 15.926 3.817 1.00 0.00 O ATOM 0 H SER A 119 -21.945 16.852 1.797 1.00 0.00 H new ATOM 0 HA SER A 119 -22.882 15.097 2.791 1.00 0.00 H new ATOM 0 HB2 SER A 119 -25.197 16.687 1.919 1.00 0.00 H new ATOM 0 HB3 SER A 119 -25.566 14.983 2.096 1.00 0.00 H new ATOM 0 HG SER A 119 -25.846 16.154 4.083 1.00 0.00 H new ATOM 1820 N SER A 120 -23.356 13.054 1.432 1.00 0.00 N ATOM 1821 CA SER A 120 -23.386 11.869 0.591 1.00 0.00 C ATOM 1822 C SER A 120 -24.787 11.677 0.007 1.00 0.00 C ATOM 1823 O SER A 120 -25.784 11.862 0.703 1.00 0.00 O ATOM 1824 CB SER A 120 -22.962 10.626 1.376 1.00 0.00 C ATOM 1825 OG SER A 120 -21.675 10.780 1.966 1.00 0.00 O ATOM 0 H SER A 120 -23.203 12.869 2.423 1.00 0.00 H new ATOM 0 HA SER A 120 -22.676 12.010 -0.224 1.00 0.00 H new ATOM 0 HB2 SER A 120 -23.696 10.422 2.156 1.00 0.00 H new ATOM 0 HB3 SER A 120 -22.955 9.762 0.711 1.00 0.00 H new ATOM 0 HG SER A 120 -21.442 9.966 2.459 1.00 0.00 H new ATOM 1831 N GLY A 121 -24.817 11.308 -1.265 1.00 0.00 N ATOM 1832 CA GLY A 121 -26.080 11.088 -1.951 1.00 0.00 C ATOM 1833 C GLY A 121 -25.859 10.866 -3.448 1.00 0.00 C ATOM 1834 O GLY A 121 -26.364 11.625 -4.273 1.00 0.00 O ATOM 0 H GLY A 121 -23.988 11.156 -1.839 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -26.585 10.223 -1.522 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -26.735 11.946 -1.800 1.00 0.00 H new TER 1838 GLY A 121