USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 890 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 53 GLN : amide:sc= -6.74! C(o=-11!,f=-20!) USER MOD Set 1.2: A 99 GLN : amide:sc= -3.3 K(o=-11,f=-8.1) USER MOD Set 1.3: A 102 TYR OH : rot 180:sc= -1.36 USER MOD Set 2.1: A 86 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: A 35 LYS NZ :NH3+ -176:sc= 0.65 (180deg=0.902) USER MOD Set 3.2: A 75 MET CE :methyl -136:sc= -1.66 (180deg=-4.66!) USER MOD Set 4.1: A 30 SER OG : rot 180:sc= -0.181! USER MOD Set 4.2: A 31 GLN : amide:sc= -1.07 K(o=-2.2,f=-1.3) USER MOD Set 4.3: A 33 THR OG1 : rot 180:sc= -0.922 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= -0.101 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.644 K(o=-0.64,f=-1.7!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00271 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -155:sc= -0.0893 (180deg=-0.817) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 106:sc= 0.423 USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= -0.0496 USER MOD Single : A 44 HIS : no HE2:sc= -3.29! C(o=-3.3!,f=-11!) USER MOD Single : A 50 HIS : no HD1:sc= -0.277 X(o=-0.28,f=0.053) USER MOD Single : A 51 HIS : no HD1:sc= -0.438 X(o=-0.44,f=0.058) USER MOD Single : A 52 TYR OH : rot 120:sc= -0.642 USER MOD Single : A 57 LYS NZ :NH3+ 170:sc= 0.0523 (180deg=-0.709!) USER MOD Single : A 61 SER OG : rot 180:sc= -0.0223 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -156:sc= -1.37 USER MOD Single : A 70 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.515 K(o=0.52,f=-1.5) USER MOD Single : A 74 THR OG1 : rot 132:sc= 0.103 USER MOD Single : A 79 ASN : amide:sc= -0.744 K(o=-0.74,f=-0.14) USER MOD Single : A 80 ASN : amide:sc=-0.00132 X(o=-0.0013,f=-0.074) USER MOD Single : A 84 ASN : amide:sc= -0.755 K(o=-0.76,f=-2.9!) USER MOD Single : A 85 THR OG1 : rot 66:sc= 0.0755 USER MOD Single : A 87 TYR OH : rot 24:sc= -0.252 USER MOD Single : A 95 ASN : amide:sc= -7.82! C(o=-7.8!,f=-16!) USER MOD Single : A 97 LYS NZ :NH3+ -156:sc= 1.3 (180deg=0.546) USER MOD Single : A 103 SER OG : rot -74:sc= 1.29 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot -162:sc= 1.04 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -38.300 -8.993 -11.083 1.00 0.00 N ATOM 2 CA GLY A 1 -38.187 -10.429 -11.258 1.00 0.00 C ATOM 3 C GLY A 1 -36.789 -10.938 -10.970 1.00 0.00 C ATOM 4 O GLY A 1 -36.256 -10.727 -9.881 1.00 0.00 O ATOM 0 H1 GLY A 1 -39.274 -8.693 -11.291 1.00 0.00 H new ATOM 0 H2 GLY A 1 -38.063 -8.743 -10.102 1.00 0.00 H new ATOM 0 H3 GLY A 1 -37.644 -8.512 -11.730 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -38.896 -10.930 -10.598 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -38.463 -10.691 -12.280 1.00 0.00 H new ATOM 8 N SER A 2 -36.193 -11.613 -11.949 1.00 0.00 N ATOM 9 CA SER A 2 -34.851 -12.160 -11.794 1.00 0.00 C ATOM 10 C SER A 2 -33.801 -11.175 -12.299 1.00 0.00 C ATOM 11 O SER A 2 -34.121 -10.217 -13.003 1.00 0.00 O ATOM 12 CB SER A 2 -34.726 -13.486 -12.546 1.00 0.00 C ATOM 13 OG SER A 2 -34.846 -13.293 -13.944 1.00 0.00 O ATOM 0 H SER A 2 -36.619 -11.794 -12.858 1.00 0.00 H new ATOM 0 HA SER A 2 -34.679 -12.336 -10.732 1.00 0.00 H new ATOM 0 HB2 SER A 2 -33.764 -13.946 -12.321 1.00 0.00 H new ATOM 0 HB3 SER A 2 -35.497 -14.176 -12.204 1.00 0.00 H new ATOM 0 HG SER A 2 -34.761 -14.155 -14.402 1.00 0.00 H new ATOM 19 N SER A 3 -32.546 -11.418 -11.935 1.00 0.00 N ATOM 20 CA SER A 3 -31.449 -10.551 -12.348 1.00 0.00 C ATOM 21 C SER A 3 -30.886 -10.992 -13.696 1.00 0.00 C ATOM 22 O SER A 3 -30.835 -10.210 -14.644 1.00 0.00 O ATOM 23 CB SER A 3 -30.341 -10.558 -11.293 1.00 0.00 C ATOM 24 OG SER A 3 -29.879 -11.876 -11.046 1.00 0.00 O ATOM 0 H SER A 3 -32.264 -12.208 -11.355 1.00 0.00 H new ATOM 0 HA SER A 3 -31.838 -9.538 -12.450 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.511 -9.935 -11.628 1.00 0.00 H new ATOM 0 HB3 SER A 3 -30.714 -10.121 -10.367 1.00 0.00 H new ATOM 0 HG SER A 3 -29.170 -11.853 -10.370 1.00 0.00 H new ATOM 30 N GLY A 4 -30.465 -12.250 -13.772 1.00 0.00 N ATOM 31 CA GLY A 4 -29.912 -12.775 -15.007 1.00 0.00 C ATOM 32 C GLY A 4 -29.582 -14.251 -14.914 1.00 0.00 C ATOM 33 O GLY A 4 -30.473 -15.083 -14.744 1.00 0.00 O ATOM 0 H GLY A 4 -30.497 -12.916 -13.000 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.624 -12.616 -15.817 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -29.009 -12.220 -15.262 1.00 0.00 H new ATOM 37 N SER A 5 -28.299 -14.578 -15.028 1.00 0.00 N ATOM 38 CA SER A 5 -27.855 -15.966 -14.961 1.00 0.00 C ATOM 39 C SER A 5 -28.444 -16.667 -13.741 1.00 0.00 C ATOM 40 O SER A 5 -28.760 -16.028 -12.737 1.00 0.00 O ATOM 41 CB SER A 5 -26.327 -16.032 -14.914 1.00 0.00 C ATOM 42 OG SER A 5 -25.757 -15.506 -16.099 1.00 0.00 O ATOM 0 H SER A 5 -27.549 -13.901 -15.167 1.00 0.00 H new ATOM 0 HA SER A 5 -28.207 -16.478 -15.857 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.962 -15.473 -14.052 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.009 -17.066 -14.781 1.00 0.00 H new ATOM 0 HG SER A 5 -24.780 -15.558 -16.043 1.00 0.00 H new ATOM 48 N SER A 6 -28.589 -17.985 -13.836 1.00 0.00 N ATOM 49 CA SER A 6 -29.142 -18.774 -12.743 1.00 0.00 C ATOM 50 C SER A 6 -28.081 -19.058 -11.686 1.00 0.00 C ATOM 51 O SER A 6 -27.284 -19.986 -11.824 1.00 0.00 O ATOM 52 CB SER A 6 -29.716 -20.089 -13.274 1.00 0.00 C ATOM 53 OG SER A 6 -30.785 -19.853 -14.173 1.00 0.00 O ATOM 0 H SER A 6 -28.331 -18.529 -14.660 1.00 0.00 H new ATOM 0 HA SER A 6 -29.943 -18.197 -12.281 1.00 0.00 H new ATOM 0 HB2 SER A 6 -28.932 -20.655 -13.777 1.00 0.00 H new ATOM 0 HB3 SER A 6 -30.065 -20.699 -12.441 1.00 0.00 H new ATOM 0 HG SER A 6 -31.133 -20.709 -14.499 1.00 0.00 H new ATOM 59 N GLY A 7 -28.075 -18.252 -10.627 1.00 0.00 N ATOM 60 CA GLY A 7 -27.107 -18.434 -9.562 1.00 0.00 C ATOM 61 C GLY A 7 -26.160 -17.256 -9.433 1.00 0.00 C ATOM 62 O GLY A 7 -25.168 -17.170 -10.155 1.00 0.00 O ATOM 0 H GLY A 7 -28.723 -17.477 -10.489 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.632 -18.579 -8.618 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -26.531 -19.341 -9.749 1.00 0.00 H new ATOM 66 N GLN A 8 -26.469 -16.349 -8.512 1.00 0.00 N ATOM 67 CA GLN A 8 -25.638 -15.171 -8.294 1.00 0.00 C ATOM 68 C GLN A 8 -24.741 -15.356 -7.075 1.00 0.00 C ATOM 69 O GLN A 8 -23.721 -14.681 -6.936 1.00 0.00 O ATOM 70 CB GLN A 8 -26.514 -13.930 -8.113 1.00 0.00 C ATOM 71 CG GLN A 8 -27.338 -13.947 -6.837 1.00 0.00 C ATOM 72 CD GLN A 8 -28.695 -14.599 -7.027 1.00 0.00 C ATOM 73 OE1 GLN A 8 -29.315 -14.471 -8.083 1.00 0.00 O ATOM 74 NE2 GLN A 8 -29.162 -15.304 -6.003 1.00 0.00 N ATOM 0 H GLN A 8 -27.287 -16.407 -7.906 1.00 0.00 H new ATOM 0 HA GLN A 8 -25.005 -15.036 -9.171 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -25.879 -13.044 -8.113 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -27.185 -13.842 -8.967 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -26.788 -14.480 -6.061 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -27.476 -12.925 -6.485 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -28.614 -15.383 -5.146 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -30.069 -15.766 -6.073 1.00 0.00 H new ATOM 83 N GLU A 9 -25.128 -16.274 -6.195 1.00 0.00 N ATOM 84 CA GLU A 9 -24.358 -16.545 -4.986 1.00 0.00 C ATOM 85 C GLU A 9 -23.493 -17.790 -5.162 1.00 0.00 C ATOM 86 O GLU A 9 -22.834 -18.239 -4.223 1.00 0.00 O ATOM 87 CB GLU A 9 -25.293 -16.726 -3.788 1.00 0.00 C ATOM 88 CG GLU A 9 -25.889 -15.424 -3.281 1.00 0.00 C ATOM 89 CD GLU A 9 -26.752 -15.620 -2.049 1.00 0.00 C ATOM 90 OE1 GLU A 9 -27.759 -16.352 -2.140 1.00 0.00 O ATOM 91 OE2 GLU A 9 -26.420 -15.040 -0.994 1.00 0.00 O ATOM 0 H GLU A 9 -25.969 -16.842 -6.296 1.00 0.00 H new ATOM 0 HA GLU A 9 -23.706 -15.691 -4.802 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -26.101 -17.402 -4.067 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -24.743 -17.204 -2.977 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -25.084 -14.726 -3.050 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -26.487 -14.970 -4.071 1.00 0.00 H new ATOM 98 N TYR A 10 -23.499 -18.343 -6.370 1.00 0.00 N ATOM 99 CA TYR A 10 -22.717 -19.537 -6.668 1.00 0.00 C ATOM 100 C TYR A 10 -21.383 -19.514 -5.927 1.00 0.00 C ATOM 101 O TYR A 10 -20.905 -20.545 -5.456 1.00 0.00 O ATOM 102 CB TYR A 10 -22.476 -19.650 -8.174 1.00 0.00 C ATOM 103 CG TYR A 10 -21.487 -18.637 -8.707 1.00 0.00 C ATOM 104 CD1 TYR A 10 -21.624 -17.285 -8.419 1.00 0.00 C ATOM 105 CD2 TYR A 10 -20.415 -19.033 -9.497 1.00 0.00 C ATOM 106 CE1 TYR A 10 -20.725 -16.357 -8.904 1.00 0.00 C ATOM 107 CE2 TYR A 10 -19.509 -18.112 -9.986 1.00 0.00 C ATOM 108 CZ TYR A 10 -19.668 -16.775 -9.687 1.00 0.00 C ATOM 109 OH TYR A 10 -18.768 -15.853 -10.172 1.00 0.00 O ATOM 0 H TYR A 10 -24.037 -17.983 -7.159 1.00 0.00 H new ATOM 0 HA TYR A 10 -23.283 -20.405 -6.331 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -22.114 -20.653 -8.401 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -23.425 -19.528 -8.696 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -22.448 -16.954 -7.805 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -20.288 -20.079 -9.733 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -20.848 -15.309 -8.672 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -18.681 -18.437 -10.599 1.00 0.00 H new ATOM 0 HH TYR A 10 -18.084 -16.312 -10.704 1.00 0.00 H new ATOM 119 N ILE A 11 -20.788 -18.329 -5.830 1.00 0.00 N ATOM 120 CA ILE A 11 -19.511 -18.171 -5.146 1.00 0.00 C ATOM 121 C ILE A 11 -19.550 -16.996 -4.175 1.00 0.00 C ATOM 122 O ILE A 11 -18.919 -17.030 -3.118 1.00 0.00 O ATOM 123 CB ILE A 11 -18.360 -17.956 -6.146 1.00 0.00 C ATOM 124 CG1 ILE A 11 -18.137 -19.219 -6.981 1.00 0.00 C ATOM 125 CG2 ILE A 11 -17.085 -17.568 -5.412 1.00 0.00 C ATOM 126 CD1 ILE A 11 -17.211 -19.011 -8.158 1.00 0.00 C ATOM 0 H ILE A 11 -21.170 -17.466 -6.216 1.00 0.00 H new ATOM 0 HA ILE A 11 -19.334 -19.093 -4.592 1.00 0.00 H new ATOM 0 HB ILE A 11 -18.631 -17.142 -6.818 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -17.727 -20.000 -6.341 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -19.099 -19.578 -7.346 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -16.281 -17.420 -6.133 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -17.251 -16.644 -4.858 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -16.808 -18.362 -4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -17.100 -19.948 -8.703 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -17.629 -18.253 -8.820 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -16.236 -18.682 -7.800 1.00 0.00 H new ATOM 138 N LEU A 12 -20.297 -15.960 -4.537 1.00 0.00 N ATOM 139 CA LEU A 12 -20.422 -14.774 -3.695 1.00 0.00 C ATOM 140 C LEU A 12 -20.844 -15.153 -2.279 1.00 0.00 C ATOM 141 O LEU A 12 -20.672 -14.376 -1.342 1.00 0.00 O ATOM 142 CB LEU A 12 -21.436 -13.801 -4.298 1.00 0.00 C ATOM 143 CG LEU A 12 -20.888 -12.816 -5.332 1.00 0.00 C ATOM 144 CD1 LEU A 12 -22.026 -12.122 -6.065 1.00 0.00 C ATOM 145 CD2 LEU A 12 -19.979 -11.793 -4.664 1.00 0.00 C ATOM 0 H LEU A 12 -20.826 -15.916 -5.408 1.00 0.00 H new ATOM 0 HA LEU A 12 -19.447 -14.289 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -22.233 -14.381 -4.764 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -21.889 -13.231 -3.487 1.00 0.00 H new ATOM 0 HG LEU A 12 -20.301 -13.374 -6.061 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.616 -11.425 -6.796 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -22.637 -12.866 -6.576 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -22.641 -11.577 -5.349 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -19.598 -11.100 -5.414 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -20.543 -11.240 -3.913 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -19.144 -12.305 -4.186 1.00 0.00 H new ATOM 157 N ALA A 13 -21.394 -16.354 -2.133 1.00 0.00 N ATOM 158 CA ALA A 13 -21.837 -16.838 -0.831 1.00 0.00 C ATOM 159 C ALA A 13 -20.715 -17.576 -0.110 1.00 0.00 C ATOM 160 O ALA A 13 -20.611 -17.524 1.116 1.00 0.00 O ATOM 161 CB ALA A 13 -23.050 -17.743 -0.989 1.00 0.00 C ATOM 0 H ALA A 13 -21.543 -17.010 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 13 -22.117 -15.976 -0.226 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.370 -18.097 -0.009 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -23.862 -17.185 -1.456 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -22.788 -18.596 -1.615 1.00 0.00 H new ATOM 167 N LEU A 14 -19.877 -18.265 -0.878 1.00 0.00 N ATOM 168 CA LEU A 14 -18.761 -19.014 -0.311 1.00 0.00 C ATOM 169 C LEU A 14 -17.453 -18.247 -0.467 1.00 0.00 C ATOM 170 O LEU A 14 -16.369 -18.820 -0.363 1.00 0.00 O ATOM 171 CB LEU A 14 -18.646 -20.383 -0.985 1.00 0.00 C ATOM 172 CG LEU A 14 -19.929 -21.212 -1.043 1.00 0.00 C ATOM 173 CD1 LEU A 14 -19.795 -22.334 -2.061 1.00 0.00 C ATOM 174 CD2 LEU A 14 -20.263 -21.775 0.331 1.00 0.00 C ATOM 0 H LEU A 14 -19.949 -18.320 -1.894 1.00 0.00 H new ATOM 0 HA LEU A 14 -18.953 -19.153 0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -18.286 -20.235 -2.003 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -17.887 -20.962 -0.459 1.00 0.00 H new ATOM 0 HG LEU A 14 -20.745 -20.560 -1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -20.718 -22.913 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -19.604 -21.910 -3.047 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -18.967 -22.984 -1.779 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -21.179 -22.362 0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -19.446 -22.411 0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -20.403 -20.955 1.036 1.00 0.00 H new ATOM 186 N ALA A 15 -17.563 -16.946 -0.716 1.00 0.00 N ATOM 187 CA ALA A 15 -16.388 -16.098 -0.882 1.00 0.00 C ATOM 188 C ALA A 15 -15.997 -15.436 0.435 1.00 0.00 C ATOM 189 O ALA A 15 -16.699 -15.568 1.439 1.00 0.00 O ATOM 190 CB ALA A 15 -16.646 -15.044 -1.949 1.00 0.00 C ATOM 0 H ALA A 15 -18.453 -16.456 -0.807 1.00 0.00 H new ATOM 0 HA ALA A 15 -15.558 -16.728 -1.201 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.761 -14.418 -2.063 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.869 -15.533 -2.897 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.493 -14.425 -1.652 1.00 0.00 H new ATOM 196 N ASP A 16 -14.875 -14.726 0.425 1.00 0.00 N ATOM 197 CA ASP A 16 -14.391 -14.044 1.619 1.00 0.00 C ATOM 198 C ASP A 16 -13.547 -12.830 1.246 1.00 0.00 C ATOM 199 O ASP A 16 -13.186 -12.644 0.085 1.00 0.00 O ATOM 200 CB ASP A 16 -13.574 -15.003 2.485 1.00 0.00 C ATOM 201 CG ASP A 16 -12.850 -14.293 3.612 1.00 0.00 C ATOM 202 OD1 ASP A 16 -13.532 -13.715 4.484 1.00 0.00 O ATOM 203 OD2 ASP A 16 -11.601 -14.314 3.622 1.00 0.00 O ATOM 0 H ASP A 16 -14.283 -14.608 -0.397 1.00 0.00 H new ATOM 0 HA ASP A 16 -15.256 -13.702 2.188 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -14.235 -15.762 2.903 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -12.847 -15.522 1.860 1.00 0.00 H new ATOM 208 N VAL A 17 -13.234 -12.004 2.241 1.00 0.00 N ATOM 209 CA VAL A 17 -12.431 -10.808 2.018 1.00 0.00 C ATOM 210 C VAL A 17 -10.987 -11.168 1.688 1.00 0.00 C ATOM 211 O VAL A 17 -10.463 -12.196 2.119 1.00 0.00 O ATOM 212 CB VAL A 17 -12.449 -9.883 3.250 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.820 -9.246 3.420 1.00 0.00 C ATOM 214 CG2 VAL A 17 -12.051 -10.652 4.500 1.00 0.00 C ATOM 0 H VAL A 17 -13.525 -12.142 3.209 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.874 -10.283 1.171 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.721 -9.086 3.095 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.813 -8.596 4.295 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -14.061 -8.659 2.534 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.570 -10.026 3.553 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.069 -9.983 5.360 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -12.752 -11.471 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.046 -11.055 4.375 1.00 0.00 H new ATOM 224 N PRO A 18 -10.326 -10.304 0.904 1.00 0.00 N ATOM 225 CA PRO A 18 -8.932 -10.509 0.499 1.00 0.00 C ATOM 226 C PRO A 18 -7.960 -10.348 1.663 1.00 0.00 C ATOM 227 O PRO A 18 -8.296 -9.751 2.687 1.00 0.00 O ATOM 228 CB PRO A 18 -8.702 -9.413 -0.545 1.00 0.00 C ATOM 229 CG PRO A 18 -9.684 -8.348 -0.199 1.00 0.00 C ATOM 230 CD PRO A 18 -10.888 -9.058 0.354 1.00 0.00 C ATOM 0 HA PRO A 18 -8.761 -11.518 0.124 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.680 -9.037 -0.505 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.865 -9.788 -1.555 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.268 -7.657 0.534 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.948 -7.760 -1.078 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.385 -8.467 1.124 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -11.628 -9.258 -0.421 1.00 0.00 H new ATOM 238 N SER A 19 -6.755 -10.885 1.501 1.00 0.00 N ATOM 239 CA SER A 19 -5.735 -10.804 2.540 1.00 0.00 C ATOM 240 C SER A 19 -4.949 -9.502 2.428 1.00 0.00 C ATOM 241 O SER A 19 -5.059 -8.780 1.438 1.00 0.00 O ATOM 242 CB SER A 19 -4.784 -11.998 2.443 1.00 0.00 C ATOM 243 OG SER A 19 -4.261 -12.336 3.717 1.00 0.00 O ATOM 0 H SER A 19 -6.461 -11.381 0.660 1.00 0.00 H new ATOM 0 HA SER A 19 -6.234 -10.824 3.509 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.312 -12.855 2.024 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.967 -11.762 1.761 1.00 0.00 H new ATOM 0 HG SER A 19 -3.657 -13.103 3.630 1.00 0.00 H new ATOM 249 N SER A 20 -4.154 -9.208 3.453 1.00 0.00 N ATOM 250 CA SER A 20 -3.351 -7.992 3.473 1.00 0.00 C ATOM 251 C SER A 20 -2.200 -8.084 2.476 1.00 0.00 C ATOM 252 O SER A 20 -1.517 -9.103 2.369 1.00 0.00 O ATOM 253 CB SER A 20 -2.803 -7.740 4.879 1.00 0.00 C ATOM 254 OG SER A 20 -2.151 -8.892 5.386 1.00 0.00 O ATOM 0 H SER A 20 -4.050 -9.796 4.280 1.00 0.00 H new ATOM 0 HA SER A 20 -3.992 -7.159 3.186 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.105 -6.903 4.856 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.618 -7.457 5.545 1.00 0.00 H new ATOM 0 HG SER A 20 -1.808 -8.705 6.285 1.00 0.00 H new ATOM 260 N PRO A 21 -1.978 -6.993 1.728 1.00 0.00 N ATOM 261 CA PRO A 21 -0.910 -6.925 0.726 1.00 0.00 C ATOM 262 C PRO A 21 0.477 -6.893 1.358 1.00 0.00 C ATOM 263 O PRO A 21 0.616 -6.684 2.564 1.00 0.00 O ATOM 264 CB PRO A 21 -1.194 -5.610 -0.006 1.00 0.00 C ATOM 265 CG PRO A 21 -1.938 -4.780 0.982 1.00 0.00 C ATOM 266 CD PRO A 21 -2.751 -5.743 1.802 1.00 0.00 C ATOM 0 HA PRO A 21 -0.906 -7.799 0.075 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.270 -5.122 -0.317 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.785 -5.778 -0.907 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.252 -4.214 1.612 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.580 -4.057 0.479 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.862 -5.400 2.831 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.755 -5.867 1.397 1.00 0.00 H new ATOM 274 N TYR A 22 1.501 -7.100 0.538 1.00 0.00 N ATOM 275 CA TYR A 22 2.878 -7.098 1.018 1.00 0.00 C ATOM 276 C TYR A 22 3.805 -6.427 0.009 1.00 0.00 C ATOM 277 O TYR A 22 3.415 -6.155 -1.125 1.00 0.00 O ATOM 278 CB TYR A 22 3.348 -8.527 1.289 1.00 0.00 C ATOM 279 CG TYR A 22 3.379 -9.399 0.054 1.00 0.00 C ATOM 280 CD1 TYR A 22 2.247 -10.090 -0.360 1.00 0.00 C ATOM 281 CD2 TYR A 22 4.540 -9.533 -0.697 1.00 0.00 C ATOM 282 CE1 TYR A 22 2.270 -10.888 -1.487 1.00 0.00 C ATOM 283 CE2 TYR A 22 4.572 -10.328 -1.826 1.00 0.00 C ATOM 284 CZ TYR A 22 3.435 -11.003 -2.217 1.00 0.00 C ATOM 285 OH TYR A 22 3.464 -11.797 -3.342 1.00 0.00 O ATOM 0 H TYR A 22 1.404 -7.271 -0.463 1.00 0.00 H new ATOM 0 HA TYR A 22 2.911 -6.530 1.948 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.346 -8.495 1.726 1.00 0.00 H new ATOM 0 HB3 TYR A 22 2.690 -8.983 2.029 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.333 -10.002 0.209 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.433 -9.007 -0.393 1.00 0.00 H new ATOM 0 HE1 TYR A 22 1.381 -11.419 -1.795 1.00 0.00 H new ATOM 0 HE2 TYR A 22 5.483 -10.420 -2.399 1.00 0.00 H new ATOM 0 HH TYR A 22 4.359 -11.768 -3.740 1.00 0.00 H new ATOM 295 N GLY A 23 5.038 -6.165 0.432 1.00 0.00 N ATOM 296 CA GLY A 23 6.003 -5.529 -0.446 1.00 0.00 C ATOM 297 C GLY A 23 5.834 -4.024 -0.503 1.00 0.00 C ATOM 298 O GLY A 23 6.339 -3.368 -1.414 1.00 0.00 O ATOM 0 H GLY A 23 5.386 -6.382 1.366 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.011 -5.765 -0.104 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.902 -5.941 -1.450 1.00 0.00 H new ATOM 302 N VAL A 24 5.118 -3.474 0.473 1.00 0.00 N ATOM 303 CA VAL A 24 4.881 -2.036 0.530 1.00 0.00 C ATOM 304 C VAL A 24 6.168 -1.279 0.839 1.00 0.00 C ATOM 305 O VAL A 24 6.644 -1.276 1.973 1.00 0.00 O ATOM 306 CB VAL A 24 3.824 -1.684 1.594 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.581 -0.182 1.629 1.00 0.00 C ATOM 308 CG2 VAL A 24 2.528 -2.435 1.327 1.00 0.00 C ATOM 0 H VAL A 24 4.692 -4.002 1.235 1.00 0.00 H new ATOM 0 HA VAL A 24 4.513 -1.736 -0.451 1.00 0.00 H new ATOM 0 HB VAL A 24 4.201 -1.991 2.570 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.832 0.048 2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.511 0.332 1.872 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.226 0.152 0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.793 -2.174 2.088 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.145 -2.162 0.344 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.716 -3.508 1.357 1.00 0.00 H new ATOM 318 N LYS A 25 6.728 -0.638 -0.182 1.00 0.00 N ATOM 319 CA LYS A 25 7.961 0.126 -0.022 1.00 0.00 C ATOM 320 C LYS A 25 7.919 1.405 -0.853 1.00 0.00 C ATOM 321 O LYS A 25 7.439 1.405 -1.986 1.00 0.00 O ATOM 322 CB LYS A 25 9.167 -0.722 -0.432 1.00 0.00 C ATOM 323 CG LYS A 25 9.021 -1.365 -1.800 1.00 0.00 C ATOM 324 CD LYS A 25 9.553 -0.461 -2.900 1.00 0.00 C ATOM 325 CE LYS A 25 11.036 -0.695 -3.144 1.00 0.00 C ATOM 326 NZ LYS A 25 11.884 0.183 -2.291 1.00 0.00 N ATOM 0 H LYS A 25 6.348 -0.632 -1.129 1.00 0.00 H new ATOM 0 HA LYS A 25 8.057 0.399 1.029 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.059 -0.096 -0.427 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.322 -1.503 0.313 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.557 -2.314 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.971 -1.589 -1.988 1.00 0.00 H new ATOM 0 HD2 LYS A 25 8.999 -0.642 -3.821 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.388 0.581 -2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.277 -1.739 -2.943 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.265 -0.512 -4.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.809 0.320 -2.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.418 1.105 -2.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.018 -0.262 -1.361 1.00 0.00 H new ATOM 340 N ILE A 26 8.427 2.492 -0.281 1.00 0.00 N ATOM 341 CA ILE A 26 8.450 3.776 -0.971 1.00 0.00 C ATOM 342 C ILE A 26 9.621 3.857 -1.943 1.00 0.00 C ATOM 343 O ILE A 26 10.782 3.755 -1.544 1.00 0.00 O ATOM 344 CB ILE A 26 8.543 4.947 0.025 1.00 0.00 C ATOM 345 CG1 ILE A 26 7.442 4.837 1.082 1.00 0.00 C ATOM 346 CG2 ILE A 26 8.447 6.277 -0.710 1.00 0.00 C ATOM 347 CD1 ILE A 26 6.054 4.706 0.496 1.00 0.00 C ATOM 0 H ILE A 26 8.828 2.509 0.657 1.00 0.00 H new ATOM 0 HA ILE A 26 7.515 3.853 -1.526 1.00 0.00 H new ATOM 0 HB ILE A 26 9.509 4.900 0.528 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.643 3.973 1.716 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.475 5.718 1.723 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.514 7.095 0.007 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.264 6.356 -1.428 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.494 6.334 -1.237 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.324 4.633 1.302 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.833 5.581 -0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.003 3.810 -0.122 1.00 0.00 H new ATOM 359 N ILE A 27 9.310 4.041 -3.222 1.00 0.00 N ATOM 360 CA ILE A 27 10.336 4.139 -4.251 1.00 0.00 C ATOM 361 C ILE A 27 10.626 5.593 -4.605 1.00 0.00 C ATOM 362 O ILE A 27 11.777 5.975 -4.811 1.00 0.00 O ATOM 363 CB ILE A 27 9.925 3.385 -5.531 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.579 3.903 -6.044 1.00 0.00 C ATOM 365 CG2 ILE A 27 9.855 1.888 -5.264 1.00 0.00 C ATOM 366 CD1 ILE A 27 8.134 3.253 -7.334 1.00 0.00 C ATOM 0 H ILE A 27 8.355 4.125 -3.570 1.00 0.00 H new ATOM 0 HA ILE A 27 11.236 3.681 -3.841 1.00 0.00 H new ATOM 0 HB ILE A 27 10.678 3.563 -6.298 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.819 3.735 -5.281 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.647 4.981 -6.194 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.564 1.369 -6.177 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.832 1.530 -4.939 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.119 1.692 -4.484 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.173 3.668 -7.638 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.874 3.443 -8.111 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.034 2.178 -7.184 1.00 0.00 H new ATOM 378 N GLU A 28 9.572 6.402 -4.670 1.00 0.00 N ATOM 379 CA GLU A 28 9.713 7.815 -4.996 1.00 0.00 C ATOM 380 C GLU A 28 9.126 8.690 -3.891 1.00 0.00 C ATOM 381 O GLU A 28 7.915 8.905 -3.831 1.00 0.00 O ATOM 382 CB GLU A 28 9.026 8.126 -6.327 1.00 0.00 C ATOM 383 CG GLU A 28 9.621 7.378 -7.508 1.00 0.00 C ATOM 384 CD GLU A 28 9.427 8.112 -8.821 1.00 0.00 C ATOM 385 OE1 GLU A 28 10.091 9.150 -9.023 1.00 0.00 O ATOM 386 OE2 GLU A 28 8.611 7.649 -9.645 1.00 0.00 O ATOM 0 H GLU A 28 8.612 6.102 -4.501 1.00 0.00 H new ATOM 0 HA GLU A 28 10.777 8.036 -5.085 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.968 7.878 -6.247 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.089 9.197 -6.517 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.686 7.224 -7.336 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.163 6.391 -7.576 1.00 0.00 H new ATOM 393 N LEU A 29 9.994 9.192 -3.019 1.00 0.00 N ATOM 394 CA LEU A 29 9.563 10.043 -1.916 1.00 0.00 C ATOM 395 C LEU A 29 9.989 11.490 -2.146 1.00 0.00 C ATOM 396 O LEU A 29 11.154 11.766 -2.430 1.00 0.00 O ATOM 397 CB LEU A 29 10.143 9.533 -0.595 1.00 0.00 C ATOM 398 CG LEU A 29 9.995 10.466 0.608 1.00 0.00 C ATOM 399 CD1 LEU A 29 8.574 10.422 1.146 1.00 0.00 C ATOM 400 CD2 LEU A 29 10.991 10.092 1.697 1.00 0.00 C ATOM 0 H LEU A 29 11.000 9.024 -3.055 1.00 0.00 H new ATOM 0 HA LEU A 29 8.475 10.007 -1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.665 8.584 -0.354 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.203 9.328 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 29 10.207 11.484 0.282 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.488 11.092 2.001 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.880 10.737 0.367 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.334 9.405 1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.872 10.766 2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.810 9.067 2.019 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.005 10.175 1.307 1.00 0.00 H new ATOM 412 N SER A 30 9.037 12.409 -2.019 1.00 0.00 N ATOM 413 CA SER A 30 9.313 13.827 -2.215 1.00 0.00 C ATOM 414 C SER A 30 9.052 14.613 -0.933 1.00 0.00 C ATOM 415 O SER A 30 8.759 14.034 0.113 1.00 0.00 O ATOM 416 CB SER A 30 8.453 14.384 -3.351 1.00 0.00 C ATOM 417 OG SER A 30 8.529 15.798 -3.402 1.00 0.00 O ATOM 0 H SER A 30 8.068 12.197 -1.781 1.00 0.00 H new ATOM 0 HA SER A 30 10.365 13.934 -2.479 1.00 0.00 H new ATOM 0 HB2 SER A 30 8.784 13.964 -4.301 1.00 0.00 H new ATOM 0 HB3 SER A 30 7.417 14.077 -3.211 1.00 0.00 H new ATOM 0 HG SER A 30 7.972 16.129 -4.137 1.00 0.00 H new ATOM 423 N GLN A 31 9.163 15.935 -1.024 1.00 0.00 N ATOM 424 CA GLN A 31 8.940 16.800 0.129 1.00 0.00 C ATOM 425 C GLN A 31 7.450 16.961 0.409 1.00 0.00 C ATOM 426 O GLN A 31 7.039 17.157 1.553 1.00 0.00 O ATOM 427 CB GLN A 31 9.578 18.171 -0.107 1.00 0.00 C ATOM 428 CG GLN A 31 9.616 18.581 -1.570 1.00 0.00 C ATOM 429 CD GLN A 31 10.897 18.157 -2.261 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.867 17.495 -3.298 1.00 0.00 O ATOM 431 NE2 GLN A 31 12.033 18.539 -1.688 1.00 0.00 N ATOM 0 H GLN A 31 9.406 16.429 -1.883 1.00 0.00 H new ATOM 0 HA GLN A 31 9.405 16.334 0.998 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.025 18.922 0.458 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.595 18.162 0.286 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.765 18.141 -2.089 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.509 19.663 -1.643 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.011 19.087 -0.828 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.927 18.284 -2.108 1.00 0.00 H new ATOM 440 N THR A 32 6.642 16.876 -0.644 1.00 0.00 N ATOM 441 CA THR A 32 5.197 17.012 -0.511 1.00 0.00 C ATOM 442 C THR A 32 4.477 15.771 -1.026 1.00 0.00 C ATOM 443 O THR A 32 3.379 15.444 -0.574 1.00 0.00 O ATOM 444 CB THR A 32 4.677 18.246 -1.274 1.00 0.00 C ATOM 445 OG1 THR A 32 4.955 18.110 -2.672 1.00 0.00 O ATOM 446 CG2 THR A 32 5.320 19.519 -0.745 1.00 0.00 C ATOM 0 H THR A 32 6.964 16.714 -1.598 1.00 0.00 H new ATOM 0 HA THR A 32 4.988 17.135 0.552 1.00 0.00 H new ATOM 0 HB THR A 32 3.600 18.312 -1.123 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.620 18.897 -3.150 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.938 20.377 -1.298 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.082 19.634 0.313 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.401 19.459 -0.869 1.00 0.00 H new ATOM 454 N THR A 33 5.103 15.080 -1.973 1.00 0.00 N ATOM 455 CA THR A 33 4.522 13.874 -2.549 1.00 0.00 C ATOM 456 C THR A 33 5.248 12.626 -2.060 1.00 0.00 C ATOM 457 O THR A 33 6.386 12.699 -1.599 1.00 0.00 O ATOM 458 CB THR A 33 4.566 13.909 -4.089 1.00 0.00 C ATOM 459 OG1 THR A 33 5.698 14.668 -4.530 1.00 0.00 O ATOM 460 CG2 THR A 33 3.291 14.516 -4.654 1.00 0.00 C ATOM 0 H THR A 33 6.013 15.335 -2.357 1.00 0.00 H new ATOM 0 HA THR A 33 3.483 13.838 -2.223 1.00 0.00 H new ATOM 0 HB THR A 33 4.653 12.884 -4.451 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.720 14.684 -5.510 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.346 14.530 -5.743 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.434 13.919 -4.341 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.178 15.535 -4.283 1.00 0.00 H new ATOM 468 N ALA A 34 4.582 11.481 -2.165 1.00 0.00 N ATOM 469 CA ALA A 34 5.165 10.216 -1.735 1.00 0.00 C ATOM 470 C ALA A 34 4.498 9.037 -2.436 1.00 0.00 C ATOM 471 O ALA A 34 3.307 8.787 -2.255 1.00 0.00 O ATOM 472 CB ALA A 34 5.051 10.067 -0.225 1.00 0.00 C ATOM 0 H ALA A 34 3.638 11.403 -2.544 1.00 0.00 H new ATOM 0 HA ALA A 34 6.220 10.220 -2.010 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.491 9.118 0.081 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.580 10.886 0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 34 4.000 10.091 0.065 1.00 0.00 H new ATOM 478 N LYS A 35 5.274 8.316 -3.239 1.00 0.00 N ATOM 479 CA LYS A 35 4.760 7.163 -3.968 1.00 0.00 C ATOM 480 C LYS A 35 4.974 5.878 -3.174 1.00 0.00 C ATOM 481 O LYS A 35 6.051 5.648 -2.624 1.00 0.00 O ATOM 482 CB LYS A 35 5.442 7.051 -5.333 1.00 0.00 C ATOM 483 CG LYS A 35 4.866 5.955 -6.213 1.00 0.00 C ATOM 484 CD LYS A 35 5.619 5.842 -7.528 1.00 0.00 C ATOM 485 CE LYS A 35 5.357 7.042 -8.424 1.00 0.00 C ATOM 486 NZ LYS A 35 5.946 6.861 -9.780 1.00 0.00 N ATOM 0 H LYS A 35 6.262 8.511 -3.401 1.00 0.00 H new ATOM 0 HA LYS A 35 3.689 7.305 -4.114 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.355 8.005 -5.852 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.506 6.864 -5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.910 5.003 -5.685 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.814 6.162 -6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.688 5.760 -7.331 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.319 4.929 -8.043 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.282 7.201 -8.513 1.00 0.00 H new ATOM 0 HE3 LYS A 35 5.774 7.937 -7.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.805 7.727 -10.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.964 6.667 -9.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 5.481 6.062 -10.257 1.00 0.00 H new ATOM 500 N VAL A 36 3.942 5.042 -3.120 1.00 0.00 N ATOM 501 CA VAL A 36 4.018 3.778 -2.396 1.00 0.00 C ATOM 502 C VAL A 36 3.804 2.595 -3.332 1.00 0.00 C ATOM 503 O VAL A 36 2.712 2.403 -3.868 1.00 0.00 O ATOM 504 CB VAL A 36 2.976 3.718 -1.263 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.568 3.836 -1.825 1.00 0.00 C ATOM 506 CG2 VAL A 36 3.134 2.434 -0.463 1.00 0.00 C ATOM 0 H VAL A 36 3.043 5.217 -3.569 1.00 0.00 H new ATOM 0 HA VAL A 36 5.017 3.719 -1.965 1.00 0.00 H new ATOM 0 HB VAL A 36 3.145 4.561 -0.592 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.846 3.792 -1.010 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.464 4.785 -2.350 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.383 3.016 -2.519 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.390 2.408 0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.992 1.576 -1.120 1.00 0.00 H new ATOM 0 HG23 VAL A 36 4.133 2.397 -0.028 1.00 0.00 H new ATOM 516 N SER A 37 4.853 1.803 -3.525 1.00 0.00 N ATOM 517 CA SER A 37 4.782 0.638 -4.400 1.00 0.00 C ATOM 518 C SER A 37 4.688 -0.648 -3.585 1.00 0.00 C ATOM 519 O SER A 37 5.515 -0.905 -2.711 1.00 0.00 O ATOM 520 CB SER A 37 6.005 0.586 -5.317 1.00 0.00 C ATOM 521 OG SER A 37 5.762 -0.234 -6.446 1.00 0.00 O ATOM 0 H SER A 37 5.763 1.946 -3.087 1.00 0.00 H new ATOM 0 HA SER A 37 3.884 0.728 -5.011 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.261 1.594 -5.644 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.862 0.203 -4.763 1.00 0.00 H new ATOM 0 HG SER A 37 5.635 0.329 -7.238 1.00 0.00 H new ATOM 527 N PHE A 38 3.673 -1.455 -3.879 1.00 0.00 N ATOM 528 CA PHE A 38 3.469 -2.715 -3.175 1.00 0.00 C ATOM 529 C PHE A 38 3.190 -3.849 -4.157 1.00 0.00 C ATOM 530 O PHE A 38 3.223 -3.654 -5.371 1.00 0.00 O ATOM 531 CB PHE A 38 2.309 -2.587 -2.184 1.00 0.00 C ATOM 532 CG PHE A 38 1.144 -1.810 -2.723 1.00 0.00 C ATOM 533 CD1 PHE A 38 1.219 -0.434 -2.870 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.030 -2.455 -3.081 1.00 0.00 C ATOM 535 CE1 PHE A 38 0.147 0.284 -3.367 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.104 -1.742 -3.579 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.017 -0.371 -3.721 1.00 0.00 C ATOM 0 H PHE A 38 2.979 -1.258 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 38 4.382 -2.949 -2.628 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.971 -3.584 -1.902 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.669 -2.103 -1.276 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.126 0.084 -2.593 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.106 -3.527 -2.969 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.219 1.356 -3.478 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.012 -2.257 -3.857 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.857 0.188 -4.108 1.00 0.00 H new ATOM 547 N ASN A 39 2.917 -5.034 -3.622 1.00 0.00 N ATOM 548 CA ASN A 39 2.635 -6.201 -4.450 1.00 0.00 C ATOM 549 C ASN A 39 1.265 -6.786 -4.117 1.00 0.00 C ATOM 550 O ASN A 39 0.746 -6.591 -3.017 1.00 0.00 O ATOM 551 CB ASN A 39 3.717 -7.265 -4.257 1.00 0.00 C ATOM 552 CG ASN A 39 5.084 -6.787 -4.706 1.00 0.00 C ATOM 553 OD1 ASN A 39 5.197 -5.873 -5.524 1.00 0.00 O ATOM 554 ND2 ASN A 39 6.131 -7.404 -4.173 1.00 0.00 N ATOM 0 H ASN A 39 2.885 -5.212 -2.618 1.00 0.00 H new ATOM 0 HA ASN A 39 2.631 -5.883 -5.492 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.761 -7.548 -3.205 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.446 -8.160 -4.817 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.076 -7.126 -4.438 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.991 -8.156 -3.499 1.00 0.00 H new ATOM 561 N LYS A 40 0.686 -7.503 -5.073 1.00 0.00 N ATOM 562 CA LYS A 40 -0.622 -8.118 -4.882 1.00 0.00 C ATOM 563 C LYS A 40 -0.648 -8.960 -3.610 1.00 0.00 C ATOM 564 O LYS A 40 0.375 -9.478 -3.160 1.00 0.00 O ATOM 565 CB LYS A 40 -0.980 -8.989 -6.089 1.00 0.00 C ATOM 566 CG LYS A 40 -0.966 -8.236 -7.408 1.00 0.00 C ATOM 567 CD LYS A 40 -2.320 -7.613 -7.708 1.00 0.00 C ATOM 568 CE LYS A 40 -3.203 -8.557 -8.508 1.00 0.00 C ATOM 569 NZ LYS A 40 -3.040 -8.362 -9.974 1.00 0.00 N ATOM 0 H LYS A 40 1.102 -7.673 -5.989 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.359 -7.321 -4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -0.278 -9.820 -6.147 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -1.970 -9.418 -5.936 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -0.205 -7.456 -7.375 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.691 -8.916 -8.214 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.817 -7.353 -6.773 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.180 -6.686 -8.264 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -2.960 -9.588 -8.250 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.246 -8.398 -8.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -3.659 -9.025 -10.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.296 -7.386 -10.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.050 -8.539 -10.240 1.00 0.00 H new ATOM 583 N PRO A 41 -1.842 -9.101 -3.017 1.00 0.00 N ATOM 584 CA PRO A 41 -2.028 -9.880 -1.790 1.00 0.00 C ATOM 585 C PRO A 41 -1.857 -11.378 -2.022 1.00 0.00 C ATOM 586 O PRO A 41 -2.371 -11.928 -2.996 1.00 0.00 O ATOM 587 CB PRO A 41 -3.470 -9.565 -1.384 1.00 0.00 C ATOM 588 CG PRO A 41 -4.148 -9.189 -2.656 1.00 0.00 C ATOM 589 CD PRO A 41 -3.102 -8.511 -3.498 1.00 0.00 C ATOM 0 HA PRO A 41 -1.290 -9.623 -1.030 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.948 -10.428 -0.921 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.509 -8.752 -0.659 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.546 -10.069 -3.161 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.990 -8.522 -2.467 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.255 -8.702 -4.560 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.117 -7.429 -3.363 1.00 0.00 H new ATOM 597 N ASP A 42 -1.132 -12.032 -1.122 1.00 0.00 N ATOM 598 CA ASP A 42 -0.894 -13.467 -1.228 1.00 0.00 C ATOM 599 C ASP A 42 -2.166 -14.199 -1.644 1.00 0.00 C ATOM 600 O ASP A 42 -2.108 -15.271 -2.246 1.00 0.00 O ATOM 601 CB ASP A 42 -0.383 -14.021 0.103 1.00 0.00 C ATOM 602 CG ASP A 42 -0.330 -15.537 0.116 1.00 0.00 C ATOM 603 OD1 ASP A 42 0.311 -16.115 -0.785 1.00 0.00 O ATOM 604 OD2 ASP A 42 -0.930 -16.143 1.029 1.00 0.00 O ATOM 0 H ASP A 42 -0.699 -11.592 -0.310 1.00 0.00 H new ATOM 0 HA ASP A 42 -0.136 -13.629 -1.994 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.613 -13.624 0.301 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.030 -13.676 0.910 1.00 0.00 H new ATOM 609 N SER A 43 -3.313 -13.614 -1.318 1.00 0.00 N ATOM 610 CA SER A 43 -4.600 -14.212 -1.653 1.00 0.00 C ATOM 611 C SER A 43 -5.639 -13.136 -1.950 1.00 0.00 C ATOM 612 O SER A 43 -5.677 -12.095 -1.294 1.00 0.00 O ATOM 613 CB SER A 43 -5.085 -15.104 -0.508 1.00 0.00 C ATOM 614 OG SER A 43 -4.050 -15.957 -0.052 1.00 0.00 O ATOM 0 H SER A 43 -3.378 -12.725 -0.822 1.00 0.00 H new ATOM 0 HA SER A 43 -4.468 -14.821 -2.548 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.438 -14.484 0.316 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.932 -15.702 -0.843 1.00 0.00 H new ATOM 0 HG SER A 43 -4.385 -16.515 0.680 1.00 0.00 H new ATOM 620 N HIS A 44 -6.482 -13.395 -2.944 1.00 0.00 N ATOM 621 CA HIS A 44 -7.524 -12.450 -3.329 1.00 0.00 C ATOM 622 C HIS A 44 -8.877 -12.871 -2.763 1.00 0.00 C ATOM 623 O HIS A 44 -9.867 -12.152 -2.894 1.00 0.00 O ATOM 624 CB HIS A 44 -7.608 -12.343 -4.853 1.00 0.00 C ATOM 625 CG HIS A 44 -8.509 -13.362 -5.477 1.00 0.00 C ATOM 626 ND1 HIS A 44 -9.851 -13.465 -5.176 1.00 0.00 N ATOM 627 CD2 HIS A 44 -8.255 -14.328 -6.392 1.00 0.00 C ATOM 628 CE1 HIS A 44 -10.383 -14.451 -5.877 1.00 0.00 C ATOM 629 NE2 HIS A 44 -9.435 -14.990 -6.623 1.00 0.00 N ATOM 0 H HIS A 44 -6.464 -14.251 -3.498 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.265 -11.475 -2.917 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -7.961 -11.347 -5.120 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -6.607 -12.450 -5.272 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -10.354 -12.873 -4.516 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -7.302 -14.538 -6.854 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -11.416 -14.763 -5.845 1.00 0.00 H new ATOM 638 N GLY A 45 -8.912 -14.041 -2.133 1.00 0.00 N ATOM 639 CA GLY A 45 -10.147 -14.538 -1.557 1.00 0.00 C ATOM 640 C GLY A 45 -10.996 -15.289 -2.565 1.00 0.00 C ATOM 641 O GLY A 45 -10.484 -15.796 -3.562 1.00 0.00 O ATOM 0 H GLY A 45 -8.106 -14.654 -2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -9.915 -15.196 -0.720 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -10.719 -13.702 -1.156 1.00 0.00 H new ATOM 645 N GLY A 46 -12.297 -15.362 -2.302 1.00 0.00 N ATOM 646 CA GLY A 46 -13.197 -16.061 -3.202 1.00 0.00 C ATOM 647 C GLY A 46 -13.581 -15.221 -4.404 1.00 0.00 C ATOM 648 O GLY A 46 -13.799 -15.749 -5.494 1.00 0.00 O ATOM 0 H GLY A 46 -12.744 -14.950 -1.483 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -12.723 -16.982 -3.542 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -14.098 -16.348 -2.660 1.00 0.00 H new ATOM 652 N VAL A 47 -13.665 -13.910 -4.207 1.00 0.00 N ATOM 653 CA VAL A 47 -14.026 -12.995 -5.283 1.00 0.00 C ATOM 654 C VAL A 47 -12.834 -12.142 -5.703 1.00 0.00 C ATOM 655 O VAL A 47 -11.936 -11.856 -4.911 1.00 0.00 O ATOM 656 CB VAL A 47 -15.185 -12.070 -4.869 1.00 0.00 C ATOM 657 CG1 VAL A 47 -16.408 -12.887 -4.480 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.759 -11.159 -3.728 1.00 0.00 C ATOM 0 H VAL A 47 -13.488 -13.457 -3.311 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.345 -13.609 -6.126 1.00 0.00 H new ATOM 0 HB VAL A 47 -15.450 -11.446 -5.722 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -17.217 -12.216 -4.190 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.726 -13.493 -5.328 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -16.159 -13.538 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.591 -10.512 -3.449 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.465 -11.764 -2.870 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.915 -10.547 -4.047 1.00 0.00 H new ATOM 668 N PRO A 48 -12.824 -11.726 -6.978 1.00 0.00 N ATOM 669 CA PRO A 48 -11.749 -10.899 -7.532 1.00 0.00 C ATOM 670 C PRO A 48 -11.758 -9.482 -6.966 1.00 0.00 C ATOM 671 O PRO A 48 -12.797 -8.823 -6.936 1.00 0.00 O ATOM 672 CB PRO A 48 -12.054 -10.877 -9.031 1.00 0.00 C ATOM 673 CG PRO A 48 -13.521 -11.120 -9.123 1.00 0.00 C ATOM 674 CD PRO A 48 -13.863 -12.031 -7.976 1.00 0.00 C ATOM 0 HA PRO A 48 -10.763 -11.296 -7.290 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -11.783 -9.920 -9.476 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -11.491 -11.646 -9.561 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -14.076 -10.184 -9.057 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -13.781 -11.579 -10.077 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -14.863 -11.833 -7.589 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -13.839 -13.079 -8.274 1.00 0.00 H new ATOM 682 N ILE A 49 -10.594 -9.021 -6.520 1.00 0.00 N ATOM 683 CA ILE A 49 -10.468 -7.682 -5.958 1.00 0.00 C ATOM 684 C ILE A 49 -11.026 -6.631 -6.911 1.00 0.00 C ATOM 685 O ILE A 49 -10.978 -6.795 -8.131 1.00 0.00 O ATOM 686 CB ILE A 49 -9.002 -7.342 -5.637 1.00 0.00 C ATOM 687 CG1 ILE A 49 -8.486 -8.227 -4.500 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.867 -5.871 -5.271 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.978 -8.242 -4.381 1.00 0.00 C ATOM 0 H ILE A 49 -9.725 -9.555 -6.537 1.00 0.00 H new ATOM 0 HA ILE A 49 -11.045 -7.672 -5.033 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.399 -7.534 -6.524 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.913 -7.881 -3.559 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.840 -9.246 -4.655 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.824 -5.646 -5.047 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -9.199 -5.256 -6.107 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.481 -5.656 -4.396 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.685 -8.889 -3.555 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.544 -8.617 -5.308 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.618 -7.230 -4.195 1.00 0.00 H new ATOM 701 N HIS A 50 -11.552 -5.548 -6.348 1.00 0.00 N ATOM 702 CA HIS A 50 -12.117 -4.467 -7.149 1.00 0.00 C ATOM 703 C HIS A 50 -11.147 -3.292 -7.235 1.00 0.00 C ATOM 704 O HIS A 50 -10.840 -2.807 -8.325 1.00 0.00 O ATOM 705 CB HIS A 50 -13.446 -4.003 -6.553 1.00 0.00 C ATOM 706 CG HIS A 50 -14.609 -4.864 -6.939 1.00 0.00 C ATOM 707 ND1 HIS A 50 -15.890 -4.377 -7.087 1.00 0.00 N ATOM 708 CD2 HIS A 50 -14.678 -6.189 -7.212 1.00 0.00 C ATOM 709 CE1 HIS A 50 -16.697 -5.364 -7.430 1.00 0.00 C ATOM 710 NE2 HIS A 50 -15.987 -6.474 -7.514 1.00 0.00 N ATOM 0 H HIS A 50 -11.599 -5.395 -5.341 1.00 0.00 H new ATOM 0 HA HIS A 50 -12.292 -4.847 -8.156 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -13.361 -3.987 -5.466 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -13.640 -2.979 -6.873 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -13.857 -6.890 -7.195 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -17.758 -5.278 -7.611 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -16.351 -7.394 -7.763 1.00 0.00 H new ATOM 719 N HIS A 51 -10.669 -2.839 -6.081 1.00 0.00 N ATOM 720 CA HIS A 51 -9.735 -1.720 -6.027 1.00 0.00 C ATOM 721 C HIS A 51 -8.972 -1.713 -4.706 1.00 0.00 C ATOM 722 O HIS A 51 -9.286 -2.476 -3.792 1.00 0.00 O ATOM 723 CB HIS A 51 -10.478 -0.397 -6.208 1.00 0.00 C ATOM 724 CG HIS A 51 -11.214 0.048 -4.981 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.524 -0.295 -4.724 1.00 0.00 N ATOM 726 CD2 HIS A 51 -10.815 0.812 -3.938 1.00 0.00 C ATOM 727 CE1 HIS A 51 -12.900 0.240 -3.575 1.00 0.00 C ATOM 728 NE2 HIS A 51 -11.881 0.918 -3.078 1.00 0.00 N ATOM 0 H HIS A 51 -10.913 -3.229 -5.171 1.00 0.00 H new ATOM 0 HA HIS A 51 -9.018 -1.838 -6.840 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.764 0.375 -6.494 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -11.186 -0.497 -7.031 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -9.839 1.256 -3.806 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.874 0.140 -3.120 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.885 1.436 -2.199 1.00 0.00 H new ATOM 737 N TYR A 52 -7.969 -0.846 -4.612 1.00 0.00 N ATOM 738 CA TYR A 52 -7.160 -0.742 -3.404 1.00 0.00 C ATOM 739 C TYR A 52 -7.487 0.536 -2.637 1.00 0.00 C ATOM 740 O TYR A 52 -7.725 1.586 -3.234 1.00 0.00 O ATOM 741 CB TYR A 52 -5.672 -0.771 -3.757 1.00 0.00 C ATOM 742 CG TYR A 52 -5.173 -2.139 -4.164 1.00 0.00 C ATOM 743 CD1 TYR A 52 -4.782 -3.070 -3.210 1.00 0.00 C ATOM 744 CD2 TYR A 52 -5.093 -2.500 -5.503 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.324 -4.320 -3.577 1.00 0.00 C ATOM 746 CE2 TYR A 52 -4.638 -3.749 -5.880 1.00 0.00 C ATOM 747 CZ TYR A 52 -4.254 -4.655 -4.913 1.00 0.00 C ATOM 748 OH TYR A 52 -3.800 -5.900 -5.285 1.00 0.00 O ATOM 0 H TYR A 52 -7.697 -0.206 -5.358 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.393 -1.596 -2.768 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.486 -0.069 -4.570 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.097 -0.424 -2.899 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.837 -2.812 -2.163 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -5.392 -1.792 -6.262 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -4.022 -5.031 -2.822 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.583 -4.014 -6.925 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.501 -6.368 -5.785 1.00 0.00 H new ATOM 758 N GLN A 53 -7.496 0.438 -1.312 1.00 0.00 N ATOM 759 CA GLN A 53 -7.794 1.585 -0.464 1.00 0.00 C ATOM 760 C GLN A 53 -6.556 2.026 0.311 1.00 0.00 C ATOM 761 O GLN A 53 -6.004 1.265 1.106 1.00 0.00 O ATOM 762 CB GLN A 53 -8.925 1.248 0.510 1.00 0.00 C ATOM 763 CG GLN A 53 -9.752 2.453 0.924 1.00 0.00 C ATOM 764 CD GLN A 53 -9.203 3.142 2.157 1.00 0.00 C ATOM 765 OE1 GLN A 53 -8.090 3.669 2.144 1.00 0.00 O ATOM 766 NE2 GLN A 53 -9.982 3.143 3.232 1.00 0.00 N ATOM 0 H GLN A 53 -7.300 -0.424 -0.803 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.110 2.406 -1.107 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.581 0.509 0.050 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.500 0.786 1.401 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -9.787 3.165 0.100 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -10.777 2.137 1.116 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -10.897 2.694 3.199 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -9.665 3.592 4.091 1.00 0.00 H new ATOM 775 N VAL A 54 -6.125 3.261 0.074 1.00 0.00 N ATOM 776 CA VAL A 54 -4.952 3.804 0.748 1.00 0.00 C ATOM 777 C VAL A 54 -5.344 4.895 1.740 1.00 0.00 C ATOM 778 O VAL A 54 -6.103 5.804 1.408 1.00 0.00 O ATOM 779 CB VAL A 54 -3.940 4.381 -0.259 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.772 5.031 0.468 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.452 3.295 -1.205 1.00 0.00 C ATOM 0 H VAL A 54 -6.571 3.904 -0.580 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.486 2.978 1.285 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.440 5.148 -0.850 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.068 5.433 -0.261 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.141 5.839 1.100 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.269 4.288 1.087 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.738 3.720 -1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.969 2.503 -0.632 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.299 2.882 -1.752 1.00 0.00 H new ATOM 791 N ASP A 55 -4.819 4.796 2.957 1.00 0.00 N ATOM 792 CA ASP A 55 -5.112 5.775 3.997 1.00 0.00 C ATOM 793 C ASP A 55 -3.826 6.354 4.577 1.00 0.00 C ATOM 794 O ASP A 55 -3.018 5.633 5.164 1.00 0.00 O ATOM 795 CB ASP A 55 -5.946 5.136 5.107 1.00 0.00 C ATOM 796 CG ASP A 55 -6.833 4.017 4.596 1.00 0.00 C ATOM 797 OD1 ASP A 55 -6.308 3.105 3.923 1.00 0.00 O ATOM 798 OD2 ASP A 55 -8.050 4.054 4.869 1.00 0.00 O ATOM 0 H ASP A 55 -4.189 4.048 3.247 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.683 6.587 3.547 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -5.281 4.745 5.877 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.565 5.900 5.578 1.00 0.00 H new ATOM 803 N VAL A 56 -3.641 7.659 4.409 1.00 0.00 N ATOM 804 CA VAL A 56 -2.452 8.334 4.917 1.00 0.00 C ATOM 805 C VAL A 56 -2.828 9.547 5.761 1.00 0.00 C ATOM 806 O VAL A 56 -3.797 10.247 5.466 1.00 0.00 O ATOM 807 CB VAL A 56 -1.531 8.787 3.768 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.200 9.875 2.944 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.195 9.267 4.316 1.00 0.00 C ATOM 0 H VAL A 56 -4.299 8.270 3.925 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.919 7.614 5.538 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.346 7.934 3.115 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.534 10.182 2.137 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.129 9.492 2.522 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.417 10.732 3.581 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.444 9.583 3.492 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.359 10.107 4.991 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.289 8.455 4.859 1.00 0.00 H new ATOM 819 N LYS A 57 -2.054 9.791 6.814 1.00 0.00 N ATOM 820 CA LYS A 57 -2.303 10.919 7.701 1.00 0.00 C ATOM 821 C LYS A 57 -1.087 11.199 8.579 1.00 0.00 C ATOM 822 O LYS A 57 -0.148 10.406 8.624 1.00 0.00 O ATOM 823 CB LYS A 57 -3.526 10.646 8.578 1.00 0.00 C ATOM 824 CG LYS A 57 -3.192 9.969 9.897 1.00 0.00 C ATOM 825 CD LYS A 57 -4.411 9.866 10.797 1.00 0.00 C ATOM 826 CE LYS A 57 -4.066 9.224 12.131 1.00 0.00 C ATOM 827 NZ LYS A 57 -5.279 8.992 12.964 1.00 0.00 N ATOM 0 H LYS A 57 -1.249 9.221 7.073 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.495 11.797 7.085 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.034 11.589 8.782 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.226 10.020 8.025 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.796 8.972 9.705 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -2.409 10.530 10.407 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -4.824 10.860 10.967 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.184 9.280 10.299 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -3.558 8.276 11.957 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.370 9.864 12.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -5.029 8.405 13.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -5.654 9.905 13.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -6.002 8.505 12.397 1.00 0.00 H new ATOM 841 N GLU A 58 -1.114 12.331 9.277 1.00 0.00 N ATOM 842 CA GLU A 58 -0.014 12.712 10.155 1.00 0.00 C ATOM 843 C GLU A 58 -0.039 11.899 11.445 1.00 0.00 C ATOM 844 O GLU A 58 -1.102 11.646 12.012 1.00 0.00 O ATOM 845 CB GLU A 58 -0.085 14.206 10.479 1.00 0.00 C ATOM 846 CG GLU A 58 0.683 15.079 9.501 1.00 0.00 C ATOM 847 CD GLU A 58 0.205 16.518 9.504 1.00 0.00 C ATOM 848 OE1 GLU A 58 -1.001 16.743 9.272 1.00 0.00 O ATOM 849 OE2 GLU A 58 1.037 17.418 9.740 1.00 0.00 O ATOM 0 H GLU A 58 -1.885 12.999 9.251 1.00 0.00 H new ATOM 0 HA GLU A 58 0.921 12.504 9.634 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.129 14.518 10.488 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.306 14.370 11.483 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.744 15.052 9.751 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.582 14.669 8.496 1.00 0.00 H new ATOM 856 N VAL A 59 1.140 11.490 11.904 1.00 0.00 N ATOM 857 CA VAL A 59 1.253 10.705 13.127 1.00 0.00 C ATOM 858 C VAL A 59 0.607 11.426 14.305 1.00 0.00 C ATOM 859 O VAL A 59 0.387 10.835 15.361 1.00 0.00 O ATOM 860 CB VAL A 59 2.727 10.408 13.468 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.536 11.694 13.505 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.827 9.666 14.792 1.00 0.00 C ATOM 0 H VAL A 59 2.030 11.689 11.447 1.00 0.00 H new ATOM 0 HA VAL A 59 0.731 9.765 12.949 1.00 0.00 H new ATOM 0 HB VAL A 59 3.142 9.770 12.688 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.574 11.464 13.747 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.490 12.181 12.531 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.125 12.360 14.264 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.874 9.464 15.018 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.396 10.277 15.585 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.283 8.724 14.723 1.00 0.00 H new ATOM 872 N ALA A 60 0.305 12.706 14.115 1.00 0.00 N ATOM 873 CA ALA A 60 -0.320 13.506 15.159 1.00 0.00 C ATOM 874 C ALA A 60 -1.790 13.763 14.850 1.00 0.00 C ATOM 875 O ALA A 60 -2.608 13.913 15.758 1.00 0.00 O ATOM 876 CB ALA A 60 0.422 14.824 15.330 1.00 0.00 C ATOM 0 H ALA A 60 0.484 13.211 13.247 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.265 12.945 16.092 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.056 15.412 16.114 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.458 14.625 15.606 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.397 15.380 14.393 1.00 0.00 H new ATOM 882 N SER A 61 -2.120 13.812 13.564 1.00 0.00 N ATOM 883 CA SER A 61 -3.493 14.055 13.135 1.00 0.00 C ATOM 884 C SER A 61 -4.413 12.927 13.593 1.00 0.00 C ATOM 885 O SER A 61 -3.959 11.819 13.875 1.00 0.00 O ATOM 886 CB SER A 61 -3.556 14.193 11.612 1.00 0.00 C ATOM 887 OG SER A 61 -4.894 14.352 11.170 1.00 0.00 O ATOM 0 H SER A 61 -1.456 13.687 12.800 1.00 0.00 H new ATOM 0 HA SER A 61 -3.832 14.985 13.592 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.961 15.050 11.296 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.118 13.311 11.145 1.00 0.00 H new ATOM 0 HG SER A 61 -4.908 14.440 10.194 1.00 0.00 H new ATOM 893 N GLU A 62 -5.708 13.220 13.664 1.00 0.00 N ATOM 894 CA GLU A 62 -6.692 12.231 14.089 1.00 0.00 C ATOM 895 C GLU A 62 -7.555 11.783 12.914 1.00 0.00 C ATOM 896 O GLU A 62 -8.251 10.770 12.993 1.00 0.00 O ATOM 897 CB GLU A 62 -7.577 12.804 15.197 1.00 0.00 C ATOM 898 CG GLU A 62 -8.277 11.742 16.028 1.00 0.00 C ATOM 899 CD GLU A 62 -7.303 10.797 16.706 1.00 0.00 C ATOM 900 OE1 GLU A 62 -6.555 11.253 17.595 1.00 0.00 O ATOM 901 OE2 GLU A 62 -7.290 9.602 16.346 1.00 0.00 O ATOM 0 H GLU A 62 -6.100 14.133 13.433 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.155 11.364 14.474 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.966 13.423 15.854 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.327 13.456 14.750 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.894 12.226 16.785 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.948 11.169 15.388 1.00 0.00 H new ATOM 908 N ILE A 63 -7.503 12.543 11.825 1.00 0.00 N ATOM 909 CA ILE A 63 -8.280 12.224 10.634 1.00 0.00 C ATOM 910 C ILE A 63 -7.433 11.472 9.612 1.00 0.00 C ATOM 911 O ILE A 63 -6.248 11.756 9.443 1.00 0.00 O ATOM 912 CB ILE A 63 -8.849 13.495 9.976 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.707 14.271 10.977 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.662 13.133 8.741 1.00 0.00 C ATOM 915 CD1 ILE A 63 -10.987 13.559 11.356 1.00 0.00 C ATOM 0 H ILE A 63 -6.931 13.384 11.743 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.106 11.590 10.956 1.00 0.00 H new ATOM 0 HB ILE A 63 -8.019 14.131 9.667 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.122 14.455 11.878 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -9.954 15.244 10.553 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -10.058 14.041 8.287 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.024 12.617 8.024 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.487 12.481 9.027 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -11.544 14.167 12.068 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.592 13.399 10.464 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -10.748 12.597 11.809 1.00 0.00 H new ATOM 927 N TRP A 64 -8.051 10.514 8.931 1.00 0.00 N ATOM 928 CA TRP A 64 -7.355 9.722 7.923 1.00 0.00 C ATOM 929 C TRP A 64 -7.801 10.113 6.519 1.00 0.00 C ATOM 930 O TRP A 64 -8.994 10.278 6.259 1.00 0.00 O ATOM 931 CB TRP A 64 -7.605 8.231 8.154 1.00 0.00 C ATOM 932 CG TRP A 64 -6.806 7.663 9.288 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.127 7.699 10.615 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.555 6.974 9.194 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.149 7.076 11.351 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.173 6.621 10.504 1.00 0.00 C ATOM 937 CE3 TRP A 64 -4.720 6.620 8.132 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -3.994 5.933 10.775 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.549 5.938 8.402 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.195 5.599 9.716 1.00 0.00 C ATOM 0 H TRP A 64 -9.032 10.267 9.058 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.287 9.923 8.013 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.665 8.074 8.352 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.367 7.684 7.242 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.018 8.151 11.025 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.149 6.969 12.365 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -4.985 6.875 7.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -3.719 5.672 11.786 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -2.896 5.661 7.588 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.274 5.064 9.895 1.00 0.00 H new ATOM 951 N LYS A 65 -6.838 10.261 5.616 1.00 0.00 N ATOM 952 CA LYS A 65 -7.131 10.633 4.237 1.00 0.00 C ATOM 953 C LYS A 65 -7.104 9.409 3.327 1.00 0.00 C ATOM 954 O LYS A 65 -6.088 8.719 3.230 1.00 0.00 O ATOM 955 CB LYS A 65 -6.124 11.673 3.742 1.00 0.00 C ATOM 956 CG LYS A 65 -6.026 12.899 4.634 1.00 0.00 C ATOM 957 CD LYS A 65 -5.078 13.935 4.056 1.00 0.00 C ATOM 958 CE LYS A 65 -5.742 14.744 2.951 1.00 0.00 C ATOM 959 NZ LYS A 65 -4.893 15.886 2.512 1.00 0.00 N ATOM 0 H LYS A 65 -5.846 10.129 5.815 1.00 0.00 H new ATOM 0 HA LYS A 65 -8.132 11.064 4.208 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.141 11.208 3.669 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.404 11.987 2.736 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.015 13.339 4.759 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -5.682 12.602 5.625 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.743 14.605 4.848 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.191 13.439 3.662 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.947 14.095 2.099 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.702 15.120 3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -5.381 16.412 1.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.718 16.519 3.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -3.986 15.526 2.152 1.00 0.00 H new ATOM 973 N ILE A 66 -8.223 9.147 2.661 1.00 0.00 N ATOM 974 CA ILE A 66 -8.326 8.008 1.758 1.00 0.00 C ATOM 975 C ILE A 66 -7.938 8.399 0.335 1.00 0.00 C ATOM 976 O ILE A 66 -8.179 9.526 -0.099 1.00 0.00 O ATOM 977 CB ILE A 66 -9.750 7.424 1.746 1.00 0.00 C ATOM 978 CG1 ILE A 66 -10.200 7.095 3.171 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.807 6.183 0.868 1.00 0.00 C ATOM 980 CD1 ILE A 66 -9.247 6.185 3.912 1.00 0.00 C ATOM 0 H ILE A 66 -9.072 9.709 2.730 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.635 7.250 2.127 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.429 8.169 1.332 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.312 8.023 3.731 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.183 6.625 3.133 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.821 5.782 0.870 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.522 6.445 -0.151 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.119 5.432 1.255 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.631 5.995 4.915 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.153 5.241 3.375 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -8.269 6.661 3.982 1.00 0.00 H new ATOM 992 N VAL A 67 -7.335 7.460 -0.388 1.00 0.00 N ATOM 993 CA VAL A 67 -6.916 7.705 -1.763 1.00 0.00 C ATOM 994 C VAL A 67 -7.120 6.466 -2.628 1.00 0.00 C ATOM 995 O VAL A 67 -6.814 5.349 -2.211 1.00 0.00 O ATOM 996 CB VAL A 67 -5.437 8.128 -1.832 1.00 0.00 C ATOM 997 CG1 VAL A 67 -4.995 8.294 -3.277 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.213 9.412 -1.047 1.00 0.00 C ATOM 0 H VAL A 67 -7.126 6.523 -0.044 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.536 8.517 -2.143 1.00 0.00 H new ATOM 0 HB VAL A 67 -4.832 7.342 -1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.947 8.593 -3.305 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.117 7.349 -3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.604 9.060 -3.758 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.162 9.696 -1.107 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.829 10.207 -1.467 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.487 9.253 -0.004 1.00 0.00 H new ATOM 1008 N ARG A 68 -7.639 6.673 -3.833 1.00 0.00 N ATOM 1009 CA ARG A 68 -7.884 5.572 -4.758 1.00 0.00 C ATOM 1010 C ARG A 68 -6.643 5.278 -5.596 1.00 0.00 C ATOM 1011 O ARG A 68 -5.842 6.172 -5.871 1.00 0.00 O ATOM 1012 CB ARG A 68 -9.065 5.900 -5.674 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.420 5.615 -5.045 1.00 0.00 C ATOM 1014 CD ARG A 68 -11.499 6.521 -5.617 1.00 0.00 C ATOM 1015 NE ARG A 68 -11.806 6.198 -7.008 1.00 0.00 N ATOM 1016 CZ ARG A 68 -12.794 6.764 -7.693 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -13.566 7.676 -7.118 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -13.011 6.416 -8.955 1.00 0.00 N ATOM 0 H ARG A 68 -7.898 7.592 -4.192 1.00 0.00 H new ATOM 0 HA ARG A 68 -8.123 4.685 -4.171 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -9.017 6.953 -5.952 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -8.972 5.323 -6.594 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.690 4.573 -5.215 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -10.359 5.756 -3.966 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -12.404 6.431 -5.016 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -11.174 7.559 -5.549 1.00 0.00 H new ATOM 0 HE ARG A 68 -11.231 5.500 -7.479 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -13.402 7.945 -6.148 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -14.324 8.109 -7.646 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -12.419 5.714 -9.399 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -13.769 6.851 -9.481 1.00 0.00 H new ATOM 1032 N SER A 69 -6.491 4.021 -5.999 1.00 0.00 N ATOM 1033 CA SER A 69 -5.345 3.609 -6.802 1.00 0.00 C ATOM 1034 C SER A 69 -5.651 3.741 -8.291 1.00 0.00 C ATOM 1035 O SER A 69 -5.129 2.986 -9.113 1.00 0.00 O ATOM 1036 CB SER A 69 -4.959 2.165 -6.475 1.00 0.00 C ATOM 1037 OG SER A 69 -3.608 1.909 -6.816 1.00 0.00 O ATOM 0 H SER A 69 -7.147 3.270 -5.783 1.00 0.00 H new ATOM 0 HA SER A 69 -4.508 4.264 -6.561 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.111 1.976 -5.412 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.610 1.479 -7.017 1.00 0.00 H new ATOM 0 HG SER A 69 -3.484 0.948 -6.962 1.00 0.00 H new ATOM 1043 N HIS A 70 -6.500 4.704 -8.632 1.00 0.00 N ATOM 1044 CA HIS A 70 -6.875 4.936 -10.022 1.00 0.00 C ATOM 1045 C HIS A 70 -6.970 3.620 -10.786 1.00 0.00 C ATOM 1046 O HIS A 70 -6.681 3.561 -11.981 1.00 0.00 O ATOM 1047 CB HIS A 70 -5.863 5.860 -10.699 1.00 0.00 C ATOM 1048 CG HIS A 70 -5.911 7.271 -10.198 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -4.779 8.017 -9.940 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -6.962 8.073 -9.909 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -5.134 9.216 -9.512 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -6.454 9.276 -9.484 1.00 0.00 N ATOM 0 H HIS A 70 -6.942 5.337 -7.965 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.855 5.414 -10.032 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.860 5.462 -10.544 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.044 5.858 -11.774 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.007 7.815 -9.996 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -4.460 10.012 -9.232 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -7.005 10.084 -9.194 1.00 0.00 H new ATOM 1061 N GLY A 71 -7.377 2.563 -10.089 1.00 0.00 N ATOM 1062 CA GLY A 71 -7.501 1.261 -10.718 1.00 0.00 C ATOM 1063 C GLY A 71 -7.118 0.128 -9.786 1.00 0.00 C ATOM 1064 O GLY A 71 -7.172 0.274 -8.564 1.00 0.00 O ATOM 0 H GLY A 71 -7.623 2.586 -9.099 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.528 1.120 -11.054 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.868 1.228 -11.605 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.732 -1.005 -10.363 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.340 -2.168 -9.576 1.00 0.00 C ATOM 1070 C VAL A 72 -4.822 -2.305 -9.516 1.00 0.00 C ATOM 1071 O VAL A 72 -4.297 -3.395 -9.292 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.938 -3.464 -10.154 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -8.457 -3.437 -10.067 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -6.482 -3.668 -11.591 1.00 0.00 C ATOM 0 H VAL A 72 -6.682 -1.142 -11.372 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.729 -2.014 -8.569 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.579 -4.305 -9.561 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.862 -4.361 -10.480 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.760 -3.342 -9.024 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.839 -2.588 -10.634 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.914 -4.589 -11.983 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.810 -2.825 -12.200 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.395 -3.736 -11.621 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.126 -1.191 -9.717 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.668 -1.186 -9.686 1.00 0.00 C ATOM 1086 C GLN A 73 -2.154 -1.254 -8.251 1.00 0.00 C ATOM 1087 O GLN A 73 -2.922 -1.120 -7.298 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.125 0.066 -10.376 1.00 0.00 C ATOM 1089 CG GLN A 73 -2.489 1.359 -9.665 1.00 0.00 C ATOM 1090 CD GLN A 73 -2.146 2.590 -10.479 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -0.978 2.848 -10.773 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -3.163 3.359 -10.848 1.00 0.00 N ATOM 0 H GLN A 73 -4.547 -0.281 -9.903 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.316 -2.068 -10.221 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.040 -0.008 -10.444 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.506 0.103 -11.396 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.557 1.360 -9.445 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.966 1.403 -8.709 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.115 3.107 -10.582 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -2.992 4.201 -11.397 1.00 0.00 H new ATOM 1101 N THR A 74 -0.849 -1.462 -8.105 1.00 0.00 N ATOM 1102 CA THR A 74 -0.232 -1.548 -6.787 1.00 0.00 C ATOM 1103 C THR A 74 0.726 -0.387 -6.551 1.00 0.00 C ATOM 1104 O THR A 74 1.493 -0.388 -5.588 1.00 0.00 O ATOM 1105 CB THR A 74 0.532 -2.873 -6.610 1.00 0.00 C ATOM 1106 OG1 THR A 74 1.426 -3.074 -7.712 1.00 0.00 O ATOM 1107 CG2 THR A 74 -0.432 -4.046 -6.513 1.00 0.00 C ATOM 0 H THR A 74 -0.199 -1.574 -8.883 1.00 0.00 H new ATOM 0 HA THR A 74 -1.040 -1.502 -6.057 1.00 0.00 H new ATOM 0 HB THR A 74 1.104 -2.816 -5.684 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.311 -3.326 -7.374 1.00 0.00 H new ATOM 0 HG21 THR A 74 0.131 -4.971 -6.388 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.092 -3.905 -5.657 1.00 0.00 H new ATOM 0 HG23 THR A 74 -1.027 -4.104 -7.424 1.00 0.00 H new ATOM 1115 N MET A 75 0.675 0.605 -7.434 1.00 0.00 N ATOM 1116 CA MET A 75 1.539 1.774 -7.320 1.00 0.00 C ATOM 1117 C MET A 75 0.730 3.062 -7.448 1.00 0.00 C ATOM 1118 O MET A 75 -0.074 3.212 -8.368 1.00 0.00 O ATOM 1119 CB MET A 75 2.631 1.736 -8.391 1.00 0.00 C ATOM 1120 CG MET A 75 3.874 2.528 -8.020 1.00 0.00 C ATOM 1121 SD MET A 75 5.320 2.040 -8.980 1.00 0.00 S ATOM 1122 CE MET A 75 5.519 3.467 -10.044 1.00 0.00 C ATOM 0 H MET A 75 0.045 0.623 -8.236 1.00 0.00 H new ATOM 0 HA MET A 75 2.006 1.754 -6.335 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.912 0.699 -8.575 1.00 0.00 H new ATOM 0 HB3 MET A 75 2.226 2.127 -9.325 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.683 3.590 -8.173 1.00 0.00 H new ATOM 0 HG3 MET A 75 4.084 2.392 -6.959 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.722 3.136 -11.062 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.605 4.061 -10.031 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.351 4.074 -9.687 1.00 0.00 H new ATOM 1132 N VAL A 76 0.947 3.987 -6.519 1.00 0.00 N ATOM 1133 CA VAL A 76 0.239 5.262 -6.529 1.00 0.00 C ATOM 1134 C VAL A 76 1.076 6.360 -5.882 1.00 0.00 C ATOM 1135 O VAL A 76 1.982 6.084 -5.095 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.110 5.159 -5.794 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -2.002 6.339 -6.148 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -1.798 3.843 -6.124 1.00 0.00 C ATOM 0 H VAL A 76 1.608 3.878 -5.750 1.00 0.00 H new ATOM 0 HA VAL A 76 0.057 5.516 -7.573 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.922 5.185 -4.721 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.951 6.249 -5.619 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.510 7.267 -5.856 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.185 6.347 -7.223 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -2.750 3.788 -5.596 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.975 3.784 -7.198 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.163 3.013 -5.815 1.00 0.00 H new ATOM 1148 N VAL A 77 0.765 7.608 -6.218 1.00 0.00 N ATOM 1149 CA VAL A 77 1.487 8.750 -5.669 1.00 0.00 C ATOM 1150 C VAL A 77 0.594 9.573 -4.747 1.00 0.00 C ATOM 1151 O VAL A 77 -0.561 9.851 -5.070 1.00 0.00 O ATOM 1152 CB VAL A 77 2.031 9.660 -6.785 1.00 0.00 C ATOM 1153 CG1 VAL A 77 0.954 10.623 -7.262 1.00 0.00 C ATOM 1154 CG2 VAL A 77 3.259 10.417 -6.305 1.00 0.00 C ATOM 0 H VAL A 77 0.018 7.854 -6.868 1.00 0.00 H new ATOM 0 HA VAL A 77 2.324 8.350 -5.097 1.00 0.00 H new ATOM 0 HB VAL A 77 2.325 9.034 -7.628 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.357 11.258 -8.051 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.106 10.058 -7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.626 11.244 -6.428 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.630 11.055 -7.107 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.994 11.032 -5.445 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.035 9.707 -6.018 1.00 0.00 H new ATOM 1164 N LEU A 78 1.136 9.960 -3.598 1.00 0.00 N ATOM 1165 CA LEU A 78 0.389 10.753 -2.628 1.00 0.00 C ATOM 1166 C LEU A 78 0.725 12.234 -2.761 1.00 0.00 C ATOM 1167 O LEU A 78 1.845 12.597 -3.117 1.00 0.00 O ATOM 1168 CB LEU A 78 0.693 10.274 -1.207 1.00 0.00 C ATOM 1169 CG LEU A 78 0.233 8.857 -0.862 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.795 8.426 0.483 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.287 8.776 -0.859 1.00 0.00 C ATOM 0 H LEU A 78 2.090 9.738 -3.315 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.674 10.622 -2.830 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.770 10.333 -1.048 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.228 10.966 -0.505 1.00 0.00 H new ATOM 0 HG LEU A 78 0.611 8.177 -1.625 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.457 7.415 0.712 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.884 8.444 0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.447 9.109 1.258 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.597 7.761 -0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.687 9.468 -0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.667 9.041 -1.845 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.253 13.086 -2.470 1.00 0.00 N ATOM 1184 CA ASN A 79 -0.060 14.529 -2.556 1.00 0.00 C ATOM 1185 C ASN A 79 -0.711 15.236 -1.371 1.00 0.00 C ATOM 1186 O ASN A 79 -1.262 14.593 -0.479 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.640 15.065 -3.866 1.00 0.00 C ATOM 1188 CG ASN A 79 -1.956 14.403 -4.229 1.00 0.00 C ATOM 1189 OD1 ASN A 79 -3.025 14.991 -4.069 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -1.882 13.172 -4.722 1.00 0.00 N ATOM 0 H ASN A 79 -1.187 12.802 -2.173 1.00 0.00 H new ATOM 0 HA ASN A 79 1.011 14.730 -2.532 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.789 16.141 -3.781 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.078 14.905 -4.670 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -2.734 12.676 -4.985 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -0.974 12.723 -4.838 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.643 16.563 -1.371 1.00 0.00 N ATOM 1198 CA ASN A 80 -1.226 17.358 -0.296 1.00 0.00 C ATOM 1199 C ASN A 80 -0.587 17.012 1.045 1.00 0.00 C ATOM 1200 O ASN A 80 -1.282 16.755 2.029 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.738 17.131 -0.227 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.508 18.084 -1.120 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -3.374 19.303 -1.008 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -4.319 17.531 -2.015 1.00 0.00 N ATOM 0 H ASN A 80 -0.190 17.111 -2.103 1.00 0.00 H new ATOM 0 HA ASN A 80 -1.033 18.409 -0.510 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.962 16.105 -0.517 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -3.074 17.251 0.803 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.862 18.122 -2.645 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -4.399 16.516 -2.072 1.00 0.00 H new ATOM 1211 N LEU A 81 0.742 17.007 1.077 1.00 0.00 N ATOM 1212 CA LEU A 81 1.476 16.693 2.298 1.00 0.00 C ATOM 1213 C LEU A 81 2.465 17.802 2.639 1.00 0.00 C ATOM 1214 O LEU A 81 2.953 18.505 1.754 1.00 0.00 O ATOM 1215 CB LEU A 81 2.216 15.364 2.143 1.00 0.00 C ATOM 1216 CG LEU A 81 1.492 14.281 1.342 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.429 13.121 1.045 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.261 13.796 2.093 1.00 0.00 C ATOM 0 H LEU A 81 1.332 17.217 0.272 1.00 0.00 H new ATOM 0 HA LEU A 81 0.758 16.609 3.113 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.176 15.560 1.666 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.428 14.971 3.137 1.00 0.00 H new ATOM 0 HG LEU A 81 1.169 14.712 0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.897 12.360 0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.280 13.480 0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.783 12.690 1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.242 13.026 1.508 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.562 13.383 3.056 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.420 14.632 2.254 1.00 0.00 H new ATOM 1230 N GLU A 82 2.757 17.953 3.927 1.00 0.00 N ATOM 1231 CA GLU A 82 3.689 18.977 4.383 1.00 0.00 C ATOM 1232 C GLU A 82 5.102 18.412 4.504 1.00 0.00 C ATOM 1233 O GLU A 82 5.306 17.260 4.889 1.00 0.00 O ATOM 1234 CB GLU A 82 3.239 19.545 5.731 1.00 0.00 C ATOM 1235 CG GLU A 82 1.863 20.191 5.690 1.00 0.00 C ATOM 1236 CD GLU A 82 1.661 21.202 6.802 1.00 0.00 C ATOM 1237 OE1 GLU A 82 1.838 20.829 7.981 1.00 0.00 O ATOM 1238 OE2 GLU A 82 1.325 22.365 6.494 1.00 0.00 O ATOM 0 H GLU A 82 2.362 17.380 4.672 1.00 0.00 H new ATOM 0 HA GLU A 82 3.698 19.778 3.644 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.233 18.744 6.470 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.968 20.283 6.067 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.725 20.683 4.727 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.100 19.417 5.765 1.00 0.00 H new ATOM 1245 N PRO A 83 6.101 19.240 4.167 1.00 0.00 N ATOM 1246 CA PRO A 83 7.511 18.846 4.229 1.00 0.00 C ATOM 1247 C PRO A 83 8.004 18.678 5.663 1.00 0.00 C ATOM 1248 O PRO A 83 7.441 19.254 6.593 1.00 0.00 O ATOM 1249 CB PRO A 83 8.235 20.010 3.549 1.00 0.00 C ATOM 1250 CG PRO A 83 7.329 21.179 3.730 1.00 0.00 C ATOM 1251 CD PRO A 83 5.931 20.627 3.700 1.00 0.00 C ATOM 0 HA PRO A 83 7.685 17.881 3.753 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.209 20.190 4.004 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.410 19.805 2.493 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.529 21.685 4.675 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.476 21.913 2.938 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.262 21.191 4.351 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.506 20.664 2.697 1.00 0.00 H new ATOM 1259 N ASN A 84 9.057 17.886 5.832 1.00 0.00 N ATOM 1260 CA ASN A 84 9.624 17.641 7.154 1.00 0.00 C ATOM 1261 C ASN A 84 8.557 17.140 8.121 1.00 0.00 C ATOM 1262 O ASN A 84 8.585 17.453 9.312 1.00 0.00 O ATOM 1263 CB ASN A 84 10.265 18.919 7.701 1.00 0.00 C ATOM 1264 CG ASN A 84 11.149 18.653 8.904 1.00 0.00 C ATOM 1265 OD1 ASN A 84 11.156 17.551 9.452 1.00 0.00 O ATOM 1266 ND2 ASN A 84 11.902 19.666 9.319 1.00 0.00 N ATOM 0 H ASN A 84 9.535 17.403 5.071 1.00 0.00 H new ATOM 0 HA ASN A 84 10.389 16.871 7.056 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.856 19.390 6.916 1.00 0.00 H new ATOM 0 HB3 ASN A 84 9.482 19.625 7.978 1.00 0.00 H new ATOM 0 HD21 ASN A 84 12.519 19.547 10.123 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.864 20.562 8.834 1.00 0.00 H new ATOM 1273 N THR A 85 7.615 16.359 7.601 1.00 0.00 N ATOM 1274 CA THR A 85 6.537 15.815 8.417 1.00 0.00 C ATOM 1275 C THR A 85 6.396 14.312 8.210 1.00 0.00 C ATOM 1276 O THR A 85 6.712 13.788 7.141 1.00 0.00 O ATOM 1277 CB THR A 85 5.192 16.494 8.097 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.232 17.870 8.488 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.047 15.792 8.813 1.00 0.00 C ATOM 0 H THR A 85 7.577 16.089 6.618 1.00 0.00 H new ATOM 0 HA THR A 85 6.797 16.013 9.457 1.00 0.00 H new ATOM 0 HB THR A 85 5.024 16.427 7.022 1.00 0.00 H new ATOM 0 HG1 THR A 85 5.881 18.349 7.932 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.108 16.289 8.572 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.000 14.752 8.491 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.212 15.832 9.890 1.00 0.00 H new ATOM 1287 N THR A 86 5.918 13.619 9.240 1.00 0.00 N ATOM 1288 CA THR A 86 5.736 12.174 9.170 1.00 0.00 C ATOM 1289 C THR A 86 4.272 11.815 8.946 1.00 0.00 C ATOM 1290 O THR A 86 3.373 12.484 9.458 1.00 0.00 O ATOM 1291 CB THR A 86 6.231 11.483 10.455 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.499 12.023 10.844 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.356 9.982 10.247 1.00 0.00 C ATOM 0 H THR A 86 5.650 14.035 10.132 1.00 0.00 H new ATOM 0 HA THR A 86 6.327 11.821 8.325 1.00 0.00 H new ATOM 0 HB THR A 86 5.502 11.665 11.244 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.806 11.580 11.662 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.707 9.515 11.167 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.383 9.570 9.979 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.068 9.784 9.445 1.00 0.00 H new ATOM 1301 N TYR A 87 4.038 10.756 8.181 1.00 0.00 N ATOM 1302 CA TYR A 87 2.680 10.308 7.887 1.00 0.00 C ATOM 1303 C TYR A 87 2.605 8.785 7.856 1.00 0.00 C ATOM 1304 O TYR A 87 3.508 8.118 7.353 1.00 0.00 O ATOM 1305 CB TYR A 87 2.210 10.882 6.549 1.00 0.00 C ATOM 1306 CG TYR A 87 2.417 12.374 6.423 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.691 12.910 6.283 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.338 13.249 6.446 1.00 0.00 C ATOM 1309 CE1 TYR A 87 3.884 14.273 6.168 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.521 14.613 6.331 1.00 0.00 C ATOM 1311 CZ TYR A 87 2.796 15.121 6.193 1.00 0.00 C ATOM 1312 OH TYR A 87 2.984 16.479 6.077 1.00 0.00 O ATOM 0 H TYR A 87 4.770 10.190 7.752 1.00 0.00 H new ATOM 0 HA TYR A 87 2.024 10.670 8.679 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.743 10.380 5.741 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.151 10.659 6.419 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.545 12.250 6.264 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.338 12.855 6.556 1.00 0.00 H new ATOM 0 HE1 TYR A 87 4.881 14.673 6.059 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.670 15.278 6.349 1.00 0.00 H new ATOM 0 HH TYR A 87 3.832 16.654 5.618 1.00 0.00 H new ATOM 1322 N GLU A 88 1.518 8.243 8.396 1.00 0.00 N ATOM 1323 CA GLU A 88 1.322 6.798 8.431 1.00 0.00 C ATOM 1324 C GLU A 88 0.413 6.345 7.293 1.00 0.00 C ATOM 1325 O GLU A 88 -0.733 6.784 7.187 1.00 0.00 O ATOM 1326 CB GLU A 88 0.726 6.374 9.775 1.00 0.00 C ATOM 1327 CG GLU A 88 1.381 7.044 10.971 1.00 0.00 C ATOM 1328 CD GLU A 88 0.772 6.609 12.289 1.00 0.00 C ATOM 1329 OE1 GLU A 88 -0.448 6.803 12.471 1.00 0.00 O ATOM 1330 OE2 GLU A 88 1.516 6.076 13.140 1.00 0.00 O ATOM 0 H GLU A 88 0.760 8.782 8.815 1.00 0.00 H new ATOM 0 HA GLU A 88 2.295 6.322 8.307 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.339 6.604 9.779 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.819 5.293 9.879 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.446 6.813 10.974 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.289 8.126 10.872 1.00 0.00 H new ATOM 1337 N ILE A 89 0.932 5.465 6.444 1.00 0.00 N ATOM 1338 CA ILE A 89 0.167 4.951 5.314 1.00 0.00 C ATOM 1339 C ILE A 89 -0.046 3.447 5.432 1.00 0.00 C ATOM 1340 O ILE A 89 0.844 2.716 5.867 1.00 0.00 O ATOM 1341 CB ILE A 89 0.867 5.255 3.976 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.431 4.251 2.907 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.378 5.229 4.150 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.817 4.657 1.502 1.00 0.00 C ATOM 0 H ILE A 89 1.879 5.093 6.517 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.800 5.455 5.333 1.00 0.00 H new ATOM 0 HB ILE A 89 0.576 6.254 3.650 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.873 3.280 3.130 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.651 4.127 2.956 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.858 5.446 3.196 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.673 5.980 4.883 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.687 4.243 4.496 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.476 3.899 0.797 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.353 5.613 1.259 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.901 4.753 1.436 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.232 2.989 5.043 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.562 1.571 5.104 1.00 0.00 C ATOM 1358 C ARG A 90 -2.302 1.130 3.845 1.00 0.00 C ATOM 1359 O ARG A 90 -3.271 1.762 3.427 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.417 1.279 6.338 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.693 2.102 6.405 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.464 1.833 7.688 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.729 2.559 7.729 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.466 2.692 8.826 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -6.064 2.151 9.968 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.607 3.368 8.785 1.00 0.00 N ATOM 0 H ARG A 90 -1.980 3.581 4.682 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.630 1.009 5.173 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.677 0.220 6.347 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.825 1.469 7.233 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.447 3.162 6.343 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.322 1.870 5.546 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.657 0.764 7.778 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -3.854 2.120 8.544 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.066 2.988 6.867 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.187 1.631 10.005 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.632 2.255 10.809 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.920 3.787 7.909 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.171 3.468 9.629 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.835 0.039 3.243 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.452 -0.487 2.031 1.00 0.00 C ATOM 1382 C VAL A 91 -3.354 -1.676 2.345 1.00 0.00 C ATOM 1383 O VAL A 91 -3.004 -2.538 3.151 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.389 -0.921 1.004 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -2.051 -1.438 -0.264 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.448 0.233 0.692 1.00 0.00 C ATOM 0 H VAL A 91 -1.033 -0.496 3.575 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.051 0.318 1.606 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.802 -1.732 1.435 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.284 -1.740 -0.978 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.680 -2.295 -0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.664 -0.650 -0.702 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.297 -0.091 -0.035 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.018 1.066 0.281 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.053 0.552 1.606 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.516 -1.715 1.703 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.468 -2.800 1.912 1.00 0.00 C ATOM 1398 C ALA A 92 -6.243 -3.104 0.635 1.00 0.00 C ATOM 1399 O ALA A 92 -6.397 -2.241 -0.229 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.426 -2.451 3.042 1.00 0.00 C ATOM 0 H ALA A 92 -4.822 -1.008 1.034 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.908 -3.694 2.187 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.131 -3.270 3.187 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.862 -2.291 3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.972 -1.542 2.788 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.729 -4.335 0.521 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.490 -4.752 -0.650 1.00 0.00 C ATOM 1408 C ALA A 93 -8.989 -4.706 -0.377 1.00 0.00 C ATOM 1409 O ALA A 93 -9.462 -5.221 0.636 1.00 0.00 O ATOM 1410 CB ALA A 93 -7.074 -6.151 -1.079 1.00 0.00 C ATOM 0 H ALA A 93 -6.609 -5.062 1.226 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.273 -4.055 -1.459 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.650 -6.450 -1.955 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.012 -6.155 -1.325 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.261 -6.852 -0.265 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.733 -4.082 -1.286 1.00 0.00 N ATOM 1417 CA VAL A 94 -11.180 -3.968 -1.143 1.00 0.00 C ATOM 1418 C VAL A 94 -11.902 -4.641 -2.305 1.00 0.00 C ATOM 1419 O VAL A 94 -11.605 -4.376 -3.469 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.621 -2.495 -1.062 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -13.117 -2.372 -1.306 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -11.242 -1.899 0.286 1.00 0.00 C ATOM 0 H VAL A 94 -9.357 -3.648 -2.129 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.447 -4.471 -0.214 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.102 -1.935 -1.840 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.411 -1.324 -1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.357 -2.759 -2.296 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.657 -2.945 -0.552 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.561 -0.858 0.326 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.732 -2.459 1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.161 -1.953 0.417 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.851 -5.512 -1.980 1.00 0.00 N ATOM 1433 CA ASN A 95 -13.616 -6.224 -2.997 1.00 0.00 C ATOM 1434 C ASN A 95 -15.093 -6.289 -2.621 1.00 0.00 C ATOM 1435 O ASN A 95 -15.512 -5.724 -1.611 1.00 0.00 O ATOM 1436 CB ASN A 95 -13.064 -7.638 -3.185 1.00 0.00 C ATOM 1437 CG ASN A 95 -13.426 -8.557 -2.035 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -14.092 -8.148 -1.084 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.986 -9.808 -2.116 1.00 0.00 N ATOM 0 H ASN A 95 -13.109 -5.742 -1.020 1.00 0.00 H new ATOM 0 HA ASN A 95 -13.522 -5.677 -3.935 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -13.450 -8.055 -4.115 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.979 -7.592 -3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.197 -10.472 -1.371 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.437 -10.104 -2.923 1.00 0.00 H new ATOM 1446 N GLY A 96 -15.877 -6.982 -3.441 1.00 0.00 N ATOM 1447 CA GLY A 96 -17.299 -7.108 -3.177 1.00 0.00 C ATOM 1448 C GLY A 96 -17.592 -7.448 -1.729 1.00 0.00 C ATOM 1449 O GLY A 96 -18.485 -6.864 -1.114 1.00 0.00 O ATOM 0 H GLY A 96 -15.553 -7.458 -4.283 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -17.798 -6.174 -3.436 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -17.718 -7.882 -3.821 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.839 -8.397 -1.182 1.00 0.00 N ATOM 1454 CA LYS A 97 -17.022 -8.815 0.203 1.00 0.00 C ATOM 1455 C LYS A 97 -16.852 -7.635 1.155 1.00 0.00 C ATOM 1456 O LYS A 97 -17.717 -7.367 1.987 1.00 0.00 O ATOM 1457 CB LYS A 97 -16.024 -9.919 0.559 1.00 0.00 C ATOM 1458 CG LYS A 97 -15.904 -10.997 -0.504 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.267 -11.528 -0.915 1.00 0.00 C ATOM 1460 CE LYS A 97 -17.839 -12.468 0.135 1.00 0.00 C ATOM 1461 NZ LYS A 97 -19.328 -12.467 0.128 1.00 0.00 N ATOM 0 H LYS A 97 -16.096 -8.891 -1.677 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.036 -9.201 0.309 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -15.044 -9.472 0.723 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -16.325 -10.380 1.500 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.391 -10.593 -1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.292 -11.816 -0.126 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -17.952 -10.694 -1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -17.182 -12.052 -1.867 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -17.476 -13.479 -0.047 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -17.480 -12.173 1.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -19.680 -12.766 1.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -19.674 -11.509 -0.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -19.672 -13.126 -0.599 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.730 -6.931 1.024 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.469 -5.788 1.878 1.00 0.00 C ATOM 1477 C GLY A 98 -13.986 -5.531 2.065 1.00 0.00 C ATOM 1478 O GLY A 98 -13.154 -6.177 1.430 1.00 0.00 O ATOM 0 H GLY A 98 -14.999 -7.133 0.342 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -15.937 -4.902 1.448 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.932 -5.952 2.851 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.656 -4.583 2.935 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.264 -4.241 3.202 1.00 0.00 C ATOM 1484 C GLN A 99 -11.623 -5.256 4.142 1.00 0.00 C ATOM 1485 O GLN A 99 -11.907 -5.273 5.339 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.167 -2.838 3.804 1.00 0.00 C ATOM 1487 CG GLN A 99 -10.765 -2.254 3.763 1.00 0.00 C ATOM 1488 CD GLN A 99 -10.765 -0.738 3.727 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -11.716 -0.095 4.171 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -9.695 -0.158 3.195 1.00 0.00 N ATOM 0 H GLN A 99 -14.334 -4.038 3.468 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.725 -4.260 2.255 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -12.844 -2.174 3.267 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -12.507 -2.871 4.839 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.209 -2.593 4.637 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.243 -2.634 2.885 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -8.929 -0.730 2.839 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.639 0.859 3.143 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.759 -6.103 3.591 1.00 0.00 N ATOM 1500 CA GLY A 100 -10.092 -7.110 4.395 1.00 0.00 C ATOM 1501 C GLY A 100 -9.202 -6.504 5.462 1.00 0.00 C ATOM 1502 O GLY A 100 -9.496 -5.432 5.989 1.00 0.00 O ATOM 0 H GLY A 100 -10.509 -6.110 2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.840 -7.746 4.868 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.493 -7.750 3.747 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.111 -7.194 5.780 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.174 -6.718 6.791 1.00 0.00 C ATOM 1508 C ASP A 101 -6.194 -5.713 6.193 1.00 0.00 C ATOM 1509 O ASP A 101 -5.863 -5.782 5.010 1.00 0.00 O ATOM 1510 CB ASP A 101 -6.410 -7.893 7.403 1.00 0.00 C ATOM 1511 CG ASP A 101 -7.253 -8.683 8.384 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -7.421 -8.219 9.530 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -7.744 -9.768 8.006 1.00 0.00 O ATOM 0 H ASP A 101 -7.854 -8.084 5.352 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.745 -6.219 7.574 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.068 -8.555 6.607 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.521 -7.520 7.911 1.00 0.00 H new ATOM 1518 N TYR A 102 -5.734 -4.780 7.019 1.00 0.00 N ATOM 1519 CA TYR A 102 -4.795 -3.759 6.572 1.00 0.00 C ATOM 1520 C TYR A 102 -3.356 -4.254 6.688 1.00 0.00 C ATOM 1521 O TYR A 102 -3.015 -4.998 7.608 1.00 0.00 O ATOM 1522 CB TYR A 102 -4.972 -2.479 7.391 1.00 0.00 C ATOM 1523 CG TYR A 102 -6.152 -1.640 6.954 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -6.059 -0.792 5.857 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.360 -1.696 7.637 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -7.134 -0.023 5.454 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.441 -0.932 7.241 1.00 0.00 C ATOM 1528 CZ TYR A 102 -8.323 -0.097 6.150 1.00 0.00 C ATOM 1529 OH TYR A 102 -9.396 0.666 5.751 1.00 0.00 O ATOM 0 H TYR A 102 -5.996 -4.710 8.002 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.004 -3.544 5.524 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.094 -2.743 8.441 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.064 -1.881 7.316 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.130 -0.733 5.310 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.456 -2.348 8.493 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -7.044 0.632 4.600 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.373 -0.989 7.783 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.157 0.497 6.345 1.00 0.00 H new ATOM 1539 N SER A 103 -2.515 -3.835 5.748 1.00 0.00 N ATOM 1540 CA SER A 103 -1.114 -4.237 5.741 1.00 0.00 C ATOM 1541 C SER A 103 -0.327 -3.483 6.809 1.00 0.00 C ATOM 1542 O SER A 103 -0.705 -2.384 7.216 1.00 0.00 O ATOM 1543 CB SER A 103 -0.496 -3.986 4.364 1.00 0.00 C ATOM 1544 OG SER A 103 -0.561 -2.613 4.019 1.00 0.00 O ATOM 0 H SER A 103 -2.780 -3.217 4.981 1.00 0.00 H new ATOM 0 HA SER A 103 -1.067 -5.303 5.964 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.543 -4.316 4.362 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.020 -4.578 3.613 1.00 0.00 H new ATOM 0 HG SER A 103 -1.482 -2.379 3.781 1.00 0.00 H new ATOM 1550 N LYS A 104 0.770 -4.082 7.260 1.00 0.00 N ATOM 1551 CA LYS A 104 1.613 -3.469 8.280 1.00 0.00 C ATOM 1552 C LYS A 104 1.692 -1.959 8.084 1.00 0.00 C ATOM 1553 O LYS A 104 2.218 -1.481 7.079 1.00 0.00 O ATOM 1554 CB LYS A 104 3.018 -4.075 8.240 1.00 0.00 C ATOM 1555 CG LYS A 104 4.009 -3.369 9.150 1.00 0.00 C ATOM 1556 CD LYS A 104 4.003 -3.964 10.549 1.00 0.00 C ATOM 1557 CE LYS A 104 5.084 -3.345 11.422 1.00 0.00 C ATOM 1558 NZ LYS A 104 5.439 -4.225 12.571 1.00 0.00 N ATOM 0 H LYS A 104 1.096 -4.992 6.935 1.00 0.00 H new ATOM 0 HA LYS A 104 1.166 -3.668 9.254 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.960 -5.126 8.525 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.390 -4.042 7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.010 -3.443 8.726 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.764 -2.308 9.204 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.027 -3.806 11.009 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.156 -5.042 10.488 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.973 -3.156 10.820 1.00 0.00 H new ATOM 0 HE3 LYS A 104 4.741 -2.380 11.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 6.179 -3.769 13.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 4.596 -4.385 13.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 5.790 -5.137 12.214 1.00 0.00 H new ATOM 1572 N ILE A 105 1.168 -1.214 9.051 1.00 0.00 N ATOM 1573 CA ILE A 105 1.183 0.243 8.986 1.00 0.00 C ATOM 1574 C ILE A 105 2.567 0.762 8.611 1.00 0.00 C ATOM 1575 O ILE A 105 3.557 0.450 9.272 1.00 0.00 O ATOM 1576 CB ILE A 105 0.756 0.871 10.326 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.663 0.433 10.690 1.00 0.00 C ATOM 1578 CG2 ILE A 105 0.845 2.388 10.251 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.729 1.043 9.807 1.00 0.00 C ATOM 0 H ILE A 105 0.728 -1.595 9.889 1.00 0.00 H new ATOM 0 HA ILE A 105 0.468 0.532 8.215 1.00 0.00 H new ATOM 0 HB ILE A 105 1.434 0.524 11.106 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.727 -0.653 10.625 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.863 0.703 11.727 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.540 2.818 11.205 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.872 2.682 10.032 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.187 2.753 9.462 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.710 0.688 10.123 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.692 2.129 9.890 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.554 0.752 8.771 1.00 0.00 H new ATOM 1591 N GLU A 106 2.627 1.559 7.548 1.00 0.00 N ATOM 1592 CA GLU A 106 3.890 2.122 7.086 1.00 0.00 C ATOM 1593 C GLU A 106 4.040 3.570 7.546 1.00 0.00 C ATOM 1594 O GLU A 106 3.056 4.304 7.646 1.00 0.00 O ATOM 1595 CB GLU A 106 3.981 2.047 5.561 1.00 0.00 C ATOM 1596 CG GLU A 106 4.434 0.692 5.044 1.00 0.00 C ATOM 1597 CD GLU A 106 5.764 0.258 5.631 1.00 0.00 C ATOM 1598 OE1 GLU A 106 6.766 0.975 5.420 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.803 -0.795 6.299 1.00 0.00 O ATOM 0 H GLU A 106 1.816 1.829 6.991 1.00 0.00 H new ATOM 0 HA GLU A 106 4.700 1.535 7.519 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.005 2.281 5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.674 2.811 5.209 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.676 -0.055 5.280 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.516 0.731 3.958 1.00 0.00 H new ATOM 1606 N ILE A 107 5.275 3.972 7.822 1.00 0.00 N ATOM 1607 CA ILE A 107 5.554 5.330 8.269 1.00 0.00 C ATOM 1608 C ILE A 107 6.667 5.964 7.442 1.00 0.00 C ATOM 1609 O ILE A 107 7.820 5.537 7.501 1.00 0.00 O ATOM 1610 CB ILE A 107 5.953 5.363 9.756 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.906 4.639 10.604 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.123 6.800 10.227 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.269 4.552 12.070 1.00 0.00 C ATOM 0 H ILE A 107 6.099 3.376 7.744 1.00 0.00 H new ATOM 0 HA ILE A 107 4.635 5.900 8.135 1.00 0.00 H new ATOM 0 HB ILE A 107 6.906 4.848 9.873 1.00 0.00 H new ATOM 0 HG12 ILE A 107 3.951 5.154 10.505 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.767 3.631 10.212 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.405 6.807 11.280 1.00 0.00 H new ATOM 0 HG22 ILE A 107 6.902 7.286 9.639 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.184 7.338 10.099 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.481 4.026 12.609 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.208 4.010 12.181 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.379 5.557 12.478 1.00 0.00 H new ATOM 1625 N PHE A 108 6.314 6.989 6.672 1.00 0.00 N ATOM 1626 CA PHE A 108 7.284 7.684 5.834 1.00 0.00 C ATOM 1627 C PHE A 108 7.251 9.187 6.094 1.00 0.00 C ATOM 1628 O PHE A 108 6.182 9.795 6.142 1.00 0.00 O ATOM 1629 CB PHE A 108 7.003 7.406 4.355 1.00 0.00 C ATOM 1630 CG PHE A 108 5.777 8.102 3.837 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.803 9.457 3.554 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.601 7.400 3.632 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.677 10.102 3.076 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.471 8.038 3.154 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.509 9.391 2.877 1.00 0.00 C ATOM 0 H PHE A 108 5.364 7.356 6.611 1.00 0.00 H new ATOM 0 HA PHE A 108 8.277 7.311 6.086 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.865 7.718 3.765 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.890 6.332 4.211 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.714 10.017 3.708 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.566 6.342 3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.710 11.159 2.859 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.560 7.479 2.997 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.627 9.892 2.506 1.00 0.00 H new ATOM 1645 N GLN A 109 8.430 9.778 6.263 1.00 0.00 N ATOM 1646 CA GLN A 109 8.536 11.209 6.520 1.00 0.00 C ATOM 1647 C GLN A 109 9.037 11.949 5.284 1.00 0.00 C ATOM 1648 O GLN A 109 10.110 11.648 4.759 1.00 0.00 O ATOM 1649 CB GLN A 109 9.473 11.469 7.700 1.00 0.00 C ATOM 1650 CG GLN A 109 9.628 12.942 8.043 1.00 0.00 C ATOM 1651 CD GLN A 109 10.681 13.188 9.104 1.00 0.00 C ATOM 1652 OE1 GLN A 109 10.672 12.557 10.162 1.00 0.00 O ATOM 1653 NE2 GLN A 109 11.598 14.106 8.827 1.00 0.00 N ATOM 0 H GLN A 109 9.324 9.288 6.227 1.00 0.00 H new ATOM 0 HA GLN A 109 7.542 11.583 6.766 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.097 10.939 8.575 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.454 11.053 7.472 1.00 0.00 H new ATOM 0 HG2 GLN A 109 9.891 13.495 7.141 1.00 0.00 H new ATOM 0 HG3 GLN A 109 8.671 13.333 8.389 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.568 14.605 7.938 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.333 14.313 9.503 1.00 0.00 H new ATOM 1662 N THR A 110 8.255 12.919 4.822 1.00 0.00 N ATOM 1663 CA THR A 110 8.620 13.702 3.648 1.00 0.00 C ATOM 1664 C THR A 110 9.968 14.386 3.839 1.00 0.00 C ATOM 1665 O THR A 110 10.487 14.456 4.954 1.00 0.00 O ATOM 1666 CB THR A 110 7.555 14.769 3.330 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.375 15.631 4.460 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.229 14.118 2.966 1.00 0.00 C ATOM 0 H THR A 110 7.364 13.182 5.243 1.00 0.00 H new ATOM 0 HA THR A 110 8.686 13.005 2.813 1.00 0.00 H new ATOM 0 HB THR A 110 7.900 15.354 2.477 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.523 16.109 4.375 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.493 14.891 2.746 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.363 13.484 2.089 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.880 13.512 3.802 1.00 0.00 H new ATOM 1676 N LEU A 111 10.530 14.891 2.746 1.00 0.00 N ATOM 1677 CA LEU A 111 11.818 15.573 2.795 1.00 0.00 C ATOM 1678 C LEU A 111 11.640 17.055 3.103 1.00 0.00 C ATOM 1679 O LEU A 111 10.690 17.698 2.654 1.00 0.00 O ATOM 1680 CB LEU A 111 12.558 15.401 1.467 1.00 0.00 C ATOM 1681 CG LEU A 111 12.893 13.965 1.065 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.077 13.860 -0.441 1.00 0.00 C ATOM 1683 CD2 LEU A 111 14.142 13.486 1.791 1.00 0.00 C ATOM 0 H LEU A 111 10.114 14.841 1.816 1.00 0.00 H new ATOM 0 HA LEU A 111 12.408 15.125 3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.953 15.846 0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.487 15.969 1.516 1.00 0.00 H new ATOM 0 HG LEU A 111 12.060 13.324 1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.315 12.830 -0.708 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.157 14.161 -0.942 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.891 14.513 -0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 111 14.366 12.462 1.493 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.982 14.131 1.534 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.974 13.522 2.867 1.00 0.00 H new ATOM 1695 N PRO A 112 12.575 17.614 3.885 1.00 0.00 N ATOM 1696 CA PRO A 112 12.544 19.029 4.269 1.00 0.00 C ATOM 1697 C PRO A 112 12.835 19.955 3.094 1.00 0.00 C ATOM 1698 O PRO A 112 13.918 19.912 2.509 1.00 0.00 O ATOM 1699 CB PRO A 112 13.651 19.136 5.321 1.00 0.00 C ATOM 1700 CG PRO A 112 14.586 18.022 5.000 1.00 0.00 C ATOM 1701 CD PRO A 112 13.735 16.909 4.456 1.00 0.00 C ATOM 0 HA PRO A 112 11.562 19.331 4.632 1.00 0.00 H new ATOM 0 HB2 PRO A 112 14.154 20.102 5.270 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.250 19.038 6.330 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.331 18.336 4.269 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.128 17.700 5.889 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.266 16.330 3.700 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.436 16.212 5.239 1.00 0.00 H new ATOM 1709 N VAL A 113 11.861 20.793 2.751 1.00 0.00 N ATOM 1710 CA VAL A 113 12.014 21.731 1.645 1.00 0.00 C ATOM 1711 C VAL A 113 13.433 22.286 1.587 1.00 0.00 C ATOM 1712 O VAL A 113 14.004 22.667 2.610 1.00 0.00 O ATOM 1713 CB VAL A 113 11.021 22.903 1.761 1.00 0.00 C ATOM 1714 CG1 VAL A 113 11.133 23.820 0.553 1.00 0.00 C ATOM 1715 CG2 VAL A 113 9.600 22.382 1.914 1.00 0.00 C ATOM 0 H VAL A 113 10.958 20.841 3.223 1.00 0.00 H new ATOM 0 HA VAL A 113 11.806 21.177 0.730 1.00 0.00 H new ATOM 0 HB VAL A 113 11.271 23.482 2.650 1.00 0.00 H new ATOM 0 HG11 VAL A 113 10.424 24.642 0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 113 12.145 24.220 0.492 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.910 23.257 -0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.911 23.223 1.995 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.338 21.780 1.044 1.00 0.00 H new ATOM 0 HG23 VAL A 113 9.532 21.770 2.813 1.00 0.00 H new ATOM 1725 N SER A 114 13.998 22.330 0.384 1.00 0.00 N ATOM 1726 CA SER A 114 15.352 22.836 0.194 1.00 0.00 C ATOM 1727 C SER A 114 15.344 24.097 -0.666 1.00 0.00 C ATOM 1728 O SER A 114 15.374 24.026 -1.893 1.00 0.00 O ATOM 1729 CB SER A 114 16.231 21.767 -0.457 1.00 0.00 C ATOM 1730 OG SER A 114 17.575 22.206 -0.562 1.00 0.00 O ATOM 0 H SER A 114 13.539 22.021 -0.473 1.00 0.00 H new ATOM 0 HA SER A 114 15.761 23.087 1.173 1.00 0.00 H new ATOM 0 HB2 SER A 114 16.190 20.850 0.131 1.00 0.00 H new ATOM 0 HB3 SER A 114 15.845 21.528 -1.448 1.00 0.00 H new ATOM 0 HG SER A 114 18.117 21.504 -0.980 1.00 0.00 H new ATOM 1736 N GLY A 115 15.305 25.252 -0.009 1.00 0.00 N ATOM 1737 CA GLY A 115 15.294 26.514 -0.726 1.00 0.00 C ATOM 1738 C GLY A 115 16.680 26.946 -1.160 1.00 0.00 C ATOM 1739 O GLY A 115 17.637 26.173 -1.116 1.00 0.00 O ATOM 0 H GLY A 115 15.281 25.336 1.007 1.00 0.00 H new ATOM 0 HA2 GLY A 115 14.653 26.424 -1.603 1.00 0.00 H new ATOM 0 HA3 GLY A 115 14.859 27.285 -0.091 1.00 0.00 H new ATOM 1743 N PRO A 116 16.803 28.210 -1.593 1.00 0.00 N ATOM 1744 CA PRO A 116 18.077 28.772 -2.046 1.00 0.00 C ATOM 1745 C PRO A 116 19.066 28.965 -0.901 1.00 0.00 C ATOM 1746 O PRO A 116 20.279 28.927 -1.101 1.00 0.00 O ATOM 1747 CB PRO A 116 17.678 30.124 -2.642 1.00 0.00 C ATOM 1748 CG PRO A 116 16.412 30.486 -1.945 1.00 0.00 C ATOM 1749 CD PRO A 116 15.704 29.188 -1.673 1.00 0.00 C ATOM 0 HA PRO A 116 18.584 28.114 -2.751 1.00 0.00 H new ATOM 0 HB2 PRO A 116 18.451 30.874 -2.474 1.00 0.00 H new ATOM 0 HB3 PRO A 116 17.531 30.054 -3.720 1.00 0.00 H new ATOM 0 HG2 PRO A 116 16.616 31.021 -1.018 1.00 0.00 H new ATOM 0 HG3 PRO A 116 15.800 31.142 -2.563 1.00 0.00 H new ATOM 0 HD2 PRO A 116 15.134 29.228 -0.745 1.00 0.00 H new ATOM 0 HD3 PRO A 116 15.002 28.939 -2.468 1.00 0.00 H new ATOM 1757 N SER A 117 18.537 29.174 0.302 1.00 0.00 N ATOM 1758 CA SER A 117 19.373 29.376 1.479 1.00 0.00 C ATOM 1759 C SER A 117 20.524 28.375 1.508 1.00 0.00 C ATOM 1760 O SER A 117 20.348 27.223 1.906 1.00 0.00 O ATOM 1761 CB SER A 117 18.536 29.246 2.753 1.00 0.00 C ATOM 1762 OG SER A 117 19.270 29.665 3.890 1.00 0.00 O ATOM 0 H SER A 117 17.534 29.208 0.486 1.00 0.00 H new ATOM 0 HA SER A 117 19.791 30.381 1.428 1.00 0.00 H new ATOM 0 HB2 SER A 117 17.630 29.845 2.660 1.00 0.00 H new ATOM 0 HB3 SER A 117 18.221 28.210 2.881 1.00 0.00 H new ATOM 0 HG SER A 117 18.713 29.574 4.691 1.00 0.00 H new ATOM 1768 N SER A 118 21.700 28.823 1.083 1.00 0.00 N ATOM 1769 CA SER A 118 22.880 27.966 1.056 1.00 0.00 C ATOM 1770 C SER A 118 23.423 27.746 2.464 1.00 0.00 C ATOM 1771 O SER A 118 23.481 28.671 3.271 1.00 0.00 O ATOM 1772 CB SER A 118 23.964 28.583 0.170 1.00 0.00 C ATOM 1773 OG SER A 118 24.829 27.586 -0.345 1.00 0.00 O ATOM 0 H SER A 118 21.862 29.774 0.753 1.00 0.00 H new ATOM 0 HA SER A 118 22.589 27.001 0.642 1.00 0.00 H new ATOM 0 HB2 SER A 118 23.500 29.127 -0.653 1.00 0.00 H new ATOM 0 HB3 SER A 118 24.540 29.307 0.746 1.00 0.00 H new ATOM 0 HG SER A 118 25.512 28.005 -0.909 1.00 0.00 H new ATOM 1779 N GLY A 119 23.822 26.509 2.751 1.00 0.00 N ATOM 1780 CA GLY A 119 24.356 26.188 4.061 1.00 0.00 C ATOM 1781 C GLY A 119 23.683 24.979 4.680 1.00 0.00 C ATOM 1782 O GLY A 119 24.195 23.862 4.592 1.00 0.00 O ATOM 0 H GLY A 119 23.784 25.725 2.099 1.00 0.00 H new ATOM 0 HA2 GLY A 119 25.427 26.001 3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 119 24.232 27.047 4.721 1.00 0.00 H new TER 1786 GLY A 119