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 99 GLN : amide:sc= -2.47! K(o=-2.8!,f=-2.1) USER MOD Set 1.2: A 102 TYR OH : rot -30:sc= -0.354 USER MOD Set 2.1: A 79 ASN : amide:sc= -1.21 K(o=-1.2,f=-0.23) USER MOD Set 2.2: A 80 ASN : amide:sc= 0 K(o=-1.2,f=-0.23) USER MOD Set 3.1: A 30 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 33 THR OG1 : rot 180:sc= -0.579 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.097 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0105 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 45:sc= 1.06 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -2.12! C(o=-2.1!,f=-3.1!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -170:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -164:sc= -0.0126 (180deg=-0.138) USER MOD Single : A 31 GLN : amide:sc= -0.992! C(o=-0.99!,f=-1.8!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -137:sc= 0.257 (180deg=0.0575) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 22:sc=9.34e-05 USER MOD Single : A 44 HIS : no HD1:sc= -2.1 K(o=-2.1,f=-5.7!) USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 HIS : no HD1:sc= -4.87! C(o=-4.9!,f=-4.2!) USER MOD Single : A 52 TYR OH : rot 80:sc= -0.988 USER MOD Single : A 53 GLN : amide:sc= -0.491 K(o=-0.49,f=-5.6!) USER MOD Single : A 57 LYS NZ :NH3+ 174:sc= 1.43 (180deg=1.32) USER MOD Single : A 61 SER OG : rot 180:sc= -0.326 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 110:sc= 0.146 USER MOD Single : A 70 HIS : no HD1:sc=-0.00734 X(o=-0.0073,f=-0.1) USER MOD Single : A 73 GLN : amide:sc= -0.146 K(o=-0.15,f=0.49) USER MOD Single : A 74 THR OG1 : rot 163:sc= 1.09 USER MOD Single : A 75 MET CE :methyl -118:sc= -0.727 (180deg=-5.06!) USER MOD Single : A 84 ASN : amide:sc= -4.16! C(o=-4.2!,f=-16!) USER MOD Single : A 85 THR OG1 : rot 67:sc= 0.163 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 23:sc= -0.795 USER MOD Single : A 95 ASN : amide:sc= -8.48! C(o=-8.5!,f=-26!) USER MOD Single : A 97 LYS NZ :NH3+ -132:sc= -0.109 (180deg=-1.49!) USER MOD Single : A 103 SER OG : rot -88:sc= 0.551 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 110 THR OG1 : rot -163:sc= 1.3 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 42:sc= 0.741 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.721 -30.675 8.885 1.00 0.00 N ATOM 2 CA GLY A 1 -14.228 -29.871 7.787 1.00 0.00 C ATOM 3 C GLY A 1 -14.145 -30.591 6.456 1.00 0.00 C ATOM 4 O GLY A 1 -13.573 -31.677 6.363 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.493 -30.880 9.551 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.338 -31.568 8.514 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.968 -30.154 9.378 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.265 -29.601 7.987 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.662 -28.941 7.730 1.00 0.00 H new ATOM 8 N SER A 2 -14.719 -29.984 5.422 1.00 0.00 N ATOM 9 CA SER A 2 -14.713 -30.576 4.089 1.00 0.00 C ATOM 10 C SER A 2 -15.024 -29.527 3.027 1.00 0.00 C ATOM 11 O SER A 2 -15.468 -28.422 3.341 1.00 0.00 O ATOM 12 CB SER A 2 -15.731 -31.716 4.009 1.00 0.00 C ATOM 13 OG SER A 2 -15.541 -32.488 2.836 1.00 0.00 O ATOM 0 H SER A 2 -15.194 -29.083 5.482 1.00 0.00 H new ATOM 0 HA SER A 2 -13.716 -30.974 3.900 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.637 -32.354 4.887 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.741 -31.307 4.019 1.00 0.00 H new ATOM 0 HG SER A 2 -16.202 -33.211 2.809 1.00 0.00 H new ATOM 19 N SER A 3 -14.786 -29.880 1.767 1.00 0.00 N ATOM 20 CA SER A 3 -15.037 -28.967 0.658 1.00 0.00 C ATOM 21 C SER A 3 -14.877 -29.683 -0.680 1.00 0.00 C ATOM 22 O SER A 3 -14.456 -30.837 -0.733 1.00 0.00 O ATOM 23 CB SER A 3 -14.083 -27.773 0.726 1.00 0.00 C ATOM 24 OG SER A 3 -12.732 -28.200 0.748 1.00 0.00 O ATOM 0 H SER A 3 -14.420 -30.791 1.489 1.00 0.00 H new ATOM 0 HA SER A 3 -16.063 -28.608 0.740 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.248 -27.122 -0.133 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.296 -27.184 1.618 1.00 0.00 H new ATOM 0 HG SER A 3 -12.142 -27.418 0.790 1.00 0.00 H new ATOM 30 N GLY A 4 -15.220 -28.988 -1.761 1.00 0.00 N ATOM 31 CA GLY A 4 -15.110 -29.572 -3.085 1.00 0.00 C ATOM 32 C GLY A 4 -15.997 -28.880 -4.100 1.00 0.00 C ATOM 33 O GLY A 4 -16.712 -27.934 -3.768 1.00 0.00 O ATOM 0 H GLY A 4 -15.572 -28.031 -1.743 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.073 -29.519 -3.417 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.375 -30.628 -3.036 1.00 0.00 H new ATOM 37 N SER A 5 -15.952 -29.351 -5.342 1.00 0.00 N ATOM 38 CA SER A 5 -16.755 -28.768 -6.410 1.00 0.00 C ATOM 39 C SER A 5 -18.244 -28.964 -6.141 1.00 0.00 C ATOM 40 O SER A 5 -18.801 -30.025 -6.422 1.00 0.00 O ATOM 41 CB SER A 5 -16.381 -29.393 -7.756 1.00 0.00 C ATOM 42 OG SER A 5 -16.697 -30.774 -7.783 1.00 0.00 O ATOM 0 H SER A 5 -15.368 -30.135 -5.633 1.00 0.00 H new ATOM 0 HA SER A 5 -16.549 -27.698 -6.444 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.911 -28.880 -8.558 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.315 -29.257 -7.940 1.00 0.00 H new ATOM 0 HG SER A 5 -17.591 -30.913 -7.406 1.00 0.00 H new ATOM 48 N SER A 6 -18.881 -27.934 -5.594 1.00 0.00 N ATOM 49 CA SER A 6 -20.303 -27.993 -5.283 1.00 0.00 C ATOM 50 C SER A 6 -21.058 -26.858 -5.968 1.00 0.00 C ATOM 51 O SER A 6 -21.373 -25.843 -5.348 1.00 0.00 O ATOM 52 CB SER A 6 -20.519 -27.923 -3.769 1.00 0.00 C ATOM 53 OG SER A 6 -19.988 -29.067 -3.125 1.00 0.00 O ATOM 0 H SER A 6 -18.434 -27.048 -5.357 1.00 0.00 H new ATOM 0 HA SER A 6 -20.691 -28.941 -5.656 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.045 -27.025 -3.372 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.585 -27.842 -3.554 1.00 0.00 H new ATOM 0 HG SER A 6 -20.137 -28.997 -2.159 1.00 0.00 H new ATOM 59 N GLY A 7 -21.345 -27.039 -7.253 1.00 0.00 N ATOM 60 CA GLY A 7 -22.059 -26.023 -8.004 1.00 0.00 C ATOM 61 C GLY A 7 -21.426 -24.652 -7.872 1.00 0.00 C ATOM 62 O GLY A 7 -20.203 -24.524 -7.882 1.00 0.00 O ATOM 0 H GLY A 7 -21.096 -27.871 -7.788 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.088 -26.307 -9.056 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -23.091 -25.978 -7.657 1.00 0.00 H new ATOM 66 N GLN A 8 -22.262 -23.625 -7.751 1.00 0.00 N ATOM 67 CA GLN A 8 -21.775 -22.257 -7.618 1.00 0.00 C ATOM 68 C GLN A 8 -21.641 -21.866 -6.151 1.00 0.00 C ATOM 69 O GLN A 8 -21.601 -20.682 -5.816 1.00 0.00 O ATOM 70 CB GLN A 8 -22.718 -21.287 -8.334 1.00 0.00 C ATOM 71 CG GLN A 8 -24.129 -21.284 -7.770 1.00 0.00 C ATOM 72 CD GLN A 8 -24.968 -22.435 -8.289 1.00 0.00 C ATOM 73 OE1 GLN A 8 -24.820 -22.858 -9.437 1.00 0.00 O ATOM 74 NE2 GLN A 8 -25.855 -22.949 -7.447 1.00 0.00 N ATOM 0 H GLN A 8 -23.278 -23.714 -7.742 1.00 0.00 H new ATOM 0 HA GLN A 8 -20.789 -22.202 -8.079 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -22.307 -20.279 -8.269 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -22.759 -21.547 -9.392 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -24.081 -21.336 -6.682 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -24.615 -20.342 -8.023 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -25.944 -22.568 -6.505 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -26.448 -23.725 -7.742 1.00 0.00 H new ATOM 83 N GLU A 9 -21.574 -22.867 -5.280 1.00 0.00 N ATOM 84 CA GLU A 9 -21.447 -22.627 -3.848 1.00 0.00 C ATOM 85 C GLU A 9 -20.175 -23.267 -3.299 1.00 0.00 C ATOM 86 O GLU A 9 -20.178 -23.851 -2.215 1.00 0.00 O ATOM 87 CB GLU A 9 -22.668 -23.174 -3.105 1.00 0.00 C ATOM 88 CG GLU A 9 -23.146 -24.518 -3.628 1.00 0.00 C ATOM 89 CD GLU A 9 -24.487 -24.926 -3.049 1.00 0.00 C ATOM 90 OE1 GLU A 9 -25.524 -24.487 -3.587 1.00 0.00 O ATOM 91 OE2 GLU A 9 -24.498 -25.685 -2.057 1.00 0.00 O ATOM 0 H GLU A 9 -21.606 -23.852 -5.541 1.00 0.00 H new ATOM 0 HA GLU A 9 -21.388 -21.550 -3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -22.426 -23.271 -2.047 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -23.482 -22.453 -3.181 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -23.222 -24.475 -4.715 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -22.405 -25.281 -3.390 1.00 0.00 H new ATOM 98 N TYR A 10 -19.089 -23.153 -4.056 1.00 0.00 N ATOM 99 CA TYR A 10 -17.811 -23.723 -3.648 1.00 0.00 C ATOM 100 C TYR A 10 -16.965 -22.691 -2.909 1.00 0.00 C ATOM 101 O TYR A 10 -16.367 -22.988 -1.875 1.00 0.00 O ATOM 102 CB TYR A 10 -17.049 -24.244 -4.868 1.00 0.00 C ATOM 103 CG TYR A 10 -16.225 -23.185 -5.566 1.00 0.00 C ATOM 104 CD1 TYR A 10 -16.836 -22.152 -6.267 1.00 0.00 C ATOM 105 CD2 TYR A 10 -14.837 -23.217 -5.523 1.00 0.00 C ATOM 106 CE1 TYR A 10 -16.088 -21.183 -6.906 1.00 0.00 C ATOM 107 CE2 TYR A 10 -14.081 -22.251 -6.158 1.00 0.00 C ATOM 108 CZ TYR A 10 -14.710 -21.237 -6.848 1.00 0.00 C ATOM 109 OH TYR A 10 -13.961 -20.273 -7.482 1.00 0.00 O ATOM 0 H TYR A 10 -19.069 -22.671 -4.955 1.00 0.00 H new ATOM 0 HA TYR A 10 -18.012 -24.553 -2.971 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -16.392 -25.056 -4.556 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -17.761 -24.665 -5.578 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -17.914 -22.106 -6.313 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -14.341 -24.010 -4.984 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -16.578 -20.388 -7.448 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -13.003 -22.290 -6.114 1.00 0.00 H new ATOM 0 HH TYR A 10 -13.008 -20.455 -7.343 1.00 0.00 H new ATOM 119 N ILE A 11 -16.921 -21.477 -3.447 1.00 0.00 N ATOM 120 CA ILE A 11 -16.151 -20.399 -2.839 1.00 0.00 C ATOM 121 C ILE A 11 -17.006 -19.150 -2.650 1.00 0.00 C ATOM 122 O ILE A 11 -16.935 -18.486 -1.616 1.00 0.00 O ATOM 123 CB ILE A 11 -14.918 -20.040 -3.688 1.00 0.00 C ATOM 124 CG1 ILE A 11 -13.817 -21.084 -3.497 1.00 0.00 C ATOM 125 CG2 ILE A 11 -14.409 -18.653 -3.324 1.00 0.00 C ATOM 126 CD1 ILE A 11 -12.974 -20.853 -2.262 1.00 0.00 C ATOM 0 H ILE A 11 -17.410 -21.215 -4.303 1.00 0.00 H new ATOM 0 HA ILE A 11 -15.819 -20.759 -1.865 1.00 0.00 H new ATOM 0 HB ILE A 11 -15.209 -20.035 -4.738 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.271 -22.073 -3.437 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -13.170 -21.083 -4.374 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -13.537 -18.414 -3.933 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -15.193 -17.918 -3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -14.132 -18.632 -2.270 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.214 -21.631 -2.190 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -12.491 -19.878 -2.328 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -13.609 -20.884 -1.377 1.00 0.00 H new ATOM 138 N LEU A 12 -17.816 -18.838 -3.657 1.00 0.00 N ATOM 139 CA LEU A 12 -18.688 -17.669 -3.602 1.00 0.00 C ATOM 140 C LEU A 12 -19.445 -17.617 -2.279 1.00 0.00 C ATOM 141 O LEU A 12 -19.899 -16.555 -1.854 1.00 0.00 O ATOM 142 CB LEU A 12 -19.676 -17.690 -4.769 1.00 0.00 C ATOM 143 CG LEU A 12 -19.147 -17.168 -6.105 1.00 0.00 C ATOM 144 CD1 LEU A 12 -20.271 -17.082 -7.127 1.00 0.00 C ATOM 145 CD2 LEU A 12 -18.484 -15.810 -5.923 1.00 0.00 C ATOM 0 H LEU A 12 -17.887 -19.377 -4.520 1.00 0.00 H new ATOM 0 HA LEU A 12 -18.066 -16.777 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -20.017 -18.715 -4.912 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -20.549 -17.099 -4.491 1.00 0.00 H new ATOM 0 HG LEU A 12 -18.399 -17.868 -6.476 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -19.876 -16.709 -8.072 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -20.701 -18.072 -7.279 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -21.043 -16.404 -6.763 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -18.114 -15.454 -6.884 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -19.211 -15.100 -5.529 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -17.652 -15.902 -5.225 1.00 0.00 H new ATOM 157 N ALA A 13 -19.578 -18.771 -1.633 1.00 0.00 N ATOM 158 CA ALA A 13 -20.277 -18.856 -0.357 1.00 0.00 C ATOM 159 C ALA A 13 -19.331 -18.577 0.807 1.00 0.00 C ATOM 160 O ALA A 13 -19.741 -18.048 1.840 1.00 0.00 O ATOM 161 CB ALA A 13 -20.923 -20.224 -0.199 1.00 0.00 C ATOM 0 H ALA A 13 -19.211 -19.660 -1.973 1.00 0.00 H new ATOM 0 HA ALA A 13 -21.057 -18.095 -0.347 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -21.441 -20.273 0.759 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -21.637 -20.385 -1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -20.154 -20.996 -0.235 1.00 0.00 H new ATOM 167 N LEU A 14 -18.065 -18.939 0.633 1.00 0.00 N ATOM 168 CA LEU A 14 -17.060 -18.729 1.670 1.00 0.00 C ATOM 169 C LEU A 14 -16.234 -17.479 1.383 1.00 0.00 C ATOM 170 O LEU A 14 -15.269 -17.186 2.087 1.00 0.00 O ATOM 171 CB LEU A 14 -16.143 -19.948 1.774 1.00 0.00 C ATOM 172 CG LEU A 14 -16.837 -21.295 1.981 1.00 0.00 C ATOM 173 CD1 LEU A 14 -15.896 -22.438 1.636 1.00 0.00 C ATOM 174 CD2 LEU A 14 -17.335 -21.423 3.413 1.00 0.00 C ATOM 0 H LEU A 14 -17.710 -19.379 -0.216 1.00 0.00 H new ATOM 0 HA LEU A 14 -17.577 -18.590 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.545 -20.006 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.451 -19.788 2.601 1.00 0.00 H new ATOM 0 HG LEU A 14 -17.697 -21.347 1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -16.407 -23.389 1.789 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.589 -22.355 0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -15.016 -22.391 2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -17.826 -22.387 3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -16.491 -21.350 4.099 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -18.045 -20.623 3.624 1.00 0.00 H new ATOM 186 N ALA A 15 -16.622 -16.746 0.343 1.00 0.00 N ATOM 187 CA ALA A 15 -15.919 -15.526 -0.035 1.00 0.00 C ATOM 188 C ALA A 15 -15.953 -14.501 1.093 1.00 0.00 C ATOM 189 O ALA A 15 -17.009 -13.956 1.419 1.00 0.00 O ATOM 190 CB ALA A 15 -16.525 -14.939 -1.302 1.00 0.00 C ATOM 0 H ALA A 15 -17.418 -16.976 -0.252 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.877 -15.781 -0.228 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.991 -14.028 -1.573 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.444 -15.662 -2.113 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.575 -14.705 -1.128 1.00 0.00 H new ATOM 196 N ASP A 16 -14.793 -14.243 1.687 1.00 0.00 N ATOM 197 CA ASP A 16 -14.691 -13.283 2.780 1.00 0.00 C ATOM 198 C ASP A 16 -14.059 -11.979 2.300 1.00 0.00 C ATOM 199 O ASP A 16 -14.745 -10.974 2.119 1.00 0.00 O ATOM 200 CB ASP A 16 -13.869 -13.870 3.928 1.00 0.00 C ATOM 201 CG ASP A 16 -12.811 -14.842 3.445 1.00 0.00 C ATOM 202 OD1 ASP A 16 -13.152 -16.020 3.206 1.00 0.00 O ATOM 203 OD2 ASP A 16 -11.643 -14.427 3.304 1.00 0.00 O ATOM 0 H ASP A 16 -13.910 -14.685 1.430 1.00 0.00 H new ATOM 0 HA ASP A 16 -15.698 -13.068 3.138 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -13.390 -13.061 4.479 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -14.535 -14.379 4.625 1.00 0.00 H new ATOM 208 N VAL A 17 -12.745 -12.004 2.096 1.00 0.00 N ATOM 209 CA VAL A 17 -12.021 -10.825 1.638 1.00 0.00 C ATOM 210 C VAL A 17 -10.555 -11.151 1.368 1.00 0.00 C ATOM 211 O VAL A 17 -10.006 -12.125 1.883 1.00 0.00 O ATOM 212 CB VAL A 17 -12.100 -9.682 2.666 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.309 -8.800 2.393 1.00 0.00 C ATOM 214 CG2 VAL A 17 -12.146 -10.240 4.081 1.00 0.00 C ATOM 0 H VAL A 17 -12.161 -12.828 2.241 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.496 -10.503 0.711 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.204 -9.069 2.570 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.348 -7.998 3.130 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -13.229 -8.372 1.394 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.218 -9.398 2.459 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.202 -9.418 4.795 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -13.023 -10.877 4.192 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.246 -10.825 4.271 1.00 0.00 H new ATOM 224 N PRO A 18 -9.905 -10.317 0.543 1.00 0.00 N ATOM 225 CA PRO A 18 -8.495 -10.495 0.188 1.00 0.00 C ATOM 226 C PRO A 18 -7.562 -10.217 1.360 1.00 0.00 C ATOM 227 O PRO A 18 -7.813 -9.323 2.168 1.00 0.00 O ATOM 228 CB PRO A 18 -8.276 -9.466 -0.924 1.00 0.00 C ATOM 229 CG PRO A 18 -9.307 -8.418 -0.678 1.00 0.00 C ATOM 230 CD PRO A 18 -10.498 -9.136 -0.106 1.00 0.00 C ATOM 0 HA PRO A 18 -8.277 -11.520 -0.111 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.270 -9.049 -0.885 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.396 -9.916 -1.909 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.937 -7.662 0.015 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.569 -7.903 -1.602 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.038 -8.514 0.608 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -11.208 -9.419 -0.883 1.00 0.00 H new ATOM 238 N SER A 19 -6.483 -10.990 1.450 1.00 0.00 N ATOM 239 CA SER A 19 -5.514 -10.829 2.527 1.00 0.00 C ATOM 240 C SER A 19 -4.713 -9.543 2.349 1.00 0.00 C ATOM 241 O SER A 19 -4.622 -9.002 1.247 1.00 0.00 O ATOM 242 CB SER A 19 -4.568 -12.030 2.575 1.00 0.00 C ATOM 243 OG SER A 19 -5.292 -13.248 2.622 1.00 0.00 O ATOM 0 H SER A 19 -6.259 -11.734 0.789 1.00 0.00 H new ATOM 0 HA SER A 19 -6.061 -10.769 3.468 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.920 -12.022 1.698 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.922 -11.953 3.450 1.00 0.00 H new ATOM 0 HG SER A 19 -4.677 -13.987 2.810 1.00 0.00 H new ATOM 249 N SER A 20 -4.133 -9.058 3.442 1.00 0.00 N ATOM 250 CA SER A 20 -3.341 -7.834 3.410 1.00 0.00 C ATOM 251 C SER A 20 -2.230 -7.932 2.368 1.00 0.00 C ATOM 252 O SER A 20 -1.587 -8.969 2.207 1.00 0.00 O ATOM 253 CB SER A 20 -2.741 -7.552 4.788 1.00 0.00 C ATOM 254 OG SER A 20 -2.000 -8.665 5.258 1.00 0.00 O ATOM 0 H SER A 20 -4.197 -9.494 4.362 1.00 0.00 H new ATOM 0 HA SER A 20 -4.001 -7.011 3.135 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.094 -6.677 4.734 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.538 -7.317 5.494 1.00 0.00 H new ATOM 0 HG SER A 20 -1.625 -8.460 6.140 1.00 0.00 H new ATOM 260 N PRO A 21 -2.000 -6.827 1.643 1.00 0.00 N ATOM 261 CA PRO A 21 -0.967 -6.763 0.606 1.00 0.00 C ATOM 262 C PRO A 21 0.442 -6.794 1.187 1.00 0.00 C ATOM 263 O PRO A 21 0.636 -6.567 2.382 1.00 0.00 O ATOM 264 CB PRO A 21 -1.235 -5.419 -0.078 1.00 0.00 C ATOM 265 CG PRO A 21 -1.916 -4.596 0.960 1.00 0.00 C ATOM 266 CD PRO A 21 -2.730 -5.556 1.783 1.00 0.00 C ATOM 0 HA PRO A 21 -1.014 -7.618 -0.069 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.308 -4.951 -0.409 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.863 -5.542 -0.961 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.189 -4.070 1.579 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.552 -3.839 0.502 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.792 -5.240 2.824 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.752 -5.636 1.413 1.00 0.00 H new ATOM 274 N TYR A 22 1.422 -7.075 0.336 1.00 0.00 N ATOM 275 CA TYR A 22 2.813 -7.137 0.766 1.00 0.00 C ATOM 276 C TYR A 22 3.731 -6.482 -0.262 1.00 0.00 C ATOM 277 O TYR A 22 3.306 -6.143 -1.365 1.00 0.00 O ATOM 278 CB TYR A 22 3.235 -8.590 0.992 1.00 0.00 C ATOM 279 CG TYR A 22 3.370 -9.386 -0.286 1.00 0.00 C ATOM 280 CD1 TYR A 22 2.266 -10.002 -0.863 1.00 0.00 C ATOM 281 CD2 TYR A 22 4.600 -9.525 -0.916 1.00 0.00 C ATOM 282 CE1 TYR A 22 2.384 -10.732 -2.031 1.00 0.00 C ATOM 283 CE2 TYR A 22 4.727 -10.252 -2.084 1.00 0.00 C ATOM 284 CZ TYR A 22 3.616 -10.853 -2.638 1.00 0.00 C ATOM 285 OH TYR A 22 3.739 -11.579 -3.800 1.00 0.00 O ATOM 0 H TYR A 22 1.279 -7.264 -0.656 1.00 0.00 H new ATOM 0 HA TYR A 22 2.901 -6.590 1.705 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.187 -8.605 1.522 1.00 0.00 H new ATOM 0 HB3 TYR A 22 2.503 -9.076 1.638 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.299 -9.909 -0.391 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.473 -9.057 -0.485 1.00 0.00 H new ATOM 0 HE1 TYR A 22 1.516 -11.205 -2.466 1.00 0.00 H new ATOM 0 HE2 TYR A 22 5.691 -10.349 -2.561 1.00 0.00 H new ATOM 0 HH TYR A 22 4.673 -11.564 -4.098 1.00 0.00 H new ATOM 295 N GLY A 23 4.997 -6.310 0.109 1.00 0.00 N ATOM 296 CA GLY A 23 5.957 -5.698 -0.790 1.00 0.00 C ATOM 297 C GLY A 23 5.861 -4.185 -0.800 1.00 0.00 C ATOM 298 O GLY A 23 6.456 -3.522 -1.649 1.00 0.00 O ATOM 0 H GLY A 23 5.374 -6.584 1.016 1.00 0.00 H new ATOM 0 HA2 GLY A 23 6.964 -5.993 -0.496 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.796 -6.076 -1.800 1.00 0.00 H new ATOM 302 N VAL A 24 5.106 -3.636 0.147 1.00 0.00 N ATOM 303 CA VAL A 24 4.933 -2.191 0.245 1.00 0.00 C ATOM 304 C VAL A 24 6.272 -1.489 0.439 1.00 0.00 C ATOM 305 O VAL A 24 7.072 -1.877 1.291 1.00 0.00 O ATOM 306 CB VAL A 24 3.996 -1.816 1.408 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.741 -0.316 1.426 1.00 0.00 C ATOM 308 CG2 VAL A 24 2.689 -2.587 1.308 1.00 0.00 C ATOM 0 H VAL A 24 4.605 -4.170 0.857 1.00 0.00 H new ATOM 0 HA VAL A 24 4.486 -1.861 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 24 4.481 -2.089 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.077 -0.070 2.254 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.686 0.212 1.549 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.277 -0.015 0.487 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.039 -2.310 2.138 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.197 -2.348 0.365 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.894 -3.657 1.349 1.00 0.00 H new ATOM 318 N LYS A 25 6.511 -0.453 -0.358 1.00 0.00 N ATOM 319 CA LYS A 25 7.753 0.306 -0.274 1.00 0.00 C ATOM 320 C LYS A 25 7.654 1.601 -1.073 1.00 0.00 C ATOM 321 O LYS A 25 7.121 1.617 -2.183 1.00 0.00 O ATOM 322 CB LYS A 25 8.925 -0.534 -0.787 1.00 0.00 C ATOM 323 CG LYS A 25 8.660 -1.188 -2.133 1.00 0.00 C ATOM 324 CD LYS A 25 9.099 -0.297 -3.283 1.00 0.00 C ATOM 325 CE LYS A 25 9.513 -1.115 -4.496 1.00 0.00 C ATOM 326 NZ LYS A 25 10.819 -1.799 -4.286 1.00 0.00 N ATOM 0 H LYS A 25 5.861 -0.120 -1.070 1.00 0.00 H new ATOM 0 HA LYS A 25 7.925 0.557 0.773 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.808 0.100 -0.868 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.154 -1.308 -0.055 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.189 -2.139 -2.186 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.597 -1.409 -2.228 1.00 0.00 H new ATOM 0 HD2 LYS A 25 8.284 0.374 -3.556 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.933 0.328 -2.963 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.745 -1.858 -4.712 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.581 -0.463 -5.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 11.196 -2.116 -5.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.490 -1.138 -3.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.684 -2.622 -3.664 1.00 0.00 H new ATOM 340 N ILE A 26 8.171 2.685 -0.503 1.00 0.00 N ATOM 341 CA ILE A 26 8.141 3.983 -1.163 1.00 0.00 C ATOM 342 C ILE A 26 9.332 4.149 -2.101 1.00 0.00 C ATOM 343 O ILE A 26 10.459 4.370 -1.656 1.00 0.00 O ATOM 344 CB ILE A 26 8.143 5.136 -0.142 1.00 0.00 C ATOM 345 CG1 ILE A 26 7.240 4.794 1.046 1.00 0.00 C ATOM 346 CG2 ILE A 26 7.692 6.430 -0.801 1.00 0.00 C ATOM 347 CD1 ILE A 26 5.813 4.486 0.650 1.00 0.00 C ATOM 0 H ILE A 26 8.616 2.689 0.415 1.00 0.00 H new ATOM 0 HA ILE A 26 7.217 4.022 -1.740 1.00 0.00 H new ATOM 0 HB ILE A 26 9.160 5.275 0.225 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.656 3.935 1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.242 5.629 1.746 1.00 0.00 H new ATOM 0 HG21 ILE A 26 7.699 7.235 -0.066 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.370 6.678 -1.617 1.00 0.00 H new ATOM 0 HG23 ILE A 26 6.683 6.306 -1.193 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.230 4.253 1.541 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.379 5.352 0.149 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.799 3.631 -0.026 1.00 0.00 H new ATOM 359 N ILE A 27 9.075 4.043 -3.400 1.00 0.00 N ATOM 360 CA ILE A 27 10.125 4.185 -4.401 1.00 0.00 C ATOM 361 C ILE A 27 10.428 5.654 -4.677 1.00 0.00 C ATOM 362 O ILE A 27 11.585 6.040 -4.832 1.00 0.00 O ATOM 363 CB ILE A 27 9.740 3.495 -5.723 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.416 4.055 -6.249 1.00 0.00 C ATOM 365 CG2 ILE A 27 9.643 1.989 -5.527 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.976 3.438 -7.558 1.00 0.00 C ATOM 0 H ILE A 27 8.148 3.859 -3.784 1.00 0.00 H new ATOM 0 HA ILE A 27 11.014 3.703 -3.995 1.00 0.00 H new ATOM 0 HB ILE A 27 10.517 3.696 -6.460 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.640 3.893 -5.501 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.513 5.133 -6.379 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.370 1.516 -6.470 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.606 1.603 -5.193 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.883 1.768 -4.777 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.031 3.882 -7.870 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.733 3.623 -8.320 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.846 2.364 -7.428 1.00 0.00 H new ATOM 378 N GLU A 28 9.378 6.468 -4.734 1.00 0.00 N ATOM 379 CA GLU A 28 9.532 7.895 -4.991 1.00 0.00 C ATOM 380 C GLU A 28 9.007 8.718 -3.818 1.00 0.00 C ATOM 381 O GLU A 28 7.802 8.935 -3.686 1.00 0.00 O ATOM 382 CB GLU A 28 8.797 8.289 -6.273 1.00 0.00 C ATOM 383 CG GLU A 28 9.340 7.609 -7.519 1.00 0.00 C ATOM 384 CD GLU A 28 9.131 8.435 -8.773 1.00 0.00 C ATOM 385 OE1 GLU A 28 9.778 9.495 -8.899 1.00 0.00 O ATOM 386 OE2 GLU A 28 8.319 8.022 -9.627 1.00 0.00 O ATOM 0 H GLU A 28 8.413 6.164 -4.606 1.00 0.00 H new ATOM 0 HA GLU A 28 10.595 8.103 -5.113 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.740 8.043 -6.166 1.00 0.00 H new ATOM 0 HB3 GLU A 28 8.862 9.369 -6.401 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.405 7.417 -7.388 1.00 0.00 H new ATOM 0 HG3 GLU A 28 8.854 6.641 -7.641 1.00 0.00 H new ATOM 393 N LEU A 29 9.920 9.174 -2.967 1.00 0.00 N ATOM 394 CA LEU A 29 9.551 9.973 -1.804 1.00 0.00 C ATOM 395 C LEU A 29 9.961 11.429 -1.991 1.00 0.00 C ATOM 396 O LEU A 29 11.119 11.726 -2.285 1.00 0.00 O ATOM 397 CB LEU A 29 10.203 9.405 -0.541 1.00 0.00 C ATOM 398 CG LEU A 29 9.822 10.083 0.774 1.00 0.00 C ATOM 399 CD1 LEU A 29 8.359 9.826 1.102 1.00 0.00 C ATOM 400 CD2 LEU A 29 10.717 9.596 1.904 1.00 0.00 C ATOM 0 H LEU A 29 10.921 9.004 -3.061 1.00 0.00 H new ATOM 0 HA LEU A 29 8.467 9.931 -1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.948 8.348 -0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.285 9.464 -0.657 1.00 0.00 H new ATOM 0 HG LEU A 29 9.965 11.158 0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.105 10.316 2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.732 10.224 0.304 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.190 8.753 1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.431 10.090 2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.606 8.518 2.017 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.756 9.832 1.673 1.00 0.00 H new ATOM 412 N SER A 30 9.004 12.336 -1.818 1.00 0.00 N ATOM 413 CA SER A 30 9.266 13.762 -1.969 1.00 0.00 C ATOM 414 C SER A 30 8.954 14.513 -0.678 1.00 0.00 C ATOM 415 O SER A 30 8.546 13.913 0.317 1.00 0.00 O ATOM 416 CB SER A 30 8.435 14.336 -3.119 1.00 0.00 C ATOM 417 OG SER A 30 8.760 13.707 -4.346 1.00 0.00 O ATOM 0 H SER A 30 8.040 12.108 -1.573 1.00 0.00 H new ATOM 0 HA SER A 30 10.325 13.889 -2.195 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.374 14.202 -2.908 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.611 15.409 -3.199 1.00 0.00 H new ATOM 0 HG SER A 30 8.215 14.090 -5.064 1.00 0.00 H new ATOM 423 N GLN A 31 9.149 15.827 -0.702 1.00 0.00 N ATOM 424 CA GLN A 31 8.889 16.658 0.467 1.00 0.00 C ATOM 425 C GLN A 31 7.402 16.972 0.592 1.00 0.00 C ATOM 426 O GLN A 31 6.926 17.363 1.659 1.00 0.00 O ATOM 427 CB GLN A 31 9.691 17.958 0.383 1.00 0.00 C ATOM 428 CG GLN A 31 9.669 18.599 -0.996 1.00 0.00 C ATOM 429 CD GLN A 31 10.823 18.147 -1.869 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.624 17.477 -2.883 1.00 0.00 O ATOM 431 NE2 GLN A 31 12.039 18.511 -1.478 1.00 0.00 N ATOM 0 H GLN A 31 9.486 16.339 -1.517 1.00 0.00 H new ATOM 0 HA GLN A 31 9.200 16.103 1.352 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.295 18.667 1.110 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.725 17.756 0.664 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.728 18.356 -1.490 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.703 19.683 -0.889 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.157 19.066 -0.631 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.855 18.235 -2.025 1.00 0.00 H new ATOM 440 N THR A 32 6.671 16.800 -0.504 1.00 0.00 N ATOM 441 CA THR A 32 5.238 17.065 -0.518 1.00 0.00 C ATOM 442 C THR A 32 4.458 15.850 -1.006 1.00 0.00 C ATOM 443 O THR A 32 3.316 15.629 -0.602 1.00 0.00 O ATOM 444 CB THR A 32 4.899 18.272 -1.413 1.00 0.00 C ATOM 445 OG1 THR A 32 5.396 18.054 -2.739 1.00 0.00 O ATOM 446 CG2 THR A 32 5.498 19.552 -0.847 1.00 0.00 C ATOM 0 H THR A 32 7.048 16.478 -1.395 1.00 0.00 H new ATOM 0 HA THR A 32 4.949 17.290 0.508 1.00 0.00 H new ATOM 0 HB THR A 32 3.815 18.379 -1.444 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.175 18.825 -3.302 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.245 20.390 -1.496 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.097 19.732 0.150 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.582 19.452 -0.789 1.00 0.00 H new ATOM 454 N THR A 33 5.081 15.064 -1.879 1.00 0.00 N ATOM 455 CA THR A 33 4.445 13.871 -2.422 1.00 0.00 C ATOM 456 C THR A 33 5.164 12.607 -1.964 1.00 0.00 C ATOM 457 O THR A 33 6.310 12.660 -1.521 1.00 0.00 O ATOM 458 CB THR A 33 4.416 13.902 -3.962 1.00 0.00 C ATOM 459 OG1 THR A 33 5.669 14.375 -4.467 1.00 0.00 O ATOM 460 CG2 THR A 33 3.291 14.795 -4.464 1.00 0.00 C ATOM 0 H THR A 33 6.026 15.233 -2.225 1.00 0.00 H new ATOM 0 HA THR A 33 3.422 13.860 -2.046 1.00 0.00 H new ATOM 0 HB THR A 33 4.241 12.888 -4.320 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.642 14.390 -5.447 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.290 14.801 -5.554 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.336 14.414 -4.103 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.440 15.810 -4.095 1.00 0.00 H new ATOM 468 N ALA A 34 4.483 11.471 -2.077 1.00 0.00 N ATOM 469 CA ALA A 34 5.059 10.193 -1.676 1.00 0.00 C ATOM 470 C ALA A 34 4.374 9.034 -2.392 1.00 0.00 C ATOM 471 O ALA A 34 3.183 8.790 -2.200 1.00 0.00 O ATOM 472 CB ALA A 34 4.958 10.018 -0.168 1.00 0.00 C ATOM 0 H ALA A 34 3.533 11.410 -2.443 1.00 0.00 H new ATOM 0 HA ALA A 34 6.111 10.191 -1.961 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.392 9.060 0.117 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.499 10.823 0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.911 10.046 0.132 1.00 0.00 H new ATOM 478 N LYS A 35 5.133 8.324 -3.218 1.00 0.00 N ATOM 479 CA LYS A 35 4.601 7.189 -3.964 1.00 0.00 C ATOM 480 C LYS A 35 4.871 5.881 -3.229 1.00 0.00 C ATOM 481 O LYS A 35 5.975 5.650 -2.736 1.00 0.00 O ATOM 482 CB LYS A 35 5.216 7.138 -5.364 1.00 0.00 C ATOM 483 CG LYS A 35 4.576 6.103 -6.273 1.00 0.00 C ATOM 484 CD LYS A 35 5.348 5.947 -7.573 1.00 0.00 C ATOM 485 CE LYS A 35 4.862 6.926 -8.630 1.00 0.00 C ATOM 486 NZ LYS A 35 5.585 8.225 -8.558 1.00 0.00 N ATOM 0 H LYS A 35 6.120 8.514 -3.389 1.00 0.00 H new ATOM 0 HA LYS A 35 3.522 7.318 -4.054 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.126 8.121 -5.827 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.281 6.923 -5.276 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.532 5.143 -5.758 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.549 6.395 -6.492 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.410 6.107 -7.388 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.239 4.927 -7.942 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.998 6.489 -9.619 1.00 0.00 H new ATOM 0 HE3 LYS A 35 3.793 7.098 -8.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 4.907 9.006 -8.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.063 8.306 -7.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 6.291 8.272 -9.320 1.00 0.00 H new ATOM 500 N VAL A 36 3.856 5.024 -3.162 1.00 0.00 N ATOM 501 CA VAL A 36 3.986 3.737 -2.490 1.00 0.00 C ATOM 502 C VAL A 36 3.695 2.585 -3.447 1.00 0.00 C ATOM 503 O VAL A 36 2.575 2.441 -3.937 1.00 0.00 O ATOM 504 CB VAL A 36 3.038 3.637 -1.280 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.627 4.051 -1.671 1.00 0.00 C ATOM 506 CG2 VAL A 36 3.048 2.227 -0.710 1.00 0.00 C ATOM 0 H VAL A 36 2.935 5.198 -3.565 1.00 0.00 H new ATOM 0 HA VAL A 36 5.016 3.665 -2.142 1.00 0.00 H new ATOM 0 HB VAL A 36 3.391 4.320 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.972 3.974 -0.803 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.636 5.081 -2.029 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.261 3.395 -2.461 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.373 2.175 0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.720 1.523 -1.475 1.00 0.00 H new ATOM 0 HG23 VAL A 36 4.058 1.971 -0.390 1.00 0.00 H new ATOM 516 N SER A 37 4.710 1.769 -3.707 1.00 0.00 N ATOM 517 CA SER A 37 4.565 0.631 -4.608 1.00 0.00 C ATOM 518 C SER A 37 4.527 -0.678 -3.828 1.00 0.00 C ATOM 519 O SER A 37 5.431 -0.975 -3.046 1.00 0.00 O ATOM 520 CB SER A 37 5.713 0.604 -5.619 1.00 0.00 C ATOM 521 OG SER A 37 5.729 -0.616 -6.340 1.00 0.00 O ATOM 0 H SER A 37 5.642 1.874 -3.307 1.00 0.00 H new ATOM 0 HA SER A 37 3.622 0.741 -5.144 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.611 1.439 -6.313 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.662 0.736 -5.100 1.00 0.00 H new ATOM 0 HG SER A 37 6.471 -0.608 -6.981 1.00 0.00 H new ATOM 527 N PHE A 38 3.474 -1.460 -4.045 1.00 0.00 N ATOM 528 CA PHE A 38 3.317 -2.738 -3.362 1.00 0.00 C ATOM 529 C PHE A 38 2.969 -3.845 -4.353 1.00 0.00 C ATOM 530 O PHE A 38 2.878 -3.609 -5.557 1.00 0.00 O ATOM 531 CB PHE A 38 2.229 -2.638 -2.291 1.00 0.00 C ATOM 532 CG PHE A 38 1.065 -1.780 -2.698 1.00 0.00 C ATOM 533 CD1 PHE A 38 1.198 -0.404 -2.785 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.163 -2.349 -2.992 1.00 0.00 C ATOM 535 CE1 PHE A 38 0.130 0.389 -3.158 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.235 -1.562 -3.368 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.089 -0.191 -3.450 1.00 0.00 C ATOM 0 H PHE A 38 2.717 -1.230 -4.689 1.00 0.00 H new ATOM 0 HA PHE A 38 4.265 -2.985 -2.885 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.868 -3.639 -2.057 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.666 -2.235 -1.377 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.149 0.055 -2.558 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.284 -3.420 -2.927 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.248 1.461 -3.221 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.186 -2.019 -3.598 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.926 0.426 -3.742 1.00 0.00 H new ATOM 547 N ASN A 39 2.779 -5.056 -3.837 1.00 0.00 N ATOM 548 CA ASN A 39 2.444 -6.201 -4.676 1.00 0.00 C ATOM 549 C ASN A 39 1.097 -6.794 -4.273 1.00 0.00 C ATOM 550 O ASN A 39 0.627 -6.592 -3.153 1.00 0.00 O ATOM 551 CB ASN A 39 3.535 -7.268 -4.578 1.00 0.00 C ATOM 552 CG ASN A 39 4.873 -6.777 -5.095 1.00 0.00 C ATOM 553 OD1 ASN A 39 4.933 -5.954 -6.009 1.00 0.00 O ATOM 554 ND2 ASN A 39 5.953 -7.281 -4.512 1.00 0.00 N ATOM 0 H ASN A 39 2.851 -5.269 -2.842 1.00 0.00 H new ATOM 0 HA ASN A 39 2.375 -5.857 -5.708 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.642 -7.579 -3.539 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.231 -8.148 -5.145 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.881 -6.989 -4.818 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.855 -7.961 -3.758 1.00 0.00 H new ATOM 561 N LYS A 40 0.481 -7.529 -5.193 1.00 0.00 N ATOM 562 CA LYS A 40 -0.810 -8.154 -4.935 1.00 0.00 C ATOM 563 C LYS A 40 -0.737 -9.071 -3.717 1.00 0.00 C ATOM 564 O LYS A 40 0.324 -9.582 -3.360 1.00 0.00 O ATOM 565 CB LYS A 40 -1.269 -8.950 -6.159 1.00 0.00 C ATOM 566 CG LYS A 40 -2.020 -8.115 -7.181 1.00 0.00 C ATOM 567 CD LYS A 40 -3.021 -8.952 -7.959 1.00 0.00 C ATOM 568 CE LYS A 40 -4.351 -9.053 -7.226 1.00 0.00 C ATOM 569 NZ LYS A 40 -5.477 -9.340 -8.158 1.00 0.00 N ATOM 0 H LYS A 40 0.856 -7.706 -6.125 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.533 -7.364 -4.731 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -0.398 -9.398 -6.638 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -1.909 -9.769 -5.830 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -2.540 -7.301 -6.676 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -1.311 -7.660 -7.872 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.179 -8.511 -8.943 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.615 -9.951 -8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.292 -9.840 -6.474 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.546 -8.120 -6.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.365 -9.401 -7.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.549 -8.577 -8.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -5.304 -10.243 -8.644 1.00 0.00 H new ATOM 583 N PRO A 41 -1.889 -9.286 -3.067 1.00 0.00 N ATOM 584 CA PRO A 41 -1.982 -10.142 -1.881 1.00 0.00 C ATOM 585 C PRO A 41 -1.784 -11.617 -2.216 1.00 0.00 C ATOM 586 O PRO A 41 -2.347 -12.125 -3.185 1.00 0.00 O ATOM 587 CB PRO A 41 -3.406 -9.896 -1.376 1.00 0.00 C ATOM 588 CG PRO A 41 -4.168 -9.466 -2.581 1.00 0.00 C ATOM 589 CD PRO A 41 -3.192 -8.707 -3.438 1.00 0.00 C ATOM 0 HA PRO A 41 -1.209 -9.909 -1.148 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.833 -10.799 -0.940 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.424 -9.129 -0.602 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.571 -10.326 -3.116 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.015 -8.838 -2.304 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.402 -8.839 -4.499 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.228 -7.636 -3.236 1.00 0.00 H new ATOM 597 N ASP A 42 -0.979 -12.299 -1.407 1.00 0.00 N ATOM 598 CA ASP A 42 -0.708 -13.716 -1.616 1.00 0.00 C ATOM 599 C ASP A 42 -2.006 -14.497 -1.800 1.00 0.00 C ATOM 600 O ASP A 42 -2.021 -15.555 -2.429 1.00 0.00 O ATOM 601 CB ASP A 42 0.082 -14.286 -0.437 1.00 0.00 C ATOM 602 CG ASP A 42 -0.672 -14.173 0.873 1.00 0.00 C ATOM 603 OD1 ASP A 42 -1.571 -15.005 1.114 1.00 0.00 O ATOM 604 OD2 ASP A 42 -0.364 -13.251 1.658 1.00 0.00 O ATOM 0 H ASP A 42 -0.503 -11.893 -0.601 1.00 0.00 H new ATOM 0 HA ASP A 42 -0.113 -13.816 -2.524 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.313 -15.333 -0.631 1.00 0.00 H new ATOM 0 HB3 ASP A 42 1.033 -13.760 -0.352 1.00 0.00 H new ATOM 609 N SER A 43 -3.091 -13.969 -1.245 1.00 0.00 N ATOM 610 CA SER A 43 -4.394 -14.619 -1.344 1.00 0.00 C ATOM 611 C SER A 43 -5.499 -13.591 -1.564 1.00 0.00 C ATOM 612 O SER A 43 -5.317 -12.400 -1.303 1.00 0.00 O ATOM 613 CB SER A 43 -4.679 -15.428 -0.076 1.00 0.00 C ATOM 614 OG SER A 43 -4.088 -16.714 -0.149 1.00 0.00 O ATOM 0 H SER A 43 -3.095 -13.093 -0.722 1.00 0.00 H new ATOM 0 HA SER A 43 -4.374 -15.292 -2.201 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.293 -14.896 0.793 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.756 -15.526 0.062 1.00 0.00 H new ATOM 0 HG SER A 43 -3.353 -16.700 -0.797 1.00 0.00 H new ATOM 620 N HIS A 44 -6.646 -14.059 -2.046 1.00 0.00 N ATOM 621 CA HIS A 44 -7.782 -13.180 -2.302 1.00 0.00 C ATOM 622 C HIS A 44 -9.039 -13.705 -1.616 1.00 0.00 C ATOM 623 O HIS A 44 -9.142 -14.892 -1.308 1.00 0.00 O ATOM 624 CB HIS A 44 -8.025 -13.051 -3.806 1.00 0.00 C ATOM 625 CG HIS A 44 -8.365 -14.349 -4.472 1.00 0.00 C ATOM 626 ND1 HIS A 44 -9.593 -14.961 -4.345 1.00 0.00 N ATOM 627 CD2 HIS A 44 -7.627 -15.150 -5.277 1.00 0.00 C ATOM 628 CE1 HIS A 44 -9.597 -16.085 -5.041 1.00 0.00 C ATOM 629 NE2 HIS A 44 -8.417 -16.222 -5.617 1.00 0.00 N ATOM 0 H HIS A 44 -6.814 -15.041 -2.267 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.549 -12.197 -1.893 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -8.836 -12.342 -3.975 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -7.134 -12.634 -4.275 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -6.608 -14.978 -5.593 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -10.425 -16.774 -5.124 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -8.137 -16.998 -6.217 1.00 0.00 H new ATOM 638 N GLY A 45 -9.995 -12.811 -1.377 1.00 0.00 N ATOM 639 CA GLY A 45 -11.232 -13.203 -0.727 1.00 0.00 C ATOM 640 C GLY A 45 -12.171 -13.937 -1.664 1.00 0.00 C ATOM 641 O GLY A 45 -13.316 -13.528 -1.851 1.00 0.00 O ATOM 0 H GLY A 45 -9.934 -11.823 -1.622 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.004 -13.841 0.127 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.732 -12.316 -0.338 1.00 0.00 H new ATOM 645 N GLY A 46 -11.686 -15.023 -2.257 1.00 0.00 N ATOM 646 CA GLY A 46 -12.502 -15.796 -3.174 1.00 0.00 C ATOM 647 C GLY A 46 -12.645 -15.129 -4.527 1.00 0.00 C ATOM 648 O GLY A 46 -12.353 -15.734 -5.559 1.00 0.00 O ATOM 0 H GLY A 46 -10.741 -15.382 -2.118 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -12.060 -16.784 -3.304 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -13.491 -15.944 -2.739 1.00 0.00 H new ATOM 652 N VAL A 47 -13.096 -13.879 -4.526 1.00 0.00 N ATOM 653 CA VAL A 47 -13.276 -13.129 -5.763 1.00 0.00 C ATOM 654 C VAL A 47 -12.057 -12.265 -6.065 1.00 0.00 C ATOM 655 O VAL A 47 -11.292 -11.894 -5.175 1.00 0.00 O ATOM 656 CB VAL A 47 -14.525 -12.229 -5.695 1.00 0.00 C ATOM 657 CG1 VAL A 47 -15.780 -13.035 -5.995 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.624 -11.556 -4.335 1.00 0.00 C ATOM 0 H VAL A 47 -13.344 -13.364 -3.681 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.405 -13.860 -6.561 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.433 -11.451 -6.452 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.652 -12.383 -5.942 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -15.707 -13.464 -6.995 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -15.881 -13.836 -5.263 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.512 -10.924 -4.305 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.693 -12.316 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.738 -10.944 -4.166 1.00 0.00 H new ATOM 668 N PRO A 48 -11.870 -11.937 -7.352 1.00 0.00 N ATOM 669 CA PRO A 48 -10.745 -11.112 -7.803 1.00 0.00 C ATOM 670 C PRO A 48 -10.871 -9.662 -7.349 1.00 0.00 C ATOM 671 O PRO A 48 -11.895 -9.018 -7.575 1.00 0.00 O ATOM 672 CB PRO A 48 -10.826 -11.204 -9.328 1.00 0.00 C ATOM 673 CG PRO A 48 -12.258 -11.502 -9.614 1.00 0.00 C ATOM 674 CD PRO A 48 -12.742 -12.345 -8.466 1.00 0.00 C ATOM 0 HA PRO A 48 -9.796 -11.457 -7.392 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -10.514 -10.271 -9.798 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -10.174 -11.988 -9.713 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -12.839 -10.583 -9.696 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -12.365 -12.032 -10.560 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -13.792 -12.157 -8.244 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -12.648 -13.409 -8.681 1.00 0.00 H new ATOM 682 N ILE A 49 -9.823 -9.154 -6.709 1.00 0.00 N ATOM 683 CA ILE A 49 -9.817 -7.779 -6.224 1.00 0.00 C ATOM 684 C ILE A 49 -10.213 -6.806 -7.329 1.00 0.00 C ATOM 685 O ILE A 49 -10.090 -7.113 -8.515 1.00 0.00 O ATOM 686 CB ILE A 49 -8.434 -7.381 -5.677 1.00 0.00 C ATOM 687 CG1 ILE A 49 -8.052 -8.275 -4.496 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.429 -5.917 -5.263 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.558 -8.435 -4.317 1.00 0.00 C ATOM 0 H ILE A 49 -8.967 -9.674 -6.514 1.00 0.00 H new ATOM 0 HA ILE A 49 -10.547 -7.726 -5.416 1.00 0.00 H new ATOM 0 HB ILE A 49 -7.695 -7.518 -6.466 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.476 -7.858 -3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.500 -9.259 -4.636 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.444 -5.651 -4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.662 -5.294 -6.127 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.177 -5.756 -4.487 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.361 -9.081 -3.462 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.130 -8.881 -5.215 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.105 -7.458 -4.146 1.00 0.00 H new ATOM 701 N HIS A 50 -10.689 -5.629 -6.932 1.00 0.00 N ATOM 702 CA HIS A 50 -11.100 -4.609 -7.889 1.00 0.00 C ATOM 703 C HIS A 50 -10.244 -3.354 -7.749 1.00 0.00 C ATOM 704 O HIS A 50 -9.883 -2.722 -8.742 1.00 0.00 O ATOM 705 CB HIS A 50 -12.576 -4.259 -7.690 1.00 0.00 C ATOM 706 CG HIS A 50 -13.509 -5.133 -8.468 1.00 0.00 C ATOM 707 ND1 HIS A 50 -14.252 -4.678 -9.537 1.00 0.00 N ATOM 708 CD2 HIS A 50 -13.818 -6.444 -8.329 1.00 0.00 C ATOM 709 CE1 HIS A 50 -14.978 -5.670 -10.021 1.00 0.00 C ATOM 710 NE2 HIS A 50 -14.733 -6.752 -9.305 1.00 0.00 N ATOM 0 H HIS A 50 -10.799 -5.359 -5.955 1.00 0.00 H new ATOM 0 HA HIS A 50 -10.961 -5.011 -8.893 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -12.819 -4.335 -6.630 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -12.737 -3.221 -7.980 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -13.419 -7.121 -7.588 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -15.656 -5.607 -10.859 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -15.155 -7.669 -9.453 1.00 0.00 H new ATOM 719 N HIS A 51 -9.923 -2.999 -6.508 1.00 0.00 N ATOM 720 CA HIS A 51 -9.109 -1.819 -6.238 1.00 0.00 C ATOM 721 C HIS A 51 -8.405 -1.943 -4.890 1.00 0.00 C ATOM 722 O HIS A 51 -8.505 -2.970 -4.218 1.00 0.00 O ATOM 723 CB HIS A 51 -9.975 -0.559 -6.259 1.00 0.00 C ATOM 724 CG HIS A 51 -10.873 -0.429 -5.068 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.181 -0.867 -5.059 1.00 0.00 N ATOM 726 CD2 HIS A 51 -10.644 0.091 -3.840 1.00 0.00 C ATOM 727 CE1 HIS A 51 -12.718 -0.618 -3.878 1.00 0.00 C ATOM 728 NE2 HIS A 51 -11.807 -0.038 -3.119 1.00 0.00 N ATOM 0 H HIS A 51 -10.214 -3.511 -5.675 1.00 0.00 H new ATOM 0 HA HIS A 51 -8.353 -1.744 -7.019 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.327 0.316 -6.312 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -10.583 -0.561 -7.164 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -9.719 0.526 -3.491 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.731 -0.850 -3.583 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.944 0.265 -2.155 1.00 0.00 H new ATOM 737 N TYR A 52 -7.691 -0.892 -4.502 1.00 0.00 N ATOM 738 CA TYR A 52 -6.968 -0.884 -3.236 1.00 0.00 C ATOM 739 C TYR A 52 -7.323 0.349 -2.412 1.00 0.00 C ATOM 740 O TYR A 52 -7.449 1.451 -2.947 1.00 0.00 O ATOM 741 CB TYR A 52 -5.459 -0.925 -3.487 1.00 0.00 C ATOM 742 CG TYR A 52 -4.956 -2.279 -3.934 1.00 0.00 C ATOM 743 CD1 TYR A 52 -4.557 -3.235 -3.008 1.00 0.00 C ATOM 744 CD2 TYR A 52 -4.879 -2.602 -5.283 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.096 -4.473 -3.412 1.00 0.00 C ATOM 746 CE2 TYR A 52 -4.421 -3.840 -5.697 1.00 0.00 C ATOM 747 CZ TYR A 52 -4.032 -4.771 -4.757 1.00 0.00 C ATOM 748 OH TYR A 52 -3.573 -6.002 -5.165 1.00 0.00 O ATOM 0 H TYR A 52 -7.598 -0.034 -5.046 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.262 -1.771 -2.674 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.205 -0.184 -4.245 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.939 -0.637 -2.573 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.608 -3.006 -1.954 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -5.182 -1.874 -6.021 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.787 -5.203 -2.679 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.368 -4.076 -6.750 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.290 -6.664 -5.076 1.00 0.00 H new ATOM 758 N GLN A 53 -7.485 0.156 -1.107 1.00 0.00 N ATOM 759 CA GLN A 53 -7.827 1.251 -0.209 1.00 0.00 C ATOM 760 C GLN A 53 -6.596 1.738 0.548 1.00 0.00 C ATOM 761 O GLN A 53 -5.949 0.972 1.263 1.00 0.00 O ATOM 762 CB GLN A 53 -8.907 0.809 0.780 1.00 0.00 C ATOM 763 CG GLN A 53 -9.609 1.967 1.471 1.00 0.00 C ATOM 764 CD GLN A 53 -11.036 1.636 1.859 1.00 0.00 C ATOM 765 OE1 GLN A 53 -11.624 0.680 1.352 1.00 0.00 O ATOM 766 NE2 GLN A 53 -11.603 2.425 2.765 1.00 0.00 N ATOM 0 H GLN A 53 -7.385 -0.750 -0.648 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.211 2.075 -0.811 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.648 0.209 0.252 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.455 0.166 1.535 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -9.049 2.246 2.364 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.608 2.834 0.810 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -11.080 3.206 3.160 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -12.562 2.249 3.066 1.00 0.00 H new ATOM 775 N VAL A 54 -6.277 3.019 0.387 1.00 0.00 N ATOM 776 CA VAL A 54 -5.124 3.610 1.056 1.00 0.00 C ATOM 777 C VAL A 54 -5.550 4.719 2.010 1.00 0.00 C ATOM 778 O VAL A 54 -6.415 5.533 1.685 1.00 0.00 O ATOM 779 CB VAL A 54 -4.116 4.180 0.040 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.925 4.796 0.756 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.665 3.097 -0.929 1.00 0.00 C ATOM 0 H VAL A 54 -6.801 3.667 -0.201 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.645 2.812 1.623 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.610 4.965 -0.533 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.224 5.193 0.021 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.267 5.603 1.404 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.428 4.034 1.357 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.953 3.518 -1.639 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.189 2.288 -0.375 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.529 2.708 -1.468 1.00 0.00 H new ATOM 791 N ASP A 55 -4.938 4.746 3.188 1.00 0.00 N ATOM 792 CA ASP A 55 -5.253 5.758 4.191 1.00 0.00 C ATOM 793 C ASP A 55 -3.979 6.331 4.803 1.00 0.00 C ATOM 794 O ASP A 55 -3.185 5.606 5.403 1.00 0.00 O ATOM 795 CB ASP A 55 -6.136 5.161 5.287 1.00 0.00 C ATOM 796 CG ASP A 55 -7.062 6.190 5.909 1.00 0.00 C ATOM 797 OD1 ASP A 55 -6.894 7.392 5.615 1.00 0.00 O ATOM 798 OD2 ASP A 55 -7.952 5.791 6.688 1.00 0.00 O ATOM 0 H ASP A 55 -4.221 4.079 3.473 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.794 6.567 3.699 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -6.729 4.348 4.869 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.505 4.728 6.063 1.00 0.00 H new ATOM 803 N VAL A 56 -3.789 7.638 4.645 1.00 0.00 N ATOM 804 CA VAL A 56 -2.611 8.309 5.182 1.00 0.00 C ATOM 805 C VAL A 56 -3.006 9.457 6.104 1.00 0.00 C ATOM 806 O VAL A 56 -4.035 10.104 5.905 1.00 0.00 O ATOM 807 CB VAL A 56 -1.715 8.855 4.056 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.410 9.992 3.322 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.376 9.313 4.616 1.00 0.00 C ATOM 0 H VAL A 56 -4.435 8.252 4.150 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.054 7.565 5.751 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.531 8.052 3.342 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.760 10.364 2.530 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.341 9.629 2.887 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.627 10.798 4.022 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.245 9.696 3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.539 10.100 5.352 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.127 8.471 5.092 1.00 0.00 H new ATOM 819 N LYS A 57 -2.182 9.705 7.117 1.00 0.00 N ATOM 820 CA LYS A 57 -2.442 10.777 8.071 1.00 0.00 C ATOM 821 C LYS A 57 -1.232 11.013 8.968 1.00 0.00 C ATOM 822 O LYS A 57 -0.492 10.081 9.285 1.00 0.00 O ATOM 823 CB LYS A 57 -3.666 10.440 8.926 1.00 0.00 C ATOM 824 CG LYS A 57 -3.730 11.216 10.230 1.00 0.00 C ATOM 825 CD LYS A 57 -4.826 10.689 11.141 1.00 0.00 C ATOM 826 CE LYS A 57 -4.376 9.445 11.891 1.00 0.00 C ATOM 827 NZ LYS A 57 -3.351 9.761 12.925 1.00 0.00 N ATOM 0 H LYS A 57 -1.328 9.178 7.298 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.638 11.690 7.509 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.568 10.641 8.349 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.661 9.373 9.148 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.769 11.151 10.740 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -3.908 12.270 10.018 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.111 11.462 11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.712 10.458 10.550 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -5.238 8.975 12.365 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.968 8.722 11.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.145 8.907 13.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -2.480 10.091 12.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.711 10.506 13.555 1.00 0.00 H new ATOM 841 N GLU A 58 -1.037 12.264 9.374 1.00 0.00 N ATOM 842 CA GLU A 58 0.084 12.620 10.237 1.00 0.00 C ATOM 843 C GLU A 58 0.053 11.814 11.531 1.00 0.00 C ATOM 844 O GLU A 58 -1.016 11.500 12.055 1.00 0.00 O ATOM 845 CB GLU A 58 0.057 14.116 10.553 1.00 0.00 C ATOM 846 CG GLU A 58 0.839 14.963 9.563 1.00 0.00 C ATOM 847 CD GLU A 58 0.451 16.427 9.612 1.00 0.00 C ATOM 848 OE1 GLU A 58 0.992 17.156 10.470 1.00 0.00 O ATOM 849 OE2 GLU A 58 -0.396 16.845 8.795 1.00 0.00 O ATOM 0 H GLU A 58 -1.640 13.047 9.120 1.00 0.00 H new ATOM 0 HA GLU A 58 1.007 12.385 9.706 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.978 14.456 10.570 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.462 14.275 11.553 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.905 14.867 9.771 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.675 14.581 8.555 1.00 0.00 H new ATOM 856 N VAL A 59 1.234 11.481 12.043 1.00 0.00 N ATOM 857 CA VAL A 59 1.343 10.712 13.277 1.00 0.00 C ATOM 858 C VAL A 59 0.753 11.477 14.456 1.00 0.00 C ATOM 859 O VAL A 59 0.623 10.940 15.556 1.00 0.00 O ATOM 860 CB VAL A 59 2.810 10.359 13.591 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.680 11.606 13.544 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.914 9.677 14.946 1.00 0.00 C ATOM 0 H VAL A 59 2.129 11.732 11.622 1.00 0.00 H new ATOM 0 HA VAL A 59 0.779 9.791 13.126 1.00 0.00 H new ATOM 0 HB VAL A 59 3.170 9.665 12.832 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.712 11.338 13.768 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.628 12.049 12.549 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.324 12.326 14.281 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.956 9.434 15.152 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.537 10.346 15.720 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.323 8.761 14.939 1.00 0.00 H new ATOM 872 N ALA A 60 0.395 12.735 14.218 1.00 0.00 N ATOM 873 CA ALA A 60 -0.185 13.574 15.259 1.00 0.00 C ATOM 874 C ALA A 60 -1.656 13.861 14.978 1.00 0.00 C ATOM 875 O ALA A 60 -2.475 13.911 15.895 1.00 0.00 O ATOM 876 CB ALA A 60 0.594 14.875 15.384 1.00 0.00 C ATOM 0 H ALA A 60 0.497 13.195 13.313 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.122 13.033 16.203 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.149 15.492 16.165 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.630 14.655 15.641 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.561 15.411 14.436 1.00 0.00 H new ATOM 882 N SER A 61 -1.983 14.048 13.703 1.00 0.00 N ATOM 883 CA SER A 61 -3.356 14.335 13.301 1.00 0.00 C ATOM 884 C SER A 61 -4.290 13.200 13.710 1.00 0.00 C ATOM 885 O SER A 61 -3.843 12.154 14.179 1.00 0.00 O ATOM 886 CB SER A 61 -3.432 14.553 11.789 1.00 0.00 C ATOM 887 OG SER A 61 -4.778 14.643 11.354 1.00 0.00 O ATOM 0 H SER A 61 -1.317 14.006 12.931 1.00 0.00 H new ATOM 0 HA SER A 61 -3.674 15.245 13.809 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.899 15.465 11.523 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.934 13.731 11.274 1.00 0.00 H new ATOM 0 HG SER A 61 -4.800 14.784 10.384 1.00 0.00 H new ATOM 893 N GLU A 62 -5.589 13.417 13.529 1.00 0.00 N ATOM 894 CA GLU A 62 -6.586 12.413 13.880 1.00 0.00 C ATOM 895 C GLU A 62 -7.459 12.069 12.676 1.00 0.00 C ATOM 896 O GLU A 62 -8.107 11.022 12.645 1.00 0.00 O ATOM 897 CB GLU A 62 -7.461 12.911 15.032 1.00 0.00 C ATOM 898 CG GLU A 62 -6.800 12.791 16.395 1.00 0.00 C ATOM 899 CD GLU A 62 -6.527 11.351 16.786 1.00 0.00 C ATOM 900 OE1 GLU A 62 -7.500 10.581 16.927 1.00 0.00 O ATOM 901 OE2 GLU A 62 -5.343 10.996 16.952 1.00 0.00 O ATOM 0 H GLU A 62 -5.975 14.278 13.142 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.061 11.512 14.196 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.721 13.954 14.854 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.394 12.347 15.039 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.862 13.346 16.390 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.440 13.253 17.147 1.00 0.00 H new ATOM 908 N ILE A 63 -7.470 12.957 11.688 1.00 0.00 N ATOM 909 CA ILE A 63 -8.262 12.747 10.482 1.00 0.00 C ATOM 910 C ILE A 63 -7.515 11.874 9.479 1.00 0.00 C ATOM 911 O ILE A 63 -6.406 12.203 9.061 1.00 0.00 O ATOM 912 CB ILE A 63 -8.628 14.083 9.810 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.665 14.835 10.650 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.154 13.842 8.403 1.00 0.00 C ATOM 915 CD1 ILE A 63 -9.058 15.658 11.764 1.00 0.00 C ATOM 0 H ILE A 63 -6.940 13.828 11.699 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.177 12.241 10.789 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.729 14.696 9.741 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -10.242 15.491 9.998 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.363 14.116 11.079 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.408 14.796 7.941 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.388 13.344 7.809 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.043 13.213 8.450 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.850 16.163 12.317 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -8.504 15.005 12.438 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.381 16.400 11.341 1.00 0.00 H new ATOM 927 N TRP A 64 -8.133 10.763 9.097 1.00 0.00 N ATOM 928 CA TRP A 64 -7.527 9.844 8.140 1.00 0.00 C ATOM 929 C TRP A 64 -7.958 10.178 6.716 1.00 0.00 C ATOM 930 O TRP A 64 -9.150 10.275 6.423 1.00 0.00 O ATOM 931 CB TRP A 64 -7.910 8.401 8.476 1.00 0.00 C ATOM 932 CG TRP A 64 -7.070 7.802 9.563 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.342 7.797 10.900 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.819 7.122 9.403 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.336 7.155 11.583 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.391 6.731 10.688 1.00 0.00 C ATOM 937 CE3 TRP A 64 -5.022 6.804 8.301 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -4.201 6.040 10.895 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.840 6.118 8.510 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.439 5.741 9.799 1.00 0.00 C ATOM 0 H TRP A 64 -9.052 10.476 9.434 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.444 9.951 8.206 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.957 8.371 8.777 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.819 7.790 7.578 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.219 8.233 11.355 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.300 7.017 12.593 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -5.324 7.089 7.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -3.890 5.750 11.887 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.215 5.868 7.665 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.511 5.204 9.929 1.00 0.00 H new ATOM 951 N LYS A 65 -6.981 10.353 5.833 1.00 0.00 N ATOM 952 CA LYS A 65 -7.258 10.675 4.438 1.00 0.00 C ATOM 953 C LYS A 65 -7.235 9.418 3.575 1.00 0.00 C ATOM 954 O LYS A 65 -6.229 8.710 3.518 1.00 0.00 O ATOM 955 CB LYS A 65 -6.234 11.685 3.913 1.00 0.00 C ATOM 956 CG LYS A 65 -6.533 13.119 4.317 1.00 0.00 C ATOM 957 CD LYS A 65 -7.413 13.816 3.293 1.00 0.00 C ATOM 958 CE LYS A 65 -7.293 15.328 3.394 1.00 0.00 C ATOM 959 NZ LYS A 65 -8.323 16.021 2.570 1.00 0.00 N ATOM 0 H LYS A 65 -5.989 10.277 6.059 1.00 0.00 H new ATOM 0 HA LYS A 65 -8.254 11.114 4.383 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.245 11.411 4.280 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.199 11.622 2.825 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.027 13.129 5.289 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -5.598 13.669 4.429 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -7.132 13.494 2.290 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -8.452 13.521 3.443 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.396 15.632 4.436 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.299 15.636 3.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.209 17.050 2.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -8.209 15.751 1.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.271 15.746 2.897 1.00 0.00 H new ATOM 973 N ILE A 66 -8.351 9.146 2.904 1.00 0.00 N ATOM 974 CA ILE A 66 -8.457 7.977 2.041 1.00 0.00 C ATOM 975 C ILE A 66 -8.128 8.328 0.594 1.00 0.00 C ATOM 976 O ILE A 66 -8.633 9.312 0.053 1.00 0.00 O ATOM 977 CB ILE A 66 -9.866 7.359 2.101 1.00 0.00 C ATOM 978 CG1 ILE A 66 -10.177 6.879 3.521 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.984 6.210 1.111 1.00 0.00 C ATOM 980 CD1 ILE A 66 -9.344 5.692 3.953 1.00 0.00 C ATOM 0 H ILE A 66 -9.193 9.720 2.942 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.734 7.248 2.408 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.593 8.124 1.828 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.013 7.701 4.218 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.232 6.614 3.583 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.986 5.784 1.166 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.801 6.579 0.102 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.250 5.443 1.355 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.617 5.406 4.969 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.526 4.855 3.279 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -8.288 5.959 3.923 1.00 0.00 H new ATOM 992 N VAL A 67 -7.281 7.516 -0.029 1.00 0.00 N ATOM 993 CA VAL A 67 -6.888 7.740 -1.415 1.00 0.00 C ATOM 994 C VAL A 67 -7.058 6.472 -2.246 1.00 0.00 C ATOM 995 O VAL A 67 -6.262 5.538 -2.140 1.00 0.00 O ATOM 996 CB VAL A 67 -5.426 8.213 -1.514 1.00 0.00 C ATOM 997 CG1 VAL A 67 -4.990 8.301 -2.970 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.251 9.552 -0.816 1.00 0.00 C ATOM 0 H VAL A 67 -6.854 6.697 0.404 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.542 8.519 -1.808 1.00 0.00 H new ATOM 0 HB VAL A 67 -4.792 7.482 -1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.954 8.637 -3.020 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.076 7.319 -3.436 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.627 9.010 -3.498 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.212 9.871 -0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.896 10.295 -1.286 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.520 9.452 0.236 1.00 0.00 H new ATOM 1008 N ARG A 68 -8.097 6.447 -3.072 1.00 0.00 N ATOM 1009 CA ARG A 68 -8.373 5.294 -3.920 1.00 0.00 C ATOM 1010 C ARG A 68 -7.596 5.386 -5.231 1.00 0.00 C ATOM 1011 O ARG A 68 -7.244 6.477 -5.681 1.00 0.00 O ATOM 1012 CB ARG A 68 -9.871 5.193 -4.210 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.659 4.506 -3.107 1.00 0.00 C ATOM 1014 CD ARG A 68 -12.109 4.965 -3.089 1.00 0.00 C ATOM 1015 NE ARG A 68 -12.870 4.424 -4.211 1.00 0.00 N ATOM 1016 CZ ARG A 68 -14.082 4.846 -4.549 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -14.669 5.811 -3.856 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -14.711 4.302 -5.584 1.00 0.00 N ATOM 0 H ARG A 68 -8.763 7.213 -3.173 1.00 0.00 H new ATOM 0 HA ARG A 68 -8.052 4.398 -3.388 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -10.272 6.195 -4.361 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -10.016 4.648 -5.143 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.620 3.426 -3.249 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -10.197 4.718 -2.143 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -12.575 4.656 -2.153 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -12.145 6.054 -3.119 1.00 0.00 H new ATOM 0 HE ARG A 68 -12.447 3.680 -4.766 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.189 6.232 -3.060 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -15.601 6.133 -4.118 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.263 3.559 -6.120 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -15.643 4.627 -5.843 1.00 0.00 H new ATOM 1032 N SER A 69 -7.331 4.234 -5.837 1.00 0.00 N ATOM 1033 CA SER A 69 -6.592 4.183 -7.094 1.00 0.00 C ATOM 1034 C SER A 69 -7.543 4.223 -8.286 1.00 0.00 C ATOM 1035 O SER A 69 -8.761 4.287 -8.121 1.00 0.00 O ATOM 1036 CB SER A 69 -5.732 2.918 -7.154 1.00 0.00 C ATOM 1037 OG SER A 69 -6.493 1.768 -6.826 1.00 0.00 O ATOM 0 H SER A 69 -7.617 3.323 -5.479 1.00 0.00 H new ATOM 0 HA SER A 69 -5.943 5.057 -7.141 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.312 2.807 -8.154 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.893 3.012 -6.464 1.00 0.00 H new ATOM 0 HG SER A 69 -6.622 1.221 -7.629 1.00 0.00 H new ATOM 1043 N HIS A 70 -6.976 4.184 -9.488 1.00 0.00 N ATOM 1044 CA HIS A 70 -7.773 4.215 -10.709 1.00 0.00 C ATOM 1045 C HIS A 70 -7.743 2.862 -11.412 1.00 0.00 C ATOM 1046 O HIS A 70 -7.616 2.787 -12.634 1.00 0.00 O ATOM 1047 CB HIS A 70 -7.259 5.304 -11.652 1.00 0.00 C ATOM 1048 CG HIS A 70 -7.772 6.672 -11.322 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -9.116 6.978 -11.265 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -7.114 7.818 -11.032 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -9.262 8.254 -10.955 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -8.062 8.786 -10.807 1.00 0.00 N ATOM 0 H HIS A 70 -5.969 4.131 -9.642 1.00 0.00 H new ATOM 0 HA HIS A 70 -8.804 4.439 -10.434 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.170 5.316 -11.621 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -7.546 5.054 -12.673 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.043 7.948 -10.986 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -10.202 8.773 -10.842 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -7.870 9.758 -10.565 1.00 0.00 H new ATOM 1061 N GLY A 71 -7.860 1.791 -10.632 1.00 0.00 N ATOM 1062 CA GLY A 71 -7.842 0.455 -11.197 1.00 0.00 C ATOM 1063 C GLY A 71 -7.241 -0.566 -10.252 1.00 0.00 C ATOM 1064 O GLY A 71 -7.210 -0.359 -9.039 1.00 0.00 O ATOM 0 H GLY A 71 -7.967 1.826 -9.618 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.860 0.157 -11.450 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.273 0.465 -12.126 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.762 -1.675 -10.808 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.159 -2.733 -10.007 1.00 0.00 C ATOM 1070 C VAL A 72 -4.653 -2.532 -9.875 1.00 0.00 C ATOM 1071 O VAL A 72 -3.895 -3.497 -9.781 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.429 -4.122 -10.615 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -7.924 -4.395 -10.680 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -5.800 -4.228 -11.997 1.00 0.00 C ATOM 0 H VAL A 72 -6.780 -1.863 -11.810 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.618 -2.682 -9.020 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.974 -4.876 -9.973 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.095 -5.381 -11.112 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.344 -4.362 -9.675 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.405 -3.638 -11.300 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.000 -5.215 -12.413 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.226 -3.466 -12.650 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -4.723 -4.078 -11.919 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.228 -1.273 -9.869 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.812 -0.946 -9.750 1.00 0.00 C ATOM 1086 C GLN A 73 -2.387 -0.893 -8.285 1.00 0.00 C ATOM 1087 O GLN A 73 -3.159 -0.481 -7.419 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.516 0.393 -10.427 1.00 0.00 C ATOM 1089 CG GLN A 73 -2.871 1.598 -9.573 1.00 0.00 C ATOM 1090 CD GLN A 73 -3.082 2.855 -10.394 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -2.178 3.681 -10.529 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -4.278 3.006 -10.950 1.00 0.00 N ATOM 0 H GLN A 73 -4.843 -0.463 -9.945 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.242 -1.730 -10.248 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.457 0.437 -10.679 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.070 0.447 -11.364 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.777 1.383 -9.007 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.076 1.772 -8.848 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.998 2.297 -10.812 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -4.477 3.831 -11.515 1.00 0.00 H new ATOM 1101 N THR A 74 -1.154 -1.313 -8.016 1.00 0.00 N ATOM 1102 CA THR A 74 -0.629 -1.315 -6.656 1.00 0.00 C ATOM 1103 C THR A 74 0.355 -0.168 -6.446 1.00 0.00 C ATOM 1104 O THR A 74 1.136 -0.175 -5.496 1.00 0.00 O ATOM 1105 CB THR A 74 0.075 -2.645 -6.328 1.00 0.00 C ATOM 1106 OG1 THR A 74 1.215 -2.819 -7.176 1.00 0.00 O ATOM 1107 CG2 THR A 74 -0.878 -3.818 -6.504 1.00 0.00 C ATOM 0 H THR A 74 -0.501 -1.656 -8.721 1.00 0.00 H new ATOM 0 HA THR A 74 -1.481 -1.188 -5.988 1.00 0.00 H new ATOM 0 HB THR A 74 0.399 -2.612 -5.288 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.804 -3.505 -6.796 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.359 -4.747 -6.267 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.731 -3.698 -5.836 1.00 0.00 H new ATOM 0 HG23 THR A 74 -1.228 -3.851 -7.536 1.00 0.00 H new ATOM 1115 N MET A 75 0.308 0.815 -7.339 1.00 0.00 N ATOM 1116 CA MET A 75 1.195 1.970 -7.249 1.00 0.00 C ATOM 1117 C MET A 75 0.403 3.272 -7.340 1.00 0.00 C ATOM 1118 O MET A 75 -0.298 3.516 -8.322 1.00 0.00 O ATOM 1119 CB MET A 75 2.247 1.920 -8.358 1.00 0.00 C ATOM 1120 CG MET A 75 3.438 2.831 -8.108 1.00 0.00 C ATOM 1121 SD MET A 75 4.833 2.464 -9.189 1.00 0.00 S ATOM 1122 CE MET A 75 4.741 3.836 -10.337 1.00 0.00 C ATOM 0 H MET A 75 -0.333 0.835 -8.132 1.00 0.00 H new ATOM 0 HA MET A 75 1.696 1.937 -6.282 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.601 0.895 -8.466 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.780 2.197 -9.303 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.134 3.868 -8.253 1.00 0.00 H new ATOM 0 HG3 MET A 75 3.753 2.734 -7.069 1.00 0.00 H new ATOM 0 HE1 MET A 75 4.562 3.457 -11.343 1.00 0.00 H new ATOM 0 HE2 MET A 75 3.925 4.498 -10.048 1.00 0.00 H new ATOM 0 HE3 MET A 75 5.680 4.389 -10.319 1.00 0.00 H new ATOM 1132 N VAL A 76 0.520 4.104 -6.310 1.00 0.00 N ATOM 1133 CA VAL A 76 -0.185 5.380 -6.276 1.00 0.00 C ATOM 1134 C VAL A 76 0.660 6.455 -5.602 1.00 0.00 C ATOM 1135 O VAL A 76 1.401 6.178 -4.658 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.529 5.259 -5.533 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -2.390 6.489 -5.783 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -2.259 3.993 -5.955 1.00 0.00 C ATOM 0 H VAL A 76 1.096 3.918 -5.489 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.375 5.665 -7.311 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.329 5.196 -4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.335 6.386 -5.250 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.868 7.377 -5.427 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.584 6.586 -6.851 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.206 3.924 -5.420 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.449 4.023 -7.028 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.645 3.124 -5.720 1.00 0.00 H new ATOM 1148 N VAL A 77 0.544 7.685 -6.093 1.00 0.00 N ATOM 1149 CA VAL A 77 1.296 8.804 -5.538 1.00 0.00 C ATOM 1150 C VAL A 77 0.413 9.672 -4.648 1.00 0.00 C ATOM 1151 O VAL A 77 -0.715 10.008 -5.011 1.00 0.00 O ATOM 1152 CB VAL A 77 1.902 9.679 -6.651 1.00 0.00 C ATOM 1153 CG1 VAL A 77 0.829 10.541 -7.298 1.00 0.00 C ATOM 1154 CG2 VAL A 77 3.028 10.540 -6.097 1.00 0.00 C ATOM 0 H VAL A 77 -0.064 7.932 -6.874 1.00 0.00 H new ATOM 0 HA VAL A 77 2.102 8.379 -4.940 1.00 0.00 H new ATOM 0 HB VAL A 77 2.318 9.025 -7.417 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.277 11.152 -8.082 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.060 9.901 -7.731 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.380 11.189 -6.545 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.445 11.152 -6.897 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.638 11.187 -5.311 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.808 9.899 -5.686 1.00 0.00 H new ATOM 1164 N LEU A 78 0.934 10.033 -3.480 1.00 0.00 N ATOM 1165 CA LEU A 78 0.194 10.863 -2.537 1.00 0.00 C ATOM 1166 C LEU A 78 0.596 12.328 -2.667 1.00 0.00 C ATOM 1167 O LEU A 78 1.745 12.641 -2.977 1.00 0.00 O ATOM 1168 CB LEU A 78 0.434 10.382 -1.104 1.00 0.00 C ATOM 1169 CG LEU A 78 -0.125 9.001 -0.757 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.355 8.562 0.617 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.645 9.013 -0.816 1.00 0.00 C ATOM 0 H LEU A 78 1.866 9.764 -3.164 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.867 10.775 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.508 10.374 -0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.001 11.110 -0.420 1.00 0.00 H new ATOM 0 HG LEU A 78 0.241 8.285 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.052 7.578 0.847 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.444 8.515 0.624 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.018 9.278 1.366 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.027 8.023 -0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.031 9.741 -0.103 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.968 9.284 -1.821 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.357 13.223 -2.428 1.00 0.00 N ATOM 1184 CA ASN A 79 -0.099 14.656 -2.517 1.00 0.00 C ATOM 1185 C ASN A 79 -0.685 15.389 -1.315 1.00 0.00 C ATOM 1186 O ASN A 79 -1.272 14.775 -0.425 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.690 15.221 -3.811 1.00 0.00 C ATOM 1188 CG ASN A 79 -2.012 14.573 -4.174 1.00 0.00 C ATOM 1189 OD1 ASN A 79 -3.069 15.196 -4.073 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -1.958 13.317 -4.599 1.00 0.00 N ATOM 0 H ASN A 79 -1.314 12.982 -2.171 1.00 0.00 H new ATOM 0 HA ASN A 79 0.980 14.807 -2.521 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.833 16.296 -3.703 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.019 15.074 -4.626 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -2.815 12.829 -4.858 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.059 12.840 -4.667 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.521 16.709 -1.295 1.00 0.00 N ATOM 1198 CA ASN A 80 -1.033 17.526 -0.202 1.00 0.00 C ATOM 1199 C ASN A 80 -0.395 17.124 1.124 1.00 0.00 C ATOM 1200 O ASN A 80 -1.091 16.858 2.106 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.555 17.396 -0.109 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.258 17.947 -1.334 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -3.082 19.112 -1.692 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -4.061 17.112 -1.982 1.00 0.00 N ATOM 0 H ASN A 80 -0.038 17.234 -2.024 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.776 18.565 -0.408 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.820 16.346 0.017 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.908 17.923 0.777 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.562 17.428 -2.812 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -4.177 16.155 -1.649 1.00 0.00 H new ATOM 1211 N LEU A 81 0.932 17.080 1.146 1.00 0.00 N ATOM 1212 CA LEU A 81 1.665 16.711 2.352 1.00 0.00 C ATOM 1213 C LEU A 81 2.692 17.780 2.715 1.00 0.00 C ATOM 1214 O LEU A 81 3.314 18.378 1.838 1.00 0.00 O ATOM 1215 CB LEU A 81 2.363 15.364 2.156 1.00 0.00 C ATOM 1216 CG LEU A 81 1.614 14.337 1.306 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.543 13.207 0.890 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.414 13.791 2.066 1.00 0.00 C ATOM 0 H LEU A 81 1.523 17.295 0.343 1.00 0.00 H new ATOM 0 HA LEU A 81 0.950 16.628 3.170 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.336 15.545 1.698 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.549 14.928 3.137 1.00 0.00 H new ATOM 0 HG LEU A 81 1.254 14.833 0.405 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.992 12.486 0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.370 13.612 0.307 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.934 12.712 1.779 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.108 13.061 1.447 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.752 13.311 2.984 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.264 14.609 2.312 1.00 0.00 H new ATOM 1230 N GLU A 82 2.864 18.012 4.012 1.00 0.00 N ATOM 1231 CA GLU A 82 3.815 19.008 4.490 1.00 0.00 C ATOM 1232 C GLU A 82 5.227 18.430 4.542 1.00 0.00 C ATOM 1233 O GLU A 82 5.436 17.266 4.883 1.00 0.00 O ATOM 1234 CB GLU A 82 3.407 19.512 5.875 1.00 0.00 C ATOM 1235 CG GLU A 82 2.015 20.119 5.917 1.00 0.00 C ATOM 1236 CD GLU A 82 1.817 21.044 7.102 1.00 0.00 C ATOM 1237 OE1 GLU A 82 2.317 22.186 7.055 1.00 0.00 O ATOM 1238 OE2 GLU A 82 1.160 20.623 8.078 1.00 0.00 O ATOM 0 H GLU A 82 2.357 17.524 4.750 1.00 0.00 H new ATOM 0 HA GLU A 82 3.808 19.844 3.791 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.454 18.684 6.582 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.129 20.257 6.208 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.836 20.672 4.995 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.275 19.320 5.957 1.00 0.00 H new ATOM 1245 N PRO A 83 6.219 19.263 4.193 1.00 0.00 N ATOM 1246 CA PRO A 83 7.628 18.859 4.192 1.00 0.00 C ATOM 1247 C PRO A 83 8.171 18.643 5.601 1.00 0.00 C ATOM 1248 O PRO A 83 7.611 19.144 6.574 1.00 0.00 O ATOM 1249 CB PRO A 83 8.336 20.038 3.520 1.00 0.00 C ATOM 1250 CG PRO A 83 7.445 21.206 3.771 1.00 0.00 C ATOM 1251 CD PRO A 83 6.043 20.664 3.775 1.00 0.00 C ATOM 0 HA PRO A 83 7.778 17.908 3.681 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.328 20.198 3.943 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.469 19.864 2.452 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.683 21.681 4.723 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.568 21.964 2.998 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.403 21.212 4.466 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.582 20.734 2.790 1.00 0.00 H new ATOM 1259 N ASN A 84 9.264 17.895 5.701 1.00 0.00 N ATOM 1260 CA ASN A 84 9.883 17.614 6.990 1.00 0.00 C ATOM 1261 C ASN A 84 8.844 17.128 7.998 1.00 0.00 C ATOM 1262 O ASN A 84 8.897 17.478 9.178 1.00 0.00 O ATOM 1263 CB ASN A 84 10.585 18.863 7.527 1.00 0.00 C ATOM 1264 CG ASN A 84 11.427 19.551 6.470 1.00 0.00 C ATOM 1265 OD1 ASN A 84 10.910 20.018 5.455 1.00 0.00 O ATOM 1266 ND2 ASN A 84 12.733 19.616 6.704 1.00 0.00 N ATOM 0 H ASN A 84 9.740 17.472 4.904 1.00 0.00 H new ATOM 0 HA ASN A 84 10.621 16.825 6.845 1.00 0.00 H new ATOM 0 HB2 ASN A 84 9.839 19.562 7.905 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.219 18.587 8.370 1.00 0.00 H new ATOM 0 HD21 ASN A 84 13.350 20.067 6.029 1.00 0.00 H new ATOM 0 HD22 ASN A 84 13.118 19.215 7.559 1.00 0.00 H new ATOM 1273 N THR A 85 7.902 16.320 7.524 1.00 0.00 N ATOM 1274 CA THR A 85 6.850 15.788 8.381 1.00 0.00 C ATOM 1275 C THR A 85 6.687 14.285 8.183 1.00 0.00 C ATOM 1276 O THR A 85 7.052 13.743 7.139 1.00 0.00 O ATOM 1277 CB THR A 85 5.501 16.479 8.111 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.547 17.838 8.561 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.367 15.746 8.813 1.00 0.00 C ATOM 0 H THR A 85 7.846 16.019 6.551 1.00 0.00 H new ATOM 0 HA THR A 85 7.151 15.986 9.410 1.00 0.00 H new ATOM 0 HB THR A 85 5.317 16.458 7.037 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.172 18.346 8.003 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.424 16.253 8.608 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.315 14.721 8.447 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.549 15.739 9.888 1.00 0.00 H new ATOM 1287 N THR A 86 6.134 13.615 9.189 1.00 0.00 N ATOM 1288 CA THR A 86 5.923 12.175 9.125 1.00 0.00 C ATOM 1289 C THR A 86 4.442 11.843 8.986 1.00 0.00 C ATOM 1290 O THR A 86 3.587 12.513 9.567 1.00 0.00 O ATOM 1291 CB THR A 86 6.481 11.470 10.375 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.856 11.823 10.565 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.353 9.959 10.246 1.00 0.00 C ATOM 0 H THR A 86 5.824 14.048 10.059 1.00 0.00 H new ATOM 0 HA THR A 86 6.457 11.815 8.246 1.00 0.00 H new ATOM 0 HB THR A 86 5.901 11.796 11.238 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.202 11.372 11.363 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.754 9.482 11.141 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.303 9.691 10.132 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.911 9.620 9.373 1.00 0.00 H new ATOM 1301 N TYR A 87 4.144 10.804 8.213 1.00 0.00 N ATOM 1302 CA TYR A 87 2.766 10.383 7.996 1.00 0.00 C ATOM 1303 C TYR A 87 2.654 8.862 7.993 1.00 0.00 C ATOM 1304 O TYR A 87 3.546 8.165 7.511 1.00 0.00 O ATOM 1305 CB TYR A 87 2.240 10.946 6.675 1.00 0.00 C ATOM 1306 CG TYR A 87 2.475 12.432 6.514 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.752 12.933 6.296 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.420 13.333 6.578 1.00 0.00 C ATOM 1309 CE1 TYR A 87 3.972 14.289 6.150 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.630 14.691 6.430 1.00 0.00 C ATOM 1311 CZ TYR A 87 2.908 15.164 6.217 1.00 0.00 C ATOM 1312 OH TYR A 87 3.123 16.515 6.069 1.00 0.00 O ATOM 0 H TYR A 87 4.839 10.238 7.726 1.00 0.00 H new ATOM 0 HA TYR A 87 2.162 10.772 8.816 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.718 10.419 5.849 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.171 10.746 6.604 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.587 12.251 6.240 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.418 12.966 6.746 1.00 0.00 H new ATOM 0 HE1 TYR A 87 4.972 14.662 5.984 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.798 15.378 6.481 1.00 0.00 H new ATOM 0 HH TYR A 87 3.956 16.661 5.574 1.00 0.00 H new ATOM 1322 N GLU A 88 1.551 8.354 8.535 1.00 0.00 N ATOM 1323 CA GLU A 88 1.322 6.915 8.594 1.00 0.00 C ATOM 1324 C GLU A 88 0.361 6.471 7.495 1.00 0.00 C ATOM 1325 O GLU A 88 -0.775 6.939 7.424 1.00 0.00 O ATOM 1326 CB GLU A 88 0.765 6.522 9.964 1.00 0.00 C ATOM 1327 CG GLU A 88 1.548 7.103 11.130 1.00 0.00 C ATOM 1328 CD GLU A 88 0.993 6.676 12.475 1.00 0.00 C ATOM 1329 OE1 GLU A 88 0.004 5.914 12.496 1.00 0.00 O ATOM 1330 OE2 GLU A 88 1.549 7.106 13.508 1.00 0.00 O ATOM 0 H GLU A 88 0.803 8.917 8.939 1.00 0.00 H new ATOM 0 HA GLU A 88 2.278 6.414 8.440 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.272 6.852 10.033 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.760 5.435 10.046 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.590 6.791 11.055 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.536 8.191 11.065 1.00 0.00 H new ATOM 1337 N ILE A 89 0.825 5.565 6.642 1.00 0.00 N ATOM 1338 CA ILE A 89 0.008 5.056 5.548 1.00 0.00 C ATOM 1339 C ILE A 89 -0.232 3.558 5.691 1.00 0.00 C ATOM 1340 O ILE A 89 0.571 2.845 6.293 1.00 0.00 O ATOM 1341 CB ILE A 89 0.663 5.333 4.181 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.181 4.315 3.146 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.179 5.295 4.303 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.706 4.576 1.751 1.00 0.00 C ATOM 0 H ILE A 89 1.763 5.168 6.687 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.947 5.579 5.597 1.00 0.00 H new ATOM 0 HB ILE A 89 0.370 6.329 3.848 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.487 3.317 3.460 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.909 4.321 3.122 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.627 5.492 3.329 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.506 6.054 5.014 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.491 4.311 4.653 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.324 3.816 1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.378 5.560 1.417 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.795 4.541 1.760 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.341 3.086 5.131 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.687 1.670 5.196 1.00 0.00 C ATOM 1358 C ARG A 90 -2.328 1.208 3.892 1.00 0.00 C ATOM 1359 O ARG A 90 -3.166 1.905 3.318 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.638 1.409 6.366 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.809 2.377 6.427 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.577 2.239 7.732 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.938 2.760 7.623 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.772 2.856 8.652 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -6.387 2.469 9.860 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.994 3.340 8.474 1.00 0.00 N ATOM 0 H ARG A 90 -2.015 3.662 4.627 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.769 1.103 5.350 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -3.022 0.392 6.291 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.078 1.470 7.299 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.444 3.399 6.325 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.479 2.193 5.588 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.613 1.189 8.023 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.047 2.771 8.523 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.265 3.067 6.707 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.448 2.096 10.001 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.030 2.544 10.648 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.294 3.639 7.546 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.634 3.413 9.265 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.929 0.027 3.427 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.465 -0.528 2.191 1.00 0.00 C ATOM 1382 C VAL A 91 -3.398 -1.700 2.475 1.00 0.00 C ATOM 1383 O VAL A 91 -3.063 -2.602 3.243 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.338 -0.999 1.253 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -1.900 -1.374 -0.110 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.270 0.076 1.122 1.00 0.00 C ATOM 0 H VAL A 91 -1.236 -0.563 3.889 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.025 0.269 1.702 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.876 -1.886 1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.089 -1.704 -0.759 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.625 -2.180 0.005 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.389 -0.507 -0.553 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.519 -0.274 0.456 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.715 0.983 0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.153 0.290 2.103 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.570 -1.682 1.848 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.551 -2.744 2.031 1.00 0.00 C ATOM 1398 C ALA A 92 -6.164 -3.160 0.699 1.00 0.00 C ATOM 1399 O ALA A 92 -6.205 -2.376 -0.248 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.637 -2.299 2.999 1.00 0.00 C ATOM 0 H ALA A 92 -4.863 -0.943 1.209 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.039 -3.610 2.451 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.363 -3.102 3.126 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.189 -2.059 3.963 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.139 -1.416 2.602 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.641 -4.399 0.633 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.253 -4.919 -0.583 1.00 0.00 C ATOM 1408 C ALA A 93 -8.774 -4.919 -0.475 1.00 0.00 C ATOM 1409 O ALA A 93 -9.339 -5.451 0.482 1.00 0.00 O ATOM 1410 CB ALA A 93 -6.743 -6.323 -0.873 1.00 0.00 C ATOM 0 H ALA A 93 -6.615 -5.061 1.408 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.973 -4.265 -1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.209 -6.698 -1.784 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.661 -6.298 -1.003 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.993 -6.980 -0.040 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.434 -4.319 -1.461 1.00 0.00 N ATOM 1417 CA VAL A 94 -10.890 -4.250 -1.476 1.00 0.00 C ATOM 1418 C VAL A 94 -11.463 -5.005 -2.671 1.00 0.00 C ATOM 1419 O VAL A 94 -11.252 -4.620 -3.819 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.383 -2.792 -1.519 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -12.862 -2.737 -1.868 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -11.114 -2.100 -0.192 1.00 0.00 C ATOM 0 H VAL A 94 -8.983 -3.874 -2.260 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.239 -4.716 -0.554 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.832 -2.264 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.191 -1.698 -1.893 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.022 -3.193 -2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.434 -3.281 -1.116 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.469 -1.070 -0.240 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.637 -2.627 0.606 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.043 -2.106 0.011 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.189 -6.081 -2.390 1.00 0.00 N ATOM 1433 CA ASN A 95 -12.794 -6.891 -3.443 1.00 0.00 C ATOM 1434 C ASN A 95 -14.317 -6.812 -3.382 1.00 0.00 C ATOM 1435 O ASN A 95 -14.885 -6.307 -2.415 1.00 0.00 O ATOM 1436 CB ASN A 95 -12.342 -8.347 -3.318 1.00 0.00 C ATOM 1437 CG ASN A 95 -13.098 -9.096 -2.237 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -13.927 -8.522 -1.533 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.812 -10.386 -2.102 1.00 0.00 N ATOM 0 H ASN A 95 -12.373 -6.413 -1.443 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.466 -6.497 -4.405 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -12.484 -8.852 -4.273 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.275 -8.376 -3.098 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.288 -10.942 -1.392 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.117 -10.820 -2.709 1.00 0.00 H new ATOM 1446 N GLY A 96 -14.971 -7.317 -4.424 1.00 0.00 N ATOM 1447 CA GLY A 96 -16.422 -7.295 -4.469 1.00 0.00 C ATOM 1448 C GLY A 96 -17.050 -7.731 -3.160 1.00 0.00 C ATOM 1449 O GLY A 96 -18.208 -7.416 -2.884 1.00 0.00 O ATOM 0 H GLY A 96 -14.523 -7.740 -5.237 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -16.760 -6.288 -4.712 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -16.767 -7.949 -5.270 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.286 -8.459 -2.353 1.00 0.00 N ATOM 1454 CA LYS A 97 -16.774 -8.940 -1.066 1.00 0.00 C ATOM 1455 C LYS A 97 -16.734 -7.831 -0.020 1.00 0.00 C ATOM 1456 O LYS A 97 -17.702 -7.619 0.711 1.00 0.00 O ATOM 1457 CB LYS A 97 -15.937 -10.131 -0.593 1.00 0.00 C ATOM 1458 CG LYS A 97 -16.708 -11.110 0.275 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.950 -11.624 -0.432 1.00 0.00 C ATOM 1460 CE LYS A 97 -17.691 -11.857 -1.913 1.00 0.00 C ATOM 1461 NZ LYS A 97 -18.692 -12.783 -2.511 1.00 0.00 N ATOM 0 H LYS A 97 -15.326 -8.729 -2.568 1.00 0.00 H new ATOM 0 HA LYS A 97 -17.809 -9.258 -1.194 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -15.547 -10.659 -1.463 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -15.078 -9.761 -0.034 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -16.064 -11.949 0.538 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -16.994 -10.624 1.207 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -18.276 -12.555 0.033 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -18.762 -10.907 -0.312 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -17.717 -10.904 -2.441 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -16.690 -12.268 -2.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -18.202 -13.511 -3.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -19.240 -13.238 -1.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -19.334 -12.248 -3.129 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.610 -7.123 0.045 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.468 -6.043 1.003 1.00 0.00 C ATOM 1477 C GLY A 98 -14.020 -5.650 1.222 1.00 0.00 C ATOM 1478 O GLY A 98 -13.137 -6.075 0.479 1.00 0.00 O ATOM 0 H GLY A 98 -14.796 -7.279 -0.549 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -16.028 -5.176 0.654 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.907 -6.345 1.954 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.778 -4.835 2.244 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.427 -4.383 2.557 1.00 0.00 C ATOM 1484 C GLN A 99 -11.750 -5.331 3.542 1.00 0.00 C ATOM 1485 O GLN A 99 -12.175 -5.456 4.690 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.462 -2.968 3.135 1.00 0.00 C ATOM 1487 CG GLN A 99 -11.082 -2.380 3.388 1.00 0.00 C ATOM 1488 CD GLN A 99 -11.140 -1.036 4.085 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -12.219 -0.503 4.342 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -9.975 -0.479 4.396 1.00 0.00 N ATOM 0 H GLN A 99 -14.499 -4.474 2.869 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.850 -4.376 1.633 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -13.005 -2.318 2.449 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -13.020 -2.981 4.071 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.501 -3.075 3.994 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.558 -2.270 2.438 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -9.104 -0.956 4.164 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.952 0.426 4.867 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.696 -5.998 3.084 1.00 0.00 N ATOM 1500 CA GLY A 100 -9.977 -6.927 3.939 1.00 0.00 C ATOM 1501 C GLY A 100 -9.316 -6.238 5.116 1.00 0.00 C ATOM 1502 O GLY A 100 -9.870 -5.298 5.685 1.00 0.00 O ATOM 0 H GLY A 100 -10.326 -5.913 2.137 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.667 -7.686 4.307 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.218 -7.444 3.352 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.129 -6.709 5.484 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.392 -6.132 6.603 1.00 0.00 C ATOM 1508 C ASP A 101 -6.247 -5.257 6.105 1.00 0.00 C ATOM 1509 O ASP A 101 -5.616 -5.558 5.091 1.00 0.00 O ATOM 1510 CB ASP A 101 -6.848 -7.240 7.507 1.00 0.00 C ATOM 1511 CG ASP A 101 -7.889 -7.754 8.483 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -8.202 -7.032 9.451 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -8.389 -8.881 8.278 1.00 0.00 O ATOM 0 H ASP A 101 -7.657 -7.488 5.024 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.078 -5.509 7.177 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.493 -8.066 6.891 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.989 -6.863 8.062 1.00 0.00 H new ATOM 1518 N TYR A 102 -5.984 -4.172 6.825 1.00 0.00 N ATOM 1519 CA TYR A 102 -4.917 -3.249 6.454 1.00 0.00 C ATOM 1520 C TYR A 102 -3.547 -3.861 6.731 1.00 0.00 C ATOM 1521 O TYR A 102 -3.367 -4.593 7.705 1.00 0.00 O ATOM 1522 CB TYR A 102 -5.063 -1.933 7.219 1.00 0.00 C ATOM 1523 CG TYR A 102 -5.932 -0.916 6.512 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -5.471 -0.237 5.392 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.216 -0.636 6.965 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -6.260 0.693 4.744 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.013 0.291 6.324 1.00 0.00 C ATOM 1528 CZ TYR A 102 -7.531 0.953 5.214 1.00 0.00 C ATOM 1529 OH TYR A 102 -8.321 1.878 4.570 1.00 0.00 O ATOM 0 H TYR A 102 -6.494 -3.910 7.668 1.00 0.00 H new ATOM 0 HA TYR A 102 -4.998 -3.051 5.385 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.485 -2.139 8.202 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.074 -1.504 7.380 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -4.477 -0.440 5.021 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.597 -1.153 7.834 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -5.885 1.213 3.875 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.008 0.497 6.689 1.00 0.00 H new ATOM 0 HH TYR A 102 -7.754 2.565 4.162 1.00 0.00 H new ATOM 1539 N SER A 103 -2.584 -3.557 5.867 1.00 0.00 N ATOM 1540 CA SER A 103 -1.230 -4.079 6.016 1.00 0.00 C ATOM 1541 C SER A 103 -0.494 -3.365 7.146 1.00 0.00 C ATOM 1542 O SER A 103 -0.893 -2.283 7.576 1.00 0.00 O ATOM 1543 CB SER A 103 -0.455 -3.923 4.707 1.00 0.00 C ATOM 1544 OG SER A 103 -0.411 -2.566 4.299 1.00 0.00 O ATOM 0 H SER A 103 -2.716 -2.952 5.056 1.00 0.00 H new ATOM 0 HA SER A 103 -1.300 -5.138 6.264 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.559 -4.301 4.834 1.00 0.00 H new ATOM 0 HB3 SER A 103 -0.924 -4.525 3.929 1.00 0.00 H new ATOM 0 HG SER A 103 -1.200 -2.363 3.754 1.00 0.00 H new ATOM 1550 N LYS A 104 0.585 -3.979 7.621 1.00 0.00 N ATOM 1551 CA LYS A 104 1.380 -3.403 8.699 1.00 0.00 C ATOM 1552 C LYS A 104 1.546 -1.899 8.510 1.00 0.00 C ATOM 1553 O LYS A 104 2.249 -1.452 7.602 1.00 0.00 O ATOM 1554 CB LYS A 104 2.754 -4.075 8.761 1.00 0.00 C ATOM 1555 CG LYS A 104 3.375 -4.059 10.147 1.00 0.00 C ATOM 1556 CD LYS A 104 4.664 -4.863 10.189 1.00 0.00 C ATOM 1557 CE LYS A 104 5.593 -4.371 11.289 1.00 0.00 C ATOM 1558 NZ LYS A 104 6.492 -3.284 10.811 1.00 0.00 N ATOM 0 H LYS A 104 0.929 -4.875 7.276 1.00 0.00 H new ATOM 0 HA LYS A 104 0.854 -3.577 9.638 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.660 -5.108 8.426 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.426 -3.574 8.065 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.577 -3.030 10.445 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.667 -4.466 10.869 1.00 0.00 H new ATOM 0 HD2 LYS A 104 4.432 -5.916 10.351 1.00 0.00 H new ATOM 0 HD3 LYS A 104 5.170 -4.792 9.226 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.001 -4.009 12.130 1.00 0.00 H new ATOM 0 HE3 LYS A 104 6.193 -5.203 11.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.109 -2.976 11.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.075 -3.636 10.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 5.920 -2.479 10.484 1.00 0.00 H new ATOM 1572 N ILE A 105 0.897 -1.123 9.371 1.00 0.00 N ATOM 1573 CA ILE A 105 0.975 0.331 9.300 1.00 0.00 C ATOM 1574 C ILE A 105 2.370 0.786 8.883 1.00 0.00 C ATOM 1575 O ILE A 105 3.365 0.415 9.504 1.00 0.00 O ATOM 1576 CB ILE A 105 0.617 0.981 10.649 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.837 0.676 11.016 1.00 0.00 C ATOM 1578 CG2 ILE A 105 0.852 2.483 10.591 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.843 1.342 10.104 1.00 0.00 C ATOM 0 H ILE A 105 0.311 -1.477 10.127 1.00 0.00 H new ATOM 0 HA ILE A 105 0.251 0.650 8.550 1.00 0.00 H new ATOM 0 HB ILE A 105 1.262 0.562 11.421 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.992 -0.403 10.988 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -1.020 0.998 12.041 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.595 2.929 11.552 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.901 2.679 10.370 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.229 2.919 9.810 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.852 1.082 10.423 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.716 2.424 10.150 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.687 1.002 9.080 1.00 0.00 H new ATOM 1591 N GLU A 106 2.433 1.592 7.828 1.00 0.00 N ATOM 1592 CA GLU A 106 3.705 2.098 7.330 1.00 0.00 C ATOM 1593 C GLU A 106 3.907 3.556 7.734 1.00 0.00 C ATOM 1594 O GLU A 106 2.965 4.348 7.728 1.00 0.00 O ATOM 1595 CB GLU A 106 3.771 1.967 5.807 1.00 0.00 C ATOM 1596 CG GLU A 106 3.925 0.533 5.325 1.00 0.00 C ATOM 1597 CD GLU A 106 5.284 -0.052 5.661 1.00 0.00 C ATOM 1598 OE1 GLU A 106 6.256 0.258 4.941 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.375 -0.818 6.643 1.00 0.00 O ATOM 0 H GLU A 106 1.618 1.908 7.302 1.00 0.00 H new ATOM 0 HA GLU A 106 4.502 1.502 7.774 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.865 2.391 5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.608 2.558 5.436 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.147 -0.083 5.775 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.775 0.498 4.246 1.00 0.00 H new ATOM 1606 N ILE A 107 5.142 3.902 8.084 1.00 0.00 N ATOM 1607 CA ILE A 107 5.467 5.264 8.489 1.00 0.00 C ATOM 1608 C ILE A 107 6.568 5.850 7.614 1.00 0.00 C ATOM 1609 O ILE A 107 7.710 5.389 7.641 1.00 0.00 O ATOM 1610 CB ILE A 107 5.913 5.320 9.963 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.874 4.642 10.859 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.133 6.762 10.395 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.345 4.441 12.283 1.00 0.00 C ATOM 0 H ILE A 107 5.933 3.258 8.095 1.00 0.00 H new ATOM 0 HA ILE A 107 4.559 5.855 8.369 1.00 0.00 H new ATOM 0 HB ILE A 107 6.857 4.783 10.063 1.00 0.00 H new ATOM 0 HG12 ILE A 107 3.965 5.243 10.867 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.613 3.674 10.431 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.448 6.785 11.438 1.00 0.00 H new ATOM 0 HG22 ILE A 107 6.905 7.214 9.773 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.204 7.321 10.284 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.559 3.956 12.861 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.237 3.815 12.286 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.579 5.408 12.729 1.00 0.00 H new ATOM 1625 N PHE A 108 6.219 6.870 6.837 1.00 0.00 N ATOM 1626 CA PHE A 108 7.178 7.522 5.953 1.00 0.00 C ATOM 1627 C PHE A 108 7.227 9.025 6.215 1.00 0.00 C ATOM 1628 O PHE A 108 6.199 9.654 6.460 1.00 0.00 O ATOM 1629 CB PHE A 108 6.815 7.259 4.490 1.00 0.00 C ATOM 1630 CG PHE A 108 5.602 8.015 4.029 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.666 9.380 3.799 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.397 7.361 3.825 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.551 10.079 3.374 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.280 8.054 3.399 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.357 9.415 3.175 1.00 0.00 C ATOM 0 H PHE A 108 5.278 7.263 6.802 1.00 0.00 H new ATOM 0 HA PHE A 108 8.164 7.104 6.157 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.662 7.528 3.860 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.642 6.192 4.353 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.598 9.904 3.953 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.330 6.298 4.001 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.614 11.143 3.198 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.348 7.532 3.241 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.484 9.959 2.845 1.00 0.00 H new ATOM 1645 N GLN A 109 8.428 9.590 6.162 1.00 0.00 N ATOM 1646 CA GLN A 109 8.611 11.018 6.395 1.00 0.00 C ATOM 1647 C GLN A 109 9.023 11.730 5.111 1.00 0.00 C ATOM 1648 O GLN A 109 10.022 11.376 4.484 1.00 0.00 O ATOM 1649 CB GLN A 109 9.664 11.248 7.480 1.00 0.00 C ATOM 1650 CG GLN A 109 10.016 12.713 7.685 1.00 0.00 C ATOM 1651 CD GLN A 109 11.363 12.900 8.354 1.00 0.00 C ATOM 1652 OE1 GLN A 109 11.878 11.991 9.006 1.00 0.00 O ATOM 1653 NE2 GLN A 109 11.942 14.085 8.197 1.00 0.00 N ATOM 0 H GLN A 109 9.289 9.082 5.960 1.00 0.00 H new ATOM 0 HA GLN A 109 7.659 11.431 6.729 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.300 10.835 8.421 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.569 10.699 7.219 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.020 13.220 6.720 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.244 13.187 8.291 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.480 14.810 7.648 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.849 14.270 8.625 1.00 0.00 H new ATOM 1662 N THR A 110 8.247 12.737 4.723 1.00 0.00 N ATOM 1663 CA THR A 110 8.530 13.498 3.513 1.00 0.00 C ATOM 1664 C THR A 110 9.937 14.084 3.550 1.00 0.00 C ATOM 1665 O THR A 110 10.500 14.308 4.622 1.00 0.00 O ATOM 1666 CB THR A 110 7.515 14.641 3.318 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.522 15.504 4.461 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.114 14.089 3.102 1.00 0.00 C ATOM 0 H THR A 110 7.417 13.045 5.230 1.00 0.00 H new ATOM 0 HA THR A 110 8.450 12.804 2.676 1.00 0.00 H new ATOM 0 HB THR A 110 7.806 15.208 2.434 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.715 16.060 4.456 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.415 14.914 2.967 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.105 13.456 2.214 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.817 13.500 3.970 1.00 0.00 H new ATOM 1676 N LEU A 111 10.499 14.332 2.372 1.00 0.00 N ATOM 1677 CA LEU A 111 11.842 14.893 2.268 1.00 0.00 C ATOM 1678 C LEU A 111 11.900 16.284 2.893 1.00 0.00 C ATOM 1679 O LEU A 111 10.992 17.100 2.736 1.00 0.00 O ATOM 1680 CB LEU A 111 12.276 14.961 0.803 1.00 0.00 C ATOM 1681 CG LEU A 111 12.539 13.620 0.118 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.062 13.835 -1.294 1.00 0.00 C ATOM 1683 CD2 LEU A 111 13.523 12.790 0.932 1.00 0.00 C ATOM 0 H LEU A 111 10.046 14.154 1.476 1.00 0.00 H new ATOM 0 HA LEU A 111 12.525 14.241 2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.505 15.488 0.241 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.183 15.562 0.741 1.00 0.00 H new ATOM 0 HG LEU A 111 11.597 13.075 0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.243 12.869 -1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.325 14.390 -1.875 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.993 14.400 -1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 111 13.699 11.839 0.430 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.465 13.331 1.025 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.110 12.606 1.924 1.00 0.00 H new ATOM 1695 N PRO A 112 12.995 16.562 3.616 1.00 0.00 N ATOM 1696 CA PRO A 112 13.199 17.855 4.276 1.00 0.00 C ATOM 1697 C PRO A 112 13.451 18.982 3.280 1.00 0.00 C ATOM 1698 O PRO A 112 14.421 18.948 2.522 1.00 0.00 O ATOM 1699 CB PRO A 112 14.439 17.619 5.142 1.00 0.00 C ATOM 1700 CG PRO A 112 15.171 16.514 4.463 1.00 0.00 C ATOM 1701 CD PRO A 112 14.117 15.637 3.845 1.00 0.00 C ATOM 0 HA PRO A 112 12.321 18.167 4.841 1.00 0.00 H new ATOM 0 HB2 PRO A 112 15.052 18.518 5.209 1.00 0.00 H new ATOM 0 HB3 PRO A 112 14.164 17.345 6.160 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.849 16.904 3.704 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.778 15.953 5.174 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.463 15.187 2.914 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.835 14.819 4.508 1.00 0.00 H new ATOM 1709 N VAL A 113 12.574 19.979 3.287 1.00 0.00 N ATOM 1710 CA VAL A 113 12.703 21.117 2.385 1.00 0.00 C ATOM 1711 C VAL A 113 14.150 21.590 2.300 1.00 0.00 C ATOM 1712 O VAL A 113 14.730 22.029 3.293 1.00 0.00 O ATOM 1713 CB VAL A 113 11.816 22.293 2.834 1.00 0.00 C ATOM 1714 CG1 VAL A 113 12.155 23.550 2.047 1.00 0.00 C ATOM 1715 CG2 VAL A 113 10.345 21.940 2.680 1.00 0.00 C ATOM 0 H VAL A 113 11.766 20.022 3.908 1.00 0.00 H new ATOM 0 HA VAL A 113 12.376 20.780 1.402 1.00 0.00 H new ATOM 0 HB VAL A 113 12.011 22.489 3.888 1.00 0.00 H new ATOM 0 HG11 VAL A 113 11.518 24.370 2.379 1.00 0.00 H new ATOM 0 HG12 VAL A 113 13.200 23.813 2.213 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.991 23.370 0.985 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.733 22.783 3.002 1.00 0.00 H new ATOM 0 HG22 VAL A 113 10.132 21.715 1.635 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.114 21.069 3.293 1.00 0.00 H new ATOM 1725 N SER A 114 14.728 21.498 1.106 1.00 0.00 N ATOM 1726 CA SER A 114 16.108 21.914 0.892 1.00 0.00 C ATOM 1727 C SER A 114 16.176 23.113 -0.048 1.00 0.00 C ATOM 1728 O SER A 114 16.236 22.959 -1.267 1.00 0.00 O ATOM 1729 CB SER A 114 16.928 20.756 0.318 1.00 0.00 C ATOM 1730 OG SER A 114 18.318 21.025 0.399 1.00 0.00 O ATOM 0 H SER A 114 14.261 21.139 0.273 1.00 0.00 H new ATOM 0 HA SER A 114 16.526 22.206 1.855 1.00 0.00 H new ATOM 0 HB2 SER A 114 16.700 19.840 0.862 1.00 0.00 H new ATOM 0 HB3 SER A 114 16.647 20.588 -0.722 1.00 0.00 H new ATOM 0 HG SER A 114 18.820 20.270 0.027 1.00 0.00 H new ATOM 1736 N GLY A 115 16.164 24.311 0.530 1.00 0.00 N ATOM 1737 CA GLY A 115 16.223 25.521 -0.269 1.00 0.00 C ATOM 1738 C GLY A 115 17.454 26.353 0.028 1.00 0.00 C ATOM 1739 O GLY A 115 18.337 25.946 0.785 1.00 0.00 O ATOM 0 H GLY A 115 16.114 24.465 1.537 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.214 25.255 -1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 115 15.331 26.119 -0.083 1.00 0.00 H new ATOM 1743 N PRO A 116 17.526 27.548 -0.575 1.00 0.00 N ATOM 1744 CA PRO A 116 18.655 28.464 -0.387 1.00 0.00 C ATOM 1745 C PRO A 116 18.688 29.061 1.016 1.00 0.00 C ATOM 1746 O PRO A 116 19.554 29.878 1.332 1.00 0.00 O ATOM 1747 CB PRO A 116 18.403 29.557 -1.428 1.00 0.00 C ATOM 1748 CG PRO A 116 16.931 29.533 -1.655 1.00 0.00 C ATOM 1749 CD PRO A 116 16.511 28.099 -1.489 1.00 0.00 C ATOM 0 HA PRO A 116 19.614 27.959 -0.504 1.00 0.00 H new ATOM 0 HB2 PRO A 116 18.732 30.531 -1.066 1.00 0.00 H new ATOM 0 HB3 PRO A 116 18.949 29.359 -2.350 1.00 0.00 H new ATOM 0 HG2 PRO A 116 16.415 30.176 -0.942 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.684 29.900 -2.651 1.00 0.00 H new ATOM 0 HD2 PRO A 116 15.508 28.020 -1.070 1.00 0.00 H new ATOM 0 HD3 PRO A 116 16.500 27.571 -2.442 1.00 0.00 H new ATOM 1757 N SER A 117 17.743 28.649 1.852 1.00 0.00 N ATOM 1758 CA SER A 117 17.662 29.147 3.221 1.00 0.00 C ATOM 1759 C SER A 117 18.478 28.270 4.166 1.00 0.00 C ATOM 1760 O SER A 117 18.010 27.228 4.625 1.00 0.00 O ATOM 1761 CB SER A 117 16.204 29.195 3.683 1.00 0.00 C ATOM 1762 OG SER A 117 15.599 27.917 3.600 1.00 0.00 O ATOM 0 H SER A 117 17.021 27.971 1.607 1.00 0.00 H new ATOM 0 HA SER A 117 18.075 30.155 3.240 1.00 0.00 H new ATOM 0 HB2 SER A 117 16.157 29.557 4.710 1.00 0.00 H new ATOM 0 HB3 SER A 117 15.648 29.904 3.069 1.00 0.00 H new ATOM 0 HG SER A 117 16.225 27.237 3.925 1.00 0.00 H new ATOM 1768 N SER A 118 19.702 28.701 4.453 1.00 0.00 N ATOM 1769 CA SER A 118 20.586 27.956 5.341 1.00 0.00 C ATOM 1770 C SER A 118 19.819 27.411 6.541 1.00 0.00 C ATOM 1771 O SER A 118 18.833 28.001 6.982 1.00 0.00 O ATOM 1772 CB SER A 118 21.735 28.847 5.818 1.00 0.00 C ATOM 1773 OG SER A 118 21.282 29.800 6.763 1.00 0.00 O ATOM 0 H SER A 118 20.104 29.562 4.083 1.00 0.00 H new ATOM 0 HA SER A 118 20.996 27.115 4.782 1.00 0.00 H new ATOM 0 HB2 SER A 118 22.516 28.231 6.264 1.00 0.00 H new ATOM 0 HB3 SER A 118 22.181 29.359 4.965 1.00 0.00 H new ATOM 0 HG SER A 118 22.035 30.356 7.054 1.00 0.00 H new ATOM 1779 N GLY A 119 20.278 26.279 7.067 1.00 0.00 N ATOM 1780 CA GLY A 119 19.623 25.672 8.211 1.00 0.00 C ATOM 1781 C GLY A 119 20.146 26.208 9.529 1.00 0.00 C ATOM 1782 O GLY A 119 20.556 27.365 9.619 1.00 0.00 O ATOM 0 H GLY A 119 21.092 25.771 6.721 1.00 0.00 H new ATOM 0 HA2 GLY A 119 18.550 25.852 8.149 1.00 0.00 H new ATOM 0 HA3 GLY A 119 19.768 24.592 8.178 1.00 0.00 H new TER 1786 GLY A 119