USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 654 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 45 LYS NZ :NH3+ 150:sc= -0.831 (180deg=-2.07!) USER MOD Set 1.2: A 49 MET CE :methyl 157:sc= -0.106 (180deg=-0.676) USER MOD Set 1.3: A 82 HIS : no HE2:sc= -1.61 X(o=-2.5,f=-2.2) USER MOD Set 2.1: A 55 ASN : amide:sc= -9.74! C(o=-10!,f=-16!) USER MOD Set 2.2: A 71 LYS NZ :NH3+ 152:sc= -0.432 (180deg=-0.297!) USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0633 (180deg=0) USER MOD Single : A 2 SER OG : rot -68:sc= -1.14 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00334 USER MOD Single : A 7 GLN : amide:sc=-0.00144 X(o=-0.0014,f=0) USER MOD Single : A 9 GLN : amide:sc= -0.847 K(o=-0.85,f=-0.26) USER MOD Single : A 10 ASN : amide:sc= -0.0728 X(o=-0.073,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -27:sc= 0.389 USER MOD Single : A 17 ASN : amide:sc= -1.18 K(o=-1.2,f=-5.4!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.72) USER MOD Single : A 23 GLN : amide:sc= -0.255 X(o=-0.25,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 154:sc= -0.332 (180deg=-0.38) USER MOD Single : A 25 ASN : amide:sc= -0.776 K(o=-0.78,f=-3.6!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -2.55! K(o=-2.5!,f=-1.1) USER MOD Single : A 34 HIS : no HD1:sc= -15.9! C(o=-16!,f=-14!) USER MOD Single : A 39 ASN : amide:sc= -3.83! C(o=-3.8!,f=-3.2!) USER MOD Single : A 47 THR OG1 : rot 88:sc= -0.449 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.507 K(o=-0.51,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0556 USER MOD Single : A 73 GLN : amide:sc= -0.0233 K(o=-0.023,f=-0.76) USER MOD Single : A 80 ASN : amide:sc= -0.938 K(o=-0.94,f=-0.33) USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=-0.054) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.827 -25.484 -17.284 1.00 0.00 N ATOM 2 CA GLY A 1 19.600 -24.353 -17.868 1.00 0.00 C ATOM 3 C GLY A 1 20.655 -24.820 -18.851 1.00 0.00 C ATOM 4 O GLY A 1 20.992 -26.001 -18.896 1.00 0.00 O ATOM 0 H1 GLY A 1 17.834 -25.418 -17.586 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.230 -26.385 -17.611 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.877 -25.439 -16.246 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.915 -23.670 -18.371 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.078 -23.791 -17.066 1.00 0.00 H new ATOM 10 N SER A 2 21.174 -23.886 -19.640 1.00 0.00 N ATOM 11 CA SER A 2 22.197 -24.203 -20.629 1.00 0.00 C ATOM 12 C SER A 2 23.372 -23.236 -20.522 1.00 0.00 C ATOM 13 O SER A 2 23.199 -22.072 -20.159 1.00 0.00 O ATOM 14 CB SER A 2 21.604 -24.157 -22.040 1.00 0.00 C ATOM 15 OG SER A 2 21.966 -25.307 -22.782 1.00 0.00 O ATOM 0 H SER A 2 20.903 -22.903 -19.614 1.00 0.00 H new ATOM 0 HA SER A 2 22.562 -25.211 -20.431 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.518 -24.086 -21.979 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.953 -23.263 -22.556 1.00 0.00 H new ATOM 0 HG SER A 2 22.929 -25.289 -22.965 1.00 0.00 H new ATOM 21 N SER A 3 24.566 -23.724 -20.837 1.00 0.00 N ATOM 22 CA SER A 3 25.769 -22.901 -20.773 1.00 0.00 C ATOM 23 C SER A 3 26.082 -22.279 -22.133 1.00 0.00 C ATOM 24 O SER A 3 27.232 -21.959 -22.428 1.00 0.00 O ATOM 25 CB SER A 3 26.959 -23.737 -20.293 1.00 0.00 C ATOM 26 OG SER A 3 27.361 -23.352 -18.990 1.00 0.00 O ATOM 0 H SER A 3 24.728 -24.685 -21.139 1.00 0.00 H new ATOM 0 HA SER A 3 25.589 -22.095 -20.062 1.00 0.00 H new ATOM 0 HB2 SER A 3 26.690 -24.793 -20.297 1.00 0.00 H new ATOM 0 HB3 SER A 3 27.793 -23.618 -20.984 1.00 0.00 H new ATOM 0 HG SER A 3 28.121 -23.902 -18.706 1.00 0.00 H new ATOM 32 N LEU A 4 25.052 -22.108 -22.958 1.00 0.00 N ATOM 33 CA LEU A 4 25.228 -21.523 -24.283 1.00 0.00 C ATOM 34 C LEU A 4 25.119 -20.000 -24.224 1.00 0.00 C ATOM 35 O LEU A 4 24.939 -19.423 -23.153 1.00 0.00 O ATOM 36 CB LEU A 4 24.200 -22.097 -25.261 1.00 0.00 C ATOM 37 CG LEU A 4 22.733 -21.874 -24.875 1.00 0.00 C ATOM 38 CD1 LEU A 4 22.126 -20.749 -25.702 1.00 0.00 C ATOM 39 CD2 LEU A 4 21.934 -23.156 -25.049 1.00 0.00 C ATOM 0 H LEU A 4 24.091 -22.365 -22.733 1.00 0.00 H new ATOM 0 HA LEU A 4 26.226 -21.778 -24.639 1.00 0.00 H new ATOM 0 HB2 LEU A 4 24.371 -21.656 -26.243 1.00 0.00 H new ATOM 0 HB3 LEU A 4 24.374 -23.169 -25.358 1.00 0.00 H new ATOM 0 HG LEU A 4 22.695 -21.586 -23.825 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.085 -20.606 -25.413 1.00 0.00 H new ATOM 0 HD12 LEU A 4 22.681 -19.828 -25.526 1.00 0.00 H new ATOM 0 HD13 LEU A 4 22.177 -21.007 -26.760 1.00 0.00 H new ATOM 0 HD21 LEU A 4 20.895 -22.978 -24.770 1.00 0.00 H new ATOM 0 HD22 LEU A 4 21.981 -23.475 -26.090 1.00 0.00 H new ATOM 0 HD23 LEU A 4 22.352 -23.935 -24.412 1.00 0.00 H new ATOM 51 N ALA A 5 25.244 -19.358 -25.381 1.00 0.00 N ATOM 52 CA ALA A 5 25.172 -17.901 -25.467 1.00 0.00 C ATOM 53 C ALA A 5 23.884 -17.357 -24.856 1.00 0.00 C ATOM 54 O ALA A 5 22.796 -17.867 -25.116 1.00 0.00 O ATOM 55 CB ALA A 5 25.302 -17.456 -26.916 1.00 0.00 C ATOM 0 H ALA A 5 25.396 -19.824 -26.275 1.00 0.00 H new ATOM 0 HA ALA A 5 26.002 -17.494 -24.890 1.00 0.00 H new ATOM 0 HB1 ALA A 5 25.247 -16.369 -26.969 1.00 0.00 H new ATOM 0 HB2 ALA A 5 26.260 -17.791 -27.315 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.493 -17.889 -27.504 1.00 0.00 H new ATOM 61 N SER A 6 24.018 -16.310 -24.045 1.00 0.00 N ATOM 62 CA SER A 6 22.868 -15.687 -23.396 1.00 0.00 C ATOM 63 C SER A 6 22.037 -14.893 -24.402 1.00 0.00 C ATOM 64 O SER A 6 22.324 -14.898 -25.600 1.00 0.00 O ATOM 65 CB SER A 6 23.331 -14.772 -22.262 1.00 0.00 C ATOM 66 OG SER A 6 22.350 -14.687 -21.241 1.00 0.00 O ATOM 0 H SER A 6 24.913 -15.875 -23.822 1.00 0.00 H new ATOM 0 HA SER A 6 22.243 -16.478 -22.982 1.00 0.00 H new ATOM 0 HB2 SER A 6 24.264 -15.150 -21.844 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.538 -13.777 -22.655 1.00 0.00 H new ATOM 0 HG SER A 6 22.671 -14.097 -20.527 1.00 0.00 H new ATOM 72 N GLN A 7 21.002 -14.218 -23.908 1.00 0.00 N ATOM 73 CA GLN A 7 20.128 -13.423 -24.765 1.00 0.00 C ATOM 74 C GLN A 7 20.589 -11.969 -24.834 1.00 0.00 C ATOM 75 O GLN A 7 21.534 -11.574 -24.150 1.00 0.00 O ATOM 76 CB GLN A 7 18.684 -13.489 -24.256 1.00 0.00 C ATOM 77 CG GLN A 7 17.681 -13.894 -25.324 1.00 0.00 C ATOM 78 CD GLN A 7 16.611 -14.829 -24.797 1.00 0.00 C ATOM 79 OE1 GLN A 7 16.341 -15.876 -25.384 1.00 0.00 O ATOM 80 NE2 GLN A 7 15.995 -14.453 -23.681 1.00 0.00 N ATOM 0 H GLN A 7 20.749 -14.206 -22.920 1.00 0.00 H new ATOM 0 HA GLN A 7 20.176 -13.842 -25.770 1.00 0.00 H new ATOM 0 HB2 GLN A 7 18.630 -14.199 -23.431 1.00 0.00 H new ATOM 0 HB3 GLN A 7 18.403 -12.514 -23.856 1.00 0.00 H new ATOM 0 HG2 GLN A 7 17.208 -13.000 -25.730 1.00 0.00 H new ATOM 0 HG3 GLN A 7 18.208 -14.378 -26.146 1.00 0.00 H new ATOM 0 HE21 GLN A 7 16.251 -13.576 -23.228 1.00 0.00 H new ATOM 0 HE22 GLN A 7 15.266 -15.041 -23.278 1.00 0.00 H new ATOM 89 N GLY A 8 19.915 -11.180 -25.666 1.00 0.00 N ATOM 90 CA GLY A 8 20.269 -9.778 -25.814 1.00 0.00 C ATOM 91 C GLY A 8 19.554 -8.884 -24.821 1.00 0.00 C ATOM 92 O GLY A 8 20.154 -7.969 -24.257 1.00 0.00 O ATOM 0 H GLY A 8 19.130 -11.486 -26.241 1.00 0.00 H new ATOM 0 HA2 GLY A 8 21.346 -9.665 -25.688 1.00 0.00 H new ATOM 0 HA3 GLY A 8 20.030 -9.453 -26.827 1.00 0.00 H new ATOM 96 N GLN A 9 18.269 -9.145 -24.606 1.00 0.00 N ATOM 97 CA GLN A 9 17.471 -8.352 -23.673 1.00 0.00 C ATOM 98 C GLN A 9 17.573 -8.907 -22.255 1.00 0.00 C ATOM 99 O GLN A 9 16.572 -9.009 -21.543 1.00 0.00 O ATOM 100 CB GLN A 9 16.008 -8.322 -24.121 1.00 0.00 C ATOM 101 CG GLN A 9 15.739 -7.352 -25.259 1.00 0.00 C ATOM 102 CD GLN A 9 15.863 -5.903 -24.830 1.00 0.00 C ATOM 103 OE1 GLN A 9 14.876 -5.263 -24.468 1.00 0.00 O ATOM 104 NE2 GLN A 9 17.081 -5.377 -24.869 1.00 0.00 N ATOM 0 H GLN A 9 17.757 -9.899 -25.064 1.00 0.00 H new ATOM 0 HA GLN A 9 17.864 -7.335 -23.671 1.00 0.00 H new ATOM 0 HB2 GLN A 9 15.711 -9.324 -24.431 1.00 0.00 H new ATOM 0 HB3 GLN A 9 15.382 -8.053 -23.270 1.00 0.00 H new ATOM 0 HG2 GLN A 9 16.438 -7.548 -26.072 1.00 0.00 H new ATOM 0 HG3 GLN A 9 14.737 -7.527 -25.652 1.00 0.00 H new ATOM 0 HE21 GLN A 9 17.872 -5.944 -25.176 1.00 0.00 H new ATOM 0 HE22 GLN A 9 17.226 -4.406 -24.592 1.00 0.00 H new ATOM 113 N ASN A 10 18.788 -9.263 -21.848 1.00 0.00 N ATOM 114 CA ASN A 10 19.018 -9.807 -20.518 1.00 0.00 C ATOM 115 C ASN A 10 18.774 -8.749 -19.449 1.00 0.00 C ATOM 116 O ASN A 10 18.104 -9.005 -18.455 1.00 0.00 O ATOM 117 CB ASN A 10 20.445 -10.348 -20.404 1.00 0.00 C ATOM 118 CG ASN A 10 20.589 -11.368 -19.292 1.00 0.00 C ATOM 119 OD1 ASN A 10 21.371 -11.180 -18.361 1.00 0.00 O ATOM 120 ND2 ASN A 10 19.835 -12.456 -19.385 1.00 0.00 N ATOM 0 H ASN A 10 19.627 -9.184 -22.422 1.00 0.00 H new ATOM 0 HA ASN A 10 18.315 -10.625 -20.360 1.00 0.00 H new ATOM 0 HB2 ASN A 10 20.735 -10.804 -21.351 1.00 0.00 H new ATOM 0 HB3 ASN A 10 21.131 -9.520 -20.225 1.00 0.00 H new ATOM 0 HD21 ASN A 10 19.890 -13.178 -18.667 1.00 0.00 H new ATOM 0 HD22 ASN A 10 19.200 -12.570 -20.175 1.00 0.00 H new ATOM 127 N LEU A 11 19.322 -7.561 -19.667 1.00 0.00 N ATOM 128 CA LEU A 11 19.171 -6.456 -18.724 1.00 0.00 C ATOM 129 C LEU A 11 17.707 -6.049 -18.583 1.00 0.00 C ATOM 130 O LEU A 11 17.263 -5.660 -17.504 1.00 0.00 O ATOM 131 CB LEU A 11 19.995 -5.256 -19.187 1.00 0.00 C ATOM 132 CG LEU A 11 21.452 -5.250 -18.722 1.00 0.00 C ATOM 133 CD1 LEU A 11 22.355 -4.672 -19.801 1.00 0.00 C ATOM 134 CD2 LEU A 11 21.591 -4.463 -17.428 1.00 0.00 C ATOM 0 H LEU A 11 19.878 -7.335 -20.492 1.00 0.00 H new ATOM 0 HA LEU A 11 19.530 -6.792 -17.751 1.00 0.00 H new ATOM 0 HB2 LEU A 11 19.978 -5.222 -20.276 1.00 0.00 H new ATOM 0 HB3 LEU A 11 19.513 -4.345 -18.832 1.00 0.00 H new ATOM 0 HG LEU A 11 21.760 -6.279 -18.535 1.00 0.00 H new ATOM 0 HD11 LEU A 11 23.388 -4.676 -19.452 1.00 0.00 H new ATOM 0 HD12 LEU A 11 22.275 -5.276 -20.705 1.00 0.00 H new ATOM 0 HD13 LEU A 11 22.050 -3.649 -20.021 1.00 0.00 H new ATOM 0 HD21 LEU A 11 22.633 -4.468 -17.109 1.00 0.00 H new ATOM 0 HD22 LEU A 11 21.266 -3.435 -17.590 1.00 0.00 H new ATOM 0 HD23 LEU A 11 20.974 -4.921 -16.655 1.00 0.00 H new ATOM 146 N SER A 12 16.964 -6.134 -19.682 1.00 0.00 N ATOM 147 CA SER A 12 15.554 -5.765 -19.679 1.00 0.00 C ATOM 148 C SER A 12 14.769 -6.602 -18.671 1.00 0.00 C ATOM 149 O SER A 12 13.773 -6.142 -18.114 1.00 0.00 O ATOM 150 CB SER A 12 14.957 -5.932 -21.077 1.00 0.00 C ATOM 151 OG SER A 12 13.926 -4.985 -21.310 1.00 0.00 O ATOM 0 H SER A 12 17.315 -6.455 -20.584 1.00 0.00 H new ATOM 0 HA SER A 12 15.481 -4.718 -19.384 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.740 -5.813 -21.826 1.00 0.00 H new ATOM 0 HB3 SER A 12 14.560 -6.941 -21.188 1.00 0.00 H new ATOM 0 HG SER A 12 13.562 -5.112 -22.211 1.00 0.00 H new ATOM 157 N THR A 13 15.221 -7.831 -18.440 1.00 0.00 N ATOM 158 CA THR A 13 14.549 -8.719 -17.496 1.00 0.00 C ATOM 159 C THR A 13 15.267 -8.750 -16.142 1.00 0.00 C ATOM 160 O THR A 13 14.836 -9.446 -15.223 1.00 0.00 O ATOM 161 CB THR A 13 14.436 -10.133 -18.073 1.00 0.00 C ATOM 162 OG1 THR A 13 13.590 -10.936 -17.270 1.00 0.00 O ATOM 163 CG2 THR A 13 15.764 -10.848 -18.195 1.00 0.00 C ATOM 0 H THR A 13 16.044 -8.233 -18.890 1.00 0.00 H new ATOM 0 HA THR A 13 13.546 -8.326 -17.332 1.00 0.00 H new ATOM 0 HB THR A 13 14.026 -9.998 -19.074 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.603 -10.605 -16.348 1.00 0.00 H new ATOM 0 HG21 THR A 13 15.605 -11.843 -18.611 1.00 0.00 H new ATOM 0 HG22 THR A 13 16.423 -10.281 -18.852 1.00 0.00 H new ATOM 0 HG23 THR A 13 16.222 -10.936 -17.210 1.00 0.00 H new ATOM 171 N VAL A 14 16.350 -7.983 -16.017 1.00 0.00 N ATOM 172 CA VAL A 14 17.102 -7.923 -14.765 1.00 0.00 C ATOM 173 C VAL A 14 16.437 -6.953 -13.793 1.00 0.00 C ATOM 174 O VAL A 14 16.525 -7.121 -12.576 1.00 0.00 O ATOM 175 CB VAL A 14 18.564 -7.486 -14.995 1.00 0.00 C ATOM 176 CG1 VAL A 14 19.332 -7.435 -13.685 1.00 0.00 C ATOM 177 CG2 VAL A 14 19.257 -8.419 -15.970 1.00 0.00 C ATOM 0 H VAL A 14 16.724 -7.398 -16.764 1.00 0.00 H new ATOM 0 HA VAL A 14 17.105 -8.928 -14.343 1.00 0.00 H new ATOM 0 HB VAL A 14 18.547 -6.483 -15.422 1.00 0.00 H new ATOM 0 HG11 VAL A 14 20.359 -7.124 -13.877 1.00 0.00 H new ATOM 0 HG12 VAL A 14 18.857 -6.721 -13.012 1.00 0.00 H new ATOM 0 HG13 VAL A 14 19.332 -8.423 -13.225 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.286 -8.092 -16.117 1.00 0.00 H new ATOM 0 HG22 VAL A 14 19.252 -9.433 -15.570 1.00 0.00 H new ATOM 0 HG23 VAL A 14 18.731 -8.403 -16.925 1.00 0.00 H new ATOM 187 N LEU A 15 15.774 -5.940 -14.340 1.00 0.00 N ATOM 188 CA LEU A 15 15.089 -4.943 -13.526 1.00 0.00 C ATOM 189 C LEU A 15 13.769 -5.494 -12.997 1.00 0.00 C ATOM 190 O LEU A 15 13.410 -5.268 -11.842 1.00 0.00 O ATOM 191 CB LEU A 15 14.839 -3.671 -14.340 1.00 0.00 C ATOM 192 CG LEU A 15 15.951 -2.623 -14.261 1.00 0.00 C ATOM 193 CD1 LEU A 15 16.185 -2.202 -12.819 1.00 0.00 C ATOM 194 CD2 LEU A 15 17.232 -3.161 -14.878 1.00 0.00 C ATOM 0 H LEU A 15 15.696 -5.788 -15.346 1.00 0.00 H new ATOM 0 HA LEU A 15 15.728 -4.698 -12.677 1.00 0.00 H new ATOM 0 HB2 LEU A 15 14.696 -3.948 -15.384 1.00 0.00 H new ATOM 0 HB3 LEU A 15 13.908 -3.217 -14.000 1.00 0.00 H new ATOM 0 HG LEU A 15 15.640 -1.745 -14.827 1.00 0.00 H new ATOM 0 HD11 LEU A 15 16.979 -1.456 -12.782 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.268 -1.776 -12.411 1.00 0.00 H new ATOM 0 HD13 LEU A 15 16.476 -3.071 -12.229 1.00 0.00 H new ATOM 0 HD21 LEU A 15 18.013 -2.403 -14.814 1.00 0.00 H new ATOM 0 HD22 LEU A 15 17.548 -4.054 -14.339 1.00 0.00 H new ATOM 0 HD23 LEU A 15 17.055 -3.412 -15.924 1.00 0.00 H new ATOM 206 N ALA A 16 13.055 -6.226 -13.848 1.00 0.00 N ATOM 207 CA ALA A 16 11.781 -6.818 -13.461 1.00 0.00 C ATOM 208 C ALA A 16 11.980 -7.826 -12.336 1.00 0.00 C ATOM 209 O ALA A 16 12.061 -9.033 -12.574 1.00 0.00 O ATOM 210 CB ALA A 16 11.121 -7.479 -14.665 1.00 0.00 C ATOM 0 H ALA A 16 13.338 -6.422 -14.808 1.00 0.00 H new ATOM 0 HA ALA A 16 11.125 -6.027 -13.097 1.00 0.00 H new ATOM 0 HB1 ALA A 16 10.170 -7.918 -14.363 1.00 0.00 H new ATOM 0 HB2 ALA A 16 10.947 -6.732 -15.440 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.774 -8.260 -15.054 1.00 0.00 H new ATOM 216 N ASN A 17 12.061 -7.326 -11.108 1.00 0.00 N ATOM 217 CA ASN A 17 12.253 -8.182 -9.944 1.00 0.00 C ATOM 218 C ASN A 17 11.183 -7.926 -8.888 1.00 0.00 C ATOM 219 O ASN A 17 10.306 -8.758 -8.661 1.00 0.00 O ATOM 220 CB ASN A 17 13.641 -7.954 -9.345 1.00 0.00 C ATOM 221 CG ASN A 17 14.740 -8.572 -10.186 1.00 0.00 C ATOM 222 OD1 ASN A 17 14.770 -8.407 -11.406 1.00 0.00 O ATOM 223 ND2 ASN A 17 15.652 -9.288 -9.539 1.00 0.00 N ATOM 0 H ASN A 17 11.997 -6.331 -10.893 1.00 0.00 H new ATOM 0 HA ASN A 17 12.168 -9.218 -10.271 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.820 -6.883 -9.247 1.00 0.00 H new ATOM 0 HB3 ASN A 17 13.674 -8.376 -8.341 1.00 0.00 H new ATOM 0 HD21 ASN A 17 16.415 -9.727 -10.054 1.00 0.00 H new ATOM 0 HD22 ASN A 17 15.589 -9.399 -8.527 1.00 0.00 H new ATOM 230 N LEU A 18 11.274 -6.770 -8.239 1.00 0.00 N ATOM 231 CA LEU A 18 10.328 -6.397 -7.194 1.00 0.00 C ATOM 232 C LEU A 18 9.681 -5.047 -7.498 1.00 0.00 C ATOM 233 O LEU A 18 10.138 -4.008 -7.019 1.00 0.00 O ATOM 234 CB LEU A 18 11.046 -6.344 -5.844 1.00 0.00 C ATOM 235 CG LEU A 18 11.596 -7.685 -5.355 1.00 0.00 C ATOM 236 CD1 LEU A 18 12.958 -7.963 -5.979 1.00 0.00 C ATOM 237 CD2 LEU A 18 11.690 -7.702 -3.837 1.00 0.00 C ATOM 0 H LEU A 18 11.996 -6.073 -8.419 1.00 0.00 H new ATOM 0 HA LEU A 18 9.540 -7.149 -7.156 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.870 -5.634 -5.915 1.00 0.00 H new ATOM 0 HB3 LEU A 18 10.354 -5.957 -5.096 1.00 0.00 H new ATOM 0 HG LEU A 18 10.909 -8.472 -5.665 1.00 0.00 H new ATOM 0 HD11 LEU A 18 13.334 -8.921 -5.620 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.861 -7.995 -7.064 1.00 0.00 H new ATOM 0 HD13 LEU A 18 13.654 -7.172 -5.700 1.00 0.00 H new ATOM 0 HD21 LEU A 18 12.083 -8.664 -3.508 1.00 0.00 H new ATOM 0 HD22 LEU A 18 12.355 -6.905 -3.505 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.699 -7.549 -3.409 1.00 0.00 H new ATOM 249 N THR A 19 8.626 -5.069 -8.306 1.00 0.00 N ATOM 250 CA THR A 19 7.927 -3.842 -8.683 1.00 0.00 C ATOM 251 C THR A 19 6.783 -3.506 -7.718 1.00 0.00 C ATOM 252 O THR A 19 6.743 -2.407 -7.168 1.00 0.00 O ATOM 253 CB THR A 19 7.394 -3.951 -10.112 1.00 0.00 C ATOM 254 OG1 THR A 19 8.448 -4.228 -11.019 1.00 0.00 O ATOM 255 CG2 THR A 19 6.700 -2.694 -10.589 1.00 0.00 C ATOM 0 H THR A 19 8.236 -5.919 -8.712 1.00 0.00 H new ATOM 0 HA THR A 19 8.651 -3.029 -8.627 1.00 0.00 H new ATOM 0 HB THR A 19 6.667 -4.763 -10.089 1.00 0.00 H new ATOM 0 HG1 THR A 19 8.088 -4.296 -11.928 1.00 0.00 H new ATOM 0 HG21 THR A 19 6.346 -2.839 -11.610 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.853 -2.477 -9.938 1.00 0.00 H new ATOM 0 HG23 THR A 19 7.401 -1.859 -10.563 1.00 0.00 H new ATOM 263 N PRO A 20 5.829 -4.435 -7.501 1.00 0.00 N ATOM 264 CA PRO A 20 4.695 -4.188 -6.603 1.00 0.00 C ATOM 265 C PRO A 20 5.120 -4.069 -5.142 1.00 0.00 C ATOM 266 O PRO A 20 4.439 -3.430 -4.345 1.00 0.00 O ATOM 267 CB PRO A 20 3.794 -5.407 -6.805 1.00 0.00 C ATOM 268 CG PRO A 20 4.703 -6.476 -7.302 1.00 0.00 C ATOM 269 CD PRO A 20 5.766 -5.779 -8.108 1.00 0.00 C ATOM 0 HA PRO A 20 4.203 -3.242 -6.830 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.311 -5.700 -5.873 1.00 0.00 H new ATOM 0 HB3 PRO A 20 3.001 -5.198 -7.523 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.143 -7.030 -6.473 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.160 -7.196 -7.914 1.00 0.00 H new ATOM 0 HD2 PRO A 20 6.724 -6.295 -8.042 1.00 0.00 H new ATOM 0 HD3 PRO A 20 5.502 -5.731 -9.165 1.00 0.00 H new ATOM 277 N GLU A 21 6.248 -4.682 -4.802 1.00 0.00 N ATOM 278 CA GLU A 21 6.758 -4.637 -3.442 1.00 0.00 C ATOM 279 C GLU A 21 7.452 -3.304 -3.177 1.00 0.00 C ATOM 280 O GLU A 21 7.248 -2.685 -2.132 1.00 0.00 O ATOM 281 CB GLU A 21 7.727 -5.790 -3.170 1.00 0.00 C ATOM 282 CG GLU A 21 8.100 -6.646 -4.372 1.00 0.00 C ATOM 283 CD GLU A 21 6.950 -7.501 -4.869 1.00 0.00 C ATOM 284 OE1 GLU A 21 5.912 -7.560 -4.176 1.00 0.00 O ATOM 285 OE2 GLU A 21 7.087 -8.109 -5.951 1.00 0.00 O ATOM 0 H GLU A 21 6.825 -5.216 -5.452 1.00 0.00 H new ATOM 0 HA GLU A 21 5.908 -4.740 -2.768 1.00 0.00 H new ATOM 0 HB2 GLU A 21 8.642 -5.377 -2.745 1.00 0.00 H new ATOM 0 HB3 GLU A 21 7.287 -6.437 -2.411 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.441 -5.999 -5.180 1.00 0.00 H new ATOM 0 HG3 GLU A 21 8.937 -7.291 -4.106 1.00 0.00 H new ATOM 292 N GLN A 22 8.271 -2.866 -4.130 1.00 0.00 N ATOM 293 CA GLN A 22 8.989 -1.604 -3.996 1.00 0.00 C ATOM 294 C GLN A 22 8.047 -0.426 -4.214 1.00 0.00 C ATOM 295 O GLN A 22 7.935 0.459 -3.364 1.00 0.00 O ATOM 296 CB GLN A 22 10.143 -1.537 -5.000 1.00 0.00 C ATOM 297 CG GLN A 22 11.312 -2.442 -4.645 1.00 0.00 C ATOM 298 CD GLN A 22 11.948 -2.079 -3.316 1.00 0.00 C ATOM 299 OE1 GLN A 22 11.991 -0.910 -2.932 1.00 0.00 O ATOM 300 NE2 GLN A 22 12.448 -3.086 -2.606 1.00 0.00 N ATOM 0 H GLN A 22 8.453 -3.366 -5.001 1.00 0.00 H new ATOM 0 HA GLN A 22 9.394 -1.549 -2.985 1.00 0.00 H new ATOM 0 HB2 GLN A 22 9.771 -1.809 -5.988 1.00 0.00 H new ATOM 0 HB3 GLN A 22 10.497 -0.508 -5.065 1.00 0.00 H new ATOM 0 HG2 GLN A 22 10.968 -3.476 -4.609 1.00 0.00 H new ATOM 0 HG3 GLN A 22 12.064 -2.383 -5.432 1.00 0.00 H new ATOM 0 HE21 GLN A 22 12.390 -4.040 -2.963 1.00 0.00 H new ATOM 0 HE22 GLN A 22 12.889 -2.905 -1.704 1.00 0.00 H new ATOM 309 N GLN A 23 7.370 -0.422 -5.358 1.00 0.00 N ATOM 310 CA GLN A 23 6.435 0.647 -5.693 1.00 0.00 C ATOM 311 C GLN A 23 5.422 0.857 -4.571 1.00 0.00 C ATOM 312 O GLN A 23 4.972 1.976 -4.329 1.00 0.00 O ATOM 313 CB GLN A 23 5.707 0.323 -6.998 1.00 0.00 C ATOM 314 CG GLN A 23 4.777 1.430 -7.468 1.00 0.00 C ATOM 315 CD GLN A 23 3.522 0.896 -8.137 1.00 0.00 C ATOM 316 OE1 GLN A 23 2.430 1.430 -7.945 1.00 0.00 O ATOM 317 NE2 GLN A 23 3.675 -0.163 -8.923 1.00 0.00 N ATOM 0 H GLN A 23 7.451 -1.148 -6.070 1.00 0.00 H new ATOM 0 HA GLN A 23 7.004 1.568 -5.820 1.00 0.00 H new ATOM 0 HB2 GLN A 23 6.444 0.125 -7.776 1.00 0.00 H new ATOM 0 HB3 GLN A 23 5.130 -0.592 -6.865 1.00 0.00 H new ATOM 0 HG2 GLN A 23 4.495 2.048 -6.616 1.00 0.00 H new ATOM 0 HG3 GLN A 23 5.310 2.075 -8.167 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.600 -0.573 -9.053 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.867 -0.567 -9.397 1.00 0.00 H new ATOM 326 N LYS A 24 5.073 -0.228 -3.885 1.00 0.00 N ATOM 327 CA LYS A 24 4.118 -0.162 -2.785 1.00 0.00 C ATOM 328 C LYS A 24 4.769 0.427 -1.540 1.00 0.00 C ATOM 329 O LYS A 24 4.125 1.130 -0.761 1.00 0.00 O ATOM 330 CB LYS A 24 3.566 -1.554 -2.472 1.00 0.00 C ATOM 331 CG LYS A 24 2.341 -1.923 -3.295 1.00 0.00 C ATOM 332 CD LYS A 24 1.055 -1.727 -2.504 1.00 0.00 C ATOM 333 CE LYS A 24 0.661 -0.261 -2.425 1.00 0.00 C ATOM 334 NZ LYS A 24 -0.133 0.034 -1.201 1.00 0.00 N ATOM 0 H LYS A 24 5.437 -1.162 -4.072 1.00 0.00 H new ATOM 0 HA LYS A 24 3.296 0.486 -3.090 1.00 0.00 H new ATOM 0 HB2 LYS A 24 4.347 -2.293 -2.648 1.00 0.00 H new ATOM 0 HB3 LYS A 24 3.311 -1.605 -1.413 1.00 0.00 H new ATOM 0 HG2 LYS A 24 2.311 -1.312 -4.197 1.00 0.00 H new ATOM 0 HG3 LYS A 24 2.417 -2.962 -3.616 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.251 -2.295 -2.971 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.183 -2.124 -1.497 1.00 0.00 H new ATOM 0 HE2 LYS A 24 1.559 0.357 -2.433 1.00 0.00 H new ATOM 0 HE3 LYS A 24 0.081 0.007 -3.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.013 1.034 -0.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.138 -0.158 -1.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.197 -0.568 -0.420 1.00 0.00 H new ATOM 348 N ASN A 25 6.051 0.128 -1.358 1.00 0.00 N ATOM 349 CA ASN A 25 6.802 0.616 -0.205 1.00 0.00 C ATOM 350 C ASN A 25 6.696 2.134 -0.077 1.00 0.00 C ATOM 351 O ASN A 25 6.324 2.651 0.976 1.00 0.00 O ATOM 352 CB ASN A 25 8.270 0.203 -0.319 1.00 0.00 C ATOM 353 CG ASN A 25 9.095 0.661 0.867 1.00 0.00 C ATOM 354 OD1 ASN A 25 9.193 1.855 1.146 1.00 0.00 O ATOM 355 ND2 ASN A 25 9.693 -0.292 1.573 1.00 0.00 N ATOM 0 H ASN A 25 6.594 -0.453 -1.997 1.00 0.00 H new ATOM 0 HA ASN A 25 6.370 0.169 0.690 1.00 0.00 H new ATOM 0 HB2 ASN A 25 8.333 -0.882 -0.404 1.00 0.00 H new ATOM 0 HB3 ASN A 25 8.692 0.620 -1.234 1.00 0.00 H new ATOM 0 HD21 ASN A 25 10.261 -0.046 2.383 1.00 0.00 H new ATOM 0 HD22 ASN A 25 9.584 -1.270 1.305 1.00 0.00 H new ATOM 362 N VAL A 26 7.028 2.844 -1.152 1.00 0.00 N ATOM 363 CA VAL A 26 6.972 4.301 -1.150 1.00 0.00 C ATOM 364 C VAL A 26 5.583 4.791 -0.752 1.00 0.00 C ATOM 365 O VAL A 26 5.443 5.708 0.056 1.00 0.00 O ATOM 366 CB VAL A 26 7.362 4.888 -2.526 1.00 0.00 C ATOM 367 CG1 VAL A 26 6.174 4.921 -3.479 1.00 0.00 C ATOM 368 CG2 VAL A 26 7.958 6.277 -2.360 1.00 0.00 C ATOM 0 H VAL A 26 7.338 2.434 -2.033 1.00 0.00 H new ATOM 0 HA VAL A 26 7.696 4.650 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 26 8.115 4.234 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.486 5.340 -4.436 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.801 3.908 -3.631 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.383 5.539 -3.053 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.227 6.677 -3.338 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.226 6.933 -1.889 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.848 6.218 -1.734 1.00 0.00 H new ATOM 378 N LEU A 27 4.559 4.168 -1.328 1.00 0.00 N ATOM 379 CA LEU A 27 3.180 4.532 -1.036 1.00 0.00 C ATOM 380 C LEU A 27 2.896 4.420 0.458 1.00 0.00 C ATOM 381 O LEU A 27 2.345 5.340 1.060 1.00 0.00 O ATOM 382 CB LEU A 27 2.220 3.636 -1.819 1.00 0.00 C ATOM 383 CG LEU A 27 2.410 3.653 -3.335 1.00 0.00 C ATOM 384 CD1 LEU A 27 1.505 2.626 -3.997 1.00 0.00 C ATOM 385 CD2 LEU A 27 2.143 5.045 -3.893 1.00 0.00 C ATOM 0 H LEU A 27 4.661 3.408 -2.000 1.00 0.00 H new ATOM 0 HA LEU A 27 3.028 5.568 -1.340 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.334 2.611 -1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 27 1.198 3.940 -1.593 1.00 0.00 H new ATOM 0 HG LEU A 27 3.445 3.390 -3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.654 2.652 -5.076 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.747 1.632 -3.621 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.465 2.857 -3.768 1.00 0.00 H new ATOM 0 HD21 LEU A 27 2.283 5.037 -4.974 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.119 5.339 -3.662 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.835 5.756 -3.443 1.00 0.00 H new ATOM 397 N GLY A 28 3.274 3.287 1.049 1.00 0.00 N ATOM 398 CA GLY A 28 3.044 3.073 2.467 1.00 0.00 C ATOM 399 C GLY A 28 3.758 4.089 3.337 1.00 0.00 C ATOM 400 O GLY A 28 3.167 4.639 4.266 1.00 0.00 O ATOM 0 H GLY A 28 3.736 2.514 0.569 1.00 0.00 H new ATOM 0 HA2 GLY A 28 1.974 3.118 2.668 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.378 2.071 2.738 1.00 0.00 H new ATOM 404 N GLU A 29 5.027 4.349 3.035 1.00 0.00 N ATOM 405 CA GLU A 29 5.806 5.315 3.805 1.00 0.00 C ATOM 406 C GLU A 29 5.119 6.676 3.787 1.00 0.00 C ATOM 407 O GLU A 29 4.827 7.249 4.836 1.00 0.00 O ATOM 408 CB GLU A 29 7.222 5.433 3.237 1.00 0.00 C ATOM 409 CG GLU A 29 7.988 4.120 3.233 1.00 0.00 C ATOM 410 CD GLU A 29 9.163 4.124 4.191 1.00 0.00 C ATOM 411 OE1 GLU A 29 8.930 4.207 5.416 1.00 0.00 O ATOM 412 OE2 GLU A 29 10.316 4.042 3.718 1.00 0.00 O ATOM 0 H GLU A 29 5.535 3.908 2.268 1.00 0.00 H new ATOM 0 HA GLU A 29 5.872 4.966 4.835 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.165 5.814 2.217 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.778 6.167 3.820 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.311 3.308 3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.348 3.917 2.224 1.00 0.00 H new ATOM 419 N ARG A 30 4.862 7.180 2.587 1.00 0.00 N ATOM 420 CA ARG A 30 4.201 8.468 2.423 1.00 0.00 C ATOM 421 C ARG A 30 2.744 8.400 2.876 1.00 0.00 C ATOM 422 O ARG A 30 2.088 9.429 3.041 1.00 0.00 O ATOM 423 CB ARG A 30 4.267 8.911 0.962 1.00 0.00 C ATOM 424 CG ARG A 30 5.684 9.073 0.438 1.00 0.00 C ATOM 425 CD ARG A 30 6.376 10.272 1.067 1.00 0.00 C ATOM 426 NE ARG A 30 6.282 11.463 0.224 1.00 0.00 N ATOM 427 CZ ARG A 30 7.116 11.731 -0.779 1.00 0.00 C ATOM 428 NH1 ARG A 30 8.095 10.888 -1.081 1.00 0.00 N ATOM 429 NH2 ARG A 30 6.964 12.842 -1.487 1.00 0.00 N ATOM 0 H ARG A 30 5.102 6.715 1.711 1.00 0.00 H new ATOM 0 HA ARG A 30 4.722 9.195 3.046 1.00 0.00 H new ATOM 0 HB2 ARG A 30 3.742 8.181 0.346 1.00 0.00 H new ATOM 0 HB3 ARG A 30 3.738 9.858 0.854 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.256 8.169 0.648 1.00 0.00 H new ATOM 0 HG3 ARG A 30 5.661 9.191 -0.645 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.929 10.480 2.039 1.00 0.00 H new ATOM 0 HD3 ARG A 30 7.425 10.034 1.243 1.00 0.00 H new ATOM 0 HE ARG A 30 5.533 12.128 0.416 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.212 10.029 -0.544 1.00 0.00 H new ATOM 0 HH12 ARG A 30 8.730 11.099 -1.850 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.209 13.490 -1.263 1.00 0.00 H new ATOM 0 HH22 ARG A 30 7.602 13.048 -2.255 1.00 0.00 H new ATOM 443 N LEU A 31 2.238 7.181 3.071 1.00 0.00 N ATOM 444 CA LEU A 31 0.858 6.984 3.496 1.00 0.00 C ATOM 445 C LEU A 31 0.699 7.276 4.984 1.00 0.00 C ATOM 446 O LEU A 31 -0.050 8.165 5.383 1.00 0.00 O ATOM 447 CB LEU A 31 0.433 5.545 3.211 1.00 0.00 C ATOM 448 CG LEU A 31 -0.828 5.389 2.364 1.00 0.00 C ATOM 449 CD1 LEU A 31 -0.510 4.674 1.061 1.00 0.00 C ATOM 450 CD2 LEU A 31 -1.902 4.642 3.141 1.00 0.00 C ATOM 0 H LEU A 31 2.766 6.318 2.941 1.00 0.00 H new ATOM 0 HA LEU A 31 0.225 7.674 2.938 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.254 5.035 2.707 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.277 5.035 4.162 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.208 6.382 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.420 4.572 0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.224 5.251 0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -0.105 3.685 1.278 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -2.794 4.540 2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.533 3.653 3.412 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.150 5.198 4.045 1.00 0.00 H new ATOM 462 N TYR A 32 1.410 6.508 5.796 1.00 0.00 N ATOM 463 CA TYR A 32 1.362 6.653 7.245 1.00 0.00 C ATOM 464 C TYR A 32 1.557 8.108 7.667 1.00 0.00 C ATOM 465 O TYR A 32 1.006 8.546 8.672 1.00 0.00 O ATOM 466 CB TYR A 32 2.446 5.760 7.868 1.00 0.00 C ATOM 467 CG TYR A 32 2.318 5.546 9.359 1.00 0.00 C ATOM 468 CD1 TYR A 32 2.741 6.516 10.257 1.00 0.00 C ATOM 469 CD2 TYR A 32 1.789 4.366 9.869 1.00 0.00 C ATOM 470 CE1 TYR A 32 2.643 6.319 11.621 1.00 0.00 C ATOM 471 CE2 TYR A 32 1.684 4.161 11.231 1.00 0.00 C ATOM 472 CZ TYR A 32 2.112 5.139 12.103 1.00 0.00 C ATOM 473 OH TYR A 32 2.015 4.938 13.459 1.00 0.00 O ATOM 0 H TYR A 32 2.034 5.769 5.472 1.00 0.00 H new ATOM 0 HA TYR A 32 0.379 6.344 7.600 1.00 0.00 H new ATOM 0 HB2 TYR A 32 2.424 4.789 7.374 1.00 0.00 H new ATOM 0 HB3 TYR A 32 3.421 6.201 7.662 1.00 0.00 H new ATOM 0 HD1 TYR A 32 3.154 7.441 9.883 1.00 0.00 H new ATOM 0 HD2 TYR A 32 1.454 3.597 9.189 1.00 0.00 H new ATOM 0 HE1 TYR A 32 2.980 7.083 12.306 1.00 0.00 H new ATOM 0 HE2 TYR A 32 1.269 3.239 11.611 1.00 0.00 H new ATOM 0 HH TYR A 32 1.619 4.058 13.632 1.00 0.00 H new ATOM 483 N ASN A 33 2.350 8.845 6.898 1.00 0.00 N ATOM 484 CA ASN A 33 2.626 10.249 7.197 1.00 0.00 C ATOM 485 C ASN A 33 1.396 11.123 7.007 1.00 0.00 C ATOM 486 O ASN A 33 1.165 12.058 7.776 1.00 0.00 O ATOM 487 CB ASN A 33 3.759 10.759 6.300 1.00 0.00 C ATOM 488 CG ASN A 33 3.931 12.265 6.363 1.00 0.00 C ATOM 489 OD1 ASN A 33 4.913 12.763 6.915 1.00 0.00 O ATOM 490 ND2 ASN A 33 2.973 13.002 5.800 1.00 0.00 N ATOM 0 H ASN A 33 2.815 8.495 6.061 1.00 0.00 H new ATOM 0 HA ASN A 33 2.922 10.310 8.244 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.692 10.279 6.595 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.560 10.464 5.270 1.00 0.00 H new ATOM 0 HD21 ASN A 33 3.037 14.020 5.816 1.00 0.00 H new ATOM 0 HD22 ASN A 33 2.176 12.548 5.353 1.00 0.00 H new ATOM 497 N HIS A 34 0.621 10.845 5.974 1.00 0.00 N ATOM 498 CA HIS A 34 -0.560 11.640 5.698 1.00 0.00 C ATOM 499 C HIS A 34 -1.549 11.541 6.851 1.00 0.00 C ATOM 500 O HIS A 34 -2.202 12.515 7.219 1.00 0.00 O ATOM 501 CB HIS A 34 -1.221 11.182 4.391 1.00 0.00 C ATOM 502 CG HIS A 34 -1.965 9.883 4.484 1.00 0.00 C ATOM 503 ND1 HIS A 34 -1.746 8.812 3.643 1.00 0.00 N ATOM 504 CD2 HIS A 34 -2.943 9.498 5.323 1.00 0.00 C ATOM 505 CE1 HIS A 34 -2.561 7.823 3.978 1.00 0.00 C ATOM 506 NE2 HIS A 34 -3.298 8.218 4.994 1.00 0.00 N ATOM 0 H HIS A 34 0.787 10.082 5.318 1.00 0.00 H new ATOM 0 HA HIS A 34 -0.256 12.681 5.588 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -1.912 11.957 4.059 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -0.452 11.090 3.624 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -3.372 10.093 6.116 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -2.612 6.857 3.499 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -4.015 7.662 5.459 1.00 0.00 H new ATOM 515 N ILE A 35 -1.669 10.335 7.381 1.00 0.00 N ATOM 516 CA ILE A 35 -2.602 10.045 8.469 1.00 0.00 C ATOM 517 C ILE A 35 -1.953 10.081 9.859 1.00 0.00 C ATOM 518 O ILE A 35 -2.642 10.322 10.845 1.00 0.00 O ATOM 519 CB ILE A 35 -3.288 8.673 8.260 1.00 0.00 C ATOM 520 CG1 ILE A 35 -4.096 8.268 9.499 1.00 0.00 C ATOM 521 CG2 ILE A 35 -2.258 7.607 7.917 1.00 0.00 C ATOM 522 CD1 ILE A 35 -5.155 7.224 9.211 1.00 0.00 C ATOM 0 H ILE A 35 -1.126 9.528 7.074 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.344 10.843 8.437 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.980 8.765 7.423 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.415 7.884 10.258 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.574 9.154 9.918 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.759 6.650 7.774 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.738 7.885 7.000 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.538 7.521 8.731 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.689 6.984 10.131 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.858 7.613 8.474 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.681 6.323 8.820 1.00 0.00 H new ATOM 534 N VAL A 36 -0.651 9.820 9.964 1.00 0.00 N ATOM 535 CA VAL A 36 -0.005 9.816 11.279 1.00 0.00 C ATOM 536 C VAL A 36 -0.338 11.087 12.061 1.00 0.00 C ATOM 537 O VAL A 36 -0.782 11.021 13.205 1.00 0.00 O ATOM 538 CB VAL A 36 1.532 9.656 11.206 1.00 0.00 C ATOM 539 CG1 VAL A 36 2.168 10.797 10.431 1.00 0.00 C ATOM 540 CG2 VAL A 36 2.119 9.573 12.608 1.00 0.00 C ATOM 0 H VAL A 36 -0.035 9.613 9.178 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.405 8.944 11.796 1.00 0.00 H new ATOM 0 HB VAL A 36 1.751 8.729 10.676 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.248 10.656 10.397 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.772 10.812 9.416 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.941 11.743 10.923 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.201 9.461 12.543 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.881 10.484 13.157 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.696 8.715 13.129 1.00 0.00 H new ATOM 550 N ALA A 37 -0.124 12.240 11.437 1.00 0.00 N ATOM 551 CA ALA A 37 -0.409 13.517 12.079 1.00 0.00 C ATOM 552 C ALA A 37 -1.913 13.726 12.221 1.00 0.00 C ATOM 553 O ALA A 37 -2.372 14.444 13.109 1.00 0.00 O ATOM 554 CB ALA A 37 0.205 14.657 11.281 1.00 0.00 C ATOM 0 H ALA A 37 0.245 12.316 10.489 1.00 0.00 H new ATOM 0 HA ALA A 37 0.033 13.505 13.075 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.016 15.605 11.772 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.285 14.521 11.224 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.214 14.663 10.275 1.00 0.00 H new ATOM 560 N ILE A 38 -2.671 13.103 11.326 1.00 0.00 N ATOM 561 CA ILE A 38 -4.127 13.233 11.335 1.00 0.00 C ATOM 562 C ILE A 38 -4.796 12.220 12.268 1.00 0.00 C ATOM 563 O ILE A 38 -5.380 12.597 13.284 1.00 0.00 O ATOM 564 CB ILE A 38 -4.701 13.086 9.914 1.00 0.00 C ATOM 565 CG1 ILE A 38 -3.881 13.935 8.941 1.00 0.00 C ATOM 566 CG2 ILE A 38 -6.166 13.497 9.887 1.00 0.00 C ATOM 567 CD1 ILE A 38 -3.854 15.403 9.299 1.00 0.00 C ATOM 0 H ILE A 38 -2.305 12.504 10.586 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.347 14.232 11.712 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.640 12.041 9.609 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -2.859 13.557 8.913 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.291 13.821 7.937 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -6.556 13.387 8.875 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.735 12.862 10.566 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.258 14.537 10.200 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.255 15.945 8.567 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.871 15.796 9.299 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.417 15.528 10.290 1.00 0.00 H new ATOM 579 N ASN A 39 -4.699 10.939 11.931 1.00 0.00 N ATOM 580 CA ASN A 39 -5.286 9.883 12.755 1.00 0.00 C ATOM 581 C ASN A 39 -4.226 8.866 13.172 1.00 0.00 C ATOM 582 O ASN A 39 -4.116 7.790 12.581 1.00 0.00 O ATOM 583 CB ASN A 39 -6.425 9.188 12.008 1.00 0.00 C ATOM 584 CG ASN A 39 -7.702 9.128 12.826 1.00 0.00 C ATOM 585 OD1 ASN A 39 -8.771 9.530 12.364 1.00 0.00 O ATOM 586 ND2 ASN A 39 -7.598 8.626 14.052 1.00 0.00 N ATOM 0 H ASN A 39 -4.221 10.604 11.095 1.00 0.00 H new ATOM 0 HA ASN A 39 -5.692 10.344 13.656 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -6.619 9.716 11.075 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -6.118 8.176 11.744 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -8.423 8.563 14.649 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -6.693 8.304 14.396 1.00 0.00 H new ATOM 593 N PRO A 40 -3.424 9.196 14.200 1.00 0.00 N ATOM 594 CA PRO A 40 -2.365 8.310 14.695 1.00 0.00 C ATOM 595 C PRO A 40 -2.873 6.909 15.017 1.00 0.00 C ATOM 596 O PRO A 40 -2.128 5.934 14.928 1.00 0.00 O ATOM 597 CB PRO A 40 -1.881 9.002 15.971 1.00 0.00 C ATOM 598 CG PRO A 40 -2.241 10.437 15.796 1.00 0.00 C ATOM 599 CD PRO A 40 -3.487 10.461 14.954 1.00 0.00 C ATOM 0 HA PRO A 40 -1.585 8.165 13.948 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -2.361 8.580 16.854 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.806 8.879 16.103 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -2.414 10.915 16.760 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.433 10.984 15.310 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -4.385 10.516 15.569 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.504 11.324 14.288 1.00 0.00 H new ATOM 607 N ALA A 41 -4.141 6.814 15.401 1.00 0.00 N ATOM 608 CA ALA A 41 -4.739 5.527 15.744 1.00 0.00 C ATOM 609 C ALA A 41 -5.427 4.898 14.537 1.00 0.00 C ATOM 610 O ALA A 41 -6.532 4.366 14.649 1.00 0.00 O ATOM 611 CB ALA A 41 -5.723 5.695 16.890 1.00 0.00 C ATOM 0 H ALA A 41 -4.774 7.610 15.483 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.941 4.855 16.060 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.163 4.729 17.137 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.202 6.090 17.762 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.511 6.387 16.594 1.00 0.00 H new ATOM 617 N ALA A 42 -4.763 4.955 13.389 1.00 0.00 N ATOM 618 CA ALA A 42 -5.306 4.385 12.162 1.00 0.00 C ATOM 619 C ALA A 42 -4.198 4.121 11.152 1.00 0.00 C ATOM 620 O ALA A 42 -4.209 3.099 10.471 1.00 0.00 O ATOM 621 CB ALA A 42 -6.362 5.302 11.567 1.00 0.00 C ATOM 0 H ALA A 42 -3.847 5.391 13.282 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.776 3.433 12.409 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -6.755 4.859 10.652 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -7.173 5.436 12.283 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.916 6.270 11.339 1.00 0.00 H new ATOM 627 N ALA A 43 -3.243 5.051 11.064 1.00 0.00 N ATOM 628 CA ALA A 43 -2.121 4.914 10.137 1.00 0.00 C ATOM 629 C ALA A 43 -1.625 3.472 10.101 1.00 0.00 C ATOM 630 O ALA A 43 -1.496 2.873 9.034 1.00 0.00 O ATOM 631 CB ALA A 43 -0.990 5.851 10.533 1.00 0.00 C ATOM 0 H ALA A 43 -3.226 5.904 11.623 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.466 5.184 9.139 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.162 5.738 9.834 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.346 6.881 10.510 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.651 5.607 11.540 1.00 0.00 H new ATOM 637 N ALA A 44 -1.352 2.922 11.280 1.00 0.00 N ATOM 638 CA ALA A 44 -0.877 1.551 11.392 1.00 0.00 C ATOM 639 C ALA A 44 -1.784 0.585 10.633 1.00 0.00 C ATOM 640 O ALA A 44 -1.318 -0.395 10.054 1.00 0.00 O ATOM 641 CB ALA A 44 -0.782 1.147 12.856 1.00 0.00 C ATOM 0 H ALA A 44 -1.452 3.407 12.172 1.00 0.00 H new ATOM 0 HA ALA A 44 0.115 1.500 10.943 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.426 0.119 12.927 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -0.086 1.809 13.372 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.766 1.223 13.319 1.00 0.00 H new ATOM 647 N LYS A 45 -3.081 0.875 10.639 1.00 0.00 N ATOM 648 CA LYS A 45 -4.060 0.039 9.952 1.00 0.00 C ATOM 649 C LYS A 45 -4.209 0.461 8.496 1.00 0.00 C ATOM 650 O LYS A 45 -4.187 -0.372 7.591 1.00 0.00 O ATOM 651 CB LYS A 45 -5.416 0.131 10.654 1.00 0.00 C ATOM 652 CG LYS A 45 -5.522 -0.749 11.886 1.00 0.00 C ATOM 653 CD LYS A 45 -5.899 -2.173 11.512 1.00 0.00 C ATOM 654 CE LYS A 45 -4.678 -3.072 11.425 1.00 0.00 C ATOM 655 NZ LYS A 45 -5.049 -4.479 11.113 1.00 0.00 N ATOM 0 H LYS A 45 -3.480 1.685 11.113 1.00 0.00 H new ATOM 0 HA LYS A 45 -3.705 -0.991 9.982 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -5.598 1.167 10.941 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.200 -0.148 9.950 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.571 -0.750 12.419 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -6.268 -0.339 12.566 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.593 -2.572 12.252 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.420 -2.172 10.554 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -4.003 -2.695 10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.135 -3.040 12.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.279 -4.931 10.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.209 -5.000 11.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.918 -4.490 10.542 1.00 0.00 H new ATOM 669 N VAL A 46 -4.352 1.761 8.281 1.00 0.00 N ATOM 670 CA VAL A 46 -4.501 2.303 6.938 1.00 0.00 C ATOM 671 C VAL A 46 -3.294 1.960 6.074 1.00 0.00 C ATOM 672 O VAL A 46 -3.437 1.488 4.949 1.00 0.00 O ATOM 673 CB VAL A 46 -4.665 3.837 6.979 1.00 0.00 C ATOM 674 CG1 VAL A 46 -4.623 4.423 5.575 1.00 0.00 C ATOM 675 CG2 VAL A 46 -5.957 4.217 7.682 1.00 0.00 C ATOM 0 H VAL A 46 -4.368 2.462 9.022 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.395 1.853 6.505 1.00 0.00 H new ATOM 0 HB VAL A 46 -3.832 4.254 7.544 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -4.741 5.505 5.629 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.667 4.185 5.110 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.432 3.999 4.980 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.055 5.302 7.701 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.803 3.786 7.147 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.941 3.836 8.703 1.00 0.00 H new ATOM 685 N THR A 47 -2.111 2.224 6.611 1.00 0.00 N ATOM 686 CA THR A 47 -0.862 1.973 5.904 1.00 0.00 C ATOM 687 C THR A 47 -0.647 0.482 5.638 1.00 0.00 C ATOM 688 O THR A 47 -0.347 0.084 4.512 1.00 0.00 O ATOM 689 CB THR A 47 0.308 2.534 6.721 1.00 0.00 C ATOM 690 OG1 THR A 47 0.241 3.948 6.780 1.00 0.00 O ATOM 691 CG2 THR A 47 1.667 2.164 6.168 1.00 0.00 C ATOM 0 H THR A 47 -1.990 2.616 7.545 1.00 0.00 H new ATOM 0 HA THR A 47 -0.915 2.473 4.937 1.00 0.00 H new ATOM 0 HB THR A 47 0.207 2.087 7.710 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.316 4.218 7.540 1.00 0.00 H new ATOM 0 HG21 THR A 47 2.446 2.595 6.797 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.771 1.079 6.154 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.765 2.551 5.154 1.00 0.00 H new ATOM 699 N GLY A 48 -0.770 -0.327 6.681 1.00 0.00 N ATOM 700 CA GLY A 48 -0.551 -1.756 6.543 1.00 0.00 C ATOM 701 C GLY A 48 -1.650 -2.454 5.777 1.00 0.00 C ATOM 702 O GLY A 48 -1.388 -3.124 4.778 1.00 0.00 O ATOM 0 H GLY A 48 -1.018 -0.021 7.622 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.400 -1.924 6.037 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -0.468 -2.202 7.534 1.00 0.00 H new ATOM 706 N MET A 49 -2.881 -2.295 6.238 1.00 0.00 N ATOM 707 CA MET A 49 -4.012 -2.919 5.574 1.00 0.00 C ATOM 708 C MET A 49 -4.275 -2.249 4.233 1.00 0.00 C ATOM 709 O MET A 49 -4.378 -2.924 3.215 1.00 0.00 O ATOM 710 CB MET A 49 -5.263 -2.856 6.455 1.00 0.00 C ATOM 711 CG MET A 49 -5.106 -3.562 7.794 1.00 0.00 C ATOM 712 SD MET A 49 -4.483 -5.248 7.631 1.00 0.00 S ATOM 713 CE MET A 49 -2.807 -5.048 8.224 1.00 0.00 C ATOM 0 H MET A 49 -3.120 -1.744 7.062 1.00 0.00 H new ATOM 0 HA MET A 49 -3.769 -3.967 5.400 1.00 0.00 H new ATOM 0 HB2 MET A 49 -5.519 -1.811 6.633 1.00 0.00 H new ATOM 0 HB3 MET A 49 -6.099 -3.301 5.916 1.00 0.00 H new ATOM 0 HG2 MET A 49 -4.426 -2.988 8.424 1.00 0.00 H new ATOM 0 HG3 MET A 49 -6.070 -3.584 8.303 1.00 0.00 H new ATOM 0 HE1 MET A 49 -2.427 -6.009 8.571 1.00 0.00 H new ATOM 0 HE2 MET A 49 -2.177 -4.679 7.415 1.00 0.00 H new ATOM 0 HE3 MET A 49 -2.795 -4.334 9.048 1.00 0.00 H new ATOM 723 N LEU A 50 -4.387 -0.915 4.260 1.00 0.00 N ATOM 724 CA LEU A 50 -4.653 -0.103 3.060 1.00 0.00 C ATOM 725 C LEU A 50 -5.458 -0.850 1.993 1.00 0.00 C ATOM 726 O LEU A 50 -6.593 -0.484 1.689 1.00 0.00 O ATOM 727 CB LEU A 50 -3.346 0.388 2.439 1.00 0.00 C ATOM 728 CG LEU A 50 -3.498 1.590 1.503 1.00 0.00 C ATOM 729 CD1 LEU A 50 -4.197 2.744 2.216 1.00 0.00 C ATOM 730 CD2 LEU A 50 -2.141 2.026 0.972 1.00 0.00 C ATOM 0 H LEU A 50 -4.296 -0.365 5.114 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.253 0.741 3.400 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.655 0.653 3.240 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -2.892 -0.433 1.884 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.117 1.291 0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.295 3.588 1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.187 2.424 2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.609 3.045 3.083 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.268 2.881 0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.497 2.306 1.806 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.685 1.204 0.421 1.00 0.00 H new ATOM 742 N LEU A 51 -4.856 -1.887 1.425 1.00 0.00 N ATOM 743 CA LEU A 51 -5.497 -2.681 0.386 1.00 0.00 C ATOM 744 C LEU A 51 -6.671 -3.480 0.939 1.00 0.00 C ATOM 745 O LEU A 51 -6.632 -4.711 0.989 1.00 0.00 O ATOM 746 CB LEU A 51 -4.468 -3.610 -0.264 1.00 0.00 C ATOM 747 CG LEU A 51 -3.254 -2.891 -0.866 1.00 0.00 C ATOM 748 CD1 LEU A 51 -1.956 -3.437 -0.286 1.00 0.00 C ATOM 749 CD2 LEU A 51 -3.256 -3.014 -2.383 1.00 0.00 C ATOM 0 H LEU A 51 -3.916 -2.199 1.670 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.893 -2.002 -0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -4.119 -4.324 0.482 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.960 -4.185 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.323 -1.835 -0.606 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.110 -2.911 -0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.950 -3.290 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.878 -4.501 -0.508 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.387 -2.498 -2.791 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.217 -4.067 -2.663 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.165 -2.566 -2.783 1.00 0.00 H new ATOM 761 N GLU A 52 -7.728 -2.771 1.335 1.00 0.00 N ATOM 762 CA GLU A 52 -8.924 -3.409 1.868 1.00 0.00 C ATOM 763 C GLU A 52 -9.907 -3.710 0.738 1.00 0.00 C ATOM 764 O GLU A 52 -9.615 -3.461 -0.432 1.00 0.00 O ATOM 765 CB GLU A 52 -9.599 -2.515 2.917 1.00 0.00 C ATOM 766 CG GLU A 52 -8.629 -1.717 3.777 1.00 0.00 C ATOM 767 CD GLU A 52 -8.321 -2.397 5.095 1.00 0.00 C ATOM 768 OE1 GLU A 52 -8.489 -3.631 5.180 1.00 0.00 O ATOM 769 OE2 GLU A 52 -7.909 -1.695 6.044 1.00 0.00 O ATOM 0 H GLU A 52 -7.777 -1.753 1.295 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.627 -4.342 2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.271 -1.823 2.409 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.214 -3.138 3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.701 -1.565 3.226 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.049 -0.730 3.971 1.00 0.00 H new ATOM 776 N MET A 53 -11.063 -4.259 1.090 1.00 0.00 N ATOM 777 CA MET A 53 -12.069 -4.603 0.088 1.00 0.00 C ATOM 778 C MET A 53 -12.711 -3.356 -0.518 1.00 0.00 C ATOM 779 O MET A 53 -12.595 -3.112 -1.721 1.00 0.00 O ATOM 780 CB MET A 53 -13.150 -5.487 0.713 1.00 0.00 C ATOM 781 CG MET A 53 -12.797 -6.964 0.713 1.00 0.00 C ATOM 782 SD MET A 53 -12.891 -7.698 -0.930 1.00 0.00 S ATOM 783 CE MET A 53 -14.634 -8.089 -1.023 1.00 0.00 C ATOM 0 H MET A 53 -11.327 -4.475 2.051 1.00 0.00 H new ATOM 0 HA MET A 53 -11.566 -5.146 -0.712 1.00 0.00 H new ATOM 0 HB2 MET A 53 -13.325 -5.163 1.739 1.00 0.00 H new ATOM 0 HB3 MET A 53 -14.084 -5.344 0.170 1.00 0.00 H new ATOM 0 HG2 MET A 53 -11.789 -7.093 1.108 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.472 -7.495 1.384 1.00 0.00 H new ATOM 0 HE1 MET A 53 -14.852 -8.552 -1.985 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.895 -8.779 -0.221 1.00 0.00 H new ATOM 0 HE3 MET A 53 -15.218 -7.175 -0.919 1.00 0.00 H new ATOM 793 N ASP A 54 -13.373 -2.561 0.315 1.00 0.00 N ATOM 794 CA ASP A 54 -14.021 -1.344 -0.156 1.00 0.00 C ATOM 795 C ASP A 54 -13.070 -0.157 -0.057 1.00 0.00 C ATOM 796 O ASP A 54 -12.572 0.335 -1.069 1.00 0.00 O ATOM 797 CB ASP A 54 -15.309 -1.078 0.622 1.00 0.00 C ATOM 798 CG ASP A 54 -15.141 -1.176 2.128 1.00 0.00 C ATOM 799 OD1 ASP A 54 -14.271 -1.946 2.585 1.00 0.00 O ATOM 800 OD2 ASP A 54 -15.884 -0.479 2.852 1.00 0.00 O ATOM 0 H ASP A 54 -13.475 -2.736 1.315 1.00 0.00 H new ATOM 0 HA ASP A 54 -14.285 -1.481 -1.205 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.677 -0.083 0.370 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -16.070 -1.790 0.303 1.00 0.00 H new ATOM 805 N ASN A 55 -12.815 0.294 1.164 1.00 0.00 N ATOM 806 CA ASN A 55 -11.915 1.415 1.396 1.00 0.00 C ATOM 807 C ASN A 55 -10.592 1.213 0.654 1.00 0.00 C ATOM 808 O ASN A 55 -9.901 2.180 0.327 1.00 0.00 O ATOM 809 CB ASN A 55 -11.670 1.557 2.898 1.00 0.00 C ATOM 810 CG ASN A 55 -10.617 2.593 3.227 1.00 0.00 C ATOM 811 OD1 ASN A 55 -10.743 3.755 2.851 1.00 0.00 O ATOM 812 ND2 ASN A 55 -9.574 2.169 3.931 1.00 0.00 N ATOM 0 H ASN A 55 -13.221 -0.101 2.012 1.00 0.00 H new ATOM 0 HA ASN A 55 -12.374 2.327 1.014 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.605 1.827 3.390 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -11.363 0.593 3.304 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -8.830 2.820 4.183 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -9.516 1.192 4.220 1.00 0.00 H new ATOM 819 N GLY A 56 -10.246 -0.045 0.389 1.00 0.00 N ATOM 820 CA GLY A 56 -9.013 -0.351 -0.310 1.00 0.00 C ATOM 821 C GLY A 56 -9.034 0.095 -1.760 1.00 0.00 C ATOM 822 O GLY A 56 -8.223 0.923 -2.170 1.00 0.00 O ATOM 0 H GLY A 56 -10.802 -0.860 0.648 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -8.181 0.132 0.202 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -8.833 -1.425 -0.267 1.00 0.00 H new ATOM 826 N GLU A 57 -9.952 -0.469 -2.548 1.00 0.00 N ATOM 827 CA GLU A 57 -10.058 -0.125 -3.968 1.00 0.00 C ATOM 828 C GLU A 57 -9.762 1.352 -4.215 1.00 0.00 C ATOM 829 O GLU A 57 -8.928 1.697 -5.052 1.00 0.00 O ATOM 830 CB GLU A 57 -11.453 -0.447 -4.495 1.00 0.00 C ATOM 831 CG GLU A 57 -11.843 -1.910 -4.353 1.00 0.00 C ATOM 832 CD GLU A 57 -11.554 -2.720 -5.602 1.00 0.00 C ATOM 833 OE1 GLU A 57 -10.937 -2.168 -6.539 1.00 0.00 O ATOM 834 OE2 GLU A 57 -11.945 -3.905 -5.644 1.00 0.00 O ATOM 0 H GLU A 57 -10.629 -1.162 -2.229 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.316 -0.722 -4.497 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -12.182 0.166 -3.965 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.507 -0.167 -5.547 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.304 -2.345 -3.511 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -12.906 -1.977 -4.120 1.00 0.00 H new ATOM 841 N ILE A 58 -10.450 2.218 -3.479 1.00 0.00 N ATOM 842 CA ILE A 58 -10.261 3.658 -3.612 1.00 0.00 C ATOM 843 C ILE A 58 -8.792 4.024 -3.420 1.00 0.00 C ATOM 844 O ILE A 58 -8.239 4.827 -4.171 1.00 0.00 O ATOM 845 CB ILE A 58 -11.126 4.426 -2.589 1.00 0.00 C ATOM 846 CG1 ILE A 58 -12.610 4.191 -2.870 1.00 0.00 C ATOM 847 CG2 ILE A 58 -10.809 5.918 -2.617 1.00 0.00 C ATOM 848 CD1 ILE A 58 -13.180 2.988 -2.150 1.00 0.00 C ATOM 0 H ILE A 58 -11.145 1.947 -2.783 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.573 3.944 -4.617 1.00 0.00 H new ATOM 0 HB ILE A 58 -10.892 4.049 -1.593 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -13.171 5.078 -2.578 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.752 4.063 -3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.432 6.436 -1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.758 6.071 -2.371 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.010 6.314 -3.612 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -14.237 2.883 -2.397 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -12.644 2.091 -2.460 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -13.070 3.122 -1.074 1.00 0.00 H new ATOM 860 N LEU A 59 -8.174 3.422 -2.406 1.00 0.00 N ATOM 861 CA LEU A 59 -6.770 3.660 -2.089 1.00 0.00 C ATOM 862 C LEU A 59 -5.934 3.842 -3.353 1.00 0.00 C ATOM 863 O LEU A 59 -5.011 4.655 -3.394 1.00 0.00 O ATOM 864 CB LEU A 59 -6.221 2.488 -1.269 1.00 0.00 C ATOM 865 CG LEU A 59 -5.579 1.359 -2.086 1.00 0.00 C ATOM 866 CD1 LEU A 59 -4.159 1.733 -2.489 1.00 0.00 C ATOM 867 CD2 LEU A 59 -5.578 0.062 -1.298 1.00 0.00 C ATOM 0 H LEU A 59 -8.632 2.757 -1.783 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.706 4.580 -1.508 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.481 2.872 -0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.034 2.068 -0.677 1.00 0.00 H new ATOM 0 HG LEU A 59 -6.170 1.213 -2.990 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.719 0.921 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.179 2.640 -3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.561 1.907 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.119 -0.726 -1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.011 0.196 -0.377 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.603 -0.217 -1.056 1.00 0.00 H new ATOM 879 N ASN A 60 -6.263 3.062 -4.375 1.00 0.00 N ATOM 880 CA ASN A 60 -5.547 3.112 -5.647 1.00 0.00 C ATOM 881 C ASN A 60 -5.314 4.550 -6.113 1.00 0.00 C ATOM 882 O ASN A 60 -4.359 4.825 -6.839 1.00 0.00 O ATOM 883 CB ASN A 60 -6.317 2.336 -6.717 1.00 0.00 C ATOM 884 CG ASN A 60 -5.566 2.257 -8.032 1.00 0.00 C ATOM 885 OD1 ASN A 60 -6.145 2.435 -9.102 1.00 0.00 O ATOM 886 ND2 ASN A 60 -4.267 1.986 -7.955 1.00 0.00 N ATOM 0 H ASN A 60 -7.024 2.384 -4.349 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.572 2.650 -5.493 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -6.517 1.327 -6.356 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -7.283 2.813 -6.882 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.709 1.918 -8.806 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.828 1.846 -7.045 1.00 0.00 H new ATOM 893 N LEU A 61 -6.186 5.463 -5.694 1.00 0.00 N ATOM 894 CA LEU A 61 -6.060 6.866 -6.078 1.00 0.00 C ATOM 895 C LEU A 61 -5.626 7.731 -4.897 1.00 0.00 C ATOM 896 O LEU A 61 -6.289 8.713 -4.564 1.00 0.00 O ATOM 897 CB LEU A 61 -7.390 7.382 -6.634 1.00 0.00 C ATOM 898 CG LEU A 61 -8.122 6.422 -7.576 1.00 0.00 C ATOM 899 CD1 LEU A 61 -9.594 6.321 -7.204 1.00 0.00 C ATOM 900 CD2 LEU A 61 -7.968 6.876 -9.019 1.00 0.00 C ATOM 0 H LEU A 61 -6.983 5.258 -5.092 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.292 6.932 -6.849 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -8.048 7.616 -5.797 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -7.205 8.316 -7.165 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.675 5.433 -7.473 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -10.095 5.634 -7.886 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -9.687 5.951 -6.183 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -10.056 7.306 -7.276 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.494 6.184 -9.676 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -8.389 7.875 -9.133 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.911 6.895 -9.283 1.00 0.00 H new ATOM 912 N LEU A 62 -4.515 7.346 -4.261 1.00 0.00 N ATOM 913 CA LEU A 62 -3.977 8.067 -3.099 1.00 0.00 C ATOM 914 C LEU A 62 -4.330 9.558 -3.133 1.00 0.00 C ATOM 915 O LEU A 62 -3.611 10.369 -3.714 1.00 0.00 O ATOM 916 CB LEU A 62 -2.458 7.891 -3.032 1.00 0.00 C ATOM 917 CG LEU A 62 -1.980 6.448 -2.896 1.00 0.00 C ATOM 918 CD1 LEU A 62 -0.708 6.223 -3.699 1.00 0.00 C ATOM 919 CD2 LEU A 62 -1.764 6.088 -1.433 1.00 0.00 C ATOM 0 H LEU A 62 -3.965 6.531 -4.534 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.436 7.641 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.018 8.320 -3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.078 8.465 -2.187 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.755 5.794 -3.297 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.386 5.188 -3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.900 6.432 -4.751 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.075 6.888 -3.335 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.423 5.055 -1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.012 6.750 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.701 6.201 -0.888 1.00 0.00 H new ATOM 931 N ASP A 63 -5.458 9.899 -2.508 1.00 0.00 N ATOM 932 CA ASP A 63 -5.935 11.281 -2.464 1.00 0.00 C ATOM 933 C ASP A 63 -5.894 11.836 -1.045 1.00 0.00 C ATOM 934 O ASP A 63 -5.853 11.085 -0.078 1.00 0.00 O ATOM 935 CB ASP A 63 -7.364 11.355 -3.010 1.00 0.00 C ATOM 936 CG ASP A 63 -7.538 12.429 -4.069 1.00 0.00 C ATOM 937 OD1 ASP A 63 -6.521 13.007 -4.505 1.00 0.00 O ATOM 938 OD2 ASP A 63 -8.695 12.689 -4.463 1.00 0.00 O ATOM 0 H ASP A 63 -6.060 9.233 -2.023 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.275 11.887 -3.084 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.636 10.388 -3.433 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.052 11.549 -2.187 1.00 0.00 H new ATOM 943 N THR A 64 -5.921 13.156 -0.919 1.00 0.00 N ATOM 944 CA THR A 64 -5.895 13.783 0.396 1.00 0.00 C ATOM 945 C THR A 64 -7.243 13.628 1.093 1.00 0.00 C ATOM 946 O THR A 64 -7.301 13.223 2.248 1.00 0.00 O ATOM 947 CB THR A 64 -5.523 15.261 0.293 1.00 0.00 C ATOM 948 OG1 THR A 64 -4.992 15.561 -0.986 1.00 0.00 O ATOM 949 CG2 THR A 64 -4.504 15.684 1.328 1.00 0.00 C ATOM 0 H THR A 64 -5.960 13.808 -1.702 1.00 0.00 H new ATOM 0 HA THR A 64 -5.133 13.279 0.990 1.00 0.00 H new ATOM 0 HB THR A 64 -6.449 15.809 0.467 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.762 16.513 -1.030 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.279 16.743 1.205 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.906 15.512 2.326 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.591 15.102 1.199 1.00 0.00 H new ATOM 957 N PRO A 65 -8.351 13.950 0.403 1.00 0.00 N ATOM 958 CA PRO A 65 -9.687 13.836 0.981 1.00 0.00 C ATOM 959 C PRO A 65 -10.190 12.394 1.028 1.00 0.00 C ATOM 960 O PRO A 65 -10.315 11.805 2.101 1.00 0.00 O ATOM 961 CB PRO A 65 -10.559 14.685 0.056 1.00 0.00 C ATOM 962 CG PRO A 65 -9.839 14.738 -1.253 1.00 0.00 C ATOM 963 CD PRO A 65 -8.382 14.445 -0.985 1.00 0.00 C ATOM 0 HA PRO A 65 -9.703 14.168 2.019 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -11.549 14.244 -0.061 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -10.702 15.686 0.464 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -10.255 14.009 -1.948 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.954 15.719 -1.714 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -7.993 13.701 -1.680 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.770 15.340 -1.101 1.00 0.00 H new ATOM 971 N GLY A 66 -10.489 11.834 -0.144 1.00 0.00 N ATOM 972 CA GLY A 66 -10.990 10.472 -0.224 1.00 0.00 C ATOM 973 C GLY A 66 -10.212 9.501 0.639 1.00 0.00 C ATOM 974 O GLY A 66 -10.783 8.830 1.500 1.00 0.00 O ATOM 0 H GLY A 66 -10.392 12.304 -1.044 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.037 10.458 0.078 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -10.953 10.138 -1.261 1.00 0.00 H new ATOM 978 N LEU A 67 -8.905 9.421 0.412 1.00 0.00 N ATOM 979 CA LEU A 67 -8.051 8.524 1.174 1.00 0.00 C ATOM 980 C LEU A 67 -8.191 8.794 2.668 1.00 0.00 C ATOM 981 O LEU A 67 -8.772 8.001 3.403 1.00 0.00 O ATOM 982 CB LEU A 67 -6.600 8.734 0.740 1.00 0.00 C ATOM 983 CG LEU A 67 -5.905 7.538 0.090 1.00 0.00 C ATOM 984 CD1 LEU A 67 -5.380 6.577 1.142 1.00 0.00 C ATOM 985 CD2 LEU A 67 -6.847 6.827 -0.871 1.00 0.00 C ATOM 0 H LEU A 67 -8.415 9.969 -0.296 1.00 0.00 H new ATOM 0 HA LEU A 67 -8.350 7.493 0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.570 9.568 0.039 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.021 9.031 1.615 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.053 7.910 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.890 5.735 0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.663 7.093 1.781 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.209 6.212 1.748 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.333 5.979 -1.323 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.723 6.473 -0.327 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.161 7.520 -1.652 1.00 0.00 H new ATOM 997 N LEU A 68 -7.666 9.924 3.114 1.00 0.00 N ATOM 998 CA LEU A 68 -7.734 10.283 4.528 1.00 0.00 C ATOM 999 C LEU A 68 -9.148 10.142 5.087 1.00 0.00 C ATOM 1000 O LEU A 68 -9.323 9.893 6.277 1.00 0.00 O ATOM 1001 CB LEU A 68 -7.221 11.701 4.751 1.00 0.00 C ATOM 1002 CG LEU A 68 -5.728 11.796 5.058 1.00 0.00 C ATOM 1003 CD1 LEU A 68 -4.920 11.868 3.772 1.00 0.00 C ATOM 1004 CD2 LEU A 68 -5.440 12.997 5.943 1.00 0.00 C ATOM 0 H LEU A 68 -7.190 10.607 2.524 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.093 9.584 5.066 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.434 12.294 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -7.777 12.149 5.574 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.430 10.896 5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.859 11.935 4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.101 10.972 3.178 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.220 12.748 3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.371 13.048 6.151 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.754 13.908 5.434 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.988 12.898 6.880 1.00 0.00 H new ATOM 1016 N ASP A 69 -10.157 10.297 4.235 1.00 0.00 N ATOM 1017 CA ASP A 69 -11.535 10.175 4.693 1.00 0.00 C ATOM 1018 C ASP A 69 -11.925 8.710 4.859 1.00 0.00 C ATOM 1019 O ASP A 69 -12.263 8.273 5.953 1.00 0.00 O ATOM 1020 CB ASP A 69 -12.491 10.864 3.718 1.00 0.00 C ATOM 1021 CG ASP A 69 -13.852 11.123 4.338 1.00 0.00 C ATOM 1022 OD1 ASP A 69 -13.902 11.468 5.537 1.00 0.00 O ATOM 1023 OD2 ASP A 69 -14.867 10.981 3.623 1.00 0.00 O ATOM 0 H ASP A 69 -10.050 10.504 3.242 1.00 0.00 H new ATOM 0 HA ASP A 69 -11.610 10.666 5.663 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -12.056 11.809 3.392 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.610 10.244 2.829 1.00 0.00 H new ATOM 1028 N ALA A 70 -11.876 7.951 3.772 1.00 0.00 N ATOM 1029 CA ALA A 70 -12.230 6.539 3.819 1.00 0.00 C ATOM 1030 C ALA A 70 -11.200 5.727 4.604 1.00 0.00 C ATOM 1031 O ALA A 70 -11.475 4.601 5.019 1.00 0.00 O ATOM 1032 CB ALA A 70 -12.374 5.985 2.410 1.00 0.00 C ATOM 0 H ALA A 70 -11.596 8.288 2.851 1.00 0.00 H new ATOM 0 HA ALA A 70 -13.186 6.453 4.336 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -12.639 4.929 2.460 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -13.156 6.531 1.883 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -11.430 6.098 1.876 1.00 0.00 H new ATOM 1038 N LYS A 71 -10.011 6.291 4.788 1.00 0.00 N ATOM 1039 CA LYS A 71 -8.940 5.604 5.502 1.00 0.00 C ATOM 1040 C LYS A 71 -9.113 5.690 7.023 1.00 0.00 C ATOM 1041 O LYS A 71 -9.145 4.667 7.705 1.00 0.00 O ATOM 1042 CB LYS A 71 -7.588 6.196 5.108 1.00 0.00 C ATOM 1043 CG LYS A 71 -7.195 5.945 3.657 1.00 0.00 C ATOM 1044 CD LYS A 71 -7.018 4.469 3.356 1.00 0.00 C ATOM 1045 CE LYS A 71 -7.834 4.050 2.143 1.00 0.00 C ATOM 1046 NZ LYS A 71 -7.674 2.606 1.829 1.00 0.00 N ATOM 0 H LYS A 71 -9.764 7.222 4.453 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.984 4.552 5.220 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.609 7.271 5.286 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.818 5.780 5.758 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.959 6.359 2.999 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.266 6.472 3.438 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.964 4.256 3.179 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.321 3.880 4.222 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.887 4.266 2.324 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.530 4.643 1.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.533 2.256 1.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.857 2.476 1.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.520 2.074 2.709 1.00 0.00 H new ATOM 1060 N VAL A 72 -9.220 6.910 7.546 1.00 0.00 N ATOM 1061 CA VAL A 72 -9.384 7.112 8.988 1.00 0.00 C ATOM 1062 C VAL A 72 -10.639 6.429 9.501 1.00 0.00 C ATOM 1063 O VAL A 72 -10.642 5.837 10.580 1.00 0.00 O ATOM 1064 CB VAL A 72 -9.456 8.608 9.352 1.00 0.00 C ATOM 1065 CG1 VAL A 72 -8.150 9.314 9.022 1.00 0.00 C ATOM 1066 CG2 VAL A 72 -10.628 9.272 8.643 1.00 0.00 C ATOM 0 H VAL A 72 -9.197 7.770 6.998 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.506 6.671 9.461 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.615 8.690 10.427 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.229 10.368 9.289 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.337 8.857 9.585 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.947 9.224 7.955 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.664 10.328 8.911 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.503 9.175 7.565 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -11.557 8.789 8.945 1.00 0.00 H new ATOM 1076 N GLN A 73 -11.708 6.525 8.727 1.00 0.00 N ATOM 1077 CA GLN A 73 -12.977 5.926 9.103 1.00 0.00 C ATOM 1078 C GLN A 73 -12.891 4.406 9.096 1.00 0.00 C ATOM 1079 O GLN A 73 -13.230 3.755 10.080 1.00 0.00 O ATOM 1080 CB GLN A 73 -14.075 6.403 8.156 1.00 0.00 C ATOM 1081 CG GLN A 73 -14.088 7.912 7.968 1.00 0.00 C ATOM 1082 CD GLN A 73 -14.415 8.661 9.245 1.00 0.00 C ATOM 1083 OE1 GLN A 73 -15.073 8.130 10.141 1.00 0.00 O ATOM 1084 NE2 GLN A 73 -13.955 9.904 9.332 1.00 0.00 N ATOM 0 H GLN A 73 -11.721 7.014 7.832 1.00 0.00 H new ATOM 0 HA GLN A 73 -13.219 6.240 10.118 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.943 5.923 7.186 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -15.043 6.083 8.541 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -13.114 8.236 7.601 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -14.819 8.172 7.203 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -13.414 10.303 8.565 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -14.143 10.460 10.166 1.00 0.00 H new ATOM 1093 N GLU A 74 -12.422 3.845 7.986 1.00 0.00 N ATOM 1094 CA GLU A 74 -12.288 2.397 7.868 1.00 0.00 C ATOM 1095 C GLU A 74 -11.324 1.855 8.918 1.00 0.00 C ATOM 1096 O GLU A 74 -11.603 0.849 9.572 1.00 0.00 O ATOM 1097 CB GLU A 74 -11.804 2.019 6.473 1.00 0.00 C ATOM 1098 CG GLU A 74 -11.678 0.520 6.259 1.00 0.00 C ATOM 1099 CD GLU A 74 -12.847 -0.258 6.830 1.00 0.00 C ATOM 1100 OE1 GLU A 74 -13.992 0.234 6.736 1.00 0.00 O ATOM 1101 OE2 GLU A 74 -12.619 -1.362 7.370 1.00 0.00 O ATOM 0 H GLU A 74 -12.130 4.367 7.160 1.00 0.00 H new ATOM 0 HA GLU A 74 -13.269 1.952 8.035 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -12.495 2.426 5.735 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.835 2.486 6.295 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.599 0.316 5.191 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.755 0.169 6.720 1.00 0.00 H new ATOM 1108 N ALA A 75 -10.193 2.530 9.070 1.00 0.00 N ATOM 1109 CA ALA A 75 -9.183 2.124 10.040 1.00 0.00 C ATOM 1110 C ALA A 75 -9.732 2.172 11.458 1.00 0.00 C ATOM 1111 O ALA A 75 -9.613 1.210 12.215 1.00 0.00 O ATOM 1112 CB ALA A 75 -7.959 3.013 9.924 1.00 0.00 C ATOM 0 H ALA A 75 -9.951 3.363 8.533 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.899 1.095 9.821 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.212 2.700 10.653 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.543 2.930 8.920 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -8.242 4.048 10.115 1.00 0.00 H new ATOM 1118 N LEU A 76 -10.328 3.302 11.814 1.00 0.00 N ATOM 1119 CA LEU A 76 -10.895 3.480 13.145 1.00 0.00 C ATOM 1120 C LEU A 76 -12.127 2.600 13.337 1.00 0.00 C ATOM 1121 O LEU A 76 -12.466 2.229 14.462 1.00 0.00 O ATOM 1122 CB LEU A 76 -11.264 4.950 13.366 1.00 0.00 C ATOM 1123 CG LEU A 76 -10.111 5.872 13.770 1.00 0.00 C ATOM 1124 CD1 LEU A 76 -10.614 7.296 13.969 1.00 0.00 C ATOM 1125 CD2 LEU A 76 -9.428 5.368 15.035 1.00 0.00 C ATOM 0 H LEU A 76 -10.432 4.110 11.200 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.144 3.183 13.877 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -11.708 5.336 12.448 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -12.032 5.000 14.138 1.00 0.00 H new ATOM 0 HG LEU A 76 -9.377 5.870 12.964 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -9.782 7.939 14.256 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -11.051 7.661 13.039 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -11.370 7.308 14.754 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -8.612 6.041 15.301 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -10.151 5.334 15.850 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -9.031 4.368 14.860 1.00 0.00 H new ATOM 1137 N GLU A 77 -12.793 2.267 12.236 1.00 0.00 N ATOM 1138 CA GLU A 77 -13.989 1.432 12.287 1.00 0.00 C ATOM 1139 C GLU A 77 -13.635 -0.018 12.613 1.00 0.00 C ATOM 1140 O GLU A 77 -14.231 -0.627 13.502 1.00 0.00 O ATOM 1141 CB GLU A 77 -14.741 1.497 10.955 1.00 0.00 C ATOM 1142 CG GLU A 77 -16.159 0.956 11.026 1.00 0.00 C ATOM 1143 CD GLU A 77 -17.196 2.055 11.161 1.00 0.00 C ATOM 1144 OE1 GLU A 77 -16.948 3.013 11.925 1.00 0.00 O ATOM 1145 OE2 GLU A 77 -18.254 1.958 10.503 1.00 0.00 O ATOM 0 H GLU A 77 -12.525 2.562 11.297 1.00 0.00 H new ATOM 0 HA GLU A 77 -14.631 1.816 13.080 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.773 2.533 10.617 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.184 0.934 10.206 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.367 0.373 10.129 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.243 0.276 11.874 1.00 0.00 H new ATOM 1152 N VAL A 78 -12.664 -0.565 11.889 1.00 0.00 N ATOM 1153 CA VAL A 78 -12.232 -1.943 12.099 1.00 0.00 C ATOM 1154 C VAL A 78 -11.064 -2.020 13.077 1.00 0.00 C ATOM 1155 O VAL A 78 -10.791 -3.079 13.645 1.00 0.00 O ATOM 1156 CB VAL A 78 -11.828 -2.613 10.770 1.00 0.00 C ATOM 1157 CG1 VAL A 78 -10.621 -1.914 10.153 1.00 0.00 C ATOM 1158 CG2 VAL A 78 -11.546 -4.094 10.979 1.00 0.00 C ATOM 0 H VAL A 78 -12.160 -0.074 11.150 1.00 0.00 H new ATOM 0 HA VAL A 78 -13.083 -2.477 12.523 1.00 0.00 H new ATOM 0 HB VAL A 78 -12.663 -2.519 10.076 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.356 -2.405 9.217 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.865 -0.870 9.959 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.778 -1.967 10.842 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.263 -4.548 10.029 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.732 -4.212 11.695 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.441 -4.584 11.363 1.00 0.00 H new ATOM 1168 N LEU A 79 -10.375 -0.895 13.273 1.00 0.00 N ATOM 1169 CA LEU A 79 -9.233 -0.836 14.182 1.00 0.00 C ATOM 1170 C LEU A 79 -8.313 -2.039 13.983 1.00 0.00 C ATOM 1171 O LEU A 79 -8.442 -2.771 13.004 1.00 0.00 O ATOM 1172 CB LEU A 79 -9.713 -0.770 15.635 1.00 0.00 C ATOM 1173 CG LEU A 79 -8.904 0.157 16.548 1.00 0.00 C ATOM 1174 CD1 LEU A 79 -9.186 1.616 16.220 1.00 0.00 C ATOM 1175 CD2 LEU A 79 -9.219 -0.131 18.009 1.00 0.00 C ATOM 0 H LEU A 79 -10.590 -0.011 12.812 1.00 0.00 H new ATOM 0 HA LEU A 79 -8.666 0.067 13.956 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.753 -0.444 15.643 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -9.691 -1.776 16.054 1.00 0.00 H new ATOM 0 HG LEU A 79 -7.844 -0.032 16.377 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.601 2.257 16.880 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.912 1.816 15.184 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -10.247 1.822 16.361 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -8.637 0.536 18.645 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.282 0.031 18.191 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -8.965 -1.166 18.239 1.00 0.00 H new ATOM 1187 N ASN A 80 -7.388 -2.240 14.920 1.00 0.00 N ATOM 1188 CA ASN A 80 -6.448 -3.356 14.843 1.00 0.00 C ATOM 1189 C ASN A 80 -7.109 -4.674 15.233 1.00 0.00 C ATOM 1190 O ASN A 80 -6.423 -5.661 15.507 1.00 0.00 O ATOM 1191 CB ASN A 80 -5.236 -3.094 15.740 1.00 0.00 C ATOM 1192 CG ASN A 80 -4.730 -1.668 15.631 1.00 0.00 C ATOM 1193 OD1 ASN A 80 -5.129 -0.794 16.401 1.00 0.00 O ATOM 1194 ND2 ASN A 80 -3.846 -1.425 14.670 1.00 0.00 N ATOM 0 H ASN A 80 -7.270 -1.645 15.740 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.118 -3.438 13.807 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -5.503 -3.303 16.776 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -4.434 -3.782 15.472 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -3.471 -0.484 14.548 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -3.542 -2.179 14.054 1.00 0.00 H new ATOM 1201 N ARG A 81 -8.443 -4.701 15.248 1.00 0.00 N ATOM 1202 CA ARG A 81 -9.177 -5.909 15.590 1.00 0.00 C ATOM 1203 C ARG A 81 -8.986 -6.993 14.531 1.00 0.00 C ATOM 1204 O ARG A 81 -9.610 -8.051 14.591 1.00 0.00 O ATOM 1205 CB ARG A 81 -10.665 -5.588 15.754 1.00 0.00 C ATOM 1206 CG ARG A 81 -11.015 -5.019 17.120 1.00 0.00 C ATOM 1207 CD ARG A 81 -11.523 -6.101 18.056 1.00 0.00 C ATOM 1208 NE ARG A 81 -11.391 -5.718 19.462 1.00 0.00 N ATOM 1209 CZ ARG A 81 -12.413 -5.364 20.241 1.00 0.00 C ATOM 1210 NH1 ARG A 81 -13.648 -5.316 19.756 1.00 0.00 N ATOM 1211 NH2 ARG A 81 -12.196 -5.051 21.511 1.00 0.00 N ATOM 0 H ARG A 81 -9.032 -3.898 15.027 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.784 -6.289 16.533 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -10.962 -4.875 14.985 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -11.245 -6.496 15.588 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.136 -4.543 17.554 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -11.774 -4.245 17.010 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -12.570 -6.310 17.834 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -10.969 -7.023 17.878 1.00 0.00 H new ATOM 0 HE ARG A 81 -10.457 -5.722 19.872 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -13.822 -5.551 18.779 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -14.423 -5.044 20.361 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -11.249 -5.082 21.889 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -12.976 -4.780 22.110 1.00 0.00 H new ATOM 1225 N HIS A 82 -8.117 -6.721 13.564 1.00 0.00 N ATOM 1226 CA HIS A 82 -7.833 -7.658 12.493 1.00 0.00 C ATOM 1227 C HIS A 82 -6.951 -8.802 12.989 1.00 0.00 C ATOM 1228 O HIS A 82 -7.389 -9.949 13.080 1.00 0.00 O ATOM 1229 CB HIS A 82 -7.138 -6.919 11.354 1.00 0.00 C ATOM 1230 CG HIS A 82 -7.913 -6.921 10.072 1.00 0.00 C ATOM 1231 ND1 HIS A 82 -7.539 -6.188 8.966 1.00 0.00 N ATOM 1232 CD2 HIS A 82 -9.047 -7.575 9.721 1.00 0.00 C ATOM 1233 CE1 HIS A 82 -8.409 -6.388 7.992 1.00 0.00 C ATOM 1234 NE2 HIS A 82 -9.333 -7.225 8.424 1.00 0.00 N ATOM 0 H HIS A 82 -7.594 -5.848 13.504 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.771 -8.085 12.139 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -6.959 -5.888 11.658 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -6.163 -7.374 11.179 1.00 0.00 H new ATOM 0 HD1 HIS A 82 -6.718 -5.585 8.909 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -9.619 -8.246 10.345 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -8.370 -5.942 7.009 1.00 0.00 H new ATOM 1243 N MET A 83 -5.699 -8.476 13.304 1.00 0.00 N ATOM 1244 CA MET A 83 -4.736 -9.463 13.787 1.00 0.00 C ATOM 1245 C MET A 83 -4.673 -10.678 12.853 1.00 0.00 C ATOM 1246 O MET A 83 -3.962 -10.651 11.848 1.00 0.00 O ATOM 1247 CB MET A 83 -5.078 -9.878 15.227 1.00 0.00 C ATOM 1248 CG MET A 83 -3.865 -10.311 16.035 1.00 0.00 C ATOM 1249 SD MET A 83 -3.490 -9.179 17.389 1.00 0.00 S ATOM 1250 CE MET A 83 -3.971 -10.169 18.803 1.00 0.00 C ATOM 0 H MET A 83 -5.326 -7.529 13.233 1.00 0.00 H new ATOM 0 HA MET A 83 -3.746 -9.008 13.790 1.00 0.00 H new ATOM 0 HB2 MET A 83 -5.563 -9.043 15.733 1.00 0.00 H new ATOM 0 HB3 MET A 83 -5.798 -10.696 15.200 1.00 0.00 H new ATOM 0 HG2 MET A 83 -4.040 -11.308 16.439 1.00 0.00 H new ATOM 0 HG3 MET A 83 -3.000 -10.381 15.375 1.00 0.00 H new ATOM 0 HE1 MET A 83 -3.798 -9.604 19.719 1.00 0.00 H new ATOM 0 HE2 MET A 83 -5.029 -10.422 18.727 1.00 0.00 H new ATOM 0 HE3 MET A 83 -3.380 -11.084 18.824 1.00 0.00 H new ATOM 1260 N ASN A 84 -5.415 -11.737 13.175 1.00 0.00 N ATOM 1261 CA ASN A 84 -5.428 -12.940 12.348 1.00 0.00 C ATOM 1262 C ASN A 84 -6.813 -13.163 11.747 1.00 0.00 C ATOM 1263 O ASN A 84 -7.260 -14.300 11.595 1.00 0.00 O ATOM 1264 CB ASN A 84 -5.006 -14.158 13.174 1.00 0.00 C ATOM 1265 CG ASN A 84 -3.764 -14.828 12.620 1.00 0.00 C ATOM 1266 OD1 ASN A 84 -2.736 -14.182 12.416 1.00 0.00 O ATOM 1267 ND2 ASN A 84 -3.851 -16.130 12.374 1.00 0.00 N ATOM 0 H ASN A 84 -6.013 -11.785 14.000 1.00 0.00 H new ATOM 0 HA ASN A 84 -4.716 -12.805 11.534 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -4.821 -13.850 14.203 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -5.824 -14.878 13.199 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -3.046 -16.633 12.001 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.723 -16.627 12.558 1.00 0.00 H new ATOM 1274 N VAL A 85 -7.485 -12.067 11.411 1.00 0.00 N ATOM 1275 CA VAL A 85 -8.822 -12.135 10.831 1.00 0.00 C ATOM 1276 C VAL A 85 -8.921 -11.263 9.585 1.00 0.00 C ATOM 1277 O VAL A 85 -8.250 -10.211 9.545 1.00 0.00 O ATOM 1278 CB VAL A 85 -9.894 -11.693 11.847 1.00 0.00 C ATOM 1279 CG1 VAL A 85 -11.290 -11.856 11.264 1.00 0.00 C ATOM 1280 CG2 VAL A 85 -9.753 -12.474 13.145 1.00 0.00 C ATOM 1281 OXT VAL A 85 -9.670 -11.640 8.660 1.00 0.00 O ATOM 0 H VAL A 85 -7.126 -11.120 11.530 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.001 -13.175 10.557 1.00 0.00 H new ATOM 0 HB VAL A 85 -9.743 -10.636 12.067 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -12.030 -11.538 11.998 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -11.383 -11.244 10.367 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -11.458 -12.902 11.009 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -10.518 -12.149 13.850 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -9.874 -13.538 12.944 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -8.766 -12.295 13.572 1.00 0.00 H new TER 1291 VAL A 85