USER MOD reduce.3.24.130724 H: found=0, std=0, add=488, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 486 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 63 GLN : amide:sc= -0.998 X(o=-1,f=-1.1) USER MOD Set 1.2: A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0712 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.0589 USER MOD Single : A 16 ASN : amide:sc= -0.146 X(o=-0.15,f=-0.57) USER MOD Single : A 17 TYR OH : rot 161:sc= 0.42 USER MOD Single : A 18 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0157) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.141 K(o=-0.14,f=-2!) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 49:sc= 0.904 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= -0.424 K(o=-0.42,f=-1.6!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= -0.569 USER MOD Single : A 48 THR OG1 : rot -75:sc= 1.36 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.536 K(o=-0.54,f=-4.6!) USER MOD Single : A 58 THR OG1 : rot 108:sc= -0.566 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.109 K(o=-0.11,f=-2.2) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.994 -11.454 -20.019 1.00 0.00 N ATOM 2 CA GLY A 1 15.618 -11.461 -19.557 1.00 0.00 C ATOM 3 C GLY A 1 14.870 -12.709 -19.982 1.00 0.00 C ATOM 4 O GLY A 1 15.337 -13.460 -20.838 1.00 0.00 O ATOM 0 H1 GLY A 1 17.634 -11.371 -19.203 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.194 -12.339 -20.527 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.142 -10.647 -20.658 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.603 -11.385 -18.470 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.103 -10.582 -19.946 1.00 0.00 H new ATOM 8 N SER A 2 13.706 -12.933 -19.380 1.00 0.00 N ATOM 9 CA SER A 2 12.894 -14.102 -19.697 1.00 0.00 C ATOM 10 C SER A 2 11.408 -13.762 -19.643 1.00 0.00 C ATOM 11 O SER A 2 11.011 -12.752 -19.062 1.00 0.00 O ATOM 12 CB SER A 2 13.203 -15.242 -18.725 1.00 0.00 C ATOM 13 OG SER A 2 13.429 -14.749 -17.416 1.00 0.00 O ATOM 0 H SER A 2 13.304 -12.320 -18.670 1.00 0.00 H new ATOM 0 HA SER A 2 13.140 -14.421 -20.710 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.373 -15.948 -18.713 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.082 -15.788 -19.068 1.00 0.00 H new ATOM 0 HG SER A 2 13.623 -15.497 -16.814 1.00 0.00 H new ATOM 19 N SER A 3 10.590 -14.614 -20.253 1.00 0.00 N ATOM 20 CA SER A 3 9.147 -14.403 -20.279 1.00 0.00 C ATOM 21 C SER A 3 8.476 -15.090 -19.094 1.00 0.00 C ATOM 22 O SER A 3 7.710 -16.037 -19.263 1.00 0.00 O ATOM 23 CB SER A 3 8.557 -14.929 -21.589 1.00 0.00 C ATOM 24 OG SER A 3 7.189 -14.578 -21.709 1.00 0.00 O ATOM 0 H SER A 3 10.902 -15.457 -20.736 1.00 0.00 H new ATOM 0 HA SER A 3 8.960 -13.331 -20.209 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.115 -14.522 -22.432 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.663 -16.013 -21.630 1.00 0.00 H new ATOM 0 HG SER A 3 6.835 -14.924 -22.555 1.00 0.00 H new ATOM 30 N GLY A 4 8.772 -14.606 -17.891 1.00 0.00 N ATOM 31 CA GLY A 4 8.190 -15.184 -16.695 1.00 0.00 C ATOM 32 C GLY A 4 6.869 -14.541 -16.322 1.00 0.00 C ATOM 33 O GLY A 4 6.782 -13.320 -16.190 1.00 0.00 O ATOM 0 H GLY A 4 9.405 -13.824 -17.724 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.040 -16.253 -16.848 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.890 -15.076 -15.866 1.00 0.00 H new ATOM 37 N SER A 5 5.839 -15.363 -16.154 1.00 0.00 N ATOM 38 CA SER A 5 4.514 -14.866 -15.801 1.00 0.00 C ATOM 39 C SER A 5 3.867 -15.751 -14.739 1.00 0.00 C ATOM 40 O SER A 5 4.091 -16.961 -14.704 1.00 0.00 O ATOM 41 CB SER A 5 3.622 -14.803 -17.041 1.00 0.00 C ATOM 42 OG SER A 5 2.255 -14.693 -16.682 1.00 0.00 O ATOM 0 H SER A 5 5.896 -16.376 -16.257 1.00 0.00 H new ATOM 0 HA SER A 5 4.627 -13.862 -15.393 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.909 -13.950 -17.656 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.771 -15.697 -17.646 1.00 0.00 H new ATOM 0 HG SER A 5 1.706 -14.653 -17.493 1.00 0.00 H new ATOM 48 N SER A 6 3.064 -15.138 -13.876 1.00 0.00 N ATOM 49 CA SER A 6 2.387 -15.868 -12.811 1.00 0.00 C ATOM 50 C SER A 6 0.877 -15.658 -12.883 1.00 0.00 C ATOM 51 O SER A 6 0.125 -16.579 -13.197 1.00 0.00 O ATOM 52 CB SER A 6 2.911 -15.422 -11.445 1.00 0.00 C ATOM 53 OG SER A 6 4.255 -15.830 -11.256 1.00 0.00 O ATOM 0 H SER A 6 2.866 -14.138 -13.893 1.00 0.00 H new ATOM 0 HA SER A 6 2.595 -16.930 -12.943 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.842 -14.337 -11.362 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.286 -15.842 -10.657 1.00 0.00 H new ATOM 0 HG SER A 6 4.567 -15.531 -10.376 1.00 0.00 H new ATOM 59 N GLY A 7 0.441 -14.437 -12.587 1.00 0.00 N ATOM 60 CA GLY A 7 -0.976 -14.126 -12.624 1.00 0.00 C ATOM 61 C GLY A 7 -1.438 -13.383 -11.386 1.00 0.00 C ATOM 62 O GLY A 7 -2.442 -13.748 -10.773 1.00 0.00 O ATOM 0 H GLY A 7 1.044 -13.658 -12.322 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.190 -13.523 -13.507 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.545 -15.050 -12.723 1.00 0.00 H new ATOM 66 N LEU A 8 -0.704 -12.339 -11.016 1.00 0.00 N ATOM 67 CA LEU A 8 -1.044 -11.543 -9.842 1.00 0.00 C ATOM 68 C LEU A 8 -2.370 -10.817 -10.041 1.00 0.00 C ATOM 69 O LEU A 8 -2.780 -10.552 -11.171 1.00 0.00 O ATOM 70 CB LEU A 8 0.066 -10.532 -9.548 1.00 0.00 C ATOM 71 CG LEU A 8 1.464 -11.113 -9.334 1.00 0.00 C ATOM 72 CD1 LEU A 8 2.456 -10.008 -9.007 1.00 0.00 C ATOM 73 CD2 LEU A 8 1.443 -12.158 -8.229 1.00 0.00 C ATOM 0 H LEU A 8 0.130 -12.024 -11.512 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.146 -12.219 -8.993 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.112 -9.823 -10.374 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.211 -9.967 -8.658 1.00 0.00 H new ATOM 0 HG LEU A 8 1.782 -11.597 -10.258 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.446 -10.440 -8.858 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.491 -9.295 -9.831 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.143 -9.496 -8.097 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.446 -12.561 -8.090 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.105 -11.699 -7.300 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.763 -12.964 -8.504 1.00 0.00 H new ATOM 85 N GLU A 9 -3.035 -10.495 -8.935 1.00 0.00 N ATOM 86 CA GLU A 9 -4.314 -9.798 -8.990 1.00 0.00 C ATOM 87 C GLU A 9 -4.111 -8.286 -8.970 1.00 0.00 C ATOM 88 O GLU A 9 -3.355 -7.762 -8.152 1.00 0.00 O ATOM 89 CB GLU A 9 -5.201 -10.220 -7.816 1.00 0.00 C ATOM 90 CG GLU A 9 -5.761 -11.626 -7.952 1.00 0.00 C ATOM 91 CD GLU A 9 -6.965 -11.862 -7.060 1.00 0.00 C ATOM 92 OE1 GLU A 9 -8.010 -11.218 -7.292 1.00 0.00 O ATOM 93 OE2 GLU A 9 -6.862 -12.690 -6.131 1.00 0.00 O ATOM 0 H GLU A 9 -2.709 -10.706 -7.992 1.00 0.00 H new ATOM 0 HA GLU A 9 -4.806 -10.069 -9.924 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.624 -10.155 -6.894 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -6.028 -9.516 -7.725 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -6.042 -11.802 -8.990 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -4.983 -12.349 -7.705 1.00 0.00 H new ATOM 100 N GLN A 10 -4.791 -7.591 -9.876 1.00 0.00 N ATOM 101 CA GLN A 10 -4.684 -6.139 -9.963 1.00 0.00 C ATOM 102 C GLN A 10 -5.816 -5.463 -9.197 1.00 0.00 C ATOM 103 O GLN A 10 -6.993 -5.687 -9.482 1.00 0.00 O ATOM 104 CB GLN A 10 -4.703 -5.692 -11.426 1.00 0.00 C ATOM 105 CG GLN A 10 -3.490 -6.150 -12.218 1.00 0.00 C ATOM 106 CD GLN A 10 -3.674 -5.987 -13.714 1.00 0.00 C ATOM 107 OE1 GLN A 10 -4.175 -6.885 -14.391 1.00 0.00 O ATOM 108 NE2 GLN A 10 -3.268 -4.836 -14.239 1.00 0.00 N ATOM 0 H GLN A 10 -5.422 -8.009 -10.560 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.737 -5.842 -9.512 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.604 -6.077 -11.903 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.762 -4.604 -11.464 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.617 -5.581 -11.899 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -3.288 -7.197 -11.993 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.858 -4.119 -13.641 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -3.366 -4.669 -15.241 1.00 0.00 H new ATOM 117 N TYR A 11 -5.453 -4.635 -8.224 1.00 0.00 N ATOM 118 CA TYR A 11 -6.439 -3.928 -7.415 1.00 0.00 C ATOM 119 C TYR A 11 -6.452 -2.440 -7.750 1.00 0.00 C ATOM 120 O TYR A 11 -5.445 -1.880 -8.185 1.00 0.00 O ATOM 121 CB TYR A 11 -6.143 -4.124 -5.927 1.00 0.00 C ATOM 122 CG TYR A 11 -6.804 -5.348 -5.335 1.00 0.00 C ATOM 123 CD1 TYR A 11 -6.486 -6.622 -5.790 1.00 0.00 C ATOM 124 CD2 TYR A 11 -7.745 -5.231 -4.319 1.00 0.00 C ATOM 125 CE1 TYR A 11 -7.088 -7.743 -5.252 1.00 0.00 C ATOM 126 CE2 TYR A 11 -8.350 -6.347 -3.774 1.00 0.00 C ATOM 127 CZ TYR A 11 -8.019 -7.601 -4.244 1.00 0.00 C ATOM 128 OH TYR A 11 -8.620 -8.715 -3.705 1.00 0.00 O ATOM 0 H TYR A 11 -4.484 -4.437 -7.976 1.00 0.00 H new ATOM 0 HA TYR A 11 -7.422 -4.342 -7.641 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -5.065 -4.200 -5.786 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -6.475 -3.242 -5.380 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -5.756 -6.738 -6.577 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.008 -4.251 -3.949 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -6.831 -8.726 -5.619 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -9.078 -6.238 -2.984 1.00 0.00 H new ATOM 0 HH TYR A 11 -9.249 -8.441 -3.005 1.00 0.00 H new ATOM 138 N VAL A 12 -7.601 -1.804 -7.544 1.00 0.00 N ATOM 139 CA VAL A 12 -7.747 -0.380 -7.822 1.00 0.00 C ATOM 140 C VAL A 12 -7.870 0.422 -6.531 1.00 0.00 C ATOM 141 O VAL A 12 -8.578 0.026 -5.606 1.00 0.00 O ATOM 142 CB VAL A 12 -8.980 -0.104 -8.704 1.00 0.00 C ATOM 143 CG1 VAL A 12 -10.260 -0.426 -7.948 1.00 0.00 C ATOM 144 CG2 VAL A 12 -8.981 1.341 -9.180 1.00 0.00 C ATOM 0 H VAL A 12 -8.444 -2.252 -7.186 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.850 -0.068 -8.356 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.931 -0.751 -9.580 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -11.120 -0.225 -8.587 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -10.259 -1.478 -7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -10.320 0.194 -7.053 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.859 1.519 -9.802 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.006 2.008 -8.318 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.079 1.533 -9.762 1.00 0.00 H new ATOM 154 N VAL A 13 -7.174 1.554 -6.477 1.00 0.00 N ATOM 155 CA VAL A 13 -7.206 2.414 -5.300 1.00 0.00 C ATOM 156 C VAL A 13 -8.572 3.071 -5.135 1.00 0.00 C ATOM 157 O VAL A 13 -9.267 3.337 -6.116 1.00 0.00 O ATOM 158 CB VAL A 13 -6.127 3.511 -5.378 1.00 0.00 C ATOM 159 CG1 VAL A 13 -6.054 4.282 -4.068 1.00 0.00 C ATOM 160 CG2 VAL A 13 -4.776 2.905 -5.725 1.00 0.00 C ATOM 0 H VAL A 13 -6.582 1.896 -7.234 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.006 1.778 -4.438 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.400 4.210 -6.169 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -5.287 5.053 -4.142 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.018 4.748 -3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.805 3.598 -3.257 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.026 3.694 -5.776 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.493 2.184 -4.958 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.840 2.402 -6.690 1.00 0.00 H new ATOM 170 N VAL A 14 -8.951 3.331 -3.888 1.00 0.00 N ATOM 171 CA VAL A 14 -10.234 3.958 -3.594 1.00 0.00 C ATOM 172 C VAL A 14 -10.042 5.342 -2.984 1.00 0.00 C ATOM 173 O VAL A 14 -10.913 6.205 -3.090 1.00 0.00 O ATOM 174 CB VAL A 14 -11.073 3.097 -2.631 1.00 0.00 C ATOM 175 CG1 VAL A 14 -11.545 1.827 -3.324 1.00 0.00 C ATOM 176 CG2 VAL A 14 -10.273 2.766 -1.380 1.00 0.00 C ATOM 0 H VAL A 14 -8.388 3.117 -3.065 1.00 0.00 H new ATOM 0 HA VAL A 14 -10.765 4.051 -4.542 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.953 3.667 -2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -12.136 1.231 -2.629 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -12.156 2.089 -4.187 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.681 1.250 -3.653 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.880 2.157 -0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.375 2.214 -1.658 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.990 3.689 -0.874 1.00 0.00 H new ATOM 186 N SER A 15 -8.895 5.547 -2.346 1.00 0.00 N ATOM 187 CA SER A 15 -8.589 6.826 -1.715 1.00 0.00 C ATOM 188 C SER A 15 -7.090 7.108 -1.757 1.00 0.00 C ATOM 189 O SER A 15 -6.278 6.191 -1.876 1.00 0.00 O ATOM 190 CB SER A 15 -9.080 6.835 -0.266 1.00 0.00 C ATOM 191 OG SER A 15 -8.648 8.002 0.412 1.00 0.00 O ATOM 0 H SER A 15 -8.162 4.844 -2.252 1.00 0.00 H new ATOM 0 HA SER A 15 -9.105 7.609 -2.271 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.169 6.782 -0.247 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.709 5.951 0.253 1.00 0.00 H new ATOM 0 HG SER A 15 -8.976 7.984 1.335 1.00 0.00 H new ATOM 197 N ASN A 16 -6.731 8.384 -1.658 1.00 0.00 N ATOM 198 CA ASN A 16 -5.330 8.788 -1.686 1.00 0.00 C ATOM 199 C ASN A 16 -4.602 8.312 -0.432 1.00 0.00 C ATOM 200 O ASN A 16 -5.189 8.232 0.647 1.00 0.00 O ATOM 201 CB ASN A 16 -5.219 10.309 -1.807 1.00 0.00 C ATOM 202 CG ASN A 16 -6.079 11.035 -0.791 1.00 0.00 C ATOM 203 OD1 ASN A 16 -7.237 11.357 -1.058 1.00 0.00 O ATOM 204 ND2 ASN A 16 -5.515 11.296 0.383 1.00 0.00 N ATOM 0 H ASN A 16 -7.391 9.156 -1.558 1.00 0.00 H new ATOM 0 HA ASN A 16 -4.861 8.326 -2.555 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.178 10.606 -1.676 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -5.513 10.613 -2.811 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -6.045 11.782 1.107 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.552 11.011 0.561 1.00 0.00 H new ATOM 211 N TYR A 17 -3.320 7.998 -0.582 1.00 0.00 N ATOM 212 CA TYR A 17 -2.512 7.529 0.537 1.00 0.00 C ATOM 213 C TYR A 17 -1.214 8.324 0.642 1.00 0.00 C ATOM 214 O TYR A 17 -0.709 8.848 -0.351 1.00 0.00 O ATOM 215 CB TYR A 17 -2.199 6.040 0.378 1.00 0.00 C ATOM 216 CG TYR A 17 -1.803 5.363 1.671 1.00 0.00 C ATOM 217 CD1 TYR A 17 -2.759 4.788 2.498 1.00 0.00 C ATOM 218 CD2 TYR A 17 -0.472 5.299 2.064 1.00 0.00 C ATOM 219 CE1 TYR A 17 -2.401 4.170 3.681 1.00 0.00 C ATOM 220 CE2 TYR A 17 -0.105 4.681 3.244 1.00 0.00 C ATOM 221 CZ TYR A 17 -1.073 4.118 4.049 1.00 0.00 C ATOM 222 OH TYR A 17 -0.712 3.502 5.225 1.00 0.00 O ATOM 0 H TYR A 17 -2.818 8.060 -1.468 1.00 0.00 H new ATOM 0 HA TYR A 17 -3.084 7.678 1.453 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -3.073 5.535 -0.034 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.393 5.922 -0.346 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -3.800 4.824 2.212 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.289 5.740 1.437 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -3.157 3.730 4.314 1.00 0.00 H new ATOM 0 HE2 TYR A 17 0.934 4.639 3.534 1.00 0.00 H new ATOM 0 HH TYR A 17 0.242 3.280 5.199 1.00 0.00 H new ATOM 232 N LYS A 18 -0.677 8.409 1.855 1.00 0.00 N ATOM 233 CA LYS A 18 0.563 9.137 2.094 1.00 0.00 C ATOM 234 C LYS A 18 1.709 8.177 2.394 1.00 0.00 C ATOM 235 O LYS A 18 1.538 7.197 3.120 1.00 0.00 O ATOM 236 CB LYS A 18 0.387 10.117 3.256 1.00 0.00 C ATOM 237 CG LYS A 18 1.378 11.268 3.237 1.00 0.00 C ATOM 238 CD LYS A 18 1.074 12.246 2.114 1.00 0.00 C ATOM 239 CE LYS A 18 1.769 13.581 2.334 1.00 0.00 C ATOM 240 NZ LYS A 18 1.072 14.407 3.359 1.00 0.00 N ATOM 0 H LYS A 18 -1.082 7.982 2.688 1.00 0.00 H new ATOM 0 HA LYS A 18 0.807 9.695 1.190 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -0.625 10.520 3.230 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.490 9.575 4.196 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.349 11.790 4.193 1.00 0.00 H new ATOM 0 HG3 LYS A 18 2.389 10.878 3.117 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.394 11.820 1.163 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -0.003 12.402 2.047 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.799 13.407 2.646 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.810 14.129 1.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.504 15.352 3.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 0.066 14.495 3.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 1.158 13.951 4.290 1.00 0.00 H new ATOM 254 N LYS A 19 2.879 8.465 1.833 1.00 0.00 N ATOM 255 CA LYS A 19 4.055 7.628 2.042 1.00 0.00 C ATOM 256 C LYS A 19 4.982 8.245 3.084 1.00 0.00 C ATOM 257 O LYS A 19 6.194 8.316 2.884 1.00 0.00 O ATOM 258 CB LYS A 19 4.808 7.434 0.725 1.00 0.00 C ATOM 259 CG LYS A 19 5.348 8.726 0.136 1.00 0.00 C ATOM 260 CD LYS A 19 5.718 8.559 -1.328 1.00 0.00 C ATOM 261 CE LYS A 19 7.155 8.090 -1.491 1.00 0.00 C ATOM 262 NZ LYS A 19 7.753 8.565 -2.769 1.00 0.00 N ATOM 0 H LYS A 19 3.038 9.272 1.230 1.00 0.00 H new ATOM 0 HA LYS A 19 3.720 6.657 2.408 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.637 6.745 0.888 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.142 6.965 0.001 1.00 0.00 H new ATOM 0 HG2 LYS A 19 4.600 9.513 0.236 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.224 9.046 0.700 1.00 0.00 H new ATOM 0 HD2 LYS A 19 5.045 7.840 -1.795 1.00 0.00 H new ATOM 0 HD3 LYS A 19 5.583 9.507 -1.849 1.00 0.00 H new ATOM 0 HE2 LYS A 19 7.752 8.452 -0.654 1.00 0.00 H new ATOM 0 HE3 LYS A 19 7.187 7.001 -1.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 8.733 8.224 -2.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 7.199 8.199 -3.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 7.746 9.605 -2.790 1.00 0.00 H new ATOM 276 N GLN A 20 4.404 8.687 4.197 1.00 0.00 N ATOM 277 CA GLN A 20 5.181 9.297 5.270 1.00 0.00 C ATOM 278 C GLN A 20 6.251 8.337 5.780 1.00 0.00 C ATOM 279 O GLN A 20 7.314 8.762 6.231 1.00 0.00 O ATOM 280 CB GLN A 20 4.262 9.713 6.420 1.00 0.00 C ATOM 281 CG GLN A 20 3.497 10.999 6.152 1.00 0.00 C ATOM 282 CD GLN A 20 2.225 11.103 6.971 1.00 0.00 C ATOM 283 OE1 GLN A 20 1.856 10.172 7.686 1.00 0.00 O ATOM 284 NE2 GLN A 20 1.547 12.241 6.870 1.00 0.00 N ATOM 0 H GLN A 20 3.402 8.634 4.379 1.00 0.00 H new ATOM 0 HA GLN A 20 5.674 10.183 4.870 1.00 0.00 H new ATOM 0 HB2 GLN A 20 3.550 8.910 6.614 1.00 0.00 H new ATOM 0 HB3 GLN A 20 4.858 9.836 7.324 1.00 0.00 H new ATOM 0 HG2 GLN A 20 4.138 11.852 6.374 1.00 0.00 H new ATOM 0 HG3 GLN A 20 3.248 11.055 5.092 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.890 12.987 6.265 1.00 0.00 H new ATOM 0 HE22 GLN A 20 0.684 12.369 7.398 1.00 0.00 H new ATOM 293 N GLU A 21 5.961 7.042 5.707 1.00 0.00 N ATOM 294 CA GLU A 21 6.899 6.023 6.163 1.00 0.00 C ATOM 295 C GLU A 21 7.939 5.720 5.088 1.00 0.00 C ATOM 296 O GLU A 21 7.755 6.057 3.920 1.00 0.00 O ATOM 297 CB GLU A 21 6.151 4.742 6.540 1.00 0.00 C ATOM 298 CG GLU A 21 6.944 3.821 7.451 1.00 0.00 C ATOM 299 CD GLU A 21 7.438 4.521 8.702 1.00 0.00 C ATOM 300 OE1 GLU A 21 6.686 4.554 9.699 1.00 0.00 O ATOM 301 OE2 GLU A 21 8.576 5.035 8.686 1.00 0.00 O ATOM 0 H GLU A 21 5.085 6.674 5.337 1.00 0.00 H new ATOM 0 HA GLU A 21 7.414 6.408 7.044 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.216 5.009 7.032 1.00 0.00 H new ATOM 0 HB3 GLU A 21 5.890 4.202 5.630 1.00 0.00 H new ATOM 0 HG2 GLU A 21 6.321 2.973 7.736 1.00 0.00 H new ATOM 0 HG3 GLU A 21 7.797 3.420 6.903 1.00 0.00 H new ATOM 308 N ASN A 22 9.032 5.083 5.494 1.00 0.00 N ATOM 309 CA ASN A 22 10.103 4.735 4.566 1.00 0.00 C ATOM 310 C ASN A 22 9.574 3.876 3.423 1.00 0.00 C ATOM 311 O ASN A 22 9.425 4.347 2.295 1.00 0.00 O ATOM 312 CB ASN A 22 11.222 3.994 5.301 1.00 0.00 C ATOM 313 CG ASN A 22 12.133 4.935 6.066 1.00 0.00 C ATOM 314 OD1 ASN A 22 12.080 5.006 7.294 1.00 0.00 O ATOM 315 ND2 ASN A 22 12.975 5.662 5.341 1.00 0.00 N ATOM 0 H ASN A 22 9.200 4.797 6.459 1.00 0.00 H new ATOM 0 HA ASN A 22 10.502 5.659 4.148 1.00 0.00 H new ATOM 0 HB2 ASN A 22 10.784 3.274 5.993 1.00 0.00 H new ATOM 0 HB3 ASN A 22 11.812 3.426 4.581 1.00 0.00 H new ATOM 0 HD21 ASN A 22 13.613 6.312 5.800 1.00 0.00 H new ATOM 0 HD22 ASN A 22 12.984 5.570 4.325 1.00 0.00 H new ATOM 322 N SER A 23 9.291 2.612 3.721 1.00 0.00 N ATOM 323 CA SER A 23 8.782 1.684 2.718 1.00 0.00 C ATOM 324 C SER A 23 7.278 1.862 2.527 1.00 0.00 C ATOM 325 O SER A 23 6.485 1.021 2.947 1.00 0.00 O ATOM 326 CB SER A 23 9.088 0.242 3.123 1.00 0.00 C ATOM 327 OG SER A 23 8.769 -0.661 2.078 1.00 0.00 O ATOM 0 H SER A 23 9.406 2.207 4.650 1.00 0.00 H new ATOM 0 HA SER A 23 9.280 1.901 1.773 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.144 0.149 3.378 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.520 -0.016 4.017 1.00 0.00 H new ATOM 0 HG SER A 23 8.975 -1.576 2.362 1.00 0.00 H new ATOM 333 N GLU A 24 6.895 2.965 1.890 1.00 0.00 N ATOM 334 CA GLU A 24 5.487 3.254 1.645 1.00 0.00 C ATOM 335 C GLU A 24 5.302 3.952 0.301 1.00 0.00 C ATOM 336 O GLU A 24 6.224 4.586 -0.215 1.00 0.00 O ATOM 337 CB GLU A 24 4.919 4.125 2.767 1.00 0.00 C ATOM 338 CG GLU A 24 3.437 3.904 3.019 1.00 0.00 C ATOM 339 CD GLU A 24 3.175 2.796 4.019 1.00 0.00 C ATOM 340 OE1 GLU A 24 3.919 1.793 4.004 1.00 0.00 O ATOM 341 OE2 GLU A 24 2.224 2.931 4.818 1.00 0.00 O ATOM 0 H GLU A 24 7.539 3.672 1.535 1.00 0.00 H new ATOM 0 HA GLU A 24 4.947 2.308 1.622 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.469 3.923 3.686 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.084 5.174 2.520 1.00 0.00 H new ATOM 0 HG2 GLU A 24 2.992 4.830 3.383 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.944 3.663 2.077 1.00 0.00 H new ATOM 348 N LEU A 25 4.105 3.831 -0.262 1.00 0.00 N ATOM 349 CA LEU A 25 3.797 4.450 -1.547 1.00 0.00 C ATOM 350 C LEU A 25 2.588 5.373 -1.431 1.00 0.00 C ATOM 351 O LEU A 25 1.602 5.042 -0.772 1.00 0.00 O ATOM 352 CB LEU A 25 3.532 3.375 -2.602 1.00 0.00 C ATOM 353 CG LEU A 25 4.750 2.575 -3.065 1.00 0.00 C ATOM 354 CD1 LEU A 25 4.353 1.565 -4.131 1.00 0.00 C ATOM 355 CD2 LEU A 25 5.834 3.507 -3.588 1.00 0.00 C ATOM 0 H LEU A 25 3.331 3.310 0.151 1.00 0.00 H new ATOM 0 HA LEU A 25 4.658 5.045 -1.851 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.794 2.678 -2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.083 3.852 -3.473 1.00 0.00 H new ATOM 0 HG LEU A 25 5.149 2.031 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.233 1.005 -4.448 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.613 0.877 -3.723 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.928 2.088 -4.988 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.693 2.920 -3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.446 4.080 -4.431 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.140 4.190 -2.796 1.00 0.00 H new ATOM 367 N SER A 26 2.671 6.531 -2.077 1.00 0.00 N ATOM 368 CA SER A 26 1.584 7.503 -2.046 1.00 0.00 C ATOM 369 C SER A 26 0.662 7.327 -3.249 1.00 0.00 C ATOM 370 O SER A 26 0.664 8.142 -4.172 1.00 0.00 O ATOM 371 CB SER A 26 2.145 8.927 -2.023 1.00 0.00 C ATOM 372 OG SER A 26 1.116 9.884 -2.203 1.00 0.00 O ATOM 0 H SER A 26 3.479 6.819 -2.628 1.00 0.00 H new ATOM 0 HA SER A 26 1.004 7.333 -1.139 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.651 9.107 -1.074 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.892 9.040 -2.809 1.00 0.00 H new ATOM 0 HG SER A 26 0.371 9.680 -1.600 1.00 0.00 H new ATOM 378 N LEU A 27 -0.125 6.257 -3.230 1.00 0.00 N ATOM 379 CA LEU A 27 -1.053 5.972 -4.319 1.00 0.00 C ATOM 380 C LEU A 27 -2.147 7.033 -4.395 1.00 0.00 C ATOM 381 O LEU A 27 -2.261 7.883 -3.512 1.00 0.00 O ATOM 382 CB LEU A 27 -1.681 4.590 -4.132 1.00 0.00 C ATOM 383 CG LEU A 27 -0.727 3.471 -3.712 1.00 0.00 C ATOM 384 CD1 LEU A 27 -1.481 2.160 -3.547 1.00 0.00 C ATOM 385 CD2 LEU A 27 0.396 3.318 -4.729 1.00 0.00 C ATOM 0 H LEU A 27 -0.139 5.573 -2.473 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.492 5.987 -5.254 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.469 4.669 -3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.159 4.301 -5.068 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.287 3.737 -2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.786 1.376 -3.248 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.249 2.276 -2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.950 1.888 -4.493 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.065 2.517 -4.414 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.027 3.075 -5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.954 4.252 -4.798 1.00 0.00 H new ATOM 397 N GLN A 28 -2.948 6.975 -5.453 1.00 0.00 N ATOM 398 CA GLN A 28 -4.033 7.931 -5.643 1.00 0.00 C ATOM 399 C GLN A 28 -5.325 7.218 -6.027 1.00 0.00 C ATOM 400 O GLN A 28 -5.301 6.190 -6.702 1.00 0.00 O ATOM 401 CB GLN A 28 -3.660 8.951 -6.719 1.00 0.00 C ATOM 402 CG GLN A 28 -2.798 10.092 -6.204 1.00 0.00 C ATOM 403 CD GLN A 28 -1.908 10.684 -7.279 1.00 0.00 C ATOM 404 OE1 GLN A 28 -1.138 9.972 -7.925 1.00 0.00 O ATOM 405 NE2 GLN A 28 -2.010 11.993 -7.478 1.00 0.00 N ATOM 0 H GLN A 28 -2.867 6.277 -6.192 1.00 0.00 H new ATOM 0 HA GLN A 28 -4.194 8.452 -4.699 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -3.130 8.441 -7.523 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.573 9.362 -7.150 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -3.441 10.874 -5.799 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -2.178 9.732 -5.383 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -2.661 12.545 -6.920 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.437 12.447 -8.189 1.00 0.00 H new ATOM 414 N ALA A 29 -6.452 7.772 -5.591 1.00 0.00 N ATOM 415 CA ALA A 29 -7.755 7.190 -5.891 1.00 0.00 C ATOM 416 C ALA A 29 -7.940 7.004 -7.393 1.00 0.00 C ATOM 417 O ALA A 29 -7.758 7.939 -8.172 1.00 0.00 O ATOM 418 CB ALA A 29 -8.866 8.061 -5.324 1.00 0.00 C ATOM 0 H ALA A 29 -6.489 8.623 -5.029 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.803 6.208 -5.421 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.833 7.614 -5.556 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.752 8.138 -4.243 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.811 9.055 -5.767 1.00 0.00 H new ATOM 424 N GLY A 30 -8.304 5.789 -7.794 1.00 0.00 N ATOM 425 CA GLY A 30 -8.508 5.503 -9.202 1.00 0.00 C ATOM 426 C GLY A 30 -7.315 4.808 -9.831 1.00 0.00 C ATOM 427 O GLY A 30 -7.438 4.182 -10.882 1.00 0.00 O ATOM 0 H GLY A 30 -8.461 4.998 -7.169 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.392 4.877 -9.318 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -8.705 6.434 -9.734 1.00 0.00 H new ATOM 431 N GLU A 31 -6.159 4.921 -9.185 1.00 0.00 N ATOM 432 CA GLU A 31 -4.939 4.301 -9.690 1.00 0.00 C ATOM 433 C GLU A 31 -5.035 2.779 -9.621 1.00 0.00 C ATOM 434 O GLU A 31 -5.799 2.229 -8.828 1.00 0.00 O ATOM 435 CB GLU A 31 -3.727 4.783 -8.891 1.00 0.00 C ATOM 436 CG GLU A 31 -2.436 4.797 -9.693 1.00 0.00 C ATOM 437 CD GLU A 31 -2.541 5.633 -10.953 1.00 0.00 C ATOM 438 OE1 GLU A 31 -3.096 6.750 -10.879 1.00 0.00 O ATOM 439 OE2 GLU A 31 -2.070 5.172 -12.013 1.00 0.00 O ATOM 0 H GLU A 31 -6.041 5.435 -8.312 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.817 4.594 -10.733 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.924 5.788 -8.518 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.597 4.140 -8.020 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.630 5.185 -9.070 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.168 3.775 -9.961 1.00 0.00 H new ATOM 446 N VAL A 32 -4.253 2.105 -10.459 1.00 0.00 N ATOM 447 CA VAL A 32 -4.248 0.648 -10.495 1.00 0.00 C ATOM 448 C VAL A 32 -2.890 0.093 -10.081 1.00 0.00 C ATOM 449 O VAL A 32 -1.848 0.639 -10.443 1.00 0.00 O ATOM 450 CB VAL A 32 -4.601 0.119 -11.898 1.00 0.00 C ATOM 451 CG1 VAL A 32 -4.730 -1.397 -11.881 1.00 0.00 C ATOM 452 CG2 VAL A 32 -5.882 0.765 -12.404 1.00 0.00 C ATOM 0 H VAL A 32 -3.615 2.545 -11.122 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.006 0.312 -9.788 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.793 0.383 -12.580 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.980 -1.752 -12.881 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.785 -1.839 -11.564 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.518 -1.687 -11.186 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.116 0.380 -13.396 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -6.700 0.533 -11.722 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -5.748 1.846 -12.457 1.00 0.00 H new ATOM 462 N VAL A 33 -2.909 -0.997 -9.320 1.00 0.00 N ATOM 463 CA VAL A 33 -1.679 -1.628 -8.858 1.00 0.00 C ATOM 464 C VAL A 33 -1.727 -3.139 -9.058 1.00 0.00 C ATOM 465 O VAL A 33 -2.679 -3.669 -9.630 1.00 0.00 O ATOM 466 CB VAL A 33 -1.418 -1.327 -7.370 1.00 0.00 C ATOM 467 CG1 VAL A 33 -1.371 0.174 -7.129 1.00 0.00 C ATOM 468 CG2 VAL A 33 -2.481 -1.982 -6.500 1.00 0.00 C ATOM 0 H VAL A 33 -3.763 -1.461 -9.011 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.867 -1.211 -9.454 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.449 -1.745 -7.097 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.186 0.367 -6.072 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.570 0.613 -7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.323 0.619 -7.418 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -2.281 -1.759 -5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -3.463 -1.595 -6.772 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -2.461 -3.061 -6.652 1.00 0.00 H new ATOM 478 N ASP A 34 -0.694 -3.826 -8.583 1.00 0.00 N ATOM 479 CA ASP A 34 -0.619 -5.277 -8.709 1.00 0.00 C ATOM 480 C ASP A 34 -0.242 -5.919 -7.377 1.00 0.00 C ATOM 481 O ASP A 34 0.897 -5.809 -6.923 1.00 0.00 O ATOM 482 CB ASP A 34 0.399 -5.666 -9.782 1.00 0.00 C ATOM 483 CG ASP A 34 -0.177 -5.588 -11.182 1.00 0.00 C ATOM 484 OD1 ASP A 34 -0.370 -4.460 -11.683 1.00 0.00 O ATOM 485 OD2 ASP A 34 -0.435 -6.654 -11.778 1.00 0.00 O ATOM 0 H ASP A 34 0.103 -3.402 -8.107 1.00 0.00 H new ATOM 0 HA ASP A 34 -1.603 -5.642 -9.003 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.266 -5.009 -9.712 1.00 0.00 H new ATOM 0 HB3 ASP A 34 0.752 -6.680 -9.593 1.00 0.00 H new ATOM 490 N VAL A 35 -1.207 -6.589 -6.755 1.00 0.00 N ATOM 491 CA VAL A 35 -0.977 -7.248 -5.475 1.00 0.00 C ATOM 492 C VAL A 35 0.018 -8.394 -5.618 1.00 0.00 C ATOM 493 O VAL A 35 -0.224 -9.351 -6.354 1.00 0.00 O ATOM 494 CB VAL A 35 -2.290 -7.794 -4.881 1.00 0.00 C ATOM 495 CG1 VAL A 35 -2.050 -8.367 -3.493 1.00 0.00 C ATOM 496 CG2 VAL A 35 -3.350 -6.703 -4.840 1.00 0.00 C ATOM 0 H VAL A 35 -2.155 -6.690 -7.117 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.567 -6.496 -4.801 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.652 -8.597 -5.522 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.988 -8.748 -3.089 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.325 -9.179 -3.555 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.664 -7.585 -2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.271 -7.106 -4.418 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.998 -5.877 -4.222 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.541 -6.344 -5.851 1.00 0.00 H new ATOM 506 N ILE A 36 1.137 -8.290 -4.910 1.00 0.00 N ATOM 507 CA ILE A 36 2.169 -9.318 -4.957 1.00 0.00 C ATOM 508 C ILE A 36 2.038 -10.282 -3.783 1.00 0.00 C ATOM 509 O ILE A 36 2.060 -11.499 -3.961 1.00 0.00 O ATOM 510 CB ILE A 36 3.580 -8.701 -4.945 1.00 0.00 C ATOM 511 CG1 ILE A 36 3.755 -7.751 -6.131 1.00 0.00 C ATOM 512 CG2 ILE A 36 4.637 -9.795 -4.975 1.00 0.00 C ATOM 513 CD1 ILE A 36 4.976 -6.865 -6.021 1.00 0.00 C ATOM 0 H ILE A 36 1.352 -7.504 -4.297 1.00 0.00 H new ATOM 0 HA ILE A 36 2.028 -9.864 -5.890 1.00 0.00 H new ATOM 0 HB ILE A 36 3.703 -8.130 -4.025 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.822 -8.336 -7.048 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.868 -7.124 -6.218 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.629 -9.343 -4.966 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.522 -10.436 -4.101 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.518 -10.391 -5.880 1.00 0.00 H new ATOM 0 HD11 ILE A 36 5.036 -6.218 -6.896 1.00 0.00 H new ATOM 0 HD12 ILE A 36 4.902 -6.253 -5.122 1.00 0.00 H new ATOM 0 HD13 ILE A 36 5.871 -7.484 -5.965 1.00 0.00 H new ATOM 525 N GLU A 37 1.900 -9.729 -2.582 1.00 0.00 N ATOM 526 CA GLU A 37 1.764 -10.541 -1.378 1.00 0.00 C ATOM 527 C GLU A 37 0.607 -10.045 -0.516 1.00 0.00 C ATOM 528 O GLU A 37 -0.002 -9.015 -0.805 1.00 0.00 O ATOM 529 CB GLU A 37 3.063 -10.516 -0.570 1.00 0.00 C ATOM 530 CG GLU A 37 3.982 -11.692 -0.858 1.00 0.00 C ATOM 531 CD GLU A 37 3.355 -13.024 -0.496 1.00 0.00 C ATOM 532 OE1 GLU A 37 2.739 -13.114 0.587 1.00 0.00 O ATOM 533 OE2 GLU A 37 3.481 -13.976 -1.293 1.00 0.00 O ATOM 0 H GLU A 37 1.879 -8.723 -2.417 1.00 0.00 H new ATOM 0 HA GLU A 37 1.554 -11.566 -1.683 1.00 0.00 H new ATOM 0 HB2 GLU A 37 3.596 -9.589 -0.783 1.00 0.00 H new ATOM 0 HB3 GLU A 37 2.820 -10.507 0.493 1.00 0.00 H new ATOM 0 HG2 GLU A 37 4.244 -11.693 -1.916 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.910 -11.568 -0.300 1.00 0.00 H new ATOM 540 N LYS A 38 0.307 -10.788 0.545 1.00 0.00 N ATOM 541 CA LYS A 38 -0.776 -10.426 1.451 1.00 0.00 C ATOM 542 C LYS A 38 -0.432 -10.804 2.888 1.00 0.00 C ATOM 543 O LYS A 38 -0.030 -11.933 3.164 1.00 0.00 O ATOM 544 CB LYS A 38 -2.075 -11.117 1.028 1.00 0.00 C ATOM 545 CG LYS A 38 -2.536 -10.742 -0.370 1.00 0.00 C ATOM 546 CD LYS A 38 -3.751 -11.550 -0.792 1.00 0.00 C ATOM 547 CE LYS A 38 -3.961 -11.496 -2.297 1.00 0.00 C ATOM 548 NZ LYS A 38 -5.174 -12.252 -2.716 1.00 0.00 N ATOM 0 H LYS A 38 0.799 -11.645 0.798 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.913 -9.346 1.400 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.935 -12.197 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -2.860 -10.864 1.741 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.776 -9.679 -0.402 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -1.724 -10.907 -1.078 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.627 -12.586 -0.478 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.637 -11.167 -0.286 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -4.053 -10.457 -2.614 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.086 -11.906 -2.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.282 -12.191 -3.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.075 -13.249 -2.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.013 -11.845 -2.256 1.00 0.00 H new ATOM 562 N ASN A 39 -0.595 -9.851 3.801 1.00 0.00 N ATOM 563 CA ASN A 39 -0.302 -10.085 5.210 1.00 0.00 C ATOM 564 C ASN A 39 -1.575 -10.019 6.048 1.00 0.00 C ATOM 565 O ASN A 39 -2.347 -9.066 5.948 1.00 0.00 O ATOM 566 CB ASN A 39 0.711 -9.058 5.719 1.00 0.00 C ATOM 567 CG ASN A 39 1.373 -9.491 7.013 1.00 0.00 C ATOM 568 OD1 ASN A 39 1.320 -10.662 7.389 1.00 0.00 O ATOM 569 ND2 ASN A 39 2.001 -8.545 7.702 1.00 0.00 N ATOM 0 H ASN A 39 -0.928 -8.910 3.590 1.00 0.00 H new ATOM 0 HA ASN A 39 0.124 -11.084 5.306 1.00 0.00 H new ATOM 0 HB2 ASN A 39 1.476 -8.898 4.959 1.00 0.00 H new ATOM 0 HB3 ASN A 39 0.210 -8.102 5.873 1.00 0.00 H new ATOM 0 HD21 ASN A 39 2.465 -8.777 8.581 1.00 0.00 H new ATOM 0 HD22 ASN A 39 2.020 -7.587 7.353 1.00 0.00 H new ATOM 576 N GLU A 40 -1.787 -11.038 6.875 1.00 0.00 N ATOM 577 CA GLU A 40 -2.966 -11.095 7.730 1.00 0.00 C ATOM 578 C GLU A 40 -3.111 -9.812 8.544 1.00 0.00 C ATOM 579 O GLU A 40 -4.220 -9.403 8.886 1.00 0.00 O ATOM 580 CB GLU A 40 -2.885 -12.301 8.669 1.00 0.00 C ATOM 581 CG GLU A 40 -3.390 -13.592 8.047 1.00 0.00 C ATOM 582 CD GLU A 40 -3.615 -14.685 9.073 1.00 0.00 C ATOM 583 OE1 GLU A 40 -3.467 -14.404 10.281 1.00 0.00 O ATOM 584 OE2 GLU A 40 -3.938 -15.822 8.669 1.00 0.00 O ATOM 0 H GLU A 40 -1.158 -11.835 6.971 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.842 -11.200 7.090 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.850 -12.439 8.981 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.464 -12.090 9.568 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.324 -13.396 7.520 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.671 -13.938 7.304 1.00 0.00 H new ATOM 591 N SER A 41 -1.981 -9.182 8.850 1.00 0.00 N ATOM 592 CA SER A 41 -1.981 -7.948 9.627 1.00 0.00 C ATOM 593 C SER A 41 -2.860 -6.890 8.967 1.00 0.00 C ATOM 594 O SER A 41 -3.387 -6.001 9.634 1.00 0.00 O ATOM 595 CB SER A 41 -0.554 -7.419 9.781 1.00 0.00 C ATOM 596 OG SER A 41 0.129 -8.089 10.826 1.00 0.00 O ATOM 0 H SER A 41 -1.055 -9.506 8.572 1.00 0.00 H new ATOM 0 HA SER A 41 -2.388 -8.168 10.614 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.011 -7.550 8.845 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.580 -6.349 9.987 1.00 0.00 H new ATOM 0 HG SER A 41 1.039 -7.734 10.903 1.00 0.00 H new ATOM 602 N GLY A 42 -3.012 -6.994 7.650 1.00 0.00 N ATOM 603 CA GLY A 42 -3.827 -6.041 6.920 1.00 0.00 C ATOM 604 C GLY A 42 -3.005 -5.157 6.004 1.00 0.00 C ATOM 605 O GLY A 42 -3.452 -4.083 5.600 1.00 0.00 O ATOM 0 H GLY A 42 -2.585 -7.721 7.076 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.569 -6.579 6.330 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -4.373 -5.417 7.628 1.00 0.00 H new ATOM 609 N TRP A 43 -1.799 -5.607 5.676 1.00 0.00 N ATOM 610 CA TRP A 43 -0.911 -4.848 4.803 1.00 0.00 C ATOM 611 C TRP A 43 -0.561 -5.649 3.554 1.00 0.00 C ATOM 612 O TRP A 43 0.105 -6.681 3.634 1.00 0.00 O ATOM 613 CB TRP A 43 0.366 -4.461 5.551 1.00 0.00 C ATOM 614 CG TRP A 43 0.150 -3.398 6.585 1.00 0.00 C ATOM 615 CD1 TRP A 43 -0.225 -3.584 7.885 1.00 0.00 C ATOM 616 CD2 TRP A 43 0.294 -1.985 6.404 1.00 0.00 C ATOM 617 NE1 TRP A 43 -0.322 -2.371 8.524 1.00 0.00 N ATOM 618 CE2 TRP A 43 -0.008 -1.375 7.637 1.00 0.00 C ATOM 619 CE3 TRP A 43 0.652 -1.177 5.322 1.00 0.00 C ATOM 620 CZ2 TRP A 43 0.035 0.005 7.815 1.00 0.00 C ATOM 621 CZ3 TRP A 43 0.694 0.193 5.500 1.00 0.00 C ATOM 622 CH2 TRP A 43 0.388 0.773 6.738 1.00 0.00 C ATOM 0 H TRP A 43 -1.414 -6.494 6.001 1.00 0.00 H new ATOM 0 HA TRP A 43 -1.432 -3.941 4.496 1.00 0.00 H new ATOM 0 HB2 TRP A 43 0.779 -5.347 6.032 1.00 0.00 H new ATOM 0 HB3 TRP A 43 1.108 -4.113 4.832 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -0.417 -4.543 8.343 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -0.585 -2.234 9.500 1.00 0.00 H new ATOM 0 HE3 TRP A 43 0.892 -1.615 4.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -0.202 0.454 8.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 0.968 0.828 4.670 1.00 0.00 H new ATOM 0 HH2 TRP A 43 0.431 1.847 6.845 1.00 0.00 H new ATOM 633 N TRP A 44 -1.013 -5.167 2.401 1.00 0.00 N ATOM 634 CA TRP A 44 -0.746 -5.839 1.135 1.00 0.00 C ATOM 635 C TRP A 44 0.432 -5.193 0.413 1.00 0.00 C ATOM 636 O TRP A 44 0.645 -3.985 0.511 1.00 0.00 O ATOM 637 CB TRP A 44 -1.988 -5.804 0.243 1.00 0.00 C ATOM 638 CG TRP A 44 -3.065 -6.747 0.688 1.00 0.00 C ATOM 639 CD1 TRP A 44 -3.299 -7.183 1.961 1.00 0.00 C ATOM 640 CD2 TRP A 44 -4.053 -7.371 -0.140 1.00 0.00 C ATOM 641 NE1 TRP A 44 -4.372 -8.041 1.974 1.00 0.00 N ATOM 642 CE2 TRP A 44 -4.853 -8.172 0.698 1.00 0.00 C ATOM 643 CE3 TRP A 44 -4.340 -7.329 -1.507 1.00 0.00 C ATOM 644 CZ2 TRP A 44 -5.919 -8.924 0.212 1.00 0.00 C ATOM 645 CZ3 TRP A 44 -5.398 -8.077 -1.988 1.00 0.00 C ATOM 646 CH2 TRP A 44 -6.178 -8.865 -1.131 1.00 0.00 C ATOM 0 H TRP A 44 -1.566 -4.314 2.317 1.00 0.00 H new ATOM 0 HA TRP A 44 -0.491 -6.877 1.350 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -2.387 -4.790 0.227 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -1.700 -6.049 -0.779 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -2.725 -6.896 2.830 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -4.749 -8.505 2.800 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -3.746 -6.723 -2.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -6.520 -9.532 0.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -5.628 -8.054 -3.043 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.999 -9.437 -1.538 1.00 0.00 H new ATOM 657 N PHE A 45 1.193 -6.006 -0.312 1.00 0.00 N ATOM 658 CA PHE A 45 2.350 -5.512 -1.050 1.00 0.00 C ATOM 659 C PHE A 45 2.037 -5.397 -2.539 1.00 0.00 C ATOM 660 O PHE A 45 2.249 -6.337 -3.305 1.00 0.00 O ATOM 661 CB PHE A 45 3.549 -6.440 -0.841 1.00 0.00 C ATOM 662 CG PHE A 45 4.812 -5.941 -1.482 1.00 0.00 C ATOM 663 CD1 PHE A 45 5.296 -4.675 -1.196 1.00 0.00 C ATOM 664 CD2 PHE A 45 5.516 -6.739 -2.370 1.00 0.00 C ATOM 665 CE1 PHE A 45 6.459 -4.213 -1.784 1.00 0.00 C ATOM 666 CE2 PHE A 45 6.679 -6.282 -2.960 1.00 0.00 C ATOM 667 CZ PHE A 45 7.151 -5.017 -2.668 1.00 0.00 C ATOM 0 H PHE A 45 1.030 -7.009 -0.404 1.00 0.00 H new ATOM 0 HA PHE A 45 2.595 -4.520 -0.670 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.719 -6.566 0.228 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.311 -7.424 -1.244 1.00 0.00 H new ATOM 0 HD1 PHE A 45 4.759 -4.042 -0.506 1.00 0.00 H new ATOM 0 HD2 PHE A 45 5.152 -7.729 -2.603 1.00 0.00 H new ATOM 0 HE1 PHE A 45 6.826 -3.224 -1.552 1.00 0.00 H new ATOM 0 HE2 PHE A 45 7.219 -6.914 -3.650 1.00 0.00 H new ATOM 0 HZ PHE A 45 8.059 -4.658 -3.130 1.00 0.00 H new ATOM 677 N VAL A 46 1.529 -4.236 -2.942 1.00 0.00 N ATOM 678 CA VAL A 46 1.186 -3.996 -4.339 1.00 0.00 C ATOM 679 C VAL A 46 2.364 -3.395 -5.098 1.00 0.00 C ATOM 680 O VAL A 46 3.338 -2.942 -4.497 1.00 0.00 O ATOM 681 CB VAL A 46 -0.026 -3.054 -4.465 1.00 0.00 C ATOM 682 CG1 VAL A 46 -1.218 -3.612 -3.703 1.00 0.00 C ATOM 683 CG2 VAL A 46 0.329 -1.660 -3.969 1.00 0.00 C ATOM 0 H VAL A 46 1.346 -3.448 -2.321 1.00 0.00 H new ATOM 0 HA VAL A 46 0.932 -4.963 -4.774 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.300 -2.982 -5.518 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.065 -2.933 -3.804 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.485 -4.588 -4.109 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.960 -3.716 -2.649 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.539 -1.008 -4.065 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.630 -1.712 -2.923 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.151 -1.261 -4.563 1.00 0.00 H new ATOM 693 N SER A 47 2.268 -3.395 -6.424 1.00 0.00 N ATOM 694 CA SER A 47 3.327 -2.853 -7.267 1.00 0.00 C ATOM 695 C SER A 47 2.774 -1.805 -8.228 1.00 0.00 C ATOM 696 O SER A 47 1.703 -1.982 -8.810 1.00 0.00 O ATOM 697 CB SER A 47 4.006 -3.975 -8.055 1.00 0.00 C ATOM 698 OG SER A 47 3.387 -4.159 -9.317 1.00 0.00 O ATOM 0 H SER A 47 1.468 -3.764 -6.937 1.00 0.00 H new ATOM 0 HA SER A 47 4.063 -2.376 -6.620 1.00 0.00 H new ATOM 0 HB2 SER A 47 5.061 -3.739 -8.195 1.00 0.00 H new ATOM 0 HB3 SER A 47 3.960 -4.903 -7.485 1.00 0.00 H new ATOM 0 HG SER A 47 3.840 -4.880 -9.802 1.00 0.00 H new ATOM 704 N THR A 48 3.512 -0.711 -8.390 1.00 0.00 N ATOM 705 CA THR A 48 3.097 0.367 -9.279 1.00 0.00 C ATOM 706 C THR A 48 4.151 0.636 -10.346 1.00 0.00 C ATOM 707 O THR A 48 5.278 0.149 -10.257 1.00 0.00 O ATOM 708 CB THR A 48 2.829 1.667 -8.498 1.00 0.00 C ATOM 709 OG1 THR A 48 4.066 2.235 -8.053 1.00 0.00 O ATOM 710 CG2 THR A 48 1.927 1.404 -7.301 1.00 0.00 C ATOM 0 H THR A 48 4.401 -0.548 -7.917 1.00 0.00 H new ATOM 0 HA THR A 48 2.173 0.043 -9.759 1.00 0.00 H new ATOM 0 HB THR A 48 2.326 2.368 -9.165 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.408 1.719 -7.293 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.752 2.337 -6.765 1.00 0.00 H new ATOM 0 HG22 THR A 48 0.975 0.999 -7.645 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.407 0.687 -6.634 1.00 0.00 H new ATOM 718 N SER A 49 3.778 1.416 -11.356 1.00 0.00 N ATOM 719 CA SER A 49 4.691 1.748 -12.443 1.00 0.00 C ATOM 720 C SER A 49 5.970 2.382 -11.904 1.00 0.00 C ATOM 721 O SER A 49 7.029 2.293 -12.525 1.00 0.00 O ATOM 722 CB SER A 49 4.015 2.699 -13.433 1.00 0.00 C ATOM 723 OG SER A 49 2.800 2.153 -13.915 1.00 0.00 O ATOM 0 H SER A 49 2.850 1.830 -11.444 1.00 0.00 H new ATOM 0 HA SER A 49 4.953 0.824 -12.959 1.00 0.00 H new ATOM 0 HB2 SER A 49 3.821 3.656 -12.948 1.00 0.00 H new ATOM 0 HB3 SER A 49 4.686 2.896 -14.269 1.00 0.00 H new ATOM 0 HG SER A 49 2.386 2.780 -14.544 1.00 0.00 H new ATOM 729 N GLU A 50 5.862 3.023 -10.744 1.00 0.00 N ATOM 730 CA GLU A 50 7.009 3.673 -10.122 1.00 0.00 C ATOM 731 C GLU A 50 7.800 2.683 -9.272 1.00 0.00 C ATOM 732 O GLU A 50 8.922 2.313 -9.617 1.00 0.00 O ATOM 733 CB GLU A 50 6.549 4.850 -9.258 1.00 0.00 C ATOM 734 CG GLU A 50 5.749 5.891 -10.024 1.00 0.00 C ATOM 735 CD GLU A 50 5.169 6.961 -9.120 1.00 0.00 C ATOM 736 OE1 GLU A 50 5.950 7.787 -8.602 1.00 0.00 O ATOM 737 OE2 GLU A 50 3.935 6.973 -8.929 1.00 0.00 O ATOM 0 H GLU A 50 4.993 3.106 -10.217 1.00 0.00 H new ATOM 0 HA GLU A 50 7.658 4.045 -10.915 1.00 0.00 H new ATOM 0 HB2 GLU A 50 5.943 4.471 -8.435 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.423 5.329 -8.816 1.00 0.00 H new ATOM 0 HG2 GLU A 50 6.390 6.360 -10.771 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.940 5.398 -10.563 1.00 0.00 H new ATOM 744 N GLU A 51 7.207 2.261 -8.160 1.00 0.00 N ATOM 745 CA GLU A 51 7.858 1.315 -7.260 1.00 0.00 C ATOM 746 C GLU A 51 6.826 0.457 -6.534 1.00 0.00 C ATOM 747 O GLU A 51 5.625 0.571 -6.781 1.00 0.00 O ATOM 748 CB GLU A 51 8.725 2.059 -6.243 1.00 0.00 C ATOM 749 CG GLU A 51 9.932 2.746 -6.859 1.00 0.00 C ATOM 750 CD GLU A 51 9.629 4.160 -7.315 1.00 0.00 C ATOM 751 OE1 GLU A 51 8.810 4.834 -6.656 1.00 0.00 O ATOM 752 OE2 GLU A 51 10.212 4.593 -8.331 1.00 0.00 O ATOM 0 H GLU A 51 6.278 2.558 -7.861 1.00 0.00 H new ATOM 0 HA GLU A 51 8.493 0.661 -7.858 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.114 2.804 -5.734 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.066 1.354 -5.485 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.743 2.769 -6.131 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.283 2.161 -7.709 1.00 0.00 H new ATOM 759 N GLN A 52 7.303 -0.401 -5.638 1.00 0.00 N ATOM 760 CA GLN A 52 6.422 -1.279 -4.877 1.00 0.00 C ATOM 761 C GLN A 52 6.498 -0.967 -3.386 1.00 0.00 C ATOM 762 O GLN A 52 7.573 -0.701 -2.851 1.00 0.00 O ATOM 763 CB GLN A 52 6.790 -2.743 -5.123 1.00 0.00 C ATOM 764 CG GLN A 52 7.010 -3.077 -6.590 1.00 0.00 C ATOM 765 CD GLN A 52 8.450 -2.888 -7.022 1.00 0.00 C ATOM 766 OE1 GLN A 52 8.841 -1.807 -7.464 1.00 0.00 O ATOM 767 NE2 GLN A 52 9.249 -3.942 -6.897 1.00 0.00 N ATOM 0 H GLN A 52 8.294 -0.507 -5.421 1.00 0.00 H new ATOM 0 HA GLN A 52 5.400 -1.107 -5.214 1.00 0.00 H new ATOM 0 HB2 GLN A 52 7.696 -2.980 -4.565 1.00 0.00 H new ATOM 0 HB3 GLN A 52 5.998 -3.379 -4.729 1.00 0.00 H new ATOM 0 HG2 GLN A 52 6.713 -4.110 -6.772 1.00 0.00 H new ATOM 0 HG3 GLN A 52 6.365 -2.447 -7.203 1.00 0.00 H new ATOM 0 HE21 GLN A 52 8.883 -4.819 -6.526 1.00 0.00 H new ATOM 0 HE22 GLN A 52 10.229 -3.875 -7.172 1.00 0.00 H new ATOM 776 N GLY A 53 5.348 -1.000 -2.720 1.00 0.00 N ATOM 777 CA GLY A 53 5.306 -0.718 -1.297 1.00 0.00 C ATOM 778 C GLY A 53 4.224 -1.503 -0.582 1.00 0.00 C ATOM 779 O GLY A 53 3.478 -2.256 -1.208 1.00 0.00 O ATOM 0 H GLY A 53 4.444 -1.217 -3.141 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.274 -0.953 -0.854 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.137 0.348 -1.146 1.00 0.00 H new ATOM 783 N TRP A 54 4.139 -1.328 0.731 1.00 0.00 N ATOM 784 CA TRP A 54 3.140 -2.027 1.532 1.00 0.00 C ATOM 785 C TRP A 54 2.032 -1.077 1.971 1.00 0.00 C ATOM 786 O TRP A 54 2.254 -0.183 2.788 1.00 0.00 O ATOM 787 CB TRP A 54 3.796 -2.666 2.758 1.00 0.00 C ATOM 788 CG TRP A 54 4.786 -3.737 2.411 1.00 0.00 C ATOM 789 CD1 TRP A 54 6.073 -3.559 1.990 1.00 0.00 C ATOM 790 CD2 TRP A 54 4.568 -5.151 2.454 1.00 0.00 C ATOM 791 NE1 TRP A 54 6.668 -4.777 1.769 1.00 0.00 N ATOM 792 CE2 TRP A 54 5.766 -5.770 2.047 1.00 0.00 C ATOM 793 CE3 TRP A 54 3.479 -5.956 2.799 1.00 0.00 C ATOM 794 CZ2 TRP A 54 5.902 -7.154 1.975 1.00 0.00 C ATOM 795 CZ3 TRP A 54 3.615 -7.329 2.727 1.00 0.00 C ATOM 796 CH2 TRP A 54 4.819 -7.917 2.318 1.00 0.00 C ATOM 0 H TRP A 54 4.749 -0.708 1.264 1.00 0.00 H new ATOM 0 HA TRP A 54 2.698 -2.809 0.915 1.00 0.00 H new ATOM 0 HB2 TRP A 54 4.298 -1.891 3.338 1.00 0.00 H new ATOM 0 HB3 TRP A 54 3.021 -3.090 3.396 1.00 0.00 H new ATOM 0 HD1 TRP A 54 6.552 -2.601 1.851 1.00 0.00 H new ATOM 0 HE1 TRP A 54 7.626 -4.919 1.450 1.00 0.00 H new ATOM 0 HE3 TRP A 54 2.547 -5.512 3.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 6.829 -7.609 1.660 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 2.779 -7.960 2.991 1.00 0.00 H new ATOM 0 HH2 TRP A 54 4.894 -8.993 2.273 1.00 0.00 H new ATOM 807 N VAL A 55 0.837 -1.276 1.424 1.00 0.00 N ATOM 808 CA VAL A 55 -0.308 -0.438 1.761 1.00 0.00 C ATOM 809 C VAL A 55 -1.449 -1.270 2.334 1.00 0.00 C ATOM 810 O VAL A 55 -1.559 -2.471 2.089 1.00 0.00 O ATOM 811 CB VAL A 55 -0.818 0.335 0.530 1.00 0.00 C ATOM 812 CG1 VAL A 55 0.081 1.527 0.237 1.00 0.00 C ATOM 813 CG2 VAL A 55 -0.908 -0.585 -0.677 1.00 0.00 C ATOM 0 H VAL A 55 0.636 -2.011 0.745 1.00 0.00 H new ATOM 0 HA VAL A 55 0.031 0.274 2.514 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.818 0.710 0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.295 2.061 -0.636 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.088 2.197 1.097 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.095 1.178 0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.270 -0.022 -1.537 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.079 -0.992 -0.899 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.597 -1.401 -0.462 1.00 0.00 H new ATOM 823 N PRO A 56 -2.322 -0.618 3.116 1.00 0.00 N ATOM 824 CA PRO A 56 -3.472 -1.278 3.740 1.00 0.00 C ATOM 825 C PRO A 56 -4.534 -1.677 2.722 1.00 0.00 C ATOM 826 O PRO A 56 -4.886 -0.896 1.838 1.00 0.00 O ATOM 827 CB PRO A 56 -4.019 -0.212 4.693 1.00 0.00 C ATOM 828 CG PRO A 56 -3.581 1.084 4.103 1.00 0.00 C ATOM 829 CD PRO A 56 -2.253 0.815 3.451 1.00 0.00 C ATOM 0 HA PRO A 56 -3.189 -2.207 4.235 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -5.105 -0.267 4.767 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.624 -0.342 5.701 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.307 1.446 3.375 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.490 1.852 4.872 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.110 1.429 2.562 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -1.424 1.031 4.124 1.00 0.00 H new ATOM 837 N ALA A 57 -5.042 -2.899 2.851 1.00 0.00 N ATOM 838 CA ALA A 57 -6.066 -3.400 1.943 1.00 0.00 C ATOM 839 C ALA A 57 -7.272 -2.468 1.907 1.00 0.00 C ATOM 840 O ALA A 57 -8.004 -2.420 0.917 1.00 0.00 O ATOM 841 CB ALA A 57 -6.492 -4.803 2.351 1.00 0.00 C ATOM 0 H ALA A 57 -4.761 -3.560 3.576 1.00 0.00 H new ATOM 0 HA ALA A 57 -5.640 -3.438 0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -7.257 -5.165 1.664 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -5.630 -5.469 2.318 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.894 -4.781 3.364 1.00 0.00 H new ATOM 847 N THR A 58 -7.475 -1.728 2.992 1.00 0.00 N ATOM 848 CA THR A 58 -8.594 -0.799 3.085 1.00 0.00 C ATOM 849 C THR A 58 -8.591 0.183 1.920 1.00 0.00 C ATOM 850 O THR A 58 -9.638 0.701 1.529 1.00 0.00 O ATOM 851 CB THR A 58 -8.560 -0.009 4.408 1.00 0.00 C ATOM 852 OG1 THR A 58 -7.253 0.536 4.619 1.00 0.00 O ATOM 853 CG2 THR A 58 -8.938 -0.901 5.580 1.00 0.00 C ATOM 0 H THR A 58 -6.879 -1.754 3.819 1.00 0.00 H new ATOM 0 HA THR A 58 -9.505 -1.397 3.051 1.00 0.00 H new ATOM 0 HB THR A 58 -9.285 0.802 4.341 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.278 1.507 4.488 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.907 -0.322 6.503 1.00 0.00 H new ATOM 0 HG22 THR A 58 -9.945 -1.291 5.430 1.00 0.00 H new ATOM 0 HG23 THR A 58 -8.234 -1.730 5.648 1.00 0.00 H new ATOM 861 N TYR A 59 -7.410 0.436 1.368 1.00 0.00 N ATOM 862 CA TYR A 59 -7.271 1.358 0.247 1.00 0.00 C ATOM 863 C TYR A 59 -7.164 0.600 -1.072 1.00 0.00 C ATOM 864 O TYR A 59 -6.545 1.073 -2.026 1.00 0.00 O ATOM 865 CB TYR A 59 -6.041 2.246 0.439 1.00 0.00 C ATOM 866 CG TYR A 59 -6.228 3.323 1.484 1.00 0.00 C ATOM 867 CD1 TYR A 59 -6.306 3.003 2.834 1.00 0.00 C ATOM 868 CD2 TYR A 59 -6.329 4.660 1.121 1.00 0.00 C ATOM 869 CE1 TYR A 59 -6.478 3.983 3.792 1.00 0.00 C ATOM 870 CE2 TYR A 59 -6.500 5.648 2.072 1.00 0.00 C ATOM 871 CZ TYR A 59 -6.574 5.304 3.406 1.00 0.00 C ATOM 872 OH TYR A 59 -6.746 6.284 4.356 1.00 0.00 O ATOM 0 H TYR A 59 -6.534 0.015 1.679 1.00 0.00 H new ATOM 0 HA TYR A 59 -8.162 1.985 0.213 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.193 1.622 0.721 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.790 2.715 -0.512 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.231 1.970 3.140 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.273 4.932 0.077 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -6.537 3.717 4.837 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -6.575 6.683 1.773 1.00 0.00 H new ATOM 0 HH TYR A 59 -6.794 7.159 3.918 1.00 0.00 H new ATOM 882 N LEU A 60 -7.772 -0.580 -1.120 1.00 0.00 N ATOM 883 CA LEU A 60 -7.747 -1.406 -2.322 1.00 0.00 C ATOM 884 C LEU A 60 -9.080 -2.120 -2.521 1.00 0.00 C ATOM 885 O LEU A 60 -9.661 -2.645 -1.571 1.00 0.00 O ATOM 886 CB LEU A 60 -6.614 -2.431 -2.237 1.00 0.00 C ATOM 887 CG LEU A 60 -5.230 -1.876 -1.898 1.00 0.00 C ATOM 888 CD1 LEU A 60 -4.250 -3.009 -1.636 1.00 0.00 C ATOM 889 CD2 LEU A 60 -4.726 -0.979 -3.019 1.00 0.00 C ATOM 0 H LEU A 60 -8.289 -0.987 -0.340 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.575 -0.753 -3.178 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.879 -3.174 -1.485 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.550 -2.952 -3.192 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.311 -1.278 -0.991 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.271 -2.595 -1.396 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.604 -3.610 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.172 -3.635 -2.525 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.740 -0.593 -2.761 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.660 -1.554 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.416 -0.147 -3.158 1.00 0.00 H new ATOM 901 N GLU A 61 -9.557 -2.137 -3.761 1.00 0.00 N ATOM 902 CA GLU A 61 -10.822 -2.788 -4.083 1.00 0.00 C ATOM 903 C GLU A 61 -10.657 -3.742 -5.263 1.00 0.00 C ATOM 904 O GLU A 61 -9.864 -3.493 -6.170 1.00 0.00 O ATOM 905 CB GLU A 61 -11.892 -1.743 -4.403 1.00 0.00 C ATOM 906 CG GLU A 61 -13.312 -2.239 -4.185 1.00 0.00 C ATOM 907 CD GLU A 61 -14.281 -1.115 -3.873 1.00 0.00 C ATOM 908 OE1 GLU A 61 -14.144 -0.029 -4.473 1.00 0.00 O ATOM 909 OE2 GLU A 61 -15.177 -1.323 -3.028 1.00 0.00 O ATOM 0 H GLU A 61 -9.088 -1.708 -4.559 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.137 -3.364 -3.213 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.725 -0.862 -3.783 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.781 -1.428 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.649 -2.767 -5.077 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.320 -2.958 -3.366 1.00 0.00 H new ATOM 916 N ALA A 62 -11.413 -4.835 -5.243 1.00 0.00 N ATOM 917 CA ALA A 62 -11.353 -5.825 -6.311 1.00 0.00 C ATOM 918 C ALA A 62 -12.025 -5.307 -7.578 1.00 0.00 C ATOM 919 O ALA A 62 -13.252 -5.260 -7.666 1.00 0.00 O ATOM 920 CB ALA A 62 -12.002 -7.126 -5.861 1.00 0.00 C ATOM 0 H ALA A 62 -12.074 -5.057 -4.499 1.00 0.00 H new ATOM 0 HA ALA A 62 -10.304 -6.015 -6.539 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -11.950 -7.857 -6.668 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -11.476 -7.512 -4.988 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -13.045 -6.942 -5.604 1.00 0.00 H new ATOM 926 N GLN A 63 -11.213 -4.920 -8.556 1.00 0.00 N ATOM 927 CA GLN A 63 -11.730 -4.404 -9.818 1.00 0.00 C ATOM 928 C GLN A 63 -11.801 -5.507 -10.869 1.00 0.00 C ATOM 929 O GLN A 63 -11.071 -6.495 -10.796 1.00 0.00 O ATOM 930 CB GLN A 63 -10.853 -3.258 -10.323 1.00 0.00 C ATOM 931 CG GLN A 63 -9.437 -3.685 -10.675 1.00 0.00 C ATOM 932 CD GLN A 63 -9.302 -4.130 -12.118 1.00 0.00 C ATOM 933 OE1 GLN A 63 -9.269 -5.326 -12.410 1.00 0.00 O ATOM 934 NE2 GLN A 63 -9.225 -3.168 -13.030 1.00 0.00 N ATOM 0 H GLN A 63 -10.195 -4.954 -8.499 1.00 0.00 H new ATOM 0 HA GLN A 63 -12.738 -4.029 -9.642 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -11.319 -2.815 -11.203 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -10.810 -2.481 -9.560 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -8.755 -2.855 -10.490 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -9.134 -4.500 -10.018 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -9.256 -2.190 -12.743 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -9.135 -3.407 -14.017 1.00 0.00 H new ATOM 943 N ASN A 64 -12.685 -5.332 -11.846 1.00 0.00 N ATOM 944 CA ASN A 64 -12.851 -6.313 -12.912 1.00 0.00 C ATOM 945 C ASN A 64 -13.015 -5.625 -14.264 1.00 0.00 C ATOM 946 O ASN A 64 -13.794 -4.683 -14.402 1.00 0.00 O ATOM 947 CB ASN A 64 -14.063 -7.203 -12.630 1.00 0.00 C ATOM 948 CG ASN A 64 -14.252 -8.275 -13.686 1.00 0.00 C ATOM 949 OD1 ASN A 64 -13.318 -8.622 -14.408 1.00 0.00 O ATOM 950 ND2 ASN A 64 -15.466 -8.804 -13.780 1.00 0.00 N ATOM 0 H ASN A 64 -13.297 -4.520 -11.921 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.954 -6.932 -12.945 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -13.945 -7.675 -11.655 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -14.960 -6.585 -12.579 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -15.654 -9.529 -14.472 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -16.211 -8.485 -13.160 1.00 0.00 H new ATOM 957 N SER A 65 -12.275 -6.105 -15.259 1.00 0.00 N ATOM 958 CA SER A 65 -12.336 -5.535 -16.600 1.00 0.00 C ATOM 959 C SER A 65 -12.412 -6.634 -17.655 1.00 0.00 C ATOM 960 O SER A 65 -11.885 -7.730 -17.465 1.00 0.00 O ATOM 961 CB SER A 65 -11.115 -4.649 -16.856 1.00 0.00 C ATOM 962 OG SER A 65 -10.931 -3.717 -15.805 1.00 0.00 O ATOM 0 H SER A 65 -11.627 -6.887 -15.162 1.00 0.00 H new ATOM 0 HA SER A 65 -13.238 -4.927 -16.669 1.00 0.00 H new ATOM 0 HB2 SER A 65 -10.225 -5.271 -16.955 1.00 0.00 H new ATOM 0 HB3 SER A 65 -11.239 -4.118 -17.800 1.00 0.00 H new ATOM 0 HG SER A 65 -10.144 -3.164 -15.992 1.00 0.00 H new ATOM 968 N GLY A 66 -13.072 -6.332 -18.769 1.00 0.00 N ATOM 969 CA GLY A 66 -13.206 -7.304 -19.838 1.00 0.00 C ATOM 970 C GLY A 66 -14.549 -7.219 -20.535 1.00 0.00 C ATOM 971 O GLY A 66 -15.400 -8.098 -20.399 1.00 0.00 O ATOM 0 H GLY A 66 -13.516 -5.432 -18.950 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.411 -7.149 -20.568 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.074 -8.307 -19.432 1.00 0.00 H new ATOM 975 N PRO A 67 -14.755 -6.137 -21.300 1.00 0.00 N ATOM 976 CA PRO A 67 -16.004 -5.913 -22.035 1.00 0.00 C ATOM 977 C PRO A 67 -16.177 -6.888 -23.195 1.00 0.00 C ATOM 978 O PRO A 67 -15.294 -7.699 -23.473 1.00 0.00 O ATOM 979 CB PRO A 67 -15.857 -4.482 -22.556 1.00 0.00 C ATOM 980 CG PRO A 67 -14.387 -4.256 -22.635 1.00 0.00 C ATOM 981 CD PRO A 67 -13.785 -5.049 -21.508 1.00 0.00 C ATOM 0 HA PRO A 67 -16.881 -6.064 -21.405 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -16.328 -4.366 -23.532 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -16.332 -3.766 -21.885 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -13.993 -4.584 -23.597 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.149 -3.197 -22.537 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.799 -5.434 -21.769 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.663 -4.443 -20.611 1.00 0.00 H new ATOM 989 N SER A 68 -17.319 -6.802 -23.869 1.00 0.00 N ATOM 990 CA SER A 68 -17.608 -7.678 -24.998 1.00 0.00 C ATOM 991 C SER A 68 -17.156 -7.043 -26.310 1.00 0.00 C ATOM 992 O SER A 68 -17.803 -6.132 -26.826 1.00 0.00 O ATOM 993 CB SER A 68 -19.104 -7.990 -25.058 1.00 0.00 C ATOM 994 OG SER A 68 -19.622 -8.257 -23.767 1.00 0.00 O ATOM 0 H SER A 68 -18.059 -6.134 -23.653 1.00 0.00 H new ATOM 0 HA SER A 68 -17.055 -8.607 -24.856 1.00 0.00 H new ATOM 0 HB2 SER A 68 -19.637 -7.148 -25.500 1.00 0.00 H new ATOM 0 HB3 SER A 68 -19.273 -8.850 -25.706 1.00 0.00 H new ATOM 0 HG SER A 68 -20.580 -8.452 -23.833 1.00 0.00 H new ATOM 1000 N SER A 69 -16.041 -7.531 -26.843 1.00 0.00 N ATOM 1001 CA SER A 69 -15.498 -7.009 -28.092 1.00 0.00 C ATOM 1002 C SER A 69 -15.937 -7.868 -29.275 1.00 0.00 C ATOM 1003 O SER A 69 -16.648 -8.857 -29.108 1.00 0.00 O ATOM 1004 CB SER A 69 -13.971 -6.954 -28.026 1.00 0.00 C ATOM 1005 OG SER A 69 -13.531 -5.769 -27.385 1.00 0.00 O ATOM 0 H SER A 69 -15.496 -8.287 -26.430 1.00 0.00 H new ATOM 0 HA SER A 69 -15.884 -6.000 -28.234 1.00 0.00 H new ATOM 0 HB2 SER A 69 -13.596 -7.824 -27.487 1.00 0.00 H new ATOM 0 HB3 SER A 69 -13.558 -7.001 -29.034 1.00 0.00 H new ATOM 0 HG SER A 69 -12.552 -5.758 -27.354 1.00 0.00 H new ATOM 1011 N GLY A 70 -15.506 -7.480 -30.471 1.00 0.00 N ATOM 1012 CA GLY A 70 -15.863 -8.223 -31.665 1.00 0.00 C ATOM 1013 C GLY A 70 -14.750 -9.142 -32.131 1.00 0.00 C ATOM 1014 O GLY A 70 -13.601 -8.995 -31.716 1.00 0.00 O ATOM 0 H GLY A 70 -14.916 -6.664 -30.634 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -16.758 -8.813 -31.468 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -16.111 -7.524 -32.464 1.00 0.00 H new TER 1018 GLY A 70