USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 890 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 GLN : amide:sc= -2.61! K(o=-2.6!,f=-0.028) USER MOD Set 1.2: A 102 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 30 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 33 THR OG1 : rot 180:sc= -0.0115 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 39:sc= 0.216 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 162:sc=-0.00896 (180deg=-0.148) USER MOD Single : A 31 GLN : amide:sc= -1.46! C(o=-1.5!,f=-1.5!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -177:sc= 0.0293 (180deg=0.028) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.0208 X(o=-0.021,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HE2:sc= 0.011 K(o=0.011,f=-3.8!) USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=-0.0078) USER MOD Single : A 51 HIS : no HD1:sc=-0.00476 X(o=-0.0048,f=-0.19) USER MOD Single : A 52 TYR OH : rot 110:sc= -1.1 USER MOD Single : A 53 GLN : amide:sc= -1.91! C(o=-1.9!,f=-3.5!) USER MOD Single : A 57 LYS NZ :NH3+ 164:sc= 1.16 (180deg=0.777) USER MOD Single : A 61 SER OG : rot 180:sc= -0.303 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 160:sc= -3.22! USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.00021) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 74 THR OG1 : rot 139:sc= 0.717 USER MOD Single : A 75 MET CE :methyl -132:sc= -2.15! (180deg=-5.67!) USER MOD Single : A 79 ASN : amide:sc= -2.17! K(o=-2.2!,f=-0.88) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= -1.1 X(o=-1.1,f=-0.64!) USER MOD Single : A 85 THR OG1 : rot 64:sc= 0.419 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 26:sc= -0.351 USER MOD Single : A 95 ASN : amide:sc= -7.75! C(o=-7.8!,f=-20!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0.25 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot -166:sc= 1.19 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= -0.0443 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.966 -37.424 5.661 1.00 0.00 N ATOM 2 CA GLY A 1 -17.404 -37.284 4.330 1.00 0.00 C ATOM 3 C GLY A 1 -18.388 -37.668 3.243 1.00 0.00 C ATOM 4 O GLY A 1 -18.777 -38.830 3.130 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.255 -37.150 6.369 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.800 -36.810 5.752 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.246 -38.413 5.817 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.086 -36.252 4.180 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.514 -37.908 4.247 1.00 0.00 H new ATOM 8 N SER A 2 -18.793 -36.688 2.440 1.00 0.00 N ATOM 9 CA SER A 2 -19.741 -36.927 1.360 1.00 0.00 C ATOM 10 C SER A 2 -19.449 -36.019 0.169 1.00 0.00 C ATOM 11 O SER A 2 -18.560 -35.169 0.226 1.00 0.00 O ATOM 12 CB SER A 2 -21.173 -36.700 1.849 1.00 0.00 C ATOM 13 OG SER A 2 -21.498 -37.587 2.906 1.00 0.00 O ATOM 0 H SER A 2 -18.478 -35.721 2.518 1.00 0.00 H new ATOM 0 HA SER A 2 -19.634 -37.963 1.040 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.286 -35.670 2.187 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.870 -36.843 1.023 1.00 0.00 H new ATOM 0 HG SER A 2 -22.417 -37.421 3.202 1.00 0.00 H new ATOM 19 N SER A 3 -20.205 -36.206 -0.909 1.00 0.00 N ATOM 20 CA SER A 3 -20.026 -35.407 -2.116 1.00 0.00 C ATOM 21 C SER A 3 -21.291 -35.418 -2.968 1.00 0.00 C ATOM 22 O SER A 3 -22.085 -36.356 -2.906 1.00 0.00 O ATOM 23 CB SER A 3 -18.843 -35.934 -2.930 1.00 0.00 C ATOM 24 OG SER A 3 -18.559 -35.082 -4.026 1.00 0.00 O ATOM 0 H SER A 3 -20.947 -36.903 -0.971 1.00 0.00 H new ATOM 0 HA SER A 3 -19.822 -34.379 -1.815 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.964 -36.014 -2.290 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.065 -36.937 -3.293 1.00 0.00 H new ATOM 0 HG SER A 3 -17.798 -35.439 -4.530 1.00 0.00 H new ATOM 30 N GLY A 4 -21.470 -34.369 -3.763 1.00 0.00 N ATOM 31 CA GLY A 4 -22.641 -34.276 -4.617 1.00 0.00 C ATOM 32 C GLY A 4 -22.508 -33.190 -5.666 1.00 0.00 C ATOM 33 O GLY A 4 -21.588 -32.375 -5.613 1.00 0.00 O ATOM 0 H GLY A 4 -20.826 -33.581 -3.832 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.805 -35.235 -5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.520 -34.079 -4.003 1.00 0.00 H new ATOM 37 N SER A 5 -23.430 -33.180 -6.625 1.00 0.00 N ATOM 38 CA SER A 5 -23.409 -32.189 -7.694 1.00 0.00 C ATOM 39 C SER A 5 -23.103 -30.801 -7.143 1.00 0.00 C ATOM 40 O SER A 5 -23.814 -30.295 -6.274 1.00 0.00 O ATOM 41 CB SER A 5 -24.751 -32.174 -8.430 1.00 0.00 C ATOM 42 OG SER A 5 -25.824 -31.970 -7.527 1.00 0.00 O ATOM 0 H SER A 5 -24.200 -33.847 -6.683 1.00 0.00 H new ATOM 0 HA SER A 5 -22.621 -32.464 -8.395 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.749 -31.385 -9.182 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.890 -33.117 -8.959 1.00 0.00 H new ATOM 0 HG SER A 5 -25.561 -31.312 -6.850 1.00 0.00 H new ATOM 48 N SER A 6 -22.039 -30.189 -7.654 1.00 0.00 N ATOM 49 CA SER A 6 -21.635 -28.859 -7.210 1.00 0.00 C ATOM 50 C SER A 6 -22.787 -27.868 -7.345 1.00 0.00 C ATOM 51 O SER A 6 -23.765 -28.127 -8.044 1.00 0.00 O ATOM 52 CB SER A 6 -20.432 -28.373 -8.020 1.00 0.00 C ATOM 53 OG SER A 6 -19.857 -27.218 -7.434 1.00 0.00 O ATOM 0 H SER A 6 -21.441 -30.592 -8.375 1.00 0.00 H new ATOM 0 HA SER A 6 -21.355 -28.923 -6.158 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.685 -29.165 -8.079 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.743 -28.151 -9.041 1.00 0.00 H new ATOM 0 HG SER A 6 -19.089 -26.928 -7.969 1.00 0.00 H new ATOM 59 N GLY A 7 -22.663 -26.731 -6.668 1.00 0.00 N ATOM 60 CA GLY A 7 -23.699 -25.717 -6.724 1.00 0.00 C ATOM 61 C GLY A 7 -23.134 -24.314 -6.823 1.00 0.00 C ATOM 62 O GLY A 7 -21.969 -24.084 -6.498 1.00 0.00 O ATOM 0 H GLY A 7 -21.863 -26.494 -6.081 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -24.343 -25.907 -7.583 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -24.324 -25.791 -5.834 1.00 0.00 H new ATOM 66 N GLN A 8 -23.960 -23.375 -7.274 1.00 0.00 N ATOM 67 CA GLN A 8 -23.533 -21.988 -7.417 1.00 0.00 C ATOM 68 C GLN A 8 -22.622 -21.578 -6.265 1.00 0.00 C ATOM 69 O GLN A 8 -21.784 -20.689 -6.412 1.00 0.00 O ATOM 70 CB GLN A 8 -24.749 -21.062 -7.474 1.00 0.00 C ATOM 71 CG GLN A 8 -25.374 -20.964 -8.856 1.00 0.00 C ATOM 72 CD GLN A 8 -26.631 -20.115 -8.869 1.00 0.00 C ATOM 73 OE1 GLN A 8 -27.082 -19.637 -7.828 1.00 0.00 O ATOM 74 NE2 GLN A 8 -27.206 -19.925 -10.051 1.00 0.00 N ATOM 0 H GLN A 8 -24.927 -23.549 -7.546 1.00 0.00 H new ATOM 0 HA GLN A 8 -22.973 -21.900 -8.348 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -25.500 -21.418 -6.769 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -24.452 -20.065 -7.147 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -24.647 -20.541 -9.550 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -25.613 -21.965 -9.215 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -26.798 -20.340 -10.889 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -28.055 -19.364 -10.121 1.00 0.00 H new ATOM 83 N GLU A 9 -22.790 -22.232 -5.120 1.00 0.00 N ATOM 84 CA GLU A 9 -21.982 -21.934 -3.944 1.00 0.00 C ATOM 85 C GLU A 9 -20.652 -22.680 -3.994 1.00 0.00 C ATOM 86 O GLU A 9 -20.140 -23.126 -2.966 1.00 0.00 O ATOM 87 CB GLU A 9 -22.741 -22.305 -2.669 1.00 0.00 C ATOM 88 CG GLU A 9 -23.974 -21.450 -2.422 1.00 0.00 C ATOM 89 CD GLU A 9 -24.896 -22.044 -1.375 1.00 0.00 C ATOM 90 OE1 GLU A 9 -25.756 -22.871 -1.743 1.00 0.00 O ATOM 91 OE2 GLU A 9 -24.757 -21.681 -0.188 1.00 0.00 O ATOM 0 H GLU A 9 -23.479 -22.972 -4.982 1.00 0.00 H new ATOM 0 HA GLU A 9 -21.777 -20.863 -3.937 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -23.041 -23.351 -2.726 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -22.068 -22.212 -1.816 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -23.664 -20.455 -2.104 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -24.522 -21.330 -3.357 1.00 0.00 H new ATOM 98 N TYR A 10 -20.100 -22.814 -5.194 1.00 0.00 N ATOM 99 CA TYR A 10 -18.832 -23.509 -5.379 1.00 0.00 C ATOM 100 C TYR A 10 -17.688 -22.740 -4.725 1.00 0.00 C ATOM 101 O TYR A 10 -16.916 -23.299 -3.945 1.00 0.00 O ATOM 102 CB TYR A 10 -18.544 -23.703 -6.869 1.00 0.00 C ATOM 103 CG TYR A 10 -18.968 -22.529 -7.725 1.00 0.00 C ATOM 104 CD1 TYR A 10 -18.139 -21.425 -7.882 1.00 0.00 C ATOM 105 CD2 TYR A 10 -20.196 -22.524 -8.373 1.00 0.00 C ATOM 106 CE1 TYR A 10 -18.521 -20.350 -8.662 1.00 0.00 C ATOM 107 CE2 TYR A 10 -20.586 -21.455 -9.156 1.00 0.00 C ATOM 108 CZ TYR A 10 -19.746 -20.370 -9.297 1.00 0.00 C ATOM 109 OH TYR A 10 -20.132 -19.303 -10.074 1.00 0.00 O ATOM 0 H TYR A 10 -20.511 -22.450 -6.054 1.00 0.00 H new ATOM 0 HA TYR A 10 -18.910 -24.485 -4.901 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -17.476 -23.874 -7.005 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -19.058 -24.600 -7.216 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -17.180 -21.407 -7.386 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -20.858 -23.370 -8.263 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -17.865 -19.500 -8.774 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -21.544 -21.469 -9.655 1.00 0.00 H new ATOM 0 HH TYR A 10 -21.020 -19.477 -10.450 1.00 0.00 H new ATOM 119 N ILE A 11 -17.588 -21.455 -5.048 1.00 0.00 N ATOM 120 CA ILE A 11 -16.540 -20.609 -4.490 1.00 0.00 C ATOM 121 C ILE A 11 -17.133 -19.388 -3.794 1.00 0.00 C ATOM 122 O ILE A 11 -16.722 -19.030 -2.690 1.00 0.00 O ATOM 123 CB ILE A 11 -15.558 -20.138 -5.579 1.00 0.00 C ATOM 124 CG1 ILE A 11 -14.921 -21.341 -6.278 1.00 0.00 C ATOM 125 CG2 ILE A 11 -14.487 -19.241 -4.975 1.00 0.00 C ATOM 126 CD1 ILE A 11 -14.547 -21.076 -7.719 1.00 0.00 C ATOM 0 H ILE A 11 -18.219 -20.978 -5.692 1.00 0.00 H new ATOM 0 HA ILE A 11 -16.000 -21.214 -3.762 1.00 0.00 H new ATOM 0 HB ILE A 11 -16.111 -19.562 -6.321 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.028 -21.639 -5.729 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -15.614 -22.182 -6.240 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -13.801 -18.916 -5.757 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -14.957 -18.369 -4.520 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -13.935 -19.794 -4.215 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -14.101 -21.972 -8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -15.440 -20.808 -8.283 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -13.830 -20.257 -7.764 1.00 0.00 H new ATOM 138 N LEU A 12 -18.100 -18.754 -4.445 1.00 0.00 N ATOM 139 CA LEU A 12 -18.753 -17.573 -3.888 1.00 0.00 C ATOM 140 C LEU A 12 -19.183 -17.819 -2.446 1.00 0.00 C ATOM 141 O LEU A 12 -19.411 -16.878 -1.687 1.00 0.00 O ATOM 142 CB LEU A 12 -19.966 -17.188 -4.736 1.00 0.00 C ATOM 143 CG LEU A 12 -19.667 -16.714 -6.159 1.00 0.00 C ATOM 144 CD1 LEU A 12 -20.820 -17.057 -7.090 1.00 0.00 C ATOM 145 CD2 LEU A 12 -19.393 -15.217 -6.176 1.00 0.00 C ATOM 0 H LEU A 12 -18.451 -19.037 -5.360 1.00 0.00 H new ATOM 0 HA LEU A 12 -18.036 -16.752 -3.899 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -20.632 -18.049 -4.794 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -20.510 -16.398 -4.218 1.00 0.00 H new ATOM 0 HG LEU A 12 -18.775 -17.231 -6.513 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -20.589 -16.712 -8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -20.970 -18.137 -7.101 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -21.729 -16.569 -6.739 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -19.182 -14.897 -7.197 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -20.266 -14.683 -5.801 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -18.534 -14.997 -5.542 1.00 0.00 H new ATOM 157 N ALA A 13 -19.290 -19.091 -2.074 1.00 0.00 N ATOM 158 CA ALA A 13 -19.689 -19.460 -0.722 1.00 0.00 C ATOM 159 C ALA A 13 -18.485 -19.503 0.213 1.00 0.00 C ATOM 160 O ALA A 13 -18.572 -19.098 1.373 1.00 0.00 O ATOM 161 CB ALA A 13 -20.401 -20.804 -0.731 1.00 0.00 C ATOM 0 H ALA A 13 -19.106 -19.883 -2.690 1.00 0.00 H new ATOM 0 HA ALA A 13 -20.376 -18.699 -0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -20.694 -21.068 0.285 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -21.289 -20.741 -1.360 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -19.731 -21.568 -1.125 1.00 0.00 H new ATOM 167 N LEU A 14 -17.363 -19.997 -0.298 1.00 0.00 N ATOM 168 CA LEU A 14 -16.140 -20.094 0.491 1.00 0.00 C ATOM 169 C LEU A 14 -15.316 -18.816 0.380 1.00 0.00 C ATOM 170 O LEU A 14 -14.146 -18.784 0.758 1.00 0.00 O ATOM 171 CB LEU A 14 -15.308 -21.293 0.034 1.00 0.00 C ATOM 172 CG LEU A 14 -16.048 -22.626 -0.064 1.00 0.00 C ATOM 173 CD1 LEU A 14 -15.212 -23.647 -0.820 1.00 0.00 C ATOM 174 CD2 LEU A 14 -16.398 -23.144 1.324 1.00 0.00 C ATOM 0 H LEU A 14 -17.275 -20.337 -1.256 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.421 -20.232 1.535 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -14.883 -21.064 -0.943 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -14.473 -21.414 0.724 1.00 0.00 H new ATOM 0 HG LEU A 14 -16.974 -22.466 -0.616 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -15.756 -24.590 -0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.011 -23.280 -1.826 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -14.269 -23.804 -0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -16.925 -24.094 1.236 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.484 -23.288 1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -17.036 -22.421 1.832 1.00 0.00 H new ATOM 186 N ALA A 15 -15.936 -17.762 -0.143 1.00 0.00 N ATOM 187 CA ALA A 15 -15.262 -16.479 -0.301 1.00 0.00 C ATOM 188 C ALA A 15 -15.562 -15.553 0.872 1.00 0.00 C ATOM 189 O ALA A 15 -16.675 -15.541 1.397 1.00 0.00 O ATOM 190 CB ALA A 15 -15.673 -15.825 -1.612 1.00 0.00 C ATOM 0 H ALA A 15 -16.904 -17.772 -0.464 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.187 -16.661 -0.320 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.162 -14.868 -1.717 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.401 -16.475 -2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.751 -15.663 -1.616 1.00 0.00 H new ATOM 196 N ASP A 16 -14.562 -14.778 1.278 1.00 0.00 N ATOM 197 CA ASP A 16 -14.720 -13.847 2.390 1.00 0.00 C ATOM 198 C ASP A 16 -14.159 -12.474 2.033 1.00 0.00 C ATOM 199 O ASP A 16 -14.909 -11.535 1.767 1.00 0.00 O ATOM 200 CB ASP A 16 -14.022 -14.388 3.639 1.00 0.00 C ATOM 201 CG ASP A 16 -14.924 -15.285 4.464 1.00 0.00 C ATOM 202 OD1 ASP A 16 -15.957 -14.791 4.961 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.597 -16.481 4.610 1.00 0.00 O ATOM 0 H ASP A 16 -13.634 -14.776 0.854 1.00 0.00 H new ATOM 0 HA ASP A 16 -15.785 -13.742 2.595 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -13.133 -14.945 3.342 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.684 -13.553 4.253 1.00 0.00 H new ATOM 208 N VAL A 17 -12.834 -12.365 2.030 1.00 0.00 N ATOM 209 CA VAL A 17 -12.172 -11.107 1.705 1.00 0.00 C ATOM 210 C VAL A 17 -10.683 -11.319 1.453 1.00 0.00 C ATOM 211 O VAL A 17 -10.070 -12.259 1.958 1.00 0.00 O ATOM 212 CB VAL A 17 -12.348 -10.072 2.833 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.734 -9.450 2.775 1.00 0.00 C ATOM 214 CG2 VAL A 17 -12.100 -10.716 4.190 1.00 0.00 C ATOM 0 H VAL A 17 -12.198 -13.132 2.249 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.641 -10.728 0.797 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.614 -9.279 2.693 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.840 -8.722 3.579 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -13.870 -8.953 1.815 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.488 -10.229 2.890 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.228 -9.971 4.975 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -12.810 -11.529 4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.084 -11.109 4.226 1.00 0.00 H new ATOM 224 N PRO A 18 -10.085 -10.423 0.653 1.00 0.00 N ATOM 225 CA PRO A 18 -8.660 -10.490 0.315 1.00 0.00 C ATOM 226 C PRO A 18 -7.766 -10.166 1.509 1.00 0.00 C ATOM 227 O PRO A 18 -8.078 -9.285 2.308 1.00 0.00 O ATOM 228 CB PRO A 18 -8.503 -9.427 -0.774 1.00 0.00 C ATOM 229 CG PRO A 18 -9.611 -8.463 -0.525 1.00 0.00 C ATOM 230 CD PRO A 18 -10.755 -9.277 0.016 1.00 0.00 C ATOM 0 HA PRO A 18 -8.362 -11.490 -0.001 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.531 -8.938 -0.712 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.576 -9.866 -1.769 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.308 -7.695 0.187 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.897 -7.951 -1.444 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.349 -8.709 0.732 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -11.431 -9.596 -0.777 1.00 0.00 H new ATOM 238 N SER A 19 -6.655 -10.886 1.621 1.00 0.00 N ATOM 239 CA SER A 19 -5.717 -10.677 2.718 1.00 0.00 C ATOM 240 C SER A 19 -4.904 -9.404 2.504 1.00 0.00 C ATOM 241 O SER A 19 -4.834 -8.879 1.393 1.00 0.00 O ATOM 242 CB SER A 19 -4.779 -11.878 2.852 1.00 0.00 C ATOM 243 OG SER A 19 -4.165 -11.907 4.128 1.00 0.00 O ATOM 0 H SER A 19 -6.382 -11.619 0.966 1.00 0.00 H new ATOM 0 HA SER A 19 -6.292 -10.570 3.638 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.339 -12.800 2.694 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.013 -11.833 2.078 1.00 0.00 H new ATOM 0 HG SER A 19 -3.572 -12.685 4.188 1.00 0.00 H new ATOM 249 N SER A 20 -4.290 -8.914 3.575 1.00 0.00 N ATOM 250 CA SER A 20 -3.484 -7.700 3.507 1.00 0.00 C ATOM 251 C SER A 20 -2.268 -7.906 2.608 1.00 0.00 C ATOM 252 O SER A 20 -1.640 -8.964 2.604 1.00 0.00 O ATOM 253 CB SER A 20 -3.033 -7.282 4.908 1.00 0.00 C ATOM 254 OG SER A 20 -2.418 -8.363 5.588 1.00 0.00 O ATOM 0 H SER A 20 -4.335 -9.339 4.501 1.00 0.00 H new ATOM 0 HA SER A 20 -4.099 -6.908 3.081 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.334 -6.449 4.835 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.891 -6.929 5.480 1.00 0.00 H new ATOM 0 HG SER A 20 -2.137 -8.071 6.480 1.00 0.00 H new ATOM 260 N PRO A 21 -1.928 -6.869 1.828 1.00 0.00 N ATOM 261 CA PRO A 21 -0.786 -6.910 0.911 1.00 0.00 C ATOM 262 C PRO A 21 0.549 -6.920 1.648 1.00 0.00 C ATOM 263 O PRO A 21 0.595 -6.788 2.870 1.00 0.00 O ATOM 264 CB PRO A 21 -0.938 -5.622 0.097 1.00 0.00 C ATOM 265 CG PRO A 21 -1.705 -4.703 0.982 1.00 0.00 C ATOM 266 CD PRO A 21 -2.633 -5.576 1.782 1.00 0.00 C ATOM 0 HA PRO A 21 -0.783 -7.816 0.305 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.033 -5.202 -0.164 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.468 -5.805 -0.838 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.037 -4.142 1.635 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.264 -3.973 0.396 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.802 -5.174 2.781 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.609 -5.667 1.306 1.00 0.00 H new ATOM 274 N TYR A 22 1.633 -7.076 0.896 1.00 0.00 N ATOM 275 CA TYR A 22 2.970 -7.104 1.479 1.00 0.00 C ATOM 276 C TYR A 22 3.985 -6.452 0.545 1.00 0.00 C ATOM 277 O TYR A 22 3.687 -6.170 -0.615 1.00 0.00 O ATOM 278 CB TYR A 22 3.387 -8.545 1.778 1.00 0.00 C ATOM 279 CG TYR A 22 3.241 -9.477 0.596 1.00 0.00 C ATOM 280 CD1 TYR A 22 2.049 -10.149 0.359 1.00 0.00 C ATOM 281 CD2 TYR A 22 4.297 -9.684 -0.284 1.00 0.00 C ATOM 282 CE1 TYR A 22 1.912 -11.001 -0.720 1.00 0.00 C ATOM 283 CE2 TYR A 22 4.167 -10.533 -1.367 1.00 0.00 C ATOM 284 CZ TYR A 22 2.973 -11.190 -1.579 1.00 0.00 C ATOM 285 OH TYR A 22 2.841 -12.038 -2.655 1.00 0.00 O ATOM 0 H TYR A 22 1.612 -7.185 -0.118 1.00 0.00 H new ATOM 0 HA TYR A 22 2.946 -6.539 2.411 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.425 -8.552 2.109 1.00 0.00 H new ATOM 0 HB3 TYR A 22 2.786 -8.924 2.605 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.215 -10.003 1.029 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.234 -9.173 -0.119 1.00 0.00 H new ATOM 0 HE1 TYR A 22 0.978 -11.516 -0.889 1.00 0.00 H new ATOM 0 HE2 TYR A 22 4.996 -10.681 -2.043 1.00 0.00 H new ATOM 0 HH TYR A 22 3.680 -12.058 -3.161 1.00 0.00 H new ATOM 295 N GLY A 23 5.188 -6.218 1.061 1.00 0.00 N ATOM 296 CA GLY A 23 6.230 -5.602 0.261 1.00 0.00 C ATOM 297 C GLY A 23 6.049 -4.103 0.127 1.00 0.00 C ATOM 298 O GLY A 23 6.962 -3.395 -0.298 1.00 0.00 O ATOM 0 H GLY A 23 5.459 -6.444 2.018 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.200 -5.809 0.713 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.237 -6.054 -0.731 1.00 0.00 H new ATOM 302 N VAL A 24 4.866 -3.617 0.490 1.00 0.00 N ATOM 303 CA VAL A 24 4.567 -2.192 0.408 1.00 0.00 C ATOM 304 C VAL A 24 5.762 -1.354 0.849 1.00 0.00 C ATOM 305 O VAL A 24 6.080 -1.281 2.036 1.00 0.00 O ATOM 306 CB VAL A 24 3.348 -1.823 1.274 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.393 -2.562 2.603 1.00 0.00 C ATOM 308 CG2 VAL A 24 3.285 -0.319 1.492 1.00 0.00 C ATOM 0 H VAL A 24 4.099 -4.189 0.844 1.00 0.00 H new ATOM 0 HA VAL A 24 4.340 -1.976 -0.636 1.00 0.00 H new ATOM 0 HB VAL A 24 2.444 -2.128 0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.524 -2.288 3.201 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.385 -3.637 2.422 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.302 -2.291 3.139 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.418 -0.076 2.106 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.192 0.014 1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.201 0.185 0.529 1.00 0.00 H new ATOM 318 N LYS A 25 6.421 -0.719 -0.115 1.00 0.00 N ATOM 319 CA LYS A 25 7.580 0.117 0.172 1.00 0.00 C ATOM 320 C LYS A 25 7.552 1.391 -0.666 1.00 0.00 C ATOM 321 O LYS A 25 7.078 1.388 -1.803 1.00 0.00 O ATOM 322 CB LYS A 25 8.872 -0.656 -0.100 1.00 0.00 C ATOM 323 CG LYS A 25 8.897 -1.343 -1.455 1.00 0.00 C ATOM 324 CD LYS A 25 9.476 -0.436 -2.528 1.00 0.00 C ATOM 325 CE LYS A 25 10.984 -0.601 -2.642 1.00 0.00 C ATOM 326 NZ LYS A 25 11.354 -1.900 -3.269 1.00 0.00 N ATOM 0 H LYS A 25 6.171 -0.768 -1.103 1.00 0.00 H new ATOM 0 HA LYS A 25 7.545 0.395 1.225 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.716 0.030 -0.034 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.008 -1.405 0.680 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.489 -2.256 -1.390 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.885 -1.638 -1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.010 -0.662 -3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.239 0.602 -2.295 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.395 0.218 -3.233 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.432 -0.535 -1.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.337 -1.855 -3.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.263 -2.662 -2.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.721 -2.091 -4.072 1.00 0.00 H new ATOM 340 N ILE A 26 8.065 2.479 -0.099 1.00 0.00 N ATOM 341 CA ILE A 26 8.100 3.758 -0.795 1.00 0.00 C ATOM 342 C ILE A 26 9.331 3.863 -1.691 1.00 0.00 C ATOM 343 O ILE A 26 10.459 3.950 -1.204 1.00 0.00 O ATOM 344 CB ILE A 26 8.098 4.939 0.194 1.00 0.00 C ATOM 345 CG1 ILE A 26 6.906 4.829 1.148 1.00 0.00 C ATOM 346 CG2 ILE A 26 8.061 6.260 -0.558 1.00 0.00 C ATOM 347 CD1 ILE A 26 5.574 4.715 0.440 1.00 0.00 C ATOM 0 H ILE A 26 8.462 2.499 0.840 1.00 0.00 H new ATOM 0 HA ILE A 26 7.200 3.807 -1.409 1.00 0.00 H new ATOM 0 HB ILE A 26 9.015 4.904 0.781 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.043 3.958 1.789 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.889 5.704 1.798 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.060 7.085 0.155 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.938 6.337 -1.201 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.159 6.306 -1.168 1.00 0.00 H new ATOM 0 HD11 ILE A 26 4.775 4.641 1.178 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.415 5.597 -0.180 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.571 3.825 -0.189 1.00 0.00 H new ATOM 359 N ILE A 27 9.106 3.855 -3.000 1.00 0.00 N ATOM 360 CA ILE A 27 10.196 3.952 -3.962 1.00 0.00 C ATOM 361 C ILE A 27 10.533 5.409 -4.267 1.00 0.00 C ATOM 362 O ILE A 27 11.703 5.782 -4.338 1.00 0.00 O ATOM 363 CB ILE A 27 9.852 3.231 -5.278 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.543 3.775 -5.855 1.00 0.00 C ATOM 365 CG2 ILE A 27 9.753 1.730 -5.050 1.00 0.00 C ATOM 366 CD1 ILE A 27 8.168 3.160 -7.186 1.00 0.00 C ATOM 0 H ILE A 27 8.179 3.782 -3.419 1.00 0.00 H new ATOM 0 HA ILE A 27 11.061 3.469 -3.508 1.00 0.00 H new ATOM 0 HB ILE A 27 10.650 3.417 -5.997 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.739 3.596 -5.142 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.629 4.855 -5.974 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.509 1.235 -5.990 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.707 1.355 -4.679 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.972 1.524 -4.318 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.230 3.592 -7.535 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.954 3.361 -7.914 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.050 2.083 -7.069 1.00 0.00 H new ATOM 378 N GLU A 28 9.498 6.225 -4.443 1.00 0.00 N ATOM 379 CA GLU A 28 9.685 7.640 -4.738 1.00 0.00 C ATOM 380 C GLU A 28 9.139 8.509 -3.609 1.00 0.00 C ATOM 381 O GLU A 28 7.925 8.646 -3.446 1.00 0.00 O ATOM 382 CB GLU A 28 8.996 8.004 -6.055 1.00 0.00 C ATOM 383 CG GLU A 28 9.574 7.286 -7.263 1.00 0.00 C ATOM 384 CD GLU A 28 9.454 8.099 -8.537 1.00 0.00 C ATOM 385 OE1 GLU A 28 8.503 8.901 -8.643 1.00 0.00 O ATOM 386 OE2 GLU A 28 10.313 7.933 -9.429 1.00 0.00 O ATOM 0 H GLU A 28 8.523 5.930 -4.386 1.00 0.00 H new ATOM 0 HA GLU A 28 10.755 7.827 -4.831 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.934 7.769 -5.977 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.074 9.080 -6.211 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.624 7.060 -7.078 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.061 6.333 -7.395 1.00 0.00 H new ATOM 393 N LEU A 29 10.043 9.094 -2.830 1.00 0.00 N ATOM 394 CA LEU A 29 9.653 9.949 -1.714 1.00 0.00 C ATOM 395 C LEU A 29 10.040 11.400 -1.980 1.00 0.00 C ATOM 396 O LEU A 29 11.201 11.704 -2.252 1.00 0.00 O ATOM 397 CB LEU A 29 10.308 9.463 -0.421 1.00 0.00 C ATOM 398 CG LEU A 29 9.941 10.234 0.849 1.00 0.00 C ATOM 399 CD1 LEU A 29 8.466 10.056 1.173 1.00 0.00 C ATOM 400 CD2 LEU A 29 10.804 9.780 2.017 1.00 0.00 C ATOM 0 H LEU A 29 11.051 8.992 -2.951 1.00 0.00 H new ATOM 0 HA LEU A 29 8.570 9.895 -1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.044 8.416 -0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.390 9.505 -0.547 1.00 0.00 H new ATOM 0 HG LEU A 29 10.129 11.294 0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.223 10.611 2.079 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.864 10.431 0.345 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.252 8.998 1.327 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.529 10.339 2.911 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.648 8.715 2.192 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.854 9.960 1.785 1.00 0.00 H new ATOM 412 N SER A 30 9.059 12.293 -1.897 1.00 0.00 N ATOM 413 CA SER A 30 9.296 13.714 -2.130 1.00 0.00 C ATOM 414 C SER A 30 9.035 14.522 -0.864 1.00 0.00 C ATOM 415 O SER A 30 8.738 13.964 0.192 1.00 0.00 O ATOM 416 CB SER A 30 8.405 14.221 -3.265 1.00 0.00 C ATOM 417 OG SER A 30 8.580 13.443 -4.438 1.00 0.00 O ATOM 0 H SER A 30 8.093 12.058 -1.670 1.00 0.00 H new ATOM 0 HA SER A 30 10.341 13.842 -2.413 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.361 14.187 -2.955 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.640 15.264 -3.478 1.00 0.00 H new ATOM 0 HG SER A 30 7.998 13.786 -5.148 1.00 0.00 H new ATOM 423 N GLN A 31 9.150 15.842 -0.978 1.00 0.00 N ATOM 424 CA GLN A 31 8.927 16.728 0.158 1.00 0.00 C ATOM 425 C GLN A 31 7.449 17.080 0.294 1.00 0.00 C ATOM 426 O GLN A 31 7.004 17.543 1.345 1.00 0.00 O ATOM 427 CB GLN A 31 9.755 18.006 0.004 1.00 0.00 C ATOM 428 CG GLN A 31 9.629 18.651 -1.365 1.00 0.00 C ATOM 429 CD GLN A 31 10.666 18.143 -2.348 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.331 17.676 -3.436 1.00 0.00 O ATOM 431 NE2 GLN A 31 11.935 18.232 -1.967 1.00 0.00 N ATOM 0 H GLN A 31 9.396 16.320 -1.845 1.00 0.00 H new ATOM 0 HA GLN A 31 9.241 16.205 1.061 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.445 18.723 0.764 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.803 17.775 0.192 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.632 18.459 -1.763 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.729 19.732 -1.264 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.167 18.626 -1.055 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.677 17.906 -2.586 1.00 0.00 H new ATOM 440 N THR A 32 6.692 16.855 -0.775 1.00 0.00 N ATOM 441 CA THR A 32 5.265 17.148 -0.776 1.00 0.00 C ATOM 442 C THR A 32 4.453 15.929 -1.198 1.00 0.00 C ATOM 443 O THR A 32 3.327 15.731 -0.742 1.00 0.00 O ATOM 444 CB THR A 32 4.934 18.323 -1.717 1.00 0.00 C ATOM 445 OG1 THR A 32 5.464 18.069 -3.022 1.00 0.00 O ATOM 446 CG2 THR A 32 5.502 19.626 -1.177 1.00 0.00 C ATOM 0 H THR A 32 7.044 16.470 -1.652 1.00 0.00 H new ATOM 0 HA THR A 32 4.998 17.423 0.244 1.00 0.00 H new ATOM 0 HB THR A 32 3.850 18.417 -1.778 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.248 18.819 -3.614 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.255 20.440 -1.858 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.073 19.831 -0.196 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.585 19.542 -1.089 1.00 0.00 H new ATOM 454 N THR A 33 5.033 15.112 -2.073 1.00 0.00 N ATOM 455 CA THR A 33 4.363 13.911 -2.557 1.00 0.00 C ATOM 456 C THR A 33 5.100 12.653 -2.114 1.00 0.00 C ATOM 457 O THR A 33 6.258 12.715 -1.700 1.00 0.00 O ATOM 458 CB THR A 33 4.250 13.913 -4.093 1.00 0.00 C ATOM 459 OG1 THR A 33 5.500 14.297 -4.677 1.00 0.00 O ATOM 460 CG2 THR A 33 3.155 14.862 -4.555 1.00 0.00 C ATOM 0 H THR A 33 5.965 15.260 -2.460 1.00 0.00 H new ATOM 0 HA THR A 33 3.362 13.912 -2.126 1.00 0.00 H new ATOM 0 HB THR A 33 3.994 12.904 -4.417 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.419 14.294 -5.654 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.095 14.846 -5.643 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.200 14.548 -4.134 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.385 15.873 -4.219 1.00 0.00 H new ATOM 468 N ALA A 34 4.424 11.514 -2.203 1.00 0.00 N ATOM 469 CA ALA A 34 5.016 10.241 -1.814 1.00 0.00 C ATOM 470 C ALA A 34 4.356 9.079 -2.549 1.00 0.00 C ATOM 471 O ALA A 34 3.146 8.877 -2.453 1.00 0.00 O ATOM 472 CB ALA A 34 4.905 10.045 -0.309 1.00 0.00 C ATOM 0 H ALA A 34 3.464 11.446 -2.542 1.00 0.00 H new ATOM 0 HA ALA A 34 6.070 10.260 -2.091 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.351 9.090 -0.033 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.429 10.852 0.203 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.855 10.053 -0.018 1.00 0.00 H new ATOM 478 N LYS A 35 5.159 8.319 -3.286 1.00 0.00 N ATOM 479 CA LYS A 35 4.654 7.177 -4.039 1.00 0.00 C ATOM 480 C LYS A 35 4.845 5.881 -3.256 1.00 0.00 C ATOM 481 O LYS A 35 5.910 5.640 -2.688 1.00 0.00 O ATOM 482 CB LYS A 35 5.362 7.077 -5.392 1.00 0.00 C ATOM 483 CG LYS A 35 4.710 6.095 -6.349 1.00 0.00 C ATOM 484 CD LYS A 35 5.361 6.138 -7.721 1.00 0.00 C ATOM 485 CE LYS A 35 4.696 7.169 -8.621 1.00 0.00 C ATOM 486 NZ LYS A 35 5.606 7.623 -9.709 1.00 0.00 N ATOM 0 H LYS A 35 6.163 8.474 -3.378 1.00 0.00 H new ATOM 0 HA LYS A 35 3.587 7.327 -4.205 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.383 8.063 -5.855 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.398 6.779 -5.229 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.783 5.086 -5.942 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.649 6.326 -6.441 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.420 6.374 -7.615 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.299 5.154 -8.185 1.00 0.00 H new ATOM 0 HE2 LYS A 35 3.793 6.742 -9.057 1.00 0.00 H new ATOM 0 HE3 LYS A 35 4.387 8.027 -8.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.135 8.362 -10.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.479 8.007 -9.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 5.840 6.818 -10.324 1.00 0.00 H new ATOM 500 N VAL A 36 3.808 5.050 -3.233 1.00 0.00 N ATOM 501 CA VAL A 36 3.864 3.778 -2.523 1.00 0.00 C ATOM 502 C VAL A 36 3.677 2.606 -3.479 1.00 0.00 C ATOM 503 O VAL A 36 2.695 2.546 -4.220 1.00 0.00 O ATOM 504 CB VAL A 36 2.791 3.703 -1.421 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.466 4.254 -1.926 1.00 0.00 C ATOM 506 CG2 VAL A 36 2.630 2.272 -0.931 1.00 0.00 C ATOM 0 H VAL A 36 2.919 5.235 -3.698 1.00 0.00 H new ATOM 0 HA VAL A 36 4.851 3.715 -2.064 1.00 0.00 H new ATOM 0 HB VAL A 36 3.115 4.317 -0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.721 4.192 -1.133 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.594 5.295 -2.223 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.132 3.670 -2.784 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.868 2.238 -0.153 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.329 1.635 -1.762 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.578 1.917 -0.527 1.00 0.00 H new ATOM 516 N SER A 37 4.625 1.674 -3.458 1.00 0.00 N ATOM 517 CA SER A 37 4.566 0.505 -4.327 1.00 0.00 C ATOM 518 C SER A 37 4.479 -0.778 -3.505 1.00 0.00 C ATOM 519 O SER A 37 5.321 -1.036 -2.644 1.00 0.00 O ATOM 520 CB SER A 37 5.795 0.457 -5.238 1.00 0.00 C ATOM 521 OG SER A 37 5.832 -0.748 -5.982 1.00 0.00 O ATOM 0 H SER A 37 5.442 1.706 -2.849 1.00 0.00 H new ATOM 0 HA SER A 37 3.670 0.585 -4.942 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.780 1.308 -5.919 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.700 0.545 -4.637 1.00 0.00 H new ATOM 0 HG SER A 37 6.626 -0.753 -6.557 1.00 0.00 H new ATOM 527 N PHE A 38 3.455 -1.578 -3.776 1.00 0.00 N ATOM 528 CA PHE A 38 3.254 -2.834 -3.062 1.00 0.00 C ATOM 529 C PHE A 38 2.946 -3.969 -4.034 1.00 0.00 C ATOM 530 O PHE A 38 2.703 -3.738 -5.217 1.00 0.00 O ATOM 531 CB PHE A 38 2.118 -2.694 -2.048 1.00 0.00 C ATOM 532 CG PHE A 38 0.859 -2.122 -2.633 1.00 0.00 C ATOM 533 CD1 PHE A 38 0.761 -0.768 -2.911 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.227 -2.939 -2.906 1.00 0.00 C ATOM 535 CE1 PHE A 38 -0.397 -0.239 -3.451 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.387 -2.416 -3.446 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.472 -1.064 -3.718 1.00 0.00 C ATOM 0 H PHE A 38 2.750 -1.380 -4.486 1.00 0.00 H new ATOM 0 HA PHE A 38 4.176 -3.073 -2.532 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.899 -3.673 -1.622 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.450 -2.057 -1.228 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.599 -0.118 -2.704 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.166 -3.996 -2.694 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.461 0.818 -3.664 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.226 -3.063 -3.655 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.378 -0.653 -4.139 1.00 0.00 H new ATOM 547 N ASN A 39 2.960 -5.196 -3.525 1.00 0.00 N ATOM 548 CA ASN A 39 2.683 -6.369 -4.346 1.00 0.00 C ATOM 549 C ASN A 39 1.290 -6.921 -4.055 1.00 0.00 C ATOM 550 O ASN A 39 0.772 -6.775 -2.948 1.00 0.00 O ATOM 551 CB ASN A 39 3.735 -7.451 -4.099 1.00 0.00 C ATOM 552 CG ASN A 39 5.128 -7.007 -4.503 1.00 0.00 C ATOM 553 OD1 ASN A 39 5.414 -6.823 -5.686 1.00 0.00 O ATOM 554 ND2 ASN A 39 6.002 -6.831 -3.519 1.00 0.00 N ATOM 0 H ASN A 39 3.160 -5.404 -2.547 1.00 0.00 H new ATOM 0 HA ASN A 39 2.723 -6.066 -5.392 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.735 -7.720 -3.043 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.467 -8.348 -4.656 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.954 -6.532 -3.730 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.721 -6.995 -2.552 1.00 0.00 H new ATOM 561 N LYS A 40 0.692 -7.558 -5.055 1.00 0.00 N ATOM 562 CA LYS A 40 -0.638 -8.135 -4.907 1.00 0.00 C ATOM 563 C LYS A 40 -0.646 -9.221 -3.835 1.00 0.00 C ATOM 564 O LYS A 40 0.356 -9.896 -3.595 1.00 0.00 O ATOM 565 CB LYS A 40 -1.116 -8.717 -6.240 1.00 0.00 C ATOM 566 CG LYS A 40 -1.001 -7.748 -7.403 1.00 0.00 C ATOM 567 CD LYS A 40 -2.267 -6.923 -7.570 1.00 0.00 C ATOM 568 CE LYS A 40 -3.250 -7.599 -8.513 1.00 0.00 C ATOM 569 NZ LYS A 40 -3.052 -7.167 -9.924 1.00 0.00 N ATOM 0 H LYS A 40 1.108 -7.688 -5.977 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.318 -7.340 -4.599 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -0.536 -9.612 -6.465 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.156 -9.028 -6.139 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -0.152 -7.084 -7.242 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.803 -8.302 -8.321 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.737 -6.774 -6.598 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.012 -5.936 -7.955 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.133 -8.681 -8.445 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.269 -7.368 -8.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -3.741 -7.650 -10.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.188 -6.138 -9.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.088 -7.410 -10.230 1.00 0.00 H new ATOM 583 N PRO A 41 -1.800 -9.395 -3.175 1.00 0.00 N ATOM 584 CA PRO A 41 -1.966 -10.398 -2.120 1.00 0.00 C ATOM 585 C PRO A 41 -1.949 -11.822 -2.666 1.00 0.00 C ATOM 586 O PRO A 41 -1.971 -12.032 -3.879 1.00 0.00 O ATOM 587 CB PRO A 41 -3.338 -10.068 -1.528 1.00 0.00 C ATOM 588 CG PRO A 41 -4.072 -9.386 -2.630 1.00 0.00 C ATOM 589 CD PRO A 41 -3.034 -8.626 -3.410 1.00 0.00 C ATOM 0 HA PRO A 41 -1.154 -10.363 -1.393 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.857 -10.970 -1.206 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.247 -9.423 -0.654 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.584 -10.110 -3.264 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.833 -8.713 -2.234 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.283 -8.579 -4.470 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -2.940 -7.598 -3.059 1.00 0.00 H new ATOM 597 N ASP A 42 -1.910 -12.796 -1.764 1.00 0.00 N ATOM 598 CA ASP A 42 -1.893 -14.201 -2.155 1.00 0.00 C ATOM 599 C ASP A 42 -3.240 -14.860 -1.879 1.00 0.00 C ATOM 600 O ASP A 42 -3.609 -15.839 -2.526 1.00 0.00 O ATOM 601 CB ASP A 42 -0.784 -14.946 -1.410 1.00 0.00 C ATOM 602 CG ASP A 42 -1.261 -15.525 -0.092 1.00 0.00 C ATOM 603 OD1 ASP A 42 -1.622 -14.736 0.807 1.00 0.00 O ATOM 604 OD2 ASP A 42 -1.274 -16.766 0.041 1.00 0.00 O ATOM 0 H ASP A 42 -1.890 -12.639 -0.756 1.00 0.00 H new ATOM 0 HA ASP A 42 -1.698 -14.251 -3.226 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.403 -15.750 -2.040 1.00 0.00 H new ATOM 0 HB3 ASP A 42 0.047 -14.265 -1.225 1.00 0.00 H new ATOM 609 N SER A 43 -3.972 -14.315 -0.912 1.00 0.00 N ATOM 610 CA SER A 43 -5.277 -14.852 -0.545 1.00 0.00 C ATOM 611 C SER A 43 -6.376 -13.822 -0.789 1.00 0.00 C ATOM 612 O SER A 43 -6.890 -13.212 0.149 1.00 0.00 O ATOM 613 CB SER A 43 -5.282 -15.282 0.922 1.00 0.00 C ATOM 614 OG SER A 43 -4.189 -16.138 1.206 1.00 0.00 O ATOM 0 H SER A 43 -3.683 -13.502 -0.369 1.00 0.00 H new ATOM 0 HA SER A 43 -5.473 -15.723 -1.171 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.234 -14.401 1.563 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.217 -15.793 1.151 1.00 0.00 H new ATOM 0 HG SER A 43 -4.214 -16.398 2.151 1.00 0.00 H new ATOM 620 N HIS A 44 -6.732 -13.635 -2.056 1.00 0.00 N ATOM 621 CA HIS A 44 -7.771 -12.679 -2.425 1.00 0.00 C ATOM 622 C HIS A 44 -9.151 -13.200 -2.036 1.00 0.00 C ATOM 623 O HIS A 44 -10.091 -12.426 -1.856 1.00 0.00 O ATOM 624 CB HIS A 44 -7.725 -12.397 -3.927 1.00 0.00 C ATOM 625 CG HIS A 44 -8.259 -13.518 -4.764 1.00 0.00 C ATOM 626 ND1 HIS A 44 -9.608 -13.757 -4.929 1.00 0.00 N ATOM 627 CD2 HIS A 44 -7.619 -14.467 -5.486 1.00 0.00 C ATOM 628 CE1 HIS A 44 -9.773 -14.806 -5.715 1.00 0.00 C ATOM 629 NE2 HIS A 44 -8.582 -15.255 -6.066 1.00 0.00 N ATOM 0 H HIS A 44 -6.317 -14.132 -2.844 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.585 -11.752 -1.883 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -8.298 -11.494 -4.136 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -6.694 -12.196 -4.219 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -10.360 -13.210 -4.510 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -6.550 -14.583 -5.587 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -10.721 -15.225 -6.019 1.00 0.00 H new ATOM 638 N GLY A 45 -9.266 -14.518 -1.906 1.00 0.00 N ATOM 639 CA GLY A 45 -10.535 -15.121 -1.541 1.00 0.00 C ATOM 640 C GLY A 45 -11.178 -15.865 -2.694 1.00 0.00 C ATOM 641 O GLY A 45 -10.514 -16.621 -3.402 1.00 0.00 O ATOM 0 H GLY A 45 -8.503 -15.180 -2.047 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.381 -15.809 -0.710 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.215 -14.345 -1.190 1.00 0.00 H new ATOM 645 N GLY A 46 -12.477 -15.653 -2.883 1.00 0.00 N ATOM 646 CA GLY A 46 -13.189 -16.319 -3.959 1.00 0.00 C ATOM 647 C GLY A 46 -13.449 -15.401 -5.137 1.00 0.00 C ATOM 648 O GLY A 46 -13.680 -15.863 -6.254 1.00 0.00 O ATOM 0 H GLY A 46 -13.049 -15.032 -2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -12.611 -17.181 -4.294 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -14.138 -16.699 -3.582 1.00 0.00 H new ATOM 652 N VAL A 47 -13.414 -14.096 -4.887 1.00 0.00 N ATOM 653 CA VAL A 47 -13.649 -13.111 -5.936 1.00 0.00 C ATOM 654 C VAL A 47 -12.425 -12.226 -6.143 1.00 0.00 C ATOM 655 O VAL A 47 -11.677 -11.928 -5.211 1.00 0.00 O ATOM 656 CB VAL A 47 -14.862 -12.219 -5.607 1.00 0.00 C ATOM 657 CG1 VAL A 47 -16.137 -13.050 -5.559 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.643 -11.486 -4.293 1.00 0.00 C ATOM 0 H VAL A 47 -13.225 -13.697 -3.968 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.852 -13.667 -6.852 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.970 -11.475 -6.397 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.984 -12.404 -5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.299 -13.525 -6.527 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -16.043 -13.817 -4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.509 -10.861 -4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.509 -12.211 -3.490 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.754 -10.860 -4.369 1.00 0.00 H new ATOM 668 N PRO A 48 -12.213 -11.794 -7.395 1.00 0.00 N ATOM 669 CA PRO A 48 -11.079 -10.936 -7.756 1.00 0.00 C ATOM 670 C PRO A 48 -11.216 -9.527 -7.188 1.00 0.00 C ATOM 671 O PRO A 48 -12.294 -8.934 -7.227 1.00 0.00 O ATOM 672 CB PRO A 48 -11.131 -10.904 -9.285 1.00 0.00 C ATOM 673 CG PRO A 48 -12.556 -11.177 -9.621 1.00 0.00 C ATOM 674 CD PRO A 48 -13.062 -12.110 -8.557 1.00 0.00 C ATOM 0 HA PRO A 48 -10.138 -11.314 -7.356 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -10.811 -9.936 -9.672 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -10.471 -11.655 -9.719 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -13.136 -10.254 -9.639 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -12.644 -11.628 -10.609 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -14.117 -11.940 -8.342 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -12.962 -13.153 -8.856 1.00 0.00 H new ATOM 682 N ILE A 49 -10.117 -8.998 -6.662 1.00 0.00 N ATOM 683 CA ILE A 49 -10.115 -7.658 -6.088 1.00 0.00 C ATOM 684 C ILE A 49 -10.619 -6.629 -7.094 1.00 0.00 C ATOM 685 O ILE A 49 -10.384 -6.752 -8.295 1.00 0.00 O ATOM 686 CB ILE A 49 -8.707 -7.250 -5.616 1.00 0.00 C ATOM 687 CG1 ILE A 49 -8.221 -8.196 -4.515 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.710 -5.811 -5.121 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.715 -8.334 -4.458 1.00 0.00 C ATOM 0 H ILE A 49 -9.217 -9.476 -6.621 1.00 0.00 H new ATOM 0 HA ILE A 49 -10.785 -7.682 -5.229 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.022 -7.322 -6.461 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.581 -7.835 -3.552 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.662 -9.180 -4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.708 -5.538 -4.791 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -9.019 -5.149 -5.930 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.405 -5.714 -4.287 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.443 -9.019 -3.655 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.349 -8.724 -5.408 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.267 -7.358 -4.270 1.00 0.00 H new ATOM 701 N HIS A 50 -11.313 -5.611 -6.593 1.00 0.00 N ATOM 702 CA HIS A 50 -11.848 -4.557 -7.448 1.00 0.00 C ATOM 703 C HIS A 50 -10.906 -3.358 -7.488 1.00 0.00 C ATOM 704 O HIS A 50 -10.629 -2.809 -8.556 1.00 0.00 O ATOM 705 CB HIS A 50 -13.226 -4.119 -6.949 1.00 0.00 C ATOM 706 CG HIS A 50 -14.131 -3.632 -8.040 1.00 0.00 C ATOM 707 ND1 HIS A 50 -15.469 -3.957 -8.110 1.00 0.00 N ATOM 708 CD2 HIS A 50 -13.882 -2.838 -9.108 1.00 0.00 C ATOM 709 CE1 HIS A 50 -16.003 -3.385 -9.174 1.00 0.00 C ATOM 710 NE2 HIS A 50 -15.061 -2.699 -9.796 1.00 0.00 N ATOM 0 H HIS A 50 -11.518 -5.494 -5.601 1.00 0.00 H new ATOM 0 HA HIS A 50 -11.943 -4.956 -8.458 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -13.702 -4.957 -6.440 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -13.101 -3.327 -6.211 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -12.932 -2.396 -9.370 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -17.035 -3.465 -9.483 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -15.189 -2.155 -10.649 1.00 0.00 H new ATOM 719 N HIS A 51 -10.415 -2.957 -6.320 1.00 0.00 N ATOM 720 CA HIS A 51 -9.502 -1.823 -6.223 1.00 0.00 C ATOM 721 C HIS A 51 -8.763 -1.834 -4.889 1.00 0.00 C ATOM 722 O HIS A 51 -8.936 -2.744 -4.079 1.00 0.00 O ATOM 723 CB HIS A 51 -10.268 -0.510 -6.385 1.00 0.00 C ATOM 724 CG HIS A 51 -11.189 -0.209 -5.242 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.472 -0.708 -5.159 1.00 0.00 N ATOM 726 CD2 HIS A 51 -11.005 0.544 -4.132 1.00 0.00 C ATOM 727 CE1 HIS A 51 -13.038 -0.273 -4.046 1.00 0.00 C ATOM 728 NE2 HIS A 51 -12.169 0.487 -3.406 1.00 0.00 N ATOM 0 H HIS A 51 -10.634 -3.400 -5.428 1.00 0.00 H new ATOM 0 HA HIS A 51 -8.769 -1.908 -7.025 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.554 0.307 -6.491 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -10.847 -0.548 -7.307 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -10.110 1.088 -3.867 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.041 -0.501 -3.717 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.335 0.956 -2.516 1.00 0.00 H new ATOM 737 N TYR A 52 -7.937 -0.817 -4.668 1.00 0.00 N ATOM 738 CA TYR A 52 -7.168 -0.711 -3.433 1.00 0.00 C ATOM 739 C TYR A 52 -7.517 0.571 -2.682 1.00 0.00 C ATOM 740 O TYR A 52 -7.816 1.597 -3.292 1.00 0.00 O ATOM 741 CB TYR A 52 -5.669 -0.745 -3.736 1.00 0.00 C ATOM 742 CG TYR A 52 -5.137 -2.135 -4.003 1.00 0.00 C ATOM 743 CD1 TYR A 52 -4.825 -2.993 -2.957 1.00 0.00 C ATOM 744 CD2 TYR A 52 -4.947 -2.590 -5.302 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.337 -4.264 -3.195 1.00 0.00 C ATOM 746 CE2 TYR A 52 -4.461 -3.860 -5.551 1.00 0.00 C ATOM 747 CZ TYR A 52 -4.158 -4.692 -4.494 1.00 0.00 C ATOM 748 OH TYR A 52 -3.673 -5.956 -4.737 1.00 0.00 O ATOM 0 H TYR A 52 -7.783 -0.054 -5.328 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.424 -1.562 -2.802 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.468 -0.115 -4.603 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.127 -0.313 -2.895 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.966 -2.661 -1.939 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -5.183 -1.940 -6.132 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -4.097 -4.918 -2.369 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.320 -4.198 -6.567 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.386 -6.513 -5.115 1.00 0.00 H new ATOM 758 N GLN A 53 -7.477 0.500 -1.355 1.00 0.00 N ATOM 759 CA GLN A 53 -7.789 1.655 -0.521 1.00 0.00 C ATOM 760 C GLN A 53 -6.568 2.094 0.280 1.00 0.00 C ATOM 761 O GLN A 53 -6.130 1.398 1.196 1.00 0.00 O ATOM 762 CB GLN A 53 -8.944 1.328 0.426 1.00 0.00 C ATOM 763 CG GLN A 53 -9.452 2.531 1.204 1.00 0.00 C ATOM 764 CD GLN A 53 -10.912 2.402 1.592 1.00 0.00 C ATOM 765 OE1 GLN A 53 -11.695 1.752 0.898 1.00 0.00 O ATOM 766 NE2 GLN A 53 -11.288 3.023 2.704 1.00 0.00 N ATOM 0 H GLN A 53 -7.232 -0.343 -0.835 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.085 2.475 -1.175 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.767 0.905 -0.150 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.620 0.561 1.130 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -8.851 2.657 2.104 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.318 3.430 0.603 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -10.606 3.551 3.249 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -12.259 2.972 3.013 1.00 0.00 H new ATOM 775 N VAL A 54 -6.020 3.252 -0.073 1.00 0.00 N ATOM 776 CA VAL A 54 -4.848 3.785 0.613 1.00 0.00 C ATOM 777 C VAL A 54 -5.236 4.907 1.570 1.00 0.00 C ATOM 778 O VAL A 54 -6.147 5.687 1.292 1.00 0.00 O ATOM 779 CB VAL A 54 -3.805 4.314 -0.387 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.621 4.922 0.349 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.350 3.202 -1.321 1.00 0.00 C ATOM 0 H VAL A 54 -6.369 3.840 -0.830 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.411 2.963 1.180 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.268 5.096 -0.989 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.894 5.291 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.965 5.748 0.972 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.155 4.163 0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.613 3.594 -2.021 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.904 2.397 -0.738 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.207 2.818 -1.874 1.00 0.00 H new ATOM 791 N ASP A 55 -4.537 4.983 2.697 1.00 0.00 N ATOM 792 CA ASP A 55 -4.806 6.012 3.695 1.00 0.00 C ATOM 793 C ASP A 55 -3.510 6.669 4.161 1.00 0.00 C ATOM 794 O ASP A 55 -2.431 6.085 4.051 1.00 0.00 O ATOM 795 CB ASP A 55 -5.546 5.412 4.891 1.00 0.00 C ATOM 796 CG ASP A 55 -4.612 4.711 5.858 1.00 0.00 C ATOM 797 OD1 ASP A 55 -3.449 4.457 5.481 1.00 0.00 O ATOM 798 OD2 ASP A 55 -5.045 4.417 6.993 1.00 0.00 O ATOM 0 H ASP A 55 -3.780 4.345 2.942 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.434 6.774 3.234 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -6.082 6.202 5.417 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.293 4.703 4.534 1.00 0.00 H new ATOM 803 N VAL A 56 -3.623 7.886 4.682 1.00 0.00 N ATOM 804 CA VAL A 56 -2.461 8.622 5.165 1.00 0.00 C ATOM 805 C VAL A 56 -2.869 9.696 6.167 1.00 0.00 C ATOM 806 O VAL A 56 -3.884 10.370 5.994 1.00 0.00 O ATOM 807 CB VAL A 56 -1.694 9.283 4.005 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.552 10.342 3.331 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.387 9.883 4.505 1.00 0.00 C ATOM 0 H VAL A 56 -4.508 8.384 4.781 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.810 7.899 5.656 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.458 8.517 3.266 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.993 10.798 2.514 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.458 9.880 2.938 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.822 11.108 4.058 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.143 10.346 3.673 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.599 10.636 5.264 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.232 9.097 4.937 1.00 0.00 H new ATOM 819 N LYS A 57 -2.069 9.852 7.217 1.00 0.00 N ATOM 820 CA LYS A 57 -2.344 10.845 8.248 1.00 0.00 C ATOM 821 C LYS A 57 -1.105 11.104 9.099 1.00 0.00 C ATOM 822 O LYS A 57 -0.264 10.221 9.270 1.00 0.00 O ATOM 823 CB LYS A 57 -3.499 10.381 9.138 1.00 0.00 C ATOM 824 CG LYS A 57 -3.566 11.101 10.474 1.00 0.00 C ATOM 825 CD LYS A 57 -4.540 10.426 11.424 1.00 0.00 C ATOM 826 CE LYS A 57 -3.883 9.278 12.173 1.00 0.00 C ATOM 827 NZ LYS A 57 -3.054 9.760 13.311 1.00 0.00 N ATOM 0 H LYS A 57 -1.224 9.303 7.376 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.625 11.775 7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.439 10.531 8.607 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.401 9.310 9.317 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.574 11.125 10.925 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -3.869 12.136 10.316 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -4.920 11.157 12.138 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.397 10.053 10.863 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -4.651 8.600 12.545 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.259 8.706 11.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -2.847 8.966 13.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -2.162 10.154 12.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.572 10.497 13.830 1.00 0.00 H new ATOM 841 N GLU A 58 -1.000 12.317 9.632 1.00 0.00 N ATOM 842 CA GLU A 58 0.137 12.689 10.466 1.00 0.00 C ATOM 843 C GLU A 58 0.117 11.923 11.785 1.00 0.00 C ATOM 844 O GLU A 58 -0.925 11.799 12.429 1.00 0.00 O ATOM 845 CB GLU A 58 0.127 14.195 10.737 1.00 0.00 C ATOM 846 CG GLU A 58 0.900 15.004 9.709 1.00 0.00 C ATOM 847 CD GLU A 58 0.336 16.399 9.521 1.00 0.00 C ATOM 848 OE1 GLU A 58 -0.904 16.545 9.520 1.00 0.00 O ATOM 849 OE2 GLU A 58 1.137 17.347 9.377 1.00 0.00 O ATOM 0 H GLU A 58 -1.688 13.059 9.501 1.00 0.00 H new ATOM 0 HA GLU A 58 1.050 12.430 9.929 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.905 14.544 10.760 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.549 14.381 11.725 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.943 15.076 10.018 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.887 14.479 8.754 1.00 0.00 H new ATOM 856 N VAL A 59 1.278 11.411 12.183 1.00 0.00 N ATOM 857 CA VAL A 59 1.395 10.657 13.425 1.00 0.00 C ATOM 858 C VAL A 59 0.740 11.402 14.584 1.00 0.00 C ATOM 859 O VAL A 59 0.362 10.799 15.588 1.00 0.00 O ATOM 860 CB VAL A 59 2.868 10.380 13.776 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.683 11.663 13.719 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.977 9.730 15.148 1.00 0.00 C ATOM 0 H VAL A 59 2.150 11.505 11.663 1.00 0.00 H new ATOM 0 HA VAL A 59 0.881 9.708 13.269 1.00 0.00 H new ATOM 0 HB VAL A 59 3.274 9.688 13.038 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.721 11.446 13.970 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.633 12.082 12.714 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.280 12.382 14.432 1.00 0.00 H new ATOM 0 HG21 VAL A 59 4.025 9.542 15.379 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.553 10.395 15.900 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.430 8.787 15.148 1.00 0.00 H new ATOM 872 N ALA A 60 0.609 12.716 14.436 1.00 0.00 N ATOM 873 CA ALA A 60 -0.003 13.544 15.469 1.00 0.00 C ATOM 874 C ALA A 60 -1.485 13.762 15.189 1.00 0.00 C ATOM 875 O ALA A 60 -2.305 13.779 16.108 1.00 0.00 O ATOM 876 CB ALA A 60 0.720 14.878 15.572 1.00 0.00 C ATOM 0 H ALA A 60 0.918 13.230 13.611 1.00 0.00 H new ATOM 0 HA ALA A 60 0.087 13.021 16.421 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.253 15.486 16.347 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.766 14.706 15.827 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.660 15.399 14.616 1.00 0.00 H new ATOM 882 N SER A 61 -1.824 13.933 13.915 1.00 0.00 N ATOM 883 CA SER A 61 -3.208 14.156 13.516 1.00 0.00 C ATOM 884 C SER A 61 -4.094 12.992 13.950 1.00 0.00 C ATOM 885 O SER A 61 -3.601 11.951 14.381 1.00 0.00 O ATOM 886 CB SER A 61 -3.301 14.343 12.000 1.00 0.00 C ATOM 887 OG SER A 61 -4.644 14.520 11.588 1.00 0.00 O ATOM 0 H SER A 61 -1.159 13.921 13.142 1.00 0.00 H new ATOM 0 HA SER A 61 -3.560 15.062 14.010 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.709 15.208 11.700 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.875 13.475 11.497 1.00 0.00 H new ATOM 0 HG SER A 61 -4.675 14.639 10.616 1.00 0.00 H new ATOM 893 N GLU A 62 -5.405 13.179 13.834 1.00 0.00 N ATOM 894 CA GLU A 62 -6.360 12.145 14.215 1.00 0.00 C ATOM 895 C GLU A 62 -7.260 11.775 13.039 1.00 0.00 C ATOM 896 O GLU A 62 -7.853 10.696 13.014 1.00 0.00 O ATOM 897 CB GLU A 62 -7.212 12.617 15.395 1.00 0.00 C ATOM 898 CG GLU A 62 -8.416 13.446 14.983 1.00 0.00 C ATOM 899 CD GLU A 62 -8.848 14.422 16.060 1.00 0.00 C ATOM 900 OE1 GLU A 62 -8.238 15.508 16.158 1.00 0.00 O ATOM 901 OE2 GLU A 62 -9.797 14.101 16.806 1.00 0.00 O ATOM 0 H GLU A 62 -5.830 14.036 13.480 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.798 11.259 14.513 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.555 11.747 15.955 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.590 13.206 16.069 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.179 13.997 14.073 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.247 12.781 14.746 1.00 0.00 H new ATOM 908 N ILE A 63 -7.357 12.677 12.069 1.00 0.00 N ATOM 909 CA ILE A 63 -8.184 12.447 10.892 1.00 0.00 C ATOM 910 C ILE A 63 -7.416 11.677 9.823 1.00 0.00 C ATOM 911 O ILE A 63 -6.289 12.034 9.476 1.00 0.00 O ATOM 912 CB ILE A 63 -8.690 13.771 10.291 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.608 14.488 11.282 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.415 13.514 8.978 1.00 0.00 C ATOM 915 CD1 ILE A 63 -10.750 13.629 11.780 1.00 0.00 C ATOM 0 H ILE A 63 -6.873 13.575 12.075 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.040 11.856 11.219 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.832 14.413 10.090 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.017 14.823 12.135 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.016 15.380 10.807 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.767 14.460 8.565 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.732 13.042 8.272 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.266 12.856 9.155 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -11.359 14.203 12.479 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.364 13.315 10.936 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -10.350 12.749 12.285 1.00 0.00 H new ATOM 927 N TRP A 64 -8.032 10.621 9.303 1.00 0.00 N ATOM 928 CA TRP A 64 -7.406 9.802 8.272 1.00 0.00 C ATOM 929 C TRP A 64 -7.912 10.189 6.887 1.00 0.00 C ATOM 930 O TRP A 64 -9.109 10.402 6.689 1.00 0.00 O ATOM 931 CB TRP A 64 -7.681 8.320 8.533 1.00 0.00 C ATOM 932 CG TRP A 64 -6.827 7.740 9.621 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.086 7.755 10.961 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.577 7.062 9.459 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.072 7.127 11.642 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.135 6.692 10.744 1.00 0.00 C ATOM 937 CE3 TRP A 64 -4.789 6.730 8.353 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -3.939 6.007 10.951 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.603 6.050 8.561 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.188 5.695 9.851 1.00 0.00 C ATOM 0 H TRP A 64 -8.964 10.312 9.579 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.331 9.977 8.307 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.731 8.194 8.798 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.515 7.759 7.613 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -7.959 8.196 11.418 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.025 7.005 12.654 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -5.101 7.000 7.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -3.617 5.732 11.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -2.986 5.788 7.714 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.256 5.164 9.980 1.00 0.00 H new ATOM 951 N LYS A 65 -6.995 10.279 5.930 1.00 0.00 N ATOM 952 CA LYS A 65 -7.349 10.640 4.562 1.00 0.00 C ATOM 953 C LYS A 65 -7.266 9.426 3.641 1.00 0.00 C ATOM 954 O LYS A 65 -6.214 8.797 3.522 1.00 0.00 O ATOM 955 CB LYS A 65 -6.425 11.746 4.049 1.00 0.00 C ATOM 956 CG LYS A 65 -6.934 13.147 4.342 1.00 0.00 C ATOM 957 CD LYS A 65 -7.970 13.588 3.322 1.00 0.00 C ATOM 958 CE LYS A 65 -7.986 15.101 3.162 1.00 0.00 C ATOM 959 NZ LYS A 65 -6.985 15.563 2.162 1.00 0.00 N ATOM 0 H LYS A 65 -6.000 10.107 6.076 1.00 0.00 H new ATOM 0 HA LYS A 65 -8.376 11.005 4.563 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.440 11.624 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.298 11.632 2.972 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.370 13.175 5.341 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.098 13.847 4.339 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -7.757 13.122 2.360 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -8.957 13.243 3.632 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -8.981 15.423 2.855 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -7.781 15.570 4.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.027 16.599 2.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -6.033 15.278 2.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.195 15.135 1.238 1.00 0.00 H new ATOM 973 N ILE A 66 -8.380 9.105 2.992 1.00 0.00 N ATOM 974 CA ILE A 66 -8.432 7.969 2.080 1.00 0.00 C ATOM 975 C ILE A 66 -8.298 8.422 0.630 1.00 0.00 C ATOM 976 O ILE A 66 -8.951 9.375 0.203 1.00 0.00 O ATOM 977 CB ILE A 66 -9.743 7.178 2.240 1.00 0.00 C ATOM 978 CG1 ILE A 66 -9.910 6.713 3.688 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.763 5.989 1.290 1.00 0.00 C ATOM 980 CD1 ILE A 66 -8.788 5.819 4.168 1.00 0.00 C ATOM 0 H ILE A 66 -9.259 9.615 3.081 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.593 7.321 2.335 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.578 7.832 1.990 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.971 7.587 4.337 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -10.855 6.179 3.783 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.696 5.439 1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.685 6.343 0.262 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -8.922 5.332 1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -8.972 5.528 5.202 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -8.740 4.927 3.543 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -7.842 6.357 4.105 1.00 0.00 H new ATOM 992 N VAL A 67 -7.448 7.732 -0.124 1.00 0.00 N ATOM 993 CA VAL A 67 -7.230 8.061 -1.528 1.00 0.00 C ATOM 994 C VAL A 67 -7.379 6.827 -2.410 1.00 0.00 C ATOM 995 O VAL A 67 -6.624 5.862 -2.279 1.00 0.00 O ATOM 996 CB VAL A 67 -5.835 8.673 -1.751 1.00 0.00 C ATOM 997 CG1 VAL A 67 -5.581 8.896 -3.234 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.696 9.975 -0.977 1.00 0.00 C ATOM 0 H VAL A 67 -6.899 6.942 0.214 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.988 8.795 -1.803 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.086 7.973 -1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -4.590 9.329 -3.372 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.637 7.943 -3.760 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -6.333 9.576 -3.634 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.704 10.394 -1.146 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.452 10.683 -1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.832 9.782 0.087 1.00 0.00 H new ATOM 1008 N ARG A 68 -8.356 6.863 -3.310 1.00 0.00 N ATOM 1009 CA ARG A 68 -8.604 5.747 -4.215 1.00 0.00 C ATOM 1010 C ARG A 68 -7.742 5.861 -5.468 1.00 0.00 C ATOM 1011 O ARG A 68 -7.351 6.958 -5.866 1.00 0.00 O ATOM 1012 CB ARG A 68 -10.083 5.696 -4.602 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.986 5.179 -3.495 1.00 0.00 C ATOM 1014 CD ARG A 68 -12.405 5.708 -3.639 1.00 0.00 C ATOM 1015 NE ARG A 68 -13.243 5.347 -2.499 1.00 0.00 N ATOM 1016 CZ ARG A 68 -14.543 5.612 -2.429 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -15.149 6.238 -3.428 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -15.238 5.251 -1.359 1.00 0.00 N ATOM 0 H ARG A 68 -8.989 7.653 -3.432 1.00 0.00 H new ATOM 0 HA ARG A 68 -8.339 4.825 -3.697 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -10.409 6.696 -4.888 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -10.198 5.060 -5.480 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.999 4.089 -3.514 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -10.583 5.476 -2.527 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -12.379 6.793 -3.740 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -12.848 5.313 -4.554 1.00 0.00 H new ATOM 0 HE ARG A 68 -12.806 4.865 -1.713 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.617 6.517 -4.252 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -16.147 6.441 -3.372 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.775 4.769 -0.589 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -16.236 5.455 -1.306 1.00 0.00 H new ATOM 1032 N SER A 69 -7.450 4.720 -6.085 1.00 0.00 N ATOM 1033 CA SER A 69 -6.631 4.693 -7.291 1.00 0.00 C ATOM 1034 C SER A 69 -7.505 4.643 -8.541 1.00 0.00 C ATOM 1035 O SER A 69 -8.731 4.710 -8.458 1.00 0.00 O ATOM 1036 CB SER A 69 -5.689 3.487 -7.265 1.00 0.00 C ATOM 1037 OG SER A 69 -4.938 3.453 -6.064 1.00 0.00 O ATOM 0 H SER A 69 -7.768 3.804 -5.770 1.00 0.00 H new ATOM 0 HA SER A 69 -6.039 5.608 -7.320 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.267 2.568 -7.362 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.013 3.531 -8.119 1.00 0.00 H new ATOM 0 HG SER A 69 -4.597 2.546 -5.917 1.00 0.00 H new ATOM 1043 N HIS A 70 -6.863 4.523 -9.699 1.00 0.00 N ATOM 1044 CA HIS A 70 -7.582 4.463 -10.967 1.00 0.00 C ATOM 1045 C HIS A 70 -7.428 3.091 -11.615 1.00 0.00 C ATOM 1046 O HIS A 70 -7.157 2.983 -12.810 1.00 0.00 O ATOM 1047 CB HIS A 70 -7.072 5.548 -11.918 1.00 0.00 C ATOM 1048 CG HIS A 70 -7.764 6.865 -11.750 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -7.123 8.002 -11.305 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -9.051 7.224 -11.973 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -7.985 9.001 -11.260 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -9.162 8.556 -11.660 1.00 0.00 N ATOM 0 H HIS A 70 -5.848 4.465 -9.786 1.00 0.00 H new ATOM 0 HA HIS A 70 -8.639 4.633 -10.765 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.003 5.686 -11.759 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -7.200 5.208 -12.946 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -9.842 6.582 -12.330 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -7.765 10.011 -10.949 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.015 9.112 -11.726 1.00 0.00 H new ATOM 1061 N GLY A 71 -7.604 2.042 -10.815 1.00 0.00 N ATOM 1062 CA GLY A 71 -7.480 0.690 -11.327 1.00 0.00 C ATOM 1063 C GLY A 71 -6.962 -0.280 -10.284 1.00 0.00 C ATOM 1064 O GLY A 71 -6.847 0.064 -9.109 1.00 0.00 O ATOM 0 H GLY A 71 -7.830 2.105 -9.822 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.452 0.350 -11.684 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.807 0.690 -12.185 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.651 -1.498 -10.715 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.143 -2.523 -9.809 1.00 0.00 C ATOM 1070 C VAL A 72 -4.627 -2.437 -9.678 1.00 0.00 C ATOM 1071 O VAL A 72 -3.959 -3.438 -9.419 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.526 -3.936 -10.288 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -8.038 -4.109 -10.283 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -5.956 -4.201 -11.673 1.00 0.00 C ATOM 0 H VAL A 72 -6.742 -1.800 -11.685 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.600 -2.341 -8.837 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.098 -4.664 -9.599 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.290 -5.113 -10.624 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.418 -3.963 -9.272 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.490 -3.375 -10.950 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.236 -5.204 -11.996 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.353 -3.469 -12.376 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -4.869 -4.121 -11.641 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.089 -1.235 -9.858 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.651 -1.018 -9.760 1.00 0.00 C ATOM 1086 C GLN A 73 -2.197 -1.029 -8.304 1.00 0.00 C ATOM 1087 O GLN A 73 -2.993 -0.798 -7.393 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.267 0.308 -10.418 1.00 0.00 C ATOM 1089 CG GLN A 73 -2.919 1.519 -9.770 1.00 0.00 C ATOM 1090 CD GLN A 73 -3.151 2.651 -10.751 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -4.246 2.804 -11.293 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -2.118 3.453 -10.984 1.00 0.00 N ATOM 0 H GLN A 73 -4.628 -0.396 -10.073 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.150 -1.832 -10.283 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.184 0.424 -10.378 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.546 0.276 -11.471 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.872 1.223 -9.331 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.289 1.873 -8.954 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -1.229 3.289 -10.512 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -2.214 4.233 -11.634 1.00 0.00 H new ATOM 1101 N THR A 74 -0.912 -1.296 -8.091 1.00 0.00 N ATOM 1102 CA THR A 74 -0.353 -1.337 -6.746 1.00 0.00 C ATOM 1103 C THR A 74 0.616 -0.184 -6.517 1.00 0.00 C ATOM 1104 O THR A 74 1.438 -0.223 -5.603 1.00 0.00 O ATOM 1105 CB THR A 74 0.379 -2.667 -6.482 1.00 0.00 C ATOM 1106 OG1 THR A 74 1.417 -2.856 -7.451 1.00 0.00 O ATOM 1107 CG2 THR A 74 -0.590 -3.838 -6.537 1.00 0.00 C ATOM 0 H THR A 74 -0.239 -1.487 -8.833 1.00 0.00 H new ATOM 0 HA THR A 74 -1.190 -1.247 -6.054 1.00 0.00 H new ATOM 0 HB THR A 74 0.816 -2.623 -5.485 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.213 -3.222 -7.011 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.050 -4.766 -6.348 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.363 -3.707 -5.780 1.00 0.00 H new ATOM 0 HG23 THR A 74 -1.052 -3.882 -7.523 1.00 0.00 H new ATOM 1115 N MET A 75 0.513 0.844 -7.355 1.00 0.00 N ATOM 1116 CA MET A 75 1.380 2.011 -7.243 1.00 0.00 C ATOM 1117 C MET A 75 0.569 3.300 -7.322 1.00 0.00 C ATOM 1118 O MET A 75 -0.127 3.549 -8.307 1.00 0.00 O ATOM 1119 CB MET A 75 2.441 1.993 -8.344 1.00 0.00 C ATOM 1120 CG MET A 75 3.718 2.728 -7.970 1.00 0.00 C ATOM 1121 SD MET A 75 5.121 2.244 -8.993 1.00 0.00 S ATOM 1122 CE MET A 75 5.256 3.665 -10.078 1.00 0.00 C ATOM 0 H MET A 75 -0.162 0.892 -8.118 1.00 0.00 H new ATOM 0 HA MET A 75 1.875 1.973 -6.272 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.685 0.958 -8.586 1.00 0.00 H new ATOM 0 HB3 MET A 75 2.024 2.441 -9.246 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.556 3.802 -8.066 1.00 0.00 H new ATOM 0 HG3 MET A 75 3.952 2.533 -6.923 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.342 3.327 -11.111 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.368 4.289 -9.973 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.140 4.244 -9.811 1.00 0.00 H new ATOM 1132 N VAL A 76 0.663 4.119 -6.279 1.00 0.00 N ATOM 1133 CA VAL A 76 -0.061 5.383 -6.231 1.00 0.00 C ATOM 1134 C VAL A 76 0.795 6.484 -5.616 1.00 0.00 C ATOM 1135 O VAL A 76 1.623 6.227 -4.743 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.367 5.252 -5.425 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -2.082 6.592 -5.345 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -2.270 4.194 -6.041 1.00 0.00 C ATOM 0 H VAL A 76 1.234 3.929 -5.455 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.303 5.648 -7.260 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.117 4.939 -4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.002 6.480 -4.772 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.436 7.320 -4.855 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.321 6.938 -6.351 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.188 4.115 -5.458 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.513 4.475 -7.066 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.757 3.233 -6.041 1.00 0.00 H new ATOM 1148 N VAL A 77 0.589 7.715 -6.077 1.00 0.00 N ATOM 1149 CA VAL A 77 1.341 8.856 -5.571 1.00 0.00 C ATOM 1150 C VAL A 77 0.454 9.770 -4.732 1.00 0.00 C ATOM 1151 O VAL A 77 -0.641 10.147 -5.151 1.00 0.00 O ATOM 1152 CB VAL A 77 1.960 9.674 -6.719 1.00 0.00 C ATOM 1153 CG1 VAL A 77 0.924 10.602 -7.334 1.00 0.00 C ATOM 1154 CG2 VAL A 77 3.165 10.461 -6.224 1.00 0.00 C ATOM 0 H VAL A 77 -0.093 7.946 -6.800 1.00 0.00 H new ATOM 0 HA VAL A 77 2.141 8.456 -4.947 1.00 0.00 H new ATOM 0 HB VAL A 77 2.298 8.983 -7.491 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.381 11.172 -8.143 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.096 10.013 -7.727 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.552 11.288 -6.573 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.590 11.033 -7.049 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.854 11.142 -5.432 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.915 9.772 -5.836 1.00 0.00 H new ATOM 1164 N LEU A 78 0.933 10.123 -3.545 1.00 0.00 N ATOM 1165 CA LEU A 78 0.185 10.994 -2.645 1.00 0.00 C ATOM 1166 C LEU A 78 0.588 12.452 -2.838 1.00 0.00 C ATOM 1167 O LEU A 78 1.721 12.748 -3.215 1.00 0.00 O ATOM 1168 CB LEU A 78 0.415 10.578 -1.191 1.00 0.00 C ATOM 1169 CG LEU A 78 -0.119 9.200 -0.796 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.385 8.809 0.585 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.640 9.185 -0.835 1.00 0.00 C ATOM 0 H LEU A 78 1.837 9.819 -3.183 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.874 10.894 -2.881 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.486 10.601 -0.992 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.046 11.324 -0.543 1.00 0.00 H new ATOM 0 HG LEU A 78 0.249 8.469 -1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.005 7.826 0.850 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.475 8.778 0.579 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.047 9.543 1.317 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.002 8.197 -0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.029 9.928 -0.138 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.980 9.420 -1.843 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.346 13.359 -2.575 1.00 0.00 N ATOM 1184 CA ASN A 79 -0.087 14.787 -2.718 1.00 0.00 C ATOM 1185 C ASN A 79 -0.672 15.567 -1.544 1.00 0.00 C ATOM 1186 O ASN A 79 -1.343 15.000 -0.682 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.677 15.305 -4.031 1.00 0.00 C ATOM 1188 CG ASN A 79 -0.698 14.242 -5.113 1.00 0.00 C ATOM 1189 OD1 ASN A 79 0.014 14.343 -6.112 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -1.517 13.216 -4.918 1.00 0.00 N ATOM 0 H ASN A 79 -1.289 13.131 -2.262 1.00 0.00 H new ATOM 0 HA ASN A 79 0.993 14.935 -2.728 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.692 15.661 -3.855 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.095 16.160 -4.376 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.574 12.470 -5.611 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -2.089 13.173 -4.075 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.415 16.870 -1.518 1.00 0.00 N ATOM 1198 CA ASN A 80 -0.916 17.728 -0.450 1.00 0.00 C ATOM 1199 C ASN A 80 -0.320 17.326 0.896 1.00 0.00 C ATOM 1200 O ASN A 80 -1.046 17.094 1.863 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.443 17.658 -0.386 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.107 18.696 -1.270 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -3.632 19.697 -0.784 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -3.086 18.460 -2.577 1.00 0.00 N ATOM 0 H ASN A 80 0.138 17.356 -2.225 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.615 18.752 -0.669 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.771 16.664 -0.688 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.768 17.801 0.645 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -3.517 19.123 -3.222 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -2.639 17.616 -2.936 1.00 0.00 H new ATOM 1211 N LEU A 81 1.005 17.244 0.949 1.00 0.00 N ATOM 1212 CA LEU A 81 1.699 16.870 2.176 1.00 0.00 C ATOM 1213 C LEU A 81 2.768 17.898 2.532 1.00 0.00 C ATOM 1214 O LEU A 81 3.412 18.467 1.651 1.00 0.00 O ATOM 1215 CB LEU A 81 2.336 15.488 2.025 1.00 0.00 C ATOM 1216 CG LEU A 81 1.483 14.429 1.324 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.346 13.263 0.869 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.371 13.945 2.245 1.00 0.00 C ATOM 0 H LEU A 81 1.620 17.431 0.157 1.00 0.00 H new ATOM 0 HA LEU A 81 0.967 16.840 2.983 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.269 15.598 1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.595 15.119 3.017 1.00 0.00 H new ATOM 0 HG LEU A 81 1.027 14.882 0.443 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.722 12.520 0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.105 13.622 0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.831 12.810 1.734 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.226 13.192 1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.807 13.510 3.144 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.265 14.786 2.521 1.00 0.00 H new ATOM 1230 N GLU A 82 2.952 18.129 3.828 1.00 0.00 N ATOM 1231 CA GLU A 82 3.945 19.088 4.299 1.00 0.00 C ATOM 1232 C GLU A 82 5.323 18.440 4.398 1.00 0.00 C ATOM 1233 O GLU A 82 5.463 17.277 4.779 1.00 0.00 O ATOM 1234 CB GLU A 82 3.535 19.653 5.661 1.00 0.00 C ATOM 1235 CG GLU A 82 2.449 20.712 5.578 1.00 0.00 C ATOM 1236 CD GLU A 82 3.008 22.102 5.338 1.00 0.00 C ATOM 1237 OE1 GLU A 82 3.962 22.488 6.044 1.00 0.00 O ATOM 1238 OE2 GLU A 82 2.490 22.803 4.443 1.00 0.00 O ATOM 0 H GLU A 82 2.427 17.666 4.570 1.00 0.00 H new ATOM 0 HA GLU A 82 3.997 19.903 3.577 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.187 18.837 6.294 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.412 20.081 6.146 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.759 20.458 4.773 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.873 20.710 6.504 1.00 0.00 H new ATOM 1245 N PRO A 83 6.365 19.210 4.048 1.00 0.00 N ATOM 1246 CA PRO A 83 7.750 18.732 4.090 1.00 0.00 C ATOM 1247 C PRO A 83 8.252 18.531 5.516 1.00 0.00 C ATOM 1248 O PRO A 83 7.660 19.036 6.468 1.00 0.00 O ATOM 1249 CB PRO A 83 8.532 19.853 3.401 1.00 0.00 C ATOM 1250 CG PRO A 83 7.699 21.072 3.598 1.00 0.00 C ATOM 1251 CD PRO A 83 6.270 20.604 3.586 1.00 0.00 C ATOM 0 HA PRO A 83 7.860 17.759 3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.522 19.974 3.842 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.679 19.640 2.342 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.941 21.562 4.541 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.878 21.799 2.806 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.645 21.205 4.247 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.834 20.668 2.589 1.00 0.00 H new ATOM 1259 N ASN A 84 9.347 17.791 5.654 1.00 0.00 N ATOM 1260 CA ASN A 84 9.928 17.523 6.964 1.00 0.00 C ATOM 1261 C ASN A 84 8.860 17.053 7.947 1.00 0.00 C ATOM 1262 O ASN A 84 8.888 17.404 9.127 1.00 0.00 O ATOM 1263 CB ASN A 84 10.618 18.777 7.505 1.00 0.00 C ATOM 1264 CG ASN A 84 11.610 18.461 8.608 1.00 0.00 C ATOM 1265 OD1 ASN A 84 11.319 17.679 9.514 1.00 0.00 O ATOM 1266 ND2 ASN A 84 12.787 19.070 8.537 1.00 0.00 N ATOM 0 H ASN A 84 9.850 17.366 4.875 1.00 0.00 H new ATOM 0 HA ASN A 84 10.667 16.730 6.851 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.134 19.284 6.690 1.00 0.00 H new ATOM 0 HB3 ASN A 84 9.865 19.468 7.884 1.00 0.00 H new ATOM 0 HD21 ASN A 84 13.494 18.898 9.252 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.984 19.710 7.768 1.00 0.00 H new ATOM 1273 N THR A 85 7.919 16.254 7.453 1.00 0.00 N ATOM 1274 CA THR A 85 6.843 15.734 8.287 1.00 0.00 C ATOM 1275 C THR A 85 6.671 14.233 8.091 1.00 0.00 C ATOM 1276 O THR A 85 7.046 13.683 7.054 1.00 0.00 O ATOM 1277 CB THR A 85 5.506 16.436 7.978 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.595 17.827 8.309 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.366 15.797 8.757 1.00 0.00 C ATOM 0 H THR A 85 7.881 15.953 6.479 1.00 0.00 H new ATOM 0 HA THR A 85 7.121 15.933 9.322 1.00 0.00 H new ATOM 0 HB THR A 85 5.302 16.328 6.913 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.259 18.259 7.732 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.433 16.309 8.522 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.282 14.746 8.482 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.565 15.878 9.826 1.00 0.00 H new ATOM 1287 N THR A 86 6.101 13.571 9.094 1.00 0.00 N ATOM 1288 CA THR A 86 5.881 12.132 9.033 1.00 0.00 C ATOM 1289 C THR A 86 4.397 11.807 8.907 1.00 0.00 C ATOM 1290 O THR A 86 3.550 12.508 9.462 1.00 0.00 O ATOM 1291 CB THR A 86 6.445 11.424 10.279 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.817 11.789 10.472 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.333 9.913 10.140 1.00 0.00 C ATOM 0 H THR A 86 5.784 14.010 9.958 1.00 0.00 H new ATOM 0 HA THR A 86 6.406 11.770 8.149 1.00 0.00 H new ATOM 0 HB THR A 86 5.860 11.739 11.144 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.167 11.336 11.267 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.738 9.435 11.032 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.286 9.635 10.023 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.895 9.585 9.266 1.00 0.00 H new ATOM 1301 N TYR A 87 4.089 10.743 8.175 1.00 0.00 N ATOM 1302 CA TYR A 87 2.705 10.327 7.975 1.00 0.00 C ATOM 1303 C TYR A 87 2.596 8.807 7.927 1.00 0.00 C ATOM 1304 O TYR A 87 3.442 8.131 7.345 1.00 0.00 O ATOM 1305 CB TYR A 87 2.151 10.931 6.683 1.00 0.00 C ATOM 1306 CG TYR A 87 2.430 12.410 6.538 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.706 12.871 6.240 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.416 13.347 6.696 1.00 0.00 C ATOM 1309 CE1 TYR A 87 3.965 14.221 6.108 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.665 14.699 6.564 1.00 0.00 C ATOM 1311 CZ TYR A 87 2.941 15.131 6.270 1.00 0.00 C ATOM 1312 OH TYR A 87 3.195 16.478 6.137 1.00 0.00 O ATOM 0 H TYR A 87 4.778 10.152 7.710 1.00 0.00 H new ATOM 0 HA TYR A 87 2.117 10.689 8.818 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.581 10.403 5.832 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.074 10.768 6.648 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.510 12.161 6.109 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.415 13.012 6.926 1.00 0.00 H new ATOM 0 HE1 TYR A 87 4.964 14.562 5.879 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.865 15.414 6.690 1.00 0.00 H new ATOM 0 HH TYR A 87 3.971 16.608 5.552 1.00 0.00 H new ATOM 1322 N GLU A 88 1.543 8.277 8.543 1.00 0.00 N ATOM 1323 CA GLU A 88 1.322 6.836 8.572 1.00 0.00 C ATOM 1324 C GLU A 88 0.356 6.412 7.468 1.00 0.00 C ATOM 1325 O GLU A 88 -0.782 6.878 7.414 1.00 0.00 O ATOM 1326 CB GLU A 88 0.775 6.408 9.935 1.00 0.00 C ATOM 1327 CG GLU A 88 1.580 6.943 11.108 1.00 0.00 C ATOM 1328 CD GLU A 88 1.419 6.100 12.359 1.00 0.00 C ATOM 1329 OE1 GLU A 88 0.276 5.973 12.845 1.00 0.00 O ATOM 1330 OE2 GLU A 88 2.436 5.567 12.851 1.00 0.00 O ATOM 0 H GLU A 88 0.831 8.823 9.028 1.00 0.00 H new ATOM 0 HA GLU A 88 2.280 6.344 8.403 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.256 6.749 10.027 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.756 5.319 9.984 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.634 6.981 10.833 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.269 7.966 11.321 1.00 0.00 H new ATOM 1337 N ILE A 89 0.819 5.527 6.593 1.00 0.00 N ATOM 1338 CA ILE A 89 -0.003 5.040 5.492 1.00 0.00 C ATOM 1339 C ILE A 89 -0.140 3.522 5.537 1.00 0.00 C ATOM 1340 O ILE A 89 0.779 2.819 5.958 1.00 0.00 O ATOM 1341 CB ILE A 89 0.581 5.452 4.128 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.077 4.515 3.029 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.101 5.448 4.179 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.437 4.972 1.633 1.00 0.00 C ATOM 0 H ILE A 89 1.759 5.132 6.625 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.987 5.494 5.608 1.00 0.00 H new ATOM 0 HB ILE A 89 0.248 6.464 3.898 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.489 3.520 3.194 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.007 4.428 3.106 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.498 5.741 3.207 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.441 6.152 4.938 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.454 4.447 4.428 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.048 4.260 0.905 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.002 5.954 1.448 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.521 5.032 1.538 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.291 3.023 5.098 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.547 1.588 5.087 1.00 0.00 C ATOM 1358 C ARG A 90 -2.320 1.183 3.836 1.00 0.00 C ATOM 1359 O ARG A 90 -3.298 1.831 3.461 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.327 1.178 6.337 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.477 2.115 6.671 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.439 1.483 7.665 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.769 2.081 7.595 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.639 2.059 8.599 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -6.320 1.472 9.744 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.831 2.625 8.458 1.00 0.00 N ATOM 0 H ARG A 90 -2.061 3.591 4.745 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.586 1.073 5.082 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.719 0.171 6.196 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.643 1.138 7.185 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.083 3.044 7.084 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.013 2.374 5.758 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.512 0.413 7.469 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.043 1.596 8.674 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.046 2.541 6.728 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.405 1.036 9.856 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.990 1.457 10.513 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.080 3.077 7.578 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.498 2.608 9.229 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.877 0.108 3.194 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.527 -0.384 1.985 1.00 0.00 C ATOM 1382 C VAL A 91 -3.446 -1.561 2.296 1.00 0.00 C ATOM 1383 O VAL A 91 -3.062 -2.491 3.004 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.494 -0.819 0.929 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -2.189 -1.237 -0.358 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.497 0.300 0.667 1.00 0.00 C ATOM 0 H VAL A 91 -1.070 -0.440 3.491 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.118 0.440 1.586 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.947 -1.680 1.314 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.443 -1.541 -1.092 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.859 -2.072 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.763 -0.398 -0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.226 -0.024 -0.082 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.026 1.181 0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.025 0.547 1.592 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.662 -1.511 1.760 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.635 -2.574 1.979 1.00 0.00 C ATOM 1398 C ALA A 92 -6.287 -2.998 0.667 1.00 0.00 C ATOM 1399 O ALA A 92 -6.395 -2.205 -0.268 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.693 -2.125 2.975 1.00 0.00 C ATOM 0 H ALA A 92 -4.996 -0.747 1.172 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.109 -3.436 2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.413 -2.929 3.129 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.218 -1.877 3.924 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.208 -1.246 2.587 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.721 -4.253 0.606 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.365 -4.781 -0.591 1.00 0.00 C ATOM 1408 C ALA A 93 -8.878 -4.838 -0.421 1.00 0.00 C ATOM 1409 O ALA A 93 -9.383 -5.420 0.539 1.00 0.00 O ATOM 1410 CB ALA A 93 -6.815 -6.161 -0.920 1.00 0.00 C ATOM 0 H ALA A 93 -6.638 -4.923 1.371 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.145 -4.108 -1.419 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.304 -6.544 -1.816 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.741 -6.093 -1.094 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.005 -6.837 -0.086 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.599 -4.231 -1.359 1.00 0.00 N ATOM 1417 CA VAL A 94 -11.057 -4.213 -1.312 1.00 0.00 C ATOM 1418 C VAL A 94 -11.654 -4.876 -2.548 1.00 0.00 C ATOM 1419 O VAL A 94 -11.260 -4.578 -3.675 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.597 -2.775 -1.202 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -13.117 -2.770 -1.257 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -11.100 -2.116 0.076 1.00 0.00 C ATOM 0 H VAL A 94 -9.197 -3.745 -2.161 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.353 -4.773 -0.425 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.224 -2.200 -2.049 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.481 -1.745 -1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.448 -3.201 -2.202 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.513 -3.360 -0.431 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.491 -1.100 0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.442 -2.689 0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.010 -2.085 0.070 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.607 -5.774 -2.329 1.00 0.00 N ATOM 1433 CA ASN A 95 -13.260 -6.480 -3.426 1.00 0.00 C ATOM 1434 C ASN A 95 -14.774 -6.487 -3.244 1.00 0.00 C ATOM 1435 O ASN A 95 -15.296 -5.934 -2.277 1.00 0.00 O ATOM 1436 CB ASN A 95 -12.739 -7.916 -3.518 1.00 0.00 C ATOM 1437 CG ASN A 95 -13.326 -8.813 -2.444 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -14.166 -8.385 -1.653 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.884 -10.064 -2.413 1.00 0.00 N ATOM 0 H ASN A 95 -12.945 -6.031 -1.402 1.00 0.00 H new ATOM 0 HA ASN A 95 -13.026 -5.956 -4.353 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -12.978 -8.324 -4.500 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.653 -7.912 -3.431 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.242 -10.714 -1.713 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.187 -10.375 -3.089 1.00 0.00 H new ATOM 1446 N GLY A 96 -15.475 -7.118 -4.181 1.00 0.00 N ATOM 1447 CA GLY A 96 -16.923 -7.186 -4.106 1.00 0.00 C ATOM 1448 C GLY A 96 -17.418 -7.452 -2.698 1.00 0.00 C ATOM 1449 O GLY A 96 -18.419 -6.880 -2.265 1.00 0.00 O ATOM 0 H GLY A 96 -15.066 -7.584 -4.991 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -17.347 -6.249 -4.466 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -17.282 -7.973 -4.769 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.718 -8.323 -1.980 1.00 0.00 N ATOM 1454 CA LYS A 97 -17.091 -8.665 -0.613 1.00 0.00 C ATOM 1455 C LYS A 97 -17.063 -7.431 0.283 1.00 0.00 C ATOM 1456 O LYS A 97 -18.089 -7.023 0.827 1.00 0.00 O ATOM 1457 CB LYS A 97 -16.147 -9.734 -0.057 1.00 0.00 C ATOM 1458 CG LYS A 97 -16.002 -10.946 -0.961 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.172 -11.902 -0.804 1.00 0.00 C ATOM 1460 CE LYS A 97 -18.351 -11.486 -1.671 1.00 0.00 C ATOM 1461 NZ LYS A 97 -19.156 -12.657 -2.111 1.00 0.00 N ATOM 0 H LYS A 97 -15.888 -8.806 -2.323 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.107 -9.059 -0.628 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -15.164 -9.291 0.103 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -16.513 -10.059 0.917 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.934 -10.621 -1.999 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.073 -11.466 -0.728 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -16.858 -12.910 -1.074 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -17.480 -11.933 0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -18.986 -10.797 -1.114 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -17.986 -10.947 -2.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -19.949 -12.331 -2.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -18.557 -13.302 -2.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -19.525 -13.157 -1.277 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.882 -6.840 0.433 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.743 -5.657 1.263 1.00 0.00 C ATOM 1477 C GLY A 98 -14.300 -5.219 1.411 1.00 0.00 C ATOM 1478 O GLY A 98 -13.549 -5.195 0.436 1.00 0.00 O ATOM 0 H GLY A 98 -15.018 -7.159 -0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -16.324 -4.843 0.830 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.162 -5.858 2.249 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.912 -4.868 2.634 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.550 -4.425 2.904 1.00 0.00 C ATOM 1484 C GLN A 99 -11.841 -5.392 3.847 1.00 0.00 C ATOM 1485 O GLN A 99 -12.134 -5.436 5.041 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.558 -3.019 3.507 1.00 0.00 C ATOM 1487 CG GLN A 99 -11.170 -2.427 3.687 1.00 0.00 C ATOM 1488 CD GLN A 99 -11.163 -0.914 3.577 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -12.000 -0.234 4.172 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -10.215 -0.380 2.816 1.00 0.00 N ATOM 0 H GLN A 99 -14.521 -4.882 3.452 1.00 0.00 H new ATOM 0 HA GLN A 99 -12.007 -4.403 1.959 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -13.144 -2.361 2.866 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -13.059 -3.050 4.475 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.778 -2.719 4.661 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.500 -2.845 2.936 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -9.542 -0.982 2.342 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -10.159 0.633 2.706 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.907 -6.165 3.302 1.00 0.00 N ATOM 1500 CA GLY A 100 -10.171 -7.120 4.110 1.00 0.00 C ATOM 1501 C GLY A 100 -9.403 -6.458 5.237 1.00 0.00 C ATOM 1502 O GLY A 100 -9.823 -5.425 5.759 1.00 0.00 O ATOM 0 H GLY A 100 -10.647 -6.147 2.316 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.865 -7.849 4.527 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.476 -7.669 3.475 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.278 -7.054 5.614 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.451 -6.515 6.688 1.00 0.00 C ATOM 1508 C ASP A 101 -6.380 -5.581 6.133 1.00 0.00 C ATOM 1509 O ASP A 101 -5.810 -5.836 5.071 1.00 0.00 O ATOM 1510 CB ASP A 101 -6.796 -7.651 7.475 1.00 0.00 C ATOM 1511 CG ASP A 101 -7.754 -8.307 8.449 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -8.612 -9.096 8.000 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -7.646 -8.033 9.663 1.00 0.00 O ATOM 0 H ASP A 101 -7.917 -7.910 5.193 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.095 -5.944 7.357 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.419 -8.401 6.779 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.936 -7.262 8.021 1.00 0.00 H new ATOM 1518 N TYR A 102 -6.112 -4.501 6.856 1.00 0.00 N ATOM 1519 CA TYR A 102 -5.112 -3.526 6.434 1.00 0.00 C ATOM 1520 C TYR A 102 -3.704 -4.104 6.556 1.00 0.00 C ATOM 1521 O TYR A 102 -3.469 -5.040 7.319 1.00 0.00 O ATOM 1522 CB TYR A 102 -5.226 -2.251 7.270 1.00 0.00 C ATOM 1523 CG TYR A 102 -6.201 -1.242 6.706 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -5.842 -0.418 5.646 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.480 -1.114 7.230 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -6.728 0.506 5.128 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.375 -0.195 6.717 1.00 0.00 C ATOM 1528 CZ TYR A 102 -7.994 0.614 5.667 1.00 0.00 C ATOM 1529 OH TYR A 102 -8.880 1.532 5.152 1.00 0.00 O ATOM 0 H TYR A 102 -6.573 -4.277 7.738 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.297 -3.283 5.388 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.535 -2.516 8.281 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.242 -1.789 7.348 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -4.853 -0.502 5.220 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.781 -1.744 8.054 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -6.432 1.141 4.306 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.367 -0.111 7.136 1.00 0.00 H new ATOM 0 HH TYR A 102 -9.727 1.480 5.642 1.00 0.00 H new ATOM 1539 N SER A 103 -2.772 -3.536 5.797 1.00 0.00 N ATOM 1540 CA SER A 103 -1.388 -3.994 5.817 1.00 0.00 C ATOM 1541 C SER A 103 -0.611 -3.330 6.951 1.00 0.00 C ATOM 1542 O SER A 103 -1.026 -2.301 7.484 1.00 0.00 O ATOM 1543 CB SER A 103 -0.711 -3.698 4.477 1.00 0.00 C ATOM 1544 OG SER A 103 -0.497 -2.306 4.312 1.00 0.00 O ATOM 0 H SER A 103 -2.950 -2.759 5.161 1.00 0.00 H new ATOM 0 HA SER A 103 -1.390 -5.071 5.985 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.242 -4.225 4.423 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.330 -4.073 3.662 1.00 0.00 H new ATOM 0 HG SER A 103 -0.062 -2.142 3.449 1.00 0.00 H new ATOM 1550 N LYS A 104 0.520 -3.926 7.313 1.00 0.00 N ATOM 1551 CA LYS A 104 1.356 -3.393 8.382 1.00 0.00 C ATOM 1552 C LYS A 104 1.516 -1.883 8.248 1.00 0.00 C ATOM 1553 O LYS A 104 2.155 -1.397 7.314 1.00 0.00 O ATOM 1554 CB LYS A 104 2.732 -4.065 8.362 1.00 0.00 C ATOM 1555 CG LYS A 104 3.499 -3.917 9.665 1.00 0.00 C ATOM 1556 CD LYS A 104 4.357 -2.663 9.667 1.00 0.00 C ATOM 1557 CE LYS A 104 5.565 -2.811 8.757 1.00 0.00 C ATOM 1558 NZ LYS A 104 6.600 -1.777 9.037 1.00 0.00 N ATOM 0 H LYS A 104 0.879 -4.778 6.882 1.00 0.00 H new ATOM 0 HA LYS A 104 0.866 -3.605 9.332 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.606 -5.125 8.142 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.323 -3.639 7.551 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.798 -3.881 10.499 1.00 0.00 H new ATOM 0 HG3 LYS A 104 4.131 -4.792 9.818 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.759 -1.811 9.343 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.690 -2.451 10.683 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.998 -3.803 8.887 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.248 -2.735 7.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.408 -1.912 8.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.194 -0.831 8.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.921 -1.865 10.022 1.00 0.00 H new ATOM 1572 N ILE A 105 0.931 -1.146 9.186 1.00 0.00 N ATOM 1573 CA ILE A 105 1.009 0.310 9.173 1.00 0.00 C ATOM 1574 C ILE A 105 2.392 0.781 8.734 1.00 0.00 C ATOM 1575 O ILE A 105 3.404 0.395 9.318 1.00 0.00 O ATOM 1576 CB ILE A 105 0.693 0.903 10.558 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.739 0.557 10.971 1.00 0.00 C ATOM 1578 CG2 ILE A 105 0.898 2.410 10.548 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.791 1.165 10.068 1.00 0.00 C ATOM 0 H ILE A 105 0.398 -1.533 9.965 1.00 0.00 H new ATOM 0 HA ILE A 105 0.264 0.660 8.459 1.00 0.00 H new ATOM 0 HB ILE A 105 1.376 0.468 11.288 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.856 -0.527 10.974 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.907 0.898 11.992 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.671 2.815 11.534 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.934 2.635 10.294 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.237 2.862 9.809 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.782 0.878 10.420 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.700 2.251 10.084 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.649 0.804 9.049 1.00 0.00 H new ATOM 1591 N GLU A 106 2.426 1.620 7.702 1.00 0.00 N ATOM 1592 CA GLU A 106 3.684 2.144 7.187 1.00 0.00 C ATOM 1593 C GLU A 106 3.889 3.593 7.621 1.00 0.00 C ATOM 1594 O GLU A 106 2.930 4.356 7.745 1.00 0.00 O ATOM 1595 CB GLU A 106 3.715 2.049 5.661 1.00 0.00 C ATOM 1596 CG GLU A 106 3.693 0.623 5.139 1.00 0.00 C ATOM 1597 CD GLU A 106 5.042 -0.060 5.249 1.00 0.00 C ATOM 1598 OE1 GLU A 106 6.069 0.650 5.213 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.071 -1.303 5.371 1.00 0.00 O ATOM 0 H GLU A 106 1.597 1.950 7.208 1.00 0.00 H new ATOM 0 HA GLU A 106 4.494 1.541 7.598 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.860 2.589 5.254 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.611 2.548 5.293 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.953 0.048 5.695 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.376 0.627 4.096 1.00 0.00 H new ATOM 1606 N ILE A 107 5.144 3.964 7.852 1.00 0.00 N ATOM 1607 CA ILE A 107 5.474 5.320 8.273 1.00 0.00 C ATOM 1608 C ILE A 107 6.569 5.916 7.394 1.00 0.00 C ATOM 1609 O ILE A 107 7.711 5.458 7.409 1.00 0.00 O ATOM 1610 CB ILE A 107 5.934 5.358 9.742 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.870 4.735 10.649 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.228 6.789 10.167 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.377 4.402 12.034 1.00 0.00 C ATOM 0 H ILE A 107 5.949 3.345 7.755 1.00 0.00 H new ATOM 0 HA ILE A 107 4.565 5.912 8.171 1.00 0.00 H new ATOM 0 HB ILE A 107 6.850 4.776 9.836 1.00 0.00 H new ATOM 0 HG12 ILE A 107 4.029 5.423 10.734 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.492 3.826 10.181 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.552 6.800 11.208 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.016 7.201 9.537 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.326 7.392 10.061 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.570 3.964 12.621 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.199 3.690 11.959 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.728 5.312 12.521 1.00 0.00 H new ATOM 1625 N PHE A 108 6.211 6.943 6.629 1.00 0.00 N ATOM 1626 CA PHE A 108 7.163 7.604 5.743 1.00 0.00 C ATOM 1627 C PHE A 108 7.270 9.090 6.073 1.00 0.00 C ATOM 1628 O PHE A 108 6.267 9.753 6.333 1.00 0.00 O ATOM 1629 CB PHE A 108 6.744 7.423 4.283 1.00 0.00 C ATOM 1630 CG PHE A 108 5.512 8.199 3.913 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.549 9.580 3.821 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.317 7.545 3.655 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.417 10.297 3.480 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.183 8.257 3.313 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.232 9.635 3.227 1.00 0.00 C ATOM 0 H PHE A 108 5.270 7.335 6.605 1.00 0.00 H new ATOM 0 HA PHE A 108 8.140 7.145 5.892 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.566 7.731 3.637 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.568 6.364 4.092 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.473 10.103 4.018 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.272 6.468 3.722 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.460 11.374 3.412 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.258 7.736 3.113 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.346 10.193 2.963 1.00 0.00 H new ATOM 1645 N GLN A 109 8.496 9.606 6.060 1.00 0.00 N ATOM 1646 CA GLN A 109 8.734 11.012 6.358 1.00 0.00 C ATOM 1647 C GLN A 109 9.187 11.765 5.111 1.00 0.00 C ATOM 1648 O GLN A 109 10.222 11.449 4.523 1.00 0.00 O ATOM 1649 CB GLN A 109 9.787 11.151 7.460 1.00 0.00 C ATOM 1650 CG GLN A 109 10.186 12.590 7.744 1.00 0.00 C ATOM 1651 CD GLN A 109 11.438 12.691 8.593 1.00 0.00 C ATOM 1652 OE1 GLN A 109 11.527 12.088 9.664 1.00 0.00 O ATOM 1653 NE2 GLN A 109 12.414 13.457 8.120 1.00 0.00 N ATOM 0 H GLN A 109 9.338 9.071 5.846 1.00 0.00 H new ATOM 0 HA GLN A 109 7.796 11.447 6.703 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.403 10.702 8.376 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.675 10.586 7.176 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.348 13.111 6.801 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.365 13.097 8.251 1.00 0.00 H new ATOM 0 HE21 GLN A 109 12.298 13.938 7.228 1.00 0.00 H new ATOM 0 HE22 GLN A 109 13.280 13.564 8.648 1.00 0.00 H new ATOM 1662 N THR A 110 8.403 12.761 4.710 1.00 0.00 N ATOM 1663 CA THR A 110 8.720 13.557 3.531 1.00 0.00 C ATOM 1664 C THR A 110 10.104 14.187 3.650 1.00 0.00 C ATOM 1665 O THR A 110 10.682 14.238 4.736 1.00 0.00 O ATOM 1666 CB THR A 110 7.680 14.670 3.308 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.593 15.501 4.470 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.313 14.078 2.998 1.00 0.00 C ATOM 0 H THR A 110 7.543 13.036 5.185 1.00 0.00 H new ATOM 0 HA THR A 110 8.704 12.879 2.678 1.00 0.00 H new ATOM 0 HB THR A 110 8.001 15.271 2.457 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.789 16.059 4.414 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.594 14.883 2.844 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.376 13.470 2.095 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.988 13.456 3.832 1.00 0.00 H new ATOM 1676 N LEU A 111 10.629 14.666 2.528 1.00 0.00 N ATOM 1677 CA LEU A 111 11.945 15.294 2.507 1.00 0.00 C ATOM 1678 C LEU A 111 11.842 16.786 2.811 1.00 0.00 C ATOM 1679 O LEU A 111 10.899 17.464 2.400 1.00 0.00 O ATOM 1680 CB LEU A 111 12.610 15.085 1.145 1.00 0.00 C ATOM 1681 CG LEU A 111 12.906 13.635 0.759 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.222 13.532 -0.725 1.00 0.00 C ATOM 1683 CD2 LEU A 111 14.057 13.086 1.590 1.00 0.00 C ATOM 0 H LEU A 111 10.164 14.632 1.621 1.00 0.00 H new ATOM 0 HA LEU A 111 12.556 14.826 3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.968 15.520 0.379 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.547 15.642 1.131 1.00 0.00 H new ATOM 0 HG LEU A 111 12.018 13.036 0.963 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.430 12.493 -0.981 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.369 13.885 -1.304 1.00 0.00 H new ATOM 0 HD13 LEU A 111 14.094 14.144 -0.955 1.00 0.00 H new ATOM 0 HD21 LEU A 111 14.254 12.053 1.302 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.950 13.687 1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.793 13.124 2.647 1.00 0.00 H new ATOM 1695 N PRO A 112 12.835 17.310 3.544 1.00 0.00 N ATOM 1696 CA PRO A 112 12.880 18.728 3.917 1.00 0.00 C ATOM 1697 C PRO A 112 13.153 19.633 2.721 1.00 0.00 C ATOM 1698 O PRO A 112 14.197 19.529 2.076 1.00 0.00 O ATOM 1699 CB PRO A 112 14.038 18.795 4.915 1.00 0.00 C ATOM 1700 CG PRO A 112 14.911 17.641 4.560 1.00 0.00 C ATOM 1701 CD PRO A 112 13.990 16.562 4.065 1.00 0.00 C ATOM 0 HA PRO A 112 11.929 19.074 4.323 1.00 0.00 H new ATOM 0 HB2 PRO A 112 14.577 19.739 4.833 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.680 18.720 5.942 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.633 17.920 3.793 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.480 17.302 5.425 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.460 15.958 3.289 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.700 15.883 4.867 1.00 0.00 H new ATOM 1709 N VAL A 113 12.208 20.523 2.429 1.00 0.00 N ATOM 1710 CA VAL A 113 12.349 21.447 1.311 1.00 0.00 C ATOM 1711 C VAL A 113 13.804 21.859 1.117 1.00 0.00 C ATOM 1712 O VAL A 113 14.492 22.216 2.073 1.00 0.00 O ATOM 1713 CB VAL A 113 11.493 22.712 1.518 1.00 0.00 C ATOM 1714 CG1 VAL A 113 11.672 23.674 0.354 1.00 0.00 C ATOM 1715 CG2 VAL A 113 10.028 22.340 1.692 1.00 0.00 C ATOM 0 H VAL A 113 11.338 20.623 2.952 1.00 0.00 H new ATOM 0 HA VAL A 113 12.002 20.922 0.421 1.00 0.00 H new ATOM 0 HB VAL A 113 11.828 23.212 2.426 1.00 0.00 H new ATOM 0 HG11 VAL A 113 11.060 24.561 0.518 1.00 0.00 H new ATOM 0 HG12 VAL A 113 12.720 23.965 0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.364 23.187 -0.571 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.438 23.245 1.837 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.677 21.817 0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 113 9.918 21.692 2.561 1.00 0.00 H new ATOM 1725 N SER A 114 14.267 21.807 -0.127 1.00 0.00 N ATOM 1726 CA SER A 114 15.642 22.170 -0.447 1.00 0.00 C ATOM 1727 C SER A 114 15.682 23.228 -1.547 1.00 0.00 C ATOM 1728 O SER A 114 15.404 22.941 -2.710 1.00 0.00 O ATOM 1729 CB SER A 114 16.431 20.935 -0.884 1.00 0.00 C ATOM 1730 OG SER A 114 17.686 21.298 -1.432 1.00 0.00 O ATOM 0 H SER A 114 13.710 21.517 -0.931 1.00 0.00 H new ATOM 0 HA SER A 114 16.100 22.585 0.451 1.00 0.00 H new ATOM 0 HB2 SER A 114 16.581 20.275 -0.030 1.00 0.00 H new ATOM 0 HB3 SER A 114 15.857 20.375 -1.622 1.00 0.00 H new ATOM 0 HG SER A 114 18.171 20.490 -1.702 1.00 0.00 H new ATOM 1736 N GLY A 115 16.031 24.453 -1.168 1.00 0.00 N ATOM 1737 CA GLY A 115 16.103 25.536 -2.132 1.00 0.00 C ATOM 1738 C GLY A 115 17.467 25.646 -2.782 1.00 0.00 C ATOM 1739 O GLY A 115 18.477 25.202 -2.234 1.00 0.00 O ATOM 0 H GLY A 115 16.265 24.715 -0.211 1.00 0.00 H new ATOM 0 HA2 GLY A 115 15.348 25.382 -2.903 1.00 0.00 H new ATOM 0 HA3 GLY A 115 15.864 26.476 -1.635 1.00 0.00 H new ATOM 1743 N PRO A 116 17.510 26.247 -3.980 1.00 0.00 N ATOM 1744 CA PRO A 116 18.756 26.426 -4.733 1.00 0.00 C ATOM 1745 C PRO A 116 19.686 27.443 -4.079 1.00 0.00 C ATOM 1746 O PRO A 116 19.308 28.593 -3.858 1.00 0.00 O ATOM 1747 CB PRO A 116 18.278 26.936 -6.094 1.00 0.00 C ATOM 1748 CG PRO A 116 16.965 27.584 -5.817 1.00 0.00 C ATOM 1749 CD PRO A 116 16.346 26.799 -4.693 1.00 0.00 C ATOM 0 HA PRO A 116 19.336 25.504 -4.788 1.00 0.00 H new ATOM 0 HB2 PRO A 116 18.987 27.645 -6.522 1.00 0.00 H new ATOM 0 HB3 PRO A 116 18.173 26.119 -6.808 1.00 0.00 H new ATOM 0 HG2 PRO A 116 17.097 28.629 -5.537 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.328 27.569 -6.701 1.00 0.00 H new ATOM 0 HD2 PRO A 116 15.742 27.434 -4.045 1.00 0.00 H new ATOM 0 HD3 PRO A 116 15.692 26.010 -5.066 1.00 0.00 H new ATOM 1757 N SER A 117 20.905 27.011 -3.773 1.00 0.00 N ATOM 1758 CA SER A 117 21.890 27.883 -3.143 1.00 0.00 C ATOM 1759 C SER A 117 22.462 28.874 -4.151 1.00 0.00 C ATOM 1760 O SER A 117 22.601 30.062 -3.859 1.00 0.00 O ATOM 1761 CB SER A 117 23.019 27.053 -2.529 1.00 0.00 C ATOM 1762 OG SER A 117 23.741 26.356 -3.529 1.00 0.00 O ATOM 0 H SER A 117 21.235 26.062 -3.951 1.00 0.00 H new ATOM 0 HA SER A 117 21.390 28.443 -2.353 1.00 0.00 H new ATOM 0 HB2 SER A 117 23.695 27.705 -1.976 1.00 0.00 H new ATOM 0 HB3 SER A 117 22.605 26.343 -1.813 1.00 0.00 H new ATOM 0 HG SER A 117 24.458 25.835 -3.111 1.00 0.00 H new ATOM 1768 N SER A 118 22.793 28.377 -5.339 1.00 0.00 N ATOM 1769 CA SER A 118 23.354 29.217 -6.389 1.00 0.00 C ATOM 1770 C SER A 118 22.513 30.475 -6.587 1.00 0.00 C ATOM 1771 O SER A 118 21.285 30.427 -6.543 1.00 0.00 O ATOM 1772 CB SER A 118 23.441 28.437 -7.703 1.00 0.00 C ATOM 1773 OG SER A 118 22.151 28.121 -8.195 1.00 0.00 O ATOM 0 H SER A 118 22.682 27.397 -5.597 1.00 0.00 H new ATOM 0 HA SER A 118 24.357 29.516 -6.084 1.00 0.00 H new ATOM 0 HB2 SER A 118 23.982 29.026 -8.444 1.00 0.00 H new ATOM 0 HB3 SER A 118 24.009 27.520 -7.548 1.00 0.00 H new ATOM 0 HG SER A 118 22.234 27.624 -9.036 1.00 0.00 H new ATOM 1779 N GLY A 119 23.186 31.601 -6.805 1.00 0.00 N ATOM 1780 CA GLY A 119 22.486 32.856 -7.006 1.00 0.00 C ATOM 1781 C GLY A 119 23.402 34.058 -6.878 1.00 0.00 C ATOM 1782 O GLY A 119 23.691 34.733 -7.865 1.00 0.00 O ATOM 0 H GLY A 119 24.203 31.666 -6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 119 22.026 32.857 -7.994 1.00 0.00 H new ATOM 0 HA3 GLY A 119 21.679 32.939 -6.278 1.00 0.00 H new TER 1786 GLY A 119