USER MOD reduce.3.24.130724 H: found=0, std=0, add=965, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 963 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 35 HIS : no HD1:sc= -2.59 K(o=-2.5,f=-3.6!) USER MOD Set 1.2: A 48 TYR OH : rot -94:sc= 0.104 USER MOD Set 2.1: A 26 SER OG : rot 75:sc= 0.154 USER MOD Set 2.2: A 29 ASN : amide:sc= -0.69 K(o=-0.54,f=-3.8!) USER MOD Single : A 1 GLY N :NH3+ -144:sc= 0.0101 (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 18:sc= 0.905 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.85 K(o=-0.85,f=-3!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 160:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 145:sc= -0.691 (180deg=-1.93!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.0749) USER MOD Single : A 36 SER OG : rot -37:sc= -0.331 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.852 USER MOD Single : A 51 THR OG1 : rot 180:sc= -4.28! USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc=-0.00159 USER MOD Single : A 66 ASN : amide:sc= -0.991 K(o=-0.99,f=-1.5) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -3.13! C(o=-3.1!,f=-4.7!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 17:sc= 1.13 USER MOD Single : A 89 THR OG1 : rot -12:sc= 0.905 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.513 K(o=-0.51,f=0) USER MOD Single : A 99 ASN : amide:sc= -6.61! C(o=-6.6!,f=-11!) USER MOD Single : A 102 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0416) USER MOD Single : A 109 LYS NZ :NH3+ -159:sc= -0.0665 (180deg=-0.379) USER MOD Single : A 114 ASN : amide:sc= -1.49 X(o=-1.5,f=-1.8) USER MOD Single : A 116 ASN : amide:sc=-0.00432 X(o=-0.0043,f=-0.0043) USER MOD Single : A 121 THR OG1 : rot 45:sc= 0.652 USER MOD Single : A 122 GLN : amide:sc= -5.93! C(o=-5.9!,f=-6.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.309 1.823 15.569 1.00 0.00 N ATOM 2 CA GLY A 1 -17.033 1.714 16.989 1.00 0.00 C ATOM 3 C GLY A 1 -17.462 2.947 17.760 1.00 0.00 C ATOM 4 O GLY A 1 -18.492 3.550 17.457 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.590 0.893 15.198 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.080 2.504 15.416 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.455 2.150 15.073 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.548 0.841 17.390 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.966 1.550 17.137 1.00 0.00 H new ATOM 8 N SER A 2 -16.672 3.322 18.761 1.00 0.00 N ATOM 9 CA SER A 2 -16.978 4.488 19.581 1.00 0.00 C ATOM 10 C SER A 2 -15.735 4.974 20.320 1.00 0.00 C ATOM 11 O SER A 2 -14.827 4.195 20.609 1.00 0.00 O ATOM 12 CB SER A 2 -18.084 4.156 20.584 1.00 0.00 C ATOM 13 OG SER A 2 -17.610 3.284 21.596 1.00 0.00 O ATOM 0 H SER A 2 -15.815 2.835 19.024 1.00 0.00 H new ATOM 0 HA SER A 2 -17.322 5.285 18.922 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.457 5.075 21.037 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.923 3.693 20.065 1.00 0.00 H new ATOM 0 HG SER A 2 -18.335 3.088 22.225 1.00 0.00 H new ATOM 19 N SER A 3 -15.703 6.268 20.622 1.00 0.00 N ATOM 20 CA SER A 3 -14.570 6.861 21.324 1.00 0.00 C ATOM 21 C SER A 3 -13.258 6.515 20.626 1.00 0.00 C ATOM 22 O SER A 3 -12.271 6.166 21.273 1.00 0.00 O ATOM 23 CB SER A 3 -14.532 6.377 22.775 1.00 0.00 C ATOM 24 OG SER A 3 -15.561 6.979 23.541 1.00 0.00 O ATOM 0 H SER A 3 -16.448 6.926 20.392 1.00 0.00 H new ATOM 0 HA SER A 3 -14.693 7.944 21.313 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.641 5.293 22.803 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.563 6.612 23.215 1.00 0.00 H new ATOM 0 HG SER A 3 -15.516 6.652 24.464 1.00 0.00 H new ATOM 30 N GLY A 4 -13.255 6.616 19.300 1.00 0.00 N ATOM 31 CA GLY A 4 -12.060 6.312 18.536 1.00 0.00 C ATOM 32 C GLY A 4 -11.576 7.494 17.721 1.00 0.00 C ATOM 33 O GLY A 4 -12.294 7.996 16.855 1.00 0.00 O ATOM 0 H GLY A 4 -14.059 6.903 18.742 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.269 5.995 19.216 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.262 5.474 17.869 1.00 0.00 H new ATOM 37 N SER A 5 -10.356 7.943 17.997 1.00 0.00 N ATOM 38 CA SER A 5 -9.779 9.078 17.287 1.00 0.00 C ATOM 39 C SER A 5 -8.258 9.076 17.405 1.00 0.00 C ATOM 40 O SER A 5 -7.688 8.346 18.215 1.00 0.00 O ATOM 41 CB SER A 5 -10.343 10.390 17.835 1.00 0.00 C ATOM 42 OG SER A 5 -11.633 10.649 17.310 1.00 0.00 O ATOM 0 H SER A 5 -9.747 7.537 18.708 1.00 0.00 H new ATOM 0 HA SER A 5 -10.044 8.989 16.234 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.393 10.342 18.923 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.672 11.211 17.582 1.00 0.00 H new ATOM 0 HG SER A 5 -12.007 9.823 16.939 1.00 0.00 H new ATOM 48 N SER A 6 -7.607 9.900 16.590 1.00 0.00 N ATOM 49 CA SER A 6 -6.151 9.992 16.599 1.00 0.00 C ATOM 50 C SER A 6 -5.692 11.383 16.171 1.00 0.00 C ATOM 51 O SER A 6 -6.371 12.064 15.404 1.00 0.00 O ATOM 52 CB SER A 6 -5.547 8.935 15.672 1.00 0.00 C ATOM 53 OG SER A 6 -4.246 8.569 16.098 1.00 0.00 O ATOM 0 H SER A 6 -8.064 10.513 15.915 1.00 0.00 H new ATOM 0 HA SER A 6 -5.806 9.812 17.617 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.188 8.054 15.653 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.505 9.321 14.653 1.00 0.00 H new ATOM 0 HG SER A 6 -3.882 7.891 15.491 1.00 0.00 H new ATOM 59 N GLY A 7 -4.534 11.798 16.675 1.00 0.00 N ATOM 60 CA GLY A 7 -4.003 13.105 16.335 1.00 0.00 C ATOM 61 C GLY A 7 -2.620 13.026 15.718 1.00 0.00 C ATOM 62 O GLY A 7 -1.655 13.548 16.276 1.00 0.00 O ATOM 0 H GLY A 7 -3.954 11.252 17.313 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.681 13.599 15.639 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.962 13.722 17.233 1.00 0.00 H new ATOM 66 N GLN A 8 -2.524 12.371 14.566 1.00 0.00 N ATOM 67 CA GLN A 8 -1.249 12.224 13.875 1.00 0.00 C ATOM 68 C GLN A 8 -1.349 12.717 12.435 1.00 0.00 C ATOM 69 O GLN A 8 -1.889 12.029 11.568 1.00 0.00 O ATOM 70 CB GLN A 8 -0.798 10.762 13.896 1.00 0.00 C ATOM 71 CG GLN A 8 -0.612 10.203 15.297 1.00 0.00 C ATOM 72 CD GLN A 8 0.404 10.985 16.107 1.00 0.00 C ATOM 73 OE1 GLN A 8 1.124 11.829 15.573 1.00 0.00 O ATOM 74 NE2 GLN A 8 0.467 10.708 17.404 1.00 0.00 N ATOM 0 H GLN A 8 -3.314 11.934 14.091 1.00 0.00 H new ATOM 0 HA GLN A 8 -0.510 12.832 14.397 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.533 10.156 13.367 1.00 0.00 H new ATOM 0 HB3 GLN A 8 0.141 10.672 13.350 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -1.570 10.211 15.817 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.294 9.162 15.230 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -0.149 10.001 17.805 1.00 0.00 H new ATOM 0 HE22 GLN A 8 1.131 11.203 17.999 1.00 0.00 H new ATOM 83 N LYS A 9 -0.827 13.913 12.186 1.00 0.00 N ATOM 84 CA LYS A 9 -0.857 14.499 10.852 1.00 0.00 C ATOM 85 C LYS A 9 -0.624 13.434 9.785 1.00 0.00 C ATOM 86 O LYS A 9 0.142 12.492 9.991 1.00 0.00 O ATOM 87 CB LYS A 9 0.202 15.597 10.730 1.00 0.00 C ATOM 88 CG LYS A 9 -0.091 16.821 11.581 1.00 0.00 C ATOM 89 CD LYS A 9 -0.917 17.844 10.820 1.00 0.00 C ATOM 90 CE LYS A 9 -0.672 19.254 11.338 1.00 0.00 C ATOM 91 NZ LYS A 9 -1.579 19.595 12.468 1.00 0.00 N ATOM 0 H LYS A 9 -0.377 14.496 12.892 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.844 14.935 10.697 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.171 15.189 11.017 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.280 15.901 9.686 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.624 16.519 12.483 1.00 0.00 H new ATOM 0 HG3 LYS A 9 0.846 17.275 11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -0.670 17.797 9.759 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.975 17.600 10.912 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.364 19.346 11.663 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -0.817 19.969 10.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -1.381 20.563 12.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.567 19.532 12.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -1.423 18.929 13.251 1.00 0.00 H new ATOM 105 N ARG A 10 -1.289 13.590 8.644 1.00 0.00 N ATOM 106 CA ARG A 10 -1.154 12.641 7.545 1.00 0.00 C ATOM 107 C ARG A 10 -1.283 13.347 6.199 1.00 0.00 C ATOM 108 O ARG A 10 -2.129 14.223 6.025 1.00 0.00 O ATOM 109 CB ARG A 10 -2.211 11.542 7.660 1.00 0.00 C ATOM 110 CG ARG A 10 -3.634 12.070 7.733 1.00 0.00 C ATOM 111 CD ARG A 10 -3.943 12.650 9.105 1.00 0.00 C ATOM 112 NE ARG A 10 -5.375 12.641 9.394 1.00 0.00 N ATOM 113 CZ ARG A 10 -6.231 13.525 8.895 1.00 0.00 C ATOM 114 NH1 ARG A 10 -5.802 14.485 8.086 1.00 0.00 N ATOM 115 NH2 ARG A 10 -7.519 13.451 9.204 1.00 0.00 N ATOM 0 H ARG A 10 -1.926 14.364 8.457 1.00 0.00 H new ATOM 0 HA ARG A 10 -0.163 12.191 7.606 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.124 10.875 6.802 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.008 10.946 8.550 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -3.778 12.837 6.972 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -4.334 11.265 7.511 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -3.416 12.077 9.868 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -3.569 13.672 9.159 1.00 0.00 H new ATOM 0 HE ARG A 10 -5.737 11.916 10.013 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.812 14.545 7.846 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.462 15.163 7.704 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.853 12.714 9.826 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.175 14.131 8.820 1.00 0.00 H new ATOM 129 N ALA A 11 -0.436 12.960 5.250 1.00 0.00 N ATOM 130 CA ALA A 11 -0.456 13.555 3.919 1.00 0.00 C ATOM 131 C ALA A 11 -1.469 12.854 3.020 1.00 0.00 C ATOM 132 O ALA A 11 -2.374 13.487 2.478 1.00 0.00 O ATOM 133 CB ALA A 11 0.931 13.502 3.297 1.00 0.00 C ATOM 0 H ALA A 11 0.272 12.237 5.378 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.758 14.598 4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.902 13.950 2.304 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.632 14.054 3.923 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.255 12.464 3.218 1.00 0.00 H new ATOM 139 N TRP A 12 -1.309 11.545 2.866 1.00 0.00 N ATOM 140 CA TRP A 12 -2.209 10.758 2.031 1.00 0.00 C ATOM 141 C TRP A 12 -3.024 9.785 2.876 1.00 0.00 C ATOM 142 O TRP A 12 -2.514 9.202 3.833 1.00 0.00 O ATOM 143 CB TRP A 12 -1.416 9.992 0.971 1.00 0.00 C ATOM 144 CG TRP A 12 -0.032 9.626 1.413 1.00 0.00 C ATOM 145 CD1 TRP A 12 0.315 8.970 2.560 1.00 0.00 C ATOM 146 CD2 TRP A 12 1.190 9.898 0.718 1.00 0.00 C ATOM 147 NE1 TRP A 12 1.680 8.817 2.619 1.00 0.00 N ATOM 148 CE2 TRP A 12 2.239 9.377 1.501 1.00 0.00 C ATOM 149 CE3 TRP A 12 1.500 10.528 -0.490 1.00 0.00 C ATOM 150 CZ2 TRP A 12 3.573 9.470 1.113 1.00 0.00 C ATOM 151 CZ3 TRP A 12 2.824 10.619 -0.873 1.00 0.00 C ATOM 152 CH2 TRP A 12 3.848 10.092 -0.074 1.00 0.00 C ATOM 0 H TRP A 12 -0.565 11.006 3.308 1.00 0.00 H new ATOM 0 HA TRP A 12 -2.896 11.443 1.535 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -1.958 9.083 0.709 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -1.353 10.598 0.067 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -0.380 8.623 3.310 1.00 0.00 H new ATOM 0 HE1 TRP A 12 2.193 8.360 3.373 1.00 0.00 H new ATOM 0 HE3 TRP A 12 0.718 10.937 -1.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 4.363 9.065 1.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 3.075 11.105 -1.804 1.00 0.00 H new ATOM 0 HH2 TRP A 12 4.873 10.179 -0.402 1.00 0.00 H new ATOM 163 N ILE A 13 -4.292 9.613 2.516 1.00 0.00 N ATOM 164 CA ILE A 13 -5.176 8.709 3.241 1.00 0.00 C ATOM 165 C ILE A 13 -4.914 7.257 2.855 1.00 0.00 C ATOM 166 O ILE A 13 -5.731 6.623 2.186 1.00 0.00 O ATOM 167 CB ILE A 13 -6.657 9.039 2.979 1.00 0.00 C ATOM 168 CG1 ILE A 13 -6.976 10.460 3.448 1.00 0.00 C ATOM 169 CG2 ILE A 13 -7.556 8.030 3.677 1.00 0.00 C ATOM 170 CD1 ILE A 13 -8.329 10.958 2.988 1.00 0.00 C ATOM 0 H ILE A 13 -4.730 10.088 1.727 1.00 0.00 H new ATOM 0 HA ILE A 13 -4.965 8.844 4.302 1.00 0.00 H new ATOM 0 HB ILE A 13 -6.843 8.980 1.907 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.937 10.492 4.537 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -6.205 11.137 3.081 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -8.600 8.277 3.482 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -7.343 7.030 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -7.371 8.059 4.751 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -8.488 11.971 3.357 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -8.365 10.958 1.899 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -9.109 10.304 3.377 1.00 0.00 H new ATOM 182 N THR A 14 -3.769 6.734 3.282 1.00 0.00 N ATOM 183 CA THR A 14 -3.398 5.357 2.983 1.00 0.00 C ATOM 184 C THR A 14 -3.958 4.398 4.027 1.00 0.00 C ATOM 185 O THR A 14 -3.967 4.700 5.220 1.00 0.00 O ATOM 186 CB THR A 14 -1.869 5.188 2.915 1.00 0.00 C ATOM 187 OG1 THR A 14 -1.277 5.581 4.158 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.283 6.019 1.783 1.00 0.00 C ATOM 0 H THR A 14 -3.082 7.244 3.837 1.00 0.00 H new ATOM 0 HA THR A 14 -3.825 5.120 2.009 1.00 0.00 H new ATOM 0 HB THR A 14 -1.649 4.137 2.725 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.384 5.185 4.234 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.202 5.884 1.754 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.714 5.698 0.835 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.513 7.072 1.948 1.00 0.00 H new ATOM 196 N ALA A 15 -4.424 3.240 3.570 1.00 0.00 N ATOM 197 CA ALA A 15 -4.982 2.235 4.466 1.00 0.00 C ATOM 198 C ALA A 15 -4.115 0.981 4.494 1.00 0.00 C ATOM 199 O ALA A 15 -3.425 0.652 3.529 1.00 0.00 O ATOM 200 CB ALA A 15 -6.403 1.886 4.047 1.00 0.00 C ATOM 0 H ALA A 15 -4.426 2.975 2.585 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.003 2.653 5.472 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.808 1.134 4.725 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -7.024 2.781 4.085 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -6.396 1.492 3.031 1.00 0.00 H new ATOM 206 N PRO A 16 -4.147 0.264 5.627 1.00 0.00 N ATOM 207 CA PRO A 16 -3.368 -0.965 5.808 1.00 0.00 C ATOM 208 C PRO A 16 -3.889 -2.113 4.951 1.00 0.00 C ATOM 209 O PRO A 16 -5.053 -2.502 5.057 1.00 0.00 O ATOM 210 CB PRO A 16 -3.548 -1.283 7.295 1.00 0.00 C ATOM 211 CG PRO A 16 -4.840 -0.641 7.666 1.00 0.00 C ATOM 212 CD PRO A 16 -4.946 0.597 6.818 1.00 0.00 C ATOM 0 HA PRO A 16 -2.328 -0.836 5.508 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.576 -2.359 7.469 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -2.724 -0.885 7.887 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.677 -1.314 7.481 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -4.861 -0.390 8.727 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.981 0.819 6.558 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.552 1.473 7.334 1.00 0.00 H new ATOM 220 N VAL A 17 -3.021 -2.653 4.101 1.00 0.00 N ATOM 221 CA VAL A 17 -3.394 -3.758 3.226 1.00 0.00 C ATOM 222 C VAL A 17 -3.424 -5.077 3.990 1.00 0.00 C ATOM 223 O VAL A 17 -2.441 -5.464 4.621 1.00 0.00 O ATOM 224 CB VAL A 17 -2.421 -3.887 2.039 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.878 -4.984 1.090 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.293 -2.558 1.309 1.00 0.00 C ATOM 0 H VAL A 17 -2.055 -2.343 4.000 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.392 -3.538 2.846 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.439 -4.160 2.425 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.178 -5.060 0.258 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.913 -5.934 1.623 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.871 -4.745 0.708 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.602 -2.667 0.473 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.270 -2.253 0.934 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.915 -1.801 1.996 1.00 0.00 H new ATOM 236 N ALA A 18 -4.560 -5.765 3.927 1.00 0.00 N ATOM 237 CA ALA A 18 -4.717 -7.043 4.611 1.00 0.00 C ATOM 238 C ALA A 18 -5.147 -8.136 3.639 1.00 0.00 C ATOM 239 O ALA A 18 -6.333 -8.451 3.527 1.00 0.00 O ATOM 240 CB ALA A 18 -5.725 -6.914 5.743 1.00 0.00 C ATOM 0 H ALA A 18 -5.384 -5.459 3.410 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.751 -7.325 5.029 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.833 -7.875 6.245 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.376 -6.168 6.457 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.689 -6.606 5.338 1.00 0.00 H new ATOM 246 N LEU A 19 -4.178 -8.711 2.936 1.00 0.00 N ATOM 247 CA LEU A 19 -4.456 -9.770 1.972 1.00 0.00 C ATOM 248 C LEU A 19 -4.314 -11.145 2.616 1.00 0.00 C ATOM 249 O LEU A 19 -3.569 -11.315 3.581 1.00 0.00 O ATOM 250 CB LEU A 19 -3.512 -9.656 0.773 1.00 0.00 C ATOM 251 CG LEU A 19 -3.423 -8.277 0.118 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.328 -8.258 -0.938 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.762 -7.889 -0.493 1.00 0.00 C ATOM 0 H LEU A 19 -3.192 -8.462 3.015 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.484 -9.654 1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.512 -9.949 1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.828 -10.375 0.017 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.172 -7.546 0.887 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.279 -7.269 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.370 -8.491 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.549 -9.000 -1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.680 -6.905 -0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.043 -8.622 -1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.523 -7.862 0.287 1.00 0.00 H new ATOM 265 N ARG A 20 -5.033 -12.123 2.076 1.00 0.00 N ATOM 266 CA ARG A 20 -4.987 -13.483 2.597 1.00 0.00 C ATOM 267 C ARG A 20 -3.981 -14.329 1.822 1.00 0.00 C ATOM 268 O ARG A 20 -3.945 -14.295 0.593 1.00 0.00 O ATOM 269 CB ARG A 20 -6.373 -14.127 2.526 1.00 0.00 C ATOM 270 CG ARG A 20 -6.621 -15.159 3.614 1.00 0.00 C ATOM 271 CD ARG A 20 -7.861 -15.990 3.321 1.00 0.00 C ATOM 272 NE ARG A 20 -9.087 -15.301 3.716 1.00 0.00 N ATOM 273 CZ ARG A 20 -10.295 -15.849 3.642 1.00 0.00 C ATOM 274 NH1 ARG A 20 -10.437 -17.088 3.192 1.00 0.00 N ATOM 275 NH2 ARG A 20 -11.363 -15.158 4.020 1.00 0.00 N ATOM 0 H ARG A 20 -5.655 -11.998 1.277 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.669 -13.435 3.639 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.131 -13.347 2.597 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.495 -14.602 1.552 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.754 -15.814 3.700 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.737 -14.656 4.574 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.901 -16.219 2.256 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -7.793 -16.941 3.849 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.011 -14.347 4.068 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.618 -17.622 2.902 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.365 -17.507 3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -11.257 -14.205 4.368 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -12.290 -15.580 3.963 1.00 0.00 H new ATOM 289 N GLU A 21 -3.166 -15.086 2.551 1.00 0.00 N ATOM 290 CA GLU A 21 -2.159 -15.939 1.930 1.00 0.00 C ATOM 291 C GLU A 21 -2.791 -17.210 1.372 1.00 0.00 C ATOM 292 O GLU A 21 -3.846 -17.646 1.832 1.00 0.00 O ATOM 293 CB GLU A 21 -1.070 -16.300 2.944 1.00 0.00 C ATOM 294 CG GLU A 21 -1.520 -17.312 3.985 1.00 0.00 C ATOM 295 CD GLU A 21 -0.380 -18.173 4.491 1.00 0.00 C ATOM 296 OE1 GLU A 21 0.324 -18.777 3.654 1.00 0.00 O ATOM 297 OE2 GLU A 21 -0.191 -18.245 5.724 1.00 0.00 O ATOM 0 H GLU A 21 -3.183 -15.126 3.570 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.710 -15.386 1.105 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.207 -16.699 2.411 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.741 -15.392 3.450 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.974 -16.786 4.825 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.291 -17.952 3.555 1.00 0.00 H new ATOM 304 N GLY A 22 -2.139 -17.800 0.375 1.00 0.00 N ATOM 305 CA GLY A 22 -2.652 -19.015 -0.231 1.00 0.00 C ATOM 306 C GLY A 22 -2.673 -18.943 -1.745 1.00 0.00 C ATOM 307 O GLY A 22 -2.224 -19.867 -2.422 1.00 0.00 O ATOM 0 H GLY A 22 -1.265 -17.458 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.038 -19.860 0.081 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.662 -19.202 0.135 1.00 0.00 H new ATOM 311 N GLU A 23 -3.198 -17.844 -2.277 1.00 0.00 N ATOM 312 CA GLU A 23 -3.278 -17.657 -3.721 1.00 0.00 C ATOM 313 C GLU A 23 -2.736 -16.289 -4.124 1.00 0.00 C ATOM 314 O GLU A 23 -2.485 -15.434 -3.274 1.00 0.00 O ATOM 315 CB GLU A 23 -4.724 -17.806 -4.197 1.00 0.00 C ATOM 316 CG GLU A 23 -5.695 -16.870 -3.497 1.00 0.00 C ATOM 317 CD GLU A 23 -7.095 -16.944 -4.073 1.00 0.00 C ATOM 318 OE1 GLU A 23 -7.222 -17.137 -5.301 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.065 -16.808 -3.298 1.00 0.00 O ATOM 0 H GLU A 23 -3.574 -17.070 -1.730 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.666 -18.424 -4.195 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -4.765 -17.622 -5.271 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -5.046 -18.835 -4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.729 -17.116 -2.436 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -5.328 -15.847 -3.575 1.00 0.00 H new ATOM 326 N ASP A 24 -2.557 -16.090 -5.425 1.00 0.00 N ATOM 327 CA ASP A 24 -2.045 -14.826 -5.941 1.00 0.00 C ATOM 328 C ASP A 24 -3.140 -13.764 -5.962 1.00 0.00 C ATOM 329 O ASP A 24 -4.106 -13.867 -6.720 1.00 0.00 O ATOM 330 CB ASP A 24 -1.478 -15.018 -7.349 1.00 0.00 C ATOM 331 CG ASP A 24 -0.677 -13.819 -7.819 1.00 0.00 C ATOM 332 OD1 ASP A 24 -0.944 -12.700 -7.332 1.00 0.00 O ATOM 333 OD2 ASP A 24 0.216 -14.000 -8.673 1.00 0.00 O ATOM 0 H ASP A 24 -2.759 -16.787 -6.141 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.248 -14.488 -5.279 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.843 -15.904 -7.364 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.296 -15.200 -8.045 1.00 0.00 H new ATOM 338 N LEU A 25 -2.984 -12.744 -5.124 1.00 0.00 N ATOM 339 CA LEU A 25 -3.960 -11.663 -5.045 1.00 0.00 C ATOM 340 C LEU A 25 -3.717 -10.629 -6.139 1.00 0.00 C ATOM 341 O LEU A 25 -3.745 -9.425 -5.886 1.00 0.00 O ATOM 342 CB LEU A 25 -3.898 -10.993 -3.671 1.00 0.00 C ATOM 343 CG LEU A 25 -4.761 -11.623 -2.577 1.00 0.00 C ATOM 344 CD1 LEU A 25 -6.223 -11.643 -2.996 1.00 0.00 C ATOM 345 CD2 LEU A 25 -4.277 -13.030 -2.259 1.00 0.00 C ATOM 0 H LEU A 25 -2.191 -12.643 -4.490 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.952 -12.091 -5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.861 -10.995 -3.334 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.194 -9.950 -3.784 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.670 -11.017 -1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.822 -12.095 -2.205 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.565 -10.623 -3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.331 -12.225 -3.911 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.903 -13.462 -1.478 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.337 -13.647 -3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.244 -12.990 -1.915 1.00 0.00 H new ATOM 357 N SER A 26 -3.481 -11.107 -7.356 1.00 0.00 N ATOM 358 CA SER A 26 -3.232 -10.224 -8.490 1.00 0.00 C ATOM 359 C SER A 26 -4.544 -9.751 -9.109 1.00 0.00 C ATOM 360 O SER A 26 -4.693 -9.720 -10.330 1.00 0.00 O ATOM 361 CB SER A 26 -2.386 -10.940 -9.545 1.00 0.00 C ATOM 362 OG SER A 26 -1.781 -10.012 -10.428 1.00 0.00 O ATOM 0 H SER A 26 -3.457 -12.101 -7.583 1.00 0.00 H new ATOM 0 HA SER A 26 -2.687 -9.353 -8.127 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.616 -11.536 -9.055 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.012 -11.630 -10.111 1.00 0.00 H new ATOM 0 HG SER A 26 -1.039 -9.563 -9.972 1.00 0.00 H new ATOM 368 N LYS A 27 -5.494 -9.383 -8.256 1.00 0.00 N ATOM 369 CA LYS A 27 -6.794 -8.910 -8.716 1.00 0.00 C ATOM 370 C LYS A 27 -7.132 -7.557 -8.097 1.00 0.00 C ATOM 371 O LYS A 27 -7.478 -6.609 -8.802 1.00 0.00 O ATOM 372 CB LYS A 27 -7.883 -9.928 -8.368 1.00 0.00 C ATOM 373 CG LYS A 27 -7.975 -11.081 -9.352 1.00 0.00 C ATOM 374 CD LYS A 27 -8.940 -12.151 -8.869 1.00 0.00 C ATOM 375 CE LYS A 27 -8.240 -13.179 -7.995 1.00 0.00 C ATOM 376 NZ LYS A 27 -7.946 -12.644 -6.636 1.00 0.00 N ATOM 0 H LYS A 27 -5.388 -9.403 -7.242 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.747 -8.793 -9.799 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.691 -10.326 -7.372 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -8.846 -9.418 -8.328 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.301 -10.707 -10.323 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.987 -11.519 -9.495 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.750 -11.685 -8.307 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.392 -12.649 -9.727 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -8.865 -14.068 -7.908 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.310 -13.489 -8.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.041 -13.406 -5.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.975 -12.271 -6.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.616 -11.881 -6.411 1.00 0.00 H new ATOM 390 N LYS A 28 -7.026 -7.474 -6.775 1.00 0.00 N ATOM 391 CA LYS A 28 -7.317 -6.237 -6.060 1.00 0.00 C ATOM 392 C LYS A 28 -6.406 -5.109 -6.533 1.00 0.00 C ATOM 393 O LYS A 28 -6.854 -3.981 -6.737 1.00 0.00 O ATOM 394 CB LYS A 28 -7.151 -6.444 -4.553 1.00 0.00 C ATOM 395 CG LYS A 28 -8.289 -7.222 -3.917 1.00 0.00 C ATOM 396 CD LYS A 28 -8.300 -8.670 -4.376 1.00 0.00 C ATOM 397 CE LYS A 28 -9.281 -9.505 -3.567 1.00 0.00 C ATOM 398 NZ LYS A 28 -10.695 -9.164 -3.887 1.00 0.00 N ATOM 0 H LYS A 28 -6.741 -8.249 -6.177 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.350 -5.959 -6.270 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.214 -6.970 -4.368 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.071 -5.471 -4.068 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.195 -7.184 -2.832 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -9.239 -6.752 -4.171 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.566 -8.716 -5.432 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.299 -9.090 -4.281 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.108 -10.563 -3.766 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.101 -9.348 -2.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.332 -9.754 -3.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.867 -8.161 -3.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.874 -9.338 -4.897 1.00 0.00 H new ATOM 412 N ASN A 29 -5.125 -5.421 -6.705 1.00 0.00 N ATOM 413 CA ASN A 29 -4.152 -4.433 -7.155 1.00 0.00 C ATOM 414 C ASN A 29 -4.777 -3.471 -8.161 1.00 0.00 C ATOM 415 O ASN A 29 -5.619 -3.847 -8.977 1.00 0.00 O ATOM 416 CB ASN A 29 -2.941 -5.127 -7.782 1.00 0.00 C ATOM 417 CG ASN A 29 -3.341 -6.186 -8.791 1.00 0.00 C ATOM 418 OD1 ASN A 29 -4.523 -6.367 -9.082 1.00 0.00 O ATOM 419 ND2 ASN A 29 -2.354 -6.891 -9.331 1.00 0.00 N ATOM 0 H ASN A 29 -4.737 -6.350 -6.539 1.00 0.00 H new ATOM 0 HA ASN A 29 -3.826 -3.861 -6.286 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -2.312 -4.383 -8.270 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -2.341 -5.586 -6.996 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.562 -7.617 -10.017 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.388 -6.707 -9.060 1.00 0.00 H new ATOM 426 N PRO A 30 -4.358 -2.198 -8.102 1.00 0.00 N ATOM 427 CA PRO A 30 -3.357 -1.738 -7.135 1.00 0.00 C ATOM 428 C PRO A 30 -3.892 -1.730 -5.707 1.00 0.00 C ATOM 429 O PRO A 30 -4.983 -1.221 -5.446 1.00 0.00 O ATOM 430 CB PRO A 30 -3.045 -0.313 -7.598 1.00 0.00 C ATOM 431 CG PRO A 30 -4.268 0.125 -8.326 1.00 0.00 C ATOM 432 CD PRO A 30 -4.828 -1.110 -8.976 1.00 0.00 C ATOM 0 HA PRO A 30 -2.485 -2.392 -7.108 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -2.833 0.341 -6.752 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.169 -0.290 -8.246 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.992 0.568 -7.642 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.028 0.883 -9.071 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.916 -1.078 -9.028 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.463 -1.228 -9.996 1.00 0.00 H new ATOM 440 N ILE A 31 -3.118 -2.295 -4.787 1.00 0.00 N ATOM 441 CA ILE A 31 -3.515 -2.350 -3.385 1.00 0.00 C ATOM 442 C ILE A 31 -3.099 -1.083 -2.646 1.00 0.00 C ATOM 443 O ILE A 31 -3.756 -0.665 -1.693 1.00 0.00 O ATOM 444 CB ILE A 31 -2.901 -3.571 -2.674 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.374 -3.509 -2.734 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.409 -4.860 -3.302 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.693 -4.608 -1.950 1.00 0.00 C ATOM 0 H ILE A 31 -2.213 -2.721 -4.987 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.601 -2.438 -3.367 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.206 -3.555 -1.628 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.057 -3.567 -3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.043 -2.543 -2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.966 -5.714 -2.789 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.494 -4.905 -3.212 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.131 -4.886 -4.356 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.388 -4.501 -2.038 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.981 -4.538 -0.901 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -0.995 -5.578 -2.345 1.00 0.00 H new ATOM 459 N ALA A 32 -2.005 -0.476 -3.093 1.00 0.00 N ATOM 460 CA ALA A 32 -1.504 0.746 -2.476 1.00 0.00 C ATOM 461 C ALA A 32 -1.819 1.965 -3.337 1.00 0.00 C ATOM 462 O ALA A 32 -2.086 1.842 -4.533 1.00 0.00 O ATOM 463 CB ALA A 32 -0.005 0.640 -2.238 1.00 0.00 C ATOM 0 H ALA A 32 -1.449 -0.810 -3.880 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.006 0.872 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 32 0.356 1.559 -1.777 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.200 -0.202 -1.577 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.505 0.487 -3.189 1.00 0.00 H new ATOM 469 N LYS A 33 -1.789 3.142 -2.721 1.00 0.00 N ATOM 470 CA LYS A 33 -2.071 4.384 -3.430 1.00 0.00 C ATOM 471 C LYS A 33 -1.540 5.586 -2.655 1.00 0.00 C ATOM 472 O LYS A 33 -2.022 5.895 -1.565 1.00 0.00 O ATOM 473 CB LYS A 33 -3.577 4.535 -3.657 1.00 0.00 C ATOM 474 CG LYS A 33 -3.975 5.890 -4.215 1.00 0.00 C ATOM 475 CD LYS A 33 -5.369 6.293 -3.762 1.00 0.00 C ATOM 476 CE LYS A 33 -6.442 5.672 -4.644 1.00 0.00 C ATOM 477 NZ LYS A 33 -6.844 4.322 -4.160 1.00 0.00 N ATOM 0 H LYS A 33 -1.572 3.262 -1.732 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.566 4.345 -4.395 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.913 3.757 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -4.096 4.374 -2.712 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.255 6.643 -3.893 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.940 5.860 -5.304 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.521 5.982 -2.728 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.461 7.379 -3.785 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.315 6.324 -4.668 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.073 5.596 -5.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.783 3.640 -4.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.208 4.025 -3.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.821 4.357 -3.806 1.00 0.00 H new ATOM 491 N ILE A 34 -0.546 6.259 -3.225 1.00 0.00 N ATOM 492 CA ILE A 34 0.048 7.428 -2.588 1.00 0.00 C ATOM 493 C ILE A 34 0.085 8.616 -3.544 1.00 0.00 C ATOM 494 O ILE A 34 0.574 8.506 -4.669 1.00 0.00 O ATOM 495 CB ILE A 34 1.477 7.135 -2.095 1.00 0.00 C ATOM 496 CG1 ILE A 34 2.266 6.381 -3.167 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.437 6.338 -0.800 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.756 6.632 -3.110 1.00 0.00 C ATOM 0 H ILE A 34 -0.135 6.015 -4.126 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.580 7.674 -1.731 1.00 0.00 H new ATOM 0 HB ILE A 34 1.980 8.082 -1.901 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.082 5.312 -3.058 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.895 6.670 -4.150 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.455 6.139 -0.464 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.908 6.910 -0.037 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.919 5.394 -0.970 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.251 6.065 -3.899 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.951 7.695 -3.250 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.141 6.317 -2.140 1.00 0.00 H new ATOM 510 N HIS A 35 -0.433 9.752 -3.088 1.00 0.00 N ATOM 511 CA HIS A 35 -0.457 10.962 -3.902 1.00 0.00 C ATOM 512 C HIS A 35 -0.537 12.206 -3.023 1.00 0.00 C ATOM 513 O HIS A 35 -1.393 12.303 -2.143 1.00 0.00 O ATOM 514 CB HIS A 35 -1.641 10.928 -4.868 1.00 0.00 C ATOM 515 CG HIS A 35 -1.706 9.680 -5.693 1.00 0.00 C ATOM 516 ND1 HIS A 35 -0.839 9.419 -6.734 1.00 0.00 N ATOM 517 CD2 HIS A 35 -2.541 8.617 -5.626 1.00 0.00 C ATOM 518 CE1 HIS A 35 -1.139 8.250 -7.271 1.00 0.00 C ATOM 519 NE2 HIS A 35 -2.167 7.742 -6.616 1.00 0.00 N ATOM 0 H HIS A 35 -0.842 9.860 -2.160 1.00 0.00 H new ATOM 0 HA HIS A 35 0.469 11.003 -4.476 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -2.566 11.026 -4.300 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -1.582 11.790 -5.532 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.351 8.482 -4.924 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -0.630 7.788 -8.104 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -2.611 6.845 -6.813 1.00 0.00 H new ATOM 528 N SER A 36 0.360 13.156 -3.267 1.00 0.00 N ATOM 529 CA SER A 36 0.394 14.393 -2.495 1.00 0.00 C ATOM 530 C SER A 36 -0.515 15.447 -3.118 1.00 0.00 C ATOM 531 O SER A 36 -0.329 16.646 -2.909 1.00 0.00 O ATOM 532 CB SER A 36 1.826 14.925 -2.407 1.00 0.00 C ATOM 533 OG SER A 36 1.864 16.178 -1.746 1.00 0.00 O ATOM 0 H SER A 36 1.073 13.093 -3.993 1.00 0.00 H new ATOM 0 HA SER A 36 0.033 14.175 -1.490 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.451 14.209 -1.873 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.242 15.026 -3.409 1.00 0.00 H new ATOM 0 HG SER A 36 1.071 16.700 -1.989 1.00 0.00 H new ATOM 539 N ASP A 37 -1.500 14.991 -3.885 1.00 0.00 N ATOM 540 CA ASP A 37 -2.440 15.894 -4.538 1.00 0.00 C ATOM 541 C ASP A 37 -1.740 17.170 -4.996 1.00 0.00 C ATOM 542 O ASP A 37 -2.303 18.263 -4.916 1.00 0.00 O ATOM 543 CB ASP A 37 -3.591 16.240 -3.592 1.00 0.00 C ATOM 544 CG ASP A 37 -3.107 16.601 -2.201 1.00 0.00 C ATOM 545 OD1 ASP A 37 -2.708 17.766 -1.994 1.00 0.00 O ATOM 546 OD2 ASP A 37 -3.129 15.718 -1.318 1.00 0.00 O ATOM 0 H ASP A 37 -1.668 14.002 -4.069 1.00 0.00 H new ATOM 0 HA ASP A 37 -2.842 15.387 -5.415 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -4.158 17.074 -4.004 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -4.273 15.392 -3.528 1.00 0.00 H new ATOM 551 N LEU A 38 -0.509 17.025 -5.474 1.00 0.00 N ATOM 552 CA LEU A 38 0.269 18.166 -5.943 1.00 0.00 C ATOM 553 C LEU A 38 0.829 17.906 -7.338 1.00 0.00 C ATOM 554 O LEU A 38 0.859 18.801 -8.182 1.00 0.00 O ATOM 555 CB LEU A 38 1.411 18.464 -4.970 1.00 0.00 C ATOM 556 CG LEU A 38 1.035 19.254 -3.716 1.00 0.00 C ATOM 557 CD1 LEU A 38 2.167 19.214 -2.701 1.00 0.00 C ATOM 558 CD2 LEU A 38 0.688 20.691 -4.075 1.00 0.00 C ATOM 0 H LEU A 38 -0.028 16.128 -5.547 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.393 19.031 -5.992 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.854 17.517 -4.660 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.183 19.017 -5.505 1.00 0.00 H new ATOM 0 HG LEU A 38 0.156 18.791 -3.268 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.882 19.781 -1.815 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.368 18.180 -2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.064 19.652 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.423 21.238 -3.170 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.548 21.166 -4.547 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.156 20.700 -4.765 1.00 0.00 H new ATOM 570 N ALA A 39 1.271 16.675 -7.573 1.00 0.00 N ATOM 571 CA ALA A 39 1.825 16.296 -8.867 1.00 0.00 C ATOM 572 C ALA A 39 0.802 16.489 -9.981 1.00 0.00 C ATOM 573 O ALA A 39 1.091 17.118 -10.998 1.00 0.00 O ATOM 574 CB ALA A 39 2.306 14.853 -8.833 1.00 0.00 C ATOM 0 H ALA A 39 1.256 15.923 -6.884 1.00 0.00 H new ATOM 0 HA ALA A 39 2.675 16.946 -9.075 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.717 14.584 -9.806 1.00 0.00 H new ATOM 0 HB2 ALA A 39 3.077 14.744 -8.070 1.00 0.00 H new ATOM 0 HB3 ALA A 39 1.469 14.196 -8.598 1.00 0.00 H new ATOM 580 N GLU A 40 -0.393 15.943 -9.781 1.00 0.00 N ATOM 581 CA GLU A 40 -1.459 16.055 -10.770 1.00 0.00 C ATOM 582 C GLU A 40 -2.165 17.403 -10.660 1.00 0.00 C ATOM 583 O GLU A 40 -2.498 18.024 -11.668 1.00 0.00 O ATOM 584 CB GLU A 40 -2.470 14.920 -10.593 1.00 0.00 C ATOM 585 CG GLU A 40 -3.507 14.851 -11.702 1.00 0.00 C ATOM 586 CD GLU A 40 -2.890 14.582 -13.061 1.00 0.00 C ATOM 587 OE1 GLU A 40 -2.357 13.470 -13.260 1.00 0.00 O ATOM 588 OE2 GLU A 40 -2.941 15.482 -13.925 1.00 0.00 O ATOM 0 H GLU A 40 -0.647 15.419 -8.944 1.00 0.00 H new ATOM 0 HA GLU A 40 -1.010 15.981 -11.760 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.935 13.972 -10.548 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.980 15.044 -9.638 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.228 14.066 -11.472 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.059 15.790 -11.737 1.00 0.00 H new ATOM 595 N GLU A 41 -2.390 17.847 -9.427 1.00 0.00 N ATOM 596 CA GLU A 41 -3.058 19.121 -9.185 1.00 0.00 C ATOM 597 C GLU A 41 -2.240 20.280 -9.747 1.00 0.00 C ATOM 598 O GLU A 41 -2.690 20.994 -10.643 1.00 0.00 O ATOM 599 CB GLU A 41 -3.288 19.324 -7.686 1.00 0.00 C ATOM 600 CG GLU A 41 -4.540 18.639 -7.164 1.00 0.00 C ATOM 601 CD GLU A 41 -5.756 18.908 -8.029 1.00 0.00 C ATOM 602 OE1 GLU A 41 -6.051 20.094 -8.287 1.00 0.00 O ATOM 603 OE2 GLU A 41 -6.412 17.932 -8.448 1.00 0.00 O ATOM 0 H GLU A 41 -2.120 17.344 -8.582 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.022 19.099 -9.694 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.423 18.947 -7.140 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.355 20.392 -7.479 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.367 17.564 -7.112 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.739 18.980 -6.148 1.00 0.00 H new ATOM 610 N ARG A 42 -1.035 20.460 -9.214 1.00 0.00 N ATOM 611 CA ARG A 42 -0.155 21.532 -9.661 1.00 0.00 C ATOM 612 C ARG A 42 0.773 21.047 -10.771 1.00 0.00 C ATOM 613 O ARG A 42 1.847 21.608 -10.985 1.00 0.00 O ATOM 614 CB ARG A 42 0.671 22.065 -8.488 1.00 0.00 C ATOM 615 CG ARG A 42 -0.171 22.667 -7.375 1.00 0.00 C ATOM 616 CD ARG A 42 -0.487 24.130 -7.644 1.00 0.00 C ATOM 617 NE ARG A 42 -1.406 24.683 -6.654 1.00 0.00 N ATOM 618 CZ ARG A 42 -1.602 25.985 -6.479 1.00 0.00 C ATOM 619 NH1 ARG A 42 -0.946 26.864 -7.226 1.00 0.00 N ATOM 620 NH2 ARG A 42 -2.455 26.412 -5.557 1.00 0.00 N ATOM 0 H ARG A 42 -0.647 19.877 -8.472 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.776 22.337 -10.055 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.272 21.253 -8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.365 22.821 -8.857 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.100 22.105 -7.276 1.00 0.00 H new ATOM 0 HG3 ARG A 42 0.359 22.577 -6.427 1.00 0.00 H new ATOM 0 HD2 ARG A 42 0.438 24.707 -7.642 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.923 24.230 -8.638 1.00 0.00 H new ATOM 0 HE ARG A 42 -1.926 24.034 -6.064 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -0.290 26.540 -7.936 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -1.098 27.863 -7.090 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -2.962 25.740 -4.981 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -2.604 27.412 -5.424 1.00 0.00 H new ATOM 634 N GLY A 43 0.350 20.001 -11.474 1.00 0.00 N ATOM 635 CA GLY A 43 1.155 19.458 -12.553 1.00 0.00 C ATOM 636 C GLY A 43 2.633 19.432 -12.217 1.00 0.00 C ATOM 637 O GLY A 43 3.478 19.651 -13.086 1.00 0.00 O ATOM 0 H GLY A 43 -0.535 19.520 -11.316 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.819 18.446 -12.779 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.000 20.054 -13.453 1.00 0.00 H new ATOM 641 N LEU A 44 2.946 19.166 -10.954 1.00 0.00 N ATOM 642 CA LEU A 44 4.333 19.114 -10.505 1.00 0.00 C ATOM 643 C LEU A 44 4.985 17.794 -10.902 1.00 0.00 C ATOM 644 O LEU A 44 4.302 16.798 -11.139 1.00 0.00 O ATOM 645 CB LEU A 44 4.406 19.296 -8.988 1.00 0.00 C ATOM 646 CG LEU A 44 4.534 20.735 -8.489 1.00 0.00 C ATOM 647 CD1 LEU A 44 4.086 20.840 -7.040 1.00 0.00 C ATOM 648 CD2 LEU A 44 5.965 21.228 -8.644 1.00 0.00 C ATOM 0 H LEU A 44 2.259 18.983 -10.223 1.00 0.00 H new ATOM 0 HA LEU A 44 4.876 19.926 -10.989 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.511 18.858 -8.546 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.257 18.726 -8.615 1.00 0.00 H new ATOM 0 HG LEU A 44 3.885 21.368 -9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.184 21.872 -6.703 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.045 20.529 -6.958 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.707 20.194 -6.419 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.037 22.254 -8.284 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.634 20.592 -8.064 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.251 21.192 -9.695 1.00 0.00 H new ATOM 660 N LYS A 45 6.312 17.793 -10.972 1.00 0.00 N ATOM 661 CA LYS A 45 7.059 16.595 -11.337 1.00 0.00 C ATOM 662 C LYS A 45 7.502 15.830 -10.094 1.00 0.00 C ATOM 663 O LYS A 45 8.437 16.237 -9.404 1.00 0.00 O ATOM 664 CB LYS A 45 8.279 16.967 -12.182 1.00 0.00 C ATOM 665 CG LYS A 45 8.000 16.996 -13.675 1.00 0.00 C ATOM 666 CD LYS A 45 7.349 18.304 -14.095 1.00 0.00 C ATOM 667 CE LYS A 45 6.956 18.284 -15.564 1.00 0.00 C ATOM 668 NZ LYS A 45 6.583 19.638 -16.057 1.00 0.00 N ATOM 0 H LYS A 45 6.893 18.609 -10.781 1.00 0.00 H new ATOM 0 HA LYS A 45 6.402 15.952 -11.923 1.00 0.00 H new ATOM 0 HB2 LYS A 45 8.642 17.946 -11.870 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.079 16.253 -11.984 1.00 0.00 H new ATOM 0 HG2 LYS A 45 8.932 16.860 -14.223 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.349 16.163 -13.941 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.465 18.485 -13.483 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.037 19.129 -13.913 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.785 17.898 -16.156 1.00 0.00 H new ATOM 0 HE3 LYS A 45 6.118 17.602 -15.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 6.322 19.582 -17.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.775 19.997 -15.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.391 20.283 -15.945 1.00 0.00 H new ATOM 682 N ILE A 46 6.826 14.720 -9.816 1.00 0.00 N ATOM 683 CA ILE A 46 7.153 13.898 -8.657 1.00 0.00 C ATOM 684 C ILE A 46 7.319 12.434 -9.052 1.00 0.00 C ATOM 685 O ILE A 46 6.494 11.877 -9.776 1.00 0.00 O ATOM 686 CB ILE A 46 6.070 14.005 -7.568 1.00 0.00 C ATOM 687 CG1 ILE A 46 5.929 15.454 -7.098 1.00 0.00 C ATOM 688 CG2 ILE A 46 6.405 13.093 -6.397 1.00 0.00 C ATOM 689 CD1 ILE A 46 5.296 15.587 -5.731 1.00 0.00 C ATOM 0 H ILE A 46 6.049 14.370 -10.377 1.00 0.00 H new ATOM 0 HA ILE A 46 8.095 14.274 -8.258 1.00 0.00 H new ATOM 0 HB ILE A 46 5.117 13.686 -7.991 1.00 0.00 H new ATOM 0 HG12 ILE A 46 6.915 15.919 -7.080 1.00 0.00 H new ATOM 0 HG13 ILE A 46 5.330 16.006 -7.822 1.00 0.00 H new ATOM 0 HG21 ILE A 46 5.630 13.180 -5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 46 6.459 12.061 -6.744 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.366 13.384 -5.972 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.228 16.641 -5.463 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.297 15.152 -5.749 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.906 15.064 -4.995 1.00 0.00 H new ATOM 701 N THR A 47 8.392 11.815 -8.568 1.00 0.00 N ATOM 702 CA THR A 47 8.667 10.416 -8.869 1.00 0.00 C ATOM 703 C THR A 47 8.407 9.531 -7.655 1.00 0.00 C ATOM 704 O THR A 47 8.844 9.839 -6.546 1.00 0.00 O ATOM 705 CB THR A 47 10.122 10.217 -9.333 1.00 0.00 C ATOM 706 OG1 THR A 47 10.459 11.194 -10.323 1.00 0.00 O ATOM 707 CG2 THR A 47 10.322 8.820 -9.903 1.00 0.00 C ATOM 0 H THR A 47 9.084 12.261 -7.966 1.00 0.00 H new ATOM 0 HA THR A 47 7.993 10.128 -9.676 1.00 0.00 H new ATOM 0 HB THR A 47 10.775 10.337 -8.469 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.386 11.061 -10.611 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.357 8.703 -10.224 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.093 8.079 -9.137 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.659 8.677 -10.756 1.00 0.00 H new ATOM 715 N TYR A 48 7.694 8.432 -7.872 1.00 0.00 N ATOM 716 CA TYR A 48 7.374 7.503 -6.795 1.00 0.00 C ATOM 717 C TYR A 48 8.374 6.351 -6.754 1.00 0.00 C ATOM 718 O TYR A 48 8.658 5.723 -7.774 1.00 0.00 O ATOM 719 CB TYR A 48 5.956 6.956 -6.968 1.00 0.00 C ATOM 720 CG TYR A 48 4.906 8.033 -7.114 1.00 0.00 C ATOM 721 CD1 TYR A 48 4.619 8.898 -6.064 1.00 0.00 C ATOM 722 CD2 TYR A 48 4.199 8.187 -8.300 1.00 0.00 C ATOM 723 CE1 TYR A 48 3.659 9.883 -6.192 1.00 0.00 C ATOM 724 CE2 TYR A 48 3.238 9.170 -8.437 1.00 0.00 C ATOM 725 CZ TYR A 48 2.972 10.016 -7.381 1.00 0.00 C ATOM 726 OH TYR A 48 2.015 10.995 -7.513 1.00 0.00 O ATOM 0 H TYR A 48 7.326 8.162 -8.784 1.00 0.00 H new ATOM 0 HA TYR A 48 7.434 8.046 -5.852 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.929 6.312 -7.847 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.708 6.333 -6.109 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.156 8.798 -5.132 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.404 7.527 -9.130 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.447 10.545 -5.366 1.00 0.00 H new ATOM 0 HE2 TYR A 48 2.698 9.275 -9.366 1.00 0.00 H new ATOM 0 HH TYR A 48 1.134 10.621 -7.303 1.00 0.00 H new ATOM 736 N LYS A 49 8.905 6.079 -5.566 1.00 0.00 N ATOM 737 CA LYS A 49 9.872 5.003 -5.388 1.00 0.00 C ATOM 738 C LYS A 49 9.378 3.993 -4.358 1.00 0.00 C ATOM 739 O LYS A 49 8.585 4.327 -3.477 1.00 0.00 O ATOM 740 CB LYS A 49 11.225 5.571 -4.954 1.00 0.00 C ATOM 741 CG LYS A 49 12.403 4.684 -5.318 1.00 0.00 C ATOM 742 CD LYS A 49 13.713 5.259 -4.808 1.00 0.00 C ATOM 743 CE LYS A 49 13.829 5.127 -3.297 1.00 0.00 C ATOM 744 NZ LYS A 49 15.038 5.819 -2.770 1.00 0.00 N ATOM 0 H LYS A 49 8.681 6.590 -4.712 1.00 0.00 H new ATOM 0 HA LYS A 49 9.990 4.493 -6.344 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.363 6.550 -5.413 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.216 5.724 -3.875 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.254 3.689 -4.898 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.452 4.569 -6.401 1.00 0.00 H new ATOM 0 HD2 LYS A 49 14.547 4.744 -5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.784 6.310 -5.089 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.938 5.544 -2.827 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.868 4.072 -3.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.080 5.705 -1.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.890 5.405 -3.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 14.989 6.831 -3.005 1.00 0.00 H new ATOM 758 N TYR A 50 9.853 2.758 -4.472 1.00 0.00 N ATOM 759 CA TYR A 50 9.459 1.699 -3.550 1.00 0.00 C ATOM 760 C TYR A 50 10.615 0.736 -3.299 1.00 0.00 C ATOM 761 O TYR A 50 11.428 0.477 -4.188 1.00 0.00 O ATOM 762 CB TYR A 50 8.255 0.934 -4.104 1.00 0.00 C ATOM 763 CG TYR A 50 6.928 1.592 -3.799 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.471 2.663 -4.557 1.00 0.00 C ATOM 765 CD2 TYR A 50 6.131 1.142 -2.754 1.00 0.00 C ATOM 766 CE1 TYR A 50 5.260 3.268 -4.283 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.917 1.740 -2.473 1.00 0.00 C ATOM 768 CZ TYR A 50 4.486 2.802 -3.240 1.00 0.00 C ATOM 769 OH TYR A 50 3.279 3.400 -2.962 1.00 0.00 O ATOM 0 H TYR A 50 10.512 2.465 -5.194 1.00 0.00 H new ATOM 0 HA TYR A 50 9.183 2.162 -2.602 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.363 0.836 -5.184 1.00 0.00 H new ATOM 0 HB3 TYR A 50 8.254 -0.075 -3.691 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.074 3.029 -5.375 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.466 0.311 -2.151 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.921 4.101 -4.881 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.309 1.378 -1.657 1.00 0.00 H new ATOM 0 HH TYR A 50 2.860 2.951 -2.199 1.00 0.00 H new ATOM 779 N THR A 51 10.683 0.208 -2.081 1.00 0.00 N ATOM 780 CA THR A 51 11.740 -0.726 -1.711 1.00 0.00 C ATOM 781 C THR A 51 11.389 -1.473 -0.429 1.00 0.00 C ATOM 782 O THR A 51 10.349 -1.226 0.180 1.00 0.00 O ATOM 783 CB THR A 51 13.086 -0.003 -1.519 1.00 0.00 C ATOM 784 OG1 THR A 51 13.989 -0.837 -0.784 1.00 0.00 O ATOM 785 CG2 THR A 51 12.893 1.315 -0.784 1.00 0.00 C ATOM 0 H THR A 51 10.019 0.411 -1.334 1.00 0.00 H new ATOM 0 HA THR A 51 11.833 -1.439 -2.530 1.00 0.00 H new ATOM 0 HB THR A 51 13.504 0.207 -2.503 1.00 0.00 H new ATOM 0 HG1 THR A 51 14.843 -0.371 -0.667 1.00 0.00 H new ATOM 0 HG21 THR A 51 13.858 1.807 -0.660 1.00 0.00 H new ATOM 0 HG22 THR A 51 12.228 1.959 -1.360 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.455 1.125 0.196 1.00 0.00 H new ATOM 793 N GLY A 52 12.264 -2.388 -0.025 1.00 0.00 N ATOM 794 CA GLY A 52 12.028 -3.157 1.183 1.00 0.00 C ATOM 795 C GLY A 52 11.802 -4.628 0.899 1.00 0.00 C ATOM 796 O GLY A 52 12.587 -5.261 0.192 1.00 0.00 O ATOM 0 H GLY A 52 13.132 -2.611 -0.512 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.881 -3.046 1.853 1.00 0.00 H new ATOM 0 HA3 GLY A 52 11.160 -2.753 1.703 1.00 0.00 H new ATOM 800 N LYS A 53 10.725 -5.177 1.453 1.00 0.00 N ATOM 801 CA LYS A 53 10.396 -6.584 1.256 1.00 0.00 C ATOM 802 C LYS A 53 9.371 -6.752 0.139 1.00 0.00 C ATOM 803 O LYS A 53 8.240 -6.279 0.245 1.00 0.00 O ATOM 804 CB LYS A 53 9.856 -7.189 2.554 1.00 0.00 C ATOM 805 CG LYS A 53 9.723 -8.701 2.511 1.00 0.00 C ATOM 806 CD LYS A 53 11.015 -9.387 2.921 1.00 0.00 C ATOM 807 CE LYS A 53 11.059 -9.642 4.420 1.00 0.00 C ATOM 808 NZ LYS A 53 12.322 -10.317 4.830 1.00 0.00 N ATOM 0 H LYS A 53 10.065 -4.668 2.042 1.00 0.00 H new ATOM 0 HA LYS A 53 11.308 -7.108 0.970 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.517 -6.914 3.376 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.881 -6.753 2.770 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.917 -9.015 3.174 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.447 -9.014 1.504 1.00 0.00 H new ATOM 0 HD2 LYS A 53 11.112 -10.332 2.387 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.864 -8.769 2.631 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.963 -8.696 4.953 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.207 -10.258 4.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.314 -10.473 5.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.401 -11.232 4.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.134 -9.718 4.577 1.00 0.00 H new ATOM 822 N GLY A 54 9.774 -7.431 -0.931 1.00 0.00 N ATOM 823 CA GLY A 54 8.877 -7.650 -2.051 1.00 0.00 C ATOM 824 C GLY A 54 9.102 -6.660 -3.176 1.00 0.00 C ATOM 825 O GLY A 54 8.306 -6.583 -4.112 1.00 0.00 O ATOM 0 H GLY A 54 10.705 -7.833 -1.042 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.014 -8.663 -2.430 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.846 -7.575 -1.706 1.00 0.00 H new ATOM 829 N ILE A 55 10.188 -5.899 -3.084 1.00 0.00 N ATOM 830 CA ILE A 55 10.514 -4.908 -4.103 1.00 0.00 C ATOM 831 C ILE A 55 11.963 -5.045 -4.558 1.00 0.00 C ATOM 832 O ILE A 55 12.234 -5.399 -5.706 1.00 0.00 O ATOM 833 CB ILE A 55 10.282 -3.475 -3.588 1.00 0.00 C ATOM 834 CG1 ILE A 55 8.789 -3.223 -3.370 1.00 0.00 C ATOM 835 CG2 ILE A 55 10.859 -2.462 -4.566 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.050 -2.842 -4.634 1.00 0.00 C ATOM 0 H ILE A 55 10.856 -5.950 -2.315 1.00 0.00 H new ATOM 0 HA ILE A 55 9.851 -5.093 -4.948 1.00 0.00 H new ATOM 0 HB ILE A 55 10.793 -3.361 -2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.335 -4.120 -2.950 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.666 -2.429 -2.634 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.688 -1.454 -4.189 1.00 0.00 H new ATOM 0 HG22 ILE A 55 11.930 -2.631 -4.675 1.00 0.00 H new ATOM 0 HG23 ILE A 55 10.373 -2.574 -5.535 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.997 -2.678 -4.405 1.00 0.00 H new ATOM 0 HD12 ILE A 55 8.478 -1.927 -5.044 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.141 -3.645 -5.365 1.00 0.00 H new ATOM 848 N THR A 56 12.892 -4.763 -3.651 1.00 0.00 N ATOM 849 CA THR A 56 14.314 -4.855 -3.958 1.00 0.00 C ATOM 850 C THR A 56 14.961 -6.023 -3.223 1.00 0.00 C ATOM 851 O THR A 56 16.026 -6.500 -3.614 1.00 0.00 O ATOM 852 CB THR A 56 15.054 -3.556 -3.588 1.00 0.00 C ATOM 853 OG1 THR A 56 16.434 -3.835 -3.327 1.00 0.00 O ATOM 854 CG2 THR A 56 14.423 -2.904 -2.366 1.00 0.00 C ATOM 0 H THR A 56 12.685 -4.469 -2.697 1.00 0.00 H new ATOM 0 HA THR A 56 14.395 -5.017 -5.033 1.00 0.00 H new ATOM 0 HB THR A 56 14.976 -2.867 -4.429 1.00 0.00 H new ATOM 0 HG1 THR A 56 16.897 -3.004 -3.094 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.962 -1.988 -2.123 1.00 0.00 H new ATOM 0 HG22 THR A 56 13.381 -2.666 -2.578 1.00 0.00 H new ATOM 0 HG23 THR A 56 14.474 -3.590 -1.521 1.00 0.00 H new ATOM 862 N GLU A 57 14.311 -6.479 -2.157 1.00 0.00 N ATOM 863 CA GLU A 57 14.825 -7.591 -1.367 1.00 0.00 C ATOM 864 C GLU A 57 14.062 -8.876 -1.676 1.00 0.00 C ATOM 865 O GLU A 57 12.833 -8.895 -1.753 1.00 0.00 O ATOM 866 CB GLU A 57 14.727 -7.274 0.126 1.00 0.00 C ATOM 867 CG GLU A 57 15.482 -6.019 0.532 1.00 0.00 C ATOM 868 CD GLU A 57 15.007 -5.456 1.858 1.00 0.00 C ATOM 869 OE1 GLU A 57 14.572 -6.250 2.718 1.00 0.00 O ATOM 870 OE2 GLU A 57 15.072 -4.222 2.035 1.00 0.00 O ATOM 0 H GLU A 57 13.428 -6.095 -1.821 1.00 0.00 H new ATOM 0 HA GLU A 57 15.872 -7.737 -1.632 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.677 -7.160 0.397 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.113 -8.120 0.695 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.546 -6.245 0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 57 15.364 -5.262 -0.243 1.00 0.00 H new ATOM 877 N PRO A 58 14.807 -9.977 -1.859 1.00 0.00 N ATOM 878 CA PRO A 58 14.222 -11.287 -2.162 1.00 0.00 C ATOM 879 C PRO A 58 13.469 -11.874 -0.974 1.00 0.00 C ATOM 880 O PRO A 58 13.985 -11.956 0.141 1.00 0.00 O ATOM 881 CB PRO A 58 15.441 -12.148 -2.502 1.00 0.00 C ATOM 882 CG PRO A 58 16.575 -11.501 -1.784 1.00 0.00 C ATOM 883 CD PRO A 58 16.276 -10.027 -1.782 1.00 0.00 C ATOM 0 HA PRO A 58 13.486 -11.230 -2.964 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.302 -13.178 -2.175 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.618 -12.176 -3.577 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.662 -11.883 -0.767 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.522 -11.707 -2.284 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.648 -9.543 -0.879 1.00 0.00 H new ATOM 0 HD3 PRO A 58 16.740 -9.522 -2.629 1.00 0.00 H new ATOM 891 N PRO A 59 12.218 -12.295 -1.215 1.00 0.00 N ATOM 892 CA PRO A 59 11.593 -12.203 -2.538 1.00 0.00 C ATOM 893 C PRO A 59 11.290 -10.763 -2.937 1.00 0.00 C ATOM 894 O PRO A 59 10.745 -9.991 -2.147 1.00 0.00 O ATOM 895 CB PRO A 59 10.295 -12.997 -2.373 1.00 0.00 C ATOM 896 CG PRO A 59 9.988 -12.924 -0.917 1.00 0.00 C ATOM 897 CD PRO A 59 11.318 -12.893 -0.215 1.00 0.00 C ATOM 0 HA PRO A 59 12.245 -12.584 -3.324 1.00 0.00 H new ATOM 0 HB2 PRO A 59 9.490 -12.568 -2.969 1.00 0.00 H new ATOM 0 HB3 PRO A 59 10.418 -14.029 -2.700 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.404 -12.034 -0.685 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.399 -13.784 -0.599 1.00 0.00 H new ATOM 0 HD2 PRO A 59 11.277 -12.297 0.697 1.00 0.00 H new ATOM 0 HD3 PRO A 59 11.644 -13.893 0.072 1.00 0.00 H new ATOM 905 N PHE A 60 11.646 -10.407 -4.167 1.00 0.00 N ATOM 906 CA PHE A 60 11.412 -9.059 -4.670 1.00 0.00 C ATOM 907 C PHE A 60 10.425 -9.076 -5.834 1.00 0.00 C ATOM 908 O PHE A 60 9.781 -8.071 -6.132 1.00 0.00 O ATOM 909 CB PHE A 60 12.730 -8.421 -5.114 1.00 0.00 C ATOM 910 CG PHE A 60 13.656 -9.380 -5.806 1.00 0.00 C ATOM 911 CD1 PHE A 60 13.388 -9.815 -7.094 1.00 0.00 C ATOM 912 CD2 PHE A 60 14.795 -9.846 -5.169 1.00 0.00 C ATOM 913 CE1 PHE A 60 14.239 -10.697 -7.734 1.00 0.00 C ATOM 914 CE2 PHE A 60 15.649 -10.727 -5.804 1.00 0.00 C ATOM 915 CZ PHE A 60 15.370 -11.154 -7.088 1.00 0.00 C ATOM 0 H PHE A 60 12.098 -11.033 -4.833 1.00 0.00 H new ATOM 0 HA PHE A 60 10.984 -8.466 -3.862 1.00 0.00 H new ATOM 0 HB2 PHE A 60 12.514 -7.589 -5.784 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.235 -8.005 -4.242 1.00 0.00 H new ATOM 0 HD1 PHE A 60 12.504 -9.461 -7.604 1.00 0.00 H new ATOM 0 HD2 PHE A 60 15.018 -9.517 -4.165 1.00 0.00 H new ATOM 0 HE1 PHE A 60 14.019 -11.028 -8.738 1.00 0.00 H new ATOM 0 HE2 PHE A 60 16.534 -11.082 -5.297 1.00 0.00 H new ATOM 0 HZ PHE A 60 16.036 -11.844 -7.585 1.00 0.00 H new ATOM 925 N GLY A 61 10.314 -10.227 -6.490 1.00 0.00 N ATOM 926 CA GLY A 61 9.405 -10.355 -7.615 1.00 0.00 C ATOM 927 C GLY A 61 7.971 -10.579 -7.179 1.00 0.00 C ATOM 928 O GLY A 61 7.189 -11.210 -7.891 1.00 0.00 O ATOM 0 H GLY A 61 10.837 -11.073 -6.263 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.459 -9.454 -8.226 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.724 -11.186 -8.244 1.00 0.00 H new ATOM 932 N ILE A 62 7.624 -10.063 -6.004 1.00 0.00 N ATOM 933 CA ILE A 62 6.274 -10.211 -5.475 1.00 0.00 C ATOM 934 C ILE A 62 5.450 -8.949 -5.709 1.00 0.00 C ATOM 935 O ILE A 62 4.237 -9.016 -5.913 1.00 0.00 O ATOM 936 CB ILE A 62 6.292 -10.525 -3.967 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.178 -11.741 -3.688 1.00 0.00 C ATOM 938 CG2 ILE A 62 4.878 -10.765 -3.459 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.281 -12.089 -2.219 1.00 0.00 C ATOM 0 H ILE A 62 8.259 -9.539 -5.401 1.00 0.00 H new ATOM 0 HA ILE A 62 5.817 -11.045 -6.007 1.00 0.00 H new ATOM 0 HB ILE A 62 6.707 -9.668 -3.437 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.783 -12.600 -4.230 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.177 -11.550 -4.079 1.00 0.00 H new ATOM 0 HG21 ILE A 62 4.907 -10.986 -2.392 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.274 -9.874 -3.629 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.438 -11.608 -3.992 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.924 -12.960 -2.096 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.705 -11.245 -1.674 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.289 -12.312 -1.828 1.00 0.00 H new ATOM 951 N PHE A 63 6.117 -7.800 -5.682 1.00 0.00 N ATOM 952 CA PHE A 63 5.446 -6.522 -5.893 1.00 0.00 C ATOM 953 C PHE A 63 6.174 -5.694 -6.948 1.00 0.00 C ATOM 954 O PHE A 63 7.390 -5.512 -6.881 1.00 0.00 O ATOM 955 CB PHE A 63 5.368 -5.741 -4.580 1.00 0.00 C ATOM 956 CG PHE A 63 4.633 -6.469 -3.491 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.326 -6.887 -3.679 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.251 -6.738 -2.280 1.00 0.00 C ATOM 959 CE1 PHE A 63 2.647 -7.557 -2.679 1.00 0.00 C ATOM 960 CE2 PHE A 63 4.577 -7.408 -1.276 1.00 0.00 C ATOM 961 CZ PHE A 63 3.274 -7.819 -1.476 1.00 0.00 C ATOM 0 H PHE A 63 7.121 -7.727 -5.516 1.00 0.00 H new ATOM 0 HA PHE A 63 4.436 -6.724 -6.248 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.379 -5.518 -4.239 1.00 0.00 H new ATOM 0 HB3 PHE A 63 4.876 -4.786 -4.764 1.00 0.00 H new ATOM 0 HD1 PHE A 63 2.832 -6.687 -4.618 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.271 -6.421 -2.119 1.00 0.00 H new ATOM 0 HE1 PHE A 63 1.627 -7.875 -2.838 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.069 -7.610 -0.336 1.00 0.00 H new ATOM 0 HZ PHE A 63 2.746 -8.344 -0.694 1.00 0.00 H new ATOM 971 N VAL A 64 5.421 -5.196 -7.923 1.00 0.00 N ATOM 972 CA VAL A 64 5.992 -4.387 -8.993 1.00 0.00 C ATOM 973 C VAL A 64 5.455 -2.961 -8.951 1.00 0.00 C ATOM 974 O VAL A 64 4.276 -2.738 -8.674 1.00 0.00 O ATOM 975 CB VAL A 64 5.695 -4.995 -10.376 1.00 0.00 C ATOM 976 CG1 VAL A 64 6.297 -6.387 -10.488 1.00 0.00 C ATOM 977 CG2 VAL A 64 4.196 -5.031 -10.631 1.00 0.00 C ATOM 0 H VAL A 64 4.414 -5.339 -7.994 1.00 0.00 H new ATOM 0 HA VAL A 64 7.070 -4.371 -8.836 1.00 0.00 H new ATOM 0 HB VAL A 64 6.155 -4.365 -11.137 1.00 0.00 H new ATOM 0 HG11 VAL A 64 6.077 -6.801 -11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.377 -6.328 -10.352 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.869 -7.031 -9.720 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.004 -5.464 -11.613 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.711 -5.638 -9.866 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.797 -4.017 -10.597 1.00 0.00 H new ATOM 987 N PHE A 65 6.327 -1.997 -9.227 1.00 0.00 N ATOM 988 CA PHE A 65 5.940 -0.591 -9.220 1.00 0.00 C ATOM 989 C PHE A 65 6.659 0.176 -10.327 1.00 0.00 C ATOM 990 O PHE A 65 7.534 -0.363 -11.003 1.00 0.00 O ATOM 991 CB PHE A 65 6.253 0.039 -7.862 1.00 0.00 C ATOM 992 CG PHE A 65 7.686 0.462 -7.713 1.00 0.00 C ATOM 993 CD1 PHE A 65 8.664 -0.461 -7.377 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.057 1.783 -7.908 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.983 -0.074 -7.239 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.375 2.176 -7.772 1.00 0.00 C ATOM 997 CZ PHE A 65 10.339 1.246 -7.437 1.00 0.00 C ATOM 0 H PHE A 65 7.306 -2.164 -9.458 1.00 0.00 H new ATOM 0 HA PHE A 65 4.867 -0.534 -9.400 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.609 0.907 -7.716 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.009 -0.674 -7.075 1.00 0.00 H new ATOM 0 HD1 PHE A 65 8.392 -1.494 -7.221 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.307 2.515 -8.170 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.735 -0.803 -6.976 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.650 3.209 -7.927 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.370 1.550 -7.330 1.00 0.00 H new ATOM 1007 N ASN A 66 6.281 1.438 -10.505 1.00 0.00 N ATOM 1008 CA ASN A 66 6.888 2.280 -11.530 1.00 0.00 C ATOM 1009 C ASN A 66 6.847 3.749 -11.121 1.00 0.00 C ATOM 1010 O ASN A 66 6.392 4.089 -10.029 1.00 0.00 O ATOM 1011 CB ASN A 66 6.169 2.090 -12.867 1.00 0.00 C ATOM 1012 CG ASN A 66 7.076 2.351 -14.054 1.00 0.00 C ATOM 1013 OD1 ASN A 66 8.232 1.929 -14.070 1.00 0.00 O ATOM 1014 ND2 ASN A 66 6.554 3.050 -15.055 1.00 0.00 N ATOM 0 H ASN A 66 5.558 1.900 -9.953 1.00 0.00 H new ATOM 0 HA ASN A 66 7.930 1.981 -11.641 1.00 0.00 H new ATOM 0 HB2 ASN A 66 5.781 1.073 -12.926 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.312 2.761 -12.914 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.116 3.257 -15.880 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.591 3.380 -14.999 1.00 0.00 H new ATOM 1021 N LYS A 67 7.325 4.617 -12.007 1.00 0.00 N ATOM 1022 CA LYS A 67 7.342 6.051 -11.741 1.00 0.00 C ATOM 1023 C LYS A 67 6.304 6.774 -12.593 1.00 0.00 C ATOM 1024 O LYS A 67 5.681 7.737 -12.144 1.00 0.00 O ATOM 1025 CB LYS A 67 8.733 6.625 -12.017 1.00 0.00 C ATOM 1026 CG LYS A 67 9.185 6.460 -13.458 1.00 0.00 C ATOM 1027 CD LYS A 67 10.615 6.933 -13.651 1.00 0.00 C ATOM 1028 CE LYS A 67 11.614 5.825 -13.356 1.00 0.00 C ATOM 1029 NZ LYS A 67 13.018 6.271 -13.573 1.00 0.00 N ATOM 0 H LYS A 67 7.706 4.352 -12.915 1.00 0.00 H new ATOM 0 HA LYS A 67 7.095 6.204 -10.690 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.736 7.685 -11.763 1.00 0.00 H new ATOM 0 HB3 LYS A 67 9.454 6.138 -11.361 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.105 5.412 -13.748 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.523 7.024 -14.115 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.749 7.282 -14.675 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.809 7.783 -12.997 1.00 0.00 H new ATOM 0 HE2 LYS A 67 11.494 5.493 -12.325 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.403 4.967 -13.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 13.668 5.487 -13.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 13.140 6.564 -14.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.228 7.074 -12.946 1.00 0.00 H new ATOM 1043 N ASP A 68 6.122 6.304 -13.822 1.00 0.00 N ATOM 1044 CA ASP A 68 5.157 6.905 -14.735 1.00 0.00 C ATOM 1045 C ASP A 68 3.733 6.723 -14.219 1.00 0.00 C ATOM 1046 O ASP A 68 2.959 7.679 -14.149 1.00 0.00 O ATOM 1047 CB ASP A 68 5.289 6.288 -16.129 1.00 0.00 C ATOM 1048 CG ASP A 68 4.543 7.079 -17.185 1.00 0.00 C ATOM 1049 OD1 ASP A 68 3.463 7.620 -16.869 1.00 0.00 O ATOM 1050 OD2 ASP A 68 5.039 7.156 -18.329 1.00 0.00 O ATOM 0 H ASP A 68 6.630 5.509 -14.209 1.00 0.00 H new ATOM 0 HA ASP A 68 5.369 7.973 -14.796 1.00 0.00 H new ATOM 0 HB2 ASP A 68 6.343 6.231 -16.399 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.909 5.267 -16.108 1.00 0.00 H new ATOM 1055 N THR A 69 3.393 5.490 -13.857 1.00 0.00 N ATOM 1056 CA THR A 69 2.062 5.183 -13.348 1.00 0.00 C ATOM 1057 C THR A 69 2.046 5.166 -11.824 1.00 0.00 C ATOM 1058 O THR A 69 1.004 5.369 -11.203 1.00 0.00 O ATOM 1059 CB THR A 69 1.562 3.822 -13.870 1.00 0.00 C ATOM 1060 OG1 THR A 69 2.152 2.760 -13.113 1.00 0.00 O ATOM 1061 CG2 THR A 69 1.900 3.651 -15.344 1.00 0.00 C ATOM 0 H THR A 69 4.021 4.688 -13.907 1.00 0.00 H new ATOM 0 HA THR A 69 1.397 5.969 -13.707 1.00 0.00 H new ATOM 0 HB THR A 69 0.478 3.789 -13.756 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.828 1.899 -13.450 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.537 2.683 -15.691 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.425 4.444 -15.921 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.981 3.703 -15.478 1.00 0.00 H new ATOM 1069 N GLY A 70 3.209 4.924 -11.227 1.00 0.00 N ATOM 1070 CA GLY A 70 3.306 4.887 -9.779 1.00 0.00 C ATOM 1071 C GLY A 70 2.187 4.086 -9.144 1.00 0.00 C ATOM 1072 O GLY A 70 1.397 4.620 -8.367 1.00 0.00 O ATOM 0 H GLY A 70 4.086 4.753 -11.720 1.00 0.00 H new ATOM 0 HA2 GLY A 70 4.265 4.456 -9.493 1.00 0.00 H new ATOM 0 HA3 GLY A 70 3.286 5.905 -9.390 1.00 0.00 H new ATOM 1076 N GLU A 71 2.120 2.800 -9.476 1.00 0.00 N ATOM 1077 CA GLU A 71 1.087 1.925 -8.934 1.00 0.00 C ATOM 1078 C GLU A 71 1.656 0.546 -8.612 1.00 0.00 C ATOM 1079 O GLU A 71 2.263 -0.102 -9.466 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.072 1.792 -9.924 1.00 0.00 C ATOM 1081 CG GLU A 71 -0.952 3.028 -9.999 1.00 0.00 C ATOM 1082 CD GLU A 71 -1.877 3.013 -11.201 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -1.418 2.634 -12.299 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -3.060 3.381 -11.043 1.00 0.00 O ATOM 0 H GLU A 71 2.768 2.342 -10.117 1.00 0.00 H new ATOM 0 HA GLU A 71 0.717 2.371 -8.011 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.330 1.582 -10.915 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.685 0.936 -9.640 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -1.547 3.102 -9.088 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -0.322 3.916 -10.041 1.00 0.00 H new ATOM 1091 N LEU A 72 1.458 0.104 -7.375 1.00 0.00 N ATOM 1092 CA LEU A 72 1.951 -1.197 -6.939 1.00 0.00 C ATOM 1093 C LEU A 72 1.059 -2.320 -7.459 1.00 0.00 C ATOM 1094 O LEU A 72 -0.109 -2.101 -7.776 1.00 0.00 O ATOM 1095 CB LEU A 72 2.022 -1.252 -5.412 1.00 0.00 C ATOM 1096 CG LEU A 72 2.838 -2.402 -4.819 1.00 0.00 C ATOM 1097 CD1 LEU A 72 4.326 -2.156 -5.015 1.00 0.00 C ATOM 1098 CD2 LEU A 72 2.515 -2.579 -3.343 1.00 0.00 C ATOM 0 H LEU A 72 0.959 0.628 -6.656 1.00 0.00 H new ATOM 0 HA LEU A 72 2.952 -1.334 -7.348 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.442 -0.312 -5.054 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.006 -1.316 -5.023 1.00 0.00 H new ATOM 0 HG LEU A 72 2.570 -3.320 -5.342 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.891 -2.984 -4.587 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.545 -2.079 -6.080 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.610 -1.228 -4.519 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.105 -3.401 -2.938 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.754 -1.661 -2.806 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.454 -2.801 -3.227 1.00 0.00 H new ATOM 1110 N ASN A 73 1.618 -3.523 -7.541 1.00 0.00 N ATOM 1111 CA ASN A 73 0.872 -4.681 -8.020 1.00 0.00 C ATOM 1112 C ASN A 73 1.514 -5.979 -7.540 1.00 0.00 C ATOM 1113 O ASN A 73 2.710 -6.200 -7.730 1.00 0.00 O ATOM 1114 CB ASN A 73 0.799 -4.670 -9.549 1.00 0.00 C ATOM 1115 CG ASN A 73 0.788 -3.264 -10.117 1.00 0.00 C ATOM 1116 OD1 ASN A 73 1.812 -2.582 -10.137 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -0.376 -2.824 -10.582 1.00 0.00 N ATOM 0 H ASN A 73 2.584 -3.721 -7.282 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.138 -4.624 -7.614 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.651 -5.216 -9.955 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.100 -5.196 -9.871 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -0.446 -1.886 -10.976 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.200 -3.424 -10.545 1.00 0.00 H new ATOM 1124 N VAL A 74 0.710 -6.835 -6.916 1.00 0.00 N ATOM 1125 CA VAL A 74 1.199 -8.112 -6.410 1.00 0.00 C ATOM 1126 C VAL A 74 1.095 -9.200 -7.472 1.00 0.00 C ATOM 1127 O VAL A 74 0.043 -9.389 -8.084 1.00 0.00 O ATOM 1128 CB VAL A 74 0.418 -8.555 -5.158 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -1.027 -8.869 -5.514 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.089 -9.756 -4.510 1.00 0.00 C ATOM 0 H VAL A 74 -0.282 -6.667 -6.749 1.00 0.00 H new ATOM 0 HA VAL A 74 2.246 -7.968 -6.144 1.00 0.00 H new ATOM 0 HB VAL A 74 0.420 -7.735 -4.440 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.563 -9.180 -4.617 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.501 -7.980 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.054 -9.672 -6.250 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.524 -10.056 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.119 -10.583 -5.220 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.105 -9.491 -4.218 1.00 0.00 H new ATOM 1140 N THR A 75 2.195 -9.916 -7.687 1.00 0.00 N ATOM 1141 CA THR A 75 2.229 -10.986 -8.676 1.00 0.00 C ATOM 1142 C THR A 75 2.766 -12.278 -8.070 1.00 0.00 C ATOM 1143 O THR A 75 3.519 -13.010 -8.713 1.00 0.00 O ATOM 1144 CB THR A 75 3.096 -10.602 -9.890 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.463 -10.457 -9.489 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.605 -9.306 -10.517 1.00 0.00 C ATOM 0 H THR A 75 3.074 -9.774 -7.189 1.00 0.00 H new ATOM 0 HA THR A 75 1.203 -11.143 -9.007 1.00 0.00 H new ATOM 0 HB THR A 75 3.018 -11.397 -10.631 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.008 -10.215 -10.267 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.232 -9.055 -11.372 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.574 -9.430 -10.847 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.657 -8.503 -9.781 1.00 0.00 H new ATOM 1154 N SER A 76 2.373 -12.553 -6.831 1.00 0.00 N ATOM 1155 CA SER A 76 2.818 -13.756 -6.137 1.00 0.00 C ATOM 1156 C SER A 76 1.804 -14.180 -5.079 1.00 0.00 C ATOM 1157 O SER A 76 0.796 -13.505 -4.864 1.00 0.00 O ATOM 1158 CB SER A 76 4.183 -13.520 -5.486 1.00 0.00 C ATOM 1159 OG SER A 76 4.927 -14.723 -5.411 1.00 0.00 O ATOM 0 H SER A 76 1.747 -11.959 -6.287 1.00 0.00 H new ATOM 0 HA SER A 76 2.907 -14.557 -6.871 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.740 -12.780 -6.060 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.046 -13.110 -4.485 1.00 0.00 H new ATOM 0 HG SER A 76 5.795 -14.545 -4.993 1.00 0.00 H new ATOM 1165 N ILE A 77 2.078 -15.301 -4.421 1.00 0.00 N ATOM 1166 CA ILE A 77 1.191 -15.815 -3.385 1.00 0.00 C ATOM 1167 C ILE A 77 1.790 -15.610 -1.998 1.00 0.00 C ATOM 1168 O ILE A 77 2.603 -16.412 -1.536 1.00 0.00 O ATOM 1169 CB ILE A 77 0.896 -17.312 -3.588 1.00 0.00 C ATOM 1170 CG1 ILE A 77 0.218 -17.542 -4.941 1.00 0.00 C ATOM 1171 CG2 ILE A 77 0.024 -17.839 -2.458 1.00 0.00 C ATOM 1172 CD1 ILE A 77 1.195 -17.738 -6.080 1.00 0.00 C ATOM 0 H ILE A 77 2.907 -15.871 -4.587 1.00 0.00 H new ATOM 0 HA ILE A 77 0.258 -15.256 -3.462 1.00 0.00 H new ATOM 0 HB ILE A 77 1.840 -17.857 -3.577 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.427 -18.418 -4.871 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.424 -16.691 -5.166 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.176 -18.899 -2.616 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.540 -17.705 -1.507 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.918 -17.291 -2.440 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.645 -17.896 -7.008 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.824 -16.853 -6.177 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.821 -18.607 -5.877 1.00 0.00 H new ATOM 1184 N LEU A 78 1.382 -14.532 -1.336 1.00 0.00 N ATOM 1185 CA LEU A 78 1.876 -14.222 0.001 1.00 0.00 C ATOM 1186 C LEU A 78 1.950 -15.481 0.859 1.00 0.00 C ATOM 1187 O LEU A 78 1.271 -16.471 0.587 1.00 0.00 O ATOM 1188 CB LEU A 78 0.974 -13.185 0.672 1.00 0.00 C ATOM 1189 CG LEU A 78 0.728 -11.898 -0.117 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.292 -11.023 0.594 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.032 -11.141 -0.321 1.00 0.00 C ATOM 0 H LEU A 78 0.710 -13.858 -1.704 1.00 0.00 H new ATOM 0 HA LEU A 78 2.881 -13.811 -0.096 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.010 -13.651 0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.413 -12.920 1.634 1.00 0.00 H new ATOM 0 HG LEU A 78 0.328 -12.165 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.454 -10.112 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.233 -11.565 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.079 -10.764 1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.838 -10.228 -0.884 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.460 -10.886 0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.733 -11.766 -0.874 1.00 0.00 H new ATOM 1203 N ASP A 79 2.778 -15.434 1.898 1.00 0.00 N ATOM 1204 CA ASP A 79 2.938 -16.569 2.799 1.00 0.00 C ATOM 1205 C ASP A 79 3.364 -16.104 4.188 1.00 0.00 C ATOM 1206 O ASP A 79 4.434 -15.518 4.356 1.00 0.00 O ATOM 1207 CB ASP A 79 3.968 -17.552 2.238 1.00 0.00 C ATOM 1208 CG ASP A 79 3.772 -18.959 2.766 1.00 0.00 C ATOM 1209 OD1 ASP A 79 4.283 -19.257 3.866 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.107 -19.763 2.079 1.00 0.00 O ATOM 0 H ASP A 79 3.348 -14.622 2.136 1.00 0.00 H new ATOM 0 HA ASP A 79 1.975 -17.073 2.884 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.901 -17.563 1.150 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.971 -17.208 2.492 1.00 0.00 H new ATOM 1215 N ARG A 80 2.520 -16.369 5.180 1.00 0.00 N ATOM 1216 CA ARG A 80 2.809 -15.975 6.554 1.00 0.00 C ATOM 1217 C ARG A 80 4.059 -16.681 7.070 1.00 0.00 C ATOM 1218 O ARG A 80 4.961 -16.046 7.616 1.00 0.00 O ATOM 1219 CB ARG A 80 1.618 -16.296 7.459 1.00 0.00 C ATOM 1220 CG ARG A 80 1.782 -15.790 8.883 1.00 0.00 C ATOM 1221 CD ARG A 80 0.436 -15.536 9.542 1.00 0.00 C ATOM 1222 NE ARG A 80 0.525 -15.570 11.000 1.00 0.00 N ATOM 1223 CZ ARG A 80 0.600 -16.693 11.705 1.00 0.00 C ATOM 1224 NH1 ARG A 80 0.598 -17.868 11.091 1.00 0.00 N ATOM 1225 NH2 ARG A 80 0.679 -16.642 13.029 1.00 0.00 N ATOM 0 H ARG A 80 1.631 -16.854 5.058 1.00 0.00 H new ATOM 0 HA ARG A 80 2.988 -14.900 6.568 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.717 -15.859 7.028 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.469 -17.376 7.481 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.343 -16.520 9.467 1.00 0.00 H new ATOM 0 HG3 ARG A 80 2.366 -14.869 8.878 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.054 -14.566 9.225 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.280 -16.286 9.205 1.00 0.00 H new ATOM 0 HE ARG A 80 0.530 -14.683 11.504 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.539 -17.912 10.074 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.656 -18.728 11.636 1.00 0.00 H new ATOM 0 HH21 ARG A 80 0.682 -15.740 13.505 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.737 -17.505 13.570 1.00 0.00 H new ATOM 1239 N GLU A 81 4.104 -17.998 6.895 1.00 0.00 N ATOM 1240 CA GLU A 81 5.243 -18.790 7.345 1.00 0.00 C ATOM 1241 C GLU A 81 6.558 -18.132 6.935 1.00 0.00 C ATOM 1242 O GLU A 81 7.391 -17.807 7.781 1.00 0.00 O ATOM 1243 CB GLU A 81 5.168 -20.206 6.770 1.00 0.00 C ATOM 1244 CG GLU A 81 3.892 -20.945 7.138 1.00 0.00 C ATOM 1245 CD GLU A 81 3.998 -22.440 6.913 1.00 0.00 C ATOM 1246 OE1 GLU A 81 5.043 -23.021 7.277 1.00 0.00 O ATOM 1247 OE2 GLU A 81 3.039 -23.030 6.374 1.00 0.00 O ATOM 0 H GLU A 81 3.365 -18.539 6.445 1.00 0.00 H new ATOM 0 HA GLU A 81 5.207 -18.846 8.433 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.247 -20.153 5.684 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.025 -20.779 7.124 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.656 -20.755 8.185 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.065 -20.550 6.548 1.00 0.00 H new ATOM 1254 N GLU A 82 6.737 -17.941 5.632 1.00 0.00 N ATOM 1255 CA GLU A 82 7.951 -17.325 5.110 1.00 0.00 C ATOM 1256 C GLU A 82 7.929 -15.814 5.324 1.00 0.00 C ATOM 1257 O GLU A 82 8.801 -15.256 5.991 1.00 0.00 O ATOM 1258 CB GLU A 82 8.109 -17.637 3.620 1.00 0.00 C ATOM 1259 CG GLU A 82 9.531 -17.476 3.112 1.00 0.00 C ATOM 1260 CD GLU A 82 10.387 -18.700 3.373 1.00 0.00 C ATOM 1261 OE1 GLU A 82 10.249 -19.691 2.627 1.00 0.00 O ATOM 1262 OE2 GLU A 82 11.196 -18.666 4.325 1.00 0.00 O ATOM 0 H GLU A 82 6.057 -18.204 4.919 1.00 0.00 H new ATOM 0 HA GLU A 82 8.800 -17.740 5.653 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.780 -18.659 3.435 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.452 -16.982 3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.509 -17.274 2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.988 -16.609 3.590 1.00 0.00 H new ATOM 1269 N THR A 83 6.925 -15.156 4.753 1.00 0.00 N ATOM 1270 CA THR A 83 6.789 -13.710 4.879 1.00 0.00 C ATOM 1271 C THR A 83 5.561 -13.343 5.705 1.00 0.00 C ATOM 1272 O THR A 83 4.472 -13.118 5.176 1.00 0.00 O ATOM 1273 CB THR A 83 6.686 -13.033 3.499 1.00 0.00 C ATOM 1274 OG1 THR A 83 5.701 -13.698 2.699 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.028 -13.057 2.783 1.00 0.00 C ATOM 0 H THR A 83 6.194 -15.602 4.199 1.00 0.00 H new ATOM 0 HA THR A 83 7.685 -13.351 5.386 1.00 0.00 H new ATOM 0 HB THR A 83 6.391 -11.995 3.650 1.00 0.00 H new ATOM 0 HG1 THR A 83 5.131 -14.250 3.274 1.00 0.00 H new ATOM 0 HG21 THR A 83 7.930 -12.573 1.811 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.769 -12.525 3.380 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.348 -14.090 2.644 1.00 0.00 H new ATOM 1283 N PRO A 84 5.738 -13.280 7.033 1.00 0.00 N ATOM 1284 CA PRO A 84 4.655 -12.939 7.960 1.00 0.00 C ATOM 1285 C PRO A 84 4.235 -11.478 7.848 1.00 0.00 C ATOM 1286 O PRO A 84 3.154 -11.096 8.298 1.00 0.00 O ATOM 1287 CB PRO A 84 5.266 -13.216 9.336 1.00 0.00 C ATOM 1288 CG PRO A 84 6.735 -13.071 9.134 1.00 0.00 C ATOM 1289 CD PRO A 84 7.009 -13.537 7.731 1.00 0.00 C ATOM 0 HA PRO A 84 3.750 -13.511 7.757 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.897 -12.512 10.082 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.012 -14.216 9.688 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.047 -12.035 9.269 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.289 -13.668 9.858 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.834 -12.987 7.279 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.277 -14.593 7.703 1.00 0.00 H new ATOM 1297 N PHE A 85 5.095 -10.664 7.246 1.00 0.00 N ATOM 1298 CA PHE A 85 4.813 -9.243 7.076 1.00 0.00 C ATOM 1299 C PHE A 85 5.730 -8.629 6.022 1.00 0.00 C ATOM 1300 O PHE A 85 6.758 -9.206 5.665 1.00 0.00 O ATOM 1301 CB PHE A 85 4.979 -8.506 8.406 1.00 0.00 C ATOM 1302 CG PHE A 85 6.369 -8.591 8.969 1.00 0.00 C ATOM 1303 CD1 PHE A 85 7.377 -7.771 8.487 1.00 0.00 C ATOM 1304 CD2 PHE A 85 6.667 -9.490 9.980 1.00 0.00 C ATOM 1305 CE1 PHE A 85 8.657 -7.847 9.004 1.00 0.00 C ATOM 1306 CE2 PHE A 85 7.945 -9.569 10.500 1.00 0.00 C ATOM 1307 CZ PHE A 85 8.941 -8.748 10.011 1.00 0.00 C ATOM 0 H PHE A 85 5.993 -10.964 6.867 1.00 0.00 H new ATOM 0 HA PHE A 85 3.782 -9.140 6.739 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.716 -7.458 8.267 1.00 0.00 H new ATOM 0 HB3 PHE A 85 4.276 -8.918 9.131 1.00 0.00 H new ATOM 0 HD1 PHE A 85 7.160 -7.065 7.699 1.00 0.00 H new ATOM 0 HD2 PHE A 85 5.892 -10.136 10.366 1.00 0.00 H new ATOM 0 HE1 PHE A 85 9.434 -7.202 8.621 1.00 0.00 H new ATOM 0 HE2 PHE A 85 8.164 -10.273 11.289 1.00 0.00 H new ATOM 0 HZ PHE A 85 9.941 -8.810 10.415 1.00 0.00 H new ATOM 1317 N PHE A 86 5.351 -7.455 5.529 1.00 0.00 N ATOM 1318 CA PHE A 86 6.138 -6.762 4.515 1.00 0.00 C ATOM 1319 C PHE A 86 6.355 -5.301 4.900 1.00 0.00 C ATOM 1320 O PHE A 86 5.407 -4.517 4.965 1.00 0.00 O ATOM 1321 CB PHE A 86 5.443 -6.845 3.155 1.00 0.00 C ATOM 1322 CG PHE A 86 5.432 -8.229 2.571 1.00 0.00 C ATOM 1323 CD1 PHE A 86 4.414 -9.117 2.880 1.00 0.00 C ATOM 1324 CD2 PHE A 86 6.438 -8.642 1.713 1.00 0.00 C ATOM 1325 CE1 PHE A 86 4.401 -10.391 2.346 1.00 0.00 C ATOM 1326 CE2 PHE A 86 6.431 -9.915 1.175 1.00 0.00 C ATOM 1327 CZ PHE A 86 5.410 -10.791 1.491 1.00 0.00 C ATOM 0 H PHE A 86 4.504 -6.963 5.815 1.00 0.00 H new ATOM 0 HA PHE A 86 7.110 -7.250 4.449 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.416 -6.495 3.259 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.941 -6.170 2.459 1.00 0.00 H new ATOM 0 HD1 PHE A 86 3.621 -8.809 3.546 1.00 0.00 H new ATOM 0 HD2 PHE A 86 7.238 -7.961 1.461 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.603 -11.074 2.597 1.00 0.00 H new ATOM 0 HE2 PHE A 86 7.222 -10.225 0.509 1.00 0.00 H new ATOM 0 HZ PHE A 86 5.401 -11.786 1.071 1.00 0.00 H new ATOM 1337 N LEU A 87 7.608 -4.942 5.154 1.00 0.00 N ATOM 1338 CA LEU A 87 7.951 -3.576 5.533 1.00 0.00 C ATOM 1339 C LEU A 87 8.439 -2.782 4.325 1.00 0.00 C ATOM 1340 O LEU A 87 9.615 -2.843 3.963 1.00 0.00 O ATOM 1341 CB LEU A 87 9.026 -3.582 6.622 1.00 0.00 C ATOM 1342 CG LEU A 87 8.519 -3.609 8.064 1.00 0.00 C ATOM 1343 CD1 LEU A 87 9.686 -3.652 9.039 1.00 0.00 C ATOM 1344 CD2 LEU A 87 7.634 -2.402 8.342 1.00 0.00 C ATOM 0 H LEU A 87 8.404 -5.578 5.104 1.00 0.00 H new ATOM 0 HA LEU A 87 7.052 -3.096 5.921 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.667 -4.450 6.467 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.650 -2.698 6.494 1.00 0.00 H new ATOM 0 HG LEU A 87 7.923 -4.511 8.202 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.306 -3.671 10.061 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.280 -4.547 8.856 1.00 0.00 H new ATOM 0 HD13 LEU A 87 10.309 -2.769 8.900 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.282 -2.438 9.373 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.206 -1.488 8.186 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.779 -2.415 7.666 1.00 0.00 H new ATOM 1356 N LEU A 88 7.530 -2.036 3.708 1.00 0.00 N ATOM 1357 CA LEU A 88 7.868 -1.228 2.541 1.00 0.00 C ATOM 1358 C LEU A 88 7.882 0.256 2.893 1.00 0.00 C ATOM 1359 O LEU A 88 7.665 0.635 4.045 1.00 0.00 O ATOM 1360 CB LEU A 88 6.871 -1.486 1.410 1.00 0.00 C ATOM 1361 CG LEU A 88 6.699 -2.946 0.988 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.643 -3.066 -0.099 1.00 0.00 C ATOM 1363 CD2 LEU A 88 8.024 -3.523 0.513 1.00 0.00 C ATOM 0 H LEU A 88 6.553 -1.973 3.996 1.00 0.00 H new ATOM 0 HA LEU A 88 8.866 -1.514 2.209 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.898 -1.100 1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.184 -0.911 0.538 1.00 0.00 H new ATOM 0 HG LEU A 88 6.366 -3.518 1.854 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.534 -4.112 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.690 -2.692 0.276 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.946 -2.481 -0.967 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.883 -4.562 0.217 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.386 -2.949 -0.340 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.754 -3.472 1.321 1.00 0.00 H new ATOM 1375 N THR A 89 8.135 1.094 1.893 1.00 0.00 N ATOM 1376 CA THR A 89 8.176 2.537 2.096 1.00 0.00 C ATOM 1377 C THR A 89 8.041 3.282 0.773 1.00 0.00 C ATOM 1378 O THR A 89 8.779 3.021 -0.176 1.00 0.00 O ATOM 1379 CB THR A 89 9.483 2.971 2.785 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.565 2.387 4.090 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.559 4.486 2.896 1.00 0.00 C ATOM 0 H THR A 89 8.315 0.798 0.934 1.00 0.00 H new ATOM 0 HA THR A 89 7.334 2.789 2.740 1.00 0.00 H new ATOM 0 HB THR A 89 10.320 2.625 2.179 1.00 0.00 H new ATOM 0 HG1 THR A 89 8.696 2.003 4.332 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.491 4.769 3.386 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.525 4.926 1.899 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.716 4.851 3.482 1.00 0.00 H new ATOM 1389 N GLY A 90 7.093 4.213 0.717 1.00 0.00 N ATOM 1390 CA GLY A 90 6.879 4.983 -0.495 1.00 0.00 C ATOM 1391 C GLY A 90 7.555 6.339 -0.447 1.00 0.00 C ATOM 1392 O GLY A 90 7.156 7.212 0.324 1.00 0.00 O ATOM 0 H GLY A 90 6.469 4.448 1.489 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.257 4.422 -1.350 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.809 5.119 -0.651 1.00 0.00 H new ATOM 1396 N TYR A 91 8.582 6.515 -1.271 1.00 0.00 N ATOM 1397 CA TYR A 91 9.317 7.774 -1.317 1.00 0.00 C ATOM 1398 C TYR A 91 8.843 8.639 -2.480 1.00 0.00 C ATOM 1399 O TYR A 91 8.944 8.247 -3.642 1.00 0.00 O ATOM 1400 CB TYR A 91 10.818 7.507 -1.443 1.00 0.00 C ATOM 1401 CG TYR A 91 11.369 6.621 -0.349 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.182 5.245 -0.381 1.00 0.00 C ATOM 1403 CD2 TYR A 91 12.079 7.160 0.717 1.00 0.00 C ATOM 1404 CE1 TYR A 91 11.683 4.432 0.617 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.586 6.355 1.719 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.385 4.991 1.664 1.00 0.00 C ATOM 1407 OH TYR A 91 12.887 4.185 2.660 1.00 0.00 O ATOM 0 H TYR A 91 8.924 5.803 -1.916 1.00 0.00 H new ATOM 0 HA TYR A 91 9.127 8.311 -0.388 1.00 0.00 H new ATOM 0 HB2 TYR A 91 11.016 7.043 -2.409 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.350 8.458 -1.431 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.635 4.803 -1.201 1.00 0.00 H new ATOM 0 HD2 TYR A 91 12.237 8.227 0.763 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.526 3.364 0.578 1.00 0.00 H new ATOM 0 HE2 TYR A 91 13.136 6.791 2.540 1.00 0.00 H new ATOM 0 HH TYR A 91 13.356 4.736 3.321 1.00 0.00 H new ATOM 1417 N ALA A 92 8.327 9.821 -2.158 1.00 0.00 N ATOM 1418 CA ALA A 92 7.840 10.744 -3.175 1.00 0.00 C ATOM 1419 C ALA A 92 8.873 11.825 -3.475 1.00 0.00 C ATOM 1420 O ALA A 92 8.793 12.937 -2.950 1.00 0.00 O ATOM 1421 CB ALA A 92 6.528 11.374 -2.731 1.00 0.00 C ATOM 0 H ALA A 92 8.236 10.161 -1.201 1.00 0.00 H new ATOM 0 HA ALA A 92 7.668 10.179 -4.091 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.176 12.061 -3.500 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.784 10.593 -2.574 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.683 11.920 -1.800 1.00 0.00 H new ATOM 1427 N LEU A 93 9.842 11.493 -4.320 1.00 0.00 N ATOM 1428 CA LEU A 93 10.892 12.436 -4.690 1.00 0.00 C ATOM 1429 C LEU A 93 10.364 13.486 -5.662 1.00 0.00 C ATOM 1430 O LEU A 93 9.283 13.332 -6.230 1.00 0.00 O ATOM 1431 CB LEU A 93 12.074 11.694 -5.315 1.00 0.00 C ATOM 1432 CG LEU A 93 12.581 10.471 -4.549 1.00 0.00 C ATOM 1433 CD1 LEU A 93 13.594 9.702 -5.382 1.00 0.00 C ATOM 1434 CD2 LEU A 93 13.189 10.891 -3.219 1.00 0.00 C ATOM 0 H LEU A 93 9.923 10.577 -4.762 1.00 0.00 H new ATOM 0 HA LEU A 93 11.227 12.942 -3.785 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.788 11.377 -6.318 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.900 12.396 -5.426 1.00 0.00 H new ATOM 0 HG LEU A 93 11.735 9.814 -4.348 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.944 8.835 -4.821 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.126 9.370 -6.309 1.00 0.00 H new ATOM 0 HD13 LEU A 93 14.440 10.349 -5.615 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.545 10.009 -2.687 1.00 0.00 H new ATOM 0 HD22 LEU A 93 14.024 11.568 -3.398 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.434 11.398 -2.618 1.00 0.00 H new ATOM 1446 N ASP A 94 11.134 14.552 -5.849 1.00 0.00 N ATOM 1447 CA ASP A 94 10.746 15.626 -6.755 1.00 0.00 C ATOM 1448 C ASP A 94 11.572 15.581 -8.037 1.00 0.00 C ATOM 1449 O ASP A 94 12.500 14.783 -8.161 1.00 0.00 O ATOM 1450 CB ASP A 94 10.915 16.984 -6.072 1.00 0.00 C ATOM 1451 CG ASP A 94 10.159 18.089 -6.785 1.00 0.00 C ATOM 1452 OD1 ASP A 94 8.912 18.097 -6.714 1.00 0.00 O ATOM 1453 OD2 ASP A 94 10.814 18.946 -7.413 1.00 0.00 O ATOM 0 H ASP A 94 12.031 14.695 -5.385 1.00 0.00 H new ATOM 0 HA ASP A 94 9.697 15.487 -7.015 1.00 0.00 H new ATOM 0 HB2 ASP A 94 10.566 16.915 -5.042 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.974 17.239 -6.033 1.00 0.00 H new ATOM 1458 N ALA A 95 11.226 16.443 -8.988 1.00 0.00 N ATOM 1459 CA ALA A 95 11.936 16.502 -10.260 1.00 0.00 C ATOM 1460 C ALA A 95 13.446 16.507 -10.046 1.00 0.00 C ATOM 1461 O ALA A 95 14.194 15.909 -10.819 1.00 0.00 O ATOM 1462 CB ALA A 95 11.508 17.732 -11.046 1.00 0.00 C ATOM 0 H ALA A 95 10.459 17.110 -8.902 1.00 0.00 H new ATOM 0 HA ALA A 95 11.680 15.611 -10.833 1.00 0.00 H new ATOM 0 HB1 ALA A 95 12.046 17.764 -11.994 1.00 0.00 H new ATOM 0 HB2 ALA A 95 10.436 17.686 -11.239 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.735 18.629 -10.470 1.00 0.00 H new ATOM 1468 N ARG A 96 13.888 17.187 -8.993 1.00 0.00 N ATOM 1469 CA ARG A 96 15.309 17.271 -8.679 1.00 0.00 C ATOM 1470 C ARG A 96 15.776 16.023 -7.936 1.00 0.00 C ATOM 1471 O ARG A 96 16.906 15.569 -8.113 1.00 0.00 O ATOM 1472 CB ARG A 96 15.594 18.516 -7.837 1.00 0.00 C ATOM 1473 CG ARG A 96 15.862 19.762 -8.664 1.00 0.00 C ATOM 1474 CD ARG A 96 17.318 19.843 -9.094 1.00 0.00 C ATOM 1475 NE ARG A 96 17.512 20.782 -10.196 1.00 0.00 N ATOM 1476 CZ ARG A 96 17.129 20.539 -11.444 1.00 0.00 C ATOM 1477 NH1 ARG A 96 16.535 19.393 -11.748 1.00 0.00 N ATOM 1478 NH2 ARG A 96 17.340 21.443 -12.392 1.00 0.00 N ATOM 0 H ARG A 96 13.282 17.688 -8.343 1.00 0.00 H new ATOM 0 HA ARG A 96 15.860 17.342 -9.617 1.00 0.00 H new ATOM 0 HB2 ARG A 96 14.744 18.702 -7.180 1.00 0.00 H new ATOM 0 HB3 ARG A 96 16.455 18.322 -7.198 1.00 0.00 H new ATOM 0 HG2 ARG A 96 15.221 19.760 -9.545 1.00 0.00 H new ATOM 0 HG3 ARG A 96 15.603 20.648 -8.084 1.00 0.00 H new ATOM 0 HD2 ARG A 96 17.930 20.149 -8.245 1.00 0.00 H new ATOM 0 HD3 ARG A 96 17.662 18.854 -9.396 1.00 0.00 H new ATOM 0 HE ARG A 96 17.966 21.673 -9.996 1.00 0.00 H new ATOM 0 HH11 ARG A 96 16.371 18.695 -11.022 1.00 0.00 H new ATOM 0 HH12 ARG A 96 16.242 19.209 -12.708 1.00 0.00 H new ATOM 0 HH21 ARG A 96 17.797 22.326 -12.162 1.00 0.00 H new ATOM 0 HH22 ARG A 96 17.045 21.255 -13.350 1.00 0.00 H new ATOM 1492 N GLY A 97 14.898 15.473 -7.102 1.00 0.00 N ATOM 1493 CA GLY A 97 15.240 14.283 -6.344 1.00 0.00 C ATOM 1494 C GLY A 97 15.852 14.610 -4.997 1.00 0.00 C ATOM 1495 O GLY A 97 16.783 13.940 -4.551 1.00 0.00 O ATOM 0 H GLY A 97 13.957 15.830 -6.938 1.00 0.00 H new ATOM 0 HA2 GLY A 97 14.344 13.680 -6.196 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.940 13.678 -6.920 1.00 0.00 H new ATOM 1499 N ASN A 98 15.330 15.645 -4.346 1.00 0.00 N ATOM 1500 CA ASN A 98 15.833 16.061 -3.042 1.00 0.00 C ATOM 1501 C ASN A 98 14.932 15.548 -1.923 1.00 0.00 C ATOM 1502 O ASN A 98 15.064 15.956 -0.770 1.00 0.00 O ATOM 1503 CB ASN A 98 15.932 17.586 -2.974 1.00 0.00 C ATOM 1504 CG ASN A 98 17.273 18.101 -3.459 1.00 0.00 C ATOM 1505 OD1 ASN A 98 18.255 18.106 -2.716 1.00 0.00 O ATOM 1506 ND2 ASN A 98 17.321 18.537 -4.713 1.00 0.00 N ATOM 0 H ASN A 98 14.559 16.211 -4.700 1.00 0.00 H new ATOM 0 HA ASN A 98 16.827 15.633 -2.909 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.137 18.026 -3.577 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.771 17.912 -1.947 1.00 0.00 H new ATOM 0 HD21 ASN A 98 18.196 18.894 -5.096 1.00 0.00 H new ATOM 0 HD22 ASN A 98 16.482 18.514 -5.293 1.00 0.00 H new ATOM 1513 N ASN A 99 14.016 14.650 -2.272 1.00 0.00 N ATOM 1514 CA ASN A 99 13.093 14.081 -1.297 1.00 0.00 C ATOM 1515 C ASN A 99 12.385 15.180 -0.511 1.00 0.00 C ATOM 1516 O ASN A 99 12.304 15.128 0.716 1.00 0.00 O ATOM 1517 CB ASN A 99 13.841 13.153 -0.337 1.00 0.00 C ATOM 1518 CG ASN A 99 14.679 12.120 -1.065 1.00 0.00 C ATOM 1519 OD1 ASN A 99 15.291 12.414 -2.092 1.00 0.00 O ATOM 1520 ND2 ASN A 99 14.708 10.903 -0.536 1.00 0.00 N ATOM 0 H ASN A 99 13.893 14.301 -3.223 1.00 0.00 H new ATOM 0 HA ASN A 99 12.342 13.505 -1.838 1.00 0.00 H new ATOM 0 HB2 ASN A 99 14.485 13.748 0.311 1.00 0.00 H new ATOM 0 HB3 ASN A 99 13.123 12.646 0.307 1.00 0.00 H new ATOM 0 HD21 ASN A 99 15.254 10.166 -0.982 1.00 0.00 H new ATOM 0 HD22 ASN A 99 14.185 10.705 0.317 1.00 0.00 H new ATOM 1527 N VAL A 100 11.873 16.176 -1.228 1.00 0.00 N ATOM 1528 CA VAL A 100 11.170 17.288 -0.599 1.00 0.00 C ATOM 1529 C VAL A 100 10.128 16.788 0.394 1.00 0.00 C ATOM 1530 O VAL A 100 9.850 17.441 1.399 1.00 0.00 O ATOM 1531 CB VAL A 100 10.479 18.180 -1.648 1.00 0.00 C ATOM 1532 CG1 VAL A 100 11.493 18.714 -2.647 1.00 0.00 C ATOM 1533 CG2 VAL A 100 9.374 17.410 -2.356 1.00 0.00 C ATOM 0 H VAL A 100 11.932 16.235 -2.245 1.00 0.00 H new ATOM 0 HA VAL A 100 11.918 17.877 -0.069 1.00 0.00 H new ATOM 0 HB VAL A 100 10.028 19.030 -1.136 1.00 0.00 H new ATOM 0 HG11 VAL A 100 10.986 19.342 -3.380 1.00 0.00 H new ATOM 0 HG12 VAL A 100 12.245 19.304 -2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 100 11.976 17.880 -3.156 1.00 0.00 H new ATOM 0 HG21 VAL A 100 8.896 18.055 -3.094 1.00 0.00 H new ATOM 0 HG22 VAL A 100 9.800 16.540 -2.856 1.00 0.00 H new ATOM 0 HG23 VAL A 100 8.633 17.083 -1.626 1.00 0.00 H new ATOM 1543 N GLU A 101 9.554 15.624 0.105 1.00 0.00 N ATOM 1544 CA GLU A 101 8.541 15.036 0.974 1.00 0.00 C ATOM 1545 C GLU A 101 9.071 13.775 1.652 1.00 0.00 C ATOM 1546 O GLU A 101 9.847 13.021 1.066 1.00 0.00 O ATOM 1547 CB GLU A 101 7.280 14.706 0.173 1.00 0.00 C ATOM 1548 CG GLU A 101 6.098 14.302 1.038 1.00 0.00 C ATOM 1549 CD GLU A 101 5.443 15.486 1.722 1.00 0.00 C ATOM 1550 OE1 GLU A 101 6.176 16.323 2.290 1.00 0.00 O ATOM 1551 OE2 GLU A 101 4.198 15.576 1.689 1.00 0.00 O ATOM 0 H GLU A 101 9.773 15.070 -0.723 1.00 0.00 H new ATOM 0 HA GLU A 101 8.293 15.765 1.745 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.002 15.574 -0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.503 13.898 -0.523 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.360 13.790 0.421 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.432 13.590 1.793 1.00 0.00 H new ATOM 1558 N LYS A 102 8.645 13.554 2.891 1.00 0.00 N ATOM 1559 CA LYS A 102 9.074 12.386 3.651 1.00 0.00 C ATOM 1560 C LYS A 102 8.167 11.192 3.371 1.00 0.00 C ATOM 1561 O LYS A 102 6.947 11.319 3.273 1.00 0.00 O ATOM 1562 CB LYS A 102 9.076 12.699 5.149 1.00 0.00 C ATOM 1563 CG LYS A 102 10.060 11.858 5.944 1.00 0.00 C ATOM 1564 CD LYS A 102 10.150 12.322 7.388 1.00 0.00 C ATOM 1565 CE LYS A 102 10.653 11.214 8.300 1.00 0.00 C ATOM 1566 NZ LYS A 102 11.997 10.723 7.888 1.00 0.00 N ATOM 0 H LYS A 102 8.003 14.169 3.390 1.00 0.00 H new ATOM 0 HA LYS A 102 10.087 12.132 3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.314 13.753 5.291 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.073 12.542 5.546 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.753 10.813 5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 102 11.045 11.914 5.481 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.818 13.180 7.454 1.00 0.00 H new ATOM 0 HD3 LYS A 102 9.169 12.655 7.726 1.00 0.00 H new ATOM 0 HE2 LYS A 102 10.699 11.581 9.325 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.945 10.385 8.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.378 10.094 8.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.916 10.199 6.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 12.638 11.532 7.759 1.00 0.00 H new ATOM 1580 N PRO A 103 8.776 10.004 3.241 1.00 0.00 N ATOM 1581 CA PRO A 103 8.041 8.764 2.973 1.00 0.00 C ATOM 1582 C PRO A 103 7.205 8.315 4.167 1.00 0.00 C ATOM 1583 O PRO A 103 7.284 8.901 5.248 1.00 0.00 O ATOM 1584 CB PRO A 103 9.151 7.749 2.685 1.00 0.00 C ATOM 1585 CG PRO A 103 10.344 8.281 3.400 1.00 0.00 C ATOM 1586 CD PRO A 103 10.227 9.779 3.345 1.00 0.00 C ATOM 0 HA PRO A 103 7.329 8.881 2.156 1.00 0.00 H new ATOM 0 HB2 PRO A 103 8.883 6.756 3.046 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.338 7.659 1.615 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.370 7.929 4.431 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.266 7.944 2.925 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.643 10.248 4.237 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.760 10.193 2.489 1.00 0.00 H new ATOM 1594 N LEU A 104 6.406 7.273 3.966 1.00 0.00 N ATOM 1595 CA LEU A 104 5.556 6.746 5.027 1.00 0.00 C ATOM 1596 C LEU A 104 5.979 5.331 5.411 1.00 0.00 C ATOM 1597 O LEU A 104 6.971 4.811 4.903 1.00 0.00 O ATOM 1598 CB LEU A 104 4.092 6.749 4.584 1.00 0.00 C ATOM 1599 CG LEU A 104 3.716 5.738 3.500 1.00 0.00 C ATOM 1600 CD1 LEU A 104 2.253 5.343 3.623 1.00 0.00 C ATOM 1601 CD2 LEU A 104 4.002 6.307 2.118 1.00 0.00 C ATOM 0 H LEU A 104 6.329 6.777 3.078 1.00 0.00 H new ATOM 0 HA LEU A 104 5.667 7.389 5.900 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.468 6.563 5.458 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.845 7.747 4.223 1.00 0.00 H new ATOM 0 HG LEU A 104 4.325 4.844 3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.004 4.623 2.843 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.078 4.894 4.601 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.627 6.228 3.513 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.728 5.574 1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.419 7.216 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 104 5.064 6.539 2.033 1.00 0.00 H new ATOM 1613 N GLU A 105 5.218 4.715 6.310 1.00 0.00 N ATOM 1614 CA GLU A 105 5.514 3.360 6.761 1.00 0.00 C ATOM 1615 C GLU A 105 4.381 2.405 6.395 1.00 0.00 C ATOM 1616 O GLU A 105 3.365 2.335 7.087 1.00 0.00 O ATOM 1617 CB GLU A 105 5.743 3.341 8.273 1.00 0.00 C ATOM 1618 CG GLU A 105 6.062 1.960 8.823 1.00 0.00 C ATOM 1619 CD GLU A 105 6.736 2.014 10.180 1.00 0.00 C ATOM 1620 OE1 GLU A 105 6.057 2.368 11.167 1.00 0.00 O ATOM 1621 OE2 GLU A 105 7.943 1.701 10.255 1.00 0.00 O ATOM 0 H GLU A 105 4.393 5.132 6.740 1.00 0.00 H new ATOM 0 HA GLU A 105 6.423 3.028 6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.562 4.018 8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.853 3.725 8.772 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.141 1.383 8.902 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.709 1.434 8.121 1.00 0.00 H new ATOM 1628 N LEU A 106 4.564 1.672 5.302 1.00 0.00 N ATOM 1629 CA LEU A 106 3.558 0.721 4.842 1.00 0.00 C ATOM 1630 C LEU A 106 3.763 -0.644 5.490 1.00 0.00 C ATOM 1631 O LEU A 106 4.757 -1.323 5.230 1.00 0.00 O ATOM 1632 CB LEU A 106 3.611 0.589 3.319 1.00 0.00 C ATOM 1633 CG LEU A 106 2.660 -0.436 2.701 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.306 0.196 2.415 1.00 0.00 C ATOM 1635 CD2 LEU A 106 3.257 -1.019 1.429 1.00 0.00 C ATOM 0 H LEU A 106 5.399 1.718 4.718 1.00 0.00 H new ATOM 0 HA LEU A 106 2.577 1.097 5.134 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.396 1.564 2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.630 0.329 3.032 1.00 0.00 H new ATOM 0 HG LEU A 106 2.516 -1.246 3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.642 -0.549 1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.873 0.564 3.345 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.431 1.026 1.719 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.566 -1.747 1.003 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.431 -0.219 0.709 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.202 -1.509 1.662 1.00 0.00 H new ATOM 1647 N ARG A 107 2.816 -1.042 6.333 1.00 0.00 N ATOM 1648 CA ARG A 107 2.892 -2.327 7.017 1.00 0.00 C ATOM 1649 C ARG A 107 1.806 -3.275 6.517 1.00 0.00 C ATOM 1650 O ARG A 107 0.688 -3.282 7.034 1.00 0.00 O ATOM 1651 CB ARG A 107 2.758 -2.133 8.529 1.00 0.00 C ATOM 1652 CG ARG A 107 3.118 -3.370 9.336 1.00 0.00 C ATOM 1653 CD ARG A 107 2.457 -3.353 10.705 1.00 0.00 C ATOM 1654 NE ARG A 107 3.252 -2.622 11.688 1.00 0.00 N ATOM 1655 CZ ARG A 107 2.760 -2.151 12.829 1.00 0.00 C ATOM 1656 NH1 ARG A 107 1.481 -2.334 13.128 1.00 0.00 N ATOM 1657 NH2 ARG A 107 3.547 -1.496 13.672 1.00 0.00 N ATOM 0 H ARG A 107 1.987 -0.493 6.559 1.00 0.00 H new ATOM 0 HA ARG A 107 3.864 -2.769 6.799 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.399 -1.308 8.839 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.733 -1.844 8.760 1.00 0.00 H new ATOM 0 HG2 ARG A 107 2.809 -4.263 8.793 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.200 -3.427 9.454 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.470 -2.897 10.625 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.308 -4.377 11.048 1.00 0.00 H new ATOM 0 HE ARG A 107 4.240 -2.464 11.488 1.00 0.00 H new ATOM 0 HH11 ARG A 107 0.873 -2.837 12.482 1.00 0.00 H new ATOM 0 HH12 ARG A 107 1.105 -1.972 14.004 1.00 0.00 H new ATOM 0 HH21 ARG A 107 4.531 -1.353 13.445 1.00 0.00 H new ATOM 0 HH22 ARG A 107 3.168 -1.135 14.547 1.00 0.00 H new ATOM 1671 N ILE A 108 2.142 -4.072 5.509 1.00 0.00 N ATOM 1672 CA ILE A 108 1.196 -5.024 4.940 1.00 0.00 C ATOM 1673 C ILE A 108 1.131 -6.300 5.773 1.00 0.00 C ATOM 1674 O ILE A 108 2.031 -7.138 5.716 1.00 0.00 O ATOM 1675 CB ILE A 108 1.567 -5.389 3.490 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.662 -4.126 2.632 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.546 -6.356 2.909 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.378 -4.342 1.317 1.00 0.00 C ATOM 0 H ILE A 108 3.062 -4.078 5.069 1.00 0.00 H new ATOM 0 HA ILE A 108 0.220 -4.539 4.945 1.00 0.00 H new ATOM 0 HB ILE A 108 2.541 -5.878 3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.657 -3.755 2.432 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.181 -3.351 3.196 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.822 -6.604 1.884 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.524 -7.266 3.509 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.440 -5.892 2.917 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.408 -3.405 0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.395 -4.683 1.508 1.00 0.00 H new ATOM 0 HD13 ILE A 108 1.847 -5.094 0.733 1.00 0.00 H new ATOM 1690 N LYS A 109 0.060 -6.441 6.546 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.126 -7.616 7.389 1.00 0.00 C ATOM 1692 C LYS A 109 -0.551 -8.822 6.557 1.00 0.00 C ATOM 1693 O LYS A 109 -1.427 -8.718 5.698 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.173 -7.334 8.469 1.00 0.00 C ATOM 1695 CG LYS A 109 -1.372 -8.485 9.439 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.793 -8.522 9.977 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.936 -7.674 11.232 1.00 0.00 C ATOM 1698 NZ LYS A 109 -2.206 -8.266 12.387 1.00 0.00 N ATOM 0 H LYS A 109 -0.693 -5.756 6.606 1.00 0.00 H new ATOM 0 HA LYS A 109 0.827 -7.844 7.866 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.876 -6.446 9.028 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.125 -7.105 7.989 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.147 -9.427 8.939 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.671 -8.389 10.268 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.482 -8.162 9.213 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.073 -9.552 10.199 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.556 -6.671 11.038 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.992 -7.572 11.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.596 -7.889 13.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.314 -9.300 12.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.197 -8.023 12.322 1.00 0.00 H new ATOM 1712 N VAL A 110 0.074 -9.965 6.818 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.242 -11.192 6.095 1.00 0.00 C ATOM 1714 C VAL A 110 -1.133 -12.107 6.927 1.00 0.00 C ATOM 1715 O VAL A 110 -0.705 -12.646 7.949 1.00 0.00 O ATOM 1716 CB VAL A 110 1.036 -11.956 5.702 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.685 -13.258 4.998 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.927 -11.089 4.824 1.00 0.00 C ATOM 0 H VAL A 110 0.802 -10.068 7.525 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.774 -10.898 5.190 1.00 0.00 H new ATOM 0 HB VAL A 110 1.587 -12.199 6.611 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.601 -13.784 4.728 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.091 -13.883 5.664 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.112 -13.041 4.097 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.825 -11.645 4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.387 -10.813 3.918 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.207 -10.187 5.368 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.373 -12.279 6.484 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.326 -13.131 7.187 1.00 0.00 C ATOM 1730 C LEU A 111 -3.011 -14.605 6.958 1.00 0.00 C ATOM 1731 O LEU A 111 -2.114 -14.946 6.187 1.00 0.00 O ATOM 1732 CB LEU A 111 -4.751 -12.824 6.725 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.214 -11.376 6.890 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.408 -11.092 5.992 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.559 -11.089 8.345 1.00 0.00 C ATOM 0 H LEU A 111 -2.743 -11.840 5.641 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.244 -12.923 8.254 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.836 -13.094 5.672 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.437 -13.468 7.275 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.397 -10.718 6.594 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.724 -10.057 6.123 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.128 -11.257 4.952 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.229 -11.758 6.257 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.887 -10.054 8.444 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.359 -11.755 8.667 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.679 -11.252 8.967 1.00 0.00 H new ATOM 1747 N ASP A 112 -3.755 -15.475 7.632 1.00 0.00 N ATOM 1748 CA ASP A 112 -3.557 -16.914 7.500 1.00 0.00 C ATOM 1749 C ASP A 112 -4.410 -17.478 6.367 1.00 0.00 C ATOM 1750 O ASP A 112 -5.467 -16.935 6.043 1.00 0.00 O ATOM 1751 CB ASP A 112 -3.899 -17.620 8.813 1.00 0.00 C ATOM 1752 CG ASP A 112 -3.404 -19.053 8.846 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -4.040 -19.915 8.204 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -2.381 -19.312 9.514 1.00 0.00 O ATOM 0 H ASP A 112 -4.501 -15.209 8.275 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.508 -17.092 7.264 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -3.460 -17.068 9.644 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.979 -17.608 8.958 1.00 0.00 H new ATOM 1759 N ILE A 113 -3.944 -18.569 5.770 1.00 0.00 N ATOM 1760 CA ILE A 113 -4.664 -19.206 4.674 1.00 0.00 C ATOM 1761 C ILE A 113 -6.127 -19.438 5.039 1.00 0.00 C ATOM 1762 O ILE A 113 -7.028 -19.120 4.264 1.00 0.00 O ATOM 1763 CB ILE A 113 -4.024 -20.552 4.286 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -4.456 -20.960 2.876 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -4.400 -21.627 5.294 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -5.717 -21.796 2.849 1.00 0.00 C ATOM 0 H ILE A 113 -3.071 -19.031 6.026 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.607 -18.528 3.823 1.00 0.00 H new ATOM 0 HB ILE A 113 -2.940 -20.438 4.294 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -4.612 -20.062 2.278 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -3.648 -21.520 2.405 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -3.940 -22.572 5.006 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.046 -21.338 6.284 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.484 -21.742 5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -5.964 -22.049 1.818 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.559 -22.711 3.419 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.538 -21.231 3.291 1.00 0.00 H new ATOM 1778 N ASN A 114 -6.354 -19.994 6.225 1.00 0.00 N ATOM 1779 CA ASN A 114 -7.707 -20.268 6.694 1.00 0.00 C ATOM 1780 C ASN A 114 -8.213 -19.139 7.586 1.00 0.00 C ATOM 1781 O ASN A 114 -8.876 -19.380 8.595 1.00 0.00 O ATOM 1782 CB ASN A 114 -7.746 -21.593 7.457 1.00 0.00 C ATOM 1783 CG ASN A 114 -7.327 -22.769 6.597 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -7.742 -22.889 5.444 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -6.499 -23.645 7.155 1.00 0.00 N ATOM 0 H ASN A 114 -5.618 -20.263 6.878 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.359 -20.339 5.823 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.089 -21.529 8.324 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -8.755 -21.763 7.833 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -6.182 -24.457 6.625 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.180 -23.506 8.114 1.00 0.00 H new ATOM 1792 N ASP A 115 -7.896 -17.906 7.207 1.00 0.00 N ATOM 1793 CA ASP A 115 -8.320 -16.738 7.971 1.00 0.00 C ATOM 1794 C ASP A 115 -9.560 -16.103 7.351 1.00 0.00 C ATOM 1795 O ASP A 115 -10.003 -16.504 6.275 1.00 0.00 O ATOM 1796 CB ASP A 115 -7.188 -15.712 8.043 1.00 0.00 C ATOM 1797 CG ASP A 115 -7.396 -14.698 9.151 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -8.086 -15.030 10.137 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -6.870 -13.571 9.031 1.00 0.00 O ATOM 0 H ASP A 115 -7.347 -17.689 6.375 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.569 -17.065 8.980 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -6.242 -16.230 8.201 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -7.111 -15.192 7.088 1.00 0.00 H new ATOM 1804 N ASN A 116 -10.117 -15.111 8.038 1.00 0.00 N ATOM 1805 CA ASN A 116 -11.309 -14.422 7.555 1.00 0.00 C ATOM 1806 C ASN A 116 -11.082 -12.914 7.506 1.00 0.00 C ATOM 1807 O ASN A 116 -10.089 -12.409 8.028 1.00 0.00 O ATOM 1808 CB ASN A 116 -12.506 -14.740 8.452 1.00 0.00 C ATOM 1809 CG ASN A 116 -12.517 -16.186 8.911 1.00 0.00 C ATOM 1810 OD1 ASN A 116 -12.935 -17.079 8.174 1.00 0.00 O ATOM 1811 ND2 ASN A 116 -12.056 -16.422 10.134 1.00 0.00 N ATOM 0 H ASN A 116 -9.763 -14.766 8.930 1.00 0.00 H new ATOM 0 HA ASN A 116 -11.518 -14.774 6.545 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -12.488 -14.085 9.323 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -13.428 -14.526 7.912 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -12.039 -17.375 10.497 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -11.719 -15.650 10.710 1.00 0.00 H new ATOM 1818 N GLU A 117 -12.011 -12.201 6.877 1.00 0.00 N ATOM 1819 CA GLU A 117 -11.912 -10.751 6.760 1.00 0.00 C ATOM 1820 C GLU A 117 -12.168 -10.079 8.106 1.00 0.00 C ATOM 1821 O GLU A 117 -13.006 -10.513 8.896 1.00 0.00 O ATOM 1822 CB GLU A 117 -12.908 -10.232 5.721 1.00 0.00 C ATOM 1823 CG GLU A 117 -12.498 -10.523 4.287 1.00 0.00 C ATOM 1824 CD GLU A 117 -13.058 -9.514 3.303 1.00 0.00 C ATOM 1825 OE1 GLU A 117 -14.296 -9.463 3.146 1.00 0.00 O ATOM 1826 OE2 GLU A 117 -12.258 -8.775 2.691 1.00 0.00 O ATOM 0 H GLU A 117 -12.840 -12.604 6.441 1.00 0.00 H new ATOM 0 HA GLU A 117 -10.900 -10.506 6.437 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -13.883 -10.680 5.909 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -13.023 -9.155 5.846 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -11.410 -10.527 4.218 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -12.838 -11.521 4.011 1.00 0.00 H new ATOM 1833 N PRO A 118 -11.429 -8.992 8.374 1.00 0.00 N ATOM 1834 CA PRO A 118 -11.556 -8.236 9.623 1.00 0.00 C ATOM 1835 C PRO A 118 -12.877 -7.479 9.710 1.00 0.00 C ATOM 1836 O PRO A 118 -13.701 -7.541 8.797 1.00 0.00 O ATOM 1837 CB PRO A 118 -10.381 -7.257 9.567 1.00 0.00 C ATOM 1838 CG PRO A 118 -10.094 -7.093 8.114 1.00 0.00 C ATOM 1839 CD PRO A 118 -10.411 -8.418 7.478 1.00 0.00 C ATOM 0 HA PRO A 118 -11.544 -8.888 10.497 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -10.637 -6.304 10.030 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -9.514 -7.648 10.100 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -10.702 -6.298 7.683 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -9.051 -6.821 7.950 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -10.791 -8.296 6.464 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -9.528 -9.054 7.413 1.00 0.00 H new ATOM 1847 N VAL A 119 -13.073 -6.763 10.813 1.00 0.00 N ATOM 1848 CA VAL A 119 -14.293 -5.993 11.018 1.00 0.00 C ATOM 1849 C VAL A 119 -14.007 -4.495 11.001 1.00 0.00 C ATOM 1850 O VAL A 119 -12.899 -4.061 11.316 1.00 0.00 O ATOM 1851 CB VAL A 119 -14.972 -6.359 12.351 1.00 0.00 C ATOM 1852 CG1 VAL A 119 -16.315 -5.657 12.478 1.00 0.00 C ATOM 1853 CG2 VAL A 119 -15.137 -7.867 12.467 1.00 0.00 C ATOM 0 H VAL A 119 -12.402 -6.701 11.578 1.00 0.00 H new ATOM 0 HA VAL A 119 -14.965 -6.242 10.197 1.00 0.00 H new ATOM 0 HB VAL A 119 -14.334 -6.021 13.168 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -16.779 -5.928 13.426 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -16.166 -4.578 12.442 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -16.964 -5.961 11.656 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -15.618 -8.109 13.415 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -15.753 -8.230 11.644 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -14.158 -8.344 12.425 1.00 0.00 H new ATOM 1863 N PHE A 120 -15.013 -3.710 10.631 1.00 0.00 N ATOM 1864 CA PHE A 120 -14.870 -2.260 10.573 1.00 0.00 C ATOM 1865 C PHE A 120 -14.941 -1.650 11.970 1.00 0.00 C ATOM 1866 O PHE A 120 -16.022 -1.340 12.471 1.00 0.00 O ATOM 1867 CB PHE A 120 -15.957 -1.654 9.684 1.00 0.00 C ATOM 1868 CG PHE A 120 -17.350 -2.036 10.096 1.00 0.00 C ATOM 1869 CD1 PHE A 120 -17.892 -3.252 9.713 1.00 0.00 C ATOM 1870 CD2 PHE A 120 -18.119 -1.177 10.866 1.00 0.00 C ATOM 1871 CE1 PHE A 120 -19.173 -3.607 10.091 1.00 0.00 C ATOM 1872 CE2 PHE A 120 -19.401 -1.526 11.247 1.00 0.00 C ATOM 1873 CZ PHE A 120 -19.929 -2.742 10.858 1.00 0.00 C ATOM 0 H PHE A 120 -15.936 -4.054 10.367 1.00 0.00 H new ATOM 0 HA PHE A 120 -13.893 -2.033 10.146 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -15.866 -0.568 9.702 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -15.791 -1.971 8.654 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -17.306 -3.931 9.111 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -17.712 -0.225 11.172 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -19.582 -4.559 9.787 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -19.989 -0.849 11.848 1.00 0.00 H new ATOM 0 HZ PHE A 120 -20.931 -3.016 11.153 1.00 0.00 H new ATOM 1883 N THR A 121 -13.780 -1.480 12.595 1.00 0.00 N ATOM 1884 CA THR A 121 -13.709 -0.909 13.934 1.00 0.00 C ATOM 1885 C THR A 121 -12.841 0.344 13.952 1.00 0.00 C ATOM 1886 O THR A 121 -11.624 0.264 14.114 1.00 0.00 O ATOM 1887 CB THR A 121 -13.148 -1.923 14.948 1.00 0.00 C ATOM 1888 OG1 THR A 121 -11.877 -2.411 14.502 1.00 0.00 O ATOM 1889 CG2 THR A 121 -14.107 -3.089 15.135 1.00 0.00 C ATOM 0 H THR A 121 -12.876 -1.730 12.195 1.00 0.00 H new ATOM 0 HA THR A 121 -14.727 -0.646 14.220 1.00 0.00 H new ATOM 0 HB THR A 121 -13.026 -1.416 15.905 1.00 0.00 H new ATOM 0 HG1 THR A 121 -11.331 -1.661 14.187 1.00 0.00 H new ATOM 0 HG21 THR A 121 -13.689 -3.792 15.856 1.00 0.00 H new ATOM 0 HG22 THR A 121 -15.064 -2.718 15.503 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.257 -3.594 14.181 1.00 0.00 H new ATOM 1897 N GLN A 122 -13.475 1.500 13.786 1.00 0.00 N ATOM 1898 CA GLN A 122 -12.759 2.770 13.783 1.00 0.00 C ATOM 1899 C GLN A 122 -11.369 2.610 13.177 1.00 0.00 C ATOM 1900 O GLN A 122 -10.392 3.157 13.688 1.00 0.00 O ATOM 1901 CB GLN A 122 -12.648 3.320 15.206 1.00 0.00 C ATOM 1902 CG GLN A 122 -12.086 2.318 16.203 1.00 0.00 C ATOM 1903 CD GLN A 122 -10.588 2.133 16.063 1.00 0.00 C ATOM 1904 OE1 GLN A 122 -9.831 3.103 16.037 1.00 0.00 O ATOM 1905 NE2 GLN A 122 -10.152 0.882 15.971 1.00 0.00 N ATOM 0 H GLN A 122 -14.483 1.583 13.652 1.00 0.00 H new ATOM 0 HA GLN A 122 -13.323 3.475 13.172 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -12.013 4.206 15.196 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -13.635 3.639 15.541 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -12.314 2.652 17.215 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -12.581 1.357 16.065 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -10.815 0.108 15.997 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -9.154 0.696 15.874 1.00 0.00 H new ATOM 1914 N ASP A 123 -11.289 1.858 12.085 1.00 0.00 N ATOM 1915 CA ASP A 123 -10.018 1.626 11.408 1.00 0.00 C ATOM 1916 C ASP A 123 -10.234 0.916 10.075 1.00 0.00 C ATOM 1917 O ASP A 123 -11.363 0.579 9.716 1.00 0.00 O ATOM 1918 CB ASP A 123 -9.086 0.800 12.296 1.00 0.00 C ATOM 1919 CG ASP A 123 -7.636 0.897 11.862 1.00 0.00 C ATOM 1920 OD1 ASP A 123 -7.314 0.415 10.756 1.00 0.00 O ATOM 1921 OD2 ASP A 123 -6.825 1.457 12.628 1.00 0.00 O ATOM 0 H ASP A 123 -12.089 1.399 11.650 1.00 0.00 H new ATOM 0 HA ASP A 123 -9.556 2.594 11.212 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.177 1.139 13.328 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -9.399 -0.244 12.275 1.00 0.00 H new TER 1926 ASP A 123