USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 889 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: B 106 GLN : amide:sc= -0.261 K(o=0.05,f=-0.49) USER MOD Set 1.2: B 110 TYR OH : rot -125:sc= 0.31 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= -0.375 (180deg=-0.375) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 165:sc= 0.531 (180deg=0.00769) USER MOD Single : A 13 TYR OH : rot 150:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -1.01 K(o=-1,f=-0.041) USER MOD Single : A 15 LYS NZ :NH3+ 155:sc= 1.25 (180deg=0.465) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -2.98! C(o=-3!,f=-3.9!) USER MOD Single : A 22 GLN : amide:sc= -0.565 X(o=-0.57,f=-0.086) USER MOD Single : A 24 GLN : amide:sc= -0.946 K(o=-0.95,f=-0.0034) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.0103 X(o=-0.01,f=-0.32) USER MOD Single : A 30 LYS NZ :NH3+ -115:sc= -0.0269 (180deg=-0.332) USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 0.991 (180deg=0.88) USER MOD Single : A 39 GLN : amide:sc= -1.07 K(o=-1.1,f=-0.012) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 100 GLN : amide:sc= -1.32! X(o=-1.3!,f=-0.97) USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 ASN : amide:sc= -1.05 K(o=-1,f=-2.9!) USER MOD Single : B 111 LYS NZ :NH3+ 165:sc= -0.0295 (180deg=-0.254) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 115 GLN : amide:sc= -0.214 K(o=-0.21,f=-3.7!) USER MOD Single : B 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 SER OG : rot -26:sc= 0.119 USER MOD Single : B 133 THR OG1 : rot -140:sc= -0.222 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 37.131 4.265 2.492 1.00 0.00 N ATOM 2 CA MET A 1 37.291 2.894 3.029 1.00 0.00 C ATOM 3 C MET A 1 36.683 2.784 4.421 1.00 0.00 C ATOM 4 O MET A 1 37.270 3.254 5.395 1.00 0.00 O ATOM 5 CB MET A 1 38.771 2.514 3.081 1.00 0.00 C ATOM 6 CG MET A 1 39.431 2.448 1.716 1.00 0.00 C ATOM 7 SD MET A 1 41.181 2.034 1.810 1.00 0.00 S ATOM 8 CE MET A 1 41.596 1.996 0.069 1.00 0.00 C ATOM 0 H1 MET A 1 37.552 4.317 1.543 1.00 0.00 H new ATOM 0 H2 MET A 1 36.119 4.500 2.435 1.00 0.00 H new ATOM 0 H3 MET A 1 37.609 4.942 3.121 1.00 0.00 H new ATOM 0 HA MET A 1 36.768 2.207 2.364 1.00 0.00 H new ATOM 0 HB2 MET A 1 39.302 3.240 3.697 1.00 0.00 H new ATOM 0 HB3 MET A 1 38.872 1.546 3.571 1.00 0.00 H new ATOM 0 HG2 MET A 1 38.918 1.705 1.105 1.00 0.00 H new ATOM 0 HG3 MET A 1 39.315 3.409 1.214 1.00 0.00 H new ATOM 0 HE1 MET A 1 42.652 1.752 -0.048 1.00 0.00 H new ATOM 0 HE2 MET A 1 40.991 1.241 -0.433 1.00 0.00 H new ATOM 0 HE3 MET A 1 41.398 2.972 -0.374 1.00 0.00 H new ATOM 20 N ASP A 2 35.493 2.187 4.490 1.00 0.00 N ATOM 21 CA ASP A 2 34.793 1.914 5.752 1.00 0.00 C ATOM 22 C ASP A 2 34.340 3.200 6.444 1.00 0.00 C ATOM 23 O ASP A 2 33.175 3.584 6.354 1.00 0.00 O ATOM 24 CB ASP A 2 35.660 1.079 6.708 1.00 0.00 C ATOM 25 CG ASP A 2 36.017 -0.280 6.141 1.00 0.00 C ATOM 26 OD1 ASP A 2 37.210 -0.516 5.855 1.00 0.00 O ATOM 27 OD2 ASP A 2 35.106 -1.121 5.971 1.00 0.00 O ATOM 0 H ASP A 2 34.980 1.875 3.665 1.00 0.00 H new ATOM 0 HA ASP A 2 33.905 1.337 5.495 1.00 0.00 H new ATOM 0 HB2 ASP A 2 36.576 1.626 6.932 1.00 0.00 H new ATOM 0 HB3 ASP A 2 35.129 0.946 7.651 1.00 0.00 H new ATOM 32 N SER A 3 35.270 3.880 7.102 1.00 0.00 N ATOM 33 CA SER A 3 34.942 5.059 7.895 1.00 0.00 C ATOM 34 C SER A 3 34.805 6.308 7.023 1.00 0.00 C ATOM 35 O SER A 3 34.608 7.409 7.530 1.00 0.00 O ATOM 36 CB SER A 3 36.006 5.276 8.973 1.00 0.00 C ATOM 37 OG SER A 3 36.153 4.118 9.780 1.00 0.00 O ATOM 0 H SER A 3 36.260 3.635 7.102 1.00 0.00 H new ATOM 0 HA SER A 3 33.977 4.885 8.371 1.00 0.00 H new ATOM 0 HB2 SER A 3 36.959 5.521 8.505 1.00 0.00 H new ATOM 0 HB3 SER A 3 35.729 6.126 9.597 1.00 0.00 H new ATOM 0 HG SER A 3 36.839 4.279 10.461 1.00 0.00 H new ATOM 43 N ALA A 4 34.905 6.135 5.709 1.00 0.00 N ATOM 44 CA ALA A 4 34.697 7.241 4.782 1.00 0.00 C ATOM 45 C ALA A 4 33.205 7.475 4.582 1.00 0.00 C ATOM 46 O ALA A 4 32.778 8.507 4.060 1.00 0.00 O ATOM 47 CB ALA A 4 35.381 6.964 3.454 1.00 0.00 C ATOM 0 H ALA A 4 35.128 5.245 5.264 1.00 0.00 H new ATOM 0 HA ALA A 4 35.140 8.143 5.205 1.00 0.00 H new ATOM 0 HB1 ALA A 4 35.213 7.801 2.777 1.00 0.00 H new ATOM 0 HB2 ALA A 4 36.451 6.837 3.616 1.00 0.00 H new ATOM 0 HB3 ALA A 4 34.970 6.055 3.015 1.00 0.00 H new ATOM 53 N ILE A 5 32.420 6.490 4.995 1.00 0.00 N ATOM 54 CA ILE A 5 30.974 6.596 4.987 1.00 0.00 C ATOM 55 C ILE A 5 30.497 7.159 6.322 1.00 0.00 C ATOM 56 O ILE A 5 30.673 6.522 7.362 1.00 0.00 O ATOM 57 CB ILE A 5 30.330 5.215 4.762 1.00 0.00 C ATOM 58 CG1 ILE A 5 30.973 4.528 3.556 1.00 0.00 C ATOM 59 CG2 ILE A 5 28.828 5.354 4.564 1.00 0.00 C ATOM 60 CD1 ILE A 5 30.515 3.101 3.349 1.00 0.00 C ATOM 0 H ILE A 5 32.770 5.598 5.344 1.00 0.00 H new ATOM 0 HA ILE A 5 30.679 7.260 4.175 1.00 0.00 H new ATOM 0 HB ILE A 5 30.500 4.599 5.645 1.00 0.00 H new ATOM 0 HG12 ILE A 5 30.749 5.105 2.659 1.00 0.00 H new ATOM 0 HG13 ILE A 5 32.056 4.538 3.679 1.00 0.00 H new ATOM 0 HG21 ILE A 5 28.389 4.369 4.406 1.00 0.00 H new ATOM 0 HG22 ILE A 5 28.385 5.811 5.449 1.00 0.00 H new ATOM 0 HG23 ILE A 5 28.632 5.982 3.695 1.00 0.00 H new ATOM 0 HD11 ILE A 5 31.015 2.682 2.476 1.00 0.00 H new ATOM 0 HD12 ILE A 5 30.764 2.508 4.229 1.00 0.00 H new ATOM 0 HD13 ILE A 5 29.436 3.084 3.193 1.00 0.00 H new ATOM 72 N SER A 6 29.909 8.347 6.302 1.00 0.00 N ATOM 73 CA SER A 6 29.451 8.979 7.528 1.00 0.00 C ATOM 74 C SER A 6 28.034 8.519 7.852 1.00 0.00 C ATOM 75 O SER A 6 27.476 7.675 7.143 1.00 0.00 O ATOM 76 CB SER A 6 29.498 10.503 7.388 1.00 0.00 C ATOM 77 OG SER A 6 30.781 10.941 6.961 1.00 0.00 O ATOM 0 H SER A 6 29.739 8.889 5.455 1.00 0.00 H new ATOM 0 HA SER A 6 30.111 8.686 8.345 1.00 0.00 H new ATOM 0 HB2 SER A 6 28.743 10.828 6.672 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.252 10.966 8.344 1.00 0.00 H new ATOM 0 HG SER A 6 30.782 11.917 6.878 1.00 0.00 H new ATOM 83 N LYS A 7 27.443 9.064 8.910 1.00 0.00 N ATOM 84 CA LYS A 7 26.070 8.725 9.255 1.00 0.00 C ATOM 85 C LYS A 7 25.118 9.262 8.189 1.00 0.00 C ATOM 86 O LYS A 7 23.961 8.855 8.116 1.00 0.00 O ATOM 87 CB LYS A 7 25.696 9.281 10.628 1.00 0.00 C ATOM 88 CG LYS A 7 24.461 8.620 11.212 1.00 0.00 C ATOM 89 CD LYS A 7 24.012 9.277 12.505 1.00 0.00 C ATOM 90 CE LYS A 7 22.943 8.455 13.211 1.00 0.00 C ATOM 91 NZ LYS A 7 23.382 7.056 13.462 1.00 0.00 N ATOM 0 H LYS A 7 27.888 9.735 9.536 1.00 0.00 H new ATOM 0 HA LYS A 7 25.984 7.639 9.297 1.00 0.00 H new ATOM 0 HB2 LYS A 7 26.534 9.144 11.311 1.00 0.00 H new ATOM 0 HB3 LYS A 7 25.524 10.354 10.546 1.00 0.00 H new ATOM 0 HG2 LYS A 7 23.650 8.663 10.485 1.00 0.00 H new ATOM 0 HG3 LYS A 7 24.668 7.566 11.396 1.00 0.00 H new ATOM 0 HD2 LYS A 7 24.869 9.404 13.166 1.00 0.00 H new ATOM 0 HD3 LYS A 7 23.624 10.273 12.292 1.00 0.00 H new ATOM 0 HE2 LYS A 7 22.690 8.930 14.159 1.00 0.00 H new ATOM 0 HE3 LYS A 7 22.036 8.446 12.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 22.746 6.612 14.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 23.355 6.519 12.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 24.353 7.058 13.835 1.00 0.00 H new ATOM 105 N GLU A 8 25.627 10.173 7.363 1.00 0.00 N ATOM 106 CA GLU A 8 24.872 10.726 6.247 1.00 0.00 C ATOM 107 C GLU A 8 24.266 9.633 5.384 1.00 0.00 C ATOM 108 O GLU A 8 23.048 9.542 5.264 1.00 0.00 O ATOM 109 CB GLU A 8 25.771 11.609 5.386 1.00 0.00 C ATOM 110 CG GLU A 8 25.845 13.040 5.873 1.00 0.00 C ATOM 111 CD GLU A 8 24.481 13.694 5.937 1.00 0.00 C ATOM 112 OE1 GLU A 8 24.223 14.448 6.898 1.00 0.00 O ATOM 113 OE2 GLU A 8 23.656 13.448 5.030 1.00 0.00 O ATOM 0 H GLU A 8 26.572 10.546 7.450 1.00 0.00 H new ATOM 0 HA GLU A 8 24.061 11.322 6.666 1.00 0.00 H new ATOM 0 HB2 GLU A 8 26.775 11.186 5.368 1.00 0.00 H new ATOM 0 HB3 GLU A 8 25.403 11.600 4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 8 26.303 13.062 6.862 1.00 0.00 H new ATOM 0 HG3 GLU A 8 26.491 13.615 5.209 1.00 0.00 H new ATOM 120 N ASP A 9 25.123 8.812 4.795 1.00 0.00 N ATOM 121 CA ASP A 9 24.685 7.729 3.918 1.00 0.00 C ATOM 122 C ASP A 9 23.746 6.772 4.648 1.00 0.00 C ATOM 123 O ASP A 9 22.736 6.332 4.096 1.00 0.00 O ATOM 124 CB ASP A 9 25.902 6.973 3.386 1.00 0.00 C ATOM 125 CG ASP A 9 25.531 5.729 2.608 1.00 0.00 C ATOM 126 OD1 ASP A 9 25.559 4.629 3.195 1.00 0.00 O ATOM 127 OD2 ASP A 9 25.229 5.838 1.401 1.00 0.00 O ATOM 0 H ASP A 9 26.135 8.874 4.908 1.00 0.00 H new ATOM 0 HA ASP A 9 24.135 8.164 3.083 1.00 0.00 H new ATOM 0 HB2 ASP A 9 26.483 7.636 2.745 1.00 0.00 H new ATOM 0 HB3 ASP A 9 26.544 6.694 4.222 1.00 0.00 H new ATOM 132 N GLU A 10 24.077 6.479 5.898 1.00 0.00 N ATOM 133 CA GLU A 10 23.278 5.576 6.718 1.00 0.00 C ATOM 134 C GLU A 10 21.875 6.129 6.940 1.00 0.00 C ATOM 135 O GLU A 10 20.890 5.547 6.484 1.00 0.00 O ATOM 136 CB GLU A 10 23.973 5.339 8.064 1.00 0.00 C ATOM 137 CG GLU A 10 23.158 4.502 9.040 1.00 0.00 C ATOM 138 CD GLU A 10 23.866 4.300 10.363 1.00 0.00 C ATOM 139 OE1 GLU A 10 23.732 5.162 11.261 1.00 0.00 O ATOM 140 OE2 GLU A 10 24.555 3.270 10.518 1.00 0.00 O ATOM 0 H GLU A 10 24.899 6.856 6.370 1.00 0.00 H new ATOM 0 HA GLU A 10 23.185 4.627 6.189 1.00 0.00 H new ATOM 0 HB2 GLU A 10 24.928 4.845 7.887 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.193 6.303 8.523 1.00 0.00 H new ATOM 0 HG2 GLU A 10 22.198 4.987 9.216 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.947 3.531 8.593 1.00 0.00 H new ATOM 147 N GLU A 11 21.796 7.265 7.617 1.00 0.00 N ATOM 148 CA GLU A 11 20.528 7.885 7.950 1.00 0.00 C ATOM 149 C GLU A 11 19.765 8.304 6.703 1.00 0.00 C ATOM 150 O GLU A 11 18.551 8.504 6.743 1.00 0.00 O ATOM 151 CB GLU A 11 20.771 9.081 8.861 1.00 0.00 C ATOM 152 CG GLU A 11 21.243 8.669 10.241 1.00 0.00 C ATOM 153 CD GLU A 11 20.123 8.085 11.072 1.00 0.00 C ATOM 154 OE1 GLU A 11 19.223 8.844 11.477 1.00 0.00 O ATOM 155 OE2 GLU A 11 20.139 6.865 11.325 1.00 0.00 O ATOM 0 H GLU A 11 22.611 7.781 7.950 1.00 0.00 H new ATOM 0 HA GLU A 11 19.912 7.152 8.472 1.00 0.00 H new ATOM 0 HB2 GLU A 11 21.514 9.736 8.406 1.00 0.00 H new ATOM 0 HB3 GLU A 11 19.851 9.658 8.952 1.00 0.00 H new ATOM 0 HG2 GLU A 11 22.044 7.936 10.146 1.00 0.00 H new ATOM 0 HG3 GLU A 11 21.662 9.535 10.754 1.00 0.00 H new ATOM 162 N ARG A 12 20.471 8.425 5.591 1.00 0.00 N ATOM 163 CA ARG A 12 19.835 8.780 4.340 1.00 0.00 C ATOM 164 C ARG A 12 18.957 7.629 3.873 1.00 0.00 C ATOM 165 O ARG A 12 17.815 7.835 3.467 1.00 0.00 O ATOM 166 CB ARG A 12 20.877 9.130 3.281 1.00 0.00 C ATOM 167 CG ARG A 12 20.311 9.898 2.102 1.00 0.00 C ATOM 168 CD ARG A 12 21.419 10.532 1.280 1.00 0.00 C ATOM 169 NE ARG A 12 22.215 11.475 2.070 1.00 0.00 N ATOM 170 CZ ARG A 12 23.278 12.124 1.601 1.00 0.00 C ATOM 171 NH1 ARG A 12 23.653 11.958 0.338 1.00 0.00 N ATOM 172 NH2 ARG A 12 23.963 12.946 2.388 1.00 0.00 N ATOM 0 H ARG A 12 21.479 8.283 5.532 1.00 0.00 H new ATOM 0 HA ARG A 12 19.213 9.662 4.496 1.00 0.00 H new ATOM 0 HB2 ARG A 12 21.668 9.721 3.743 1.00 0.00 H new ATOM 0 HB3 ARG A 12 21.337 8.211 2.918 1.00 0.00 H new ATOM 0 HG2 ARG A 12 19.726 9.226 1.473 1.00 0.00 H new ATOM 0 HG3 ARG A 12 19.632 10.671 2.460 1.00 0.00 H new ATOM 0 HD2 ARG A 12 22.069 9.752 0.884 1.00 0.00 H new ATOM 0 HD3 ARG A 12 20.985 11.051 0.425 1.00 0.00 H new ATOM 0 HE ARG A 12 21.938 11.644 3.037 1.00 0.00 H new ATOM 0 HH11 ARG A 12 23.126 11.333 -0.272 1.00 0.00 H new ATOM 0 HH12 ARG A 12 24.468 12.455 -0.022 1.00 0.00 H new ATOM 0 HH21 ARG A 12 23.675 13.082 3.357 1.00 0.00 H new ATOM 0 HH22 ARG A 12 24.777 13.441 2.023 1.00 0.00 H new ATOM 186 N TYR A 13 19.476 6.410 3.971 1.00 0.00 N ATOM 187 CA TYR A 13 18.699 5.240 3.609 1.00 0.00 C ATOM 188 C TYR A 13 17.755 4.840 4.739 1.00 0.00 C ATOM 189 O TYR A 13 16.562 4.670 4.519 1.00 0.00 O ATOM 190 CB TYR A 13 19.607 4.062 3.242 1.00 0.00 C ATOM 191 CG TYR A 13 18.868 2.746 3.191 1.00 0.00 C ATOM 192 CD1 TYR A 13 19.279 1.670 3.963 1.00 0.00 C ATOM 193 CD2 TYR A 13 17.741 2.594 2.394 1.00 0.00 C ATOM 194 CE1 TYR A 13 18.588 0.474 3.943 1.00 0.00 C ATOM 195 CE2 TYR A 13 17.043 1.405 2.365 1.00 0.00 C ATOM 196 CZ TYR A 13 17.470 0.345 3.145 1.00 0.00 C ATOM 197 OH TYR A 13 16.779 -0.848 3.130 1.00 0.00 O ATOM 0 H TYR A 13 20.422 6.211 4.295 1.00 0.00 H new ATOM 0 HA TYR A 13 18.105 5.502 2.734 1.00 0.00 H new ATOM 0 HB2 TYR A 13 20.067 4.253 2.273 1.00 0.00 H new ATOM 0 HB3 TYR A 13 20.415 3.992 3.970 1.00 0.00 H new ATOM 0 HD1 TYR A 13 20.153 1.769 4.590 1.00 0.00 H new ATOM 0 HD2 TYR A 13 17.405 3.421 1.786 1.00 0.00 H new ATOM 0 HE1 TYR A 13 18.921 -0.356 4.549 1.00 0.00 H new ATOM 0 HE2 TYR A 13 16.170 1.302 1.738 1.00 0.00 H new ATOM 0 HH TYR A 13 15.832 -0.675 2.948 1.00 0.00 H new ATOM 207 N GLN A 14 18.296 4.705 5.943 1.00 0.00 N ATOM 208 CA GLN A 14 17.526 4.233 7.097 1.00 0.00 C ATOM 209 C GLN A 14 16.255 5.044 7.300 1.00 0.00 C ATOM 210 O GLN A 14 15.153 4.503 7.286 1.00 0.00 O ATOM 211 CB GLN A 14 18.376 4.303 8.362 1.00 0.00 C ATOM 212 CG GLN A 14 19.598 3.405 8.330 1.00 0.00 C ATOM 213 CD GLN A 14 19.249 1.929 8.300 1.00 0.00 C ATOM 214 OE1 GLN A 14 19.968 1.126 7.709 1.00 0.00 O ATOM 215 NE2 GLN A 14 18.157 1.556 8.953 1.00 0.00 N ATOM 0 H GLN A 14 19.272 4.916 6.151 1.00 0.00 H new ATOM 0 HA GLN A 14 17.243 3.200 6.896 1.00 0.00 H new ATOM 0 HB2 GLN A 14 18.698 5.333 8.516 1.00 0.00 H new ATOM 0 HB3 GLN A 14 17.759 4.031 9.218 1.00 0.00 H new ATOM 0 HG2 GLN A 14 20.198 3.649 7.453 1.00 0.00 H new ATOM 0 HG3 GLN A 14 20.215 3.609 9.205 1.00 0.00 H new ATOM 0 HE21 GLN A 14 17.586 2.253 9.431 1.00 0.00 H new ATOM 0 HE22 GLN A 14 17.888 0.572 8.977 1.00 0.00 H new ATOM 224 N LYS A 15 16.410 6.341 7.494 1.00 0.00 N ATOM 225 CA LYS A 15 15.267 7.218 7.674 1.00 0.00 C ATOM 226 C LYS A 15 14.358 7.209 6.443 1.00 0.00 C ATOM 227 O LYS A 15 13.148 7.397 6.562 1.00 0.00 O ATOM 228 CB LYS A 15 15.724 8.638 7.995 1.00 0.00 C ATOM 229 CG LYS A 15 16.329 8.767 9.381 1.00 0.00 C ATOM 230 CD LYS A 15 15.286 8.528 10.459 1.00 0.00 C ATOM 231 CE LYS A 15 15.916 8.365 11.830 1.00 0.00 C ATOM 232 NZ LYS A 15 16.740 9.541 12.221 1.00 0.00 N ATOM 0 H LYS A 15 17.315 6.810 7.531 1.00 0.00 H new ATOM 0 HA LYS A 15 14.688 6.841 8.517 1.00 0.00 H new ATOM 0 HB2 LYS A 15 16.458 8.954 7.253 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.874 9.315 7.911 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.143 8.051 9.494 1.00 0.00 H new ATOM 0 HG3 LYS A 15 16.760 9.761 9.502 1.00 0.00 H new ATOM 0 HD2 LYS A 15 14.586 9.363 10.478 1.00 0.00 H new ATOM 0 HD3 LYS A 15 14.710 7.635 10.216 1.00 0.00 H new ATOM 0 HE2 LYS A 15 15.131 8.212 12.571 1.00 0.00 H new ATOM 0 HE3 LYS A 15 16.539 7.471 11.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 16.795 9.597 13.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 17.698 9.440 11.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.304 10.409 11.850 1.00 0.00 H new ATOM 246 N LEU A 16 14.941 6.965 5.271 1.00 0.00 N ATOM 247 CA LEU A 16 14.173 6.900 4.030 1.00 0.00 C ATOM 248 C LEU A 16 13.184 5.746 4.073 1.00 0.00 C ATOM 249 O LEU A 16 12.026 5.895 3.674 1.00 0.00 O ATOM 250 CB LEU A 16 15.107 6.726 2.833 1.00 0.00 C ATOM 251 CG LEU A 16 14.470 6.923 1.458 1.00 0.00 C ATOM 252 CD1 LEU A 16 13.795 8.281 1.376 1.00 0.00 C ATOM 253 CD2 LEU A 16 15.531 6.787 0.385 1.00 0.00 C ATOM 0 H LEU A 16 15.942 6.809 5.155 1.00 0.00 H new ATOM 0 HA LEU A 16 13.624 7.835 3.923 1.00 0.00 H new ATOM 0 HB2 LEU A 16 15.932 7.431 2.935 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.536 5.725 2.874 1.00 0.00 H new ATOM 0 HG LEU A 16 13.709 6.159 1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.346 8.405 0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 16 13.019 8.348 2.139 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.534 9.065 1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.077 6.927 -0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 16 16.303 7.541 0.539 1.00 0.00 H new ATOM 0 HD23 LEU A 16 15.978 5.794 0.439 1.00 0.00 H new ATOM 265 N VAL A 17 13.642 4.593 4.557 1.00 0.00 N ATOM 266 CA VAL A 17 12.777 3.425 4.668 1.00 0.00 C ATOM 267 C VAL A 17 11.602 3.756 5.567 1.00 0.00 C ATOM 268 O VAL A 17 10.467 3.424 5.258 1.00 0.00 O ATOM 269 CB VAL A 17 13.519 2.163 5.195 1.00 0.00 C ATOM 270 CG1 VAL A 17 14.949 2.153 4.712 1.00 0.00 C ATOM 271 CG2 VAL A 17 13.467 2.036 6.715 1.00 0.00 C ATOM 0 H VAL A 17 14.600 4.445 4.876 1.00 0.00 H new ATOM 0 HA VAL A 17 12.430 3.180 3.664 1.00 0.00 H new ATOM 0 HB VAL A 17 12.995 1.297 4.790 1.00 0.00 H new ATOM 0 HG11 VAL A 17 15.454 1.264 5.089 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.965 2.144 3.622 1.00 0.00 H new ATOM 0 HG13 VAL A 17 15.462 3.043 5.075 1.00 0.00 H new ATOM 0 HG21 VAL A 17 14.001 1.137 7.024 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.934 2.910 7.169 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.428 1.970 7.039 1.00 0.00 H new ATOM 281 N THR A 18 11.882 4.474 6.647 1.00 0.00 N ATOM 282 CA THR A 18 10.863 4.854 7.594 1.00 0.00 C ATOM 283 C THR A 18 9.792 5.692 6.903 1.00 0.00 C ATOM 284 O THR A 18 8.604 5.440 7.058 1.00 0.00 O ATOM 285 CB THR A 18 11.495 5.610 8.789 1.00 0.00 C ATOM 286 OG1 THR A 18 11.385 4.819 9.980 1.00 0.00 O ATOM 287 CG2 THR A 18 10.854 6.971 9.007 1.00 0.00 C ATOM 0 H THR A 18 12.818 4.803 6.883 1.00 0.00 H new ATOM 0 HA THR A 18 10.385 3.957 7.986 1.00 0.00 H new ATOM 0 HB THR A 18 12.546 5.777 8.554 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.788 5.302 10.732 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.329 7.465 9.855 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.983 7.581 8.113 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.791 6.844 9.210 1.00 0.00 H new ATOM 295 N GLU A 19 10.230 6.647 6.095 1.00 0.00 N ATOM 296 CA GLU A 19 9.324 7.521 5.370 1.00 0.00 C ATOM 297 C GLU A 19 8.412 6.707 4.475 1.00 0.00 C ATOM 298 O GLU A 19 7.207 6.942 4.414 1.00 0.00 O ATOM 299 CB GLU A 19 10.143 8.510 4.548 1.00 0.00 C ATOM 300 CG GLU A 19 11.030 9.376 5.422 1.00 0.00 C ATOM 301 CD GLU A 19 10.249 10.417 6.191 1.00 0.00 C ATOM 302 OE1 GLU A 19 10.294 11.603 5.799 1.00 0.00 O ATOM 303 OE2 GLU A 19 9.585 10.058 7.184 1.00 0.00 O ATOM 0 H GLU A 19 11.218 6.836 5.925 1.00 0.00 H new ATOM 0 HA GLU A 19 8.699 8.069 6.075 1.00 0.00 H new ATOM 0 HB2 GLU A 19 10.759 7.965 3.833 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.471 9.145 3.970 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.572 8.742 6.124 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.774 9.872 4.799 1.00 0.00 H new ATOM 310 N ASN A 20 9.010 5.724 3.829 1.00 0.00 N ATOM 311 CA ASN A 20 8.318 4.845 2.900 1.00 0.00 C ATOM 312 C ASN A 20 7.307 3.951 3.628 1.00 0.00 C ATOM 313 O ASN A 20 6.197 3.727 3.143 1.00 0.00 O ATOM 314 CB ASN A 20 9.373 4.009 2.172 1.00 0.00 C ATOM 315 CG ASN A 20 8.831 3.182 1.028 1.00 0.00 C ATOM 316 OD1 ASN A 20 7.752 3.443 0.498 1.00 0.00 O ATOM 317 ND2 ASN A 20 9.608 2.188 0.621 1.00 0.00 N ATOM 0 H ASN A 20 10.002 5.509 3.934 1.00 0.00 H new ATOM 0 HA ASN A 20 7.749 5.436 2.182 1.00 0.00 H new ATOM 0 HB2 ASN A 20 10.146 4.675 1.789 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.852 3.344 2.891 1.00 0.00 H new ATOM 0 HD21 ASN A 20 9.319 1.602 -0.162 1.00 0.00 H new ATOM 0 HD22 ASN A 20 10.495 2.009 1.091 1.00 0.00 H new ATOM 324 N GLU A 21 7.688 3.457 4.800 1.00 0.00 N ATOM 325 CA GLU A 21 6.822 2.582 5.582 1.00 0.00 C ATOM 326 C GLU A 21 5.690 3.370 6.255 1.00 0.00 C ATOM 327 O GLU A 21 4.563 2.883 6.364 1.00 0.00 O ATOM 328 CB GLU A 21 7.651 1.852 6.633 1.00 0.00 C ATOM 329 CG GLU A 21 8.893 1.203 6.055 1.00 0.00 C ATOM 330 CD GLU A 21 8.676 -0.203 5.537 1.00 0.00 C ATOM 331 OE1 GLU A 21 8.166 -0.363 4.410 1.00 0.00 O ATOM 332 OE2 GLU A 21 9.054 -1.158 6.247 1.00 0.00 O ATOM 0 H GLU A 21 8.593 3.648 5.231 1.00 0.00 H new ATOM 0 HA GLU A 21 6.366 1.858 4.907 1.00 0.00 H new ATOM 0 HB2 GLU A 21 7.944 2.556 7.412 1.00 0.00 H new ATOM 0 HB3 GLU A 21 7.035 1.088 7.109 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.268 1.824 5.241 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.667 1.180 6.822 1.00 0.00 H new ATOM 339 N GLN A 22 5.990 4.589 6.704 1.00 0.00 N ATOM 340 CA GLN A 22 5.000 5.404 7.406 1.00 0.00 C ATOM 341 C GLN A 22 3.852 5.799 6.491 1.00 0.00 C ATOM 342 O GLN A 22 2.689 5.528 6.786 1.00 0.00 O ATOM 343 CB GLN A 22 5.608 6.690 7.969 1.00 0.00 C ATOM 344 CG GLN A 22 6.724 6.482 8.979 1.00 0.00 C ATOM 345 CD GLN A 22 7.057 7.754 9.730 1.00 0.00 C ATOM 346 OE1 GLN A 22 6.480 8.036 10.778 1.00 0.00 O ATOM 347 NE2 GLN A 22 7.983 8.533 9.199 1.00 0.00 N ATOM 0 H GLN A 22 6.903 5.031 6.595 1.00 0.00 H new ATOM 0 HA GLN A 22 4.634 4.783 8.223 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.993 7.285 7.141 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.816 7.273 8.439 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.430 5.709 9.689 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.615 6.121 8.465 1.00 0.00 H new ATOM 0 HE21 GLN A 22 8.438 8.263 8.327 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.242 9.405 9.661 1.00 0.00 H new ATOM 356 N LEU A 23 4.182 6.436 5.378 1.00 0.00 N ATOM 357 CA LEU A 23 3.169 7.100 4.575 1.00 0.00 C ATOM 358 C LEU A 23 2.299 6.107 3.806 1.00 0.00 C ATOM 359 O LEU A 23 1.165 6.421 3.457 1.00 0.00 O ATOM 360 CB LEU A 23 3.807 8.157 3.659 1.00 0.00 C ATOM 361 CG LEU A 23 4.242 7.725 2.257 1.00 0.00 C ATOM 362 CD1 LEU A 23 4.872 8.904 1.543 1.00 0.00 C ATOM 363 CD2 LEU A 23 5.217 6.563 2.288 1.00 0.00 C ATOM 0 H LEU A 23 5.132 6.507 5.014 1.00 0.00 H new ATOM 0 HA LEU A 23 2.495 7.621 5.254 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.097 8.977 3.550 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.682 8.558 4.171 1.00 0.00 H new ATOM 0 HG LEU A 23 3.354 7.387 1.723 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.183 8.600 0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 23 4.146 9.713 1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.741 9.248 2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.495 6.294 1.269 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.109 6.851 2.844 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.748 5.707 2.774 1.00 0.00 H new ATOM 375 N GLN A 24 2.807 4.898 3.580 1.00 0.00 N ATOM 376 CA GLN A 24 2.001 3.854 2.953 1.00 0.00 C ATOM 377 C GLN A 24 0.901 3.406 3.914 1.00 0.00 C ATOM 378 O GLN A 24 -0.194 3.030 3.497 1.00 0.00 O ATOM 379 CB GLN A 24 2.865 2.661 2.529 1.00 0.00 C ATOM 380 CG GLN A 24 3.506 1.915 3.684 1.00 0.00 C ATOM 381 CD GLN A 24 4.348 0.737 3.235 1.00 0.00 C ATOM 382 OE1 GLN A 24 4.463 -0.259 3.945 1.00 0.00 O ATOM 383 NE2 GLN A 24 4.953 0.844 2.059 1.00 0.00 N ATOM 0 H GLN A 24 3.759 4.619 3.818 1.00 0.00 H new ATOM 0 HA GLN A 24 1.545 4.265 2.052 1.00 0.00 H new ATOM 0 HB2 GLN A 24 2.249 1.965 1.959 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.649 3.015 1.860 1.00 0.00 H new ATOM 0 HG2 GLN A 24 4.130 2.604 4.253 1.00 0.00 H new ATOM 0 HG3 GLN A 24 2.726 1.561 4.358 1.00 0.00 H new ATOM 0 HE21 GLN A 24 4.833 1.688 1.498 1.00 0.00 H new ATOM 0 HE22 GLN A 24 5.538 0.083 1.715 1.00 0.00 H new ATOM 392 N ARG A 25 1.199 3.479 5.208 1.00 0.00 N ATOM 393 CA ARG A 25 0.232 3.188 6.243 1.00 0.00 C ATOM 394 C ARG A 25 -0.793 4.312 6.317 1.00 0.00 C ATOM 395 O ARG A 25 -1.990 4.074 6.469 1.00 0.00 O ATOM 396 CB ARG A 25 0.958 3.045 7.578 1.00 0.00 C ATOM 397 CG ARG A 25 0.163 3.567 8.754 1.00 0.00 C ATOM 398 CD ARG A 25 1.079 4.021 9.875 1.00 0.00 C ATOM 399 NE ARG A 25 2.045 2.984 10.230 1.00 0.00 N ATOM 400 CZ ARG A 25 3.248 3.221 10.745 1.00 0.00 C ATOM 401 NH1 ARG A 25 3.636 4.464 11.010 1.00 0.00 N ATOM 402 NH2 ARG A 25 4.064 2.210 10.999 1.00 0.00 N ATOM 0 H ARG A 25 2.119 3.742 5.561 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.287 2.257 6.015 1.00 0.00 H new ATOM 0 HB2 ARG A 25 1.192 1.994 7.745 1.00 0.00 H new ATOM 0 HB3 ARG A 25 1.907 3.578 7.526 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.463 4.399 8.433 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.505 2.788 9.120 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.608 4.924 9.571 1.00 0.00 H new ATOM 0 HD3 ARG A 25 0.484 4.280 10.750 1.00 0.00 H new ATOM 0 HE ARG A 25 1.779 2.012 10.072 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.009 5.246 10.818 1.00 0.00 H new ATOM 0 HH12 ARG A 25 4.560 4.636 11.405 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.769 1.254 10.800 1.00 0.00 H new ATOM 0 HH22 ARG A 25 4.988 2.387 11.394 1.00 0.00 H new ATOM 416 N LEU A 26 -0.300 5.537 6.205 1.00 0.00 N ATOM 417 CA LEU A 26 -1.147 6.717 6.258 1.00 0.00 C ATOM 418 C LEU A 26 -2.155 6.695 5.120 1.00 0.00 C ATOM 419 O LEU A 26 -3.318 7.044 5.302 1.00 0.00 O ATOM 420 CB LEU A 26 -0.276 7.972 6.215 1.00 0.00 C ATOM 421 CG LEU A 26 0.708 8.072 7.387 1.00 0.00 C ATOM 422 CD1 LEU A 26 1.659 9.241 7.215 1.00 0.00 C ATOM 423 CD2 LEU A 26 -0.043 8.190 8.705 1.00 0.00 C ATOM 0 H LEU A 26 0.691 5.739 6.076 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.709 6.723 7.192 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.283 7.985 5.279 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.919 8.852 6.215 1.00 0.00 H new ATOM 0 HG LEU A 26 1.301 7.158 7.400 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.342 9.282 8.063 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.230 9.113 6.295 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.089 10.169 7.163 1.00 0.00 H new ATOM 0 HD21 LEU A 26 0.671 8.260 9.526 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.667 9.084 8.690 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.672 7.311 8.845 1.00 0.00 H new ATOM 435 N ILE A 27 -1.705 6.253 3.954 1.00 0.00 N ATOM 436 CA ILE A 27 -2.605 6.009 2.838 1.00 0.00 C ATOM 437 C ILE A 27 -3.626 4.950 3.226 1.00 0.00 C ATOM 438 O ILE A 27 -4.829 5.160 3.112 1.00 0.00 O ATOM 439 CB ILE A 27 -1.841 5.516 1.594 1.00 0.00 C ATOM 440 CG1 ILE A 27 -0.843 6.569 1.134 1.00 0.00 C ATOM 441 CG2 ILE A 27 -2.805 5.162 0.468 1.00 0.00 C ATOM 442 CD1 ILE A 27 0.094 6.065 0.067 1.00 0.00 C ATOM 0 H ILE A 27 -0.724 6.057 3.757 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.098 6.951 2.599 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.294 4.613 1.865 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.386 7.435 0.754 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -0.261 6.909 1.991 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.241 4.817 -0.399 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -3.479 4.372 0.801 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.386 6.043 0.196 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.781 6.861 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 27 0.661 5.217 0.452 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.481 5.752 -0.804 1.00 0.00 H new ATOM 454 N THR A 28 -3.114 3.826 3.718 1.00 0.00 N ATOM 455 CA THR A 28 -3.924 2.674 4.075 1.00 0.00 C ATOM 456 C THR A 28 -5.067 3.035 5.039 1.00 0.00 C ATOM 457 O THR A 28 -6.205 2.598 4.844 1.00 0.00 O ATOM 458 CB THR A 28 -3.015 1.565 4.673 1.00 0.00 C ATOM 459 OG1 THR A 28 -2.949 0.441 3.790 1.00 0.00 O ATOM 460 CG2 THR A 28 -3.476 1.115 6.049 1.00 0.00 C ATOM 0 H THR A 28 -2.116 3.691 3.880 1.00 0.00 H new ATOM 0 HA THR A 28 -4.398 2.302 3.167 1.00 0.00 H new ATOM 0 HB THR A 28 -2.022 1.999 4.787 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.371 -0.248 4.180 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.807 0.339 6.421 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.463 1.964 6.733 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.489 0.718 5.982 1.00 0.00 H new ATOM 468 N GLN A 29 -4.774 3.850 6.049 1.00 0.00 N ATOM 469 CA GLN A 29 -5.762 4.172 7.072 1.00 0.00 C ATOM 470 C GLN A 29 -6.762 5.215 6.574 1.00 0.00 C ATOM 471 O GLN A 29 -7.933 5.183 6.940 1.00 0.00 O ATOM 472 CB GLN A 29 -5.081 4.643 8.352 1.00 0.00 C ATOM 473 CG GLN A 29 -4.391 5.966 8.193 1.00 0.00 C ATOM 474 CD GLN A 29 -3.877 6.531 9.500 1.00 0.00 C ATOM 475 OE1 GLN A 29 -2.738 6.279 9.892 1.00 0.00 O ATOM 476 NE2 GLN A 29 -4.714 7.288 10.188 1.00 0.00 N ATOM 0 H GLN A 29 -3.866 4.296 6.180 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.318 3.261 7.294 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.824 4.719 9.146 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -4.354 3.895 8.667 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.557 5.853 7.501 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.083 6.678 7.744 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.650 7.472 9.827 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.424 7.688 11.080 1.00 0.00 H new ATOM 485 N LYS A 30 -6.311 6.126 5.731 1.00 0.00 N ATOM 486 CA LYS A 30 -7.194 7.149 5.190 1.00 0.00 C ATOM 487 C LYS A 30 -8.070 6.560 4.085 1.00 0.00 C ATOM 488 O LYS A 30 -9.268 6.831 4.024 1.00 0.00 O ATOM 489 CB LYS A 30 -6.383 8.343 4.679 1.00 0.00 C ATOM 490 CG LYS A 30 -5.549 9.011 5.768 1.00 0.00 C ATOM 491 CD LYS A 30 -6.404 9.451 6.952 1.00 0.00 C ATOM 492 CE LYS A 30 -5.561 10.066 8.061 1.00 0.00 C ATOM 493 NZ LYS A 30 -4.866 11.304 7.622 1.00 0.00 N ATOM 0 H LYS A 30 -5.346 6.181 5.406 1.00 0.00 H new ATOM 0 HA LYS A 30 -7.848 7.507 5.985 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.723 8.010 3.878 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.063 9.078 4.248 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.781 8.319 6.113 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.034 9.876 5.351 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -7.146 10.175 6.615 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.951 8.593 7.344 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.199 10.294 8.915 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -4.823 9.338 8.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -3.838 11.148 7.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.168 11.548 6.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.105 12.084 8.267 1.00 0.00 H new ATOM 507 N GLU A 31 -7.465 5.724 3.244 1.00 0.00 N ATOM 508 CA GLU A 31 -8.167 5.063 2.147 1.00 0.00 C ATOM 509 C GLU A 31 -9.418 4.324 2.619 1.00 0.00 C ATOM 510 O GLU A 31 -10.494 4.492 2.040 1.00 0.00 O ATOM 511 CB GLU A 31 -7.230 4.081 1.441 1.00 0.00 C ATOM 512 CG GLU A 31 -6.465 4.692 0.279 1.00 0.00 C ATOM 513 CD GLU A 31 -7.334 4.862 -0.952 1.00 0.00 C ATOM 514 OE1 GLU A 31 -7.275 3.991 -1.850 1.00 0.00 O ATOM 515 OE2 GLU A 31 -8.096 5.846 -1.024 1.00 0.00 O ATOM 0 H GLU A 31 -6.475 5.486 3.304 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.484 5.842 1.454 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.518 3.688 2.166 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.813 3.236 1.076 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.067 5.662 0.578 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -5.612 4.059 0.035 1.00 0.00 H new ATOM 522 N GLU A 32 -9.280 3.517 3.671 1.00 0.00 N ATOM 523 CA GLU A 32 -10.391 2.701 4.150 1.00 0.00 C ATOM 524 C GLU A 32 -11.548 3.562 4.660 1.00 0.00 C ATOM 525 O GLU A 32 -12.710 3.270 4.371 1.00 0.00 O ATOM 526 CB GLU A 32 -9.936 1.712 5.232 1.00 0.00 C ATOM 527 CG GLU A 32 -9.064 2.322 6.313 1.00 0.00 C ATOM 528 CD GLU A 32 -8.963 1.446 7.544 1.00 0.00 C ATOM 529 OE1 GLU A 32 -8.043 0.609 7.607 1.00 0.00 O ATOM 530 OE2 GLU A 32 -9.809 1.585 8.453 1.00 0.00 O ATOM 0 H GLU A 32 -8.416 3.412 4.203 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.753 2.127 3.297 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.817 1.272 5.699 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -9.388 0.899 4.756 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -8.065 2.497 5.913 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.469 3.294 6.596 1.00 0.00 H new ATOM 537 N LYS A 33 -11.238 4.626 5.399 1.00 0.00 N ATOM 538 CA LYS A 33 -12.281 5.511 5.908 1.00 0.00 C ATOM 539 C LYS A 33 -12.934 6.296 4.774 1.00 0.00 C ATOM 540 O LYS A 33 -14.161 6.355 4.682 1.00 0.00 O ATOM 541 CB LYS A 33 -11.744 6.484 6.967 1.00 0.00 C ATOM 542 CG LYS A 33 -11.656 5.901 8.374 1.00 0.00 C ATOM 543 CD LYS A 33 -10.449 4.998 8.538 1.00 0.00 C ATOM 544 CE LYS A 33 -10.380 4.390 9.929 1.00 0.00 C ATOM 545 NZ LYS A 33 -11.345 3.272 10.092 1.00 0.00 N ATOM 0 H LYS A 33 -10.287 4.893 5.655 1.00 0.00 H new ATOM 0 HA LYS A 33 -13.029 4.874 6.380 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -10.752 6.820 6.664 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.386 7.365 6.992 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.604 6.712 9.100 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.563 5.337 8.591 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.488 4.201 7.795 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.540 5.568 8.346 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.369 4.028 10.117 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.587 5.160 10.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -11.416 3.018 11.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.279 3.566 9.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.016 2.448 9.549 1.00 0.00 H new ATOM 559 N ILE A 34 -12.117 6.881 3.902 1.00 0.00 N ATOM 560 CA ILE A 34 -12.632 7.696 2.806 1.00 0.00 C ATOM 561 C ILE A 34 -13.558 6.891 1.900 1.00 0.00 C ATOM 562 O ILE A 34 -14.570 7.405 1.415 1.00 0.00 O ATOM 563 CB ILE A 34 -11.504 8.297 1.946 1.00 0.00 C ATOM 564 CG1 ILE A 34 -10.679 9.289 2.762 1.00 0.00 C ATOM 565 CG2 ILE A 34 -12.101 8.981 0.731 1.00 0.00 C ATOM 566 CD1 ILE A 34 -9.304 9.553 2.182 1.00 0.00 C ATOM 0 H ILE A 34 -11.100 6.806 3.933 1.00 0.00 H new ATOM 0 HA ILE A 34 -13.189 8.508 3.274 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.843 7.495 1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.223 10.231 2.831 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.569 8.909 3.778 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -11.302 9.406 0.123 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -12.658 8.253 0.141 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.773 9.776 1.054 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.774 10.267 2.813 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.742 8.620 2.138 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.406 9.963 1.177 1.00 0.00 H new ATOM 578 N ARG A 35 -13.214 5.628 1.683 1.00 0.00 N ATOM 579 CA ARG A 35 -13.978 4.762 0.840 1.00 0.00 C ATOM 580 C ARG A 35 -15.404 4.639 1.347 1.00 0.00 C ATOM 581 O ARG A 35 -16.347 4.526 0.567 1.00 0.00 O ATOM 582 CB ARG A 35 -13.295 3.412 0.815 1.00 0.00 C ATOM 583 CG ARG A 35 -13.566 2.666 -0.450 1.00 0.00 C ATOM 584 CD ARG A 35 -12.625 1.490 -0.617 1.00 0.00 C ATOM 585 NE ARG A 35 -11.253 1.935 -0.845 1.00 0.00 N ATOM 586 CZ ARG A 35 -10.185 1.401 -0.261 1.00 0.00 C ATOM 587 NH1 ARG A 35 -10.322 0.398 0.596 1.00 0.00 N ATOM 588 NH2 ARG A 35 -8.977 1.876 -0.534 1.00 0.00 N ATOM 0 H ARG A 35 -12.391 5.188 2.095 1.00 0.00 H new ATOM 0 HA ARG A 35 -14.030 5.171 -0.169 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -12.220 3.548 0.931 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -13.635 2.819 1.664 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -14.597 2.311 -0.450 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -13.461 3.340 -1.300 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -12.663 0.862 0.273 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -12.954 0.875 -1.455 1.00 0.00 H new ATOM 0 HE ARG A 35 -11.104 2.707 -1.495 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -11.250 0.033 0.810 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -9.499 -0.008 1.041 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.869 2.649 -1.191 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.156 1.468 -0.087 1.00 0.00 H new ATOM 602 N VAL A 36 -15.554 4.676 2.659 1.00 0.00 N ATOM 603 CA VAL A 36 -16.869 4.639 3.267 1.00 0.00 C ATOM 604 C VAL A 36 -17.514 6.015 3.205 1.00 0.00 C ATOM 605 O VAL A 36 -18.712 6.141 2.960 1.00 0.00 O ATOM 606 CB VAL A 36 -16.796 4.181 4.728 1.00 0.00 C ATOM 607 CG1 VAL A 36 -18.191 3.901 5.256 1.00 0.00 C ATOM 608 CG2 VAL A 36 -15.895 2.962 4.856 1.00 0.00 C ATOM 0 H VAL A 36 -14.781 4.732 3.322 1.00 0.00 H new ATOM 0 HA VAL A 36 -17.471 3.923 2.708 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.362 4.978 5.332 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -18.129 3.576 6.295 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.792 4.808 5.195 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.656 3.117 4.658 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -15.853 2.648 5.899 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -16.294 2.149 4.249 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -14.892 3.213 4.512 1.00 0.00 H new ATOM 618 N LEU A 37 -16.703 7.042 3.421 1.00 0.00 N ATOM 619 CA LEU A 37 -17.152 8.431 3.333 1.00 0.00 C ATOM 620 C LEU A 37 -17.826 8.708 2.003 1.00 0.00 C ATOM 621 O LEU A 37 -18.894 9.311 1.957 1.00 0.00 O ATOM 622 CB LEU A 37 -15.970 9.384 3.506 1.00 0.00 C ATOM 623 CG LEU A 37 -15.752 9.912 4.923 1.00 0.00 C ATOM 624 CD1 LEU A 37 -16.815 10.942 5.277 1.00 0.00 C ATOM 625 CD2 LEU A 37 -15.769 8.764 5.920 1.00 0.00 C ATOM 0 H LEU A 37 -15.717 6.940 3.662 1.00 0.00 H new ATOM 0 HA LEU A 37 -17.875 8.594 4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -15.063 8.872 3.184 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -16.110 10.234 2.838 1.00 0.00 H new ATOM 0 HG LEU A 37 -14.777 10.397 4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -16.645 11.307 6.290 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -16.762 11.775 4.577 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -17.801 10.482 5.219 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -15.613 9.153 6.926 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -16.732 8.256 5.873 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -14.974 8.059 5.676 1.00 0.00 H new ATOM 637 N ARG A 38 -17.200 8.257 0.930 1.00 0.00 N ATOM 638 CA ARG A 38 -17.720 8.491 -0.411 1.00 0.00 C ATOM 639 C ARG A 38 -19.099 7.851 -0.564 1.00 0.00 C ATOM 640 O ARG A 38 -19.997 8.430 -1.168 1.00 0.00 O ATOM 641 CB ARG A 38 -16.735 7.963 -1.464 1.00 0.00 C ATOM 642 CG ARG A 38 -16.921 6.505 -1.853 1.00 0.00 C ATOM 643 CD ARG A 38 -15.796 6.020 -2.750 1.00 0.00 C ATOM 644 NE ARG A 38 -15.625 6.861 -3.936 1.00 0.00 N ATOM 645 CZ ARG A 38 -14.634 6.711 -4.812 1.00 0.00 C ATOM 646 NH1 ARG A 38 -13.748 5.739 -4.652 1.00 0.00 N ATOM 647 NH2 ARG A 38 -14.532 7.527 -5.853 1.00 0.00 N ATOM 0 H ARG A 38 -16.330 7.726 0.959 1.00 0.00 H new ATOM 0 HA ARG A 38 -17.831 9.564 -0.567 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -16.824 8.576 -2.361 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -15.721 8.095 -1.088 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -16.962 5.890 -0.954 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -17.875 6.383 -2.366 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -14.865 6.003 -2.183 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -15.999 4.995 -3.061 1.00 0.00 H new ATOM 0 HE ARG A 38 -16.304 7.604 -4.100 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.825 5.105 -3.857 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.989 5.625 -5.324 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.215 8.273 -5.985 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.771 7.408 -6.522 1.00 0.00 H new ATOM 661 N GLN A 39 -19.257 6.665 0.012 1.00 0.00 N ATOM 662 CA GLN A 39 -20.539 5.965 0.008 1.00 0.00 C ATOM 663 C GLN A 39 -21.543 6.686 0.893 1.00 0.00 C ATOM 664 O GLN A 39 -22.728 6.769 0.571 1.00 0.00 O ATOM 665 CB GLN A 39 -20.359 4.534 0.511 1.00 0.00 C ATOM 666 CG GLN A 39 -19.214 3.799 -0.157 1.00 0.00 C ATOM 667 CD GLN A 39 -19.467 3.491 -1.623 1.00 0.00 C ATOM 668 OE1 GLN A 39 -18.536 3.457 -2.431 1.00 0.00 O ATOM 669 NE2 GLN A 39 -20.719 3.248 -1.976 1.00 0.00 N ATOM 0 H GLN A 39 -18.509 6.164 0.491 1.00 0.00 H new ATOM 0 HA GLN A 39 -20.914 5.946 -1.015 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -20.189 4.554 1.587 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -21.283 3.980 0.345 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -18.308 4.399 -0.071 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.031 2.866 0.376 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.462 3.286 -1.278 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -20.941 3.023 -2.946 1.00 0.00 H new ATOM 678 N ARG A 40 -21.059 7.200 2.010 1.00 0.00 N ATOM 679 CA ARG A 40 -21.884 7.953 2.927 1.00 0.00 C ATOM 680 C ARG A 40 -22.436 9.199 2.256 1.00 0.00 C ATOM 681 O ARG A 40 -23.608 9.533 2.423 1.00 0.00 O ATOM 682 CB ARG A 40 -21.078 8.327 4.166 1.00 0.00 C ATOM 683 CG ARG A 40 -20.922 7.179 5.151 1.00 0.00 C ATOM 684 CD ARG A 40 -20.177 7.607 6.402 1.00 0.00 C ATOM 685 NE ARG A 40 -20.187 6.562 7.424 1.00 0.00 N ATOM 686 CZ ARG A 40 -20.353 6.792 8.729 1.00 0.00 C ATOM 687 NH1 ARG A 40 -20.539 8.027 9.180 1.00 0.00 N ATOM 688 NH2 ARG A 40 -20.346 5.782 9.587 1.00 0.00 N ATOM 0 H ARG A 40 -20.086 7.106 2.303 1.00 0.00 H new ATOM 0 HA ARG A 40 -22.726 7.330 3.229 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -20.090 8.670 3.858 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -21.564 9.164 4.668 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -21.906 6.800 5.426 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -20.387 6.359 4.672 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -19.147 7.854 6.145 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -20.631 8.513 6.804 1.00 0.00 H new ATOM 0 HE ARG A 40 -20.059 5.596 7.121 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -20.556 8.811 8.528 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -20.665 8.192 10.179 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -20.214 4.828 9.251 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.473 5.959 10.584 1.00 0.00 H new ATOM 702 N LEU A 41 -21.598 9.880 1.483 1.00 0.00 N ATOM 703 CA LEU A 41 -22.048 11.059 0.753 1.00 0.00 C ATOM 704 C LEU A 41 -23.072 10.666 -0.304 1.00 0.00 C ATOM 705 O LEU A 41 -23.893 11.481 -0.700 1.00 0.00 O ATOM 706 CB LEU A 41 -20.908 11.802 0.059 1.00 0.00 C ATOM 707 CG LEU A 41 -19.589 11.935 0.821 1.00 0.00 C ATOM 708 CD1 LEU A 41 -18.608 12.751 0.002 1.00 0.00 C ATOM 709 CD2 LEU A 41 -19.781 12.571 2.187 1.00 0.00 C ATOM 0 H LEU A 41 -20.616 9.640 1.346 1.00 0.00 H new ATOM 0 HA LEU A 41 -22.487 11.725 1.496 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -20.702 11.297 -0.885 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -21.259 12.805 -0.185 1.00 0.00 H new ATOM 0 HG LEU A 41 -19.195 10.932 0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -17.669 12.845 0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -18.427 12.253 -0.951 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -19.022 13.743 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -18.818 12.645 2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -20.206 13.568 2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -20.457 11.957 2.782 1.00 0.00 H new ATOM 721 N VAL A 42 -23.009 9.423 -0.775 1.00 0.00 N ATOM 722 CA VAL A 42 -23.995 8.919 -1.726 1.00 0.00 C ATOM 723 C VAL A 42 -25.394 8.993 -1.125 1.00 0.00 C ATOM 724 O VAL A 42 -26.345 9.427 -1.772 1.00 0.00 O ATOM 725 CB VAL A 42 -23.694 7.456 -2.128 1.00 0.00 C ATOM 726 CG1 VAL A 42 -24.811 6.888 -2.983 1.00 0.00 C ATOM 727 CG2 VAL A 42 -22.355 7.351 -2.846 1.00 0.00 C ATOM 0 H VAL A 42 -22.289 8.749 -0.515 1.00 0.00 H new ATOM 0 HA VAL A 42 -23.941 9.545 -2.617 1.00 0.00 H new ATOM 0 HB VAL A 42 -23.633 6.864 -1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -24.575 5.858 -3.252 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -25.746 6.912 -2.423 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -24.915 7.485 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -22.168 6.312 -3.117 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -22.377 7.963 -3.748 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -21.561 7.702 -2.188 1.00 0.00 H new ATOM 737 N GLU A 43 -25.496 8.584 0.129 1.00 0.00 N ATOM 738 CA GLU A 43 -26.761 8.602 0.850 1.00 0.00 C ATOM 739 C GLU A 43 -27.197 10.028 1.180 1.00 0.00 C ATOM 740 O GLU A 43 -28.350 10.267 1.537 1.00 0.00 O ATOM 741 CB GLU A 43 -26.633 7.797 2.142 1.00 0.00 C ATOM 742 CG GLU A 43 -26.244 6.347 1.919 1.00 0.00 C ATOM 743 CD GLU A 43 -26.078 5.588 3.217 1.00 0.00 C ATOM 744 OE1 GLU A 43 -24.933 5.466 3.702 1.00 0.00 O ATOM 745 OE2 GLU A 43 -27.093 5.103 3.760 1.00 0.00 O ATOM 0 H GLU A 43 -24.710 8.232 0.675 1.00 0.00 H new ATOM 0 HA GLU A 43 -27.518 8.154 0.207 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -25.888 8.270 2.782 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -27.582 7.832 2.677 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -27.005 5.859 1.311 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.312 6.306 1.356 1.00 0.00 H new ATOM 752 N ARG A 44 -26.273 10.970 1.077 1.00 0.00 N ATOM 753 CA ARG A 44 -26.560 12.353 1.431 1.00 0.00 C ATOM 754 C ARG A 44 -26.779 13.202 0.184 1.00 0.00 C ATOM 755 O ARG A 44 -27.533 14.172 0.198 1.00 0.00 O ATOM 756 CB ARG A 44 -25.417 12.931 2.265 1.00 0.00 C ATOM 757 CG ARG A 44 -25.027 12.048 3.435 1.00 0.00 C ATOM 758 CD ARG A 44 -24.200 12.786 4.475 1.00 0.00 C ATOM 759 NE ARG A 44 -23.156 13.626 3.887 1.00 0.00 N ATOM 760 CZ ARG A 44 -22.212 14.233 4.607 1.00 0.00 C ATOM 761 NH1 ARG A 44 -22.119 14.009 5.912 1.00 0.00 N ATOM 762 NH2 ARG A 44 -21.351 15.053 4.018 1.00 0.00 N ATOM 0 H ARG A 44 -25.320 10.804 0.752 1.00 0.00 H new ATOM 0 HA ARG A 44 -27.477 12.370 2.021 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -24.548 13.080 1.625 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -25.709 13.912 2.640 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -25.929 11.655 3.905 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -24.461 11.192 3.067 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -24.860 13.407 5.081 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -23.740 12.061 5.146 1.00 0.00 H new ATOM 0 HE ARG A 44 -23.150 13.754 2.875 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -22.771 13.371 6.368 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -21.395 14.475 6.459 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -21.411 15.220 3.013 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -20.629 15.517 4.570 1.00 0.00 H new ATOM 776 N GLY A 45 -26.112 12.814 -0.888 1.00 0.00 N ATOM 777 CA GLY A 45 -26.165 13.555 -2.128 1.00 0.00 C ATOM 778 C GLY A 45 -25.144 14.670 -2.139 1.00 0.00 C ATOM 779 O GLY A 45 -25.479 15.830 -1.918 1.00 0.00 O ATOM 0 H GLY A 45 -25.523 11.982 -0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -25.982 12.882 -2.966 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -27.163 13.970 -2.265 1.00 0.00 H new ATOM 783 N ASP A 46 -23.891 14.312 -2.399 1.00 0.00 N ATOM 784 CA ASP A 46 -22.765 15.248 -2.295 1.00 0.00 C ATOM 785 C ASP A 46 -22.919 16.448 -3.230 1.00 0.00 C ATOM 786 O ASP A 46 -22.369 17.518 -2.970 1.00 0.00 O ATOM 787 CB ASP A 46 -21.449 14.519 -2.587 1.00 0.00 C ATOM 788 CG ASP A 46 -20.227 15.398 -2.394 1.00 0.00 C ATOM 789 OD1 ASP A 46 -19.420 15.517 -3.340 1.00 0.00 O ATOM 790 OD2 ASP A 46 -20.064 15.973 -1.295 1.00 0.00 O ATOM 0 H ASP A 46 -23.623 13.371 -2.687 1.00 0.00 H new ATOM 0 HA ASP A 46 -22.754 15.632 -1.275 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -21.370 13.649 -1.935 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -21.465 14.149 -3.612 1.00 0.00 H new ATOM 795 N ALA A 47 -23.676 16.277 -4.306 1.00 0.00 N ATOM 796 CA ALA A 47 -23.903 17.360 -5.254 1.00 0.00 C ATOM 797 C ALA A 47 -24.698 18.497 -4.611 1.00 0.00 C ATOM 798 O ALA A 47 -24.352 19.669 -4.757 1.00 0.00 O ATOM 799 CB ALA A 47 -24.621 16.841 -6.490 1.00 0.00 C ATOM 0 H ALA A 47 -24.142 15.401 -4.544 1.00 0.00 H new ATOM 0 HA ALA A 47 -22.933 17.756 -5.554 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -24.783 17.662 -7.188 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -24.013 16.073 -6.968 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -25.582 16.416 -6.201 1.00 0.00 H new ATOM 805 N LYS A 48 -25.751 18.143 -3.884 1.00 0.00 N ATOM 806 CA LYS A 48 -26.606 19.138 -3.247 1.00 0.00 C ATOM 807 C LYS A 48 -26.180 19.408 -1.811 1.00 0.00 C ATOM 808 O LYS A 48 -26.440 20.481 -1.265 1.00 0.00 O ATOM 809 CB LYS A 48 -28.069 18.689 -3.272 1.00 0.00 C ATOM 810 CG LYS A 48 -28.770 18.923 -4.602 1.00 0.00 C ATOM 811 CD LYS A 48 -28.861 20.405 -4.938 1.00 0.00 C ATOM 812 CE LYS A 48 -29.629 21.182 -3.881 1.00 0.00 C ATOM 813 NZ LYS A 48 -29.723 22.629 -4.213 1.00 0.00 N ATOM 0 H LYS A 48 -26.033 17.176 -3.721 1.00 0.00 H new ATOM 0 HA LYS A 48 -26.502 20.063 -3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -28.116 17.627 -3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -28.613 19.217 -2.489 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -28.231 18.403 -5.394 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -29.772 18.496 -4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -27.857 20.818 -5.033 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -29.349 20.528 -5.905 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -30.632 20.767 -3.783 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -29.138 21.063 -2.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -30.254 23.122 -3.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -28.767 23.032 -4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -30.214 22.745 -5.122 1.00 0.00 H new ATOM 827 N GLY A 49 -25.531 18.432 -1.205 1.00 0.00 N ATOM 828 CA GLY A 49 -25.136 18.554 0.176 1.00 0.00 C ATOM 829 C GLY A 49 -26.200 18.006 1.098 1.00 0.00 C ATOM 830 O GLY A 49 -27.047 17.224 0.672 1.00 0.00 O ATOM 0 H GLY A 49 -25.269 17.552 -1.649 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -24.200 18.019 0.338 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -24.950 19.602 0.413 1.00 0.00 H new ATOM 834 N THR A 50 -26.164 18.412 2.354 1.00 0.00 N ATOM 835 CA THR A 50 -27.139 17.968 3.325 1.00 0.00 C ATOM 836 C THR A 50 -26.987 18.764 4.617 1.00 0.00 C ATOM 837 O THR A 50 -25.872 19.010 5.083 1.00 0.00 O ATOM 838 CB THR A 50 -27.014 16.453 3.609 1.00 0.00 C ATOM 839 OG1 THR A 50 -28.068 16.020 4.476 1.00 0.00 O ATOM 840 CG2 THR A 50 -25.668 16.116 4.233 1.00 0.00 C ATOM 0 H THR A 50 -25.463 19.054 2.725 1.00 0.00 H new ATOM 0 HA THR A 50 -28.131 18.143 2.908 1.00 0.00 H new ATOM 0 HB THR A 50 -27.092 15.931 2.655 1.00 0.00 H new ATOM 0 HG1 THR A 50 -27.978 15.059 4.646 1.00 0.00 H new ATOM 0 HG21 THR A 50 -25.612 15.044 4.420 1.00 0.00 H new ATOM 0 HG22 THR A 50 -24.868 16.408 3.552 1.00 0.00 H new ATOM 0 HG23 THR A 50 -25.558 16.655 5.174 1.00 0.00 H new ATOM 848 N GLU A 51 -28.105 19.198 5.164 1.00 0.00 N ATOM 849 CA GLU A 51 -28.104 19.942 6.412 1.00 0.00 C ATOM 850 C GLU A 51 -27.870 19.014 7.595 1.00 0.00 C ATOM 851 O GLU A 51 -28.596 18.040 7.788 1.00 0.00 O ATOM 852 CB GLU A 51 -29.423 20.695 6.585 1.00 0.00 C ATOM 853 CG GLU A 51 -29.654 21.752 5.524 1.00 0.00 C ATOM 854 CD GLU A 51 -28.558 22.795 5.508 1.00 0.00 C ATOM 855 OE1 GLU A 51 -28.603 23.720 6.343 1.00 0.00 O ATOM 856 OE2 GLU A 51 -27.645 22.693 4.664 1.00 0.00 O ATOM 0 H GLU A 51 -29.031 19.048 4.763 1.00 0.00 H new ATOM 0 HA GLU A 51 -27.289 20.665 6.376 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -30.246 19.981 6.562 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -29.438 21.167 7.567 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -29.714 21.275 4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -30.613 22.238 5.701 1.00 0.00 H new ATOM 863 N LEU A 52 -26.843 19.317 8.374 1.00 0.00 N ATOM 864 CA LEU A 52 -26.482 18.505 9.523 1.00 0.00 C ATOM 865 C LEU A 52 -26.046 19.384 10.691 1.00 0.00 C ATOM 866 O LEU A 52 -25.268 18.964 11.551 1.00 0.00 O ATOM 867 CB LEU A 52 -25.381 17.512 9.129 1.00 0.00 C ATOM 868 CG LEU A 52 -24.229 18.102 8.305 1.00 0.00 C ATOM 869 CD1 LEU A 52 -23.151 18.694 9.201 1.00 0.00 C ATOM 870 CD2 LEU A 52 -23.644 17.047 7.386 1.00 0.00 C ATOM 0 H LEU A 52 -26.241 20.127 8.228 1.00 0.00 H new ATOM 0 HA LEU A 52 -27.355 17.940 9.849 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -24.968 17.073 10.038 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -25.834 16.700 8.560 1.00 0.00 H new ATOM 0 HG LEU A 52 -24.631 18.912 7.696 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -22.350 19.103 8.585 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.581 19.488 9.812 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -22.749 17.915 9.849 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.828 17.480 6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.266 16.216 7.981 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -24.417 16.686 6.708 1.00 0.00 H new ATOM 882 N ASN A 53 -26.560 20.607 10.723 1.00 0.00 N ATOM 883 CA ASN A 53 -26.232 21.544 11.791 1.00 0.00 C ATOM 884 C ASN A 53 -27.037 21.222 13.037 1.00 0.00 C ATOM 885 O ASN A 53 -28.116 21.774 13.251 1.00 0.00 O ATOM 886 CB ASN A 53 -26.504 22.990 11.367 1.00 0.00 C ATOM 887 CG ASN A 53 -25.500 23.509 10.360 1.00 0.00 C ATOM 888 OD1 ASN A 53 -25.711 23.420 9.149 1.00 0.00 O ATOM 889 ND2 ASN A 53 -24.395 24.052 10.849 1.00 0.00 N ATOM 0 H ASN A 53 -27.205 20.973 10.023 1.00 0.00 H new ATOM 0 HA ASN A 53 -25.168 21.442 12.006 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -27.505 23.056 10.941 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -26.490 23.630 12.249 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -23.682 24.415 10.216 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -24.257 24.107 11.858 1.00 0.00 H new TER 896 ASN A 53 ATOM 897 N GLY B 84 11.571 -6.881 4.578 1.00 0.00 N ATOM 898 CA GLY B 84 11.459 -6.854 3.134 1.00 0.00 C ATOM 899 C GLY B 84 12.091 -8.072 2.487 1.00 0.00 C ATOM 900 O GLY B 84 12.590 -8.959 3.182 1.00 0.00 O ATOM 0 HA2 GLY B 84 10.407 -6.801 2.854 1.00 0.00 H new ATOM 0 HA3 GLY B 84 11.937 -5.952 2.751 1.00 0.00 H new ATOM 904 N PRO B 85 12.098 -8.145 1.150 1.00 0.00 N ATOM 905 CA PRO B 85 12.646 -9.288 0.429 1.00 0.00 C ATOM 906 C PRO B 85 14.170 -9.236 0.331 1.00 0.00 C ATOM 907 O PRO B 85 14.812 -8.397 0.966 1.00 0.00 O ATOM 908 CB PRO B 85 12.005 -9.161 -0.948 1.00 0.00 C ATOM 909 CG PRO B 85 11.864 -7.693 -1.144 1.00 0.00 C ATOM 910 CD PRO B 85 11.579 -7.115 0.224 1.00 0.00 C ATOM 0 HA PRO B 85 12.435 -10.235 0.926 1.00 0.00 H new ATOM 0 HB2 PRO B 85 12.629 -9.609 -1.722 1.00 0.00 H new ATOM 0 HB3 PRO B 85 11.039 -9.664 -0.987 1.00 0.00 H new ATOM 0 HG2 PRO B 85 12.774 -7.267 -1.566 1.00 0.00 H new ATOM 0 HG3 PRO B 85 11.055 -7.468 -1.839 1.00 0.00 H new ATOM 0 HD2 PRO B 85 12.080 -6.158 0.367 1.00 0.00 H new ATOM 0 HD3 PRO B 85 10.513 -6.942 0.373 1.00 0.00 H new ATOM 918 N LEU B 86 14.729 -10.150 -0.450 1.00 0.00 N ATOM 919 CA LEU B 86 16.175 -10.236 -0.661 1.00 0.00 C ATOM 920 C LEU B 86 16.792 -8.877 -1.013 1.00 0.00 C ATOM 921 O LEU B 86 16.329 -8.179 -1.916 1.00 0.00 O ATOM 922 CB LEU B 86 16.538 -11.279 -1.747 1.00 0.00 C ATOM 923 CG LEU B 86 15.487 -11.623 -2.832 1.00 0.00 C ATOM 924 CD1 LEU B 86 14.440 -12.597 -2.301 1.00 0.00 C ATOM 925 CD2 LEU B 86 14.820 -10.375 -3.410 1.00 0.00 C ATOM 0 H LEU B 86 14.195 -10.856 -0.958 1.00 0.00 H new ATOM 0 HA LEU B 86 16.599 -10.564 0.288 1.00 0.00 H new ATOM 0 HB2 LEU B 86 17.435 -10.927 -2.256 1.00 0.00 H new ATOM 0 HB3 LEU B 86 16.803 -12.206 -1.239 1.00 0.00 H new ATOM 0 HG LEU B 86 16.026 -12.108 -3.645 1.00 0.00 H new ATOM 0 HD11 LEU B 86 13.717 -12.818 -3.086 1.00 0.00 H new ATOM 0 HD12 LEU B 86 14.928 -13.520 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU B 86 13.926 -12.150 -1.450 1.00 0.00 H new ATOM 0 HD21 LEU B 86 14.092 -10.669 -4.166 1.00 0.00 H new ATOM 0 HD22 LEU B 86 14.315 -9.830 -2.612 1.00 0.00 H new ATOM 0 HD23 LEU B 86 15.577 -9.735 -3.864 1.00 0.00 H new ATOM 937 N GLY B 87 17.836 -8.506 -0.283 1.00 0.00 N ATOM 938 CA GLY B 87 18.495 -7.237 -0.522 1.00 0.00 C ATOM 939 C GLY B 87 19.791 -7.392 -1.293 1.00 0.00 C ATOM 940 O GLY B 87 20.363 -6.412 -1.763 1.00 0.00 O ATOM 0 H GLY B 87 18.239 -9.062 0.471 1.00 0.00 H new ATOM 0 HA2 GLY B 87 17.823 -6.581 -1.075 1.00 0.00 H new ATOM 0 HA3 GLY B 87 18.700 -6.752 0.433 1.00 0.00 H new ATOM 944 N SER B 88 20.259 -8.624 -1.417 1.00 0.00 N ATOM 945 CA SER B 88 21.499 -8.909 -2.125 1.00 0.00 C ATOM 946 C SER B 88 21.212 -9.636 -3.437 1.00 0.00 C ATOM 947 O SER B 88 22.092 -10.290 -4.004 1.00 0.00 O ATOM 948 CB SER B 88 22.425 -9.745 -1.240 1.00 0.00 C ATOM 949 OG SER B 88 22.672 -9.096 0.000 1.00 0.00 O ATOM 0 H SER B 88 19.796 -9.448 -1.034 1.00 0.00 H new ATOM 0 HA SER B 88 21.994 -7.967 -2.359 1.00 0.00 H new ATOM 0 HB2 SER B 88 21.976 -10.722 -1.060 1.00 0.00 H new ATOM 0 HB3 SER B 88 23.369 -9.918 -1.757 1.00 0.00 H new ATOM 0 HG SER B 88 23.265 -9.652 0.548 1.00 0.00 H new ATOM 955 N ARG B 89 19.966 -9.519 -3.898 1.00 0.00 N ATOM 956 CA ARG B 89 19.498 -10.197 -5.103 1.00 0.00 C ATOM 957 C ARG B 89 20.421 -9.930 -6.286 1.00 0.00 C ATOM 958 O ARG B 89 21.032 -10.846 -6.832 1.00 0.00 O ATOM 959 CB ARG B 89 18.078 -9.734 -5.441 1.00 0.00 C ATOM 960 CG ARG B 89 17.502 -10.368 -6.697 1.00 0.00 C ATOM 961 CD ARG B 89 16.144 -9.779 -7.038 1.00 0.00 C ATOM 962 NE ARG B 89 15.559 -10.395 -8.228 1.00 0.00 N ATOM 963 CZ ARG B 89 14.321 -10.154 -8.661 1.00 0.00 C ATOM 964 NH1 ARG B 89 13.547 -9.283 -8.024 1.00 0.00 N ATOM 965 NH2 ARG B 89 13.857 -10.780 -9.734 1.00 0.00 N ATOM 0 H ARG B 89 19.253 -8.949 -3.443 1.00 0.00 H new ATOM 0 HA ARG B 89 19.499 -11.269 -4.908 1.00 0.00 H new ATOM 0 HB2 ARG B 89 17.423 -9.960 -4.599 1.00 0.00 H new ATOM 0 HB3 ARG B 89 18.079 -8.651 -5.561 1.00 0.00 H new ATOM 0 HG2 ARG B 89 18.187 -10.216 -7.531 1.00 0.00 H new ATOM 0 HG3 ARG B 89 17.409 -11.445 -6.554 1.00 0.00 H new ATOM 0 HD2 ARG B 89 15.469 -9.912 -6.193 1.00 0.00 H new ATOM 0 HD3 ARG B 89 16.245 -8.706 -7.199 1.00 0.00 H new ATOM 0 HE ARG B 89 16.133 -11.049 -8.760 1.00 0.00 H new ATOM 0 HH11 ARG B 89 13.899 -8.795 -7.200 1.00 0.00 H new ATOM 0 HH12 ARG B 89 12.601 -9.102 -8.359 1.00 0.00 H new ATOM 0 HH21 ARG B 89 14.447 -11.448 -10.230 1.00 0.00 H new ATOM 0 HH22 ARG B 89 12.910 -10.594 -10.063 1.00 0.00 H new ATOM 979 N ARG B 90 20.526 -8.669 -6.669 1.00 0.00 N ATOM 980 CA ARG B 90 21.364 -8.278 -7.789 1.00 0.00 C ATOM 981 C ARG B 90 22.725 -7.813 -7.288 1.00 0.00 C ATOM 982 O ARG B 90 23.277 -6.818 -7.768 1.00 0.00 O ATOM 983 CB ARG B 90 20.679 -7.167 -8.577 1.00 0.00 C ATOM 984 CG ARG B 90 19.332 -7.569 -9.150 1.00 0.00 C ATOM 985 CD ARG B 90 18.515 -6.351 -9.540 1.00 0.00 C ATOM 986 NE ARG B 90 18.145 -5.551 -8.374 1.00 0.00 N ATOM 987 CZ ARG B 90 17.542 -4.367 -8.447 1.00 0.00 C ATOM 988 NH1 ARG B 90 17.301 -3.812 -9.631 1.00 0.00 N ATOM 989 NH2 ARG B 90 17.188 -3.738 -7.335 1.00 0.00 N ATOM 0 H ARG B 90 20.038 -7.895 -6.218 1.00 0.00 H new ATOM 0 HA ARG B 90 21.513 -9.137 -8.444 1.00 0.00 H new ATOM 0 HB2 ARG B 90 20.544 -6.302 -7.927 1.00 0.00 H new ATOM 0 HB3 ARG B 90 21.332 -6.855 -9.392 1.00 0.00 H new ATOM 0 HG2 ARG B 90 19.480 -8.205 -10.023 1.00 0.00 H new ATOM 0 HG3 ARG B 90 18.783 -8.158 -8.416 1.00 0.00 H new ATOM 0 HD2 ARG B 90 19.087 -5.737 -10.236 1.00 0.00 H new ATOM 0 HD3 ARG B 90 17.614 -6.670 -10.063 1.00 0.00 H new ATOM 0 HE ARG B 90 18.362 -5.922 -7.449 1.00 0.00 H new ATOM 0 HH11 ARG B 90 17.578 -4.294 -10.486 1.00 0.00 H new ATOM 0 HH12 ARG B 90 16.839 -2.904 -9.684 1.00 0.00 H new ATOM 0 HH21 ARG B 90 17.378 -4.162 -6.427 1.00 0.00 H new ATOM 0 HH22 ARG B 90 16.726 -2.830 -7.388 1.00 0.00 H new ATOM 1003 N PHE B 91 23.246 -8.550 -6.309 1.00 0.00 N ATOM 1004 CA PHE B 91 24.533 -8.251 -5.687 1.00 0.00 C ATOM 1005 C PHE B 91 24.489 -6.913 -4.954 1.00 0.00 C ATOM 1006 O PHE B 91 23.420 -6.316 -4.797 1.00 0.00 O ATOM 1007 CB PHE B 91 25.664 -8.259 -6.724 1.00 0.00 C ATOM 1008 CG PHE B 91 25.827 -9.576 -7.429 1.00 0.00 C ATOM 1009 CD1 PHE B 91 26.469 -10.635 -6.807 1.00 0.00 C ATOM 1010 CD2 PHE B 91 25.339 -9.755 -8.714 1.00 0.00 C ATOM 1011 CE1 PHE B 91 26.621 -11.846 -7.452 1.00 0.00 C ATOM 1012 CE2 PHE B 91 25.490 -10.964 -9.364 1.00 0.00 C ATOM 1013 CZ PHE B 91 26.131 -12.010 -8.732 1.00 0.00 C ATOM 0 H PHE B 91 22.785 -9.374 -5.924 1.00 0.00 H new ATOM 0 HA PHE B 91 24.736 -9.034 -4.957 1.00 0.00 H new ATOM 0 HB2 PHE B 91 25.472 -7.482 -7.464 1.00 0.00 H new ATOM 0 HB3 PHE B 91 26.601 -8.003 -6.229 1.00 0.00 H new ATOM 0 HD1 PHE B 91 26.855 -10.511 -5.806 1.00 0.00 H new ATOM 0 HD2 PHE B 91 24.835 -8.940 -9.212 1.00 0.00 H new ATOM 0 HE1 PHE B 91 27.122 -12.664 -6.956 1.00 0.00 H new ATOM 0 HE2 PHE B 91 25.107 -11.091 -10.366 1.00 0.00 H new ATOM 0 HZ PHE B 91 26.249 -12.956 -9.239 1.00 0.00 H new ATOM 1023 N VAL B 92 25.640 -6.445 -4.502 1.00 0.00 N ATOM 1024 CA VAL B 92 25.705 -5.192 -3.769 1.00 0.00 C ATOM 1025 C VAL B 92 25.541 -4.012 -4.714 1.00 0.00 C ATOM 1026 O VAL B 92 24.819 -3.068 -4.414 1.00 0.00 O ATOM 1027 CB VAL B 92 27.038 -5.046 -3.002 1.00 0.00 C ATOM 1028 CG1 VAL B 92 27.034 -3.791 -2.140 1.00 0.00 C ATOM 1029 CG2 VAL B 92 27.302 -6.278 -2.154 1.00 0.00 C ATOM 0 H VAL B 92 26.538 -6.911 -4.629 1.00 0.00 H new ATOM 0 HA VAL B 92 24.889 -5.201 -3.046 1.00 0.00 H new ATOM 0 HB VAL B 92 27.842 -4.951 -3.732 1.00 0.00 H new ATOM 0 HG11 VAL B 92 27.983 -3.711 -1.610 1.00 0.00 H new ATOM 0 HG12 VAL B 92 26.897 -2.915 -2.774 1.00 0.00 H new ATOM 0 HG13 VAL B 92 26.219 -3.848 -1.418 1.00 0.00 H new ATOM 0 HG21 VAL B 92 28.245 -6.158 -1.621 1.00 0.00 H new ATOM 0 HG22 VAL B 92 26.493 -6.405 -1.435 1.00 0.00 H new ATOM 0 HG23 VAL B 92 27.358 -7.157 -2.796 1.00 0.00 H new ATOM 1039 N VAL B 93 26.196 -4.090 -5.870 1.00 0.00 N ATOM 1040 CA VAL B 93 26.213 -2.991 -6.835 1.00 0.00 C ATOM 1041 C VAL B 93 24.806 -2.469 -7.132 1.00 0.00 C ATOM 1042 O VAL B 93 24.494 -1.302 -6.866 1.00 0.00 O ATOM 1043 CB VAL B 93 26.878 -3.418 -8.158 1.00 0.00 C ATOM 1044 CG1 VAL B 93 26.987 -2.239 -9.112 1.00 0.00 C ATOM 1045 CG2 VAL B 93 28.248 -4.028 -7.904 1.00 0.00 C ATOM 0 H VAL B 93 26.727 -4.910 -6.164 1.00 0.00 H new ATOM 0 HA VAL B 93 26.795 -2.191 -6.378 1.00 0.00 H new ATOM 0 HB VAL B 93 26.248 -4.177 -8.622 1.00 0.00 H new ATOM 0 HG11 VAL B 93 27.459 -2.564 -10.039 1.00 0.00 H new ATOM 0 HG12 VAL B 93 25.991 -1.853 -9.328 1.00 0.00 H new ATOM 0 HG13 VAL B 93 27.589 -1.454 -8.654 1.00 0.00 H new ATOM 0 HG21 VAL B 93 28.697 -4.321 -8.853 1.00 0.00 H new ATOM 0 HG22 VAL B 93 28.887 -3.295 -7.411 1.00 0.00 H new ATOM 0 HG23 VAL B 93 28.143 -4.905 -7.266 1.00 0.00 H new ATOM 1055 N ASP B 94 23.956 -3.340 -7.659 1.00 0.00 N ATOM 1056 CA ASP B 94 22.616 -2.957 -8.060 1.00 0.00 C ATOM 1057 C ASP B 94 21.752 -2.604 -6.862 1.00 0.00 C ATOM 1058 O ASP B 94 21.379 -1.447 -6.685 1.00 0.00 O ATOM 1059 CB ASP B 94 21.962 -4.090 -8.841 1.00 0.00 C ATOM 1060 CG ASP B 94 22.193 -3.997 -10.334 1.00 0.00 C ATOM 1061 OD1 ASP B 94 23.249 -4.465 -10.808 1.00 0.00 O ATOM 1062 OD2 ASP B 94 21.307 -3.477 -11.045 1.00 0.00 O ATOM 0 H ASP B 94 24.177 -4.323 -7.818 1.00 0.00 H new ATOM 0 HA ASP B 94 22.701 -2.072 -8.691 1.00 0.00 H new ATOM 0 HB2 ASP B 94 22.349 -5.043 -8.479 1.00 0.00 H new ATOM 0 HB3 ASP B 94 20.890 -4.086 -8.645 1.00 0.00 H new ATOM 1067 N ASP B 95 21.472 -3.594 -6.020 1.00 0.00 N ATOM 1068 CA ASP B 95 20.479 -3.443 -4.956 1.00 0.00 C ATOM 1069 C ASP B 95 20.920 -2.496 -3.849 1.00 0.00 C ATOM 1070 O ASP B 95 20.164 -2.251 -2.917 1.00 0.00 O ATOM 1071 CB ASP B 95 20.083 -4.789 -4.353 1.00 0.00 C ATOM 1072 CG ASP B 95 18.957 -5.454 -5.118 1.00 0.00 C ATOM 1073 OD1 ASP B 95 19.215 -6.416 -5.864 1.00 0.00 O ATOM 1074 OD2 ASP B 95 17.795 -5.004 -4.983 1.00 0.00 O ATOM 0 H ASP B 95 21.918 -4.511 -6.052 1.00 0.00 H new ATOM 0 HA ASP B 95 19.610 -2.999 -5.440 1.00 0.00 H new ATOM 0 HB2 ASP B 95 20.951 -5.449 -4.342 1.00 0.00 H new ATOM 0 HB3 ASP B 95 19.779 -4.645 -3.316 1.00 0.00 H new ATOM 1079 N ARG B 96 22.130 -1.975 -3.916 1.00 0.00 N ATOM 1080 CA ARG B 96 22.508 -0.924 -2.989 1.00 0.00 C ATOM 1081 C ARG B 96 21.883 0.375 -3.462 1.00 0.00 C ATOM 1082 O ARG B 96 21.068 0.977 -2.765 1.00 0.00 O ATOM 1083 CB ARG B 96 24.028 -0.768 -2.884 1.00 0.00 C ATOM 1084 CG ARG B 96 24.498 -0.294 -1.517 1.00 0.00 C ATOM 1085 CD ARG B 96 23.947 1.080 -1.162 1.00 0.00 C ATOM 1086 NE ARG B 96 24.009 1.326 0.275 1.00 0.00 N ATOM 1087 CZ ARG B 96 24.239 2.513 0.829 1.00 0.00 C ATOM 1088 NH1 ARG B 96 24.403 3.594 0.074 1.00 0.00 N ATOM 1089 NH2 ARG B 96 24.289 2.615 2.148 1.00 0.00 N ATOM 0 H ARG B 96 22.851 -2.252 -4.582 1.00 0.00 H new ATOM 0 HA ARG B 96 22.147 -1.188 -1.995 1.00 0.00 H new ATOM 0 HB2 ARG B 96 24.500 -1.724 -3.110 1.00 0.00 H new ATOM 0 HB3 ARG B 96 24.365 -0.060 -3.641 1.00 0.00 H new ATOM 0 HG2 ARG B 96 24.189 -1.014 -0.759 1.00 0.00 H new ATOM 0 HG3 ARG B 96 25.587 -0.262 -1.501 1.00 0.00 H new ATOM 0 HD2 ARG B 96 24.514 1.848 -1.688 1.00 0.00 H new ATOM 0 HD3 ARG B 96 22.914 1.158 -1.501 1.00 0.00 H new ATOM 0 HE ARG B 96 23.866 0.532 0.899 1.00 0.00 H new ATOM 0 HH11 ARG B 96 24.353 3.519 -0.942 1.00 0.00 H new ATOM 0 HH12 ARG B 96 24.579 4.499 0.510 1.00 0.00 H new ATOM 0 HH21 ARG B 96 24.152 1.788 2.729 1.00 0.00 H new ATOM 0 HH22 ARG B 96 24.465 3.521 2.583 1.00 0.00 H new ATOM 1103 N ARG B 97 22.245 0.777 -4.674 1.00 0.00 N ATOM 1104 CA ARG B 97 21.746 2.015 -5.250 1.00 0.00 C ATOM 1105 C ARG B 97 20.270 1.881 -5.619 1.00 0.00 C ATOM 1106 O ARG B 97 19.451 2.720 -5.255 1.00 0.00 O ATOM 1107 CB ARG B 97 22.592 2.396 -6.474 1.00 0.00 C ATOM 1108 CG ARG B 97 22.057 3.579 -7.268 1.00 0.00 C ATOM 1109 CD ARG B 97 21.114 3.129 -8.375 1.00 0.00 C ATOM 1110 NE ARG B 97 20.441 4.259 -9.010 1.00 0.00 N ATOM 1111 CZ ARG B 97 19.702 4.164 -10.111 1.00 0.00 C ATOM 1112 NH1 ARG B 97 19.541 2.990 -10.709 1.00 0.00 N ATOM 1113 NH2 ARG B 97 19.130 5.250 -10.619 1.00 0.00 N ATOM 0 H ARG B 97 22.885 0.260 -5.277 1.00 0.00 H new ATOM 0 HA ARG B 97 21.829 2.811 -4.510 1.00 0.00 H new ATOM 0 HB2 ARG B 97 23.605 2.625 -6.143 1.00 0.00 H new ATOM 0 HB3 ARG B 97 22.661 1.532 -7.135 1.00 0.00 H new ATOM 0 HG2 ARG B 97 21.534 4.261 -6.598 1.00 0.00 H new ATOM 0 HG3 ARG B 97 22.889 4.134 -7.701 1.00 0.00 H new ATOM 0 HD2 ARG B 97 21.675 2.572 -9.126 1.00 0.00 H new ATOM 0 HD3 ARG B 97 20.369 2.448 -7.963 1.00 0.00 H new ATOM 0 HE ARG B 97 20.544 5.179 -8.582 1.00 0.00 H new ATOM 0 HH11 ARG B 97 19.985 2.156 -10.324 1.00 0.00 H new ATOM 0 HH12 ARG B 97 18.973 2.921 -11.554 1.00 0.00 H new ATOM 0 HH21 ARG B 97 19.258 6.154 -10.164 1.00 0.00 H new ATOM 0 HH22 ARG B 97 18.563 5.180 -11.464 1.00 0.00 H new ATOM 1127 N GLU B 98 19.949 0.809 -6.328 1.00 0.00 N ATOM 1128 CA GLU B 98 18.595 0.561 -6.813 1.00 0.00 C ATOM 1129 C GLU B 98 17.576 0.564 -5.685 1.00 0.00 C ATOM 1130 O GLU B 98 16.503 1.157 -5.807 1.00 0.00 O ATOM 1131 CB GLU B 98 18.551 -0.782 -7.527 1.00 0.00 C ATOM 1132 CG GLU B 98 18.865 -0.707 -9.009 1.00 0.00 C ATOM 1133 CD GLU B 98 17.674 -0.245 -9.821 1.00 0.00 C ATOM 1134 OE1 GLU B 98 17.024 -1.100 -10.461 1.00 0.00 O ATOM 1135 OE2 GLU B 98 17.366 0.964 -9.803 1.00 0.00 O ATOM 0 H GLU B 98 20.619 0.084 -6.585 1.00 0.00 H new ATOM 0 HA GLU B 98 18.336 1.367 -7.499 1.00 0.00 H new ATOM 0 HB2 GLU B 98 19.261 -1.458 -7.050 1.00 0.00 H new ATOM 0 HB3 GLU B 98 17.560 -1.217 -7.398 1.00 0.00 H new ATOM 0 HG2 GLU B 98 19.699 -0.023 -9.168 1.00 0.00 H new ATOM 0 HG3 GLU B 98 19.185 -1.688 -9.361 1.00 0.00 H new ATOM 1142 N LEU B 99 17.918 -0.094 -4.590 1.00 0.00 N ATOM 1143 CA LEU B 99 17.002 -0.239 -3.476 1.00 0.00 C ATOM 1144 C LEU B 99 16.751 1.110 -2.809 1.00 0.00 C ATOM 1145 O LEU B 99 15.611 1.541 -2.711 1.00 0.00 O ATOM 1146 CB LEU B 99 17.551 -1.270 -2.488 1.00 0.00 C ATOM 1147 CG LEU B 99 16.640 -1.672 -1.320 1.00 0.00 C ATOM 1148 CD1 LEU B 99 16.758 -0.678 -0.182 1.00 0.00 C ATOM 1149 CD2 LEU B 99 15.193 -1.795 -1.772 1.00 0.00 C ATOM 0 H LEU B 99 18.826 -0.537 -4.451 1.00 0.00 H new ATOM 0 HA LEU B 99 16.041 -0.600 -3.842 1.00 0.00 H new ATOM 0 HB2 LEU B 99 17.804 -2.172 -3.046 1.00 0.00 H new ATOM 0 HB3 LEU B 99 18.481 -0.880 -2.073 1.00 0.00 H new ATOM 0 HG LEU B 99 16.967 -2.648 -0.962 1.00 0.00 H new ATOM 0 HD11 LEU B 99 16.104 -0.982 0.636 1.00 0.00 H new ATOM 0 HD12 LEU B 99 17.789 -0.648 0.170 1.00 0.00 H new ATOM 0 HD13 LEU B 99 16.466 0.312 -0.532 1.00 0.00 H new ATOM 0 HD21 LEU B 99 14.570 -2.081 -0.924 1.00 0.00 H new ATOM 0 HD22 LEU B 99 14.852 -0.838 -2.166 1.00 0.00 H new ATOM 0 HD23 LEU B 99 15.118 -2.555 -2.550 1.00 0.00 H new ATOM 1161 N GLN B 100 17.806 1.795 -2.381 1.00 0.00 N ATOM 1162 CA GLN B 100 17.628 3.084 -1.714 1.00 0.00 C ATOM 1163 C GLN B 100 16.962 4.088 -2.652 1.00 0.00 C ATOM 1164 O GLN B 100 16.222 4.969 -2.212 1.00 0.00 O ATOM 1165 CB GLN B 100 18.959 3.642 -1.208 1.00 0.00 C ATOM 1166 CG GLN B 100 20.008 3.840 -2.290 1.00 0.00 C ATOM 1167 CD GLN B 100 21.254 4.538 -1.777 1.00 0.00 C ATOM 1168 OE1 GLN B 100 22.361 4.275 -2.243 1.00 0.00 O ATOM 1169 NE2 GLN B 100 21.081 5.454 -0.834 1.00 0.00 N ATOM 0 H GLN B 100 18.774 1.490 -2.480 1.00 0.00 H new ATOM 0 HA GLN B 100 16.981 2.920 -0.853 1.00 0.00 H new ATOM 0 HB2 GLN B 100 18.775 4.598 -0.717 1.00 0.00 H new ATOM 0 HB3 GLN B 100 19.358 2.967 -0.451 1.00 0.00 H new ATOM 0 HG2 GLN B 100 20.284 2.870 -2.704 1.00 0.00 H new ATOM 0 HG3 GLN B 100 19.579 4.424 -3.104 1.00 0.00 H new ATOM 0 HE21 GLN B 100 20.146 5.644 -0.473 1.00 0.00 H new ATOM 0 HE22 GLN B 100 21.883 5.969 -0.470 1.00 0.00 H new ATOM 1178 N TYR B 101 17.222 3.939 -3.944 1.00 0.00 N ATOM 1179 CA TYR B 101 16.640 4.812 -4.951 1.00 0.00 C ATOM 1180 C TYR B 101 15.131 4.602 -5.052 1.00 0.00 C ATOM 1181 O TYR B 101 14.384 5.558 -5.242 1.00 0.00 O ATOM 1182 CB TYR B 101 17.294 4.575 -6.316 1.00 0.00 C ATOM 1183 CG TYR B 101 16.874 5.568 -7.378 1.00 0.00 C ATOM 1184 CD1 TYR B 101 17.404 6.852 -7.399 1.00 0.00 C ATOM 1185 CD2 TYR B 101 15.951 5.223 -8.359 1.00 0.00 C ATOM 1186 CE1 TYR B 101 17.028 7.763 -8.366 1.00 0.00 C ATOM 1187 CE2 TYR B 101 15.571 6.131 -9.330 1.00 0.00 C ATOM 1188 CZ TYR B 101 16.112 7.399 -9.329 1.00 0.00 C ATOM 1189 OH TYR B 101 15.740 8.307 -10.295 1.00 0.00 O ATOM 0 H TYR B 101 17.836 3.217 -4.320 1.00 0.00 H new ATOM 0 HA TYR B 101 16.826 5.842 -4.646 1.00 0.00 H new ATOM 0 HB2 TYR B 101 18.377 4.617 -6.201 1.00 0.00 H new ATOM 0 HB3 TYR B 101 17.048 3.569 -6.656 1.00 0.00 H new ATOM 0 HD1 TYR B 101 18.122 7.142 -6.646 1.00 0.00 H new ATOM 0 HD2 TYR B 101 15.524 4.231 -8.363 1.00 0.00 H new ATOM 0 HE1 TYR B 101 17.450 8.757 -8.368 1.00 0.00 H new ATOM 0 HE2 TYR B 101 14.853 5.848 -10.086 1.00 0.00 H new ATOM 0 HH TYR B 101 15.088 7.894 -10.899 1.00 0.00 H new ATOM 1199 N ARG B 102 14.680 3.355 -4.918 1.00 0.00 N ATOM 1200 CA ARG B 102 13.256 3.055 -5.051 1.00 0.00 C ATOM 1201 C ARG B 102 12.494 3.459 -3.795 1.00 0.00 C ATOM 1202 O ARG B 102 11.305 3.749 -3.857 1.00 0.00 O ATOM 1203 CB ARG B 102 13.016 1.569 -5.375 1.00 0.00 C ATOM 1204 CG ARG B 102 13.328 0.613 -4.236 1.00 0.00 C ATOM 1205 CD ARG B 102 13.183 -0.838 -4.663 1.00 0.00 C ATOM 1206 NE ARG B 102 11.800 -1.197 -4.974 1.00 0.00 N ATOM 1207 CZ ARG B 102 11.438 -2.360 -5.520 1.00 0.00 C ATOM 1208 NH1 ARG B 102 12.354 -3.272 -5.823 1.00 0.00 N ATOM 1209 NH2 ARG B 102 10.158 -2.613 -5.753 1.00 0.00 N ATOM 0 H ARG B 102 15.271 2.547 -4.720 1.00 0.00 H new ATOM 0 HA ARG B 102 12.878 3.642 -5.888 1.00 0.00 H new ATOM 0 HB2 ARG B 102 11.974 1.438 -5.666 1.00 0.00 H new ATOM 0 HB3 ARG B 102 13.624 1.296 -6.237 1.00 0.00 H new ATOM 0 HG2 ARG B 102 14.344 0.788 -3.882 1.00 0.00 H new ATOM 0 HG3 ARG B 102 12.660 0.814 -3.399 1.00 0.00 H new ATOM 0 HD2 ARG B 102 13.807 -1.020 -5.538 1.00 0.00 H new ATOM 0 HD3 ARG B 102 13.553 -1.486 -3.868 1.00 0.00 H new ATOM 0 HE ARG B 102 11.069 -0.519 -4.761 1.00 0.00 H new ATOM 0 HH11 ARG B 102 13.340 -3.086 -5.639 1.00 0.00 H new ATOM 0 HH12 ARG B 102 12.072 -4.159 -6.240 1.00 0.00 H new ATOM 0 HH21 ARG B 102 9.449 -1.919 -5.515 1.00 0.00 H new ATOM 0 HH22 ARG B 102 9.882 -3.502 -6.170 1.00 0.00 H new ATOM 1223 N VAL B 103 13.182 3.512 -2.664 1.00 0.00 N ATOM 1224 CA VAL B 103 12.540 3.883 -1.407 1.00 0.00 C ATOM 1225 C VAL B 103 12.141 5.362 -1.429 1.00 0.00 C ATOM 1226 O VAL B 103 11.031 5.717 -1.038 1.00 0.00 O ATOM 1227 CB VAL B 103 13.460 3.604 -0.197 1.00 0.00 C ATOM 1228 CG1 VAL B 103 12.717 3.724 1.116 1.00 0.00 C ATOM 1229 CG2 VAL B 103 14.102 2.235 -0.291 1.00 0.00 C ATOM 0 H VAL B 103 14.178 3.305 -2.588 1.00 0.00 H new ATOM 0 HA VAL B 103 11.645 3.270 -1.300 1.00 0.00 H new ATOM 0 HB VAL B 103 14.241 4.363 -0.224 1.00 0.00 H new ATOM 0 HG11 VAL B 103 13.400 3.520 1.941 1.00 0.00 H new ATOM 0 HG12 VAL B 103 12.317 4.733 1.217 1.00 0.00 H new ATOM 0 HG13 VAL B 103 11.898 3.005 1.137 1.00 0.00 H new ATOM 0 HG21 VAL B 103 14.742 2.073 0.576 1.00 0.00 H new ATOM 0 HG22 VAL B 103 13.326 1.470 -0.317 1.00 0.00 H new ATOM 0 HG23 VAL B 103 14.701 2.176 -1.200 1.00 0.00 H new ATOM 1239 N GLU B 104 13.043 6.224 -1.904 1.00 0.00 N ATOM 1240 CA GLU B 104 12.743 7.655 -2.009 1.00 0.00 C ATOM 1241 C GLU B 104 11.641 7.953 -3.026 1.00 0.00 C ATOM 1242 O GLU B 104 10.801 8.812 -2.776 1.00 0.00 O ATOM 1243 CB GLU B 104 13.987 8.486 -2.329 1.00 0.00 C ATOM 1244 CG GLU B 104 14.914 7.839 -3.327 1.00 0.00 C ATOM 1245 CD GLU B 104 15.915 8.815 -3.911 1.00 0.00 C ATOM 1246 OE1 GLU B 104 15.555 9.537 -4.865 1.00 0.00 O ATOM 1247 OE2 GLU B 104 17.061 8.866 -3.421 1.00 0.00 O ATOM 0 H GLU B 104 13.977 5.961 -2.219 1.00 0.00 H new ATOM 0 HA GLU B 104 12.379 7.947 -1.024 1.00 0.00 H new ATOM 0 HB2 GLU B 104 13.674 9.456 -2.714 1.00 0.00 H new ATOM 0 HB3 GLU B 104 14.536 8.671 -1.405 1.00 0.00 H new ATOM 0 HG2 GLU B 104 15.449 7.022 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU B 104 14.325 7.402 -4.134 1.00 0.00 H new ATOM 1254 N VAL B 105 11.630 7.270 -4.174 1.00 0.00 N ATOM 1255 CA VAL B 105 10.534 7.465 -5.123 1.00 0.00 C ATOM 1256 C VAL B 105 9.228 7.023 -4.489 1.00 0.00 C ATOM 1257 O VAL B 105 8.219 7.697 -4.619 1.00 0.00 O ATOM 1258 CB VAL B 105 10.750 6.762 -6.496 1.00 0.00 C ATOM 1259 CG1 VAL B 105 11.594 5.518 -6.365 1.00 0.00 C ATOM 1260 CG2 VAL B 105 9.432 6.406 -7.158 1.00 0.00 C ATOM 0 H VAL B 105 12.342 6.599 -4.462 1.00 0.00 H new ATOM 0 HA VAL B 105 10.501 8.531 -5.348 1.00 0.00 H new ATOM 0 HB VAL B 105 11.279 7.479 -7.124 1.00 0.00 H new ATOM 0 HG11 VAL B 105 11.720 5.059 -7.346 1.00 0.00 H new ATOM 0 HG12 VAL B 105 12.571 5.782 -5.960 1.00 0.00 H new ATOM 0 HG13 VAL B 105 11.102 4.813 -5.695 1.00 0.00 H new ATOM 0 HG21 VAL B 105 9.625 5.917 -8.113 1.00 0.00 H new ATOM 0 HG22 VAL B 105 8.871 5.731 -6.512 1.00 0.00 H new ATOM 0 HG23 VAL B 105 8.852 7.314 -7.325 1.00 0.00 H new ATOM 1270 N GLN B 106 9.266 5.921 -3.758 1.00 0.00 N ATOM 1271 CA GLN B 106 8.098 5.462 -3.024 1.00 0.00 C ATOM 1272 C GLN B 106 7.652 6.517 -2.008 1.00 0.00 C ATOM 1273 O GLN B 106 6.466 6.821 -1.899 1.00 0.00 O ATOM 1274 CB GLN B 106 8.413 4.136 -2.334 1.00 0.00 C ATOM 1275 CG GLN B 106 8.540 2.968 -3.294 1.00 0.00 C ATOM 1276 CD GLN B 106 7.237 2.632 -3.988 1.00 0.00 C ATOM 1277 OE1 GLN B 106 6.460 1.815 -3.503 1.00 0.00 O ATOM 1278 NE2 GLN B 106 6.983 3.263 -5.124 1.00 0.00 N ATOM 0 H GLN B 106 10.090 5.329 -3.657 1.00 0.00 H new ATOM 0 HA GLN B 106 7.276 5.306 -3.723 1.00 0.00 H new ATOM 0 HB2 GLN B 106 9.343 4.239 -1.775 1.00 0.00 H new ATOM 0 HB3 GLN B 106 7.628 3.917 -1.610 1.00 0.00 H new ATOM 0 HG2 GLN B 106 9.296 3.201 -4.044 1.00 0.00 H new ATOM 0 HG3 GLN B 106 8.892 2.092 -2.748 1.00 0.00 H new ATOM 0 HE21 GLN B 106 7.654 3.935 -5.495 1.00 0.00 H new ATOM 0 HE22 GLN B 106 6.116 3.077 -5.628 1.00 0.00 H new ATOM 1287 N ASN B 107 8.620 7.089 -1.293 1.00 0.00 N ATOM 1288 CA ASN B 107 8.362 8.175 -0.341 1.00 0.00 C ATOM 1289 C ASN B 107 7.719 9.378 -1.044 1.00 0.00 C ATOM 1290 O ASN B 107 6.896 10.085 -0.467 1.00 0.00 O ATOM 1291 CB ASN B 107 9.673 8.604 0.327 1.00 0.00 C ATOM 1292 CG ASN B 107 9.472 9.669 1.390 1.00 0.00 C ATOM 1293 OD1 ASN B 107 8.425 9.737 2.038 1.00 0.00 O ATOM 1294 ND2 ASN B 107 10.472 10.516 1.576 1.00 0.00 N ATOM 0 H ASN B 107 9.601 6.816 -1.355 1.00 0.00 H new ATOM 0 HA ASN B 107 7.670 7.809 0.418 1.00 0.00 H new ATOM 0 HB2 ASN B 107 10.148 7.732 0.778 1.00 0.00 H new ATOM 0 HB3 ASN B 107 10.356 8.981 -0.434 1.00 0.00 H new ATOM 0 HD21 ASN B 107 10.391 11.255 2.274 1.00 0.00 H new ATOM 0 HD22 ASN B 107 11.324 10.429 1.021 1.00 0.00 H new ATOM 1301 N ARG B 108 8.095 9.601 -2.296 1.00 0.00 N ATOM 1302 CA ARG B 108 7.573 10.720 -3.070 1.00 0.00 C ATOM 1303 C ARG B 108 6.196 10.405 -3.655 1.00 0.00 C ATOM 1304 O ARG B 108 5.255 11.182 -3.503 1.00 0.00 O ATOM 1305 CB ARG B 108 8.549 11.078 -4.191 1.00 0.00 C ATOM 1306 CG ARG B 108 9.858 11.667 -3.688 1.00 0.00 C ATOM 1307 CD ARG B 108 10.784 12.052 -4.832 1.00 0.00 C ATOM 1308 NE ARG B 108 11.290 10.890 -5.568 1.00 0.00 N ATOM 1309 CZ ARG B 108 11.339 10.816 -6.902 1.00 0.00 C ATOM 1310 NH1 ARG B 108 10.839 11.793 -7.646 1.00 0.00 N ATOM 1311 NH2 ARG B 108 11.883 9.761 -7.494 1.00 0.00 N ATOM 0 H ARG B 108 8.763 9.018 -2.800 1.00 0.00 H new ATOM 0 HA ARG B 108 7.463 11.571 -2.398 1.00 0.00 H new ATOM 0 HB2 ARG B 108 8.763 10.183 -4.776 1.00 0.00 H new ATOM 0 HB3 ARG B 108 8.073 11.792 -4.863 1.00 0.00 H new ATOM 0 HG2 ARG B 108 9.650 12.546 -3.078 1.00 0.00 H new ATOM 0 HG3 ARG B 108 10.358 10.943 -3.044 1.00 0.00 H new ATOM 0 HD2 ARG B 108 10.251 12.708 -5.520 1.00 0.00 H new ATOM 0 HD3 ARG B 108 11.626 12.621 -4.437 1.00 0.00 H new ATOM 0 HE ARG B 108 11.625 10.090 -5.031 1.00 0.00 H new ATOM 0 HH11 ARG B 108 10.414 12.607 -7.201 1.00 0.00 H new ATOM 0 HH12 ARG B 108 10.879 11.731 -8.663 1.00 0.00 H new ATOM 0 HH21 ARG B 108 12.266 9.002 -6.931 1.00 0.00 H new ATOM 0 HH22 ARG B 108 11.918 9.709 -8.512 1.00 0.00 H new ATOM 1325 N VAL B 109 6.093 9.263 -4.321 1.00 0.00 N ATOM 1326 CA VAL B 109 4.854 8.839 -4.969 1.00 0.00 C ATOM 1327 C VAL B 109 3.721 8.697 -3.966 1.00 0.00 C ATOM 1328 O VAL B 109 2.638 9.246 -4.158 1.00 0.00 O ATOM 1329 CB VAL B 109 5.037 7.494 -5.701 1.00 0.00 C ATOM 1330 CG1 VAL B 109 3.735 7.044 -6.351 1.00 0.00 C ATOM 1331 CG2 VAL B 109 6.149 7.595 -6.733 1.00 0.00 C ATOM 0 H VAL B 109 6.863 8.603 -4.429 1.00 0.00 H new ATOM 0 HA VAL B 109 4.600 9.615 -5.691 1.00 0.00 H new ATOM 0 HB VAL B 109 5.320 6.742 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL B 109 3.892 6.093 -6.860 1.00 0.00 H new ATOM 0 HG12 VAL B 109 2.969 6.923 -5.585 1.00 0.00 H new ATOM 0 HG13 VAL B 109 3.411 7.793 -7.073 1.00 0.00 H new ATOM 0 HG21 VAL B 109 6.264 6.637 -7.239 1.00 0.00 H new ATOM 0 HG22 VAL B 109 5.898 8.364 -7.464 1.00 0.00 H new ATOM 0 HG23 VAL B 109 7.083 7.857 -6.237 1.00 0.00 H new ATOM 1341 N TYR B 110 3.982 7.969 -2.892 1.00 0.00 N ATOM 1342 CA TYR B 110 2.970 7.717 -1.877 1.00 0.00 C ATOM 1343 C TYR B 110 2.578 9.016 -1.181 1.00 0.00 C ATOM 1344 O TYR B 110 1.459 9.162 -0.689 1.00 0.00 O ATOM 1345 CB TYR B 110 3.472 6.682 -0.871 1.00 0.00 C ATOM 1346 CG TYR B 110 3.509 5.264 -1.409 1.00 0.00 C ATOM 1347 CD1 TYR B 110 3.096 4.198 -0.623 1.00 0.00 C ATOM 1348 CD2 TYR B 110 3.946 4.993 -2.699 1.00 0.00 C ATOM 1349 CE1 TYR B 110 3.118 2.905 -1.105 1.00 0.00 C ATOM 1350 CE2 TYR B 110 3.971 3.704 -3.186 1.00 0.00 C ATOM 1351 CZ TYR B 110 3.557 2.665 -2.388 1.00 0.00 C ATOM 1352 OH TYR B 110 3.585 1.378 -2.874 1.00 0.00 O ATOM 0 H TYR B 110 4.888 7.541 -2.700 1.00 0.00 H new ATOM 0 HA TYR B 110 2.081 7.314 -2.361 1.00 0.00 H new ATOM 0 HB2 TYR B 110 4.474 6.963 -0.546 1.00 0.00 H new ATOM 0 HB3 TYR B 110 2.832 6.708 0.011 1.00 0.00 H new ATOM 0 HD1 TYR B 110 2.751 4.383 0.384 1.00 0.00 H new ATOM 0 HD2 TYR B 110 4.272 5.806 -3.331 1.00 0.00 H new ATOM 0 HE1 TYR B 110 2.793 2.086 -0.480 1.00 0.00 H new ATOM 0 HE2 TYR B 110 4.315 3.511 -4.191 1.00 0.00 H new ATOM 0 HH TYR B 110 4.486 1.171 -3.200 1.00 0.00 H new ATOM 1362 N LYS B 111 3.505 9.967 -1.164 1.00 0.00 N ATOM 1363 CA LYS B 111 3.238 11.292 -0.625 1.00 0.00 C ATOM 1364 C LYS B 111 2.219 12.002 -1.509 1.00 0.00 C ATOM 1365 O LYS B 111 1.298 12.650 -1.015 1.00 0.00 O ATOM 1366 CB LYS B 111 4.550 12.086 -0.537 1.00 0.00 C ATOM 1367 CG LYS B 111 4.464 13.401 0.231 1.00 0.00 C ATOM 1368 CD LYS B 111 3.889 14.526 -0.614 1.00 0.00 C ATOM 1369 CE LYS B 111 3.953 15.859 0.113 1.00 0.00 C ATOM 1370 NZ LYS B 111 5.353 16.310 0.320 1.00 0.00 N ATOM 0 H LYS B 111 4.453 9.842 -1.520 1.00 0.00 H new ATOM 0 HA LYS B 111 2.823 11.211 0.380 1.00 0.00 H new ATOM 0 HB2 LYS B 111 5.305 11.457 -0.066 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.897 12.297 -1.549 1.00 0.00 H new ATOM 0 HG2 LYS B 111 3.844 13.262 1.117 1.00 0.00 H new ATOM 0 HG3 LYS B 111 5.458 13.682 0.578 1.00 0.00 H new ATOM 0 HD2 LYS B 111 4.440 14.595 -1.552 1.00 0.00 H new ATOM 0 HD3 LYS B 111 2.854 14.299 -0.868 1.00 0.00 H new ATOM 0 HE2 LYS B 111 3.410 16.611 -0.459 1.00 0.00 H new ATOM 0 HE3 LYS B 111 3.454 15.771 1.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 5.358 17.317 0.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 5.788 15.752 1.082 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 5.894 16.177 -0.558 1.00 0.00 H new ATOM 1384 N LYS B 112 2.385 11.851 -2.820 1.00 0.00 N ATOM 1385 CA LYS B 112 1.470 12.435 -3.790 1.00 0.00 C ATOM 1386 C LYS B 112 0.056 11.910 -3.578 1.00 0.00 C ATOM 1387 O LYS B 112 -0.919 12.655 -3.704 1.00 0.00 O ATOM 1388 CB LYS B 112 1.931 12.109 -5.208 1.00 0.00 C ATOM 1389 CG LYS B 112 3.283 12.676 -5.559 1.00 0.00 C ATOM 1390 CD LYS B 112 3.788 12.061 -6.844 1.00 0.00 C ATOM 1391 CE LYS B 112 5.265 12.312 -7.026 1.00 0.00 C ATOM 1392 NZ LYS B 112 5.773 11.751 -8.303 1.00 0.00 N ATOM 0 H LYS B 112 3.153 11.324 -3.236 1.00 0.00 H new ATOM 0 HA LYS B 112 1.467 13.516 -3.651 1.00 0.00 H new ATOM 0 HB2 LYS B 112 1.960 11.026 -5.330 1.00 0.00 H new ATOM 0 HB3 LYS B 112 1.194 12.490 -5.915 1.00 0.00 H new ATOM 0 HG2 LYS B 112 3.215 13.758 -5.667 1.00 0.00 H new ATOM 0 HG3 LYS B 112 3.989 12.480 -4.752 1.00 0.00 H new ATOM 0 HD2 LYS B 112 3.597 10.988 -6.836 1.00 0.00 H new ATOM 0 HD3 LYS B 112 3.239 12.476 -7.689 1.00 0.00 H new ATOM 0 HE2 LYS B 112 5.456 13.385 -7.000 1.00 0.00 H new ATOM 0 HE3 LYS B 112 5.813 11.871 -6.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 6.791 11.946 -8.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 5.615 10.723 -8.318 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 5.269 12.190 -9.100 1.00 0.00 H new ATOM 1406 N GLU B 113 -0.051 10.623 -3.254 1.00 0.00 N ATOM 1407 CA GLU B 113 -1.344 10.012 -2.984 1.00 0.00 C ATOM 1408 C GLU B 113 -2.001 10.701 -1.801 1.00 0.00 C ATOM 1409 O GLU B 113 -3.148 11.132 -1.880 1.00 0.00 O ATOM 1410 CB GLU B 113 -1.201 8.521 -2.680 1.00 0.00 C ATOM 1411 CG GLU B 113 -0.304 7.777 -3.653 1.00 0.00 C ATOM 1412 CD GLU B 113 -0.563 6.287 -3.651 1.00 0.00 C ATOM 1413 OE1 GLU B 113 -1.601 5.868 -4.210 1.00 0.00 O ATOM 1414 OE2 GLU B 113 0.260 5.528 -3.104 1.00 0.00 O ATOM 0 H GLU B 113 0.742 9.987 -3.173 1.00 0.00 H new ATOM 0 HA GLU B 113 -1.962 10.127 -3.875 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -0.804 8.402 -1.672 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -2.190 8.062 -2.689 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -0.459 8.169 -4.658 1.00 0.00 H new ATOM 0 HG3 GLU B 113 0.739 7.962 -3.396 1.00 0.00 H new ATOM 1421 N ILE B 114 -1.249 10.818 -0.714 1.00 0.00 N ATOM 1422 CA ILE B 114 -1.731 11.438 0.508 1.00 0.00 C ATOM 1423 C ILE B 114 -2.218 12.869 0.284 1.00 0.00 C ATOM 1424 O ILE B 114 -3.107 13.335 0.985 1.00 0.00 O ATOM 1425 CB ILE B 114 -0.634 11.404 1.584 1.00 0.00 C ATOM 1426 CG1 ILE B 114 -0.317 9.949 1.915 1.00 0.00 C ATOM 1427 CG2 ILE B 114 -1.054 12.169 2.830 1.00 0.00 C ATOM 1428 CD1 ILE B 114 0.799 9.778 2.908 1.00 0.00 C ATOM 0 H ILE B 114 -0.287 10.484 -0.657 1.00 0.00 H new ATOM 0 HA ILE B 114 -2.591 10.861 0.848 1.00 0.00 H new ATOM 0 HB ILE B 114 0.260 11.894 1.200 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -1.215 9.472 2.307 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -0.055 9.426 0.995 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -0.255 12.125 3.571 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -1.250 13.209 2.570 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -1.958 11.722 3.244 1.00 0.00 H new ATOM 0 HD11 ILE B 114 0.964 8.716 3.091 1.00 0.00 H new ATOM 0 HD12 ILE B 114 1.711 10.224 2.511 1.00 0.00 H new ATOM 0 HD13 ILE B 114 0.532 10.270 3.843 1.00 0.00 H new ATOM 1440 N GLN B 115 -1.652 13.564 -0.693 1.00 0.00 N ATOM 1441 CA GLN B 115 -2.100 14.914 -1.010 1.00 0.00 C ATOM 1442 C GLN B 115 -3.494 14.876 -1.623 1.00 0.00 C ATOM 1443 O GLN B 115 -4.358 15.688 -1.287 1.00 0.00 O ATOM 1444 CB GLN B 115 -1.124 15.587 -1.961 1.00 0.00 C ATOM 1445 CG GLN B 115 0.306 15.498 -1.484 1.00 0.00 C ATOM 1446 CD GLN B 115 1.247 16.360 -2.298 1.00 0.00 C ATOM 1447 OE1 GLN B 115 1.815 15.909 -3.294 1.00 0.00 O ATOM 1448 NE2 GLN B 115 1.419 17.603 -1.882 1.00 0.00 N ATOM 0 H GLN B 115 -0.889 13.220 -1.275 1.00 0.00 H new ATOM 0 HA GLN B 115 -2.139 15.493 -0.087 1.00 0.00 H new ATOM 0 HB2 GLN B 115 -1.204 15.125 -2.945 1.00 0.00 H new ATOM 0 HB3 GLN B 115 -1.400 16.635 -2.077 1.00 0.00 H new ATOM 0 HG2 GLN B 115 0.355 15.801 -0.438 1.00 0.00 H new ATOM 0 HG3 GLN B 115 0.637 14.461 -1.532 1.00 0.00 H new ATOM 0 HE21 GLN B 115 0.929 17.935 -1.052 1.00 0.00 H new ATOM 0 HE22 GLN B 115 2.042 18.230 -2.391 1.00 0.00 H new ATOM 1457 N ALA B 116 -3.702 13.922 -2.518 1.00 0.00 N ATOM 1458 CA ALA B 116 -5.025 13.682 -3.081 1.00 0.00 C ATOM 1459 C ALA B 116 -5.983 13.273 -1.974 1.00 0.00 C ATOM 1460 O ALA B 116 -7.081 13.817 -1.838 1.00 0.00 O ATOM 1461 CB ALA B 116 -4.963 12.595 -4.142 1.00 0.00 C ATOM 0 H ALA B 116 -2.973 13.301 -2.871 1.00 0.00 H new ATOM 0 HA ALA B 116 -5.381 14.600 -3.548 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -5.959 12.429 -4.551 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -4.289 12.904 -4.941 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.596 11.671 -3.695 1.00 0.00 H new ATOM 1467 N LEU B 117 -5.528 12.326 -1.167 1.00 0.00 N ATOM 1468 CA LEU B 117 -6.302 11.815 -0.049 1.00 0.00 C ATOM 1469 C LEU B 117 -6.573 12.920 0.966 1.00 0.00 C ATOM 1470 O LEU B 117 -7.571 12.887 1.664 1.00 0.00 O ATOM 1471 CB LEU B 117 -5.554 10.656 0.618 1.00 0.00 C ATOM 1472 CG LEU B 117 -5.098 9.544 -0.335 1.00 0.00 C ATOM 1473 CD1 LEU B 117 -4.221 8.538 0.383 1.00 0.00 C ATOM 1474 CD2 LEU B 117 -6.287 8.841 -0.964 1.00 0.00 C ATOM 0 H LEU B 117 -4.611 11.891 -1.270 1.00 0.00 H new ATOM 0 HA LEU B 117 -7.259 11.452 -0.425 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.679 11.055 1.131 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -6.198 10.219 1.381 1.00 0.00 H new ATOM 0 HG LEU B 117 -4.514 10.012 -1.127 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -3.912 7.761 -0.316 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -3.339 9.041 0.779 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -4.780 8.087 1.203 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -5.934 8.058 -1.635 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -6.903 8.398 -0.182 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -6.879 9.562 -1.528 1.00 0.00 H new ATOM 1486 N ASP B 118 -5.680 13.902 1.024 1.00 0.00 N ATOM 1487 CA ASP B 118 -5.800 15.032 1.949 1.00 0.00 C ATOM 1488 C ASP B 118 -7.085 15.816 1.705 1.00 0.00 C ATOM 1489 O ASP B 118 -7.705 16.323 2.643 1.00 0.00 O ATOM 1490 CB ASP B 118 -4.579 15.945 1.815 1.00 0.00 C ATOM 1491 CG ASP B 118 -4.732 17.266 2.544 1.00 0.00 C ATOM 1492 OD1 ASP B 118 -5.126 18.261 1.900 1.00 0.00 O ATOM 1493 OD2 ASP B 118 -4.436 17.325 3.754 1.00 0.00 O ATOM 0 H ASP B 118 -4.850 13.940 0.432 1.00 0.00 H new ATOM 0 HA ASP B 118 -5.843 14.640 2.965 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -3.702 15.425 2.200 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -4.395 16.141 0.759 1.00 0.00 H new ATOM 1498 N ALA B 119 -7.489 15.908 0.445 1.00 0.00 N ATOM 1499 CA ALA B 119 -8.765 16.525 0.101 1.00 0.00 C ATOM 1500 C ALA B 119 -9.909 15.698 0.675 1.00 0.00 C ATOM 1501 O ALA B 119 -10.910 16.225 1.173 1.00 0.00 O ATOM 1502 CB ALA B 119 -8.903 16.649 -1.407 1.00 0.00 C ATOM 0 H ALA B 119 -6.955 15.565 -0.353 1.00 0.00 H new ATOM 0 HA ALA B 119 -8.803 17.526 0.531 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -9.860 17.111 -1.648 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -8.094 17.266 -1.797 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -8.854 15.659 -1.859 1.00 0.00 H new ATOM 1508 N GLU B 120 -9.747 14.392 0.614 1.00 0.00 N ATOM 1509 CA GLU B 120 -10.703 13.478 1.202 1.00 0.00 C ATOM 1510 C GLU B 120 -10.585 13.497 2.727 1.00 0.00 C ATOM 1511 O GLU B 120 -11.539 13.219 3.435 1.00 0.00 O ATOM 1512 CB GLU B 120 -10.510 12.069 0.657 1.00 0.00 C ATOM 1513 CG GLU B 120 -11.082 11.838 -0.739 1.00 0.00 C ATOM 1514 CD GLU B 120 -10.542 12.774 -1.799 1.00 0.00 C ATOM 1515 OE1 GLU B 120 -11.120 13.870 -1.979 1.00 0.00 O ATOM 1516 OE2 GLU B 120 -9.563 12.409 -2.479 1.00 0.00 O ATOM 0 H GLU B 120 -8.955 13.938 0.159 1.00 0.00 H new ATOM 0 HA GLU B 120 -11.707 13.805 0.931 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -9.443 11.845 0.639 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -10.973 11.362 1.345 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -10.874 10.811 -1.038 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -12.166 11.944 -0.696 1.00 0.00 H new ATOM 1523 N ILE B 121 -9.409 13.812 3.238 1.00 0.00 N ATOM 1524 CA ILE B 121 -9.249 14.021 4.667 1.00 0.00 C ATOM 1525 C ILE B 121 -10.191 15.127 5.136 1.00 0.00 C ATOM 1526 O ILE B 121 -10.657 15.113 6.267 1.00 0.00 O ATOM 1527 CB ILE B 121 -7.775 14.337 5.048 1.00 0.00 C ATOM 1528 CG1 ILE B 121 -7.061 13.064 5.513 1.00 0.00 C ATOM 1529 CG2 ILE B 121 -7.679 15.411 6.124 1.00 0.00 C ATOM 1530 CD1 ILE B 121 -6.965 11.985 4.459 1.00 0.00 C ATOM 0 H ILE B 121 -8.556 13.928 2.691 1.00 0.00 H new ATOM 0 HA ILE B 121 -9.510 13.094 5.177 1.00 0.00 H new ATOM 0 HB ILE B 121 -7.285 14.722 4.154 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -6.055 13.325 5.842 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -7.586 12.663 6.380 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -6.631 15.599 6.358 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -8.141 16.330 5.763 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -8.197 15.074 7.022 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -6.446 11.119 4.871 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -7.967 11.692 4.146 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -6.413 12.364 3.599 1.00 0.00 H new ATOM 1542 N ARG B 122 -10.502 16.060 4.240 1.00 0.00 N ATOM 1543 CA ARG B 122 -11.432 17.133 4.555 1.00 0.00 C ATOM 1544 C ARG B 122 -12.823 16.572 4.851 1.00 0.00 C ATOM 1545 O ARG B 122 -13.466 16.975 5.821 1.00 0.00 O ATOM 1546 CB ARG B 122 -11.510 18.136 3.405 1.00 0.00 C ATOM 1547 CG ARG B 122 -12.199 19.433 3.783 1.00 0.00 C ATOM 1548 CD ARG B 122 -11.429 20.161 4.870 1.00 0.00 C ATOM 1549 NE ARG B 122 -11.992 21.472 5.169 1.00 0.00 N ATOM 1550 CZ ARG B 122 -11.711 22.162 6.271 1.00 0.00 C ATOM 1551 NH1 ARG B 122 -10.895 21.653 7.192 1.00 0.00 N ATOM 1552 NH2 ARG B 122 -12.250 23.360 6.449 1.00 0.00 N ATOM 0 H ARG B 122 -10.123 16.092 3.293 1.00 0.00 H new ATOM 0 HA ARG B 122 -11.064 17.646 5.443 1.00 0.00 H new ATOM 0 HB2 ARG B 122 -10.501 18.357 3.057 1.00 0.00 H new ATOM 0 HB3 ARG B 122 -12.043 17.680 2.570 1.00 0.00 H new ATOM 0 HG2 ARG B 122 -12.287 20.072 2.904 1.00 0.00 H new ATOM 0 HG3 ARG B 122 -13.212 19.224 4.127 1.00 0.00 H new ATOM 0 HD2 ARG B 122 -11.425 19.555 5.776 1.00 0.00 H new ATOM 0 HD3 ARG B 122 -10.391 20.277 4.560 1.00 0.00 H new ATOM 0 HE ARG B 122 -12.638 21.883 4.495 1.00 0.00 H new ATOM 0 HH11 ARG B 122 -10.483 20.730 7.054 1.00 0.00 H new ATOM 0 HH12 ARG B 122 -10.682 22.186 8.035 1.00 0.00 H new ATOM 0 HH21 ARG B 122 -12.876 23.748 5.743 1.00 0.00 H new ATOM 0 HH22 ARG B 122 -12.039 23.894 7.292 1.00 0.00 H new ATOM 1566 N LYS B 123 -13.285 15.638 4.016 1.00 0.00 N ATOM 1567 CA LYS B 123 -14.579 14.989 4.255 1.00 0.00 C ATOM 1568 C LYS B 123 -14.521 14.194 5.557 1.00 0.00 C ATOM 1569 O LYS B 123 -15.477 14.165 6.336 1.00 0.00 O ATOM 1570 CB LYS B 123 -14.980 14.085 3.072 1.00 0.00 C ATOM 1571 CG LYS B 123 -14.202 12.780 2.972 1.00 0.00 C ATOM 1572 CD LYS B 123 -13.951 12.374 1.525 1.00 0.00 C ATOM 1573 CE LYS B 123 -15.231 12.041 0.798 1.00 0.00 C ATOM 1574 NZ LYS B 123 -15.021 11.919 -0.671 1.00 0.00 N ATOM 0 H LYS B 123 -12.793 15.317 3.182 1.00 0.00 H new ATOM 0 HA LYS B 123 -15.344 15.760 4.345 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -16.042 13.853 3.154 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -14.846 14.643 2.145 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -13.248 12.886 3.489 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -14.754 11.989 3.480 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -13.440 13.184 1.005 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -13.286 11.511 1.501 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -15.636 11.106 1.186 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -15.972 12.815 0.995 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -15.924 11.690 -1.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -14.659 12.819 -1.046 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -14.333 11.163 -0.862 1.00 0.00 H new ATOM 1588 N LEU B 124 -13.372 13.573 5.794 1.00 0.00 N ATOM 1589 CA LEU B 124 -13.119 12.874 7.039 1.00 0.00 C ATOM 1590 C LEU B 124 -13.231 13.830 8.218 1.00 0.00 C ATOM 1591 O LEU B 124 -13.920 13.534 9.188 1.00 0.00 O ATOM 1592 CB LEU B 124 -11.734 12.225 7.021 1.00 0.00 C ATOM 1593 CG LEU B 124 -11.587 11.014 6.101 1.00 0.00 C ATOM 1594 CD1 LEU B 124 -10.157 10.496 6.132 1.00 0.00 C ATOM 1595 CD2 LEU B 124 -12.548 9.920 6.518 1.00 0.00 C ATOM 0 H LEU B 124 -12.597 13.542 5.131 1.00 0.00 H new ATOM 0 HA LEU B 124 -13.869 12.091 7.148 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -11.003 12.977 6.723 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -11.481 11.921 8.037 1.00 0.00 H new ATOM 0 HG LEU B 124 -11.825 11.321 5.082 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -10.068 9.633 5.472 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -9.478 11.281 5.797 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -9.898 10.202 7.149 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -12.433 9.063 5.855 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -12.332 9.617 7.543 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -13.571 10.292 6.457 1.00 0.00 H new ATOM 1607 N GLU B 125 -12.570 14.982 8.113 1.00 0.00 N ATOM 1608 CA GLU B 125 -12.587 15.996 9.169 1.00 0.00 C ATOM 1609 C GLU B 125 -14.009 16.360 9.573 1.00 0.00 C ATOM 1610 O GLU B 125 -14.267 16.692 10.726 1.00 0.00 O ATOM 1611 CB GLU B 125 -11.850 17.258 8.723 1.00 0.00 C ATOM 1612 CG GLU B 125 -10.358 17.058 8.539 1.00 0.00 C ATOM 1613 CD GLU B 125 -9.646 18.343 8.175 1.00 0.00 C ATOM 1614 OE1 GLU B 125 -9.583 18.684 6.976 1.00 0.00 O ATOM 1615 OE2 GLU B 125 -9.152 19.027 9.092 1.00 0.00 O ATOM 0 H GLU B 125 -12.011 15.239 7.300 1.00 0.00 H new ATOM 0 HA GLU B 125 -12.079 15.566 10.032 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -12.280 17.607 7.784 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -12.014 18.044 9.460 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -9.931 16.657 9.458 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -10.187 16.317 7.758 1.00 0.00 H new ATOM 1622 N ARG B 126 -14.927 16.293 8.620 1.00 0.00 N ATOM 1623 CA ARG B 126 -16.332 16.568 8.890 1.00 0.00 C ATOM 1624 C ARG B 126 -16.930 15.526 9.831 1.00 0.00 C ATOM 1625 O ARG B 126 -17.905 15.797 10.522 1.00 0.00 O ATOM 1626 CB ARG B 126 -17.122 16.629 7.583 1.00 0.00 C ATOM 1627 CG ARG B 126 -17.229 18.031 7.001 1.00 0.00 C ATOM 1628 CD ARG B 126 -15.876 18.721 6.922 1.00 0.00 C ATOM 1629 NE ARG B 126 -16.003 20.131 6.564 1.00 0.00 N ATOM 1630 CZ ARG B 126 -15.283 21.109 7.115 1.00 0.00 C ATOM 1631 NH1 ARG B 126 -14.381 20.832 8.051 1.00 0.00 N ATOM 1632 NH2 ARG B 126 -15.473 22.367 6.734 1.00 0.00 N ATOM 0 H ARG B 126 -14.724 16.050 7.650 1.00 0.00 H new ATOM 0 HA ARG B 126 -16.397 17.537 9.384 1.00 0.00 H new ATOM 0 HB2 ARG B 126 -16.648 15.976 6.851 1.00 0.00 H new ATOM 0 HB3 ARG B 126 -18.125 16.239 7.756 1.00 0.00 H new ATOM 0 HG2 ARG B 126 -17.667 17.977 6.004 1.00 0.00 H new ATOM 0 HG3 ARG B 126 -17.905 18.627 7.614 1.00 0.00 H new ATOM 0 HD2 ARG B 126 -15.368 18.635 7.883 1.00 0.00 H new ATOM 0 HD3 ARG B 126 -15.253 18.214 6.185 1.00 0.00 H new ATOM 0 HE ARG B 126 -16.684 20.383 5.848 1.00 0.00 H new ATOM 0 HH11 ARG B 126 -14.237 19.868 8.351 1.00 0.00 H new ATOM 0 HH12 ARG B 126 -13.833 21.584 8.469 1.00 0.00 H new ATOM 0 HH21 ARG B 126 -16.169 22.584 6.021 1.00 0.00 H new ATOM 0 HH22 ARG B 126 -14.923 23.116 7.155 1.00 0.00 H new ATOM 1646 N LEU B 127 -16.351 14.333 9.841 1.00 0.00 N ATOM 1647 CA LEU B 127 -16.739 13.304 10.805 1.00 0.00 C ATOM 1648 C LEU B 127 -15.921 13.420 12.095 1.00 0.00 C ATOM 1649 O LEU B 127 -16.481 13.351 13.191 1.00 0.00 O ATOM 1650 CB LEU B 127 -16.602 11.903 10.202 1.00 0.00 C ATOM 1651 CG LEU B 127 -17.844 11.380 9.468 1.00 0.00 C ATOM 1652 CD1 LEU B 127 -18.258 12.324 8.348 1.00 0.00 C ATOM 1653 CD2 LEU B 127 -17.589 9.984 8.923 1.00 0.00 C ATOM 0 H LEU B 127 -15.613 14.051 9.196 1.00 0.00 H new ATOM 0 HA LEU B 127 -17.788 13.464 11.054 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -15.763 11.906 9.506 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -16.351 11.205 11.001 1.00 0.00 H new ATOM 0 HG LEU B 127 -18.664 11.330 10.184 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -19.140 11.928 7.846 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -18.487 13.305 8.765 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -17.443 12.417 7.630 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -18.479 9.627 8.405 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -16.751 10.013 8.226 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -17.353 9.309 9.746 1.00 0.00 H new ATOM 1665 N LEU B 128 -14.599 13.573 11.964 1.00 0.00 N ATOM 1666 CA LEU B 128 -13.727 13.848 13.099 1.00 0.00 C ATOM 1667 C LEU B 128 -14.287 14.958 13.984 1.00 0.00 C ATOM 1668 O LEU B 128 -14.635 14.729 15.141 1.00 0.00 O ATOM 1669 CB LEU B 128 -12.341 14.260 12.599 1.00 0.00 C ATOM 1670 CG LEU B 128 -11.418 13.123 12.158 1.00 0.00 C ATOM 1671 CD1 LEU B 128 -11.944 12.385 10.944 1.00 0.00 C ATOM 1672 CD2 LEU B 128 -10.028 13.664 11.880 1.00 0.00 C ATOM 0 H LEU B 128 -14.110 13.509 11.071 1.00 0.00 H new ATOM 0 HA LEU B 128 -13.660 12.936 13.692 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -12.469 14.943 11.759 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -11.843 14.818 13.391 1.00 0.00 H new ATOM 0 HG LEU B 128 -11.377 12.403 12.976 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -11.251 11.589 10.674 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -12.919 11.955 11.174 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -12.041 13.080 10.110 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -9.376 12.849 11.566 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -10.080 14.412 11.089 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -9.628 14.121 12.785 1.00 0.00 H new ATOM 1684 N GLU B 129 -14.394 16.153 13.417 1.00 0.00 N ATOM 1685 CA GLU B 129 -14.858 17.327 14.155 1.00 0.00 C ATOM 1686 C GLU B 129 -16.323 17.201 14.563 1.00 0.00 C ATOM 1687 O GLU B 129 -16.810 17.957 15.403 1.00 0.00 O ATOM 1688 CB GLU B 129 -14.656 18.588 13.315 1.00 0.00 C ATOM 1689 CG GLU B 129 -13.204 18.833 12.948 1.00 0.00 C ATOM 1690 CD GLU B 129 -12.988 20.157 12.241 1.00 0.00 C ATOM 1691 OE1 GLU B 129 -12.405 20.161 11.134 1.00 0.00 O ATOM 1692 OE2 GLU B 129 -13.397 21.201 12.790 1.00 0.00 O ATOM 0 H GLU B 129 -14.164 16.338 12.441 1.00 0.00 H new ATOM 0 HA GLU B 129 -14.266 17.397 15.067 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -15.247 18.508 12.402 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -15.036 19.449 13.866 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -12.597 18.807 13.853 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -12.855 18.024 12.307 1.00 0.00 H new ATOM 1699 N SER B 130 -17.022 16.249 13.968 1.00 0.00 N ATOM 1700 CA SER B 130 -18.420 16.010 14.300 1.00 0.00 C ATOM 1701 C SER B 130 -18.531 15.154 15.558 1.00 0.00 C ATOM 1702 O SER B 130 -19.605 15.042 16.149 1.00 0.00 O ATOM 1703 CB SER B 130 -19.137 15.322 13.135 1.00 0.00 C ATOM 1704 OG SER B 130 -20.541 15.269 13.340 1.00 0.00 O ATOM 0 H SER B 130 -16.646 15.628 13.252 1.00 0.00 H new ATOM 0 HA SER B 130 -18.896 16.973 14.487 1.00 0.00 H new ATOM 0 HB2 SER B 130 -18.924 15.857 12.210 1.00 0.00 H new ATOM 0 HB3 SER B 130 -18.748 14.311 13.015 1.00 0.00 H new ATOM 0 HG SER B 130 -20.732 15.290 14.301 1.00 0.00 H new ATOM 1710 N GLY B 131 -17.415 14.559 15.962 1.00 0.00 N ATOM 1711 CA GLY B 131 -17.414 13.701 17.126 1.00 0.00 C ATOM 1712 C GLY B 131 -17.706 12.258 16.771 1.00 0.00 C ATOM 1713 O GLY B 131 -18.133 11.474 17.619 1.00 0.00 O ATOM 0 H GLY B 131 -16.510 14.657 15.501 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -16.445 13.763 17.621 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -18.159 14.056 17.838 1.00 0.00 H new ATOM 1717 N LEU B 132 -17.476 11.905 15.513 1.00 0.00 N ATOM 1718 CA LEU B 132 -17.744 10.558 15.040 1.00 0.00 C ATOM 1719 C LEU B 132 -16.476 9.711 15.117 1.00 0.00 C ATOM 1720 O LEU B 132 -16.474 8.631 15.710 1.00 0.00 O ATOM 1721 CB LEU B 132 -18.291 10.613 13.600 1.00 0.00 C ATOM 1722 CG LEU B 132 -18.783 9.286 12.995 1.00 0.00 C ATOM 1723 CD1 LEU B 132 -17.619 8.437 12.504 1.00 0.00 C ATOM 1724 CD2 LEU B 132 -19.612 8.510 14.007 1.00 0.00 C ATOM 0 H LEU B 132 -17.104 12.536 14.803 1.00 0.00 H new ATOM 0 HA LEU B 132 -18.497 10.093 15.676 1.00 0.00 H new ATOM 0 HB2 LEU B 132 -19.117 11.324 13.577 1.00 0.00 H new ATOM 0 HB3 LEU B 132 -17.509 11.012 12.954 1.00 0.00 H new ATOM 0 HG LEU B 132 -19.412 9.526 12.137 1.00 0.00 H new ATOM 0 HD11 LEU B 132 -18.000 7.507 12.082 1.00 0.00 H new ATOM 0 HD12 LEU B 132 -17.068 8.983 11.739 1.00 0.00 H new ATOM 0 HD13 LEU B 132 -16.955 8.212 13.339 1.00 0.00 H new ATOM 0 HD21 LEU B 132 -19.950 7.575 13.560 1.00 0.00 H new ATOM 0 HD22 LEU B 132 -19.004 8.293 14.885 1.00 0.00 H new ATOM 0 HD23 LEU B 132 -20.476 9.105 14.302 1.00 0.00 H new ATOM 1736 N THR B 133 -15.403 10.209 14.527 1.00 0.00 N ATOM 1737 CA THR B 133 -14.154 9.474 14.471 1.00 0.00 C ATOM 1738 C THR B 133 -13.385 9.611 15.783 1.00 0.00 C ATOM 1739 O THR B 133 -13.396 8.654 16.583 1.00 0.00 O ATOM 1740 CB THR B 133 -13.285 9.968 13.302 1.00 0.00 C ATOM 1741 OG1 THR B 133 -14.090 10.063 12.116 1.00 0.00 O ATOM 1742 CG2 THR B 133 -12.118 9.022 13.051 1.00 0.00 C ATOM 1743 OXT THR B 133 -12.788 10.684 16.018 1.00 0.00 O ATOM 0 H THR B 133 -15.373 11.124 14.078 1.00 0.00 H new ATOM 0 HA THR B 133 -14.392 8.422 14.313 1.00 0.00 H new ATOM 0 HB THR B 133 -12.883 10.948 13.560 1.00 0.00 H new ATOM 0 HG1 THR B 133 -13.574 9.749 11.344 1.00 0.00 H new ATOM 0 HG21 THR B 133 -11.520 9.395 12.220 1.00 0.00 H new ATOM 0 HG22 THR B 133 -11.499 8.963 13.946 1.00 0.00 H new ATOM 0 HG23 THR B 133 -12.499 8.030 12.808 1.00 0.00 H new TER 1751 THR B 133