USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 647 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.0468) USER MOD Set 1.2: A 38 LYS NZ :NH3+ -165:sc= 0 (180deg=0) USER MOD Set 2.1: A 20 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 22 THR OG1 : rot 39:sc= 0.318 USER MOD Single : A 1 GLY N :NH3+ 134:sc= 0.0082 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 43:sc= 1.19 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 36:sc= 0.651 USER MOD Single : A 13 LYS NZ :NH3+ -157:sc= -0.0474 (180deg=-0.322) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.0145 USER MOD Single : A 28 GLN : amide:sc= -2.22! C(o=-2.2!,f=-7.6!) USER MOD Single : A 30 MET CE :methyl 174:sc= 0 (180deg=-0.024) USER MOD Single : A 39 GLN : amide:sc= -0.0268 X(o=-0.027,f=0) USER MOD Single : A 40 LYS NZ :NH3+ -105:sc= 1.31 (180deg=0.107) USER MOD Single : A 41 TYR OH : rot 180:sc= -1.8 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN : amide:sc= -4.03! C(o=-4!,f=-6.8!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 165:sc= -1.88! USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.00075) USER MOD Single : A 67 ASN : amide:sc= -5.58! C(o=-5.6!,f=-3.2!) USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.00198) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc=-0.00673 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 36.488 -12.032 7.686 1.00 0.00 N ATOM 2 CA GLY A 1 35.439 -11.178 7.162 1.00 0.00 C ATOM 3 C GLY A 1 34.217 -11.961 6.725 1.00 0.00 C ATOM 4 O GLY A 1 34.338 -13.040 6.145 1.00 0.00 O ATOM 0 H1 GLY A 1 37.401 -11.752 7.274 1.00 0.00 H new ATOM 0 H2 GLY A 1 36.530 -11.935 8.721 1.00 0.00 H new ATOM 0 H3 GLY A 1 36.286 -13.022 7.439 1.00 0.00 H new ATOM 0 HA2 GLY A 1 35.149 -10.454 7.924 1.00 0.00 H new ATOM 0 HA3 GLY A 1 35.826 -10.611 6.315 1.00 0.00 H new ATOM 8 N SER A 2 33.037 -11.418 7.005 1.00 0.00 N ATOM 9 CA SER A 2 31.787 -12.077 6.642 1.00 0.00 C ATOM 10 C SER A 2 30.712 -11.050 6.300 1.00 0.00 C ATOM 11 O SER A 2 30.289 -10.270 7.154 1.00 0.00 O ATOM 12 CB SER A 2 31.308 -12.973 7.785 1.00 0.00 C ATOM 13 OG SER A 2 30.203 -13.765 7.383 1.00 0.00 O ATOM 0 H SER A 2 32.920 -10.524 7.482 1.00 0.00 H new ATOM 0 HA SER A 2 31.971 -12.692 5.761 1.00 0.00 H new ATOM 0 HB2 SER A 2 32.123 -13.619 8.111 1.00 0.00 H new ATOM 0 HB3 SER A 2 31.027 -12.358 8.640 1.00 0.00 H new ATOM 0 HG SER A 2 29.916 -14.330 8.131 1.00 0.00 H new ATOM 19 N SER A 3 30.274 -11.057 5.045 1.00 0.00 N ATOM 20 CA SER A 3 29.250 -10.124 4.588 1.00 0.00 C ATOM 21 C SER A 3 28.093 -10.868 3.929 1.00 0.00 C ATOM 22 O SER A 3 28.144 -12.084 3.748 1.00 0.00 O ATOM 23 CB SER A 3 29.850 -9.117 3.604 1.00 0.00 C ATOM 24 OG SER A 3 30.998 -8.492 4.152 1.00 0.00 O ATOM 0 H SER A 3 30.612 -11.698 4.327 1.00 0.00 H new ATOM 0 HA SER A 3 28.867 -9.589 5.457 1.00 0.00 H new ATOM 0 HB2 SER A 3 30.116 -9.624 2.676 1.00 0.00 H new ATOM 0 HB3 SER A 3 29.106 -8.362 3.352 1.00 0.00 H new ATOM 0 HG SER A 3 31.364 -7.854 3.504 1.00 0.00 H new ATOM 30 N GLY A 4 27.048 -10.127 3.572 1.00 0.00 N ATOM 31 CA GLY A 4 25.892 -10.732 2.937 1.00 0.00 C ATOM 32 C GLY A 4 25.529 -10.058 1.629 1.00 0.00 C ATOM 33 O GLY A 4 26.397 -9.530 0.934 1.00 0.00 O ATOM 0 H GLY A 4 26.982 -9.119 3.711 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.093 -11.788 2.754 1.00 0.00 H new ATOM 0 HA3 GLY A 4 25.041 -10.682 3.616 1.00 0.00 H new ATOM 37 N SER A 5 24.244 -10.077 1.291 1.00 0.00 N ATOM 38 CA SER A 5 23.769 -9.468 0.054 1.00 0.00 C ATOM 39 C SER A 5 22.244 -9.458 0.004 1.00 0.00 C ATOM 40 O SER A 5 21.580 -9.999 0.887 1.00 0.00 O ATOM 41 CB SER A 5 24.327 -10.219 -1.156 1.00 0.00 C ATOM 42 OG SER A 5 25.593 -9.708 -1.535 1.00 0.00 O ATOM 0 H SER A 5 23.513 -10.508 1.857 1.00 0.00 H new ATOM 0 HA SER A 5 24.122 -8.437 0.026 1.00 0.00 H new ATOM 0 HB2 SER A 5 24.415 -11.280 -0.920 1.00 0.00 H new ATOM 0 HB3 SER A 5 23.633 -10.135 -1.992 1.00 0.00 H new ATOM 0 HG SER A 5 26.137 -9.556 -0.734 1.00 0.00 H new ATOM 48 N SER A 6 21.697 -8.839 -1.038 1.00 0.00 N ATOM 49 CA SER A 6 20.251 -8.756 -1.203 1.00 0.00 C ATOM 50 C SER A 6 19.891 -8.321 -2.621 1.00 0.00 C ATOM 51 O SER A 6 20.767 -8.036 -3.436 1.00 0.00 O ATOM 52 CB SER A 6 19.656 -7.775 -0.190 1.00 0.00 C ATOM 53 OG SER A 6 19.874 -6.433 -0.591 1.00 0.00 O ATOM 0 H SER A 6 22.233 -8.388 -1.779 1.00 0.00 H new ATOM 0 HA SER A 6 19.832 -9.747 -1.027 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.586 -7.958 -0.087 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.104 -7.943 0.790 1.00 0.00 H new ATOM 0 HG SER A 6 19.483 -5.826 0.072 1.00 0.00 H new ATOM 59 N GLY A 7 18.593 -8.273 -2.907 1.00 0.00 N ATOM 60 CA GLY A 7 18.138 -7.873 -4.225 1.00 0.00 C ATOM 61 C GLY A 7 16.760 -7.244 -4.197 1.00 0.00 C ATOM 62 O GLY A 7 16.298 -6.791 -3.151 1.00 0.00 O ATOM 0 H GLY A 7 17.849 -8.504 -2.249 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.848 -7.165 -4.652 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.123 -8.744 -4.880 1.00 0.00 H new ATOM 66 N GLY A 8 16.100 -7.213 -5.352 1.00 0.00 N ATOM 67 CA GLY A 8 14.774 -6.631 -5.433 1.00 0.00 C ATOM 68 C GLY A 8 14.616 -5.713 -6.629 1.00 0.00 C ATOM 69 O GLY A 8 15.437 -4.823 -6.849 1.00 0.00 O ATOM 0 H GLY A 8 16.461 -7.581 -6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 8 14.033 -7.429 -5.491 1.00 0.00 H new ATOM 0 HA3 GLY A 8 14.570 -6.072 -4.520 1.00 0.00 H new ATOM 73 N GLU A 9 13.559 -5.931 -7.406 1.00 0.00 N ATOM 74 CA GLU A 9 13.299 -5.117 -8.587 1.00 0.00 C ATOM 75 C GLU A 9 11.805 -5.062 -8.892 1.00 0.00 C ATOM 76 O GLU A 9 11.063 -6.017 -8.661 1.00 0.00 O ATOM 77 CB GLU A 9 14.057 -5.674 -9.794 1.00 0.00 C ATOM 78 CG GLU A 9 15.562 -5.479 -9.711 1.00 0.00 C ATOM 79 CD GLU A 9 16.273 -5.880 -10.988 1.00 0.00 C ATOM 80 OE1 GLU A 9 16.432 -7.097 -11.221 1.00 0.00 O ATOM 81 OE2 GLU A 9 16.672 -4.979 -11.755 1.00 0.00 O ATOM 0 H GLU A 9 12.870 -6.664 -7.239 1.00 0.00 H new ATOM 0 HA GLU A 9 13.648 -4.105 -8.383 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.842 -6.738 -9.888 1.00 0.00 H new ATOM 0 HB3 GLU A 9 13.686 -5.193 -10.699 1.00 0.00 H new ATOM 0 HG2 GLU A 9 15.778 -4.433 -9.493 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.955 -6.066 -8.881 1.00 0.00 H new ATOM 88 N PRO A 10 11.352 -3.917 -9.424 1.00 0.00 N ATOM 89 CA PRO A 10 9.943 -3.709 -9.772 1.00 0.00 C ATOM 90 C PRO A 10 9.512 -4.550 -10.969 1.00 0.00 C ATOM 91 O PRO A 10 10.301 -5.317 -11.518 1.00 0.00 O ATOM 92 CB PRO A 10 9.879 -2.219 -10.115 1.00 0.00 C ATOM 93 CG PRO A 10 11.262 -1.868 -10.541 1.00 0.00 C ATOM 94 CD PRO A 10 12.180 -2.738 -9.727 1.00 0.00 C ATOM 0 HA PRO A 10 9.275 -4.003 -8.962 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.159 -2.027 -10.910 1.00 0.00 H new ATOM 0 HB3 PRO A 10 9.568 -1.628 -9.254 1.00 0.00 H new ATOM 0 HG2 PRO A 10 11.399 -2.047 -11.607 1.00 0.00 H new ATOM 0 HG3 PRO A 10 11.468 -0.812 -10.366 1.00 0.00 H new ATOM 0 HD2 PRO A 10 13.076 -3.009 -10.285 1.00 0.00 H new ATOM 0 HD3 PRO A 10 12.510 -2.234 -8.818 1.00 0.00 H new ATOM 102 N GLY A 11 8.252 -4.401 -11.368 1.00 0.00 N ATOM 103 CA GLY A 11 7.738 -5.153 -12.498 1.00 0.00 C ATOM 104 C GLY A 11 7.123 -4.260 -13.557 1.00 0.00 C ATOM 105 O GLY A 11 7.573 -3.133 -13.769 1.00 0.00 O ATOM 0 H GLY A 11 7.579 -3.773 -10.929 1.00 0.00 H new ATOM 0 HA2 GLY A 11 8.546 -5.734 -12.942 1.00 0.00 H new ATOM 0 HA3 GLY A 11 6.990 -5.864 -12.147 1.00 0.00 H new ATOM 109 N THR A 12 6.092 -4.763 -14.228 1.00 0.00 N ATOM 110 CA THR A 12 5.416 -4.005 -15.273 1.00 0.00 C ATOM 111 C THR A 12 3.916 -4.277 -15.267 1.00 0.00 C ATOM 112 O THR A 12 3.475 -5.391 -15.548 1.00 0.00 O ATOM 113 CB THR A 12 5.981 -4.342 -16.666 1.00 0.00 C ATOM 114 OG1 THR A 12 5.766 -5.727 -16.960 1.00 0.00 O ATOM 115 CG2 THR A 12 7.468 -4.028 -16.737 1.00 0.00 C ATOM 0 H THR A 12 5.707 -5.693 -14.066 1.00 0.00 H new ATOM 0 HA THR A 12 5.592 -2.950 -15.062 1.00 0.00 H new ATOM 0 HB THR A 12 5.461 -3.730 -17.403 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.904 -6.010 -16.589 1.00 0.00 H new ATOM 0 HG21 THR A 12 7.845 -4.274 -17.730 1.00 0.00 H new ATOM 0 HG22 THR A 12 7.626 -2.967 -16.542 1.00 0.00 H new ATOM 0 HG23 THR A 12 8.000 -4.617 -15.990 1.00 0.00 H new ATOM 123 N LYS A 13 3.135 -3.251 -14.945 1.00 0.00 N ATOM 124 CA LYS A 13 1.683 -3.377 -14.904 1.00 0.00 C ATOM 125 C LYS A 13 1.024 -2.016 -14.703 1.00 0.00 C ATOM 126 O LYS A 13 1.203 -1.376 -13.668 1.00 0.00 O ATOM 127 CB LYS A 13 1.265 -4.328 -13.781 1.00 0.00 C ATOM 128 CG LYS A 13 1.711 -3.874 -12.402 1.00 0.00 C ATOM 129 CD LYS A 13 1.880 -5.051 -11.455 1.00 0.00 C ATOM 130 CE LYS A 13 2.901 -4.751 -10.369 1.00 0.00 C ATOM 131 NZ LYS A 13 4.283 -4.661 -10.917 1.00 0.00 N ATOM 0 H LYS A 13 3.484 -2.322 -14.708 1.00 0.00 H new ATOM 0 HA LYS A 13 1.352 -3.784 -15.859 1.00 0.00 H new ATOM 0 HB2 LYS A 13 0.180 -4.430 -13.787 1.00 0.00 H new ATOM 0 HB3 LYS A 13 1.679 -5.316 -13.980 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.654 -3.333 -12.483 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.979 -3.178 -11.992 1.00 0.00 H new ATOM 0 HD2 LYS A 13 0.920 -5.292 -10.997 1.00 0.00 H new ATOM 0 HD3 LYS A 13 2.194 -5.930 -12.018 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.643 -3.813 -9.877 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.862 -5.531 -9.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.970 -4.846 -10.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.404 -5.366 -11.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 4.442 -3.709 -11.304 1.00 0.00 H new ATOM 145 N ALA A 14 0.261 -1.581 -15.700 1.00 0.00 N ATOM 146 CA ALA A 14 -0.428 -0.297 -15.631 1.00 0.00 C ATOM 147 C ALA A 14 -1.902 -0.483 -15.291 1.00 0.00 C ATOM 148 O ALA A 14 -2.674 -1.010 -16.093 1.00 0.00 O ATOM 149 CB ALA A 14 -0.278 0.453 -16.946 1.00 0.00 C ATOM 0 H ALA A 14 0.104 -2.098 -16.565 1.00 0.00 H new ATOM 0 HA ALA A 14 0.030 0.291 -14.836 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -0.797 1.409 -16.881 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.779 0.627 -17.147 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.709 -0.139 -17.754 1.00 0.00 H new ATOM 155 N LYS A 15 -2.289 -0.048 -14.097 1.00 0.00 N ATOM 156 CA LYS A 15 -3.672 -0.166 -13.649 1.00 0.00 C ATOM 157 C LYS A 15 -4.251 1.203 -13.308 1.00 0.00 C ATOM 158 O LYS A 15 -3.557 2.067 -12.771 1.00 0.00 O ATOM 159 CB LYS A 15 -3.758 -1.087 -12.430 1.00 0.00 C ATOM 160 CG LYS A 15 -2.982 -0.579 -11.228 1.00 0.00 C ATOM 161 CD LYS A 15 -3.842 0.307 -10.343 1.00 0.00 C ATOM 162 CE LYS A 15 -4.576 -0.504 -9.286 1.00 0.00 C ATOM 163 NZ LYS A 15 -3.692 -0.850 -8.139 1.00 0.00 N ATOM 0 H LYS A 15 -1.664 0.390 -13.421 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.256 -0.596 -14.462 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.805 -1.210 -12.151 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.383 -2.073 -12.703 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.613 -1.425 -10.648 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.110 -0.020 -11.567 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.216 1.056 -9.858 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.564 0.845 -10.957 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.434 0.063 -8.925 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.964 -1.419 -9.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.229 -1.402 -7.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.886 -1.412 -8.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.342 0.023 -7.695 1.00 0.00 H new ATOM 177 N LYS A 16 -5.528 1.395 -13.621 1.00 0.00 N ATOM 178 CA LYS A 16 -6.203 2.657 -13.345 1.00 0.00 C ATOM 179 C LYS A 16 -7.185 2.508 -12.188 1.00 0.00 C ATOM 180 O LYS A 16 -8.381 2.309 -12.398 1.00 0.00 O ATOM 181 CB LYS A 16 -6.939 3.149 -14.593 1.00 0.00 C ATOM 182 CG LYS A 16 -6.014 3.653 -15.687 1.00 0.00 C ATOM 183 CD LYS A 16 -5.533 5.066 -15.403 1.00 0.00 C ATOM 184 CE LYS A 16 -4.519 5.529 -16.439 1.00 0.00 C ATOM 185 NZ LYS A 16 -3.689 6.658 -15.937 1.00 0.00 N ATOM 0 H LYS A 16 -6.117 0.691 -14.067 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.447 3.390 -13.064 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -7.547 2.336 -14.990 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.622 3.950 -14.309 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.156 2.986 -15.775 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -6.535 3.630 -16.644 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.384 5.747 -15.396 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.085 5.106 -14.410 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.872 4.695 -16.711 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.041 5.837 -17.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -3.011 6.944 -16.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.304 7.463 -15.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.171 6.357 -15.087 1.00 0.00 H new ATOM 199 N GLY A 17 -6.673 2.607 -10.965 1.00 0.00 N ATOM 200 CA GLY A 17 -7.519 2.481 -9.794 1.00 0.00 C ATOM 201 C GLY A 17 -8.573 1.403 -9.952 1.00 0.00 C ATOM 202 O GLY A 17 -9.709 1.687 -10.331 1.00 0.00 O ATOM 0 H GLY A 17 -5.687 2.772 -10.765 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -6.900 2.255 -8.926 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -8.007 3.436 -9.598 1.00 0.00 H new ATOM 206 N ARG A 18 -8.195 0.162 -9.664 1.00 0.00 N ATOM 207 CA ARG A 18 -9.115 -0.963 -9.780 1.00 0.00 C ATOM 208 C ARG A 18 -10.383 -0.715 -8.967 1.00 0.00 C ATOM 209 O ARG A 18 -10.364 -0.774 -7.737 1.00 0.00 O ATOM 210 CB ARG A 18 -8.440 -2.253 -9.310 1.00 0.00 C ATOM 211 CG ARG A 18 -7.718 -3.001 -10.419 1.00 0.00 C ATOM 212 CD ARG A 18 -7.619 -4.487 -10.115 1.00 0.00 C ATOM 213 NE ARG A 18 -6.716 -4.759 -9.000 1.00 0.00 N ATOM 214 CZ ARG A 18 -6.470 -5.979 -8.534 1.00 0.00 C ATOM 215 NH1 ARG A 18 -7.056 -7.033 -9.084 1.00 0.00 N ATOM 216 NH2 ARG A 18 -5.636 -6.145 -7.515 1.00 0.00 N ATOM 0 H ARG A 18 -7.258 -0.090 -9.349 1.00 0.00 H new ATOM 0 HA ARG A 18 -9.391 -1.067 -10.829 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -7.727 -2.014 -8.521 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -9.193 -2.908 -8.872 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -8.246 -2.856 -11.361 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -6.718 -2.587 -10.547 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -8.610 -4.876 -9.882 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -7.269 -5.016 -11.002 1.00 0.00 H new ATOM 0 HE ARG A 18 -6.249 -3.969 -8.555 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -7.698 -6.909 -9.867 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -6.865 -7.968 -8.724 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -5.184 -5.336 -7.089 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -5.447 -7.082 -7.158 1.00 0.00 H new ATOM 230 N ARG A 19 -11.480 -0.437 -9.662 1.00 0.00 N ATOM 231 CA ARG A 19 -12.756 -0.178 -9.005 1.00 0.00 C ATOM 232 C ARG A 19 -13.285 -1.440 -8.330 1.00 0.00 C ATOM 233 O ARG A 19 -13.936 -2.269 -8.965 1.00 0.00 O ATOM 234 CB ARG A 19 -13.780 0.340 -10.017 1.00 0.00 C ATOM 235 CG ARG A 19 -13.665 1.830 -10.291 1.00 0.00 C ATOM 236 CD ARG A 19 -14.398 2.648 -9.238 1.00 0.00 C ATOM 237 NE ARG A 19 -14.471 4.062 -9.597 1.00 0.00 N ATOM 238 CZ ARG A 19 -14.627 5.038 -8.709 1.00 0.00 C ATOM 239 NH1 ARG A 19 -14.725 4.754 -7.418 1.00 0.00 N ATOM 240 NH2 ARG A 19 -14.684 6.300 -9.113 1.00 0.00 N ATOM 0 H ARG A 19 -11.512 -0.385 -10.680 1.00 0.00 H new ATOM 0 HA ARG A 19 -12.595 0.582 -8.241 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.659 -0.204 -10.954 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -14.783 0.123 -9.650 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -12.614 2.118 -10.310 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -14.074 2.053 -11.276 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -15.406 2.254 -9.110 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -13.890 2.543 -8.279 1.00 0.00 H new ATOM 0 HE ARG A 19 -14.398 4.314 -10.583 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -14.681 3.784 -7.104 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -14.845 5.505 -6.738 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -14.608 6.522 -10.106 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -14.804 7.049 -8.431 1.00 0.00 H new ATOM 254 N SER A 20 -13.001 -1.578 -7.039 1.00 0.00 N ATOM 255 CA SER A 20 -13.445 -2.740 -6.278 1.00 0.00 C ATOM 256 C SER A 20 -14.324 -2.318 -5.105 1.00 0.00 C ATOM 257 O SER A 20 -14.595 -1.133 -4.913 1.00 0.00 O ATOM 258 CB SER A 20 -12.240 -3.532 -5.767 1.00 0.00 C ATOM 259 OG SER A 20 -11.304 -2.682 -5.128 1.00 0.00 O ATOM 0 H SER A 20 -12.465 -0.899 -6.498 1.00 0.00 H new ATOM 0 HA SER A 20 -14.034 -3.374 -6.941 1.00 0.00 H new ATOM 0 HB2 SER A 20 -12.575 -4.299 -5.069 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.760 -4.046 -6.599 1.00 0.00 H new ATOM 0 HG SER A 20 -10.544 -3.213 -4.809 1.00 0.00 H new ATOM 265 N ARG A 21 -14.767 -3.298 -4.324 1.00 0.00 N ATOM 266 CA ARG A 21 -15.618 -3.029 -3.170 1.00 0.00 C ATOM 267 C ARG A 21 -14.914 -3.422 -1.874 1.00 0.00 C ATOM 268 O ARG A 21 -15.515 -4.031 -0.988 1.00 0.00 O ATOM 269 CB ARG A 21 -16.939 -3.789 -3.296 1.00 0.00 C ATOM 270 CG ARG A 21 -16.775 -5.300 -3.299 1.00 0.00 C ATOM 271 CD ARG A 21 -18.051 -5.998 -3.744 1.00 0.00 C ATOM 272 NE ARG A 21 -17.972 -7.446 -3.570 1.00 0.00 N ATOM 273 CZ ARG A 21 -18.242 -8.064 -2.425 1.00 0.00 C ATOM 274 NH1 ARG A 21 -18.607 -7.364 -1.360 1.00 0.00 N ATOM 275 NH2 ARG A 21 -18.148 -9.385 -2.345 1.00 0.00 N ATOM 0 H ARG A 21 -14.551 -4.284 -4.469 1.00 0.00 H new ATOM 0 HA ARG A 21 -15.824 -1.959 -3.142 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -17.592 -3.505 -2.471 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -17.437 -3.484 -4.216 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -15.957 -5.577 -3.964 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -16.503 -5.640 -2.300 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -18.895 -5.610 -3.173 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -18.243 -5.769 -4.792 1.00 0.00 H new ATOM 0 HE ARG A 21 -17.695 -8.014 -4.371 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.681 -6.348 -1.418 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -18.814 -7.841 -0.482 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -17.868 -9.927 -3.163 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -18.355 -9.859 -1.466 1.00 0.00 H new ATOM 289 N THR A 22 -13.637 -3.068 -1.769 1.00 0.00 N ATOM 290 CA THR A 22 -12.852 -3.384 -0.582 1.00 0.00 C ATOM 291 C THR A 22 -13.135 -2.397 0.544 1.00 0.00 C ATOM 292 O THR A 22 -12.895 -1.197 0.407 1.00 0.00 O ATOM 293 CB THR A 22 -11.342 -3.376 -0.890 1.00 0.00 C ATOM 294 OG1 THR A 22 -10.970 -2.128 -1.485 1.00 0.00 O ATOM 295 CG2 THR A 22 -10.974 -4.519 -1.823 1.00 0.00 C ATOM 0 H THR A 22 -13.124 -2.562 -2.492 1.00 0.00 H new ATOM 0 HA THR A 22 -13.146 -4.385 -0.265 1.00 0.00 H new ATOM 0 HB THR A 22 -10.802 -3.506 0.048 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.466 -1.400 -1.055 1.00 0.00 H new ATOM 0 HG21 THR A 22 -9.903 -4.493 -2.026 1.00 0.00 H new ATOM 0 HG22 THR A 22 -11.231 -5.469 -1.354 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.523 -4.416 -2.759 1.00 0.00 H new ATOM 303 N VAL A 23 -13.647 -2.909 1.659 1.00 0.00 N ATOM 304 CA VAL A 23 -13.961 -2.071 2.810 1.00 0.00 C ATOM 305 C VAL A 23 -13.278 -2.591 4.070 1.00 0.00 C ATOM 306 O VAL A 23 -13.307 -3.788 4.357 1.00 0.00 O ATOM 307 CB VAL A 23 -15.480 -2.001 3.055 1.00 0.00 C ATOM 308 CG1 VAL A 23 -15.785 -1.159 4.284 1.00 0.00 C ATOM 309 CG2 VAL A 23 -16.192 -1.448 1.830 1.00 0.00 C ATOM 0 H VAL A 23 -13.853 -3.899 1.789 1.00 0.00 H new ATOM 0 HA VAL A 23 -13.590 -1.071 2.585 1.00 0.00 H new ATOM 0 HB VAL A 23 -15.848 -3.011 3.236 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -16.863 -1.121 4.441 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -15.307 -1.603 5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -15.404 -0.148 4.136 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -17.264 -1.406 2.021 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -15.822 -0.446 1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -16.001 -2.096 0.975 1.00 0.00 H new ATOM 319 N PHE A 24 -12.663 -1.683 4.821 1.00 0.00 N ATOM 320 CA PHE A 24 -11.972 -2.049 6.051 1.00 0.00 C ATOM 321 C PHE A 24 -12.731 -1.542 7.274 1.00 0.00 C ATOM 322 O PHE A 24 -13.532 -0.611 7.180 1.00 0.00 O ATOM 323 CB PHE A 24 -10.550 -1.484 6.049 1.00 0.00 C ATOM 324 CG PHE A 24 -9.687 -2.035 4.950 1.00 0.00 C ATOM 325 CD1 PHE A 24 -9.766 -1.521 3.666 1.00 0.00 C ATOM 326 CD2 PHE A 24 -8.798 -3.067 5.201 1.00 0.00 C ATOM 327 CE1 PHE A 24 -8.973 -2.025 2.652 1.00 0.00 C ATOM 328 CE2 PHE A 24 -8.002 -3.575 4.191 1.00 0.00 C ATOM 329 CZ PHE A 24 -8.091 -3.055 2.915 1.00 0.00 C ATOM 0 H PHE A 24 -12.629 -0.688 4.599 1.00 0.00 H new ATOM 0 HA PHE A 24 -11.924 -3.137 6.101 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -10.599 -0.399 5.952 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -10.081 -1.698 7.010 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -10.455 -0.717 3.455 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.726 -3.479 6.197 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -9.043 -1.614 1.656 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.311 -4.378 4.400 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.472 -3.453 2.124 1.00 0.00 H new ATOM 339 N THR A 25 -12.474 -2.161 8.421 1.00 0.00 N ATOM 340 CA THR A 25 -13.133 -1.775 9.663 1.00 0.00 C ATOM 341 C THR A 25 -12.197 -0.969 10.555 1.00 0.00 C ATOM 342 O THR A 25 -10.989 -1.202 10.573 1.00 0.00 O ATOM 343 CB THR A 25 -13.631 -3.008 10.441 1.00 0.00 C ATOM 344 OG1 THR A 25 -12.520 -3.709 11.011 1.00 0.00 O ATOM 345 CG2 THR A 25 -14.414 -3.942 9.531 1.00 0.00 C ATOM 0 H THR A 25 -11.814 -2.933 8.516 1.00 0.00 H new ATOM 0 HA THR A 25 -13.988 -1.158 9.388 1.00 0.00 H new ATOM 0 HB THR A 25 -14.291 -2.665 11.238 1.00 0.00 H new ATOM 0 HG1 THR A 25 -12.845 -4.490 11.505 1.00 0.00 H new ATOM 0 HG21 THR A 25 -14.755 -4.805 10.102 1.00 0.00 H new ATOM 0 HG22 THR A 25 -15.275 -3.414 9.122 1.00 0.00 H new ATOM 0 HG23 THR A 25 -13.773 -4.277 8.715 1.00 0.00 H new ATOM 353 N GLU A 26 -12.763 -0.020 11.295 1.00 0.00 N ATOM 354 CA GLU A 26 -11.976 0.820 12.190 1.00 0.00 C ATOM 355 C GLU A 26 -10.823 0.032 12.804 1.00 0.00 C ATOM 356 O GLU A 26 -9.740 0.572 13.035 1.00 0.00 O ATOM 357 CB GLU A 26 -12.863 1.394 13.297 1.00 0.00 C ATOM 358 CG GLU A 26 -13.684 2.595 12.858 1.00 0.00 C ATOM 359 CD GLU A 26 -14.051 3.505 14.014 1.00 0.00 C ATOM 360 OE1 GLU A 26 -13.144 3.876 14.787 1.00 0.00 O ATOM 361 OE2 GLU A 26 -15.245 3.845 14.146 1.00 0.00 O ATOM 0 H GLU A 26 -13.762 0.186 11.292 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.560 1.640 11.605 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.537 0.614 13.652 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.236 1.682 14.141 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.122 3.164 12.117 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.595 2.249 12.370 1.00 0.00 H new ATOM 368 N LEU A 27 -11.063 -1.248 13.066 1.00 0.00 N ATOM 369 CA LEU A 27 -10.046 -2.113 13.654 1.00 0.00 C ATOM 370 C LEU A 27 -8.940 -2.415 12.647 1.00 0.00 C ATOM 371 O LEU A 27 -7.769 -2.130 12.894 1.00 0.00 O ATOM 372 CB LEU A 27 -10.677 -3.418 14.142 1.00 0.00 C ATOM 373 CG LEU A 27 -9.855 -4.227 15.145 1.00 0.00 C ATOM 374 CD1 LEU A 27 -10.758 -5.131 15.970 1.00 0.00 C ATOM 375 CD2 LEU A 27 -8.792 -5.046 14.426 1.00 0.00 C ATOM 0 H LEU A 27 -11.953 -1.710 12.881 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.607 -1.590 14.503 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.640 -3.185 14.596 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.877 -4.048 13.275 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.356 -3.532 15.820 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.155 -5.699 16.678 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.481 -4.524 16.514 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.286 -5.819 15.309 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.216 -5.616 15.156 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.272 -5.731 13.727 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.126 -4.378 13.880 1.00 0.00 H new ATOM 387 N GLN A 28 -9.322 -2.992 11.512 1.00 0.00 N ATOM 388 CA GLN A 28 -8.362 -3.331 10.468 1.00 0.00 C ATOM 389 C GLN A 28 -7.545 -2.109 10.062 1.00 0.00 C ATOM 390 O GLN A 28 -6.321 -2.178 9.945 1.00 0.00 O ATOM 391 CB GLN A 28 -9.085 -3.904 9.248 1.00 0.00 C ATOM 392 CG GLN A 28 -9.863 -5.176 9.543 1.00 0.00 C ATOM 393 CD GLN A 28 -10.748 -5.601 8.388 1.00 0.00 C ATOM 394 OE1 GLN A 28 -11.299 -4.764 7.673 1.00 0.00 O ATOM 395 NE2 GLN A 28 -10.889 -6.908 8.200 1.00 0.00 N ATOM 0 H GLN A 28 -10.288 -3.234 11.292 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.682 -4.084 10.866 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.770 -3.152 8.856 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.354 -4.108 8.466 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -9.164 -5.979 9.774 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -10.478 -5.024 10.430 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -10.413 -7.566 8.817 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -11.473 -7.254 7.438 1.00 0.00 H new ATOM 404 N LEU A 29 -8.229 -0.990 9.848 1.00 0.00 N ATOM 405 CA LEU A 29 -7.567 0.248 9.454 1.00 0.00 C ATOM 406 C LEU A 29 -6.578 0.701 10.524 1.00 0.00 C ATOM 407 O LEU A 29 -5.470 1.136 10.213 1.00 0.00 O ATOM 408 CB LEU A 29 -8.602 1.346 9.204 1.00 0.00 C ATOM 409 CG LEU A 29 -9.458 1.188 7.946 1.00 0.00 C ATOM 410 CD1 LEU A 29 -10.737 2.002 8.065 1.00 0.00 C ATOM 411 CD2 LEU A 29 -8.672 1.602 6.711 1.00 0.00 C ATOM 0 H LEU A 29 -9.242 -0.915 9.941 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.017 0.059 8.532 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.266 1.395 10.067 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.082 2.302 9.147 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.729 0.137 7.844 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.333 1.877 7.161 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -11.309 1.658 8.927 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -10.487 3.055 8.193 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -9.296 1.483 5.826 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -8.370 2.645 6.805 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -7.786 0.975 6.617 1.00 0.00 H new ATOM 423 N MET A 30 -6.986 0.592 11.784 1.00 0.00 N ATOM 424 CA MET A 30 -6.134 0.986 12.899 1.00 0.00 C ATOM 425 C MET A 30 -4.754 0.346 12.783 1.00 0.00 C ATOM 426 O MET A 30 -3.740 0.978 13.073 1.00 0.00 O ATOM 427 CB MET A 30 -6.782 0.592 14.228 1.00 0.00 C ATOM 428 CG MET A 30 -5.907 0.875 15.438 1.00 0.00 C ATOM 429 SD MET A 30 -6.861 1.054 16.958 1.00 0.00 S ATOM 430 CE MET A 30 -7.578 -0.580 17.102 1.00 0.00 C ATOM 0 H MET A 30 -7.901 0.234 12.058 1.00 0.00 H new ATOM 0 HA MET A 30 -6.016 2.069 12.868 1.00 0.00 H new ATOM 0 HB2 MET A 30 -7.724 1.130 14.337 1.00 0.00 H new ATOM 0 HB3 MET A 30 -7.023 -0.471 14.205 1.00 0.00 H new ATOM 0 HG2 MET A 30 -5.187 0.065 15.558 1.00 0.00 H new ATOM 0 HG3 MET A 30 -5.335 1.786 15.263 1.00 0.00 H new ATOM 0 HE1 MET A 30 -8.110 -0.662 18.050 1.00 0.00 H new ATOM 0 HE2 MET A 30 -8.274 -0.746 16.279 1.00 0.00 H new ATOM 0 HE3 MET A 30 -6.787 -1.329 17.065 1.00 0.00 H new ATOM 440 N GLY A 31 -4.725 -0.914 12.357 1.00 0.00 N ATOM 441 CA GLY A 31 -3.465 -1.618 12.211 1.00 0.00 C ATOM 442 C GLY A 31 -2.751 -1.267 10.921 1.00 0.00 C ATOM 443 O GLY A 31 -1.548 -1.001 10.921 1.00 0.00 O ATOM 0 H GLY A 31 -5.551 -1.459 12.111 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -2.819 -1.380 13.056 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -3.647 -2.692 12.241 1.00 0.00 H new ATOM 447 N LEU A 32 -3.491 -1.267 9.818 1.00 0.00 N ATOM 448 CA LEU A 32 -2.920 -0.947 8.514 1.00 0.00 C ATOM 449 C LEU A 32 -2.244 0.419 8.536 1.00 0.00 C ATOM 450 O LEU A 32 -1.115 0.571 8.070 1.00 0.00 O ATOM 451 CB LEU A 32 -4.009 -0.973 7.439 1.00 0.00 C ATOM 452 CG LEU A 32 -4.504 -2.358 7.019 1.00 0.00 C ATOM 453 CD1 LEU A 32 -5.778 -2.242 6.197 1.00 0.00 C ATOM 454 CD2 LEU A 32 -3.427 -3.094 6.235 1.00 0.00 C ATOM 0 H LEU A 32 -4.487 -1.485 9.800 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.168 -1.700 8.279 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.862 -0.398 7.800 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.631 -0.461 6.554 1.00 0.00 H new ATOM 0 HG LEU A 32 -4.727 -2.932 7.919 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.116 -3.237 5.907 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.551 -1.755 6.791 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -5.581 -1.651 5.303 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.796 -4.077 5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.173 -2.523 5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.539 -3.209 6.857 1.00 0.00 H new ATOM 466 N GLU A 33 -2.941 1.411 9.082 1.00 0.00 N ATOM 467 CA GLU A 33 -2.406 2.764 9.166 1.00 0.00 C ATOM 468 C GLU A 33 -1.172 2.807 10.062 1.00 0.00 C ATOM 469 O GLU A 33 -0.166 3.432 9.724 1.00 0.00 O ATOM 470 CB GLU A 33 -3.471 3.725 9.699 1.00 0.00 C ATOM 471 CG GLU A 33 -4.739 3.753 8.863 1.00 0.00 C ATOM 472 CD GLU A 33 -5.940 4.256 9.641 1.00 0.00 C ATOM 473 OE1 GLU A 33 -6.473 3.489 10.469 1.00 0.00 O ATOM 474 OE2 GLU A 33 -6.346 5.417 9.421 1.00 0.00 O ATOM 0 H GLU A 33 -3.877 1.302 9.472 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.116 3.075 8.163 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.725 3.442 10.720 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -3.052 4.730 9.742 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.582 4.390 7.993 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.946 2.750 8.490 1.00 0.00 H new ATOM 481 N LYS A 34 -1.257 2.140 11.208 1.00 0.00 N ATOM 482 CA LYS A 34 -0.148 2.100 12.154 1.00 0.00 C ATOM 483 C LYS A 34 1.111 1.547 11.494 1.00 0.00 C ATOM 484 O LYS A 34 2.160 2.191 11.500 1.00 0.00 O ATOM 485 CB LYS A 34 -0.518 1.245 13.369 1.00 0.00 C ATOM 486 CG LYS A 34 0.274 1.588 14.618 1.00 0.00 C ATOM 487 CD LYS A 34 1.716 1.121 14.510 1.00 0.00 C ATOM 488 CE LYS A 34 2.378 1.038 15.877 1.00 0.00 C ATOM 489 NZ LYS A 34 3.483 0.039 15.898 1.00 0.00 N ATOM 0 H LYS A 34 -2.083 1.620 11.504 1.00 0.00 H new ATOM 0 HA LYS A 34 0.054 3.120 12.482 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -1.581 1.367 13.578 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.359 0.195 13.125 1.00 0.00 H new ATOM 0 HG2 LYS A 34 0.251 2.666 14.780 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -0.195 1.125 15.486 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.748 0.143 14.029 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.275 1.808 13.875 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.769 2.018 16.151 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.633 0.771 16.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 4.135 0.258 16.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.088 -0.913 16.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 3.999 0.073 14.996 1.00 0.00 H new ATOM 503 N ARG A 35 0.999 0.351 10.925 1.00 0.00 N ATOM 504 CA ARG A 35 2.128 -0.288 10.261 1.00 0.00 C ATOM 505 C ARG A 35 2.603 0.545 9.074 1.00 0.00 C ATOM 506 O ARG A 35 3.779 0.898 8.981 1.00 0.00 O ATOM 507 CB ARG A 35 1.743 -1.692 9.791 1.00 0.00 C ATOM 508 CG ARG A 35 1.858 -2.750 10.875 1.00 0.00 C ATOM 509 CD ARG A 35 3.241 -2.752 11.508 1.00 0.00 C ATOM 510 NE ARG A 35 3.560 -4.037 12.123 1.00 0.00 N ATOM 511 CZ ARG A 35 4.798 -4.432 12.401 1.00 0.00 C ATOM 512 NH1 ARG A 35 5.827 -3.644 12.121 1.00 0.00 N ATOM 513 NH2 ARG A 35 5.008 -5.616 12.961 1.00 0.00 N ATOM 0 H ARG A 35 0.137 -0.195 10.911 1.00 0.00 H new ATOM 0 HA ARG A 35 2.944 -0.364 10.979 1.00 0.00 H new ATOM 0 HB2 ARG A 35 0.718 -1.674 9.421 1.00 0.00 H new ATOM 0 HB3 ARG A 35 2.380 -1.973 8.952 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.106 -2.569 11.643 1.00 0.00 H new ATOM 0 HG3 ARG A 35 1.650 -3.732 10.450 1.00 0.00 H new ATOM 0 HD2 ARG A 35 3.987 -2.518 10.749 1.00 0.00 H new ATOM 0 HD3 ARG A 35 3.296 -1.966 12.261 1.00 0.00 H new ATOM 0 HE ARG A 35 2.790 -4.666 12.352 1.00 0.00 H new ATOM 0 HH11 ARG A 35 5.669 -2.732 11.691 1.00 0.00 H new ATOM 0 HH12 ARG A 35 6.776 -3.949 12.335 1.00 0.00 H new ATOM 0 HH21 ARG A 35 4.219 -6.224 13.179 1.00 0.00 H new ATOM 0 HH22 ARG A 35 5.959 -5.918 13.174 1.00 0.00 H new ATOM 527 N PHE A 36 1.681 0.857 8.169 1.00 0.00 N ATOM 528 CA PHE A 36 2.006 1.647 6.988 1.00 0.00 C ATOM 529 C PHE A 36 2.795 2.896 7.369 1.00 0.00 C ATOM 530 O PHE A 36 3.790 3.233 6.729 1.00 0.00 O ATOM 531 CB PHE A 36 0.727 2.044 6.247 1.00 0.00 C ATOM 532 CG PHE A 36 0.976 2.892 5.033 1.00 0.00 C ATOM 533 CD1 PHE A 36 1.479 4.177 5.161 1.00 0.00 C ATOM 534 CD2 PHE A 36 0.709 2.405 3.764 1.00 0.00 C ATOM 535 CE1 PHE A 36 1.709 4.960 4.045 1.00 0.00 C ATOM 536 CE2 PHE A 36 0.937 3.183 2.644 1.00 0.00 C ATOM 537 CZ PHE A 36 1.439 4.462 2.785 1.00 0.00 C ATOM 0 H PHE A 36 0.703 0.575 8.231 1.00 0.00 H new ATOM 0 HA PHE A 36 2.624 1.035 6.331 1.00 0.00 H new ATOM 0 HB2 PHE A 36 0.196 1.141 5.947 1.00 0.00 H new ATOM 0 HB3 PHE A 36 0.074 2.586 6.931 1.00 0.00 H new ATOM 0 HD1 PHE A 36 1.694 4.571 6.143 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.318 1.405 3.648 1.00 0.00 H new ATOM 0 HE1 PHE A 36 2.100 5.961 4.158 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.723 2.791 1.661 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.620 5.072 1.912 1.00 0.00 H new ATOM 547 N GLU A 37 2.341 3.579 8.415 1.00 0.00 N ATOM 548 CA GLU A 37 3.004 4.792 8.881 1.00 0.00 C ATOM 549 C GLU A 37 4.435 4.495 9.320 1.00 0.00 C ATOM 550 O GLU A 37 5.384 5.123 8.849 1.00 0.00 O ATOM 551 CB GLU A 37 2.222 5.414 10.039 1.00 0.00 C ATOM 552 CG GLU A 37 1.129 6.370 9.592 1.00 0.00 C ATOM 553 CD GLU A 37 1.680 7.618 8.931 1.00 0.00 C ATOM 554 OE1 GLU A 37 1.893 7.595 7.701 1.00 0.00 O ATOM 555 OE2 GLU A 37 1.897 8.620 9.645 1.00 0.00 O ATOM 0 H GLU A 37 1.518 3.314 8.956 1.00 0.00 H new ATOM 0 HA GLU A 37 3.036 5.500 8.052 1.00 0.00 H new ATOM 0 HB2 GLU A 37 1.775 4.617 10.634 1.00 0.00 H new ATOM 0 HB3 GLU A 37 2.915 5.947 10.690 1.00 0.00 H new ATOM 0 HG2 GLU A 37 0.466 5.857 8.896 1.00 0.00 H new ATOM 0 HG3 GLU A 37 0.527 6.656 10.454 1.00 0.00 H new ATOM 562 N LYS A 38 4.583 3.534 10.225 1.00 0.00 N ATOM 563 CA LYS A 38 5.897 3.152 10.729 1.00 0.00 C ATOM 564 C LYS A 38 6.829 2.770 9.583 1.00 0.00 C ATOM 565 O LYS A 38 7.890 3.367 9.409 1.00 0.00 O ATOM 566 CB LYS A 38 5.771 1.984 11.709 1.00 0.00 C ATOM 567 CG LYS A 38 5.105 2.361 13.021 1.00 0.00 C ATOM 568 CD LYS A 38 5.988 3.276 13.853 1.00 0.00 C ATOM 569 CE LYS A 38 5.277 3.743 15.113 1.00 0.00 C ATOM 570 NZ LYS A 38 5.457 2.785 16.239 1.00 0.00 N ATOM 0 H LYS A 38 3.808 3.005 10.625 1.00 0.00 H new ATOM 0 HA LYS A 38 6.322 4.010 11.250 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.199 1.185 11.237 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.764 1.586 11.916 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.155 2.856 12.819 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.879 1.458 13.588 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.904 2.751 14.124 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.281 4.141 13.258 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.659 4.721 15.404 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.214 3.865 14.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 4.766 2.996 16.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.310 1.814 15.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.420 2.875 16.621 1.00 0.00 H new ATOM 584 N GLN A 39 6.422 1.772 8.804 1.00 0.00 N ATOM 585 CA GLN A 39 7.221 1.312 7.675 1.00 0.00 C ATOM 586 C GLN A 39 6.450 1.456 6.367 1.00 0.00 C ATOM 587 O GLN A 39 5.546 0.673 6.077 1.00 0.00 O ATOM 588 CB GLN A 39 7.636 -0.147 7.877 1.00 0.00 C ATOM 589 CG GLN A 39 8.945 -0.508 7.195 1.00 0.00 C ATOM 590 CD GLN A 39 9.536 -1.804 7.714 1.00 0.00 C ATOM 591 OE1 GLN A 39 10.716 -1.865 8.063 1.00 0.00 O ATOM 592 NE2 GLN A 39 8.718 -2.848 7.769 1.00 0.00 N ATOM 0 H GLN A 39 5.545 1.268 8.934 1.00 0.00 H new ATOM 0 HA GLN A 39 8.115 1.933 7.619 1.00 0.00 H new ATOM 0 HB2 GLN A 39 7.726 -0.346 8.945 1.00 0.00 H new ATOM 0 HB3 GLN A 39 6.847 -0.796 7.497 1.00 0.00 H new ATOM 0 HG2 GLN A 39 8.779 -0.593 6.121 1.00 0.00 H new ATOM 0 HG3 GLN A 39 9.662 0.299 7.344 1.00 0.00 H new ATOM 0 HE21 GLN A 39 7.748 -2.752 7.470 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.060 -3.746 8.111 1.00 0.00 H new ATOM 601 N LYS A 40 6.812 2.464 5.581 1.00 0.00 N ATOM 602 CA LYS A 40 6.156 2.712 4.303 1.00 0.00 C ATOM 603 C LYS A 40 5.815 1.401 3.602 1.00 0.00 C ATOM 604 O LYS A 40 4.849 1.325 2.842 1.00 0.00 O ATOM 605 CB LYS A 40 7.052 3.566 3.402 1.00 0.00 C ATOM 606 CG LYS A 40 7.215 4.996 3.886 1.00 0.00 C ATOM 607 CD LYS A 40 5.965 5.819 3.624 1.00 0.00 C ATOM 608 CE LYS A 40 5.912 7.052 4.513 1.00 0.00 C ATOM 609 NZ LYS A 40 4.536 7.615 4.600 1.00 0.00 N ATOM 0 H LYS A 40 7.557 3.123 5.807 1.00 0.00 H new ATOM 0 HA LYS A 40 5.229 3.251 4.499 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.035 3.100 3.335 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.635 3.577 2.395 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.435 4.997 4.954 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.066 5.456 3.384 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.941 6.123 2.577 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.081 5.205 3.798 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.263 6.794 5.512 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.591 7.810 4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.477 8.478 4.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.852 6.916 4.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.317 7.845 5.590 1.00 0.00 H new ATOM 623 N TYR A 41 6.611 0.371 3.865 1.00 0.00 N ATOM 624 CA TYR A 41 6.394 -0.937 3.259 1.00 0.00 C ATOM 625 C TYR A 41 6.460 -2.042 4.309 1.00 0.00 C ATOM 626 O TYR A 41 6.605 -1.773 5.502 1.00 0.00 O ATOM 627 CB TYR A 41 7.432 -1.195 2.165 1.00 0.00 C ATOM 628 CG TYR A 41 7.221 -0.360 0.922 1.00 0.00 C ATOM 629 CD1 TYR A 41 7.438 1.012 0.937 1.00 0.00 C ATOM 630 CD2 TYR A 41 6.806 -0.944 -0.268 1.00 0.00 C ATOM 631 CE1 TYR A 41 7.246 1.778 -0.196 1.00 0.00 C ATOM 632 CE2 TYR A 41 6.613 -0.186 -1.407 1.00 0.00 C ATOM 633 CZ TYR A 41 6.834 1.175 -1.366 1.00 0.00 C ATOM 634 OH TYR A 41 6.643 1.934 -2.497 1.00 0.00 O ATOM 0 H TYR A 41 7.413 0.417 4.494 1.00 0.00 H new ATOM 0 HA TYR A 41 5.399 -0.942 2.814 1.00 0.00 H new ATOM 0 HB2 TYR A 41 8.426 -0.993 2.564 1.00 0.00 H new ATOM 0 HB3 TYR A 41 7.406 -2.250 1.893 1.00 0.00 H new ATOM 0 HD1 TYR A 41 7.762 1.488 1.851 1.00 0.00 H new ATOM 0 HD2 TYR A 41 6.631 -2.009 -0.304 1.00 0.00 H new ATOM 0 HE1 TYR A 41 7.418 2.844 -0.166 1.00 0.00 H new ATOM 0 HE2 TYR A 41 6.291 -0.656 -2.324 1.00 0.00 H new ATOM 0 HH TYR A 41 6.354 1.356 -3.234 1.00 0.00 H new ATOM 644 N LEU A 42 6.354 -3.286 3.856 1.00 0.00 N ATOM 645 CA LEU A 42 6.402 -4.434 4.755 1.00 0.00 C ATOM 646 C LEU A 42 7.131 -5.605 4.104 1.00 0.00 C ATOM 647 O LEU A 42 6.972 -5.862 2.911 1.00 0.00 O ATOM 648 CB LEU A 42 4.986 -4.857 5.151 1.00 0.00 C ATOM 649 CG LEU A 42 4.191 -3.846 5.977 1.00 0.00 C ATOM 650 CD1 LEU A 42 2.708 -4.181 5.947 1.00 0.00 C ATOM 651 CD2 LEU A 42 4.701 -3.808 7.411 1.00 0.00 C ATOM 0 H LEU A 42 6.234 -3.526 2.872 1.00 0.00 H new ATOM 0 HA LEU A 42 6.950 -4.140 5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.425 -5.074 4.242 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.051 -5.787 5.716 1.00 0.00 H new ATOM 0 HG LEU A 42 4.329 -2.858 5.537 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.158 -3.451 6.540 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.350 -4.156 4.918 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.552 -5.177 6.361 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.123 -3.083 7.984 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.594 -4.795 7.862 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.752 -3.519 7.416 1.00 0.00 H new ATOM 663 N SER A 43 7.930 -6.313 4.897 1.00 0.00 N ATOM 664 CA SER A 43 8.685 -7.456 4.397 1.00 0.00 C ATOM 665 C SER A 43 7.751 -8.607 4.034 1.00 0.00 C ATOM 666 O SER A 43 6.579 -8.616 4.414 1.00 0.00 O ATOM 667 CB SER A 43 9.701 -7.919 5.442 1.00 0.00 C ATOM 668 OG SER A 43 10.484 -6.833 5.909 1.00 0.00 O ATOM 0 H SER A 43 8.071 -6.115 5.888 1.00 0.00 H new ATOM 0 HA SER A 43 9.216 -7.144 3.498 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.180 -8.382 6.280 1.00 0.00 H new ATOM 0 HB3 SER A 43 10.350 -8.680 5.010 1.00 0.00 H new ATOM 0 HG SER A 43 11.124 -7.155 6.577 1.00 0.00 H new ATOM 674 N THR A 44 8.279 -9.579 3.296 1.00 0.00 N ATOM 675 CA THR A 44 7.494 -10.735 2.881 1.00 0.00 C ATOM 676 C THR A 44 6.726 -11.329 4.055 1.00 0.00 C ATOM 677 O THR A 44 5.498 -11.418 4.044 1.00 0.00 O ATOM 678 CB THR A 44 8.387 -11.826 2.260 1.00 0.00 C ATOM 679 OG1 THR A 44 8.474 -11.641 0.843 1.00 0.00 O ATOM 680 CG2 THR A 44 7.837 -13.212 2.563 1.00 0.00 C ATOM 0 H THR A 44 9.247 -9.588 2.974 1.00 0.00 H new ATOM 0 HA THR A 44 6.787 -10.384 2.130 1.00 0.00 H new ATOM 0 HB THR A 44 9.382 -11.743 2.698 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.045 -12.338 0.457 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.484 -13.966 2.115 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.800 -13.361 3.642 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.833 -13.303 2.150 1.00 0.00 H new ATOM 688 N PRO A 45 7.464 -11.747 5.095 1.00 0.00 N ATOM 689 CA PRO A 45 6.872 -12.339 6.298 1.00 0.00 C ATOM 690 C PRO A 45 6.101 -11.318 7.128 1.00 0.00 C ATOM 691 O PRO A 45 5.230 -11.679 7.920 1.00 0.00 O ATOM 692 CB PRO A 45 8.087 -12.853 7.075 1.00 0.00 C ATOM 693 CG PRO A 45 9.218 -12.000 6.616 1.00 0.00 C ATOM 694 CD PRO A 45 8.932 -11.672 5.177 1.00 0.00 C ATOM 0 HA PRO A 45 6.145 -13.114 6.055 1.00 0.00 H new ATOM 0 HB2 PRO A 45 7.935 -12.764 8.151 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.275 -13.906 6.865 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.291 -11.093 7.216 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.168 -12.525 6.715 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.299 -10.681 4.910 1.00 0.00 H new ATOM 0 HD3 PRO A 45 9.409 -12.381 4.501 1.00 0.00 H new ATOM 702 N ASP A 46 6.428 -10.044 6.943 1.00 0.00 N ATOM 703 CA ASP A 46 5.765 -8.971 7.674 1.00 0.00 C ATOM 704 C ASP A 46 4.295 -8.872 7.280 1.00 0.00 C ATOM 705 O ASP A 46 3.413 -8.834 8.138 1.00 0.00 O ATOM 706 CB ASP A 46 6.467 -7.637 7.412 1.00 0.00 C ATOM 707 CG ASP A 46 7.601 -7.379 8.384 1.00 0.00 C ATOM 708 OD1 ASP A 46 8.288 -8.350 8.766 1.00 0.00 O ATOM 709 OD2 ASP A 46 7.802 -6.206 8.765 1.00 0.00 O ATOM 0 H ASP A 46 7.148 -9.729 6.293 1.00 0.00 H new ATOM 0 HA ASP A 46 5.822 -9.200 8.738 1.00 0.00 H new ATOM 0 HB2 ASP A 46 6.856 -7.628 6.394 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.741 -6.827 7.483 1.00 0.00 H new ATOM 714 N ARG A 47 4.039 -8.829 5.976 1.00 0.00 N ATOM 715 CA ARG A 47 2.676 -8.732 5.468 1.00 0.00 C ATOM 716 C ARG A 47 1.857 -9.955 5.871 1.00 0.00 C ATOM 717 O ARG A 47 0.669 -9.846 6.176 1.00 0.00 O ATOM 718 CB ARG A 47 2.685 -8.590 3.945 1.00 0.00 C ATOM 719 CG ARG A 47 1.379 -8.062 3.375 1.00 0.00 C ATOM 720 CD ARG A 47 1.538 -7.630 1.925 1.00 0.00 C ATOM 721 NE ARG A 47 1.918 -8.745 1.061 1.00 0.00 N ATOM 722 CZ ARG A 47 2.282 -8.599 -0.208 1.00 0.00 C ATOM 723 NH1 ARG A 47 2.317 -7.393 -0.757 1.00 0.00 N ATOM 724 NH2 ARG A 47 2.613 -9.662 -0.931 1.00 0.00 N ATOM 0 H ARG A 47 4.758 -8.860 5.253 1.00 0.00 H new ATOM 0 HA ARG A 47 2.214 -7.847 5.906 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.495 -7.920 3.656 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.900 -9.561 3.499 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.612 -8.834 3.444 1.00 0.00 H new ATOM 0 HG3 ARG A 47 1.035 -7.217 3.972 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.602 -7.199 1.570 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.294 -6.847 1.861 1.00 0.00 H new ATOM 0 HE ARG A 47 1.903 -9.686 1.453 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.064 -6.574 -0.205 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.597 -7.284 -1.732 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.588 -10.592 -0.512 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.892 -9.549 -1.905 1.00 0.00 H new ATOM 738 N ILE A 48 2.501 -11.118 5.869 1.00 0.00 N ATOM 739 CA ILE A 48 1.832 -12.360 6.234 1.00 0.00 C ATOM 740 C ILE A 48 1.526 -12.401 7.727 1.00 0.00 C ATOM 741 O ILE A 48 0.430 -12.786 8.136 1.00 0.00 O ATOM 742 CB ILE A 48 2.685 -13.588 5.862 1.00 0.00 C ATOM 743 CG1 ILE A 48 2.873 -13.665 4.346 1.00 0.00 C ATOM 744 CG2 ILE A 48 2.036 -14.861 6.386 1.00 0.00 C ATOM 745 CD1 ILE A 48 3.733 -14.828 3.902 1.00 0.00 C ATOM 0 H ILE A 48 3.484 -11.225 5.619 1.00 0.00 H new ATOM 0 HA ILE A 48 0.898 -12.393 5.673 1.00 0.00 H new ATOM 0 HB ILE A 48 3.666 -13.485 6.326 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.895 -13.744 3.870 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.323 -12.736 3.996 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.650 -15.720 6.116 1.00 0.00 H new ATOM 0 HG22 ILE A 48 1.948 -14.805 7.471 1.00 0.00 H new ATOM 0 HG23 ILE A 48 1.044 -14.971 5.947 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.823 -14.820 2.816 1.00 0.00 H new ATOM 0 HD12 ILE A 48 4.723 -14.740 4.349 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.273 -15.763 4.221 1.00 0.00 H new ATOM 757 N ASP A 49 2.500 -12.001 8.537 1.00 0.00 N ATOM 758 CA ASP A 49 2.334 -11.989 9.986 1.00 0.00 C ATOM 759 C ASP A 49 1.276 -10.972 10.403 1.00 0.00 C ATOM 760 O ASP A 49 0.491 -11.218 11.319 1.00 0.00 O ATOM 761 CB ASP A 49 3.664 -11.669 10.670 1.00 0.00 C ATOM 762 CG ASP A 49 4.455 -12.917 11.009 1.00 0.00 C ATOM 763 OD1 ASP A 49 4.465 -13.855 10.185 1.00 0.00 O ATOM 764 OD2 ASP A 49 5.064 -12.957 12.099 1.00 0.00 O ATOM 0 H ASP A 49 3.413 -11.681 8.215 1.00 0.00 H new ATOM 0 HA ASP A 49 2.003 -12.980 10.298 1.00 0.00 H new ATOM 0 HB2 ASP A 49 4.260 -11.030 10.018 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.473 -11.104 11.582 1.00 0.00 H new ATOM 769 N LEU A 50 1.262 -9.829 9.726 1.00 0.00 N ATOM 770 CA LEU A 50 0.301 -8.774 10.027 1.00 0.00 C ATOM 771 C LEU A 50 -1.098 -9.160 9.555 1.00 0.00 C ATOM 772 O LEU A 50 -2.049 -9.159 10.335 1.00 0.00 O ATOM 773 CB LEU A 50 0.730 -7.462 9.366 1.00 0.00 C ATOM 774 CG LEU A 50 -0.329 -6.361 9.309 1.00 0.00 C ATOM 775 CD1 LEU A 50 -0.459 -5.674 10.659 1.00 0.00 C ATOM 776 CD2 LEU A 50 0.011 -5.350 8.224 1.00 0.00 C ATOM 0 H LEU A 50 1.905 -9.609 8.965 1.00 0.00 H new ATOM 0 HA LEU A 50 0.275 -8.638 11.108 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.598 -7.076 9.901 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.054 -7.680 8.348 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.288 -6.818 9.064 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.217 -4.893 10.599 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.750 -6.405 11.413 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.497 -5.230 10.935 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.754 -4.574 8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.980 -4.898 8.438 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.051 -5.853 7.258 1.00 0.00 H new ATOM 788 N ALA A 51 -1.213 -9.491 8.273 1.00 0.00 N ATOM 789 CA ALA A 51 -2.494 -9.884 7.698 1.00 0.00 C ATOM 790 C ALA A 51 -3.165 -10.964 8.540 1.00 0.00 C ATOM 791 O ALA A 51 -4.392 -11.046 8.595 1.00 0.00 O ATOM 792 CB ALA A 51 -2.304 -10.368 6.268 1.00 0.00 C ATOM 0 H ALA A 51 -0.435 -9.495 7.613 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.145 -9.010 7.690 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.268 -10.658 5.851 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -1.875 -9.567 5.667 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.632 -11.226 6.261 1.00 0.00 H new ATOM 798 N GLU A 52 -2.353 -11.789 9.192 1.00 0.00 N ATOM 799 CA GLU A 52 -2.871 -12.865 10.030 1.00 0.00 C ATOM 800 C GLU A 52 -3.363 -12.324 11.369 1.00 0.00 C ATOM 801 O GLU A 52 -4.299 -12.860 11.961 1.00 0.00 O ATOM 802 CB GLU A 52 -1.792 -13.925 10.261 1.00 0.00 C ATOM 803 CG GLU A 52 -1.775 -15.017 9.204 1.00 0.00 C ATOM 804 CD GLU A 52 -2.802 -16.100 9.468 1.00 0.00 C ATOM 805 OE1 GLU A 52 -2.730 -16.737 10.540 1.00 0.00 O ATOM 806 OE2 GLU A 52 -3.677 -16.312 8.603 1.00 0.00 O ATOM 0 H GLU A 52 -1.335 -11.734 9.157 1.00 0.00 H new ATOM 0 HA GLU A 52 -3.714 -13.321 9.511 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.817 -13.439 10.285 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -1.946 -14.380 11.239 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.963 -14.574 8.226 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.782 -15.465 9.165 1.00 0.00 H new ATOM 813 N SER A 53 -2.724 -11.257 11.840 1.00 0.00 N ATOM 814 CA SER A 53 -3.092 -10.645 13.111 1.00 0.00 C ATOM 815 C SER A 53 -4.399 -9.868 12.981 1.00 0.00 C ATOM 816 O SER A 53 -5.304 -10.011 13.804 1.00 0.00 O ATOM 817 CB SER A 53 -1.979 -9.715 13.596 1.00 0.00 C ATOM 818 OG SER A 53 -2.340 -9.074 14.807 1.00 0.00 O ATOM 0 H SER A 53 -1.949 -10.799 11.360 1.00 0.00 H new ATOM 0 HA SER A 53 -3.233 -11.441 13.842 1.00 0.00 H new ATOM 0 HB2 SER A 53 -1.062 -10.286 13.743 1.00 0.00 H new ATOM 0 HB3 SER A 53 -1.769 -8.965 12.833 1.00 0.00 H new ATOM 0 HG SER A 53 -1.611 -8.487 15.096 1.00 0.00 H new ATOM 824 N LEU A 54 -4.490 -9.046 11.942 1.00 0.00 N ATOM 825 CA LEU A 54 -5.685 -8.245 11.702 1.00 0.00 C ATOM 826 C LEU A 54 -6.759 -9.066 10.996 1.00 0.00 C ATOM 827 O LEU A 54 -7.946 -8.752 11.072 1.00 0.00 O ATOM 828 CB LEU A 54 -5.338 -7.012 10.866 1.00 0.00 C ATOM 829 CG LEU A 54 -4.345 -6.033 11.493 1.00 0.00 C ATOM 830 CD1 LEU A 54 -3.944 -4.962 10.491 1.00 0.00 C ATOM 831 CD2 LEU A 54 -4.937 -5.400 12.744 1.00 0.00 C ATOM 0 H LEU A 54 -3.750 -8.916 11.252 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.076 -7.923 12.667 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.933 -7.348 9.911 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.261 -6.474 10.649 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.451 -6.587 11.778 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.237 -4.275 10.956 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.478 -5.431 9.624 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.829 -4.411 10.173 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.216 -4.706 13.177 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.848 -4.861 12.483 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -5.172 -6.179 13.470 1.00 0.00 H new ATOM 843 N GLY A 55 -6.333 -10.123 10.310 1.00 0.00 N ATOM 844 CA GLY A 55 -7.270 -10.975 9.602 1.00 0.00 C ATOM 845 C GLY A 55 -7.573 -10.469 8.206 1.00 0.00 C ATOM 846 O GLY A 55 -8.686 -10.633 7.706 1.00 0.00 O ATOM 0 H GLY A 55 -5.356 -10.404 10.232 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.863 -11.984 9.539 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -8.198 -11.041 10.171 1.00 0.00 H new ATOM 850 N LEU A 56 -6.581 -9.850 7.575 1.00 0.00 N ATOM 851 CA LEU A 56 -6.747 -9.316 6.227 1.00 0.00 C ATOM 852 C LEU A 56 -6.017 -10.182 5.205 1.00 0.00 C ATOM 853 O LEU A 56 -5.347 -11.151 5.562 1.00 0.00 O ATOM 854 CB LEU A 56 -6.227 -7.879 6.159 1.00 0.00 C ATOM 855 CG LEU A 56 -7.051 -6.832 6.909 1.00 0.00 C ATOM 856 CD1 LEU A 56 -6.305 -5.508 6.967 1.00 0.00 C ATOM 857 CD2 LEU A 56 -8.411 -6.652 6.252 1.00 0.00 C ATOM 0 H LEU A 56 -5.654 -9.705 7.975 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.811 -9.323 5.988 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -5.211 -7.862 6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.168 -7.584 5.111 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.207 -7.183 7.929 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.906 -4.775 7.504 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -5.356 -5.648 7.484 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.118 -5.151 5.954 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.983 -5.903 6.799 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.277 -6.324 5.221 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -8.949 -7.600 6.264 1.00 0.00 H new ATOM 869 N SER A 57 -6.150 -9.824 3.932 1.00 0.00 N ATOM 870 CA SER A 57 -5.504 -10.569 2.857 1.00 0.00 C ATOM 871 C SER A 57 -4.233 -9.863 2.395 1.00 0.00 C ATOM 872 O SER A 57 -4.240 -8.661 2.130 1.00 0.00 O ATOM 873 CB SER A 57 -6.464 -10.739 1.678 1.00 0.00 C ATOM 874 OG SER A 57 -7.543 -11.594 2.018 1.00 0.00 O ATOM 0 H SER A 57 -6.699 -9.023 3.620 1.00 0.00 H new ATOM 0 HA SER A 57 -5.233 -11.553 3.241 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.849 -9.765 1.375 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.926 -11.149 0.823 1.00 0.00 H new ATOM 0 HG SER A 57 -8.143 -11.685 1.249 1.00 0.00 H new ATOM 880 N GLN A 58 -3.145 -10.620 2.300 1.00 0.00 N ATOM 881 CA GLN A 58 -1.866 -10.067 1.870 1.00 0.00 C ATOM 882 C GLN A 58 -2.066 -9.005 0.795 1.00 0.00 C ATOM 883 O GLN A 58 -1.290 -8.053 0.696 1.00 0.00 O ATOM 884 CB GLN A 58 -0.957 -11.179 1.343 1.00 0.00 C ATOM 885 CG GLN A 58 -0.683 -12.275 2.361 1.00 0.00 C ATOM 886 CD GLN A 58 -0.426 -13.621 1.713 1.00 0.00 C ATOM 887 OE1 GLN A 58 -1.295 -14.494 1.702 1.00 0.00 O ATOM 888 NE2 GLN A 58 0.773 -13.798 1.170 1.00 0.00 N ATOM 0 H GLN A 58 -3.123 -11.617 2.515 1.00 0.00 H new ATOM 0 HA GLN A 58 -1.393 -9.599 2.733 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.415 -11.622 0.459 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.009 -10.743 1.027 1.00 0.00 H new ATOM 0 HG2 GLN A 58 0.180 -11.996 2.966 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.533 -12.358 3.038 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.463 -13.048 1.202 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.004 -14.684 0.721 1.00 0.00 H new ATOM 897 N LEU A 59 -3.109 -9.174 -0.010 1.00 0.00 N ATOM 898 CA LEU A 59 -3.411 -8.229 -1.080 1.00 0.00 C ATOM 899 C LEU A 59 -3.787 -6.864 -0.511 1.00 0.00 C ATOM 900 O LEU A 59 -3.268 -5.837 -0.945 1.00 0.00 O ATOM 901 CB LEU A 59 -4.550 -8.762 -1.951 1.00 0.00 C ATOM 902 CG LEU A 59 -5.125 -7.784 -2.976 1.00 0.00 C ATOM 903 CD1 LEU A 59 -4.057 -7.371 -3.977 1.00 0.00 C ATOM 904 CD2 LEU A 59 -6.318 -8.401 -3.691 1.00 0.00 C ATOM 0 H LEU A 59 -3.760 -9.956 0.058 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.517 -8.113 -1.692 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -4.193 -9.645 -2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.358 -9.089 -1.297 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.464 -6.892 -2.449 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.484 -6.675 -4.699 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.233 -6.888 -3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.687 -8.253 -4.499 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.714 -7.691 -4.417 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.004 -9.309 -4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -7.092 -8.646 -2.963 1.00 0.00 H new ATOM 916 N GLN A 60 -4.691 -6.864 0.464 1.00 0.00 N ATOM 917 CA GLN A 60 -5.134 -5.625 1.092 1.00 0.00 C ATOM 918 C GLN A 60 -3.953 -4.699 1.363 1.00 0.00 C ATOM 919 O GLN A 60 -3.908 -3.572 0.868 1.00 0.00 O ATOM 920 CB GLN A 60 -5.871 -5.927 2.399 1.00 0.00 C ATOM 921 CG GLN A 60 -7.191 -6.654 2.199 1.00 0.00 C ATOM 922 CD GLN A 60 -8.271 -5.756 1.630 1.00 0.00 C ATOM 923 OE1 GLN A 60 -8.094 -5.143 0.577 1.00 0.00 O ATOM 924 NE2 GLN A 60 -9.400 -5.674 2.325 1.00 0.00 N ATOM 0 H GLN A 60 -5.130 -7.707 0.835 1.00 0.00 H new ATOM 0 HA GLN A 60 -5.816 -5.123 0.406 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -5.227 -6.530 3.039 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -6.057 -4.991 2.926 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -7.037 -7.500 1.530 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -7.526 -7.059 3.154 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -9.504 -6.200 3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -10.163 -5.086 1.991 1.00 0.00 H new ATOM 933 N VAL A 61 -2.998 -5.180 2.152 1.00 0.00 N ATOM 934 CA VAL A 61 -1.816 -4.396 2.488 1.00 0.00 C ATOM 935 C VAL A 61 -1.095 -3.922 1.231 1.00 0.00 C ATOM 936 O VAL A 61 -0.783 -2.740 1.089 1.00 0.00 O ATOM 937 CB VAL A 61 -0.834 -5.205 3.356 1.00 0.00 C ATOM 938 CG1 VAL A 61 0.391 -4.369 3.695 1.00 0.00 C ATOM 939 CG2 VAL A 61 -1.521 -5.696 4.621 1.00 0.00 C ATOM 0 H VAL A 61 -3.020 -6.110 2.571 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.161 -3.530 3.054 1.00 0.00 H new ATOM 0 HB VAL A 61 -0.505 -6.075 2.788 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.074 -4.956 4.309 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.894 -4.071 2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.084 -3.479 4.244 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.812 -6.266 5.222 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.880 -4.842 5.195 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.364 -6.333 4.353 1.00 0.00 H new ATOM 949 N LYS A 62 -0.834 -4.853 0.320 1.00 0.00 N ATOM 950 CA LYS A 62 -0.151 -4.533 -0.928 1.00 0.00 C ATOM 951 C LYS A 62 -0.818 -3.352 -1.626 1.00 0.00 C ATOM 952 O LYS A 62 -0.222 -2.284 -1.771 1.00 0.00 O ATOM 953 CB LYS A 62 -0.143 -5.749 -1.856 1.00 0.00 C ATOM 954 CG LYS A 62 0.723 -5.567 -3.091 1.00 0.00 C ATOM 955 CD LYS A 62 -0.067 -4.967 -4.242 1.00 0.00 C ATOM 956 CE LYS A 62 0.589 -5.263 -5.582 1.00 0.00 C ATOM 957 NZ LYS A 62 1.826 -4.460 -5.783 1.00 0.00 N ATOM 0 H LYS A 62 -1.085 -5.836 0.423 1.00 0.00 H new ATOM 0 HA LYS A 62 0.877 -4.259 -0.690 1.00 0.00 H new ATOM 0 HB2 LYS A 62 0.210 -6.617 -1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -1.165 -5.964 -2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.568 -4.921 -2.852 1.00 0.00 H new ATOM 0 HG3 LYS A 62 1.134 -6.530 -3.394 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -1.081 -5.367 -4.236 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -0.148 -3.889 -4.106 1.00 0.00 H new ATOM 0 HE2 LYS A 62 0.831 -6.324 -5.641 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -0.116 -5.052 -6.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 2.243 -4.691 -6.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 1.591 -3.447 -5.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 2.509 -4.680 -5.030 1.00 0.00 H new ATOM 971 N THR A 63 -2.061 -3.549 -2.055 1.00 0.00 N ATOM 972 CA THR A 63 -2.810 -2.501 -2.737 1.00 0.00 C ATOM 973 C THR A 63 -3.059 -1.314 -1.814 1.00 0.00 C ATOM 974 O THR A 63 -2.626 -0.197 -2.093 1.00 0.00 O ATOM 975 CB THR A 63 -4.161 -3.025 -3.258 1.00 0.00 C ATOM 976 OG1 THR A 63 -3.958 -4.197 -4.055 1.00 0.00 O ATOM 977 CG2 THR A 63 -4.871 -1.962 -4.083 1.00 0.00 C ATOM 0 H THR A 63 -2.570 -4.425 -1.942 1.00 0.00 H new ATOM 0 HA THR A 63 -2.204 -2.178 -3.583 1.00 0.00 H new ATOM 0 HB THR A 63 -4.785 -3.274 -2.399 1.00 0.00 H new ATOM 0 HG1 THR A 63 -4.822 -4.525 -4.381 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.823 -2.355 -4.441 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.050 -1.082 -3.466 1.00 0.00 H new ATOM 0 HG23 THR A 63 -4.249 -1.687 -4.935 1.00 0.00 H new ATOM 985 N TRP A 64 -3.759 -1.564 -0.713 1.00 0.00 N ATOM 986 CA TRP A 64 -4.066 -0.515 0.252 1.00 0.00 C ATOM 987 C TRP A 64 -2.890 0.445 0.405 1.00 0.00 C ATOM 988 O TRP A 64 -3.063 1.663 0.365 1.00 0.00 O ATOM 989 CB TRP A 64 -4.419 -1.128 1.608 1.00 0.00 C ATOM 990 CG TRP A 64 -4.935 -0.127 2.597 1.00 0.00 C ATOM 991 CD1 TRP A 64 -6.243 0.188 2.837 1.00 0.00 C ATOM 992 CD2 TRP A 64 -4.156 0.692 3.475 1.00 0.00 C ATOM 993 NE1 TRP A 64 -6.322 1.152 3.812 1.00 0.00 N ATOM 994 CE2 TRP A 64 -5.056 1.478 4.221 1.00 0.00 C ATOM 995 CE3 TRP A 64 -2.785 0.835 3.706 1.00 0.00 C ATOM 996 CZ2 TRP A 64 -4.627 2.394 5.178 1.00 0.00 C ATOM 997 CZ3 TRP A 64 -2.361 1.745 4.656 1.00 0.00 C ATOM 998 CH2 TRP A 64 -3.280 2.514 5.383 1.00 0.00 C ATOM 0 H TRP A 64 -4.124 -2.484 -0.467 1.00 0.00 H new ATOM 0 HA TRP A 64 -4.924 0.046 -0.119 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -5.170 -1.905 1.463 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -3.534 -1.613 2.021 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -7.090 -0.256 2.334 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -7.184 1.560 4.173 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.070 0.245 3.152 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -5.333 2.989 5.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -1.304 1.866 4.841 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.917 3.215 6.120 1.00 0.00 H new ATOM 1009 N TYR A 65 -1.697 -0.112 0.580 1.00 0.00 N ATOM 1010 CA TYR A 65 -0.494 0.696 0.740 1.00 0.00 C ATOM 1011 C TYR A 65 -0.274 1.593 -0.473 1.00 0.00 C ATOM 1012 O TYR A 65 -0.172 2.813 -0.346 1.00 0.00 O ATOM 1013 CB TYR A 65 0.725 -0.204 0.950 1.00 0.00 C ATOM 1014 CG TYR A 65 1.004 -0.517 2.403 1.00 0.00 C ATOM 1015 CD1 TYR A 65 0.035 -1.107 3.206 1.00 0.00 C ATOM 1016 CD2 TYR A 65 2.237 -0.224 2.973 1.00 0.00 C ATOM 1017 CE1 TYR A 65 0.285 -1.394 4.533 1.00 0.00 C ATOM 1018 CE2 TYR A 65 2.496 -0.509 4.300 1.00 0.00 C ATOM 1019 CZ TYR A 65 1.517 -1.093 5.076 1.00 0.00 C ATOM 1020 OH TYR A 65 1.770 -1.379 6.398 1.00 0.00 O ATOM 0 H TYR A 65 -1.537 -1.119 0.615 1.00 0.00 H new ATOM 0 HA TYR A 65 -0.627 1.329 1.617 1.00 0.00 H new ATOM 0 HB2 TYR A 65 0.574 -1.138 0.408 1.00 0.00 H new ATOM 0 HB3 TYR A 65 1.601 0.278 0.516 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -0.930 -1.345 2.784 1.00 0.00 H new ATOM 0 HD2 TYR A 65 3.006 0.234 2.369 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -0.480 -1.852 5.143 1.00 0.00 H new ATOM 0 HE2 TYR A 65 3.460 -0.276 4.727 1.00 0.00 H new ATOM 0 HH TYR A 65 2.735 -1.334 6.564 1.00 0.00 H new ATOM 1030 N GLN A 66 -0.202 0.980 -1.650 1.00 0.00 N ATOM 1031 CA GLN A 66 0.005 1.723 -2.887 1.00 0.00 C ATOM 1032 C GLN A 66 -0.974 2.887 -2.994 1.00 0.00 C ATOM 1033 O GLN A 66 -0.586 4.008 -3.319 1.00 0.00 O ATOM 1034 CB GLN A 66 -0.151 0.797 -4.095 1.00 0.00 C ATOM 1035 CG GLN A 66 0.658 1.234 -5.305 1.00 0.00 C ATOM 1036 CD GLN A 66 0.633 0.212 -6.425 1.00 0.00 C ATOM 1037 OE1 GLN A 66 1.002 -0.947 -6.231 1.00 0.00 O ATOM 1038 NE2 GLN A 66 0.195 0.636 -7.604 1.00 0.00 N ATOM 0 H GLN A 66 -0.284 -0.029 -1.773 1.00 0.00 H new ATOM 0 HA GLN A 66 1.018 2.125 -2.874 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.151 -0.211 -3.811 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -1.204 0.748 -4.371 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.268 2.182 -5.675 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.690 1.410 -5.003 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -0.101 1.605 -7.720 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.154 -0.007 -8.394 1.00 0.00 H new ATOM 1047 N ASN A 67 -2.244 2.613 -2.718 1.00 0.00 N ATOM 1048 CA ASN A 67 -3.279 3.638 -2.783 1.00 0.00 C ATOM 1049 C ASN A 67 -3.016 4.743 -1.765 1.00 0.00 C ATOM 1050 O ASN A 67 -3.570 5.838 -1.865 1.00 0.00 O ATOM 1051 CB ASN A 67 -4.656 3.019 -2.535 1.00 0.00 C ATOM 1052 CG ASN A 67 -5.103 2.126 -3.677 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -5.290 2.587 -4.803 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -5.275 0.841 -3.390 1.00 0.00 N ATOM 0 H ASN A 67 -2.582 1.689 -2.447 1.00 0.00 H new ATOM 0 HA ASN A 67 -3.259 4.075 -3.781 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -4.630 2.439 -1.613 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.388 3.814 -2.391 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -5.574 0.192 -4.117 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -5.108 0.503 -2.442 1.00 0.00 H new ATOM 1061 N ARG A 68 -2.165 4.449 -0.787 1.00 0.00 N ATOM 1062 CA ARG A 68 -1.828 5.417 0.249 1.00 0.00 C ATOM 1063 C ARG A 68 -0.580 6.209 -0.131 1.00 0.00 C ATOM 1064 O ARG A 68 -0.583 7.439 -0.108 1.00 0.00 O ATOM 1065 CB ARG A 68 -1.608 4.708 1.587 1.00 0.00 C ATOM 1066 CG ARG A 68 -2.894 4.423 2.345 1.00 0.00 C ATOM 1067 CD ARG A 68 -3.374 5.648 3.107 1.00 0.00 C ATOM 1068 NE ARG A 68 -2.820 5.705 4.457 1.00 0.00 N ATOM 1069 CZ ARG A 68 -3.233 6.560 5.386 1.00 0.00 C ATOM 1070 NH1 ARG A 68 -4.199 7.426 5.112 1.00 0.00 N ATOM 1071 NH2 ARG A 68 -2.680 6.550 6.592 1.00 0.00 N ATOM 0 H ARG A 68 -1.697 3.548 -0.691 1.00 0.00 H new ATOM 0 HA ARG A 68 -2.662 6.112 0.347 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.086 3.768 1.409 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -0.957 5.321 2.210 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -3.666 4.102 1.646 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.733 3.600 3.041 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -3.092 6.548 2.561 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.463 5.637 3.162 1.00 0.00 H new ATOM 0 HE ARG A 68 -2.075 5.052 4.700 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.627 7.437 4.186 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.514 8.081 5.827 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -1.937 5.885 6.807 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -2.998 7.207 7.304 1.00 0.00 H new ATOM 1085 N ARG A 69 0.484 5.493 -0.480 1.00 0.00 N ATOM 1086 CA ARG A 69 1.739 6.129 -0.863 1.00 0.00 C ATOM 1087 C ARG A 69 1.514 7.152 -1.972 1.00 0.00 C ATOM 1088 O ARG A 69 2.162 8.198 -2.006 1.00 0.00 O ATOM 1089 CB ARG A 69 2.749 5.076 -1.324 1.00 0.00 C ATOM 1090 CG ARG A 69 3.507 4.418 -0.182 1.00 0.00 C ATOM 1091 CD ARG A 69 4.583 3.475 -0.697 1.00 0.00 C ATOM 1092 NE ARG A 69 5.563 4.167 -1.530 1.00 0.00 N ATOM 1093 CZ ARG A 69 5.398 4.388 -2.829 1.00 0.00 C ATOM 1094 NH1 ARG A 69 4.297 3.975 -3.441 1.00 0.00 N ATOM 1095 NH2 ARG A 69 6.336 5.025 -3.519 1.00 0.00 N ATOM 0 H ARG A 69 0.502 4.473 -0.505 1.00 0.00 H new ATOM 0 HA ARG A 69 2.136 6.647 0.010 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.226 4.307 -1.892 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.464 5.543 -2.002 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.963 5.186 0.443 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.810 3.866 0.449 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.090 3.008 0.147 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.118 2.674 -1.273 1.00 0.00 H new ATOM 0 HE ARG A 69 6.421 4.499 -1.090 1.00 0.00 H new ATOM 0 HH11 ARG A 69 3.573 3.486 -2.914 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.173 4.146 -4.439 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.184 5.345 -3.052 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.209 5.194 -4.517 1.00 0.00 H new ATOM 1109 N MET A 70 0.592 6.842 -2.878 1.00 0.00 N ATOM 1110 CA MET A 70 0.281 7.735 -3.988 1.00 0.00 C ATOM 1111 C MET A 70 -0.209 9.087 -3.478 1.00 0.00 C ATOM 1112 O MET A 70 0.215 10.136 -3.963 1.00 0.00 O ATOM 1113 CB MET A 70 -0.777 7.106 -4.896 1.00 0.00 C ATOM 1114 CG MET A 70 -2.136 6.955 -4.232 1.00 0.00 C ATOM 1115 SD MET A 70 -3.360 6.200 -5.319 1.00 0.00 S ATOM 1116 CE MET A 70 -4.734 7.332 -5.119 1.00 0.00 C ATOM 0 H MET A 70 0.048 5.980 -2.865 1.00 0.00 H new ATOM 0 HA MET A 70 1.195 7.892 -4.561 1.00 0.00 H new ATOM 0 HB2 MET A 70 -0.885 7.718 -5.792 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.429 6.125 -5.220 1.00 0.00 H new ATOM 0 HG2 MET A 70 -2.031 6.348 -3.333 1.00 0.00 H new ATOM 0 HG3 MET A 70 -2.492 7.935 -3.916 1.00 0.00 H new ATOM 0 HE1 MET A 70 -5.572 6.999 -5.731 1.00 0.00 H new ATOM 0 HE2 MET A 70 -5.036 7.356 -4.072 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.431 8.331 -5.432 1.00 0.00 H new ATOM 1126 N LYS A 71 -1.104 9.054 -2.496 1.00 0.00 N ATOM 1127 CA LYS A 71 -1.652 10.276 -1.919 1.00 0.00 C ATOM 1128 C LYS A 71 -0.671 10.898 -0.931 1.00 0.00 C ATOM 1129 O LYS A 71 -0.736 12.094 -0.646 1.00 0.00 O ATOM 1130 CB LYS A 71 -2.980 9.983 -1.218 1.00 0.00 C ATOM 1131 CG LYS A 71 -3.630 11.212 -0.607 1.00 0.00 C ATOM 1132 CD LYS A 71 -4.748 10.834 0.350 1.00 0.00 C ATOM 1133 CE LYS A 71 -5.767 11.955 0.488 1.00 0.00 C ATOM 1134 NZ LYS A 71 -6.927 11.550 1.329 1.00 0.00 N ATOM 0 H LYS A 71 -1.465 8.194 -2.083 1.00 0.00 H new ATOM 0 HA LYS A 71 -1.824 10.985 -2.729 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -3.669 9.537 -1.935 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.812 9.244 -0.435 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -2.878 11.797 -0.077 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.027 11.847 -1.399 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.244 9.932 -0.007 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -4.328 10.601 1.328 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.287 12.829 0.928 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -6.120 12.248 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.598 12.341 1.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.400 10.731 0.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.594 11.294 2.280 1.00 0.00 H new ATOM 1148 N TRP A 72 0.238 10.080 -0.412 1.00 0.00 N ATOM 1149 CA TRP A 72 1.234 10.552 0.543 1.00 0.00 C ATOM 1150 C TRP A 72 2.349 11.314 -0.164 1.00 0.00 C ATOM 1151 O TRP A 72 2.803 12.354 0.312 1.00 0.00 O ATOM 1152 CB TRP A 72 1.820 9.373 1.324 1.00 0.00 C ATOM 1153 CG TRP A 72 3.174 9.657 1.899 1.00 0.00 C ATOM 1154 CD1 TRP A 72 3.450 10.349 3.044 1.00 0.00 C ATOM 1155 CD2 TRP A 72 4.437 9.257 1.355 1.00 0.00 C ATOM 1156 NE1 TRP A 72 4.808 10.403 3.244 1.00 0.00 N ATOM 1157 CE2 TRP A 72 5.436 9.740 2.223 1.00 0.00 C ATOM 1158 CE3 TRP A 72 4.821 8.537 0.221 1.00 0.00 C ATOM 1159 CZ2 TRP A 72 6.792 9.526 1.990 1.00 0.00 C ATOM 1160 CZ3 TRP A 72 6.167 8.325 -0.009 1.00 0.00 C ATOM 1161 CH2 TRP A 72 7.139 8.817 0.872 1.00 0.00 C ATOM 0 H TRP A 72 0.306 9.087 -0.636 1.00 0.00 H new ATOM 0 HA TRP A 72 0.741 11.231 1.239 1.00 0.00 H new ATOM 0 HB2 TRP A 72 1.138 9.107 2.132 1.00 0.00 H new ATOM 0 HB3 TRP A 72 1.887 8.507 0.665 1.00 0.00 H new ATOM 0 HD1 TRP A 72 2.710 10.789 3.696 1.00 0.00 H new ATOM 0 HE1 TRP A 72 5.274 10.863 4.027 1.00 0.00 H new ATOM 0 HE3 TRP A 72 4.079 8.153 -0.464 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 7.543 9.906 2.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 6.475 7.770 -0.883 1.00 0.00 H new ATOM 0 HH2 TRP A 72 8.183 8.633 0.665 1.00 0.00 H new ATOM 1172 N LYS A 73 2.787 10.790 -1.304 1.00 0.00 N ATOM 1173 CA LYS A 73 3.849 11.421 -2.078 1.00 0.00 C ATOM 1174 C LYS A 73 3.537 12.893 -2.330 1.00 0.00 C ATOM 1175 O LYS A 73 2.538 13.227 -2.968 1.00 0.00 O ATOM 1176 CB LYS A 73 4.037 10.694 -3.412 1.00 0.00 C ATOM 1177 CG LYS A 73 4.982 9.508 -3.329 1.00 0.00 C ATOM 1178 CD LYS A 73 5.379 9.014 -4.710 1.00 0.00 C ATOM 1179 CE LYS A 73 6.477 9.875 -5.316 1.00 0.00 C ATOM 1180 NZ LYS A 73 7.815 9.546 -4.752 1.00 0.00 N ATOM 0 H LYS A 73 2.422 9.929 -1.712 1.00 0.00 H new ATOM 0 HA LYS A 73 4.772 11.356 -1.502 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.066 10.350 -3.769 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.417 11.400 -4.151 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.875 9.792 -2.772 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.505 8.699 -2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.720 7.981 -4.644 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.507 9.020 -5.364 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.494 9.734 -6.397 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.255 10.927 -5.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.425 10.387 -4.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.710 9.242 -3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.246 8.779 -5.306 1.00 0.00 H new ATOM 1194 N LYS A 74 4.398 13.770 -1.825 1.00 0.00 N ATOM 1195 CA LYS A 74 4.217 15.207 -1.997 1.00 0.00 C ATOM 1196 C LYS A 74 4.144 15.573 -3.476 1.00 0.00 C ATOM 1197 O LYS A 74 3.235 16.282 -3.906 1.00 0.00 O ATOM 1198 CB LYS A 74 5.362 15.970 -1.328 1.00 0.00 C ATOM 1199 CG LYS A 74 5.104 16.296 0.133 1.00 0.00 C ATOM 1200 CD LYS A 74 6.100 17.314 0.662 1.00 0.00 C ATOM 1201 CE LYS A 74 7.407 16.652 1.073 1.00 0.00 C ATOM 1202 NZ LYS A 74 8.098 17.413 2.151 1.00 0.00 N ATOM 0 H LYS A 74 5.229 13.511 -1.293 1.00 0.00 H new ATOM 0 HA LYS A 74 3.276 15.488 -1.524 1.00 0.00 H new ATOM 0 HB2 LYS A 74 6.275 15.379 -1.404 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.537 16.898 -1.873 1.00 0.00 H new ATOM 0 HG2 LYS A 74 4.092 16.683 0.247 1.00 0.00 H new ATOM 0 HG3 LYS A 74 5.165 15.384 0.726 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.296 18.065 -0.103 1.00 0.00 H new ATOM 0 HD3 LYS A 74 5.670 17.835 1.517 1.00 0.00 H new ATOM 0 HE2 LYS A 74 7.208 15.636 1.415 1.00 0.00 H new ATOM 0 HE3 LYS A 74 8.063 16.573 0.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 8.984 16.930 2.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.311 18.374 1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 7.482 17.466 2.988 1.00 0.00 H new ATOM 1216 N SER A 75 5.107 15.083 -4.251 1.00 0.00 N ATOM 1217 CA SER A 75 5.153 15.361 -5.681 1.00 0.00 C ATOM 1218 C SER A 75 4.397 14.294 -6.467 1.00 0.00 C ATOM 1219 O SER A 75 4.946 13.668 -7.372 1.00 0.00 O ATOM 1220 CB SER A 75 6.604 15.432 -6.162 1.00 0.00 C ATOM 1221 OG SER A 75 6.707 16.177 -7.364 1.00 0.00 O ATOM 0 H SER A 75 5.866 14.492 -3.912 1.00 0.00 H new ATOM 0 HA SER A 75 4.672 16.324 -5.854 1.00 0.00 H new ATOM 0 HB2 SER A 75 7.224 15.891 -5.392 1.00 0.00 H new ATOM 0 HB3 SER A 75 6.987 14.424 -6.321 1.00 0.00 H new ATOM 0 HG SER A 75 7.644 16.209 -7.650 1.00 0.00 H new ATOM 1227 N GLY A 76 3.131 14.092 -6.112 1.00 0.00 N ATOM 1228 CA GLY A 76 2.319 13.100 -6.792 1.00 0.00 C ATOM 1229 C GLY A 76 1.456 13.705 -7.880 1.00 0.00 C ATOM 1230 O GLY A 76 0.961 14.826 -7.758 1.00 0.00 O ATOM 0 H GLY A 76 2.654 14.598 -5.366 1.00 0.00 H new ATOM 0 HA2 GLY A 76 2.968 12.340 -7.228 1.00 0.00 H new ATOM 0 HA3 GLY A 76 1.682 12.596 -6.065 1.00 0.00 H new ATOM 1234 N PRO A 77 1.265 12.955 -8.976 1.00 0.00 N ATOM 1235 CA PRO A 77 0.455 13.405 -10.112 1.00 0.00 C ATOM 1236 C PRO A 77 -1.031 13.467 -9.776 1.00 0.00 C ATOM 1237 O PRO A 77 -1.829 14.002 -10.547 1.00 0.00 O ATOM 1238 CB PRO A 77 0.718 12.339 -11.179 1.00 0.00 C ATOM 1239 CG PRO A 77 1.097 11.120 -10.411 1.00 0.00 C ATOM 1240 CD PRO A 77 1.824 11.610 -9.189 1.00 0.00 C ATOM 0 HA PRO A 77 0.718 14.415 -10.425 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.168 12.163 -11.789 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.516 12.645 -11.856 1.00 0.00 H new ATOM 0 HG2 PRO A 77 0.215 10.543 -10.135 1.00 0.00 H new ATOM 0 HG3 PRO A 77 1.733 10.465 -11.007 1.00 0.00 H new ATOM 0 HD2 PRO A 77 1.649 10.962 -8.330 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.902 11.643 -9.349 1.00 0.00 H new ATOM 1248 N SER A 78 -1.396 12.919 -8.622 1.00 0.00 N ATOM 1249 CA SER A 78 -2.787 12.909 -8.186 1.00 0.00 C ATOM 1250 C SER A 78 -3.139 14.206 -7.464 1.00 0.00 C ATOM 1251 O SER A 78 -2.436 14.629 -6.546 1.00 0.00 O ATOM 1252 CB SER A 78 -3.048 11.714 -7.268 1.00 0.00 C ATOM 1253 OG SER A 78 -2.538 11.949 -5.967 1.00 0.00 O ATOM 0 H SER A 78 -0.747 12.476 -7.972 1.00 0.00 H new ATOM 0 HA SER A 78 -3.418 12.823 -9.070 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.119 11.521 -7.213 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.585 10.821 -7.688 1.00 0.00 H new ATOM 0 HG SER A 78 -2.719 11.171 -5.399 1.00 0.00 H new ATOM 1259 N SER A 79 -4.233 14.833 -7.885 1.00 0.00 N ATOM 1260 CA SER A 79 -4.677 16.084 -7.282 1.00 0.00 C ATOM 1261 C SER A 79 -5.840 15.842 -6.324 1.00 0.00 C ATOM 1262 O SER A 79 -6.450 14.774 -6.328 1.00 0.00 O ATOM 1263 CB SER A 79 -5.094 17.079 -8.367 1.00 0.00 C ATOM 1264 OG SER A 79 -6.264 16.642 -9.037 1.00 0.00 O ATOM 0 H SER A 79 -4.828 14.495 -8.641 1.00 0.00 H new ATOM 0 HA SER A 79 -3.844 16.502 -6.717 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.271 18.057 -7.919 1.00 0.00 H new ATOM 0 HB3 SER A 79 -4.283 17.199 -9.085 1.00 0.00 H new ATOM 0 HG SER A 79 -6.511 17.296 -9.724 1.00 0.00 H new ATOM 1270 N GLY A 80 -6.141 16.844 -5.504 1.00 0.00 N ATOM 1271 CA GLY A 80 -7.229 16.722 -4.551 1.00 0.00 C ATOM 1272 C GLY A 80 -8.585 16.652 -5.226 1.00 0.00 C ATOM 1273 O GLY A 80 -9.049 17.633 -5.806 1.00 0.00 O ATOM 0 H GLY A 80 -5.651 17.738 -5.482 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.080 15.827 -3.947 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.209 17.573 -3.870 1.00 0.00 H new TER 1277 GLY A 80