USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 786 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 22 SER OG : rot 180:sc=-0.00506 USER MOD Set 1.2: A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.0323 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 85:sc= 0.103 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 27:sc= 0.147 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 23:sc= 0.245 USER MOD Single : A 41 TYR OH : rot 30:sc= -0.0203 USER MOD Single : A 44 LYS NZ :NH3+ -117:sc= -1.72! (180deg=-5.43!) USER MOD Single : A 45 TYR OH : rot -140:sc= -2.65 USER MOD Single : A 46 HIS : no HD1:sc= -0.0452 X(o=-0.045,f=-0.0019) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -60:sc= 0.21 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot -112:sc= -0.0242 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -7.84! C(o=-7.8!,f=-7.5!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot -170:sc= 0 USER MOD Single : A 77 TYR OH : rot 130:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.178 K(o=-0.18,f=-2.2!) USER MOD Single : A 85 SER OG : rot 180:sc= -0.038 USER MOD Single : A 89 TYR OH : rot -126:sc= 0.0593 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 96 HIS : no HD1:sc= -6.91! C(o=-6.9!,f=-7!) USER MOD Single : A 97 HIS : no HE2:sc= -0.335 K(o=-0.33,f=-1.7) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 THR OG1 : rot 120:sc= -0.139 USER MOD Single : A 101 GLN : amide:sc=-0.00701 K(o=-0.007,f=-1.9!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -0.0123 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.410 21.179 12.021 1.00 0.00 N ATOM 2 CA GLY A 1 6.004 20.340 13.134 1.00 0.00 C ATOM 3 C GLY A 1 7.185 19.829 13.935 1.00 0.00 C ATOM 4 O GLY A 1 8.226 20.483 14.004 1.00 0.00 O ATOM 0 H1 GLY A 1 5.877 22.072 12.047 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.428 21.381 12.092 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.217 20.686 11.126 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.342 20.906 13.789 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.431 19.493 12.757 1.00 0.00 H new ATOM 8 N SER A 2 7.024 18.659 14.544 1.00 0.00 N ATOM 9 CA SER A 2 8.084 18.064 15.350 1.00 0.00 C ATOM 10 C SER A 2 8.634 16.808 14.681 1.00 0.00 C ATOM 11 O SER A 2 7.931 15.808 14.539 1.00 0.00 O ATOM 12 CB SER A 2 7.562 17.724 16.747 1.00 0.00 C ATOM 13 OG SER A 2 7.260 18.900 17.478 1.00 0.00 O ATOM 0 H SER A 2 6.170 18.104 14.495 1.00 0.00 H new ATOM 0 HA SER A 2 8.891 18.791 15.439 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.669 17.104 16.664 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.308 17.139 17.285 1.00 0.00 H new ATOM 0 HG SER A 2 6.927 18.656 18.367 1.00 0.00 H new ATOM 19 N SER A 3 9.897 16.868 14.272 1.00 0.00 N ATOM 20 CA SER A 3 10.543 15.737 13.615 1.00 0.00 C ATOM 21 C SER A 3 10.687 14.560 14.575 1.00 0.00 C ATOM 22 O SER A 3 11.285 14.685 15.642 1.00 0.00 O ATOM 23 CB SER A 3 11.917 16.147 13.082 1.00 0.00 C ATOM 24 OG SER A 3 12.512 15.094 12.343 1.00 0.00 O ATOM 0 H SER A 3 10.494 17.688 14.384 1.00 0.00 H new ATOM 0 HA SER A 3 9.915 15.427 12.780 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.817 17.029 12.449 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.565 16.424 13.913 1.00 0.00 H new ATOM 0 HG SER A 3 13.388 15.381 12.012 1.00 0.00 H new ATOM 30 N GLY A 4 10.132 13.416 14.186 1.00 0.00 N ATOM 31 CA GLY A 4 10.209 12.233 15.023 1.00 0.00 C ATOM 32 C GLY A 4 11.429 11.386 14.719 1.00 0.00 C ATOM 33 O GLY A 4 12.358 11.312 15.523 1.00 0.00 O ATOM 0 H GLY A 4 9.631 13.288 13.307 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.231 12.534 16.070 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.310 11.633 14.882 1.00 0.00 H new ATOM 37 N SER A 5 11.427 10.743 13.555 1.00 0.00 N ATOM 38 CA SER A 5 12.539 9.893 13.149 1.00 0.00 C ATOM 39 C SER A 5 12.888 10.118 11.681 1.00 0.00 C ATOM 40 O SER A 5 12.028 10.023 10.805 1.00 0.00 O ATOM 41 CB SER A 5 12.195 8.421 13.383 1.00 0.00 C ATOM 42 OG SER A 5 11.803 8.195 14.726 1.00 0.00 O ATOM 0 H SER A 5 10.667 10.795 12.877 1.00 0.00 H new ATOM 0 HA SER A 5 13.406 10.157 13.755 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.391 8.121 12.711 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.058 7.800 13.144 1.00 0.00 H new ATOM 0 HG SER A 5 11.587 7.247 14.849 1.00 0.00 H new ATOM 48 N SER A 6 14.157 10.418 11.420 1.00 0.00 N ATOM 49 CA SER A 6 14.620 10.662 10.059 1.00 0.00 C ATOM 50 C SER A 6 14.887 9.347 9.333 1.00 0.00 C ATOM 51 O SER A 6 15.990 8.806 9.390 1.00 0.00 O ATOM 52 CB SER A 6 15.890 11.516 10.075 1.00 0.00 C ATOM 53 OG SER A 6 15.637 12.796 10.628 1.00 0.00 O ATOM 0 H SER A 6 14.882 10.498 12.133 1.00 0.00 H new ATOM 0 HA SER A 6 13.836 11.199 9.525 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.663 11.012 10.655 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.272 11.624 9.060 1.00 0.00 H new ATOM 0 HG SER A 6 16.464 13.321 10.629 1.00 0.00 H new ATOM 59 N GLY A 7 13.866 8.838 8.649 1.00 0.00 N ATOM 60 CA GLY A 7 14.010 7.591 7.921 1.00 0.00 C ATOM 61 C GLY A 7 14.149 7.804 6.427 1.00 0.00 C ATOM 62 O GLY A 7 14.532 8.880 5.965 1.00 0.00 O ATOM 0 H GLY A 7 12.943 9.267 8.586 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.885 7.057 8.292 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.144 6.958 8.116 1.00 0.00 H new ATOM 66 N PRO A 8 13.836 6.761 5.644 1.00 0.00 N ATOM 67 CA PRO A 8 13.922 6.815 4.182 1.00 0.00 C ATOM 68 C PRO A 8 12.856 7.718 3.571 1.00 0.00 C ATOM 69 O PRO A 8 11.913 8.144 4.238 1.00 0.00 O ATOM 70 CB PRO A 8 13.696 5.361 3.760 1.00 0.00 C ATOM 71 CG PRO A 8 12.908 4.761 4.873 1.00 0.00 C ATOM 72 CD PRO A 8 13.373 5.449 6.127 1.00 0.00 C ATOM 0 HA PRO A 8 14.872 7.229 3.845 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.155 5.303 2.816 1.00 0.00 H new ATOM 0 HB3 PRO A 8 14.642 4.838 3.618 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.839 4.910 4.719 1.00 0.00 H new ATOM 0 HG3 PRO A 8 13.074 3.685 4.933 1.00 0.00 H new ATOM 0 HD2 PRO A 8 12.566 5.550 6.853 1.00 0.00 H new ATOM 0 HD3 PRO A 8 14.174 4.895 6.616 1.00 0.00 H new ATOM 80 N PRO A 9 13.007 8.019 2.273 1.00 0.00 N ATOM 81 CA PRO A 9 12.066 8.874 1.544 1.00 0.00 C ATOM 82 C PRO A 9 10.715 8.200 1.331 1.00 0.00 C ATOM 83 O PRO A 9 10.645 7.002 1.058 1.00 0.00 O ATOM 84 CB PRO A 9 12.765 9.107 0.202 1.00 0.00 C ATOM 85 CG PRO A 9 13.661 7.929 0.033 1.00 0.00 C ATOM 86 CD PRO A 9 14.108 7.547 1.417 1.00 0.00 C ATOM 0 HA PRO A 9 11.843 9.791 2.089 1.00 0.00 H new ATOM 0 HB2 PRO A 9 12.045 9.177 -0.613 1.00 0.00 H new ATOM 0 HB3 PRO A 9 13.332 10.038 0.207 1.00 0.00 H new ATOM 0 HG2 PRO A 9 13.135 7.105 -0.449 1.00 0.00 H new ATOM 0 HG3 PRO A 9 14.514 8.175 -0.599 1.00 0.00 H new ATOM 0 HD2 PRO A 9 14.256 6.471 1.509 1.00 0.00 H new ATOM 0 HD3 PRO A 9 15.053 8.022 1.680 1.00 0.00 H new ATOM 94 N ALA A 10 9.645 8.977 1.459 1.00 0.00 N ATOM 95 CA ALA A 10 8.296 8.455 1.278 1.00 0.00 C ATOM 96 C ALA A 10 8.147 7.775 -0.078 1.00 0.00 C ATOM 97 O ALA A 10 8.325 8.404 -1.122 1.00 0.00 O ATOM 98 CB ALA A 10 7.273 9.573 1.425 1.00 0.00 C ATOM 0 H ALA A 10 9.686 9.970 1.687 1.00 0.00 H new ATOM 0 HA ALA A 10 8.116 7.708 2.051 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.270 9.169 1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.354 10.012 2.419 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.461 10.340 0.674 1.00 0.00 H new ATOM 104 N VAL A 11 7.822 6.487 -0.057 1.00 0.00 N ATOM 105 CA VAL A 11 7.649 5.721 -1.286 1.00 0.00 C ATOM 106 C VAL A 11 6.893 6.528 -2.335 1.00 0.00 C ATOM 107 O VAL A 11 5.750 6.930 -2.119 1.00 0.00 O ATOM 108 CB VAL A 11 6.894 4.404 -1.025 1.00 0.00 C ATOM 109 CG1 VAL A 11 6.649 3.662 -2.330 1.00 0.00 C ATOM 110 CG2 VAL A 11 7.665 3.534 -0.043 1.00 0.00 C ATOM 0 H VAL A 11 7.673 5.951 0.798 1.00 0.00 H new ATOM 0 HA VAL A 11 8.647 5.491 -1.659 1.00 0.00 H new ATOM 0 HB VAL A 11 5.926 4.641 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.115 2.734 -2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.053 4.285 -2.997 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.604 3.434 -2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.117 2.608 0.130 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.647 3.303 -0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.783 4.067 0.900 1.00 0.00 H new ATOM 120 N SER A 12 7.540 6.763 -3.472 1.00 0.00 N ATOM 121 CA SER A 12 6.930 7.526 -4.555 1.00 0.00 C ATOM 122 C SER A 12 6.734 6.653 -5.791 1.00 0.00 C ATOM 123 O SER A 12 7.108 5.480 -5.802 1.00 0.00 O ATOM 124 CB SER A 12 7.796 8.737 -4.904 1.00 0.00 C ATOM 125 OG SER A 12 8.865 8.371 -5.759 1.00 0.00 O ATOM 0 H SER A 12 8.486 6.436 -3.667 1.00 0.00 H new ATOM 0 HA SER A 12 5.953 7.872 -4.218 1.00 0.00 H new ATOM 0 HB2 SER A 12 7.184 9.498 -5.388 1.00 0.00 H new ATOM 0 HB3 SER A 12 8.192 9.180 -3.990 1.00 0.00 H new ATOM 0 HG SER A 12 8.556 8.374 -6.689 1.00 0.00 H new ATOM 131 N ASP A 13 6.146 7.234 -6.830 1.00 0.00 N ATOM 132 CA ASP A 13 5.900 6.511 -8.073 1.00 0.00 C ATOM 133 C ASP A 13 5.266 5.152 -7.795 1.00 0.00 C ATOM 134 O ASP A 13 5.780 4.118 -8.222 1.00 0.00 O ATOM 135 CB ASP A 13 7.206 6.330 -8.849 1.00 0.00 C ATOM 136 CG ASP A 13 7.785 7.648 -9.323 1.00 0.00 C ATOM 137 OD1 ASP A 13 7.137 8.317 -10.155 1.00 0.00 O ATOM 138 OD2 ASP A 13 8.887 8.011 -8.861 1.00 0.00 O ATOM 0 H ASP A 13 5.830 8.204 -6.837 1.00 0.00 H new ATOM 0 HA ASP A 13 5.207 7.098 -8.675 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.934 5.823 -8.216 1.00 0.00 H new ATOM 0 HB3 ASP A 13 7.028 5.685 -9.709 1.00 0.00 H new ATOM 143 N ILE A 14 4.149 5.162 -7.075 1.00 0.00 N ATOM 144 CA ILE A 14 3.446 3.930 -6.740 1.00 0.00 C ATOM 145 C ILE A 14 2.377 3.608 -7.778 1.00 0.00 C ATOM 146 O ILE A 14 1.446 4.386 -7.988 1.00 0.00 O ATOM 147 CB ILE A 14 2.786 4.018 -5.351 1.00 0.00 C ATOM 148 CG1 ILE A 14 3.832 4.357 -4.287 1.00 0.00 C ATOM 149 CG2 ILE A 14 2.084 2.711 -5.014 1.00 0.00 C ATOM 150 CD1 ILE A 14 3.233 4.774 -2.962 1.00 0.00 C ATOM 0 H ILE A 14 3.712 6.009 -6.713 1.00 0.00 H new ATOM 0 HA ILE A 14 4.191 3.134 -6.730 1.00 0.00 H new ATOM 0 HB ILE A 14 2.041 4.813 -5.368 1.00 0.00 H new ATOM 0 HG12 ILE A 14 4.473 3.489 -4.130 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.468 5.160 -4.658 1.00 0.00 H new ATOM 0 HG21 ILE A 14 1.623 2.789 -4.030 1.00 0.00 H new ATOM 0 HG22 ILE A 14 1.315 2.508 -5.760 1.00 0.00 H new ATOM 0 HG23 ILE A 14 2.810 1.898 -5.011 1.00 0.00 H new ATOM 0 HD11 ILE A 14 4.032 4.999 -2.256 1.00 0.00 H new ATOM 0 HD12 ILE A 14 2.615 5.660 -3.105 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.619 3.963 -2.569 1.00 0.00 H new ATOM 162 N ARG A 15 2.516 2.455 -8.425 1.00 0.00 N ATOM 163 CA ARG A 15 1.561 2.029 -9.441 1.00 0.00 C ATOM 164 C ARG A 15 1.024 0.634 -9.132 1.00 0.00 C ATOM 165 O ARG A 15 1.601 -0.101 -8.331 1.00 0.00 O ATOM 166 CB ARG A 15 2.217 2.040 -10.824 1.00 0.00 C ATOM 167 CG ARG A 15 2.138 3.386 -11.524 1.00 0.00 C ATOM 168 CD ARG A 15 2.761 3.330 -12.911 1.00 0.00 C ATOM 169 NE ARG A 15 1.787 2.956 -13.933 1.00 0.00 N ATOM 170 CZ ARG A 15 1.934 3.232 -15.224 1.00 0.00 C ATOM 171 NH1 ARG A 15 3.010 3.881 -15.648 1.00 0.00 N ATOM 172 NH2 ARG A 15 1.005 2.859 -16.094 1.00 0.00 N ATOM 0 H ARG A 15 3.281 1.799 -8.264 1.00 0.00 H new ATOM 0 HA ARG A 15 0.726 2.730 -9.436 1.00 0.00 H new ATOM 0 HB2 ARG A 15 3.264 1.753 -10.723 1.00 0.00 H new ATOM 0 HB3 ARG A 15 1.739 1.286 -11.450 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.096 3.695 -11.604 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.649 4.140 -10.925 1.00 0.00 H new ATOM 0 HD2 ARG A 15 3.189 4.302 -13.156 1.00 0.00 H new ATOM 0 HD3 ARG A 15 3.581 2.612 -12.911 1.00 0.00 H new ATOM 0 HE ARG A 15 0.948 2.456 -13.639 1.00 0.00 H new ATOM 0 HH11 ARG A 15 3.727 4.169 -14.982 1.00 0.00 H new ATOM 0 HH12 ARG A 15 3.121 4.092 -16.640 1.00 0.00 H new ATOM 0 HH21 ARG A 15 0.176 2.359 -15.772 1.00 0.00 H new ATOM 0 HH22 ARG A 15 1.119 3.072 -17.085 1.00 0.00 H new ATOM 186 N VAL A 16 -0.084 0.277 -9.773 1.00 0.00 N ATOM 187 CA VAL A 16 -0.699 -1.029 -9.568 1.00 0.00 C ATOM 188 C VAL A 16 -0.528 -1.916 -10.796 1.00 0.00 C ATOM 189 O VAL A 16 -0.927 -1.549 -11.902 1.00 0.00 O ATOM 190 CB VAL A 16 -2.200 -0.898 -9.247 1.00 0.00 C ATOM 191 CG1 VAL A 16 -2.764 -2.231 -8.780 1.00 0.00 C ATOM 192 CG2 VAL A 16 -2.428 0.183 -8.201 1.00 0.00 C ATOM 0 H VAL A 16 -0.574 0.874 -10.439 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.192 -1.488 -8.719 1.00 0.00 H new ATOM 0 HB VAL A 16 -2.725 -0.608 -10.157 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.825 -2.119 -8.558 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -2.634 -2.976 -9.565 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -2.237 -2.554 -7.882 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.494 0.262 -7.986 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -1.892 -0.075 -7.288 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -2.062 1.138 -8.579 1.00 0.00 H new ATOM 202 N THR A 17 0.067 -3.087 -10.595 1.00 0.00 N ATOM 203 CA THR A 17 0.291 -4.028 -11.685 1.00 0.00 C ATOM 204 C THR A 17 -0.642 -5.228 -11.577 1.00 0.00 C ATOM 205 O THR A 17 -1.156 -5.532 -10.500 1.00 0.00 O ATOM 206 CB THR A 17 1.749 -4.526 -11.707 1.00 0.00 C ATOM 207 OG1 THR A 17 2.003 -5.246 -12.918 1.00 0.00 O ATOM 208 CG2 THR A 17 2.033 -5.420 -10.510 1.00 0.00 C ATOM 0 H THR A 17 0.403 -3.407 -9.686 1.00 0.00 H new ATOM 0 HA THR A 17 0.083 -3.493 -12.611 1.00 0.00 H new ATOM 0 HB THR A 17 2.407 -3.658 -11.657 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.932 -5.557 -12.925 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.068 -5.759 -10.547 1.00 0.00 H new ATOM 0 HG22 THR A 17 1.867 -4.860 -9.590 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.367 -6.283 -10.534 1.00 0.00 H new ATOM 216 N ARG A 18 -0.857 -5.908 -12.699 1.00 0.00 N ATOM 217 CA ARG A 18 -1.729 -7.075 -12.729 1.00 0.00 C ATOM 218 C ARG A 18 -2.904 -6.902 -11.771 1.00 0.00 C ATOM 219 O ARG A 18 -3.183 -7.777 -10.951 1.00 0.00 O ATOM 220 CB ARG A 18 -0.943 -8.336 -12.366 1.00 0.00 C ATOM 221 CG ARG A 18 -0.203 -8.952 -13.542 1.00 0.00 C ATOM 222 CD ARG A 18 0.610 -7.911 -14.296 1.00 0.00 C ATOM 223 NE ARG A 18 1.404 -8.507 -15.367 1.00 0.00 N ATOM 224 CZ ARG A 18 2.402 -7.878 -15.979 1.00 0.00 C ATOM 225 NH1 ARG A 18 2.725 -6.641 -15.628 1.00 0.00 N ATOM 226 NH2 ARG A 18 3.078 -8.487 -16.945 1.00 0.00 N ATOM 0 H ARG A 18 -0.439 -5.670 -13.599 1.00 0.00 H new ATOM 0 HA ARG A 18 -2.120 -7.178 -13.741 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.225 -8.093 -11.583 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -1.629 -9.075 -11.952 1.00 0.00 H new ATOM 0 HG2 ARG A 18 0.458 -9.742 -13.184 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.918 -9.417 -14.220 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.061 -7.162 -14.716 1.00 0.00 H new ATOM 0 HD3 ARG A 18 1.270 -7.393 -13.600 1.00 0.00 H new ATOM 0 HE ARG A 18 1.180 -9.458 -15.661 1.00 0.00 H new ATOM 0 HH11 ARG A 18 2.207 -6.170 -14.886 1.00 0.00 H new ATOM 0 HH12 ARG A 18 3.491 -6.161 -16.099 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.832 -9.438 -17.218 1.00 0.00 H new ATOM 0 HH22 ARG A 18 3.844 -8.004 -17.414 1.00 0.00 H new ATOM 240 N SER A 19 -3.587 -5.767 -11.879 1.00 0.00 N ATOM 241 CA SER A 19 -4.728 -5.477 -11.019 1.00 0.00 C ATOM 242 C SER A 19 -5.833 -6.510 -11.216 1.00 0.00 C ATOM 243 O SER A 19 -5.881 -7.199 -12.235 1.00 0.00 O ATOM 244 CB SER A 19 -5.268 -4.075 -11.309 1.00 0.00 C ATOM 245 OG SER A 19 -6.075 -4.069 -12.474 1.00 0.00 O ATOM 0 H SER A 19 -3.370 -5.033 -12.554 1.00 0.00 H new ATOM 0 HA SER A 19 -4.392 -5.523 -9.983 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.851 -3.723 -10.458 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.437 -3.381 -11.435 1.00 0.00 H new ATOM 0 HG SER A 19 -6.409 -3.162 -12.636 1.00 0.00 H new ATOM 251 N SER A 20 -6.721 -6.612 -10.231 1.00 0.00 N ATOM 252 CA SER A 20 -7.824 -7.564 -10.293 1.00 0.00 C ATOM 253 C SER A 20 -9.042 -7.032 -9.544 1.00 0.00 C ATOM 254 O SER A 20 -8.939 -6.171 -8.670 1.00 0.00 O ATOM 255 CB SER A 20 -7.398 -8.910 -9.705 1.00 0.00 C ATOM 256 OG SER A 20 -6.777 -9.722 -10.687 1.00 0.00 O ATOM 0 H SER A 20 -6.698 -6.048 -9.382 1.00 0.00 H new ATOM 0 HA SER A 20 -8.094 -7.702 -11.340 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.710 -8.747 -8.876 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.269 -9.425 -9.300 1.00 0.00 H new ATOM 0 HG SER A 20 -6.370 -9.152 -11.373 1.00 0.00 H new ATOM 262 N PRO A 21 -10.226 -7.558 -9.893 1.00 0.00 N ATOM 263 CA PRO A 21 -11.488 -7.152 -9.266 1.00 0.00 C ATOM 264 C PRO A 21 -11.594 -7.623 -7.820 1.00 0.00 C ATOM 265 O PRO A 21 -12.223 -6.968 -6.988 1.00 0.00 O ATOM 266 CB PRO A 21 -12.549 -7.836 -10.131 1.00 0.00 C ATOM 267 CG PRO A 21 -11.853 -9.011 -10.726 1.00 0.00 C ATOM 268 CD PRO A 21 -10.424 -8.589 -10.925 1.00 0.00 C ATOM 0 HA PRO A 21 -11.591 -6.068 -9.220 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -13.407 -8.145 -9.534 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -12.923 -7.164 -10.904 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -11.916 -9.877 -10.067 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -12.311 -9.297 -11.673 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.736 -9.425 -10.795 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.258 -8.192 -11.927 1.00 0.00 H new ATOM 276 N SER A 22 -10.976 -8.763 -7.526 1.00 0.00 N ATOM 277 CA SER A 22 -11.005 -9.323 -6.180 1.00 0.00 C ATOM 278 C SER A 22 -9.697 -9.041 -5.447 1.00 0.00 C ATOM 279 O SER A 22 -9.689 -8.808 -4.238 1.00 0.00 O ATOM 280 CB SER A 22 -11.255 -10.831 -6.238 1.00 0.00 C ATOM 281 OG SER A 22 -10.094 -11.525 -6.661 1.00 0.00 O ATOM 0 H SER A 22 -10.449 -9.316 -8.202 1.00 0.00 H new ATOM 0 HA SER A 22 -11.819 -8.848 -5.632 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.559 -11.190 -5.255 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.077 -11.040 -6.922 1.00 0.00 H new ATOM 0 HG SER A 22 -10.280 -12.487 -6.688 1.00 0.00 H new ATOM 287 N SER A 23 -8.594 -9.065 -6.187 1.00 0.00 N ATOM 288 CA SER A 23 -7.279 -8.815 -5.607 1.00 0.00 C ATOM 289 C SER A 23 -6.625 -7.595 -6.249 1.00 0.00 C ATOM 290 O SER A 23 -7.075 -7.109 -7.287 1.00 0.00 O ATOM 291 CB SER A 23 -6.381 -10.041 -5.782 1.00 0.00 C ATOM 292 OG SER A 23 -7.069 -11.231 -5.438 1.00 0.00 O ATOM 0 H SER A 23 -8.584 -9.255 -7.189 1.00 0.00 H new ATOM 0 HA SER A 23 -7.409 -8.617 -4.543 1.00 0.00 H new ATOM 0 HB2 SER A 23 -6.039 -10.101 -6.815 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.493 -9.937 -5.158 1.00 0.00 H new ATOM 0 HG SER A 23 -6.474 -12.000 -5.560 1.00 0.00 H new ATOM 298 N LEU A 24 -5.560 -7.106 -5.624 1.00 0.00 N ATOM 299 CA LEU A 24 -4.842 -5.942 -6.133 1.00 0.00 C ATOM 300 C LEU A 24 -3.352 -6.042 -5.820 1.00 0.00 C ATOM 301 O LEU A 24 -2.943 -5.940 -4.663 1.00 0.00 O ATOM 302 CB LEU A 24 -5.417 -4.660 -5.530 1.00 0.00 C ATOM 303 CG LEU A 24 -6.941 -4.535 -5.546 1.00 0.00 C ATOM 304 CD1 LEU A 24 -7.399 -3.467 -4.565 1.00 0.00 C ATOM 305 CD2 LEU A 24 -7.435 -4.219 -6.950 1.00 0.00 C ATOM 0 H LEU A 24 -5.174 -7.497 -4.764 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.966 -5.914 -7.216 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.077 -4.584 -4.497 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.997 -3.810 -6.067 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.368 -5.489 -5.238 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.486 -3.392 -4.590 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.077 -3.735 -3.559 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.963 -2.507 -4.842 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.522 -4.134 -6.943 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.999 -3.278 -7.286 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.138 -5.019 -7.629 1.00 0.00 H new ATOM 317 N SER A 25 -2.546 -6.240 -6.858 1.00 0.00 N ATOM 318 CA SER A 25 -1.102 -6.355 -6.693 1.00 0.00 C ATOM 319 C SER A 25 -0.446 -4.978 -6.678 1.00 0.00 C ATOM 320 O SER A 25 -0.515 -4.233 -7.657 1.00 0.00 O ATOM 321 CB SER A 25 -0.505 -7.204 -7.817 1.00 0.00 C ATOM 322 OG SER A 25 0.789 -7.668 -7.474 1.00 0.00 O ATOM 0 H SER A 25 -2.868 -6.324 -7.822 1.00 0.00 H new ATOM 0 HA SER A 25 -0.908 -6.842 -5.737 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.157 -8.053 -8.021 1.00 0.00 H new ATOM 0 HB3 SER A 25 -0.453 -6.615 -8.733 1.00 0.00 H new ATOM 0 HG SER A 25 1.148 -8.209 -8.208 1.00 0.00 H new ATOM 328 N LEU A 26 0.190 -4.645 -5.560 1.00 0.00 N ATOM 329 CA LEU A 26 0.860 -3.357 -5.416 1.00 0.00 C ATOM 330 C LEU A 26 2.374 -3.516 -5.514 1.00 0.00 C ATOM 331 O LEU A 26 2.945 -4.460 -4.969 1.00 0.00 O ATOM 332 CB LEU A 26 0.489 -2.715 -4.078 1.00 0.00 C ATOM 333 CG LEU A 26 -1.001 -2.687 -3.737 1.00 0.00 C ATOM 334 CD1 LEU A 26 -1.202 -2.521 -2.238 1.00 0.00 C ATOM 335 CD2 LEU A 26 -1.702 -1.571 -4.498 1.00 0.00 C ATOM 0 H LEU A 26 0.256 -5.249 -4.740 1.00 0.00 H new ATOM 0 HA LEU A 26 0.528 -2.710 -6.228 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.013 -3.248 -3.285 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.861 -1.691 -4.074 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.441 -3.637 -4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.269 -2.503 -2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.735 -3.355 -1.714 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.747 -1.586 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.762 -1.566 -4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.259 -0.612 -4.227 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.588 -1.734 -5.570 1.00 0.00 H new ATOM 347 N ALA A 27 3.017 -2.586 -6.212 1.00 0.00 N ATOM 348 CA ALA A 27 4.465 -2.621 -6.378 1.00 0.00 C ATOM 349 C ALA A 27 5.016 -1.232 -6.686 1.00 0.00 C ATOM 350 O ALA A 27 4.597 -0.587 -7.647 1.00 0.00 O ATOM 351 CB ALA A 27 4.846 -3.598 -7.480 1.00 0.00 C ATOM 0 H ALA A 27 2.558 -1.799 -6.672 1.00 0.00 H new ATOM 0 HA ALA A 27 4.906 -2.958 -5.440 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.930 -3.614 -7.593 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.494 -4.596 -7.219 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.388 -3.285 -8.418 1.00 0.00 H new ATOM 357 N TRP A 28 5.955 -0.779 -5.865 1.00 0.00 N ATOM 358 CA TRP A 28 6.562 0.535 -6.049 1.00 0.00 C ATOM 359 C TRP A 28 8.039 0.406 -6.409 1.00 0.00 C ATOM 360 O TRP A 28 8.618 -0.676 -6.313 1.00 0.00 O ATOM 361 CB TRP A 28 6.405 1.375 -4.781 1.00 0.00 C ATOM 362 CG TRP A 28 6.453 0.565 -3.521 1.00 0.00 C ATOM 363 CD1 TRP A 28 7.386 0.649 -2.528 1.00 0.00 C ATOM 364 CD2 TRP A 28 5.529 -0.454 -3.122 1.00 0.00 C ATOM 365 NE1 TRP A 28 7.098 -0.256 -1.535 1.00 0.00 N ATOM 366 CE2 TRP A 28 5.963 -0.944 -1.875 1.00 0.00 C ATOM 367 CE3 TRP A 28 4.376 -0.997 -3.695 1.00 0.00 C ATOM 368 CZ2 TRP A 28 5.285 -1.952 -1.195 1.00 0.00 C ATOM 369 CZ3 TRP A 28 3.705 -1.998 -3.019 1.00 0.00 C ATOM 370 CH2 TRP A 28 4.160 -2.466 -1.779 1.00 0.00 C ATOM 0 H TRP A 28 6.313 -1.301 -5.065 1.00 0.00 H new ATOM 0 HA TRP A 28 6.048 1.033 -6.871 1.00 0.00 H new ATOM 0 HB2 TRP A 28 7.194 2.126 -4.752 1.00 0.00 H new ATOM 0 HB3 TRP A 28 5.457 1.911 -4.824 1.00 0.00 H new ATOM 0 HD1 TRP A 28 8.227 1.327 -2.524 1.00 0.00 H new ATOM 0 HE1 TRP A 28 7.641 -0.393 -0.683 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.016 -0.641 -4.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 5.635 -2.315 -0.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.814 -2.427 -3.454 1.00 0.00 H new ATOM 0 HH2 TRP A 28 3.612 -3.248 -1.275 1.00 0.00 H new ATOM 381 N ALA A 29 8.642 1.516 -6.821 1.00 0.00 N ATOM 382 CA ALA A 29 10.051 1.527 -7.192 1.00 0.00 C ATOM 383 C ALA A 29 10.938 1.768 -5.975 1.00 0.00 C ATOM 384 O ALA A 29 10.862 2.819 -5.338 1.00 0.00 O ATOM 385 CB ALA A 29 10.309 2.586 -8.254 1.00 0.00 C ATOM 0 H ALA A 29 8.176 2.419 -6.906 1.00 0.00 H new ATOM 0 HA ALA A 29 10.301 0.548 -7.602 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.366 2.583 -8.522 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.710 2.368 -9.138 1.00 0.00 H new ATOM 0 HB3 ALA A 29 10.036 3.567 -7.864 1.00 0.00 H new ATOM 391 N VAL A 30 11.778 0.788 -5.657 1.00 0.00 N ATOM 392 CA VAL A 30 12.679 0.895 -4.516 1.00 0.00 C ATOM 393 C VAL A 30 13.368 2.254 -4.485 1.00 0.00 C ATOM 394 O VAL A 30 14.084 2.637 -5.411 1.00 0.00 O ATOM 395 CB VAL A 30 13.751 -0.211 -4.542 1.00 0.00 C ATOM 396 CG1 VAL A 30 14.697 -0.011 -5.717 1.00 0.00 C ATOM 397 CG2 VAL A 30 14.517 -0.241 -3.229 1.00 0.00 C ATOM 0 H VAL A 30 11.853 -0.088 -6.173 1.00 0.00 H new ATOM 0 HA VAL A 30 12.069 0.780 -3.620 1.00 0.00 H new ATOM 0 HB VAL A 30 13.253 -1.172 -4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 30 15.447 -0.802 -5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.132 -0.045 -6.649 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.190 0.957 -5.626 1.00 0.00 H new ATOM 0 HG21 VAL A 30 15.270 -1.028 -3.265 1.00 0.00 H new ATOM 0 HG22 VAL A 30 15.005 0.721 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 30 13.826 -0.437 -2.409 1.00 0.00 H new ATOM 407 N PRO A 31 13.149 3.003 -3.394 1.00 0.00 N ATOM 408 CA PRO A 31 13.741 4.332 -3.215 1.00 0.00 C ATOM 409 C PRO A 31 15.248 4.270 -2.990 1.00 0.00 C ATOM 410 O PRO A 31 15.830 3.188 -2.913 1.00 0.00 O ATOM 411 CB PRO A 31 13.036 4.869 -1.967 1.00 0.00 C ATOM 412 CG PRO A 31 12.620 3.653 -1.214 1.00 0.00 C ATOM 413 CD PRO A 31 12.308 2.611 -2.251 1.00 0.00 C ATOM 0 HA PRO A 31 13.611 4.958 -4.098 1.00 0.00 H new ATOM 0 HB2 PRO A 31 13.704 5.493 -1.373 1.00 0.00 H new ATOM 0 HB3 PRO A 31 12.176 5.484 -2.232 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.414 3.315 -0.548 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.749 3.858 -0.592 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.551 1.609 -1.899 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.250 2.609 -2.513 1.00 0.00 H new ATOM 421 N ARG A 32 15.875 5.437 -2.884 1.00 0.00 N ATOM 422 CA ARG A 32 17.315 5.515 -2.668 1.00 0.00 C ATOM 423 C ARG A 32 17.633 6.310 -1.406 1.00 0.00 C ATOM 424 O ARG A 32 17.336 7.501 -1.319 1.00 0.00 O ATOM 425 CB ARG A 32 17.999 6.159 -3.876 1.00 0.00 C ATOM 426 CG ARG A 32 17.768 5.410 -5.178 1.00 0.00 C ATOM 427 CD ARG A 32 18.388 6.141 -6.359 1.00 0.00 C ATOM 428 NE ARG A 32 18.583 5.259 -7.507 1.00 0.00 N ATOM 429 CZ ARG A 32 19.590 4.398 -7.609 1.00 0.00 C ATOM 430 NH1 ARG A 32 20.487 4.304 -6.637 1.00 0.00 N ATOM 431 NH2 ARG A 32 19.700 3.630 -8.685 1.00 0.00 N ATOM 0 H ARG A 32 15.408 6.342 -2.944 1.00 0.00 H new ATOM 0 HA ARG A 32 17.694 4.501 -2.542 1.00 0.00 H new ATOM 0 HB2 ARG A 32 17.637 7.181 -3.986 1.00 0.00 H new ATOM 0 HB3 ARG A 32 19.071 6.219 -3.687 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.194 4.409 -5.104 1.00 0.00 H new ATOM 0 HG3 ARG A 32 16.698 5.289 -5.345 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.747 6.974 -6.647 1.00 0.00 H new ATOM 0 HD3 ARG A 32 19.347 6.565 -6.060 1.00 0.00 H new ATOM 0 HE ARG A 32 17.910 5.307 -8.272 1.00 0.00 H new ATOM 0 HH11 ARG A 32 20.405 4.893 -5.809 1.00 0.00 H new ATOM 0 HH12 ARG A 32 21.259 3.642 -6.718 1.00 0.00 H new ATOM 0 HH21 ARG A 32 19.012 3.700 -9.434 1.00 0.00 H new ATOM 0 HH22 ARG A 32 20.473 2.969 -8.763 1.00 0.00 H new ATOM 445 N ALA A 33 18.240 5.643 -0.430 1.00 0.00 N ATOM 446 CA ALA A 33 18.600 6.287 0.827 1.00 0.00 C ATOM 447 C ALA A 33 20.109 6.479 0.933 1.00 0.00 C ATOM 448 O ALA A 33 20.897 5.642 0.494 1.00 0.00 O ATOM 449 CB ALA A 33 18.085 5.472 2.005 1.00 0.00 C ATOM 0 H ALA A 33 18.493 4.656 -0.486 1.00 0.00 H new ATOM 0 HA ALA A 33 18.133 7.271 0.849 1.00 0.00 H new ATOM 0 HB1 ALA A 33 18.361 5.965 2.937 1.00 0.00 H new ATOM 0 HB2 ALA A 33 17.000 5.391 1.945 1.00 0.00 H new ATOM 0 HB3 ALA A 33 18.525 4.475 1.978 1.00 0.00 H new ATOM 455 N PRO A 34 20.522 7.607 1.529 1.00 0.00 N ATOM 456 CA PRO A 34 21.940 7.935 1.706 1.00 0.00 C ATOM 457 C PRO A 34 22.621 7.030 2.727 1.00 0.00 C ATOM 458 O PRO A 34 23.735 6.556 2.505 1.00 0.00 O ATOM 459 CB PRO A 34 21.910 9.381 2.208 1.00 0.00 C ATOM 460 CG PRO A 34 20.576 9.529 2.855 1.00 0.00 C ATOM 461 CD PRO A 34 19.638 8.649 2.076 1.00 0.00 C ATOM 0 HA PRO A 34 22.507 7.801 0.785 1.00 0.00 H new ATOM 0 HB2 PRO A 34 22.717 9.571 2.916 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.033 10.088 1.387 1.00 0.00 H new ATOM 0 HG2 PRO A 34 20.615 9.228 3.902 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.245 10.567 2.834 1.00 0.00 H new ATOM 0 HD2 PRO A 34 18.863 8.224 2.714 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.132 9.202 1.285 1.00 0.00 H new ATOM 469 N SER A 35 21.944 6.794 3.846 1.00 0.00 N ATOM 470 CA SER A 35 22.486 5.949 4.904 1.00 0.00 C ATOM 471 C SER A 35 21.796 4.588 4.918 1.00 0.00 C ATOM 472 O SER A 35 20.569 4.501 4.929 1.00 0.00 O ATOM 473 CB SER A 35 22.324 6.630 6.264 1.00 0.00 C ATOM 474 OG SER A 35 20.956 6.850 6.564 1.00 0.00 O ATOM 0 H SER A 35 21.019 7.176 4.044 1.00 0.00 H new ATOM 0 HA SER A 35 23.547 5.798 4.707 1.00 0.00 H new ATOM 0 HB2 SER A 35 22.775 6.012 7.040 1.00 0.00 H new ATOM 0 HB3 SER A 35 22.857 7.581 6.264 1.00 0.00 H new ATOM 0 HG SER A 35 20.404 6.222 6.053 1.00 0.00 H new ATOM 480 N GLY A 36 22.596 3.526 4.918 1.00 0.00 N ATOM 481 CA GLY A 36 22.046 2.183 4.930 1.00 0.00 C ATOM 482 C GLY A 36 21.097 1.934 3.775 1.00 0.00 C ATOM 483 O GLY A 36 21.136 2.641 2.768 1.00 0.00 O ATOM 0 H GLY A 36 23.615 3.572 4.910 1.00 0.00 H new ATOM 0 HA2 GLY A 36 22.861 1.460 4.889 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.520 2.018 5.870 1.00 0.00 H new ATOM 487 N ALA A 37 20.244 0.926 3.919 1.00 0.00 N ATOM 488 CA ALA A 37 19.281 0.585 2.879 1.00 0.00 C ATOM 489 C ALA A 37 17.920 0.250 3.480 1.00 0.00 C ATOM 490 O ALA A 37 17.832 -0.286 4.584 1.00 0.00 O ATOM 491 CB ALA A 37 19.793 -0.580 2.046 1.00 0.00 C ATOM 0 H ALA A 37 20.200 0.331 4.746 1.00 0.00 H new ATOM 0 HA ALA A 37 19.160 1.454 2.232 1.00 0.00 H new ATOM 0 HB1 ALA A 37 19.063 -0.823 1.274 1.00 0.00 H new ATOM 0 HB2 ALA A 37 20.739 -0.305 1.578 1.00 0.00 H new ATOM 0 HB3 ALA A 37 19.945 -1.448 2.688 1.00 0.00 H new ATOM 497 N VAL A 38 16.859 0.571 2.746 1.00 0.00 N ATOM 498 CA VAL A 38 15.501 0.304 3.206 1.00 0.00 C ATOM 499 C VAL A 38 15.374 -1.117 3.745 1.00 0.00 C ATOM 500 O VAL A 38 15.658 -2.087 3.042 1.00 0.00 O ATOM 501 CB VAL A 38 14.475 0.506 2.075 1.00 0.00 C ATOM 502 CG1 VAL A 38 13.067 0.224 2.575 1.00 0.00 C ATOM 503 CG2 VAL A 38 14.577 1.914 1.510 1.00 0.00 C ATOM 0 H VAL A 38 16.914 1.016 1.830 1.00 0.00 H new ATOM 0 HA VAL A 38 15.292 1.014 4.006 1.00 0.00 H new ATOM 0 HB VAL A 38 14.698 -0.199 1.275 1.00 0.00 H new ATOM 0 HG11 VAL A 38 12.356 0.372 1.762 1.00 0.00 H new ATOM 0 HG12 VAL A 38 13.006 -0.805 2.928 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.829 0.903 3.394 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.845 2.040 0.712 1.00 0.00 H new ATOM 0 HG22 VAL A 38 14.380 2.638 2.300 1.00 0.00 H new ATOM 0 HG23 VAL A 38 15.579 2.075 1.112 1.00 0.00 H new ATOM 513 N LEU A 39 14.945 -1.232 4.997 1.00 0.00 N ATOM 514 CA LEU A 39 14.778 -2.535 5.632 1.00 0.00 C ATOM 515 C LEU A 39 13.472 -3.190 5.195 1.00 0.00 C ATOM 516 O LEU A 39 13.478 -4.219 4.519 1.00 0.00 O ATOM 517 CB LEU A 39 14.805 -2.389 7.154 1.00 0.00 C ATOM 518 CG LEU A 39 16.044 -1.712 7.742 1.00 0.00 C ATOM 519 CD1 LEU A 39 15.862 -1.466 9.232 1.00 0.00 C ATOM 520 CD2 LEU A 39 17.285 -2.555 7.487 1.00 0.00 C ATOM 0 H LEU A 39 14.706 -0.439 5.593 1.00 0.00 H new ATOM 0 HA LEU A 39 15.605 -3.173 5.320 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.926 -1.822 7.460 1.00 0.00 H new ATOM 0 HB3 LEU A 39 14.714 -3.381 7.596 1.00 0.00 H new ATOM 0 HG LEU A 39 16.176 -0.749 7.249 1.00 0.00 H new ATOM 0 HD11 LEU A 39 16.754 -0.984 9.633 1.00 0.00 H new ATOM 0 HD12 LEU A 39 14.998 -0.821 9.391 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.704 -2.417 9.741 1.00 0.00 H new ATOM 0 HD21 LEU A 39 18.157 -2.057 7.912 1.00 0.00 H new ATOM 0 HD22 LEU A 39 17.162 -3.533 7.952 1.00 0.00 H new ATOM 0 HD23 LEU A 39 17.426 -2.679 6.413 1.00 0.00 H new ATOM 532 N ASP A 40 12.355 -2.587 5.585 1.00 0.00 N ATOM 533 CA ASP A 40 11.040 -3.110 5.231 1.00 0.00 C ATOM 534 C ASP A 40 10.065 -1.975 4.934 1.00 0.00 C ATOM 535 O ASP A 40 10.386 -0.802 5.126 1.00 0.00 O ATOM 536 CB ASP A 40 10.494 -3.984 6.361 1.00 0.00 C ATOM 537 CG ASP A 40 10.357 -3.224 7.666 1.00 0.00 C ATOM 538 OD1 ASP A 40 9.853 -2.082 7.637 1.00 0.00 O ATOM 539 OD2 ASP A 40 10.752 -3.772 8.716 1.00 0.00 O ATOM 0 H ASP A 40 12.333 -1.736 6.146 1.00 0.00 H new ATOM 0 HA ASP A 40 11.148 -3.717 4.332 1.00 0.00 H new ATOM 0 HB2 ASP A 40 9.521 -4.381 6.071 1.00 0.00 H new ATOM 0 HB3 ASP A 40 11.156 -4.837 6.509 1.00 0.00 H new ATOM 544 N TYR A 41 8.876 -2.331 4.462 1.00 0.00 N ATOM 545 CA TYR A 41 7.856 -1.343 4.135 1.00 0.00 C ATOM 546 C TYR A 41 6.567 -1.614 4.904 1.00 0.00 C ATOM 547 O TYR A 41 6.405 -2.673 5.510 1.00 0.00 O ATOM 548 CB TYR A 41 7.576 -1.347 2.631 1.00 0.00 C ATOM 549 CG TYR A 41 8.826 -1.288 1.782 1.00 0.00 C ATOM 550 CD1 TYR A 41 9.560 -2.437 1.511 1.00 0.00 C ATOM 551 CD2 TYR A 41 9.274 -0.084 1.253 1.00 0.00 C ATOM 552 CE1 TYR A 41 10.703 -2.388 0.737 1.00 0.00 C ATOM 553 CE2 TYR A 41 10.415 -0.026 0.476 1.00 0.00 C ATOM 554 CZ TYR A 41 11.126 -1.181 0.221 1.00 0.00 C ATOM 555 OH TYR A 41 12.264 -1.127 -0.551 1.00 0.00 O ATOM 0 H TYR A 41 8.595 -3.298 4.297 1.00 0.00 H new ATOM 0 HA TYR A 41 8.231 -0.362 4.426 1.00 0.00 H new ATOM 0 HB2 TYR A 41 7.016 -2.247 2.377 1.00 0.00 H new ATOM 0 HB3 TYR A 41 6.940 -0.496 2.386 1.00 0.00 H new ATOM 0 HD1 TYR A 41 9.231 -3.384 1.912 1.00 0.00 H new ATOM 0 HD2 TYR A 41 8.721 0.822 1.453 1.00 0.00 H new ATOM 0 HE1 TYR A 41 11.262 -3.290 0.537 1.00 0.00 H new ATOM 0 HE2 TYR A 41 10.749 0.918 0.071 1.00 0.00 H new ATOM 0 HH TYR A 41 12.378 -1.977 -1.025 1.00 0.00 H new ATOM 565 N GLU A 42 5.652 -0.650 4.873 1.00 0.00 N ATOM 566 CA GLU A 42 4.377 -0.785 5.567 1.00 0.00 C ATOM 567 C GLU A 42 3.219 -0.369 4.664 1.00 0.00 C ATOM 568 O GLU A 42 3.173 0.759 4.174 1.00 0.00 O ATOM 569 CB GLU A 42 4.373 0.061 6.842 1.00 0.00 C ATOM 570 CG GLU A 42 3.317 -0.361 7.849 1.00 0.00 C ATOM 571 CD GLU A 42 1.996 0.356 7.646 1.00 0.00 C ATOM 572 OE1 GLU A 42 1.862 1.500 8.127 1.00 0.00 O ATOM 573 OE2 GLU A 42 1.098 -0.229 7.005 1.00 0.00 O ATOM 0 H GLU A 42 5.770 0.232 4.375 1.00 0.00 H new ATOM 0 HA GLU A 42 4.248 -1.834 5.835 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.355 0.001 7.311 1.00 0.00 H new ATOM 0 HB3 GLU A 42 4.211 1.105 6.575 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.157 -1.437 7.773 1.00 0.00 H new ATOM 0 HG3 GLU A 42 3.682 -0.163 8.857 1.00 0.00 H new ATOM 580 N VAL A 43 2.285 -1.290 4.447 1.00 0.00 N ATOM 581 CA VAL A 43 1.126 -1.020 3.604 1.00 0.00 C ATOM 582 C VAL A 43 -0.129 -0.811 4.444 1.00 0.00 C ATOM 583 O VAL A 43 -0.632 -1.744 5.071 1.00 0.00 O ATOM 584 CB VAL A 43 0.878 -2.167 2.607 1.00 0.00 C ATOM 585 CG1 VAL A 43 -0.330 -1.865 1.734 1.00 0.00 C ATOM 586 CG2 VAL A 43 2.115 -2.408 1.754 1.00 0.00 C ATOM 0 H VAL A 43 2.308 -2.230 4.843 1.00 0.00 H new ATOM 0 HA VAL A 43 1.344 -0.107 3.050 1.00 0.00 H new ATOM 0 HB VAL A 43 0.670 -3.076 3.171 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.489 -2.687 1.036 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.213 -1.747 2.363 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.155 -0.945 1.177 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.922 -3.222 1.055 1.00 0.00 H new ATOM 0 HG22 VAL A 43 2.356 -1.502 1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.954 -2.673 2.397 1.00 0.00 H new ATOM 596 N LYS A 44 -0.631 0.419 4.453 1.00 0.00 N ATOM 597 CA LYS A 44 -1.829 0.751 5.215 1.00 0.00 C ATOM 598 C LYS A 44 -2.982 1.113 4.284 1.00 0.00 C ATOM 599 O LYS A 44 -2.992 2.184 3.678 1.00 0.00 O ATOM 600 CB LYS A 44 -1.545 1.914 6.168 1.00 0.00 C ATOM 601 CG LYS A 44 -2.783 2.435 6.877 1.00 0.00 C ATOM 602 CD LYS A 44 -2.428 3.470 7.931 1.00 0.00 C ATOM 603 CE LYS A 44 -3.564 4.458 8.147 1.00 0.00 C ATOM 604 NZ LYS A 44 -4.520 3.986 9.187 1.00 0.00 N ATOM 0 H LYS A 44 -0.227 1.203 3.941 1.00 0.00 H new ATOM 0 HA LYS A 44 -2.115 -0.126 5.796 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.818 1.593 6.914 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.088 2.729 5.607 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.463 2.876 6.148 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.312 1.605 7.345 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.197 2.969 8.871 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -1.530 4.007 7.627 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.154 5.424 8.442 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.096 4.611 7.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.456 3.839 8.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.180 3.090 9.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.593 4.699 9.940 1.00 0.00 H new ATOM 618 N TYR A 45 -3.953 0.213 4.176 1.00 0.00 N ATOM 619 CA TYR A 45 -5.111 0.437 3.319 1.00 0.00 C ATOM 620 C TYR A 45 -6.401 0.432 4.133 1.00 0.00 C ATOM 621 O TYR A 45 -6.619 -0.447 4.968 1.00 0.00 O ATOM 622 CB TYR A 45 -5.179 -0.634 2.229 1.00 0.00 C ATOM 623 CG TYR A 45 -5.261 -2.044 2.769 1.00 0.00 C ATOM 624 CD1 TYR A 45 -4.119 -2.717 3.185 1.00 0.00 C ATOM 625 CD2 TYR A 45 -6.481 -2.703 2.865 1.00 0.00 C ATOM 626 CE1 TYR A 45 -4.189 -4.005 3.678 1.00 0.00 C ATOM 627 CE2 TYR A 45 -6.560 -3.990 3.358 1.00 0.00 C ATOM 628 CZ TYR A 45 -5.411 -4.638 3.763 1.00 0.00 C ATOM 629 OH TYR A 45 -5.485 -5.921 4.255 1.00 0.00 O ATOM 0 H TYR A 45 -3.961 -0.679 4.671 1.00 0.00 H new ATOM 0 HA TYR A 45 -5.001 1.416 2.852 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.048 -0.444 1.599 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -4.299 -0.549 1.592 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -3.160 -2.224 3.122 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.383 -2.200 2.548 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -3.291 -4.514 3.995 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -7.516 -4.487 3.426 1.00 0.00 H new ATOM 0 HH TYR A 45 -6.132 -6.436 3.729 1.00 0.00 H new ATOM 639 N HIS A 46 -7.254 1.421 3.884 1.00 0.00 N ATOM 640 CA HIS A 46 -8.524 1.532 4.593 1.00 0.00 C ATOM 641 C HIS A 46 -9.641 1.953 3.643 1.00 0.00 C ATOM 642 O HIS A 46 -9.416 2.719 2.706 1.00 0.00 O ATOM 643 CB HIS A 46 -8.407 2.537 5.738 1.00 0.00 C ATOM 644 CG HIS A 46 -8.417 3.965 5.285 1.00 0.00 C ATOM 645 ND1 HIS A 46 -7.278 4.641 4.902 1.00 0.00 N ATOM 646 CD2 HIS A 46 -9.437 4.845 5.154 1.00 0.00 C ATOM 647 CE1 HIS A 46 -7.596 5.875 4.556 1.00 0.00 C ATOM 648 NE2 HIS A 46 -8.901 6.025 4.700 1.00 0.00 N ATOM 0 H HIS A 46 -7.089 2.157 3.197 1.00 0.00 H new ATOM 0 HA HIS A 46 -8.770 0.553 5.003 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -9.231 2.380 6.434 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.485 2.345 6.286 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -10.479 4.655 5.367 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -6.907 6.633 4.214 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.425 6.878 4.506 1.00 0.00 H new ATOM 657 N GLU A 47 -10.845 1.446 3.890 1.00 0.00 N ATOM 658 CA GLU A 47 -11.996 1.769 3.055 1.00 0.00 C ATOM 659 C GLU A 47 -12.298 3.264 3.100 1.00 0.00 C ATOM 660 O GLU A 47 -12.496 3.838 4.171 1.00 0.00 O ATOM 661 CB GLU A 47 -13.223 0.975 3.510 1.00 0.00 C ATOM 662 CG GLU A 47 -14.205 0.677 2.390 1.00 0.00 C ATOM 663 CD GLU A 47 -15.616 0.451 2.896 1.00 0.00 C ATOM 664 OE1 GLU A 47 -16.302 1.449 3.203 1.00 0.00 O ATOM 665 OE2 GLU A 47 -16.035 -0.722 2.985 1.00 0.00 O ATOM 0 H GLU A 47 -11.048 0.810 4.661 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.756 1.495 2.028 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.893 0.035 3.952 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.736 1.533 4.293 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.205 1.506 1.682 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -13.872 -0.207 1.846 1.00 0.00 H new ATOM 672 N LYS A 48 -12.332 3.889 1.928 1.00 0.00 N ATOM 673 CA LYS A 48 -12.610 5.317 1.831 1.00 0.00 C ATOM 674 C LYS A 48 -13.613 5.750 2.895 1.00 0.00 C ATOM 675 O LYS A 48 -13.410 6.750 3.583 1.00 0.00 O ATOM 676 CB LYS A 48 -13.148 5.659 0.439 1.00 0.00 C ATOM 677 CG LYS A 48 -13.638 7.091 0.312 1.00 0.00 C ATOM 678 CD LYS A 48 -12.523 8.025 -0.128 1.00 0.00 C ATOM 679 CE LYS A 48 -12.441 8.120 -1.644 1.00 0.00 C ATOM 680 NZ LYS A 48 -13.299 9.214 -2.178 1.00 0.00 N ATOM 0 H LYS A 48 -12.170 3.429 1.032 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.677 5.855 1.996 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.363 5.486 -0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -13.967 4.981 0.198 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -14.455 7.134 -0.408 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -14.038 7.426 1.269 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.691 9.017 0.291 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -11.572 7.669 0.267 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -11.407 8.291 -1.942 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -12.746 7.171 -2.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -13.216 9.246 -3.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.290 9.038 -1.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.992 10.123 -1.778 1.00 0.00 H new ATOM 694 N GLY A 49 -14.696 4.989 3.026 1.00 0.00 N ATOM 695 CA GLY A 49 -15.713 5.310 4.010 1.00 0.00 C ATOM 696 C GLY A 49 -15.519 4.558 5.311 1.00 0.00 C ATOM 697 O GLY A 49 -16.294 3.659 5.638 1.00 0.00 O ATOM 0 H GLY A 49 -14.887 4.156 2.468 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.697 6.382 4.208 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.696 5.076 3.602 1.00 0.00 H new ATOM 701 N ALA A 50 -14.481 4.923 6.056 1.00 0.00 N ATOM 702 CA ALA A 50 -14.187 4.277 7.328 1.00 0.00 C ATOM 703 C ALA A 50 -14.103 5.299 8.457 1.00 0.00 C ATOM 704 O ALA A 50 -13.211 6.147 8.472 1.00 0.00 O ATOM 705 CB ALA A 50 -12.891 3.485 7.232 1.00 0.00 C ATOM 0 H ALA A 50 -13.829 5.664 5.799 1.00 0.00 H new ATOM 0 HA ALA A 50 -15.003 3.591 7.555 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.684 3.008 8.190 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -12.987 2.722 6.460 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.072 4.157 6.977 1.00 0.00 H new ATOM 711 N GLU A 51 -15.037 5.212 9.399 1.00 0.00 N ATOM 712 CA GLU A 51 -15.067 6.131 10.531 1.00 0.00 C ATOM 713 C GLU A 51 -14.090 5.690 11.617 1.00 0.00 C ATOM 714 O GLU A 51 -14.460 4.973 12.545 1.00 0.00 O ATOM 715 CB GLU A 51 -16.482 6.219 11.107 1.00 0.00 C ATOM 716 CG GLU A 51 -16.670 7.367 12.084 1.00 0.00 C ATOM 717 CD GLU A 51 -16.127 8.680 11.554 1.00 0.00 C ATOM 718 OE1 GLU A 51 -16.385 8.996 10.374 1.00 0.00 O ATOM 719 OE2 GLU A 51 -15.443 9.391 12.320 1.00 0.00 O ATOM 0 H GLU A 51 -15.782 4.515 9.401 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.765 7.116 10.174 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -17.193 6.330 10.288 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -16.719 5.282 11.610 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -17.731 7.480 12.306 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -16.172 7.125 13.023 1.00 0.00 H new ATOM 726 N GLY A 52 -12.839 6.124 11.491 1.00 0.00 N ATOM 727 CA GLY A 52 -11.828 5.764 12.468 1.00 0.00 C ATOM 728 C GLY A 52 -10.834 4.754 11.928 1.00 0.00 C ATOM 729 O GLY A 52 -11.112 4.026 10.974 1.00 0.00 O ATOM 0 H GLY A 52 -12.508 6.718 10.730 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.295 6.661 12.783 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -12.313 5.354 13.354 1.00 0.00 H new ATOM 733 N PRO A 53 -9.644 4.701 12.544 1.00 0.00 N ATOM 734 CA PRO A 53 -8.582 3.778 12.136 1.00 0.00 C ATOM 735 C PRO A 53 -8.921 2.326 12.455 1.00 0.00 C ATOM 736 O PRO A 53 -8.135 1.420 12.179 1.00 0.00 O ATOM 737 CB PRO A 53 -7.376 4.239 12.958 1.00 0.00 C ATOM 738 CG PRO A 53 -7.965 4.902 14.155 1.00 0.00 C ATOM 739 CD PRO A 53 -9.244 5.539 13.687 1.00 0.00 C ATOM 0 HA PRO A 53 -8.415 3.800 11.059 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -6.745 3.397 13.242 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.751 4.929 12.391 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.156 4.178 14.947 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.283 5.649 14.563 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.003 5.540 14.470 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -9.091 6.577 13.390 1.00 0.00 H new ATOM 747 N SER A 54 -10.096 2.112 13.038 1.00 0.00 N ATOM 748 CA SER A 54 -10.538 0.770 13.398 1.00 0.00 C ATOM 749 C SER A 54 -10.671 -0.109 12.158 1.00 0.00 C ATOM 750 O SER A 54 -10.115 -1.206 12.098 1.00 0.00 O ATOM 751 CB SER A 54 -11.875 0.832 14.138 1.00 0.00 C ATOM 752 OG SER A 54 -12.087 -0.339 14.908 1.00 0.00 O ATOM 0 H SER A 54 -10.759 2.851 13.271 1.00 0.00 H new ATOM 0 HA SER A 54 -9.787 0.331 14.055 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.894 1.707 14.788 1.00 0.00 H new ATOM 0 HB3 SER A 54 -12.686 0.951 13.420 1.00 0.00 H new ATOM 0 HG SER A 54 -12.947 -0.274 15.372 1.00 0.00 H new ATOM 758 N SER A 55 -11.412 0.381 11.169 1.00 0.00 N ATOM 759 CA SER A 55 -11.622 -0.360 9.931 1.00 0.00 C ATOM 760 C SER A 55 -10.435 -0.191 8.989 1.00 0.00 C ATOM 761 O SER A 55 -10.600 0.158 7.820 1.00 0.00 O ATOM 762 CB SER A 55 -12.905 0.109 9.243 1.00 0.00 C ATOM 763 OG SER A 55 -13.239 -0.736 8.155 1.00 0.00 O ATOM 0 H SER A 55 -11.877 1.288 11.201 1.00 0.00 H new ATOM 0 HA SER A 55 -11.718 -1.417 10.180 1.00 0.00 H new ATOM 0 HB2 SER A 55 -13.724 0.121 9.963 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.778 1.132 8.888 1.00 0.00 H new ATOM 0 HG SER A 55 -12.510 -0.729 7.500 1.00 0.00 H new ATOM 769 N VAL A 56 -9.236 -0.441 9.506 1.00 0.00 N ATOM 770 CA VAL A 56 -8.020 -0.318 8.712 1.00 0.00 C ATOM 771 C VAL A 56 -7.152 -1.565 8.838 1.00 0.00 C ATOM 772 O VAL A 56 -7.032 -2.143 9.918 1.00 0.00 O ATOM 773 CB VAL A 56 -7.195 0.912 9.135 1.00 0.00 C ATOM 774 CG1 VAL A 56 -6.045 1.144 8.167 1.00 0.00 C ATOM 775 CG2 VAL A 56 -8.084 2.144 9.224 1.00 0.00 C ATOM 0 H VAL A 56 -9.081 -0.730 10.472 1.00 0.00 H new ATOM 0 HA VAL A 56 -8.331 -0.199 7.674 1.00 0.00 H new ATOM 0 HB VAL A 56 -6.774 0.723 10.122 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -5.474 2.017 8.483 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -5.395 0.269 8.158 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -6.441 1.312 7.165 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -7.485 3.004 9.524 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.535 2.338 8.251 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.869 1.974 9.961 1.00 0.00 H new ATOM 785 N ARG A 57 -6.550 -1.975 7.727 1.00 0.00 N ATOM 786 CA ARG A 57 -5.693 -3.155 7.712 1.00 0.00 C ATOM 787 C ARG A 57 -4.238 -2.767 7.468 1.00 0.00 C ATOM 788 O ARG A 57 -3.952 -1.711 6.904 1.00 0.00 O ATOM 789 CB ARG A 57 -6.159 -4.136 6.636 1.00 0.00 C ATOM 790 CG ARG A 57 -7.217 -5.115 7.119 1.00 0.00 C ATOM 791 CD ARG A 57 -7.329 -6.316 6.195 1.00 0.00 C ATOM 792 NE ARG A 57 -8.313 -7.284 6.672 1.00 0.00 N ATOM 793 CZ ARG A 57 -8.768 -8.293 5.937 1.00 0.00 C ATOM 794 NH1 ARG A 57 -8.330 -8.465 4.697 1.00 0.00 N ATOM 795 NH2 ARG A 57 -9.664 -9.132 6.441 1.00 0.00 N ATOM 0 H ARG A 57 -6.640 -1.508 6.825 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.763 -3.637 8.687 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.556 -3.573 5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -5.298 -4.696 6.270 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.970 -5.451 8.126 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.181 -4.610 7.179 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.606 -5.980 5.196 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.356 -6.800 6.110 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.671 -7.180 7.622 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -7.642 -7.822 4.305 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -8.681 -9.241 4.135 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -10.004 -9.003 7.394 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -10.012 -9.906 5.876 1.00 0.00 H new ATOM 809 N PHE A 58 -3.321 -3.629 7.896 1.00 0.00 N ATOM 810 CA PHE A 58 -1.895 -3.377 7.725 1.00 0.00 C ATOM 811 C PHE A 58 -1.195 -4.596 7.132 1.00 0.00 C ATOM 812 O PHE A 58 -1.640 -5.730 7.311 1.00 0.00 O ATOM 813 CB PHE A 58 -1.256 -3.009 9.065 1.00 0.00 C ATOM 814 CG PHE A 58 -1.611 -1.629 9.540 1.00 0.00 C ATOM 815 CD1 PHE A 58 -2.874 -1.358 10.041 1.00 0.00 C ATOM 816 CD2 PHE A 58 -0.681 -0.603 9.486 1.00 0.00 C ATOM 817 CE1 PHE A 58 -3.203 -0.089 10.478 1.00 0.00 C ATOM 818 CE2 PHE A 58 -1.005 0.668 9.922 1.00 0.00 C ATOM 819 CZ PHE A 58 -2.267 0.925 10.420 1.00 0.00 C ATOM 0 H PHE A 58 -3.540 -4.508 8.364 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.779 -2.542 7.034 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.566 -3.734 9.817 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -0.172 -3.086 8.975 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -3.610 -2.147 10.091 1.00 0.00 H new ATOM 0 HD2 PHE A 58 0.308 -0.799 9.099 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -4.192 0.110 10.865 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.272 1.459 9.873 1.00 0.00 H new ATOM 0 HZ PHE A 58 -2.522 1.917 10.763 1.00 0.00 H new ATOM 829 N LEU A 59 -0.097 -4.353 6.424 1.00 0.00 N ATOM 830 CA LEU A 59 0.667 -5.430 5.803 1.00 0.00 C ATOM 831 C LEU A 59 2.145 -5.067 5.712 1.00 0.00 C ATOM 832 O LEU A 59 2.531 -4.169 4.964 1.00 0.00 O ATOM 833 CB LEU A 59 0.117 -5.732 4.408 1.00 0.00 C ATOM 834 CG LEU A 59 1.030 -6.544 3.488 1.00 0.00 C ATOM 835 CD1 LEU A 59 0.829 -8.034 3.717 1.00 0.00 C ATOM 836 CD2 LEU A 59 0.774 -6.187 2.032 1.00 0.00 C ATOM 0 H LEU A 59 0.284 -3.420 6.266 1.00 0.00 H new ATOM 0 HA LEU A 59 0.569 -6.319 6.426 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.825 -6.270 4.519 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.112 -4.786 3.917 1.00 0.00 H new ATOM 0 HG LEU A 59 2.065 -6.297 3.725 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.487 -8.596 3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.064 -8.278 4.753 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.208 -8.298 3.508 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.433 -6.774 1.392 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.264 -6.404 1.781 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.970 -5.126 1.878 1.00 0.00 H new ATOM 848 N LYS A 60 2.971 -5.773 6.478 1.00 0.00 N ATOM 849 CA LYS A 60 4.408 -5.528 6.482 1.00 0.00 C ATOM 850 C LYS A 60 5.117 -6.437 5.484 1.00 0.00 C ATOM 851 O LYS A 60 5.128 -7.659 5.638 1.00 0.00 O ATOM 852 CB LYS A 60 4.979 -5.749 7.885 1.00 0.00 C ATOM 853 CG LYS A 60 4.716 -4.596 8.838 1.00 0.00 C ATOM 854 CD LYS A 60 4.659 -5.068 10.281 1.00 0.00 C ATOM 855 CE LYS A 60 5.045 -3.957 11.246 1.00 0.00 C ATOM 856 NZ LYS A 60 5.195 -4.460 12.639 1.00 0.00 N ATOM 0 H LYS A 60 2.669 -6.520 7.104 1.00 0.00 H new ATOM 0 HA LYS A 60 4.576 -4.492 6.187 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.550 -6.660 8.303 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.055 -5.909 7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.501 -3.847 8.730 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.775 -4.112 8.575 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.653 -5.418 10.511 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.330 -5.917 10.414 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.981 -3.503 10.921 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.286 -3.175 11.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.458 -3.673 13.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.295 -4.871 12.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.937 -5.188 12.667 1.00 0.00 H new ATOM 870 N THR A 61 5.712 -5.834 4.459 1.00 0.00 N ATOM 871 CA THR A 61 6.424 -6.588 3.436 1.00 0.00 C ATOM 872 C THR A 61 7.912 -6.258 3.445 1.00 0.00 C ATOM 873 O THR A 61 8.301 -5.109 3.655 1.00 0.00 O ATOM 874 CB THR A 61 5.855 -6.306 2.032 1.00 0.00 C ATOM 875 OG1 THR A 61 6.681 -6.920 1.037 1.00 0.00 O ATOM 876 CG2 THR A 61 5.768 -4.810 1.774 1.00 0.00 C ATOM 0 H THR A 61 5.714 -4.824 4.316 1.00 0.00 H new ATOM 0 HA THR A 61 6.288 -7.644 3.670 1.00 0.00 H new ATOM 0 HB THR A 61 4.851 -6.726 1.980 1.00 0.00 H new ATOM 0 HG1 THR A 61 7.128 -6.226 0.509 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.364 -4.636 0.777 1.00 0.00 H new ATOM 0 HG22 THR A 61 5.115 -4.350 2.516 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.763 -4.370 1.844 1.00 0.00 H new ATOM 884 N SER A 62 8.740 -7.272 3.214 1.00 0.00 N ATOM 885 CA SER A 62 10.187 -7.089 3.199 1.00 0.00 C ATOM 886 C SER A 62 10.639 -6.451 1.889 1.00 0.00 C ATOM 887 O SER A 62 11.744 -5.915 1.798 1.00 0.00 O ATOM 888 CB SER A 62 10.893 -8.432 3.396 1.00 0.00 C ATOM 889 OG SER A 62 10.733 -9.264 2.261 1.00 0.00 O ATOM 0 H SER A 62 8.434 -8.228 3.035 1.00 0.00 H new ATOM 0 HA SER A 62 10.454 -6.422 4.019 1.00 0.00 H new ATOM 0 HB2 SER A 62 11.954 -8.265 3.581 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.490 -8.932 4.277 1.00 0.00 H new ATOM 0 HG SER A 62 11.195 -10.115 2.412 1.00 0.00 H new ATOM 895 N GLU A 63 9.778 -6.512 0.879 1.00 0.00 N ATOM 896 CA GLU A 63 10.089 -5.941 -0.426 1.00 0.00 C ATOM 897 C GLU A 63 9.164 -4.770 -0.742 1.00 0.00 C ATOM 898 O GLU A 63 8.199 -4.515 -0.022 1.00 0.00 O ATOM 899 CB GLU A 63 9.971 -7.008 -1.516 1.00 0.00 C ATOM 900 CG GLU A 63 8.602 -7.664 -1.580 1.00 0.00 C ATOM 901 CD GLU A 63 8.651 -9.059 -2.172 1.00 0.00 C ATOM 902 OE1 GLU A 63 9.529 -9.313 -3.022 1.00 0.00 O ATOM 903 OE2 GLU A 63 7.810 -9.897 -1.784 1.00 0.00 O ATOM 0 H GLU A 63 8.859 -6.951 0.939 1.00 0.00 H new ATOM 0 HA GLU A 63 11.115 -5.573 -0.398 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.193 -6.555 -2.482 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.725 -7.776 -1.344 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.180 -7.714 -0.576 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.933 -7.043 -2.177 1.00 0.00 H new ATOM 910 N ASN A 64 9.466 -4.060 -1.825 1.00 0.00 N ATOM 911 CA ASN A 64 8.662 -2.915 -2.237 1.00 0.00 C ATOM 912 C ASN A 64 7.478 -3.360 -3.091 1.00 0.00 C ATOM 913 O ASN A 64 6.961 -2.592 -3.901 1.00 0.00 O ATOM 914 CB ASN A 64 9.520 -1.916 -3.015 1.00 0.00 C ATOM 915 CG ASN A 64 9.856 -2.407 -4.410 1.00 0.00 C ATOM 916 OD1 ASN A 64 9.408 -3.474 -4.830 1.00 0.00 O ATOM 917 ND2 ASN A 64 10.650 -1.629 -5.136 1.00 0.00 N ATOM 0 H ASN A 64 10.261 -4.258 -2.433 1.00 0.00 H new ATOM 0 HA ASN A 64 8.278 -2.431 -1.339 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.992 -0.965 -3.085 1.00 0.00 H new ATOM 0 HB3 ASN A 64 10.443 -1.729 -2.466 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.911 -1.908 -6.082 1.00 0.00 H new ATOM 0 HD22 ASN A 64 10.999 -0.752 -4.748 1.00 0.00 H new ATOM 924 N ARG A 65 7.055 -4.606 -2.903 1.00 0.00 N ATOM 925 CA ARG A 65 5.934 -5.154 -3.656 1.00 0.00 C ATOM 926 C ARG A 65 5.107 -6.100 -2.790 1.00 0.00 C ATOM 927 O ARG A 65 5.653 -6.953 -2.090 1.00 0.00 O ATOM 928 CB ARG A 65 6.438 -5.891 -4.898 1.00 0.00 C ATOM 929 CG ARG A 65 7.478 -6.957 -4.593 1.00 0.00 C ATOM 930 CD ARG A 65 7.944 -7.659 -5.859 1.00 0.00 C ATOM 931 NE ARG A 65 6.836 -8.280 -6.580 1.00 0.00 N ATOM 932 CZ ARG A 65 6.974 -8.901 -7.746 1.00 0.00 C ATOM 933 NH1 ARG A 65 8.167 -8.983 -8.320 1.00 0.00 N ATOM 934 NH2 ARG A 65 5.918 -9.442 -8.340 1.00 0.00 N ATOM 0 H ARG A 65 7.472 -5.255 -2.235 1.00 0.00 H new ATOM 0 HA ARG A 65 5.298 -4.325 -3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.591 -6.355 -5.403 1.00 0.00 H new ATOM 0 HB3 ARG A 65 6.865 -5.167 -5.592 1.00 0.00 H new ATOM 0 HG2 ARG A 65 8.332 -6.501 -4.093 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.059 -7.689 -3.903 1.00 0.00 H new ATOM 0 HD2 ARG A 65 8.442 -6.940 -6.510 1.00 0.00 H new ATOM 0 HD3 ARG A 65 8.681 -8.420 -5.601 1.00 0.00 H new ATOM 0 HE ARG A 65 5.905 -8.234 -6.165 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.981 -8.569 -7.866 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.270 -9.460 -9.215 1.00 0.00 H new ATOM 0 HH21 ARG A 65 4.999 -9.381 -7.901 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.025 -9.919 -9.235 1.00 0.00 H new ATOM 948 N ALA A 66 3.789 -5.942 -2.842 1.00 0.00 N ATOM 949 CA ALA A 66 2.887 -6.782 -2.063 1.00 0.00 C ATOM 950 C ALA A 66 1.616 -7.094 -2.845 1.00 0.00 C ATOM 951 O ALA A 66 1.297 -6.419 -3.824 1.00 0.00 O ATOM 952 CB ALA A 66 2.546 -6.108 -0.743 1.00 0.00 C ATOM 0 H ALA A 66 3.322 -5.240 -3.416 1.00 0.00 H new ATOM 0 HA ALA A 66 3.395 -7.724 -1.856 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.872 -6.746 -0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.460 -5.943 -0.172 1.00 0.00 H new ATOM 0 HB3 ALA A 66 2.062 -5.151 -0.938 1.00 0.00 H new ATOM 958 N GLU A 67 0.893 -8.120 -2.406 1.00 0.00 N ATOM 959 CA GLU A 67 -0.343 -8.521 -3.067 1.00 0.00 C ATOM 960 C GLU A 67 -1.484 -8.641 -2.060 1.00 0.00 C ATOM 961 O GLU A 67 -1.384 -9.377 -1.077 1.00 0.00 O ATOM 962 CB GLU A 67 -0.150 -9.852 -3.796 1.00 0.00 C ATOM 963 CG GLU A 67 -1.441 -10.444 -4.336 1.00 0.00 C ATOM 964 CD GLU A 67 -1.762 -9.963 -5.737 1.00 0.00 C ATOM 965 OE1 GLU A 67 -1.081 -10.405 -6.686 1.00 0.00 O ATOM 966 OE2 GLU A 67 -2.694 -9.145 -5.886 1.00 0.00 O ATOM 0 H GLU A 67 1.142 -8.688 -1.596 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.602 -7.751 -3.794 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.546 -9.706 -4.622 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.310 -10.567 -3.114 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.365 -11.531 -4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -2.263 -10.183 -3.669 1.00 0.00 H new ATOM 973 N LEU A 68 -2.566 -7.914 -2.312 1.00 0.00 N ATOM 974 CA LEU A 68 -3.727 -7.938 -1.428 1.00 0.00 C ATOM 975 C LEU A 68 -4.854 -8.770 -2.032 1.00 0.00 C ATOM 976 O LEU A 68 -5.307 -8.503 -3.145 1.00 0.00 O ATOM 977 CB LEU A 68 -4.216 -6.514 -1.158 1.00 0.00 C ATOM 978 CG LEU A 68 -3.169 -5.533 -0.630 1.00 0.00 C ATOM 979 CD1 LEU A 68 -3.695 -4.108 -0.690 1.00 0.00 C ATOM 980 CD2 LEU A 68 -2.767 -5.896 0.792 1.00 0.00 C ATOM 0 H LEU A 68 -2.664 -7.300 -3.121 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.427 -8.397 -0.486 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.628 -6.111 -2.083 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.034 -6.562 -0.439 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.285 -5.599 -1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.936 -3.424 -0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.932 -3.851 -1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.595 -4.026 -0.080 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.021 -5.187 1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.644 -5.859 1.439 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.348 -6.902 0.806 1.00 0.00 H new ATOM 992 N ARG A 69 -5.303 -9.776 -1.289 1.00 0.00 N ATOM 993 CA ARG A 69 -6.379 -10.646 -1.751 1.00 0.00 C ATOM 994 C ARG A 69 -7.631 -10.462 -0.898 1.00 0.00 C ATOM 995 O ARG A 69 -7.563 -9.959 0.223 1.00 0.00 O ATOM 996 CB ARG A 69 -5.932 -12.108 -1.712 1.00 0.00 C ATOM 997 CG ARG A 69 -4.722 -12.399 -2.584 1.00 0.00 C ATOM 998 CD ARG A 69 -4.142 -13.774 -2.292 1.00 0.00 C ATOM 999 NE ARG A 69 -4.756 -14.813 -3.116 1.00 0.00 N ATOM 1000 CZ ARG A 69 -4.645 -14.863 -4.438 1.00 0.00 C ATOM 1001 NH1 ARG A 69 -3.946 -13.940 -5.084 1.00 0.00 N ATOM 1002 NH2 ARG A 69 -5.232 -15.840 -5.118 1.00 0.00 N ATOM 0 H ARG A 69 -4.939 -10.009 -0.365 1.00 0.00 H new ATOM 0 HA ARG A 69 -6.618 -10.373 -2.779 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -5.701 -12.381 -0.682 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.760 -12.741 -2.032 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.006 -12.339 -3.635 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -3.960 -11.638 -2.416 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -3.067 -13.759 -2.469 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -4.288 -14.013 -1.239 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.300 -15.539 -2.650 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -3.491 -13.189 -4.565 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -3.863 -13.981 -6.100 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.769 -16.553 -4.625 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.146 -15.877 -6.134 1.00 0.00 H new ATOM 1016 N GLY A 70 -8.774 -10.872 -1.439 1.00 0.00 N ATOM 1017 CA GLY A 70 -10.025 -10.744 -0.714 1.00 0.00 C ATOM 1018 C GLY A 70 -10.462 -9.300 -0.563 1.00 0.00 C ATOM 1019 O GLY A 70 -10.425 -8.744 0.535 1.00 0.00 O ATOM 0 H GLY A 70 -8.856 -11.290 -2.366 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -10.802 -11.303 -1.235 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -9.917 -11.193 0.273 1.00 0.00 H new ATOM 1023 N LEU A 71 -10.877 -8.691 -1.669 1.00 0.00 N ATOM 1024 CA LEU A 71 -11.322 -7.302 -1.655 1.00 0.00 C ATOM 1025 C LEU A 71 -12.519 -7.105 -2.579 1.00 0.00 C ATOM 1026 O LEU A 71 -12.987 -8.048 -3.217 1.00 0.00 O ATOM 1027 CB LEU A 71 -10.180 -6.376 -2.078 1.00 0.00 C ATOM 1028 CG LEU A 71 -8.829 -6.628 -1.408 1.00 0.00 C ATOM 1029 CD1 LEU A 71 -7.692 -6.167 -2.307 1.00 0.00 C ATOM 1030 CD2 LEU A 71 -8.763 -5.925 -0.060 1.00 0.00 C ATOM 0 H LEU A 71 -10.914 -9.137 -2.586 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.626 -7.054 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.050 -6.462 -3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.478 -5.348 -1.874 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.722 -7.700 -1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.739 -6.355 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.727 -6.716 -3.248 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.794 -5.100 -2.505 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.795 -6.115 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.893 -4.852 -0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.555 -6.303 0.587 1.00 0.00 H new ATOM 1042 N LYS A 72 -13.010 -5.872 -2.648 1.00 0.00 N ATOM 1043 CA LYS A 72 -14.151 -5.549 -3.496 1.00 0.00 C ATOM 1044 C LYS A 72 -13.690 -5.059 -4.865 1.00 0.00 C ATOM 1045 O LYS A 72 -12.492 -4.926 -5.116 1.00 0.00 O ATOM 1046 CB LYS A 72 -15.024 -4.483 -2.829 1.00 0.00 C ATOM 1047 CG LYS A 72 -15.552 -4.896 -1.466 1.00 0.00 C ATOM 1048 CD LYS A 72 -16.842 -4.170 -1.124 1.00 0.00 C ATOM 1049 CE LYS A 72 -17.721 -4.999 -0.200 1.00 0.00 C ATOM 1050 NZ LYS A 72 -17.340 -4.828 1.229 1.00 0.00 N ATOM 0 H LYS A 72 -12.635 -5.080 -2.126 1.00 0.00 H new ATOM 0 HA LYS A 72 -14.738 -6.457 -3.633 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.445 -3.566 -2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -15.866 -4.254 -3.482 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -15.725 -5.972 -1.453 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.801 -4.684 -0.705 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -16.609 -3.217 -0.648 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -17.387 -3.944 -2.040 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -18.763 -4.710 -0.335 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -17.644 -6.051 -0.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -17.962 -5.409 1.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -16.353 -5.127 1.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -17.438 -3.828 1.497 1.00 0.00 H new ATOM 1064 N ARG A 73 -14.648 -4.789 -5.746 1.00 0.00 N ATOM 1065 CA ARG A 73 -14.340 -4.314 -7.089 1.00 0.00 C ATOM 1066 C ARG A 73 -14.985 -2.955 -7.346 1.00 0.00 C ATOM 1067 O ARG A 73 -16.057 -2.869 -7.943 1.00 0.00 O ATOM 1068 CB ARG A 73 -14.819 -5.323 -8.133 1.00 0.00 C ATOM 1069 CG ARG A 73 -16.065 -6.087 -7.716 1.00 0.00 C ATOM 1070 CD ARG A 73 -15.712 -7.341 -6.931 1.00 0.00 C ATOM 1071 NE ARG A 73 -16.891 -8.150 -6.633 1.00 0.00 N ATOM 1072 CZ ARG A 73 -17.712 -7.907 -5.617 1.00 0.00 C ATOM 1073 NH1 ARG A 73 -17.484 -6.883 -4.807 1.00 0.00 N ATOM 1074 NH2 ARG A 73 -18.764 -8.689 -5.412 1.00 0.00 N ATOM 0 H ARG A 73 -15.644 -4.891 -5.553 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.258 -4.205 -7.169 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -15.021 -4.798 -9.067 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.017 -6.034 -8.333 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -16.702 -5.443 -7.109 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -16.639 -6.360 -8.601 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -14.998 -7.936 -7.501 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -15.221 -7.059 -6.000 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.095 -8.945 -7.238 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -16.677 -6.279 -4.963 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -18.116 -6.699 -4.028 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -18.943 -9.477 -6.034 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -19.394 -8.502 -4.632 1.00 0.00 H new ATOM 1088 N GLY A 74 -14.324 -1.895 -6.890 1.00 0.00 N ATOM 1089 CA GLY A 74 -14.848 -0.556 -7.079 1.00 0.00 C ATOM 1090 C GLY A 74 -14.727 0.296 -5.831 1.00 0.00 C ATOM 1091 O GLY A 74 -14.263 1.434 -5.891 1.00 0.00 O ATOM 0 H GLY A 74 -13.435 -1.941 -6.393 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -14.315 -0.073 -7.898 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.896 -0.617 -7.373 1.00 0.00 H new ATOM 1095 N ALA A 75 -15.147 -0.255 -4.697 1.00 0.00 N ATOM 1096 CA ALA A 75 -15.084 0.461 -3.430 1.00 0.00 C ATOM 1097 C ALA A 75 -13.757 1.199 -3.282 1.00 0.00 C ATOM 1098 O ALA A 75 -12.734 0.596 -2.958 1.00 0.00 O ATOM 1099 CB ALA A 75 -15.287 -0.500 -2.269 1.00 0.00 C ATOM 0 H ALA A 75 -15.535 -1.196 -4.630 1.00 0.00 H new ATOM 0 HA ALA A 75 -15.885 1.200 -3.419 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -15.237 0.049 -1.329 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -16.262 -0.978 -2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -14.507 -1.261 -2.286 1.00 0.00 H new ATOM 1105 N SER A 76 -13.781 2.506 -3.523 1.00 0.00 N ATOM 1106 CA SER A 76 -12.579 3.324 -3.422 1.00 0.00 C ATOM 1107 C SER A 76 -11.673 2.822 -2.301 1.00 0.00 C ATOM 1108 O SER A 76 -12.083 2.746 -1.143 1.00 0.00 O ATOM 1109 CB SER A 76 -12.952 4.787 -3.174 1.00 0.00 C ATOM 1110 OG SER A 76 -14.131 4.888 -2.394 1.00 0.00 O ATOM 0 H SER A 76 -14.620 3.021 -3.790 1.00 0.00 H new ATOM 0 HA SER A 76 -12.038 3.249 -4.365 1.00 0.00 H new ATOM 0 HB2 SER A 76 -12.132 5.294 -2.666 1.00 0.00 H new ATOM 0 HB3 SER A 76 -13.098 5.295 -4.127 1.00 0.00 H new ATOM 0 HG SER A 76 -14.436 5.819 -2.382 1.00 0.00 H new ATOM 1116 N TYR A 77 -10.439 2.481 -2.656 1.00 0.00 N ATOM 1117 CA TYR A 77 -9.474 1.983 -1.682 1.00 0.00 C ATOM 1118 C TYR A 77 -8.276 2.922 -1.574 1.00 0.00 C ATOM 1119 O TYR A 77 -7.494 3.060 -2.515 1.00 0.00 O ATOM 1120 CB TYR A 77 -9.004 0.580 -2.070 1.00 0.00 C ATOM 1121 CG TYR A 77 -9.848 -0.526 -1.478 1.00 0.00 C ATOM 1122 CD1 TYR A 77 -9.706 -0.898 -0.146 1.00 0.00 C ATOM 1123 CD2 TYR A 77 -10.787 -1.200 -2.249 1.00 0.00 C ATOM 1124 CE1 TYR A 77 -10.475 -1.908 0.399 1.00 0.00 C ATOM 1125 CE2 TYR A 77 -11.560 -2.211 -1.712 1.00 0.00 C ATOM 1126 CZ TYR A 77 -11.400 -2.561 -0.388 1.00 0.00 C ATOM 1127 OH TYR A 77 -12.168 -3.569 0.150 1.00 0.00 O ATOM 0 H TYR A 77 -10.083 2.540 -3.610 1.00 0.00 H new ATOM 0 HA TYR A 77 -9.966 1.938 -0.710 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -9.013 0.490 -3.156 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.971 0.450 -1.748 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.982 -0.389 0.473 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -10.915 -0.929 -3.287 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -10.352 -2.185 1.436 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -12.285 -2.724 -2.326 1.00 0.00 H new ATOM 0 HH TYR A 77 -13.112 -3.409 -0.060 1.00 0.00 H new ATOM 1137 N LEU A 78 -8.139 3.564 -0.420 1.00 0.00 N ATOM 1138 CA LEU A 78 -7.035 4.490 -0.186 1.00 0.00 C ATOM 1139 C LEU A 78 -5.915 3.814 0.599 1.00 0.00 C ATOM 1140 O LEU A 78 -5.969 3.724 1.826 1.00 0.00 O ATOM 1141 CB LEU A 78 -7.531 5.724 0.570 1.00 0.00 C ATOM 1142 CG LEU A 78 -8.321 6.742 -0.253 1.00 0.00 C ATOM 1143 CD1 LEU A 78 -7.470 7.285 -1.390 1.00 0.00 C ATOM 1144 CD2 LEU A 78 -9.599 6.116 -0.792 1.00 0.00 C ATOM 0 H LEU A 78 -8.778 3.461 0.369 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.640 4.799 -1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -8.157 5.391 1.398 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.669 6.229 1.006 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.594 7.573 0.398 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.049 8.008 -1.965 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.585 7.772 -0.981 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.166 6.465 -2.040 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -10.148 6.855 -1.375 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.348 5.266 -1.427 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.217 5.778 0.040 1.00 0.00 H new ATOM 1156 N VAL A 79 -4.899 3.343 -0.117 1.00 0.00 N ATOM 1157 CA VAL A 79 -3.764 2.679 0.513 1.00 0.00 C ATOM 1158 C VAL A 79 -2.494 3.512 0.375 1.00 0.00 C ATOM 1159 O VAL A 79 -2.240 4.104 -0.674 1.00 0.00 O ATOM 1160 CB VAL A 79 -3.519 1.286 -0.098 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -3.217 1.400 -1.584 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -2.389 0.577 0.631 1.00 0.00 C ATOM 0 H VAL A 79 -4.839 3.409 -1.133 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.009 2.567 1.569 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.426 0.692 0.019 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.047 0.406 -1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.062 1.865 -2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.326 2.011 -1.728 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.229 -0.405 0.187 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -1.476 1.166 0.547 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -2.651 0.461 1.683 1.00 0.00 H new ATOM 1172 N GLN A 80 -1.702 3.554 1.441 1.00 0.00 N ATOM 1173 CA GLN A 80 -0.458 4.315 1.439 1.00 0.00 C ATOM 1174 C GLN A 80 0.720 3.435 1.845 1.00 0.00 C ATOM 1175 O GLN A 80 0.731 2.858 2.932 1.00 0.00 O ATOM 1176 CB GLN A 80 -0.566 5.512 2.385 1.00 0.00 C ATOM 1177 CG GLN A 80 -1.694 6.468 2.030 1.00 0.00 C ATOM 1178 CD GLN A 80 -2.265 7.173 3.244 1.00 0.00 C ATOM 1179 OE1 GLN A 80 -2.139 6.694 4.371 1.00 0.00 O ATOM 1180 NE2 GLN A 80 -2.897 8.319 3.021 1.00 0.00 N ATOM 0 H GLN A 80 -1.899 3.070 2.317 1.00 0.00 H new ATOM 0 HA GLN A 80 -0.285 4.677 0.425 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.715 5.149 3.402 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.378 6.057 2.377 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.326 7.211 1.323 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.489 5.916 1.528 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.978 8.680 2.070 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -3.301 8.839 3.800 1.00 0.00 H new ATOM 1189 N VAL A 81 1.710 3.337 0.964 1.00 0.00 N ATOM 1190 CA VAL A 81 2.893 2.528 1.231 1.00 0.00 C ATOM 1191 C VAL A 81 4.076 3.401 1.635 1.00 0.00 C ATOM 1192 O VAL A 81 4.391 4.385 0.966 1.00 0.00 O ATOM 1193 CB VAL A 81 3.286 1.685 0.003 1.00 0.00 C ATOM 1194 CG1 VAL A 81 4.477 0.795 0.325 1.00 0.00 C ATOM 1195 CG2 VAL A 81 2.104 0.856 -0.474 1.00 0.00 C ATOM 0 H VAL A 81 1.716 3.808 0.059 1.00 0.00 H new ATOM 0 HA VAL A 81 2.640 1.860 2.054 1.00 0.00 H new ATOM 0 HB VAL A 81 3.575 2.360 -0.802 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.740 0.207 -0.554 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.326 1.414 0.615 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.219 0.125 1.145 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.400 0.267 -1.342 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.782 0.188 0.325 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.282 1.518 -0.747 1.00 0.00 H new ATOM 1205 N ARG A 82 4.729 3.033 2.733 1.00 0.00 N ATOM 1206 CA ARG A 82 5.877 3.783 3.227 1.00 0.00 C ATOM 1207 C ARG A 82 7.084 2.869 3.414 1.00 0.00 C ATOM 1208 O ARG A 82 6.943 1.650 3.509 1.00 0.00 O ATOM 1209 CB ARG A 82 5.534 4.470 4.550 1.00 0.00 C ATOM 1210 CG ARG A 82 5.526 3.527 5.742 1.00 0.00 C ATOM 1211 CD ARG A 82 5.164 4.255 7.026 1.00 0.00 C ATOM 1212 NE ARG A 82 4.727 3.335 8.073 1.00 0.00 N ATOM 1213 CZ ARG A 82 4.238 3.731 9.242 1.00 0.00 C ATOM 1214 NH1 ARG A 82 4.124 5.024 9.513 1.00 0.00 N ATOM 1215 NH2 ARG A 82 3.861 2.833 10.144 1.00 0.00 N ATOM 0 H ARG A 82 4.482 2.220 3.297 1.00 0.00 H new ATOM 0 HA ARG A 82 6.129 4.542 2.486 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.254 5.267 4.733 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.554 4.940 4.462 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.813 2.722 5.566 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.508 3.065 5.849 1.00 0.00 H new ATOM 0 HD2 ARG A 82 6.027 4.821 7.378 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.372 4.976 6.823 1.00 0.00 H new ATOM 0 HE ARG A 82 4.802 2.333 7.896 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.412 5.717 8.822 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.748 5.325 10.412 1.00 0.00 H new ATOM 0 HH21 ARG A 82 3.947 1.837 9.939 1.00 0.00 H new ATOM 0 HH22 ARG A 82 3.485 3.139 11.042 1.00 0.00 H new ATOM 1229 N ALA A 83 8.270 3.466 3.465 1.00 0.00 N ATOM 1230 CA ALA A 83 9.501 2.706 3.643 1.00 0.00 C ATOM 1231 C ALA A 83 10.082 2.919 5.036 1.00 0.00 C ATOM 1232 O ALA A 83 9.694 3.847 5.746 1.00 0.00 O ATOM 1233 CB ALA A 83 10.518 3.093 2.580 1.00 0.00 C ATOM 0 H ALA A 83 8.404 4.474 3.386 1.00 0.00 H new ATOM 0 HA ALA A 83 9.264 1.648 3.536 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.433 2.518 2.725 1.00 0.00 H new ATOM 0 HB2 ALA A 83 10.109 2.882 1.592 1.00 0.00 H new ATOM 0 HB3 ALA A 83 10.742 4.157 2.661 1.00 0.00 H new ATOM 1239 N ARG A 84 11.014 2.054 5.422 1.00 0.00 N ATOM 1240 CA ARG A 84 11.647 2.147 6.732 1.00 0.00 C ATOM 1241 C ARG A 84 13.126 1.781 6.649 1.00 0.00 C ATOM 1242 O ARG A 84 13.509 0.864 5.922 1.00 0.00 O ATOM 1243 CB ARG A 84 10.940 1.229 7.731 1.00 0.00 C ATOM 1244 CG ARG A 84 11.659 1.109 9.064 1.00 0.00 C ATOM 1245 CD ARG A 84 11.406 -0.242 9.715 1.00 0.00 C ATOM 1246 NE ARG A 84 11.541 -0.184 11.168 1.00 0.00 N ATOM 1247 CZ ARG A 84 11.333 -1.224 11.967 1.00 0.00 C ATOM 1248 NH1 ARG A 84 10.984 -2.397 11.457 1.00 0.00 N ATOM 1249 NH2 ARG A 84 11.476 -1.092 13.280 1.00 0.00 N ATOM 0 H ARG A 84 11.347 1.281 4.846 1.00 0.00 H new ATOM 0 HA ARG A 84 11.564 3.178 7.074 1.00 0.00 H new ATOM 0 HB2 ARG A 84 9.931 1.604 7.905 1.00 0.00 H new ATOM 0 HB3 ARG A 84 10.840 0.237 7.291 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.730 1.247 8.915 1.00 0.00 H new ATOM 0 HG3 ARG A 84 11.325 1.904 9.731 1.00 0.00 H new ATOM 0 HD2 ARG A 84 10.404 -0.586 9.458 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.107 -0.974 9.315 1.00 0.00 H new ATOM 0 HE ARG A 84 11.810 0.704 11.592 1.00 0.00 H new ATOM 0 HH11 ARG A 84 10.875 -2.502 10.448 1.00 0.00 H new ATOM 0 HH12 ARG A 84 10.825 -3.194 12.073 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.746 -0.191 13.676 1.00 0.00 H new ATOM 0 HH22 ARG A 84 11.316 -1.891 13.893 1.00 0.00 H new ATOM 1263 N SER A 85 13.953 2.504 7.397 1.00 0.00 N ATOM 1264 CA SER A 85 15.390 2.259 7.405 1.00 0.00 C ATOM 1265 C SER A 85 15.889 1.996 8.822 1.00 0.00 C ATOM 1266 O SER A 85 15.137 2.117 9.788 1.00 0.00 O ATOM 1267 CB SER A 85 16.136 3.452 6.802 1.00 0.00 C ATOM 1268 OG SER A 85 17.490 3.126 6.539 1.00 0.00 O ATOM 0 H SER A 85 13.652 3.265 8.006 1.00 0.00 H new ATOM 0 HA SER A 85 15.586 1.374 6.800 1.00 0.00 H new ATOM 0 HB2 SER A 85 15.647 3.762 5.878 1.00 0.00 H new ATOM 0 HB3 SER A 85 16.089 4.299 7.487 1.00 0.00 H new ATOM 0 HG SER A 85 17.945 3.904 6.153 1.00 0.00 H new ATOM 1274 N GLU A 86 17.164 1.636 8.937 1.00 0.00 N ATOM 1275 CA GLU A 86 17.764 1.355 10.236 1.00 0.00 C ATOM 1276 C GLU A 86 17.178 2.264 11.313 1.00 0.00 C ATOM 1277 O GLU A 86 16.811 1.806 12.395 1.00 0.00 O ATOM 1278 CB GLU A 86 19.282 1.535 10.172 1.00 0.00 C ATOM 1279 CG GLU A 86 20.020 0.897 11.336 1.00 0.00 C ATOM 1280 CD GLU A 86 21.522 1.092 11.252 1.00 0.00 C ATOM 1281 OE1 GLU A 86 21.955 2.169 10.791 1.00 0.00 O ATOM 1282 OE2 GLU A 86 22.264 0.168 11.646 1.00 0.00 O ATOM 0 H GLU A 86 17.801 1.532 8.147 1.00 0.00 H new ATOM 0 HA GLU A 86 17.539 0.320 10.495 1.00 0.00 H new ATOM 0 HB2 GLU A 86 19.651 1.107 9.240 1.00 0.00 H new ATOM 0 HB3 GLU A 86 19.512 2.600 10.147 1.00 0.00 H new ATOM 0 HG2 GLU A 86 19.654 1.322 12.270 1.00 0.00 H new ATOM 0 HG3 GLU A 86 19.797 -0.170 11.362 1.00 0.00 H new ATOM 1289 N ALA A 87 17.096 3.555 11.009 1.00 0.00 N ATOM 1290 CA ALA A 87 16.554 4.528 11.950 1.00 0.00 C ATOM 1291 C ALA A 87 15.130 4.165 12.357 1.00 0.00 C ATOM 1292 O ALA A 87 14.871 3.827 13.511 1.00 0.00 O ATOM 1293 CB ALA A 87 16.593 5.924 11.346 1.00 0.00 C ATOM 0 H ALA A 87 17.398 3.951 10.119 1.00 0.00 H new ATOM 0 HA ALA A 87 17.174 4.514 12.846 1.00 0.00 H new ATOM 0 HB1 ALA A 87 16.185 6.641 12.059 1.00 0.00 H new ATOM 0 HB2 ALA A 87 17.624 6.191 11.112 1.00 0.00 H new ATOM 0 HB3 ALA A 87 15.998 5.942 10.433 1.00 0.00 H new ATOM 1299 N GLY A 88 14.209 4.239 11.401 1.00 0.00 N ATOM 1300 CA GLY A 88 12.822 3.916 11.680 1.00 0.00 C ATOM 1301 C GLY A 88 11.929 4.098 10.469 1.00 0.00 C ATOM 1302 O GLY A 88 12.408 4.405 9.377 1.00 0.00 O ATOM 0 H GLY A 88 14.399 4.517 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 88 12.755 2.884 12.025 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.461 4.548 12.492 1.00 0.00 H new ATOM 1306 N TYR A 89 10.629 3.907 10.661 1.00 0.00 N ATOM 1307 CA TYR A 89 9.667 4.047 9.574 1.00 0.00 C ATOM 1308 C TYR A 89 9.568 5.500 9.119 1.00 0.00 C ATOM 1309 O TYR A 89 9.394 6.407 9.932 1.00 0.00 O ATOM 1310 CB TYR A 89 8.291 3.545 10.014 1.00 0.00 C ATOM 1311 CG TYR A 89 8.162 2.038 9.994 1.00 0.00 C ATOM 1312 CD1 TYR A 89 8.489 1.278 11.110 1.00 0.00 C ATOM 1313 CD2 TYR A 89 7.715 1.375 8.858 1.00 0.00 C ATOM 1314 CE1 TYR A 89 8.373 -0.098 11.096 1.00 0.00 C ATOM 1315 CE2 TYR A 89 7.595 -0.001 8.835 1.00 0.00 C ATOM 1316 CZ TYR A 89 7.925 -0.733 9.956 1.00 0.00 C ATOM 1317 OH TYR A 89 7.809 -2.104 9.937 1.00 0.00 O ATOM 0 H TYR A 89 10.217 3.655 11.559 1.00 0.00 H new ATOM 0 HA TYR A 89 10.015 3.444 8.735 1.00 0.00 H new ATOM 0 HB2 TYR A 89 8.087 3.906 11.022 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.531 3.975 9.362 1.00 0.00 H new ATOM 0 HD1 TYR A 89 8.840 1.772 12.004 1.00 0.00 H new ATOM 0 HD2 TYR A 89 7.457 1.945 7.978 1.00 0.00 H new ATOM 0 HE1 TYR A 89 8.631 -0.674 11.972 1.00 0.00 H new ATOM 0 HE2 TYR A 89 7.245 -0.501 7.944 1.00 0.00 H new ATOM 0 HH TYR A 89 8.303 -2.463 9.171 1.00 0.00 H new ATOM 1327 N GLY A 90 9.680 5.713 7.811 1.00 0.00 N ATOM 1328 CA GLY A 90 9.600 7.057 7.269 1.00 0.00 C ATOM 1329 C GLY A 90 8.171 7.542 7.130 1.00 0.00 C ATOM 1330 O GLY A 90 7.216 6.806 7.377 1.00 0.00 O ATOM 0 H GLY A 90 9.825 4.979 7.118 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.151 7.740 7.916 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.085 7.081 6.293 1.00 0.00 H new ATOM 1334 N PRO A 91 8.009 8.811 6.727 1.00 0.00 N ATOM 1335 CA PRO A 91 6.689 9.423 6.548 1.00 0.00 C ATOM 1336 C PRO A 91 5.940 8.845 5.353 1.00 0.00 C ATOM 1337 O PRO A 91 6.542 8.251 4.458 1.00 0.00 O ATOM 1338 CB PRO A 91 7.012 10.901 6.313 1.00 0.00 C ATOM 1339 CG PRO A 91 8.397 10.903 5.764 1.00 0.00 C ATOM 1340 CD PRO A 91 9.103 9.747 6.415 1.00 0.00 C ATOM 0 HA PRO A 91 6.038 9.246 7.404 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.308 11.354 5.614 1.00 0.00 H new ATOM 0 HB3 PRO A 91 6.953 11.472 7.240 1.00 0.00 H new ATOM 0 HG2 PRO A 91 8.387 10.793 4.680 1.00 0.00 H new ATOM 0 HG3 PRO A 91 8.903 11.843 5.985 1.00 0.00 H new ATOM 0 HD2 PRO A 91 9.838 9.298 5.747 1.00 0.00 H new ATOM 0 HD3 PRO A 91 9.636 10.056 7.314 1.00 0.00 H new ATOM 1348 N PHE A 92 4.623 9.023 5.343 1.00 0.00 N ATOM 1349 CA PHE A 92 3.791 8.518 4.257 1.00 0.00 C ATOM 1350 C PHE A 92 3.858 9.444 3.046 1.00 0.00 C ATOM 1351 O PHE A 92 3.944 10.663 3.186 1.00 0.00 O ATOM 1352 CB PHE A 92 2.341 8.373 4.723 1.00 0.00 C ATOM 1353 CG PHE A 92 2.057 7.062 5.399 1.00 0.00 C ATOM 1354 CD1 PHE A 92 2.122 5.873 4.691 1.00 0.00 C ATOM 1355 CD2 PHE A 92 1.725 7.019 6.744 1.00 0.00 C ATOM 1356 CE1 PHE A 92 1.861 4.666 5.310 1.00 0.00 C ATOM 1357 CE2 PHE A 92 1.464 5.815 7.369 1.00 0.00 C ATOM 1358 CZ PHE A 92 1.531 4.636 6.651 1.00 0.00 C ATOM 0 H PHE A 92 4.109 9.513 6.075 1.00 0.00 H new ATOM 0 HA PHE A 92 4.171 7.539 3.965 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.106 9.186 5.410 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.679 8.481 3.864 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.380 5.890 3.642 1.00 0.00 H new ATOM 0 HD2 PHE A 92 1.670 7.937 7.310 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.915 3.747 4.746 1.00 0.00 H new ATOM 0 HE2 PHE A 92 1.208 5.795 8.418 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.326 3.694 7.137 1.00 0.00 H new ATOM 1368 N GLY A 93 3.817 8.854 1.855 1.00 0.00 N ATOM 1369 CA GLY A 93 3.875 9.640 0.636 1.00 0.00 C ATOM 1370 C GLY A 93 2.513 9.814 -0.006 1.00 0.00 C ATOM 1371 O GLY A 93 1.485 9.641 0.648 1.00 0.00 O ATOM 0 H GLY A 93 3.745 7.847 1.713 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.296 10.620 0.859 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.548 9.157 -0.072 1.00 0.00 H new ATOM 1375 N GLN A 94 2.505 10.160 -1.290 1.00 0.00 N ATOM 1376 CA GLN A 94 1.259 10.360 -2.019 1.00 0.00 C ATOM 1377 C GLN A 94 0.365 9.128 -1.918 1.00 0.00 C ATOM 1378 O GLN A 94 0.820 8.003 -2.118 1.00 0.00 O ATOM 1379 CB GLN A 94 1.548 10.676 -3.487 1.00 0.00 C ATOM 1380 CG GLN A 94 0.295 10.805 -4.340 1.00 0.00 C ATOM 1381 CD GLN A 94 0.601 11.210 -5.768 1.00 0.00 C ATOM 1382 OE1 GLN A 94 1.490 10.647 -6.409 1.00 0.00 O ATOM 1383 NE2 GLN A 94 -0.136 12.191 -6.277 1.00 0.00 N ATOM 0 H GLN A 94 3.347 10.307 -1.846 1.00 0.00 H new ATOM 0 HA GLN A 94 0.736 11.204 -1.569 1.00 0.00 H new ATOM 0 HB2 GLN A 94 2.114 11.605 -3.545 1.00 0.00 H new ATOM 0 HB3 GLN A 94 2.180 9.891 -3.901 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -0.238 9.854 -4.342 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -0.371 11.543 -3.892 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -0.862 12.630 -5.711 1.00 0.00 H new ATOM 0 HE22 GLN A 94 0.024 12.505 -7.234 1.00 0.00 H new ATOM 1392 N GLU A 95 -0.908 9.351 -1.607 1.00 0.00 N ATOM 1393 CA GLU A 95 -1.865 8.258 -1.478 1.00 0.00 C ATOM 1394 C GLU A 95 -1.844 7.369 -2.718 1.00 0.00 C ATOM 1395 O GLU A 95 -1.246 7.718 -3.736 1.00 0.00 O ATOM 1396 CB GLU A 95 -3.275 8.809 -1.255 1.00 0.00 C ATOM 1397 CG GLU A 95 -3.905 9.395 -2.507 1.00 0.00 C ATOM 1398 CD GLU A 95 -3.623 10.877 -2.663 1.00 0.00 C ATOM 1399 OE1 GLU A 95 -2.473 11.293 -2.412 1.00 0.00 O ATOM 1400 OE2 GLU A 95 -4.555 11.621 -3.036 1.00 0.00 O ATOM 0 H GLU A 95 -1.300 10.278 -1.440 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.578 7.656 -0.616 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.913 8.010 -0.878 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -3.238 9.578 -0.483 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.529 8.863 -3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.983 9.235 -2.476 1.00 0.00 H new ATOM 1407 N HIS A 96 -2.502 6.217 -2.624 1.00 0.00 N ATOM 1408 CA HIS A 96 -2.560 5.277 -3.737 1.00 0.00 C ATOM 1409 C HIS A 96 -4.006 4.959 -4.106 1.00 0.00 C ATOM 1410 O HIS A 96 -4.845 4.737 -3.233 1.00 0.00 O ATOM 1411 CB HIS A 96 -1.817 3.988 -3.383 1.00 0.00 C ATOM 1412 CG HIS A 96 -1.445 3.163 -4.577 1.00 0.00 C ATOM 1413 ND1 HIS A 96 -1.281 1.795 -4.525 1.00 0.00 N ATOM 1414 CD2 HIS A 96 -1.208 3.521 -5.861 1.00 0.00 C ATOM 1415 CE1 HIS A 96 -0.957 1.347 -5.724 1.00 0.00 C ATOM 1416 NE2 HIS A 96 -0.906 2.374 -6.553 1.00 0.00 N ATOM 0 H HIS A 96 -3.002 5.913 -1.789 1.00 0.00 H new ATOM 0 HA HIS A 96 -2.078 5.741 -4.597 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.912 4.240 -2.830 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -2.441 3.390 -2.718 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -1.249 4.522 -6.265 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -0.766 0.316 -5.983 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -0.679 2.323 -7.546 1.00 0.00 H new ATOM 1425 N HIS A 97 -4.290 4.941 -5.404 1.00 0.00 N ATOM 1426 CA HIS A 97 -5.635 4.651 -5.888 1.00 0.00 C ATOM 1427 C HIS A 97 -5.666 3.329 -6.649 1.00 0.00 C ATOM 1428 O HIS A 97 -5.196 3.243 -7.783 1.00 0.00 O ATOM 1429 CB HIS A 97 -6.131 5.783 -6.789 1.00 0.00 C ATOM 1430 CG HIS A 97 -5.695 7.143 -6.337 1.00 0.00 C ATOM 1431 ND1 HIS A 97 -4.948 7.993 -7.123 1.00 0.00 N ATOM 1432 CD2 HIS A 97 -5.908 7.799 -5.173 1.00 0.00 C ATOM 1433 CE1 HIS A 97 -4.718 9.113 -6.461 1.00 0.00 C ATOM 1434 NE2 HIS A 97 -5.291 9.021 -5.275 1.00 0.00 N ATOM 0 H HIS A 97 -3.607 5.124 -6.139 1.00 0.00 H new ATOM 0 HA HIS A 97 -6.295 4.568 -5.024 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.770 5.613 -7.804 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -7.220 5.754 -6.829 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.623 7.789 -8.068 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.461 7.430 -4.322 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -4.157 9.960 -6.828 1.00 0.00 H new ATOM 1443 N SER A 98 -6.221 2.300 -6.016 1.00 0.00 N ATOM 1444 CA SER A 98 -6.309 0.981 -6.631 1.00 0.00 C ATOM 1445 C SER A 98 -7.596 0.843 -7.439 1.00 0.00 C ATOM 1446 O SER A 98 -8.354 -0.110 -7.258 1.00 0.00 O ATOM 1447 CB SER A 98 -6.246 -0.109 -5.560 1.00 0.00 C ATOM 1448 OG SER A 98 -4.905 -0.395 -5.201 1.00 0.00 O ATOM 0 H SER A 98 -6.616 2.355 -5.077 1.00 0.00 H new ATOM 0 HA SER A 98 -5.462 0.865 -7.307 1.00 0.00 H new ATOM 0 HB2 SER A 98 -6.801 0.211 -4.678 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.728 -1.014 -5.929 1.00 0.00 H new ATOM 0 HG SER A 98 -4.892 -1.094 -4.514 1.00 0.00 H new ATOM 1454 N GLN A 99 -7.834 1.800 -8.329 1.00 0.00 N ATOM 1455 CA GLN A 99 -9.029 1.786 -9.164 1.00 0.00 C ATOM 1456 C GLN A 99 -9.162 0.458 -9.902 1.00 0.00 C ATOM 1457 O GLN A 99 -8.507 0.233 -10.920 1.00 0.00 O ATOM 1458 CB GLN A 99 -8.990 2.940 -10.168 1.00 0.00 C ATOM 1459 CG GLN A 99 -7.745 2.943 -11.041 1.00 0.00 C ATOM 1460 CD GLN A 99 -7.516 4.276 -11.726 1.00 0.00 C ATOM 1461 OE1 GLN A 99 -6.459 4.889 -11.578 1.00 0.00 O ATOM 1462 NE2 GLN A 99 -8.509 4.733 -12.480 1.00 0.00 N ATOM 0 H GLN A 99 -7.215 2.595 -8.491 1.00 0.00 H new ATOM 0 HA GLN A 99 -9.896 1.908 -8.515 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -9.872 2.885 -10.807 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -9.047 3.884 -9.626 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -6.876 2.699 -10.429 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -7.833 2.161 -11.796 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -9.368 4.192 -12.575 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -8.412 5.625 -12.964 1.00 0.00 H new ATOM 1471 N THR A 100 -10.015 -0.420 -9.382 1.00 0.00 N ATOM 1472 CA THR A 100 -10.232 -1.726 -9.990 1.00 0.00 C ATOM 1473 C THR A 100 -10.812 -1.589 -11.394 1.00 0.00 C ATOM 1474 O THR A 100 -10.114 -1.799 -12.386 1.00 0.00 O ATOM 1475 CB THR A 100 -11.179 -2.592 -9.138 1.00 0.00 C ATOM 1476 OG1 THR A 100 -12.431 -1.920 -8.962 1.00 0.00 O ATOM 1477 CG2 THR A 100 -10.563 -2.892 -7.780 1.00 0.00 C ATOM 0 H THR A 100 -10.566 -0.249 -8.541 1.00 0.00 H new ATOM 0 HA THR A 100 -9.259 -2.214 -10.047 1.00 0.00 H new ATOM 0 HB THR A 100 -11.343 -3.534 -9.661 1.00 0.00 H new ATOM 0 HG1 THR A 100 -13.152 -2.468 -9.336 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.250 -3.505 -7.196 1.00 0.00 H new ATOM 0 HG22 THR A 100 -9.624 -3.429 -7.917 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.373 -1.957 -7.252 1.00 0.00 H new ATOM 1485 N GLN A 101 -12.091 -1.236 -11.469 1.00 0.00 N ATOM 1486 CA GLN A 101 -12.763 -1.072 -12.752 1.00 0.00 C ATOM 1487 C GLN A 101 -13.339 0.334 -12.889 1.00 0.00 C ATOM 1488 O GLN A 101 -14.447 0.516 -13.395 1.00 0.00 O ATOM 1489 CB GLN A 101 -13.877 -2.109 -12.905 1.00 0.00 C ATOM 1490 CG GLN A 101 -14.358 -2.279 -14.337 1.00 0.00 C ATOM 1491 CD GLN A 101 -13.516 -3.265 -15.122 1.00 0.00 C ATOM 1492 OE1 GLN A 101 -12.295 -3.130 -15.204 1.00 0.00 O ATOM 1493 NE2 GLN A 101 -14.166 -4.266 -15.706 1.00 0.00 N ATOM 0 H GLN A 101 -12.682 -1.058 -10.657 1.00 0.00 H new ATOM 0 HA GLN A 101 -12.026 -1.222 -13.541 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.521 -3.070 -12.534 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -14.721 -1.818 -12.279 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.394 -2.617 -14.330 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -14.341 -1.312 -14.839 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -15.179 -4.340 -15.612 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -13.652 -4.961 -16.248 1.00 0.00 H new ATOM 1502 N LEU A 102 -12.580 1.325 -12.435 1.00 0.00 N ATOM 1503 CA LEU A 102 -13.015 2.716 -12.506 1.00 0.00 C ATOM 1504 C LEU A 102 -12.227 3.480 -13.565 1.00 0.00 C ATOM 1505 O LEU A 102 -11.688 4.554 -13.298 1.00 0.00 O ATOM 1506 CB LEU A 102 -12.851 3.393 -11.144 1.00 0.00 C ATOM 1507 CG LEU A 102 -13.930 3.084 -10.106 1.00 0.00 C ATOM 1508 CD1 LEU A 102 -13.387 3.277 -8.699 1.00 0.00 C ATOM 1509 CD2 LEU A 102 -15.154 3.958 -10.333 1.00 0.00 C ATOM 0 H LEU A 102 -11.661 1.192 -12.014 1.00 0.00 H new ATOM 0 HA LEU A 102 -14.068 2.727 -12.786 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -11.885 3.104 -10.731 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -12.822 4.472 -11.298 1.00 0.00 H new ATOM 0 HG LEU A 102 -14.228 2.042 -10.218 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -14.169 3.053 -7.973 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -12.542 2.608 -8.540 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -13.061 4.309 -8.573 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -15.912 3.724 -9.585 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -14.872 5.008 -10.249 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -15.556 3.769 -11.328 1.00 0.00 H new ATOM 1521 N ASP A 103 -12.165 2.919 -14.768 1.00 0.00 N ATOM 1522 CA ASP A 103 -11.445 3.549 -15.869 1.00 0.00 C ATOM 1523 C ASP A 103 -12.274 4.670 -16.489 1.00 0.00 C ATOM 1524 O ASP A 103 -13.486 4.539 -16.658 1.00 0.00 O ATOM 1525 CB ASP A 103 -11.090 2.511 -16.934 1.00 0.00 C ATOM 1526 CG ASP A 103 -9.833 1.736 -16.592 1.00 0.00 C ATOM 1527 OD1 ASP A 103 -9.631 1.429 -15.398 1.00 0.00 O ATOM 1528 OD2 ASP A 103 -9.050 1.436 -17.517 1.00 0.00 O ATOM 0 H ASP A 103 -12.604 2.030 -15.005 1.00 0.00 H new ATOM 0 HA ASP A 103 -10.526 3.979 -15.471 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -11.921 1.816 -17.051 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -10.955 3.011 -17.893 1.00 0.00 H new ATOM 1533 N SER A 104 -11.611 5.772 -16.827 1.00 0.00 N ATOM 1534 CA SER A 104 -12.287 6.917 -17.424 1.00 0.00 C ATOM 1535 C SER A 104 -11.336 7.700 -18.325 1.00 0.00 C ATOM 1536 O SER A 104 -10.117 7.611 -18.186 1.00 0.00 O ATOM 1537 CB SER A 104 -12.843 7.834 -16.333 1.00 0.00 C ATOM 1538 OG SER A 104 -13.693 8.825 -16.883 1.00 0.00 O ATOM 0 H SER A 104 -10.607 5.895 -16.697 1.00 0.00 H new ATOM 0 HA SER A 104 -13.112 6.544 -18.031 1.00 0.00 H new ATOM 0 HB2 SER A 104 -13.395 7.242 -15.603 1.00 0.00 H new ATOM 0 HB3 SER A 104 -12.020 8.311 -15.801 1.00 0.00 H new ATOM 0 HG SER A 104 -14.036 9.397 -16.165 1.00 0.00 H new ATOM 1544 N GLY A 105 -11.905 8.466 -19.251 1.00 0.00 N ATOM 1545 CA GLY A 105 -11.095 9.253 -20.162 1.00 0.00 C ATOM 1546 C GLY A 105 -10.083 10.118 -19.438 1.00 0.00 C ATOM 1547 O GLY A 105 -10.356 10.672 -18.373 1.00 0.00 O ATOM 0 H GLY A 105 -12.912 8.555 -19.386 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -10.573 8.586 -20.848 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -11.744 9.887 -20.766 1.00 0.00 H new ATOM 1551 N PRO A 106 -8.881 10.243 -20.020 1.00 0.00 N ATOM 1552 CA PRO A 106 -7.799 11.045 -19.440 1.00 0.00 C ATOM 1553 C PRO A 106 -8.091 12.541 -19.498 1.00 0.00 C ATOM 1554 O PRO A 106 -7.795 13.203 -20.492 1.00 0.00 O ATOM 1555 CB PRO A 106 -6.593 10.702 -20.318 1.00 0.00 C ATOM 1556 CG PRO A 106 -7.180 10.281 -21.621 1.00 0.00 C ATOM 1557 CD PRO A 106 -8.485 9.612 -21.291 1.00 0.00 C ATOM 0 HA PRO A 106 -7.651 10.825 -18.383 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -5.935 11.562 -20.440 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -5.996 9.904 -19.876 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -7.336 11.140 -22.274 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -6.513 9.598 -22.147 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -9.229 9.777 -22.070 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -8.368 8.534 -21.185 1.00 0.00 H new ATOM 1565 N SER A 107 -8.674 13.067 -18.425 1.00 0.00 N ATOM 1566 CA SER A 107 -9.009 14.484 -18.356 1.00 0.00 C ATOM 1567 C SER A 107 -7.779 15.317 -18.006 1.00 0.00 C ATOM 1568 O SER A 107 -6.756 14.783 -17.578 1.00 0.00 O ATOM 1569 CB SER A 107 -10.110 14.719 -17.319 1.00 0.00 C ATOM 1570 OG SER A 107 -10.630 16.034 -17.417 1.00 0.00 O ATOM 0 H SER A 107 -8.924 12.533 -17.592 1.00 0.00 H new ATOM 0 HA SER A 107 -9.370 14.795 -19.336 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.912 13.995 -17.465 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.712 14.556 -16.318 1.00 0.00 H new ATOM 0 HG SER A 107 -11.333 16.159 -16.745 1.00 0.00 H new ATOM 1576 N SER A 108 -7.888 16.628 -18.192 1.00 0.00 N ATOM 1577 CA SER A 108 -6.785 17.536 -17.901 1.00 0.00 C ATOM 1578 C SER A 108 -6.599 17.700 -16.395 1.00 0.00 C ATOM 1579 O SER A 108 -7.515 17.445 -15.614 1.00 0.00 O ATOM 1580 CB SER A 108 -7.033 18.900 -18.548 1.00 0.00 C ATOM 1581 OG SER A 108 -8.254 19.462 -18.097 1.00 0.00 O ATOM 0 H SER A 108 -8.729 17.086 -18.543 1.00 0.00 H new ATOM 0 HA SER A 108 -5.874 17.106 -18.317 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.209 19.574 -18.312 1.00 0.00 H new ATOM 0 HB3 SER A 108 -7.056 18.793 -19.633 1.00 0.00 H new ATOM 0 HG SER A 108 -8.390 20.334 -18.523 1.00 0.00 H new ATOM 1587 N GLY A 109 -5.406 18.130 -15.995 1.00 0.00 N ATOM 1588 CA GLY A 109 -5.121 18.321 -14.586 1.00 0.00 C ATOM 1589 C GLY A 109 -6.223 19.076 -13.868 1.00 0.00 C ATOM 1590 O GLY A 109 -6.788 18.583 -12.892 1.00 0.00 O ATOM 0 H GLY A 109 -4.632 18.349 -16.622 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -4.982 17.349 -14.112 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -4.183 18.865 -14.479 1.00 0.00 H new TER 1594 GLY A 109