USER MOD reduce.3.24.130724 H: found=0, std=0, add=772, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 766 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 89 HIS : no HD1:sc= -0.0958 X(o=-0.9,f=-1.3) USER MOD Set 1.2: A 93 SER OG : rot -171:sc= -0.806 USER MOD Set 2.1: A 62 MET CE :methyl 164:sc= -0.0673 (180deg=-0.275) USER MOD Set 2.2: A 68 CYS SG : rot -61:sc= -0.986 USER MOD Set 3.1: A 48 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 82 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 24 THR OG1 : rot -121:sc= 0.87 USER MOD Set 4.2: A 27 SER OG : rot 152:sc= 1.01 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 64:sc= 0.00766 USER MOD Single : A 10 LYS NZ :NH3+ -164:sc= -0.0146 (180deg=-0.146) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -22:sc= 1.13 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0413 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -113:sc= -5.26! (180deg=-7.33!) USER MOD Single : A 44 SER OG : rot 10:sc= 0.825 USER MOD Single : A 46 HIS : no HD1:sc= -5.31! C(o=-5.3!,f=-8.7!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -3.74 K(o=-3.7,f=-5.9!) USER MOD Single : A 66 SER OG : rot 72:sc= 0.617 USER MOD Single : A 67 HIS : no HD1:sc= -0.681 K(o=-0.68,f=-4.2!) USER MOD Single : A 74 GLN : amide:sc= -3.12! C(o=-3.1!,f=-3.2!) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HE2:sc= -7.08! C(o=-7.1!,f=-8.5!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 139:sc= -0.0665 (180deg=-1.2) USER MOD Single : A 85 TYR OH : rot 150:sc= -1.32 USER MOD Single : A 88 GLN : amide:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 33.163 -4.714 -34.580 1.00 0.00 N ATOM 2 CA GLY A 1 31.778 -4.842 -34.168 1.00 0.00 C ATOM 3 C GLY A 1 31.245 -6.249 -34.354 1.00 0.00 C ATOM 4 O GLY A 1 31.869 -7.218 -33.923 1.00 0.00 O ATOM 0 H1 GLY A 1 33.480 -3.734 -34.433 1.00 0.00 H new ATOM 0 H2 GLY A 1 33.754 -5.357 -34.016 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.250 -4.958 -35.587 1.00 0.00 H new ATOM 0 HA2 GLY A 1 31.686 -4.558 -33.120 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.166 -4.146 -34.742 1.00 0.00 H new ATOM 8 N SER A 2 30.086 -6.361 -34.996 1.00 0.00 N ATOM 9 CA SER A 2 29.467 -7.659 -35.233 1.00 0.00 C ATOM 10 C SER A 2 29.206 -8.385 -33.917 1.00 0.00 C ATOM 11 O SER A 2 29.406 -9.595 -33.812 1.00 0.00 O ATOM 12 CB SER A 2 30.358 -8.517 -36.133 1.00 0.00 C ATOM 13 OG SER A 2 30.343 -8.041 -37.468 1.00 0.00 O ATOM 0 H SER A 2 29.558 -5.569 -35.361 1.00 0.00 H new ATOM 0 HA SER A 2 28.512 -7.492 -35.732 1.00 0.00 H new ATOM 0 HB2 SER A 2 31.379 -8.510 -35.752 1.00 0.00 H new ATOM 0 HB3 SER A 2 30.016 -9.552 -36.109 1.00 0.00 H new ATOM 0 HG SER A 2 30.921 -8.605 -38.023 1.00 0.00 H new ATOM 19 N SER A 3 28.758 -7.637 -32.914 1.00 0.00 N ATOM 20 CA SER A 3 28.473 -8.206 -31.603 1.00 0.00 C ATOM 21 C SER A 3 27.037 -7.908 -31.181 1.00 0.00 C ATOM 22 O SER A 3 26.486 -6.859 -31.512 1.00 0.00 O ATOM 23 CB SER A 3 29.447 -7.655 -30.560 1.00 0.00 C ATOM 24 OG SER A 3 29.487 -6.239 -30.599 1.00 0.00 O ATOM 0 H SER A 3 28.585 -6.634 -32.985 1.00 0.00 H new ATOM 0 HA SER A 3 28.597 -9.287 -31.670 1.00 0.00 H new ATOM 0 HB2 SER A 3 29.146 -7.986 -29.566 1.00 0.00 H new ATOM 0 HB3 SER A 3 30.444 -8.055 -30.742 1.00 0.00 H new ATOM 0 HG SER A 3 30.115 -5.911 -29.922 1.00 0.00 H new ATOM 30 N GLY A 4 26.436 -8.841 -30.448 1.00 0.00 N ATOM 31 CA GLY A 4 25.070 -8.660 -29.993 1.00 0.00 C ATOM 32 C GLY A 4 24.978 -8.485 -28.490 1.00 0.00 C ATOM 33 O GLY A 4 24.750 -9.449 -27.758 1.00 0.00 O ATOM 0 H GLY A 4 26.871 -9.718 -30.162 1.00 0.00 H new ATOM 0 HA2 GLY A 4 24.639 -7.788 -30.484 1.00 0.00 H new ATOM 0 HA3 GLY A 4 24.473 -9.522 -30.293 1.00 0.00 H new ATOM 37 N SER A 5 25.158 -7.252 -28.027 1.00 0.00 N ATOM 38 CA SER A 5 25.099 -6.955 -26.601 1.00 0.00 C ATOM 39 C SER A 5 23.820 -7.510 -25.982 1.00 0.00 C ATOM 40 O SER A 5 22.766 -6.876 -26.035 1.00 0.00 O ATOM 41 CB SER A 5 25.178 -5.444 -26.370 1.00 0.00 C ATOM 42 OG SER A 5 24.792 -5.110 -25.047 1.00 0.00 O ATOM 0 H SER A 5 25.346 -6.443 -28.619 1.00 0.00 H new ATOM 0 HA SER A 5 25.951 -7.434 -26.120 1.00 0.00 H new ATOM 0 HB2 SER A 5 26.195 -5.097 -26.554 1.00 0.00 H new ATOM 0 HB3 SER A 5 24.532 -4.930 -27.082 1.00 0.00 H new ATOM 0 HG SER A 5 24.852 -4.140 -24.924 1.00 0.00 H new ATOM 48 N SER A 6 23.922 -8.698 -25.395 1.00 0.00 N ATOM 49 CA SER A 6 22.773 -9.342 -24.769 1.00 0.00 C ATOM 50 C SER A 6 22.769 -9.101 -23.262 1.00 0.00 C ATOM 51 O SER A 6 23.734 -8.581 -22.703 1.00 0.00 O ATOM 52 CB SER A 6 22.784 -10.844 -25.057 1.00 0.00 C ATOM 53 OG SER A 6 22.304 -11.118 -26.362 1.00 0.00 O ATOM 0 H SER A 6 24.788 -9.234 -25.340 1.00 0.00 H new ATOM 0 HA SER A 6 21.868 -8.905 -25.191 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.798 -11.230 -24.951 1.00 0.00 H new ATOM 0 HB3 SER A 6 22.167 -11.362 -24.323 1.00 0.00 H new ATOM 0 HG SER A 6 22.905 -10.715 -27.023 1.00 0.00 H new ATOM 59 N GLY A 7 21.675 -9.484 -22.611 1.00 0.00 N ATOM 60 CA GLY A 7 21.565 -9.302 -21.175 1.00 0.00 C ATOM 61 C GLY A 7 22.649 -10.036 -20.412 1.00 0.00 C ATOM 62 O GLY A 7 22.715 -11.265 -20.443 1.00 0.00 O ATOM 0 H GLY A 7 20.863 -9.917 -23.052 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.618 -8.239 -20.942 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.589 -9.654 -20.841 1.00 0.00 H new ATOM 66 N ARG A 8 23.504 -9.283 -19.728 1.00 0.00 N ATOM 67 CA ARG A 8 24.593 -9.870 -18.957 1.00 0.00 C ATOM 68 C ARG A 8 24.081 -10.998 -18.065 1.00 0.00 C ATOM 69 O ARG A 8 22.982 -10.919 -17.515 1.00 0.00 O ATOM 70 CB ARG A 8 25.276 -8.801 -18.102 1.00 0.00 C ATOM 71 CG ARG A 8 24.509 -8.451 -16.837 1.00 0.00 C ATOM 72 CD ARG A 8 23.296 -7.586 -17.142 1.00 0.00 C ATOM 73 NE ARG A 8 23.673 -6.301 -17.726 1.00 0.00 N ATOM 74 CZ ARG A 8 22.809 -5.321 -17.964 1.00 0.00 C ATOM 75 NH1 ARG A 8 21.525 -5.477 -17.669 1.00 0.00 N ATOM 76 NH2 ARG A 8 23.228 -4.181 -18.498 1.00 0.00 N ATOM 0 H ARG A 8 23.463 -8.264 -19.692 1.00 0.00 H new ATOM 0 HA ARG A 8 25.318 -10.283 -19.658 1.00 0.00 H new ATOM 0 HB2 ARG A 8 26.272 -9.149 -17.828 1.00 0.00 H new ATOM 0 HB3 ARG A 8 25.406 -7.899 -18.699 1.00 0.00 H new ATOM 0 HG2 ARG A 8 24.189 -9.366 -16.340 1.00 0.00 H new ATOM 0 HG3 ARG A 8 25.167 -7.926 -16.145 1.00 0.00 H new ATOM 0 HD2 ARG A 8 22.636 -8.116 -17.828 1.00 0.00 H new ATOM 0 HD3 ARG A 8 22.732 -7.416 -16.225 1.00 0.00 H new ATOM 0 HE ARG A 8 24.653 -6.148 -17.964 1.00 0.00 H new ATOM 0 HH11 ARG A 8 21.199 -6.352 -17.258 1.00 0.00 H new ATOM 0 HH12 ARG A 8 20.864 -4.722 -17.853 1.00 0.00 H new ATOM 0 HH21 ARG A 8 24.214 -4.057 -18.726 1.00 0.00 H new ATOM 0 HH22 ARG A 8 22.564 -3.429 -18.681 1.00 0.00 H new ATOM 90 N VAL A 9 24.884 -12.048 -17.928 1.00 0.00 N ATOM 91 CA VAL A 9 24.513 -13.192 -17.103 1.00 0.00 C ATOM 92 C VAL A 9 24.156 -12.756 -15.687 1.00 0.00 C ATOM 93 O VAL A 9 25.002 -12.761 -14.792 1.00 0.00 O ATOM 94 CB VAL A 9 25.650 -14.229 -17.038 1.00 0.00 C ATOM 95 CG1 VAL A 9 25.249 -15.406 -16.163 1.00 0.00 C ATOM 96 CG2 VAL A 9 26.025 -14.697 -18.436 1.00 0.00 C ATOM 0 H VAL A 9 25.796 -12.130 -18.378 1.00 0.00 H new ATOM 0 HA VAL A 9 23.640 -13.649 -17.570 1.00 0.00 H new ATOM 0 HB VAL A 9 26.525 -13.756 -16.591 1.00 0.00 H new ATOM 0 HG11 VAL A 9 26.064 -16.128 -16.129 1.00 0.00 H new ATOM 0 HG12 VAL A 9 25.034 -15.053 -15.154 1.00 0.00 H new ATOM 0 HG13 VAL A 9 24.360 -15.882 -16.578 1.00 0.00 H new ATOM 0 HG21 VAL A 9 26.830 -15.429 -18.371 1.00 0.00 H new ATOM 0 HG22 VAL A 9 25.157 -15.153 -18.912 1.00 0.00 H new ATOM 0 HG23 VAL A 9 26.357 -13.844 -19.028 1.00 0.00 H new ATOM 106 N LYS A 10 22.898 -12.378 -15.489 1.00 0.00 N ATOM 107 CA LYS A 10 22.426 -11.940 -14.181 1.00 0.00 C ATOM 108 C LYS A 10 20.902 -11.964 -14.116 1.00 0.00 C ATOM 109 O LYS A 10 20.230 -11.223 -14.833 1.00 0.00 O ATOM 110 CB LYS A 10 22.938 -10.530 -13.878 1.00 0.00 C ATOM 111 CG LYS A 10 24.320 -10.508 -13.247 1.00 0.00 C ATOM 112 CD LYS A 10 24.495 -9.309 -12.331 1.00 0.00 C ATOM 113 CE LYS A 10 24.985 -8.089 -13.096 1.00 0.00 C ATOM 114 NZ LYS A 10 26.414 -8.222 -13.495 1.00 0.00 N ATOM 0 H LYS A 10 22.186 -12.366 -16.219 1.00 0.00 H new ATOM 0 HA LYS A 10 22.815 -12.630 -13.432 1.00 0.00 H new ATOM 0 HB2 LYS A 10 22.961 -9.954 -14.803 1.00 0.00 H new ATOM 0 HB3 LYS A 10 22.235 -10.033 -13.210 1.00 0.00 H new ATOM 0 HG2 LYS A 10 24.477 -11.426 -12.681 1.00 0.00 H new ATOM 0 HG3 LYS A 10 25.078 -10.483 -14.030 1.00 0.00 H new ATOM 0 HD2 LYS A 10 23.546 -9.079 -11.846 1.00 0.00 H new ATOM 0 HD3 LYS A 10 25.205 -9.554 -11.541 1.00 0.00 H new ATOM 0 HE2 LYS A 10 24.371 -7.947 -13.986 1.00 0.00 H new ATOM 0 HE3 LYS A 10 24.862 -7.199 -12.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 26.787 -7.290 -13.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 26.964 -8.597 -12.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 26.490 -8.872 -14.303 1.00 0.00 H new ATOM 128 N GLU A 11 20.364 -12.819 -13.252 1.00 0.00 N ATOM 129 CA GLU A 11 18.920 -12.937 -13.094 1.00 0.00 C ATOM 130 C GLU A 11 18.383 -11.850 -12.167 1.00 0.00 C ATOM 131 O GLU A 11 17.577 -12.120 -11.277 1.00 0.00 O ATOM 132 CB GLU A 11 18.556 -14.317 -12.543 1.00 0.00 C ATOM 133 CG GLU A 11 19.216 -14.635 -11.212 1.00 0.00 C ATOM 134 CD GLU A 11 18.810 -15.991 -10.668 1.00 0.00 C ATOM 135 OE1 GLU A 11 19.380 -17.006 -11.121 1.00 0.00 O ATOM 136 OE2 GLU A 11 17.923 -16.038 -9.791 1.00 0.00 O ATOM 0 H GLU A 11 20.906 -13.440 -12.651 1.00 0.00 H new ATOM 0 HA GLU A 11 18.462 -12.813 -14.075 1.00 0.00 H new ATOM 0 HB2 GLU A 11 17.474 -14.378 -12.426 1.00 0.00 H new ATOM 0 HB3 GLU A 11 18.841 -15.076 -13.271 1.00 0.00 H new ATOM 0 HG2 GLU A 11 20.299 -14.605 -11.332 1.00 0.00 H new ATOM 0 HG3 GLU A 11 18.954 -13.864 -10.488 1.00 0.00 H new ATOM 143 N SER A 12 18.836 -10.619 -12.383 1.00 0.00 N ATOM 144 CA SER A 12 18.406 -9.491 -11.565 1.00 0.00 C ATOM 145 C SER A 12 17.082 -8.927 -12.071 1.00 0.00 C ATOM 146 O SER A 12 16.948 -8.589 -13.247 1.00 0.00 O ATOM 147 CB SER A 12 19.474 -8.396 -11.566 1.00 0.00 C ATOM 148 OG SER A 12 19.313 -7.525 -10.460 1.00 0.00 O ATOM 0 H SER A 12 19.501 -10.378 -13.118 1.00 0.00 H new ATOM 0 HA SER A 12 18.263 -9.847 -10.545 1.00 0.00 H new ATOM 0 HB2 SER A 12 20.465 -8.850 -11.534 1.00 0.00 H new ATOM 0 HB3 SER A 12 19.414 -7.826 -12.493 1.00 0.00 H new ATOM 0 HG SER A 12 20.009 -6.835 -10.483 1.00 0.00 H new ATOM 154 N ILE A 13 16.106 -8.830 -11.174 1.00 0.00 N ATOM 155 CA ILE A 13 14.793 -8.306 -11.529 1.00 0.00 C ATOM 156 C ILE A 13 14.413 -7.127 -10.640 1.00 0.00 C ATOM 157 O ILE A 13 13.304 -6.598 -10.730 1.00 0.00 O ATOM 158 CB ILE A 13 13.705 -9.391 -11.416 1.00 0.00 C ATOM 159 CG1 ILE A 13 13.432 -9.720 -9.947 1.00 0.00 C ATOM 160 CG2 ILE A 13 14.124 -10.641 -12.176 1.00 0.00 C ATOM 161 CD1 ILE A 13 12.426 -8.795 -9.299 1.00 0.00 C ATOM 0 H ILE A 13 16.200 -9.107 -10.197 1.00 0.00 H new ATOM 0 HA ILE A 13 14.856 -7.972 -12.565 1.00 0.00 H new ATOM 0 HB ILE A 13 12.785 -9.010 -11.860 1.00 0.00 H new ATOM 0 HG12 ILE A 13 13.071 -10.746 -9.874 1.00 0.00 H new ATOM 0 HG13 ILE A 13 14.369 -9.672 -9.392 1.00 0.00 H new ATOM 0 HG21 ILE A 13 13.346 -11.399 -12.087 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.273 -10.395 -13.227 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.054 -11.026 -11.758 1.00 0.00 H new ATOM 0 HD11 ILE A 13 12.281 -9.086 -8.259 1.00 0.00 H new ATOM 0 HD12 ILE A 13 12.795 -7.770 -9.341 1.00 0.00 H new ATOM 0 HD13 ILE A 13 11.476 -8.861 -9.830 1.00 0.00 H new ATOM 173 N THR A 14 15.341 -6.717 -9.780 1.00 0.00 N ATOM 174 CA THR A 14 15.104 -5.600 -8.875 1.00 0.00 C ATOM 175 C THR A 14 15.608 -4.292 -9.473 1.00 0.00 C ATOM 176 O THR A 14 15.875 -3.331 -8.751 1.00 0.00 O ATOM 177 CB THR A 14 15.788 -5.826 -7.513 1.00 0.00 C ATOM 178 OG1 THR A 14 15.620 -4.672 -6.683 1.00 0.00 O ATOM 179 CG2 THR A 14 17.271 -6.115 -7.694 1.00 0.00 C ATOM 0 H THR A 14 16.264 -7.143 -9.692 1.00 0.00 H new ATOM 0 HA THR A 14 14.026 -5.537 -8.726 1.00 0.00 H new ATOM 0 HB THR A 14 15.321 -6.687 -7.035 1.00 0.00 H new ATOM 0 HG1 THR A 14 15.432 -3.890 -7.244 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.733 -6.271 -6.719 1.00 0.00 H new ATOM 0 HG22 THR A 14 17.396 -7.011 -8.302 1.00 0.00 H new ATOM 0 HG23 THR A 14 17.748 -5.270 -8.191 1.00 0.00 H new ATOM 187 N ARG A 15 15.735 -4.261 -10.795 1.00 0.00 N ATOM 188 CA ARG A 15 16.207 -3.069 -11.490 1.00 0.00 C ATOM 189 C ARG A 15 15.036 -2.193 -11.924 1.00 0.00 C ATOM 190 O ARG A 15 15.013 -1.677 -13.042 1.00 0.00 O ATOM 191 CB ARG A 15 17.044 -3.462 -12.709 1.00 0.00 C ATOM 192 CG ARG A 15 18.043 -2.397 -13.131 1.00 0.00 C ATOM 193 CD ARG A 15 19.327 -2.486 -12.322 1.00 0.00 C ATOM 194 NE ARG A 15 20.290 -1.458 -12.708 1.00 0.00 N ATOM 195 CZ ARG A 15 21.467 -1.293 -12.114 1.00 0.00 C ATOM 196 NH1 ARG A 15 21.825 -2.086 -11.114 1.00 0.00 N ATOM 197 NH2 ARG A 15 22.289 -0.335 -12.523 1.00 0.00 N ATOM 0 H ARG A 15 15.518 -5.048 -11.407 1.00 0.00 H new ATOM 0 HA ARG A 15 16.828 -2.498 -10.800 1.00 0.00 H new ATOM 0 HB2 ARG A 15 17.581 -4.385 -12.488 1.00 0.00 H new ATOM 0 HB3 ARG A 15 16.377 -3.674 -13.544 1.00 0.00 H new ATOM 0 HG2 ARG A 15 18.271 -2.510 -14.191 1.00 0.00 H new ATOM 0 HG3 ARG A 15 17.599 -1.410 -13.004 1.00 0.00 H new ATOM 0 HD2 ARG A 15 19.095 -2.385 -11.262 1.00 0.00 H new ATOM 0 HD3 ARG A 15 19.774 -3.471 -12.459 1.00 0.00 H new ATOM 0 HE ARG A 15 20.046 -0.832 -13.476 1.00 0.00 H new ATOM 0 HH11 ARG A 15 21.196 -2.825 -10.799 1.00 0.00 H new ATOM 0 HH12 ARG A 15 22.729 -1.957 -10.660 1.00 0.00 H new ATOM 0 HH21 ARG A 15 22.017 0.275 -13.294 1.00 0.00 H new ATOM 0 HH22 ARG A 15 23.192 -0.209 -12.067 1.00 0.00 H new ATOM 211 N THR A 16 14.064 -2.028 -11.032 1.00 0.00 N ATOM 212 CA THR A 16 12.889 -1.216 -11.322 1.00 0.00 C ATOM 213 C THR A 16 12.791 -0.031 -10.370 1.00 0.00 C ATOM 214 O THR A 16 13.301 -0.078 -9.250 1.00 0.00 O ATOM 215 CB THR A 16 11.595 -2.046 -11.226 1.00 0.00 C ATOM 216 OG1 THR A 16 10.460 -1.216 -11.494 1.00 0.00 O ATOM 217 CG2 THR A 16 11.456 -2.675 -9.848 1.00 0.00 C ATOM 0 H THR A 16 14.068 -2.447 -10.102 1.00 0.00 H new ATOM 0 HA THR A 16 13.002 -0.850 -12.342 1.00 0.00 H new ATOM 0 HB THR A 16 11.645 -2.843 -11.968 1.00 0.00 H new ATOM 0 HG1 THR A 16 9.641 -1.751 -11.433 1.00 0.00 H new ATOM 0 HG21 THR A 16 10.535 -3.256 -9.805 1.00 0.00 H new ATOM 0 HG22 THR A 16 12.307 -3.329 -9.659 1.00 0.00 H new ATOM 0 HG23 THR A 16 11.426 -1.891 -9.091 1.00 0.00 H new ATOM 225 N SER A 17 12.132 1.032 -10.820 1.00 0.00 N ATOM 226 CA SER A 17 11.970 2.232 -10.008 1.00 0.00 C ATOM 227 C SER A 17 10.511 2.422 -9.605 1.00 0.00 C ATOM 228 O SER A 17 10.186 2.486 -8.419 1.00 0.00 O ATOM 229 CB SER A 17 12.464 3.462 -10.773 1.00 0.00 C ATOM 230 OG SER A 17 13.849 3.364 -11.055 1.00 0.00 O ATOM 0 H SER A 17 11.701 1.086 -11.743 1.00 0.00 H new ATOM 0 HA SER A 17 12.566 2.112 -9.103 1.00 0.00 H new ATOM 0 HB2 SER A 17 11.906 3.563 -11.704 1.00 0.00 H new ATOM 0 HB3 SER A 17 12.272 4.360 -10.187 1.00 0.00 H new ATOM 0 HG SER A 17 14.140 4.161 -11.546 1.00 0.00 H new ATOM 236 N ARG A 18 9.635 2.511 -10.601 1.00 0.00 N ATOM 237 CA ARG A 18 8.211 2.695 -10.352 1.00 0.00 C ATOM 238 C ARG A 18 7.440 1.407 -10.627 1.00 0.00 C ATOM 239 O ARG A 18 7.947 0.496 -11.280 1.00 0.00 O ATOM 240 CB ARG A 18 7.661 3.827 -11.222 1.00 0.00 C ATOM 241 CG ARG A 18 8.046 5.214 -10.733 1.00 0.00 C ATOM 242 CD ARG A 18 7.073 6.270 -11.231 1.00 0.00 C ATOM 243 NE ARG A 18 7.340 7.581 -10.644 1.00 0.00 N ATOM 244 CZ ARG A 18 6.571 8.645 -10.842 1.00 0.00 C ATOM 245 NH1 ARG A 18 5.492 8.555 -11.607 1.00 0.00 N ATOM 246 NH2 ARG A 18 6.880 9.804 -10.274 1.00 0.00 N ATOM 0 H ARG A 18 9.887 2.459 -11.588 1.00 0.00 H new ATOM 0 HA ARG A 18 8.083 2.958 -9.302 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.022 3.698 -12.242 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.574 3.752 -11.256 1.00 0.00 H new ATOM 0 HG2 ARG A 18 8.069 5.224 -9.643 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.053 5.455 -11.075 1.00 0.00 H new ATOM 0 HD2 ARG A 18 7.138 6.339 -12.317 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.054 5.966 -10.991 1.00 0.00 H new ATOM 0 HE ARG A 18 8.162 7.684 -10.049 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.250 7.666 -12.046 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.903 9.374 -11.757 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.709 9.878 -9.685 1.00 0.00 H new ATOM 0 HH22 ARG A 18 6.288 10.621 -10.427 1.00 0.00 H new ATOM 260 N ALA A 19 6.212 1.340 -10.124 1.00 0.00 N ATOM 261 CA ALA A 19 5.371 0.165 -10.316 1.00 0.00 C ATOM 262 C ALA A 19 5.118 -0.092 -11.798 1.00 0.00 C ATOM 263 O ALA A 19 5.321 0.776 -12.647 1.00 0.00 O ATOM 264 CB ALA A 19 4.052 0.333 -9.575 1.00 0.00 C ATOM 0 H ALA A 19 5.777 2.086 -9.580 1.00 0.00 H new ATOM 0 HA ALA A 19 5.897 -0.698 -9.908 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.434 -0.552 -9.727 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.247 0.461 -8.510 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.530 1.210 -9.956 1.00 0.00 H new ATOM 270 N PRO A 20 4.664 -1.313 -12.118 1.00 0.00 N ATOM 271 CA PRO A 20 4.374 -1.713 -13.498 1.00 0.00 C ATOM 272 C PRO A 20 3.149 -1.002 -14.062 1.00 0.00 C ATOM 273 O PRO A 20 2.774 -1.212 -15.216 1.00 0.00 O ATOM 274 CB PRO A 20 4.115 -3.217 -13.385 1.00 0.00 C ATOM 275 CG PRO A 20 3.663 -3.419 -11.980 1.00 0.00 C ATOM 276 CD PRO A 20 4.399 -2.397 -11.158 1.00 0.00 C ATOM 0 HA PRO A 20 5.188 -1.457 -14.176 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.355 -3.542 -14.096 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.017 -3.791 -13.597 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.585 -3.286 -11.894 1.00 0.00 H new ATOM 0 HG3 PRO A 20 3.888 -4.430 -11.639 1.00 0.00 H new ATOM 0 HD2 PRO A 20 3.799 -2.051 -10.316 1.00 0.00 H new ATOM 0 HD3 PRO A 20 5.323 -2.803 -10.745 1.00 0.00 H new ATOM 284 N SER A 21 2.528 -0.160 -13.242 1.00 0.00 N ATOM 285 CA SER A 21 1.343 0.579 -13.658 1.00 0.00 C ATOM 286 C SER A 21 0.136 -0.348 -13.772 1.00 0.00 C ATOM 287 O SER A 21 -0.734 -0.153 -14.621 1.00 0.00 O ATOM 288 CB SER A 21 1.593 1.274 -14.998 1.00 0.00 C ATOM 289 OG SER A 21 0.777 2.424 -15.137 1.00 0.00 O ATOM 0 H SER A 21 2.827 0.027 -12.285 1.00 0.00 H new ATOM 0 HA SER A 21 1.131 1.332 -12.899 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.643 1.558 -15.073 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.391 0.580 -15.814 1.00 0.00 H new ATOM 0 HG SER A 21 0.957 2.850 -16.001 1.00 0.00 H new ATOM 295 N VAL A 22 0.091 -1.358 -12.909 1.00 0.00 N ATOM 296 CA VAL A 22 -1.008 -2.316 -12.910 1.00 0.00 C ATOM 297 C VAL A 22 -2.028 -1.984 -11.826 1.00 0.00 C ATOM 298 O VAL A 22 -1.701 -1.954 -10.640 1.00 0.00 O ATOM 299 CB VAL A 22 -0.500 -3.754 -12.697 1.00 0.00 C ATOM 300 CG1 VAL A 22 0.431 -4.164 -13.828 1.00 0.00 C ATOM 301 CG2 VAL A 22 0.197 -3.879 -11.351 1.00 0.00 C ATOM 0 H VAL A 22 0.803 -1.534 -12.200 1.00 0.00 H new ATOM 0 HA VAL A 22 -1.485 -2.248 -13.888 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.357 -4.428 -12.701 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.780 -5.183 -13.661 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.105 -4.115 -14.776 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.286 -3.488 -13.859 1.00 0.00 H new ATOM 0 HG21 VAL A 22 0.549 -4.902 -11.217 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.045 -3.195 -11.316 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -0.503 -3.630 -10.554 1.00 0.00 H new ATOM 311 N ALA A 23 -3.265 -1.735 -12.242 1.00 0.00 N ATOM 312 CA ALA A 23 -4.334 -1.408 -11.306 1.00 0.00 C ATOM 313 C ALA A 23 -5.675 -1.290 -12.024 1.00 0.00 C ATOM 314 O ALA A 23 -5.734 -1.275 -13.254 1.00 0.00 O ATOM 315 CB ALA A 23 -4.013 -0.116 -10.569 1.00 0.00 C ATOM 0 H ALA A 23 -3.552 -1.753 -13.221 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.409 -2.218 -10.581 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.820 0.116 -9.874 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.081 -0.234 -10.017 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.909 0.697 -11.288 1.00 0.00 H new ATOM 321 N THR A 24 -6.751 -1.209 -11.248 1.00 0.00 N ATOM 322 CA THR A 24 -8.091 -1.095 -11.809 1.00 0.00 C ATOM 323 C THR A 24 -8.936 -0.102 -11.018 1.00 0.00 C ATOM 324 O THR A 24 -8.591 0.265 -9.894 1.00 0.00 O ATOM 325 CB THR A 24 -8.808 -2.458 -11.832 1.00 0.00 C ATOM 326 OG1 THR A 24 -10.192 -2.278 -12.155 1.00 0.00 O ATOM 327 CG2 THR A 24 -8.684 -3.158 -10.487 1.00 0.00 C ATOM 0 H THR A 24 -6.720 -1.220 -10.229 1.00 0.00 H new ATOM 0 HA THR A 24 -7.976 -0.736 -12.832 1.00 0.00 H new ATOM 0 HB THR A 24 -8.335 -3.079 -12.592 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.746 -2.636 -11.430 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.198 -4.118 -10.528 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.631 -3.320 -10.257 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.134 -2.538 -9.711 1.00 0.00 H new ATOM 335 N VAL A 25 -10.045 0.329 -11.611 1.00 0.00 N ATOM 336 CA VAL A 25 -10.940 1.278 -10.961 1.00 0.00 C ATOM 337 C VAL A 25 -12.393 0.829 -11.074 1.00 0.00 C ATOM 338 O VAL A 25 -12.810 0.295 -12.101 1.00 0.00 O ATOM 339 CB VAL A 25 -10.801 2.687 -11.567 1.00 0.00 C ATOM 340 CG1 VAL A 25 -11.159 2.670 -13.046 1.00 0.00 C ATOM 341 CG2 VAL A 25 -11.670 3.680 -10.811 1.00 0.00 C ATOM 0 H VAL A 25 -10.345 0.036 -12.541 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.654 1.313 -9.910 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.762 3.003 -11.473 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.055 3.674 -13.457 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.490 1.990 -13.574 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.189 2.333 -13.167 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.559 4.670 -11.253 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.713 3.370 -10.871 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.361 3.712 -9.766 1.00 0.00 H new ATOM 351 N GLY A 26 -13.160 1.051 -10.011 1.00 0.00 N ATOM 352 CA GLY A 26 -14.558 0.663 -10.011 1.00 0.00 C ATOM 353 C GLY A 26 -14.743 -0.840 -9.968 1.00 0.00 C ATOM 354 O GLY A 26 -15.689 -1.373 -10.548 1.00 0.00 O ATOM 0 H GLY A 26 -12.838 1.493 -9.150 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -15.056 1.112 -9.152 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.042 1.060 -10.903 1.00 0.00 H new ATOM 358 N SER A 27 -13.837 -1.527 -9.280 1.00 0.00 N ATOM 359 CA SER A 27 -13.902 -2.980 -9.168 1.00 0.00 C ATOM 360 C SER A 27 -13.158 -3.463 -7.926 1.00 0.00 C ATOM 361 O SER A 27 -12.367 -2.725 -7.337 1.00 0.00 O ATOM 362 CB SER A 27 -13.310 -3.635 -10.418 1.00 0.00 C ATOM 363 OG SER A 27 -11.913 -3.412 -10.498 1.00 0.00 O ATOM 0 H SER A 27 -13.049 -1.101 -8.792 1.00 0.00 H new ATOM 0 HA SER A 27 -14.950 -3.267 -9.077 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.510 -4.706 -10.400 1.00 0.00 H new ATOM 0 HB3 SER A 27 -13.797 -3.235 -11.307 1.00 0.00 H new ATOM 0 HG SER A 27 -11.492 -4.149 -10.987 1.00 0.00 H new ATOM 369 N ILE A 28 -13.418 -4.705 -7.535 1.00 0.00 N ATOM 370 CA ILE A 28 -12.773 -5.288 -6.365 1.00 0.00 C ATOM 371 C ILE A 28 -11.330 -5.676 -6.668 1.00 0.00 C ATOM 372 O ILE A 28 -11.071 -6.717 -7.273 1.00 0.00 O ATOM 373 CB ILE A 28 -13.533 -6.530 -5.863 1.00 0.00 C ATOM 374 CG1 ILE A 28 -14.956 -6.152 -5.450 1.00 0.00 C ATOM 375 CG2 ILE A 28 -12.790 -7.172 -4.701 1.00 0.00 C ATOM 376 CD1 ILE A 28 -15.819 -7.343 -5.095 1.00 0.00 C ATOM 0 H ILE A 28 -14.071 -5.328 -8.011 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.785 -4.526 -5.586 1.00 0.00 H new ATOM 0 HB ILE A 28 -13.592 -7.255 -6.675 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -14.910 -5.479 -4.594 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -15.428 -5.601 -6.264 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.340 -8.048 -4.357 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.795 -7.473 -5.027 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.703 -6.455 -3.884 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -16.814 -7.000 -4.812 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.895 -8.007 -5.956 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -15.370 -7.882 -4.261 1.00 0.00 H new ATOM 388 N CYS A 29 -10.395 -4.834 -6.243 1.00 0.00 N ATOM 389 CA CYS A 29 -8.977 -5.089 -6.468 1.00 0.00 C ATOM 390 C CYS A 29 -8.367 -5.847 -5.292 1.00 0.00 C ATOM 391 O CYS A 29 -8.524 -5.450 -4.137 1.00 0.00 O ATOM 392 CB CYS A 29 -8.229 -3.773 -6.685 1.00 0.00 C ATOM 393 SG CYS A 29 -6.545 -3.976 -7.313 1.00 0.00 S ATOM 0 H CYS A 29 -10.593 -3.969 -5.741 1.00 0.00 H new ATOM 0 HA CYS A 29 -8.881 -5.705 -7.362 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -8.794 -3.157 -7.384 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -8.190 -3.230 -5.741 1.00 0.00 H new ATOM 0 HG CYS A 29 -5.995 -2.808 -7.466 1.00 0.00 H new ATOM 399 N ASP A 30 -7.673 -6.938 -5.595 1.00 0.00 N ATOM 400 CA ASP A 30 -7.041 -7.752 -4.563 1.00 0.00 C ATOM 401 C ASP A 30 -5.557 -7.417 -4.441 1.00 0.00 C ATOM 402 O ASP A 30 -4.759 -7.758 -5.314 1.00 0.00 O ATOM 403 CB ASP A 30 -7.216 -9.239 -4.877 1.00 0.00 C ATOM 404 CG ASP A 30 -6.899 -9.566 -6.323 1.00 0.00 C ATOM 405 OD1 ASP A 30 -7.522 -8.961 -7.220 1.00 0.00 O ATOM 406 OD2 ASP A 30 -6.026 -10.428 -6.558 1.00 0.00 O ATOM 0 H ASP A 30 -7.534 -7.279 -6.546 1.00 0.00 H new ATOM 0 HA ASP A 30 -7.526 -7.530 -3.612 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -6.568 -9.824 -4.225 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -8.241 -9.536 -4.657 1.00 0.00 H new ATOM 411 N LEU A 31 -5.195 -6.747 -3.352 1.00 0.00 N ATOM 412 CA LEU A 31 -3.808 -6.365 -3.115 1.00 0.00 C ATOM 413 C LEU A 31 -3.055 -7.472 -2.384 1.00 0.00 C ATOM 414 O LEU A 31 -3.142 -7.593 -1.162 1.00 0.00 O ATOM 415 CB LEU A 31 -3.747 -5.069 -2.304 1.00 0.00 C ATOM 416 CG LEU A 31 -2.347 -4.560 -1.958 1.00 0.00 C ATOM 417 CD1 LEU A 31 -1.659 -4.006 -3.196 1.00 0.00 C ATOM 418 CD2 LEU A 31 -2.420 -3.501 -0.868 1.00 0.00 C ATOM 0 H LEU A 31 -5.843 -6.457 -2.620 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.331 -6.204 -4.082 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.268 -4.290 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.297 -5.219 -1.375 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.758 -5.398 -1.585 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.664 -3.649 -2.930 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.574 -4.791 -3.947 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.245 -3.180 -3.599 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.415 -3.150 -0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.026 -2.664 -1.214 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.872 -3.930 0.026 1.00 0.00 H new ATOM 430 N ASN A 32 -2.315 -8.277 -3.139 1.00 0.00 N ATOM 431 CA ASN A 32 -1.546 -9.373 -2.563 1.00 0.00 C ATOM 432 C ASN A 32 -0.178 -8.888 -2.091 1.00 0.00 C ATOM 433 O ASN A 32 0.630 -8.406 -2.885 1.00 0.00 O ATOM 434 CB ASN A 32 -1.375 -10.497 -3.586 1.00 0.00 C ATOM 435 CG ASN A 32 -0.355 -11.530 -3.146 1.00 0.00 C ATOM 436 OD1 ASN A 32 -0.388 -12.007 -2.011 1.00 0.00 O ATOM 437 ND2 ASN A 32 0.557 -11.881 -4.044 1.00 0.00 N ATOM 0 H ASN A 32 -2.232 -8.191 -4.152 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.094 -9.755 -1.702 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -2.336 -10.986 -3.749 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.068 -10.071 -4.541 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.268 -12.572 -3.805 1.00 0.00 H new ATOM 0 HD22 ASN A 32 0.547 -11.460 -4.973 1.00 0.00 H new ATOM 444 N LEU A 33 0.074 -9.020 -0.793 1.00 0.00 N ATOM 445 CA LEU A 33 1.344 -8.596 -0.214 1.00 0.00 C ATOM 446 C LEU A 33 2.089 -9.781 0.392 1.00 0.00 C ATOM 447 O LEU A 33 1.475 -10.715 0.910 1.00 0.00 O ATOM 448 CB LEU A 33 1.109 -7.527 0.855 1.00 0.00 C ATOM 449 CG LEU A 33 0.696 -6.147 0.343 1.00 0.00 C ATOM 450 CD1 LEU A 33 -0.082 -5.392 1.411 1.00 0.00 C ATOM 451 CD2 LEU A 33 1.918 -5.351 -0.091 1.00 0.00 C ATOM 0 H LEU A 33 -0.584 -9.417 -0.122 1.00 0.00 H new ATOM 0 HA LEU A 33 1.956 -8.175 -1.012 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.337 -7.886 1.536 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.023 -7.418 1.438 1.00 0.00 H new ATOM 0 HG LEU A 33 0.048 -6.281 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.368 -4.412 1.029 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.978 -5.954 1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.542 -5.268 2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.605 -4.372 -0.452 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.591 -5.226 0.757 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.435 -5.884 -0.889 1.00 0.00 H new ATOM 463 N LYS A 34 3.415 -9.737 0.326 1.00 0.00 N ATOM 464 CA LYS A 34 4.245 -10.805 0.871 1.00 0.00 C ATOM 465 C LYS A 34 4.510 -10.584 2.356 1.00 0.00 C ATOM 466 O LYS A 34 5.653 -10.387 2.770 1.00 0.00 O ATOM 467 CB LYS A 34 5.571 -10.886 0.111 1.00 0.00 C ATOM 468 CG LYS A 34 6.209 -12.264 0.145 1.00 0.00 C ATOM 469 CD LYS A 34 7.558 -12.272 -0.554 1.00 0.00 C ATOM 470 CE LYS A 34 8.342 -13.536 -0.238 1.00 0.00 C ATOM 471 NZ LYS A 34 7.757 -14.733 -0.903 1.00 0.00 N ATOM 0 H LYS A 34 3.939 -8.972 -0.100 1.00 0.00 H new ATOM 0 HA LYS A 34 3.707 -11.746 0.753 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.403 -10.598 -0.927 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.267 -10.162 0.534 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.333 -12.583 1.180 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.546 -12.985 -0.334 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.411 -12.193 -1.631 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.134 -11.399 -0.246 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.376 -13.412 -0.559 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.360 -13.692 0.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.320 -15.574 -0.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.778 -14.867 -0.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.763 -14.595 -1.934 1.00 0.00 H new ATOM 485 N ILE A 35 3.448 -10.618 3.154 1.00 0.00 N ATOM 486 CA ILE A 35 3.568 -10.424 4.593 1.00 0.00 C ATOM 487 C ILE A 35 3.948 -11.725 5.294 1.00 0.00 C ATOM 488 O ILE A 35 3.441 -12.801 4.976 1.00 0.00 O ATOM 489 CB ILE A 35 2.256 -9.892 5.200 1.00 0.00 C ATOM 490 CG1 ILE A 35 1.883 -8.550 4.567 1.00 0.00 C ATOM 491 CG2 ILE A 35 2.389 -9.752 6.710 1.00 0.00 C ATOM 492 CD1 ILE A 35 0.396 -8.275 4.565 1.00 0.00 C ATOM 0 H ILE A 35 2.495 -10.778 2.828 1.00 0.00 H new ATOM 0 HA ILE A 35 4.356 -9.687 4.747 1.00 0.00 H new ATOM 0 HB ILE A 35 1.460 -10.606 4.989 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.391 -7.750 5.105 1.00 0.00 H new ATOM 0 HG13 ILE A 35 2.250 -8.527 3.541 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.454 -9.375 7.124 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.614 -10.725 7.147 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.195 -9.056 6.941 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.206 -7.307 4.101 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.117 -9.054 4.002 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.026 -8.265 5.590 1.00 0.00 H new ATOM 504 N PRO A 36 4.860 -11.625 6.271 1.00 0.00 N ATOM 505 CA PRO A 36 5.327 -12.783 7.039 1.00 0.00 C ATOM 506 C PRO A 36 4.251 -13.336 7.967 1.00 0.00 C ATOM 507 O PRO A 36 3.069 -13.028 7.814 1.00 0.00 O ATOM 508 CB PRO A 36 6.496 -12.221 7.852 1.00 0.00 C ATOM 509 CG PRO A 36 6.208 -10.765 7.974 1.00 0.00 C ATOM 510 CD PRO A 36 5.506 -10.374 6.703 1.00 0.00 C ATOM 0 HA PRO A 36 5.601 -13.617 6.393 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.561 -12.695 8.831 1.00 0.00 H new ATOM 0 HB3 PRO A 36 7.447 -12.395 7.350 1.00 0.00 H new ATOM 0 HG2 PRO A 36 5.583 -10.562 8.843 1.00 0.00 H new ATOM 0 HG3 PRO A 36 7.128 -10.195 8.103 1.00 0.00 H new ATOM 0 HD2 PRO A 36 4.776 -9.583 6.874 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.207 -10.004 5.954 1.00 0.00 H new ATOM 518 N GLU A 37 4.667 -14.154 8.929 1.00 0.00 N ATOM 519 CA GLU A 37 3.737 -14.749 9.880 1.00 0.00 C ATOM 520 C GLU A 37 2.767 -13.702 10.421 1.00 0.00 C ATOM 521 O GLU A 37 1.690 -14.036 10.916 1.00 0.00 O ATOM 522 CB GLU A 37 4.500 -15.398 11.037 1.00 0.00 C ATOM 523 CG GLU A 37 5.072 -16.764 10.697 1.00 0.00 C ATOM 524 CD GLU A 37 6.296 -17.106 11.525 1.00 0.00 C ATOM 525 OE1 GLU A 37 7.212 -16.262 11.607 1.00 0.00 O ATOM 526 OE2 GLU A 37 6.336 -18.219 12.091 1.00 0.00 O ATOM 0 H GLU A 37 5.642 -14.419 9.070 1.00 0.00 H new ATOM 0 HA GLU A 37 3.164 -15.515 9.357 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.313 -14.738 11.341 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.832 -15.496 11.893 1.00 0.00 H new ATOM 0 HG2 GLU A 37 4.307 -17.524 10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.334 -16.791 9.639 1.00 0.00 H new ATOM 533 N ILE A 38 3.158 -12.436 10.323 1.00 0.00 N ATOM 534 CA ILE A 38 2.324 -11.341 10.801 1.00 0.00 C ATOM 535 C ILE A 38 0.855 -11.584 10.473 1.00 0.00 C ATOM 536 O ILE A 38 0.469 -11.633 9.306 1.00 0.00 O ATOM 537 CB ILE A 38 2.758 -9.995 10.192 1.00 0.00 C ATOM 538 CG1 ILE A 38 4.079 -9.533 10.809 1.00 0.00 C ATOM 539 CG2 ILE A 38 1.675 -8.946 10.398 1.00 0.00 C ATOM 540 CD1 ILE A 38 4.638 -8.280 10.172 1.00 0.00 C ATOM 0 H ILE A 38 4.047 -12.144 9.917 1.00 0.00 H new ATOM 0 HA ILE A 38 2.450 -11.299 11.883 1.00 0.00 H new ATOM 0 HB ILE A 38 2.907 -10.129 9.121 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.930 -9.354 11.874 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.812 -10.334 10.720 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.997 -8.000 9.962 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.754 -9.274 9.915 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.497 -8.812 11.465 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.575 -8.011 10.660 1.00 0.00 H new ATOM 0 HD12 ILE A 38 4.819 -8.460 9.112 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.923 -7.465 10.285 1.00 0.00 H new ATOM 552 N ASN A 39 0.039 -11.735 11.512 1.00 0.00 N ATOM 553 CA ASN A 39 -1.389 -11.972 11.334 1.00 0.00 C ATOM 554 C ASN A 39 -2.089 -10.719 10.817 1.00 0.00 C ATOM 555 O ASN A 39 -1.447 -9.703 10.550 1.00 0.00 O ATOM 556 CB ASN A 39 -2.022 -12.415 12.655 1.00 0.00 C ATOM 557 CG ASN A 39 -1.768 -13.879 12.956 1.00 0.00 C ATOM 558 OD1 ASN A 39 -0.699 -14.249 13.441 1.00 0.00 O ATOM 559 ND2 ASN A 39 -2.754 -14.721 12.669 1.00 0.00 N ATOM 0 H ASN A 39 0.342 -11.697 12.485 1.00 0.00 H new ATOM 0 HA ASN A 39 -1.511 -12.765 10.596 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -1.625 -11.806 13.467 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -3.097 -12.236 12.618 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -2.642 -15.719 12.850 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -3.624 -14.370 12.268 1.00 0.00 H new ATOM 566 N SER A 40 -3.408 -10.799 10.678 1.00 0.00 N ATOM 567 CA SER A 40 -4.195 -9.673 10.189 1.00 0.00 C ATOM 568 C SER A 40 -4.908 -8.969 11.339 1.00 0.00 C ATOM 569 O SER A 40 -5.076 -7.750 11.326 1.00 0.00 O ATOM 570 CB SER A 40 -5.217 -10.148 9.155 1.00 0.00 C ATOM 571 OG SER A 40 -6.144 -11.052 9.732 1.00 0.00 O ATOM 0 H SER A 40 -3.955 -11.632 10.897 1.00 0.00 H new ATOM 0 HA SER A 40 -3.515 -8.964 9.717 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.749 -9.290 8.744 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.702 -10.631 8.325 1.00 0.00 H new ATOM 0 HG SER A 40 -6.788 -11.340 9.051 1.00 0.00 H new ATOM 577 N SER A 41 -5.324 -9.746 12.334 1.00 0.00 N ATOM 578 CA SER A 41 -6.023 -9.199 13.491 1.00 0.00 C ATOM 579 C SER A 41 -5.169 -8.148 14.193 1.00 0.00 C ATOM 580 O SER A 41 -5.670 -7.362 14.998 1.00 0.00 O ATOM 581 CB SER A 41 -6.384 -10.317 14.471 1.00 0.00 C ATOM 582 OG SER A 41 -7.247 -11.265 13.867 1.00 0.00 O ATOM 0 H SER A 41 -5.189 -10.757 12.362 1.00 0.00 H new ATOM 0 HA SER A 41 -6.939 -8.724 13.140 1.00 0.00 H new ATOM 0 HB2 SER A 41 -5.475 -10.813 14.812 1.00 0.00 H new ATOM 0 HB3 SER A 41 -6.865 -9.892 15.352 1.00 0.00 H new ATOM 0 HG SER A 41 -7.462 -11.970 14.513 1.00 0.00 H new ATOM 588 N ASP A 42 -3.877 -8.140 13.883 1.00 0.00 N ATOM 589 CA ASP A 42 -2.953 -7.185 14.483 1.00 0.00 C ATOM 590 C ASP A 42 -2.660 -6.036 13.524 1.00 0.00 C ATOM 591 O ASP A 42 -2.520 -4.887 13.941 1.00 0.00 O ATOM 592 CB ASP A 42 -1.649 -7.883 14.875 1.00 0.00 C ATOM 593 CG ASP A 42 -1.699 -8.457 16.277 1.00 0.00 C ATOM 594 OD1 ASP A 42 -1.704 -7.666 17.243 1.00 0.00 O ATOM 595 OD2 ASP A 42 -1.733 -9.698 16.408 1.00 0.00 O ATOM 0 H ASP A 42 -3.446 -8.784 13.220 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.422 -6.777 15.378 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.441 -8.683 14.165 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.825 -7.173 14.805 1.00 0.00 H new ATOM 600 N MET A 43 -2.569 -6.354 12.237 1.00 0.00 N ATOM 601 CA MET A 43 -2.293 -5.348 11.218 1.00 0.00 C ATOM 602 C MET A 43 -3.501 -4.440 11.010 1.00 0.00 C ATOM 603 O MET A 43 -4.529 -4.598 11.668 1.00 0.00 O ATOM 604 CB MET A 43 -1.911 -6.019 9.898 1.00 0.00 C ATOM 605 CG MET A 43 -0.440 -6.394 9.810 1.00 0.00 C ATOM 606 SD MET A 43 0.136 -6.552 8.109 1.00 0.00 S ATOM 607 CE MET A 43 -1.129 -7.616 7.420 1.00 0.00 C ATOM 0 H MET A 43 -2.682 -7.301 11.875 1.00 0.00 H new ATOM 0 HA MET A 43 -1.457 -4.738 11.562 1.00 0.00 H new ATOM 0 HB2 MET A 43 -2.515 -6.917 9.768 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.156 -5.348 9.075 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.155 -5.638 10.322 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.277 -7.336 10.334 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.693 -8.582 7.167 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.924 -7.757 8.152 1.00 0.00 H new ATOM 0 HE3 MET A 43 -1.541 -7.157 6.521 1.00 0.00 H new ATOM 617 N SER A 44 -3.369 -3.489 10.091 1.00 0.00 N ATOM 618 CA SER A 44 -4.449 -2.553 9.799 1.00 0.00 C ATOM 619 C SER A 44 -4.281 -1.945 8.410 1.00 0.00 C ATOM 620 O SER A 44 -3.291 -1.269 8.132 1.00 0.00 O ATOM 621 CB SER A 44 -4.490 -1.444 10.852 1.00 0.00 C ATOM 622 OG SER A 44 -4.961 -1.937 12.094 1.00 0.00 O ATOM 0 H SER A 44 -2.525 -3.346 9.536 1.00 0.00 H new ATOM 0 HA SER A 44 -5.390 -3.103 9.824 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.493 -1.022 10.979 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.137 -0.636 10.509 1.00 0.00 H new ATOM 0 HG SER A 44 -5.012 -2.915 12.060 1.00 0.00 H new ATOM 628 N ALA A 45 -5.256 -2.192 7.541 1.00 0.00 N ATOM 629 CA ALA A 45 -5.218 -1.668 6.181 1.00 0.00 C ATOM 630 C ALA A 45 -6.242 -0.554 5.993 1.00 0.00 C ATOM 631 O ALA A 45 -7.388 -0.670 6.431 1.00 0.00 O ATOM 632 CB ALA A 45 -5.461 -2.786 5.178 1.00 0.00 C ATOM 0 H ALA A 45 -6.082 -2.752 7.755 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.227 -1.248 6.007 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.430 -2.381 4.167 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.689 -3.547 5.288 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -6.439 -3.232 5.360 1.00 0.00 H new ATOM 638 N HIS A 46 -5.822 0.525 5.341 1.00 0.00 N ATOM 639 CA HIS A 46 -6.704 1.661 5.096 1.00 0.00 C ATOM 640 C HIS A 46 -6.234 2.462 3.885 1.00 0.00 C ATOM 641 O HIS A 46 -5.082 2.893 3.823 1.00 0.00 O ATOM 642 CB HIS A 46 -6.763 2.564 6.328 1.00 0.00 C ATOM 643 CG HIS A 46 -7.389 1.910 7.521 1.00 0.00 C ATOM 644 ND1 HIS A 46 -6.736 0.974 8.296 1.00 0.00 N ATOM 645 CD2 HIS A 46 -8.616 2.062 8.071 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.535 0.578 9.270 1.00 0.00 C ATOM 647 NE2 HIS A 46 -8.682 1.223 9.157 1.00 0.00 N ATOM 0 H HIS A 46 -4.877 0.637 4.973 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.703 1.276 4.890 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.752 2.879 6.586 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.325 3.465 6.081 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.398 2.720 7.721 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.292 -0.150 10.030 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.486 1.116 9.775 1.00 0.00 H new ATOM 655 N VAL A 47 -7.132 2.657 2.925 1.00 0.00 N ATOM 656 CA VAL A 47 -6.809 3.407 1.717 1.00 0.00 C ATOM 657 C VAL A 47 -7.096 4.893 1.899 1.00 0.00 C ATOM 658 O VAL A 47 -8.250 5.322 1.878 1.00 0.00 O ATOM 659 CB VAL A 47 -7.605 2.887 0.505 1.00 0.00 C ATOM 660 CG1 VAL A 47 -7.250 3.677 -0.745 1.00 0.00 C ATOM 661 CG2 VAL A 47 -7.349 1.402 0.298 1.00 0.00 C ATOM 0 H VAL A 47 -8.089 2.306 2.960 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.744 3.266 1.532 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.668 3.025 0.703 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -7.822 3.296 -1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.489 4.729 -0.590 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -6.185 3.573 -0.951 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.919 1.051 -0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.286 1.237 0.121 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.658 0.852 1.187 1.00 0.00 H new ATOM 671 N THR A 48 -6.037 5.677 2.078 1.00 0.00 N ATOM 672 CA THR A 48 -6.174 7.116 2.265 1.00 0.00 C ATOM 673 C THR A 48 -6.481 7.815 0.945 1.00 0.00 C ATOM 674 O THR A 48 -6.217 7.276 -0.129 1.00 0.00 O ATOM 675 CB THR A 48 -4.897 7.727 2.871 1.00 0.00 C ATOM 676 OG1 THR A 48 -4.572 7.067 4.100 1.00 0.00 O ATOM 677 CG2 THR A 48 -5.077 9.217 3.123 1.00 0.00 C ATOM 0 H THR A 48 -5.075 5.339 2.097 1.00 0.00 H new ATOM 0 HA THR A 48 -7.004 7.268 2.955 1.00 0.00 H new ATOM 0 HB THR A 48 -4.083 7.590 2.159 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.758 7.461 4.477 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.162 9.627 3.551 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.295 9.722 2.182 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.903 9.371 3.817 1.00 0.00 H new ATOM 685 N SER A 49 -7.040 9.017 1.034 1.00 0.00 N ATOM 686 CA SER A 49 -7.386 9.789 -0.154 1.00 0.00 C ATOM 687 C SER A 49 -6.466 10.997 -0.304 1.00 0.00 C ATOM 688 O SER A 49 -5.916 11.516 0.668 1.00 0.00 O ATOM 689 CB SER A 49 -8.843 10.249 -0.082 1.00 0.00 C ATOM 690 OG SER A 49 -9.727 9.142 -0.056 1.00 0.00 O ATOM 0 H SER A 49 -7.263 9.478 1.916 1.00 0.00 H new ATOM 0 HA SER A 49 -7.258 9.146 -1.025 1.00 0.00 H new ATOM 0 HB2 SER A 49 -8.992 10.858 0.810 1.00 0.00 H new ATOM 0 HB3 SER A 49 -9.071 10.880 -0.941 1.00 0.00 H new ATOM 0 HG SER A 49 -10.652 9.463 -0.008 1.00 0.00 H new ATOM 696 N PRO A 50 -6.293 11.456 -1.552 1.00 0.00 N ATOM 697 CA PRO A 50 -5.441 12.608 -1.861 1.00 0.00 C ATOM 698 C PRO A 50 -6.033 13.919 -1.355 1.00 0.00 C ATOM 699 O PRO A 50 -5.409 14.975 -1.462 1.00 0.00 O ATOM 700 CB PRO A 50 -5.380 12.604 -3.391 1.00 0.00 C ATOM 701 CG PRO A 50 -6.629 11.914 -3.818 1.00 0.00 C ATOM 702 CD PRO A 50 -6.918 10.887 -2.758 1.00 0.00 C ATOM 0 HA PRO A 50 -4.465 12.533 -1.382 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -5.332 13.618 -3.788 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -4.495 12.079 -3.751 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -7.453 12.621 -3.911 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.501 11.443 -4.793 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.989 10.739 -2.624 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.492 9.917 -3.012 1.00 0.00 H new ATOM 710 N SER A 51 -7.240 13.845 -0.804 1.00 0.00 N ATOM 711 CA SER A 51 -7.918 15.027 -0.285 1.00 0.00 C ATOM 712 C SER A 51 -7.819 15.085 1.237 1.00 0.00 C ATOM 713 O SER A 51 -7.840 16.162 1.831 1.00 0.00 O ATOM 714 CB SER A 51 -9.387 15.028 -0.712 1.00 0.00 C ATOM 715 OG SER A 51 -10.074 13.908 -0.180 1.00 0.00 O ATOM 0 H SER A 51 -7.769 12.978 -0.705 1.00 0.00 H new ATOM 0 HA SER A 51 -7.427 15.908 -0.698 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.866 15.947 -0.374 1.00 0.00 H new ATOM 0 HB3 SER A 51 -9.453 15.016 -1.800 1.00 0.00 H new ATOM 0 HG SER A 51 -11.011 13.933 -0.466 1.00 0.00 H new ATOM 721 N GLY A 52 -7.712 13.916 1.862 1.00 0.00 N ATOM 722 CA GLY A 52 -7.612 13.855 3.308 1.00 0.00 C ATOM 723 C GLY A 52 -8.446 12.737 3.900 1.00 0.00 C ATOM 724 O GLY A 52 -8.158 12.251 4.994 1.00 0.00 O ATOM 0 H GLY A 52 -7.693 13.011 1.392 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.569 13.715 3.591 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.933 14.807 3.732 1.00 0.00 H new ATOM 728 N ARG A 53 -9.484 12.328 3.178 1.00 0.00 N ATOM 729 CA ARG A 53 -10.364 11.262 3.639 1.00 0.00 C ATOM 730 C ARG A 53 -9.621 9.931 3.700 1.00 0.00 C ATOM 731 O ARG A 53 -8.669 9.704 2.952 1.00 0.00 O ATOM 732 CB ARG A 53 -11.578 11.138 2.717 1.00 0.00 C ATOM 733 CG ARG A 53 -12.746 12.021 3.127 1.00 0.00 C ATOM 734 CD ARG A 53 -13.749 12.178 1.995 1.00 0.00 C ATOM 735 NE ARG A 53 -14.703 11.073 1.950 1.00 0.00 N ATOM 736 CZ ARG A 53 -15.652 10.958 1.028 1.00 0.00 C ATOM 737 NH1 ARG A 53 -15.772 11.875 0.078 1.00 0.00 N ATOM 738 NH2 ARG A 53 -16.482 9.923 1.054 1.00 0.00 N ATOM 0 H ARG A 53 -9.736 12.719 2.270 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.703 11.516 4.643 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.279 11.394 1.700 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.907 10.099 2.701 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -13.242 11.590 3.997 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.375 13.002 3.425 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -14.288 13.117 2.117 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -13.217 12.236 1.045 1.00 0.00 H new ATOM 0 HE ARG A 53 -14.637 10.350 2.666 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -15.135 12.671 0.054 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -16.502 11.784 -0.629 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -16.391 9.215 1.783 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -17.211 9.836 0.345 1.00 0.00 H new ATOM 752 N VAL A 54 -10.061 9.053 4.596 1.00 0.00 N ATOM 753 CA VAL A 54 -9.438 7.744 4.754 1.00 0.00 C ATOM 754 C VAL A 54 -10.477 6.630 4.692 1.00 0.00 C ATOM 755 O VAL A 54 -11.555 6.737 5.278 1.00 0.00 O ATOM 756 CB VAL A 54 -8.673 7.644 6.087 1.00 0.00 C ATOM 757 CG1 VAL A 54 -8.031 6.273 6.232 1.00 0.00 C ATOM 758 CG2 VAL A 54 -7.627 8.744 6.184 1.00 0.00 C ATOM 0 H VAL A 54 -10.847 9.225 5.224 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.734 7.627 3.930 1.00 0.00 H new ATOM 0 HB VAL A 54 -9.382 7.775 6.904 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.495 6.221 7.180 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.804 5.505 6.210 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.333 6.109 5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -7.096 8.658 7.132 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -6.919 8.646 5.361 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.116 9.717 6.128 1.00 0.00 H new ATOM 768 N THR A 55 -10.146 5.558 3.978 1.00 0.00 N ATOM 769 CA THR A 55 -11.050 4.424 3.839 1.00 0.00 C ATOM 770 C THR A 55 -10.518 3.203 4.580 1.00 0.00 C ATOM 771 O THR A 55 -9.347 3.155 4.955 1.00 0.00 O ATOM 772 CB THR A 55 -11.268 4.057 2.359 1.00 0.00 C ATOM 773 OG1 THR A 55 -11.555 5.237 1.599 1.00 0.00 O ATOM 774 CG2 THR A 55 -12.409 3.062 2.210 1.00 0.00 C ATOM 0 H THR A 55 -9.258 5.452 3.487 1.00 0.00 H new ATOM 0 HA THR A 55 -12.003 4.724 4.275 1.00 0.00 H new ATOM 0 HB THR A 55 -10.354 3.596 1.984 1.00 0.00 H new ATOM 0 HG1 THR A 55 -11.691 4.996 0.659 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.544 2.818 1.156 1.00 0.00 H new ATOM 0 HG22 THR A 55 -12.175 2.154 2.765 1.00 0.00 H new ATOM 0 HG23 THR A 55 -13.327 3.500 2.601 1.00 0.00 H new ATOM 782 N GLU A 56 -11.386 2.217 4.787 1.00 0.00 N ATOM 783 CA GLU A 56 -11.001 0.995 5.484 1.00 0.00 C ATOM 784 C GLU A 56 -11.134 -0.218 4.568 1.00 0.00 C ATOM 785 O GLU A 56 -12.066 -0.306 3.768 1.00 0.00 O ATOM 786 CB GLU A 56 -11.862 0.802 6.733 1.00 0.00 C ATOM 787 CG GLU A 56 -11.309 -0.232 7.699 1.00 0.00 C ATOM 788 CD GLU A 56 -12.119 -0.328 8.978 1.00 0.00 C ATOM 789 OE1 GLU A 56 -12.175 0.673 9.722 1.00 0.00 O ATOM 790 OE2 GLU A 56 -12.697 -1.405 9.234 1.00 0.00 O ATOM 0 H GLU A 56 -12.359 2.241 4.482 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.957 1.090 5.783 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -11.956 1.757 7.250 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.866 0.504 6.430 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.291 -1.206 7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.278 0.021 7.945 1.00 0.00 H new ATOM 797 N ALA A 57 -10.196 -1.151 4.691 1.00 0.00 N ATOM 798 CA ALA A 57 -10.209 -2.360 3.877 1.00 0.00 C ATOM 799 C ALA A 57 -10.244 -3.610 4.750 1.00 0.00 C ATOM 800 O ALA A 57 -9.901 -3.563 5.931 1.00 0.00 O ATOM 801 CB ALA A 57 -8.996 -2.390 2.958 1.00 0.00 C ATOM 0 H ALA A 57 -9.417 -1.093 5.347 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.113 -2.349 3.268 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -9.018 -3.298 2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -9.015 -1.519 2.302 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -8.085 -2.374 3.557 1.00 0.00 H new ATOM 807 N GLU A 58 -10.662 -4.726 4.161 1.00 0.00 N ATOM 808 CA GLU A 58 -10.744 -5.988 4.887 1.00 0.00 C ATOM 809 C GLU A 58 -9.604 -6.920 4.487 1.00 0.00 C ATOM 810 O GLU A 58 -9.165 -6.924 3.337 1.00 0.00 O ATOM 811 CB GLU A 58 -12.089 -6.667 4.624 1.00 0.00 C ATOM 812 CG GLU A 58 -12.204 -8.050 5.244 1.00 0.00 C ATOM 813 CD GLU A 58 -13.643 -8.458 5.495 1.00 0.00 C ATOM 814 OE1 GLU A 58 -14.310 -7.800 6.321 1.00 0.00 O ATOM 815 OE2 GLU A 58 -14.102 -9.435 4.867 1.00 0.00 O ATOM 0 H GLU A 58 -10.949 -4.782 3.184 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.657 -5.772 5.952 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.888 -6.036 5.014 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -12.242 -6.747 3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.733 -8.780 4.586 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.655 -8.069 6.186 1.00 0.00 H new ATOM 822 N ILE A 59 -9.128 -7.708 5.446 1.00 0.00 N ATOM 823 CA ILE A 59 -8.040 -8.645 5.194 1.00 0.00 C ATOM 824 C ILE A 59 -8.536 -10.086 5.230 1.00 0.00 C ATOM 825 O ILE A 59 -8.874 -10.612 6.291 1.00 0.00 O ATOM 826 CB ILE A 59 -6.905 -8.478 6.222 1.00 0.00 C ATOM 827 CG1 ILE A 59 -6.415 -7.029 6.243 1.00 0.00 C ATOM 828 CG2 ILE A 59 -5.759 -9.427 5.903 1.00 0.00 C ATOM 829 CD1 ILE A 59 -5.659 -6.665 7.501 1.00 0.00 C ATOM 0 H ILE A 59 -9.479 -7.716 6.404 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.654 -8.421 4.199 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.291 -8.725 7.211 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.771 -6.859 5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.271 -6.363 6.138 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -4.964 -9.298 6.638 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.119 -10.455 5.935 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -5.372 -9.209 4.908 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.342 -5.624 7.446 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.306 -6.802 8.367 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -4.783 -7.306 7.597 1.00 0.00 H new ATOM 841 N VAL A 60 -8.576 -10.722 4.063 1.00 0.00 N ATOM 842 CA VAL A 60 -9.028 -12.105 3.961 1.00 0.00 C ATOM 843 C VAL A 60 -7.906 -13.077 4.307 1.00 0.00 C ATOM 844 O VAL A 60 -6.799 -13.002 3.772 1.00 0.00 O ATOM 845 CB VAL A 60 -9.550 -12.421 2.547 1.00 0.00 C ATOM 846 CG1 VAL A 60 -9.850 -13.906 2.409 1.00 0.00 C ATOM 847 CG2 VAL A 60 -10.784 -11.588 2.235 1.00 0.00 C ATOM 0 H VAL A 60 -8.301 -10.302 3.175 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.842 -12.226 4.676 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.774 -12.162 1.826 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.218 -14.111 1.404 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.940 -14.479 2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.608 -14.193 3.138 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.139 -11.825 1.232 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.567 -11.812 2.959 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.532 -10.529 2.290 1.00 0.00 H new ATOM 857 N PRO A 61 -8.195 -14.013 5.223 1.00 0.00 N ATOM 858 CA PRO A 61 -7.223 -15.019 5.660 1.00 0.00 C ATOM 859 C PRO A 61 -6.916 -16.041 4.571 1.00 0.00 C ATOM 860 O PRO A 61 -7.778 -16.831 4.188 1.00 0.00 O ATOM 861 CB PRO A 61 -7.919 -15.693 6.845 1.00 0.00 C ATOM 862 CG PRO A 61 -9.374 -15.490 6.595 1.00 0.00 C ATOM 863 CD PRO A 61 -9.493 -14.161 5.902 1.00 0.00 C ATOM 0 HA PRO A 61 -6.260 -14.573 5.910 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -7.671 -16.753 6.899 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -7.613 -15.245 7.791 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -9.779 -16.291 5.976 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.935 -15.495 7.530 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -10.321 -14.150 5.193 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.670 -13.352 6.611 1.00 0.00 H new ATOM 871 N MET A 62 -5.683 -16.018 4.075 1.00 0.00 N ATOM 872 CA MET A 62 -5.263 -16.944 3.030 1.00 0.00 C ATOM 873 C MET A 62 -4.687 -18.221 3.635 1.00 0.00 C ATOM 874 O MET A 62 -5.295 -19.287 3.553 1.00 0.00 O ATOM 875 CB MET A 62 -4.225 -16.284 2.121 1.00 0.00 C ATOM 876 CG MET A 62 -4.788 -15.151 1.278 1.00 0.00 C ATOM 877 SD MET A 62 -3.564 -14.439 0.163 1.00 0.00 S ATOM 878 CE MET A 62 -4.341 -14.730 -1.424 1.00 0.00 C ATOM 0 H MET A 62 -4.958 -15.369 4.380 1.00 0.00 H new ATOM 0 HA MET A 62 -6.140 -17.206 2.438 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.410 -15.899 2.734 1.00 0.00 H new ATOM 0 HB3 MET A 62 -3.799 -17.040 1.461 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.632 -15.521 0.696 1.00 0.00 H new ATOM 0 HG3 MET A 62 -5.172 -14.371 1.935 1.00 0.00 H new ATOM 0 HE1 MET A 62 -3.863 -14.110 -2.182 1.00 0.00 H new ATOM 0 HE2 MET A 62 -4.234 -15.781 -1.694 1.00 0.00 H new ATOM 0 HE3 MET A 62 -5.399 -14.477 -1.363 1.00 0.00 H new ATOM 888 N GLY A 63 -3.509 -18.105 4.241 1.00 0.00 N ATOM 889 CA GLY A 63 -2.872 -19.258 4.850 1.00 0.00 C ATOM 890 C GLY A 63 -1.631 -18.885 5.637 1.00 0.00 C ATOM 891 O GLY A 63 -1.713 -18.183 6.646 1.00 0.00 O ATOM 0 H GLY A 63 -2.985 -17.234 4.321 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.582 -19.755 5.511 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -2.604 -19.974 4.073 1.00 0.00 H new ATOM 895 N LYS A 64 -0.477 -19.358 5.178 1.00 0.00 N ATOM 896 CA LYS A 64 0.787 -19.071 5.846 1.00 0.00 C ATOM 897 C LYS A 64 1.442 -17.825 5.259 1.00 0.00 C ATOM 898 O LYS A 64 1.598 -17.708 4.045 1.00 0.00 O ATOM 899 CB LYS A 64 1.736 -20.266 5.720 1.00 0.00 C ATOM 900 CG LYS A 64 1.992 -20.691 4.285 1.00 0.00 C ATOM 901 CD LYS A 64 3.020 -21.807 4.209 1.00 0.00 C ATOM 902 CE LYS A 64 3.606 -21.931 2.811 1.00 0.00 C ATOM 903 NZ LYS A 64 2.777 -22.808 1.938 1.00 0.00 N ATOM 0 H LYS A 64 -0.391 -19.942 4.346 1.00 0.00 H new ATOM 0 HA LYS A 64 0.579 -18.888 6.900 1.00 0.00 H new ATOM 0 HB2 LYS A 64 2.687 -20.015 6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.320 -21.109 6.271 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.058 -21.023 3.831 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.340 -19.835 3.707 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.820 -21.616 4.924 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.556 -22.751 4.495 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.685 -20.941 2.361 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.617 -22.334 2.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.210 -22.867 0.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.722 -23.760 2.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.819 -22.411 1.856 1.00 0.00 H new ATOM 917 N ASN A 65 1.825 -16.897 6.131 1.00 0.00 N ATOM 918 CA ASN A 65 2.464 -15.659 5.699 1.00 0.00 C ATOM 919 C ASN A 65 1.825 -15.136 4.416 1.00 0.00 C ATOM 920 O ASN A 65 2.519 -14.705 3.495 1.00 0.00 O ATOM 921 CB ASN A 65 3.962 -15.884 5.481 1.00 0.00 C ATOM 922 CG ASN A 65 4.248 -16.715 4.245 1.00 0.00 C ATOM 923 OD1 ASN A 65 4.019 -17.925 4.231 1.00 0.00 O ATOM 924 ND2 ASN A 65 4.752 -16.069 3.201 1.00 0.00 N ATOM 0 H ASN A 65 1.704 -16.979 7.140 1.00 0.00 H new ATOM 0 HA ASN A 65 2.325 -14.914 6.483 1.00 0.00 H new ATOM 0 HB2 ASN A 65 4.462 -14.920 5.391 1.00 0.00 H new ATOM 0 HB3 ASN A 65 4.383 -16.381 6.355 1.00 0.00 H new ATOM 0 HD21 ASN A 65 4.966 -16.576 2.342 1.00 0.00 H new ATOM 0 HD22 ASN A 65 4.926 -15.065 3.257 1.00 0.00 H new ATOM 931 N SER A 66 0.497 -15.178 4.363 1.00 0.00 N ATOM 932 CA SER A 66 -0.236 -14.711 3.192 1.00 0.00 C ATOM 933 C SER A 66 -1.457 -13.894 3.606 1.00 0.00 C ATOM 934 O SER A 66 -2.193 -14.274 4.517 1.00 0.00 O ATOM 935 CB SER A 66 -0.671 -15.898 2.330 1.00 0.00 C ATOM 936 OG SER A 66 0.439 -16.485 1.674 1.00 0.00 O ATOM 0 H SER A 66 -0.093 -15.530 5.117 1.00 0.00 H new ATOM 0 HA SER A 66 0.427 -14.072 2.609 1.00 0.00 H new ATOM 0 HB2 SER A 66 -1.165 -16.643 2.954 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.401 -15.567 1.591 1.00 0.00 H new ATOM 0 HG SER A 66 0.987 -16.968 2.327 1.00 0.00 H new ATOM 942 N HIS A 67 -1.665 -12.769 2.929 1.00 0.00 N ATOM 943 CA HIS A 67 -2.796 -11.897 3.224 1.00 0.00 C ATOM 944 C HIS A 67 -3.293 -11.204 1.959 1.00 0.00 C ATOM 945 O HIS A 67 -2.498 -10.738 1.142 1.00 0.00 O ATOM 946 CB HIS A 67 -2.404 -10.854 4.270 1.00 0.00 C ATOM 947 CG HIS A 67 -2.159 -11.432 5.630 1.00 0.00 C ATOM 948 ND1 HIS A 67 -3.164 -11.641 6.551 1.00 0.00 N ATOM 949 CD2 HIS A 67 -1.015 -11.847 6.223 1.00 0.00 C ATOM 950 CE1 HIS A 67 -2.648 -12.158 7.652 1.00 0.00 C ATOM 951 NE2 HIS A 67 -1.346 -12.294 7.479 1.00 0.00 N ATOM 0 H HIS A 67 -1.065 -12.440 2.173 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.603 -12.513 3.621 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.504 -10.337 3.936 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.194 -10.106 4.339 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.026 -11.830 5.789 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.198 -12.424 8.543 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -0.692 -12.670 8.166 1.00 0.00 H new ATOM 959 N CYS A 68 -4.611 -11.142 1.804 1.00 0.00 N ATOM 960 CA CYS A 68 -5.214 -10.507 0.637 1.00 0.00 C ATOM 961 C CYS A 68 -6.221 -9.441 1.057 1.00 0.00 C ATOM 962 O CYS A 68 -7.051 -9.669 1.937 1.00 0.00 O ATOM 963 CB CYS A 68 -5.899 -11.554 -0.242 1.00 0.00 C ATOM 964 SG CYS A 68 -5.960 -11.120 -1.996 1.00 0.00 S ATOM 0 H CYS A 68 -5.282 -11.523 2.471 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.420 -10.026 0.065 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -5.376 -12.504 -0.132 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -6.916 -11.707 0.119 1.00 0.00 H new ATOM 0 HG CYS A 68 -6.636 -10.020 -2.148 1.00 0.00 H new ATOM 970 N VAL A 69 -6.140 -8.276 0.423 1.00 0.00 N ATOM 971 CA VAL A 69 -7.044 -7.174 0.732 1.00 0.00 C ATOM 972 C VAL A 69 -7.966 -6.874 -0.445 1.00 0.00 C ATOM 973 O VAL A 69 -7.521 -6.399 -1.490 1.00 0.00 O ATOM 974 CB VAL A 69 -6.266 -5.896 1.099 1.00 0.00 C ATOM 975 CG1 VAL A 69 -7.225 -4.749 1.378 1.00 0.00 C ATOM 976 CG2 VAL A 69 -5.362 -6.149 2.296 1.00 0.00 C ATOM 0 H VAL A 69 -5.458 -8.071 -0.307 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.642 -7.485 1.589 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.640 -5.616 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -6.658 -3.855 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.827 -4.554 0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.879 -5.015 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.820 -5.236 2.542 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.966 -6.453 3.151 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -4.651 -6.939 2.055 1.00 0.00 H new ATOM 986 N ARG A 70 -9.253 -7.153 -0.267 1.00 0.00 N ATOM 987 CA ARG A 70 -10.239 -6.914 -1.314 1.00 0.00 C ATOM 988 C ARG A 70 -10.984 -5.605 -1.071 1.00 0.00 C ATOM 989 O ARG A 70 -11.674 -5.449 -0.064 1.00 0.00 O ATOM 990 CB ARG A 70 -11.234 -8.074 -1.383 1.00 0.00 C ATOM 991 CG ARG A 70 -10.640 -9.353 -1.951 1.00 0.00 C ATOM 992 CD ARG A 70 -11.665 -10.476 -1.984 1.00 0.00 C ATOM 993 NE ARG A 70 -11.344 -11.480 -2.995 1.00 0.00 N ATOM 994 CZ ARG A 70 -12.043 -12.596 -3.170 1.00 0.00 C ATOM 995 NH1 ARG A 70 -13.096 -12.849 -2.406 1.00 0.00 N ATOM 996 NH2 ARG A 70 -11.688 -13.461 -4.111 1.00 0.00 N ATOM 0 H ARG A 70 -9.637 -7.545 0.593 1.00 0.00 H new ATOM 0 HA ARG A 70 -9.711 -6.841 -2.265 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.616 -8.274 -0.382 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -12.085 -7.776 -1.995 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -10.270 -9.167 -2.959 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -9.784 -9.657 -1.348 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -11.714 -10.951 -1.004 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.652 -10.060 -2.187 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.539 -11.315 -3.600 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -13.372 -12.186 -1.681 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -13.631 -13.707 -2.543 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -10.878 -13.269 -4.701 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.225 -14.318 -4.245 1.00 0.00 H new ATOM 1010 N PHE A 71 -10.838 -4.666 -2.000 1.00 0.00 N ATOM 1011 CA PHE A 71 -11.495 -3.369 -1.886 1.00 0.00 C ATOM 1012 C PHE A 71 -11.571 -2.677 -3.243 1.00 0.00 C ATOM 1013 O PHE A 71 -10.930 -3.099 -4.205 1.00 0.00 O ATOM 1014 CB PHE A 71 -10.748 -2.481 -0.889 1.00 0.00 C ATOM 1015 CG PHE A 71 -9.343 -2.156 -1.310 1.00 0.00 C ATOM 1016 CD1 PHE A 71 -8.344 -3.112 -1.230 1.00 0.00 C ATOM 1017 CD2 PHE A 71 -9.023 -0.895 -1.786 1.00 0.00 C ATOM 1018 CE1 PHE A 71 -7.050 -2.817 -1.618 1.00 0.00 C ATOM 1019 CE2 PHE A 71 -7.731 -0.594 -2.176 1.00 0.00 C ATOM 1020 CZ PHE A 71 -6.743 -1.556 -2.090 1.00 0.00 C ATOM 0 H PHE A 71 -10.271 -4.779 -2.840 1.00 0.00 H new ATOM 0 HA PHE A 71 -12.510 -3.534 -1.525 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -11.303 -1.552 -0.756 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -10.722 -2.979 0.080 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -8.578 -4.099 -0.860 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -9.791 -0.139 -1.853 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.280 -3.572 -1.552 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -7.494 0.392 -2.547 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.733 -1.322 -2.391 1.00 0.00 H new ATOM 1030 N VAL A 72 -12.361 -1.610 -3.313 1.00 0.00 N ATOM 1031 CA VAL A 72 -12.522 -0.858 -4.552 1.00 0.00 C ATOM 1032 C VAL A 72 -11.752 0.457 -4.500 1.00 0.00 C ATOM 1033 O VAL A 72 -12.254 1.482 -4.038 1.00 0.00 O ATOM 1034 CB VAL A 72 -14.006 -0.560 -4.839 1.00 0.00 C ATOM 1035 CG1 VAL A 72 -14.152 0.233 -6.129 1.00 0.00 C ATOM 1036 CG2 VAL A 72 -14.805 -1.852 -4.905 1.00 0.00 C ATOM 0 H VAL A 72 -12.899 -1.247 -2.526 1.00 0.00 H new ATOM 0 HA VAL A 72 -12.122 -1.479 -5.354 1.00 0.00 H new ATOM 0 HB VAL A 72 -14.402 0.044 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -15.207 0.434 -6.315 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.613 1.176 -6.039 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.740 -0.342 -6.958 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.851 -1.623 -5.108 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -14.410 -2.484 -5.701 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.727 -2.377 -3.953 1.00 0.00 H new ATOM 1046 N PRO A 73 -10.502 0.430 -4.987 1.00 0.00 N ATOM 1047 CA PRO A 73 -9.636 1.612 -5.008 1.00 0.00 C ATOM 1048 C PRO A 73 -10.108 2.659 -6.012 1.00 0.00 C ATOM 1049 O PRO A 73 -9.586 2.746 -7.123 1.00 0.00 O ATOM 1050 CB PRO A 73 -8.275 1.047 -5.426 1.00 0.00 C ATOM 1051 CG PRO A 73 -8.598 -0.192 -6.187 1.00 0.00 C ATOM 1052 CD PRO A 73 -9.839 -0.756 -5.553 1.00 0.00 C ATOM 0 HA PRO A 73 -9.624 2.125 -4.046 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.723 1.757 -6.042 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.654 0.828 -4.558 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.765 0.030 -7.241 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.776 -0.906 -6.138 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -10.471 -1.259 -6.285 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.599 -1.488 -4.782 1.00 0.00 H new ATOM 1060 N GLN A 74 -11.097 3.451 -5.611 1.00 0.00 N ATOM 1061 CA GLN A 74 -11.640 4.492 -6.477 1.00 0.00 C ATOM 1062 C GLN A 74 -11.453 5.871 -5.853 1.00 0.00 C ATOM 1063 O GLN A 74 -12.058 6.185 -4.828 1.00 0.00 O ATOM 1064 CB GLN A 74 -13.124 4.238 -6.747 1.00 0.00 C ATOM 1065 CG GLN A 74 -13.376 3.230 -7.856 1.00 0.00 C ATOM 1066 CD GLN A 74 -14.732 3.409 -8.510 1.00 0.00 C ATOM 1067 OE1 GLN A 74 -14.848 4.035 -9.564 1.00 0.00 O ATOM 1068 NE2 GLN A 74 -15.768 2.858 -7.887 1.00 0.00 N ATOM 0 H GLN A 74 -11.538 3.392 -4.693 1.00 0.00 H new ATOM 0 HA GLN A 74 -11.097 4.464 -7.421 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -13.596 3.883 -5.831 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -13.604 5.181 -7.008 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -12.597 3.325 -8.612 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -13.304 2.222 -7.449 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -15.626 2.348 -7.015 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -16.705 2.945 -8.280 1.00 0.00 H new ATOM 1077 N GLU A 75 -10.611 6.689 -6.477 1.00 0.00 N ATOM 1078 CA GLU A 75 -10.344 8.034 -5.980 1.00 0.00 C ATOM 1079 C GLU A 75 -10.242 9.028 -7.133 1.00 0.00 C ATOM 1080 O GLU A 75 -10.212 8.641 -8.300 1.00 0.00 O ATOM 1081 CB GLU A 75 -9.052 8.052 -5.160 1.00 0.00 C ATOM 1082 CG GLU A 75 -9.004 9.164 -4.126 1.00 0.00 C ATOM 1083 CD GLU A 75 -10.291 9.280 -3.333 1.00 0.00 C ATOM 1084 OE1 GLU A 75 -10.830 8.231 -2.922 1.00 0.00 O ATOM 1085 OE2 GLU A 75 -10.759 10.418 -3.124 1.00 0.00 O ATOM 0 H GLU A 75 -10.103 6.444 -7.327 1.00 0.00 H new ATOM 0 HA GLU A 75 -11.175 8.330 -5.340 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.938 7.093 -4.655 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.204 8.159 -5.836 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -8.175 8.983 -3.442 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -8.803 10.111 -4.626 1.00 0.00 H new ATOM 1092 N MET A 76 -10.189 10.313 -6.795 1.00 0.00 N ATOM 1093 CA MET A 76 -10.089 11.364 -7.801 1.00 0.00 C ATOM 1094 C MET A 76 -8.642 11.810 -7.980 1.00 0.00 C ATOM 1095 O MET A 76 -8.361 12.767 -8.700 1.00 0.00 O ATOM 1096 CB MET A 76 -10.959 12.559 -7.409 1.00 0.00 C ATOM 1097 CG MET A 76 -12.397 12.185 -7.088 1.00 0.00 C ATOM 1098 SD MET A 76 -13.511 13.603 -7.137 1.00 0.00 S ATOM 1099 CE MET A 76 -14.515 13.294 -5.687 1.00 0.00 C ATOM 0 H MET A 76 -10.214 10.651 -5.833 1.00 0.00 H new ATOM 0 HA MET A 76 -10.445 10.960 -8.749 1.00 0.00 H new ATOM 0 HB2 MET A 76 -10.518 13.050 -6.542 1.00 0.00 H new ATOM 0 HB3 MET A 76 -10.954 13.284 -8.223 1.00 0.00 H new ATOM 0 HG2 MET A 76 -12.740 11.433 -7.799 1.00 0.00 H new ATOM 0 HG3 MET A 76 -12.438 11.730 -6.098 1.00 0.00 H new ATOM 0 HE1 MET A 76 -15.254 14.088 -5.581 1.00 0.00 H new ATOM 0 HE2 MET A 76 -15.024 12.336 -5.794 1.00 0.00 H new ATOM 0 HE3 MET A 76 -13.879 13.270 -4.802 1.00 0.00 H new ATOM 1109 N GLY A 77 -7.725 11.110 -7.318 1.00 0.00 N ATOM 1110 CA GLY A 77 -6.318 11.450 -7.417 1.00 0.00 C ATOM 1111 C GLY A 77 -5.415 10.249 -7.214 1.00 0.00 C ATOM 1112 O GLY A 77 -5.619 9.200 -7.824 1.00 0.00 O ATOM 0 H GLY A 77 -7.932 10.314 -6.715 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.121 11.887 -8.396 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.078 12.211 -6.674 1.00 0.00 H new ATOM 1116 N VAL A 78 -4.413 10.403 -6.353 1.00 0.00 N ATOM 1117 CA VAL A 78 -3.476 9.323 -6.071 1.00 0.00 C ATOM 1118 C VAL A 78 -3.941 8.487 -4.884 1.00 0.00 C ATOM 1119 O VAL A 78 -4.502 9.013 -3.922 1.00 0.00 O ATOM 1120 CB VAL A 78 -2.064 9.866 -5.780 1.00 0.00 C ATOM 1121 CG1 VAL A 78 -2.048 10.635 -4.467 1.00 0.00 C ATOM 1122 CG2 VAL A 78 -1.051 8.732 -5.756 1.00 0.00 C ATOM 0 H VAL A 78 -4.230 11.265 -5.839 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.440 8.696 -6.962 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.786 10.553 -6.579 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.043 11.011 -4.278 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.743 11.472 -4.527 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.347 9.973 -3.654 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.059 9.134 -5.549 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.322 8.018 -4.978 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.044 8.230 -6.723 1.00 0.00 H new ATOM 1132 N HIS A 79 -3.705 7.181 -4.958 1.00 0.00 N ATOM 1133 CA HIS A 79 -4.100 6.271 -3.889 1.00 0.00 C ATOM 1134 C HIS A 79 -2.914 5.951 -2.983 1.00 0.00 C ATOM 1135 O HIS A 79 -1.784 5.802 -3.450 1.00 0.00 O ATOM 1136 CB HIS A 79 -4.673 4.980 -4.474 1.00 0.00 C ATOM 1137 CG HIS A 79 -5.956 5.178 -5.220 1.00 0.00 C ATOM 1138 ND1 HIS A 79 -6.156 6.211 -6.112 1.00 0.00 N ATOM 1139 CD2 HIS A 79 -7.108 4.468 -5.205 1.00 0.00 C ATOM 1140 CE1 HIS A 79 -7.376 6.128 -6.611 1.00 0.00 C ATOM 1141 NE2 HIS A 79 -7.975 5.079 -6.077 1.00 0.00 N ATOM 0 H HIS A 79 -3.242 6.729 -5.747 1.00 0.00 H new ATOM 0 HA HIS A 79 -4.869 6.762 -3.293 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -3.937 4.537 -5.145 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -4.838 4.267 -3.666 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -5.469 6.927 -6.349 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -7.308 3.585 -4.616 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -7.810 6.803 -7.333 1.00 0.00 H new ATOM 1149 N THR A 80 -3.179 5.846 -1.684 1.00 0.00 N ATOM 1150 CA THR A 80 -2.134 5.546 -0.713 1.00 0.00 C ATOM 1151 C THR A 80 -2.607 4.510 0.300 1.00 0.00 C ATOM 1152 O THR A 80 -3.548 4.750 1.056 1.00 0.00 O ATOM 1153 CB THR A 80 -1.684 6.813 0.038 1.00 0.00 C ATOM 1154 OG1 THR A 80 -1.289 7.823 -0.897 1.00 0.00 O ATOM 1155 CG2 THR A 80 -0.528 6.504 0.976 1.00 0.00 C ATOM 0 H THR A 80 -4.108 5.964 -1.281 1.00 0.00 H new ATOM 0 HA THR A 80 -1.289 5.145 -1.272 1.00 0.00 H new ATOM 0 HB THR A 80 -2.525 7.175 0.630 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.006 8.626 -0.411 1.00 0.00 H new ATOM 0 HG21 THR A 80 -0.228 7.414 1.495 1.00 0.00 H new ATOM 0 HG22 THR A 80 -0.841 5.757 1.705 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.314 6.119 0.401 1.00 0.00 H new ATOM 1163 N VAL A 81 -1.947 3.355 0.310 1.00 0.00 N ATOM 1164 CA VAL A 81 -2.299 2.282 1.232 1.00 0.00 C ATOM 1165 C VAL A 81 -1.466 2.357 2.507 1.00 0.00 C ATOM 1166 O VAL A 81 -0.237 2.299 2.461 1.00 0.00 O ATOM 1167 CB VAL A 81 -2.103 0.899 0.584 1.00 0.00 C ATOM 1168 CG1 VAL A 81 -2.466 -0.206 1.564 1.00 0.00 C ATOM 1169 CG2 VAL A 81 -2.927 0.786 -0.689 1.00 0.00 C ATOM 0 H VAL A 81 -1.166 3.139 -0.310 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.352 2.412 1.482 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.052 0.786 0.320 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.321 -1.176 1.088 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.828 -0.135 2.445 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.509 -0.100 1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.776 -0.198 -1.134 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.983 0.919 -0.452 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.613 1.555 -1.395 1.00 0.00 H new ATOM 1179 N SER A 82 -2.143 2.486 3.643 1.00 0.00 N ATOM 1180 CA SER A 82 -1.465 2.573 4.931 1.00 0.00 C ATOM 1181 C SER A 82 -1.483 1.226 5.647 1.00 0.00 C ATOM 1182 O SER A 82 -2.505 0.817 6.198 1.00 0.00 O ATOM 1183 CB SER A 82 -2.125 3.638 5.809 1.00 0.00 C ATOM 1184 OG SER A 82 -2.147 4.895 5.155 1.00 0.00 O ATOM 0 H SER A 82 -3.160 2.533 3.698 1.00 0.00 H new ATOM 0 HA SER A 82 -0.428 2.854 4.748 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.143 3.333 6.053 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.584 3.724 6.751 1.00 0.00 H new ATOM 0 HG SER A 82 -2.575 5.558 5.736 1.00 0.00 H new ATOM 1190 N VAL A 83 -0.345 0.539 5.633 1.00 0.00 N ATOM 1191 CA VAL A 83 -0.229 -0.762 6.280 1.00 0.00 C ATOM 1192 C VAL A 83 0.725 -0.701 7.468 1.00 0.00 C ATOM 1193 O VAL A 83 1.943 -0.649 7.298 1.00 0.00 O ATOM 1194 CB VAL A 83 0.264 -1.838 5.294 1.00 0.00 C ATOM 1195 CG1 VAL A 83 0.325 -3.197 5.974 1.00 0.00 C ATOM 1196 CG2 VAL A 83 -0.633 -1.886 4.067 1.00 0.00 C ATOM 0 H VAL A 83 0.510 0.862 5.180 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.225 -1.031 6.631 1.00 0.00 H new ATOM 0 HB VAL A 83 1.271 -1.576 4.969 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.675 -3.945 5.262 1.00 0.00 H new ATOM 0 HG12 VAL A 83 1.012 -3.151 6.819 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.668 -3.471 6.329 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.270 -2.651 3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.652 -2.124 4.371 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.620 -0.917 3.569 1.00 0.00 H new ATOM 1206 N LYS A 84 0.163 -0.709 8.672 1.00 0.00 N ATOM 1207 CA LYS A 84 0.963 -0.657 9.890 1.00 0.00 C ATOM 1208 C LYS A 84 0.768 -1.919 10.723 1.00 0.00 C ATOM 1209 O LYS A 84 -0.295 -2.540 10.689 1.00 0.00 O ATOM 1210 CB LYS A 84 0.589 0.576 10.718 1.00 0.00 C ATOM 1211 CG LYS A 84 1.156 1.873 10.167 1.00 0.00 C ATOM 1212 CD LYS A 84 0.781 3.059 11.039 1.00 0.00 C ATOM 1213 CE LYS A 84 -0.570 3.636 10.644 1.00 0.00 C ATOM 1214 NZ LYS A 84 -1.693 2.939 11.331 1.00 0.00 N ATOM 0 H LYS A 84 -0.844 -0.751 8.830 1.00 0.00 H new ATOM 0 HA LYS A 84 2.012 -0.590 9.603 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.497 0.655 10.766 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.944 0.439 11.739 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.241 1.798 10.100 1.00 0.00 H new ATOM 0 HG3 LYS A 84 0.785 2.033 9.155 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.754 2.750 12.084 1.00 0.00 H new ATOM 0 HD3 LYS A 84 1.546 3.831 10.954 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.597 4.698 10.889 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.698 3.555 9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.402 3.637 11.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.132 2.260 10.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.330 2.432 12.163 1.00 0.00 H new ATOM 1228 N TYR A 85 1.799 -2.294 11.472 1.00 0.00 N ATOM 1229 CA TYR A 85 1.742 -3.483 12.313 1.00 0.00 C ATOM 1230 C TYR A 85 1.982 -3.127 13.777 1.00 0.00 C ATOM 1231 O TYR A 85 3.124 -2.978 14.211 1.00 0.00 O ATOM 1232 CB TYR A 85 2.775 -4.511 11.850 1.00 0.00 C ATOM 1233 CG TYR A 85 3.044 -5.599 12.865 1.00 0.00 C ATOM 1234 CD1 TYR A 85 2.049 -6.500 13.226 1.00 0.00 C ATOM 1235 CD2 TYR A 85 4.291 -5.727 13.464 1.00 0.00 C ATOM 1236 CE1 TYR A 85 2.289 -7.495 14.154 1.00 0.00 C ATOM 1237 CE2 TYR A 85 4.540 -6.720 14.391 1.00 0.00 C ATOM 1238 CZ TYR A 85 3.536 -7.602 14.733 1.00 0.00 C ATOM 1239 OH TYR A 85 3.780 -8.591 15.657 1.00 0.00 O ATOM 0 H TYR A 85 2.685 -1.791 11.514 1.00 0.00 H new ATOM 0 HA TYR A 85 0.745 -3.914 12.222 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.430 -4.968 10.923 1.00 0.00 H new ATOM 0 HB3 TYR A 85 3.710 -3.998 11.624 1.00 0.00 H new ATOM 0 HD1 TYR A 85 1.072 -6.421 12.773 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.080 -5.038 13.200 1.00 0.00 H new ATOM 0 HE1 TYR A 85 1.504 -8.186 14.425 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.516 -6.806 14.846 1.00 0.00 H new ATOM 0 HH TYR A 85 4.724 -8.851 15.617 1.00 0.00 H new ATOM 1249 N ARG A 86 0.897 -2.994 14.532 1.00 0.00 N ATOM 1250 CA ARG A 86 0.988 -2.655 15.947 1.00 0.00 C ATOM 1251 C ARG A 86 1.496 -1.228 16.133 1.00 0.00 C ATOM 1252 O ARG A 86 2.196 -0.929 17.099 1.00 0.00 O ATOM 1253 CB ARG A 86 1.914 -3.636 16.670 1.00 0.00 C ATOM 1254 CG ARG A 86 1.814 -5.061 16.153 1.00 0.00 C ATOM 1255 CD ARG A 86 2.554 -6.035 17.057 1.00 0.00 C ATOM 1256 NE ARG A 86 4.003 -5.896 16.941 1.00 0.00 N ATOM 1257 CZ ARG A 86 4.868 -6.752 17.474 1.00 0.00 C ATOM 1258 NH1 ARG A 86 4.432 -7.803 18.155 1.00 0.00 N ATOM 1259 NH2 ARG A 86 6.172 -6.558 17.326 1.00 0.00 N ATOM 0 H ARG A 86 -0.055 -3.116 14.188 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.011 -2.725 16.377 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.944 -3.293 16.568 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.679 -3.627 17.734 1.00 0.00 H new ATOM 0 HG2 ARG A 86 0.766 -5.351 16.084 1.00 0.00 H new ATOM 0 HG3 ARG A 86 2.226 -5.113 15.145 1.00 0.00 H new ATOM 0 HD2 ARG A 86 2.255 -5.868 18.092 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.266 -7.055 16.803 1.00 0.00 H new ATOM 0 HE ARG A 86 4.371 -5.098 16.423 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.430 -7.956 18.271 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.098 -8.459 18.563 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.511 -5.751 16.803 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.835 -7.216 17.736 1.00 0.00 H new ATOM 1273 N GLY A 87 1.137 -0.352 15.200 1.00 0.00 N ATOM 1274 CA GLY A 87 1.566 1.033 15.279 1.00 0.00 C ATOM 1275 C GLY A 87 2.952 1.244 14.703 1.00 0.00 C ATOM 1276 O GLY A 87 3.821 1.820 15.357 1.00 0.00 O ATOM 0 H GLY A 87 0.557 -0.576 14.391 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.854 1.662 14.744 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.556 1.355 16.320 1.00 0.00 H new ATOM 1280 N GLN A 88 3.160 0.775 13.477 1.00 0.00 N ATOM 1281 CA GLN A 88 4.452 0.914 12.815 1.00 0.00 C ATOM 1282 C GLN A 88 4.335 0.612 11.325 1.00 0.00 C ATOM 1283 O GLN A 88 3.821 -0.435 10.932 1.00 0.00 O ATOM 1284 CB GLN A 88 5.481 -0.018 13.458 1.00 0.00 C ATOM 1285 CG GLN A 88 5.500 -1.413 12.853 1.00 0.00 C ATOM 1286 CD GLN A 88 6.482 -2.336 13.546 1.00 0.00 C ATOM 1287 OE1 GLN A 88 7.316 -2.972 12.900 1.00 0.00 O ATOM 1288 NE2 GLN A 88 6.389 -2.415 14.868 1.00 0.00 N ATOM 0 H GLN A 88 2.451 0.296 12.922 1.00 0.00 H new ATOM 0 HA GLN A 88 4.784 1.946 12.933 1.00 0.00 H new ATOM 0 HB2 GLN A 88 6.472 0.425 13.360 1.00 0.00 H new ATOM 0 HB3 GLN A 88 5.271 -0.096 14.525 1.00 0.00 H new ATOM 0 HG2 GLN A 88 4.500 -1.843 12.910 1.00 0.00 H new ATOM 0 HG3 GLN A 88 5.757 -1.343 11.796 1.00 0.00 H new ATOM 0 HE21 GLN A 88 5.683 -1.870 15.363 1.00 0.00 H new ATOM 0 HE22 GLN A 88 7.024 -3.020 15.389 1.00 0.00 H new ATOM 1297 N HIS A 89 4.815 1.537 10.500 1.00 0.00 N ATOM 1298 CA HIS A 89 4.765 1.369 9.052 1.00 0.00 C ATOM 1299 C HIS A 89 5.816 0.367 8.584 1.00 0.00 C ATOM 1300 O HIS A 89 7.016 0.595 8.734 1.00 0.00 O ATOM 1301 CB HIS A 89 4.979 2.713 8.354 1.00 0.00 C ATOM 1302 CG HIS A 89 3.772 3.600 8.380 1.00 0.00 C ATOM 1303 ND1 HIS A 89 2.673 3.399 7.571 1.00 0.00 N ATOM 1304 CD2 HIS A 89 3.494 4.696 9.124 1.00 0.00 C ATOM 1305 CE1 HIS A 89 1.773 4.334 7.816 1.00 0.00 C ATOM 1306 NE2 HIS A 89 2.246 5.133 8.755 1.00 0.00 N ATOM 0 H HIS A 89 5.243 2.410 10.809 1.00 0.00 H new ATOM 0 HA HIS A 89 3.780 0.984 8.790 1.00 0.00 H new ATOM 0 HB2 HIS A 89 5.811 3.232 8.830 1.00 0.00 H new ATOM 0 HB3 HIS A 89 5.266 2.533 7.318 1.00 0.00 H new ATOM 0 HD2 HIS A 89 4.135 5.144 9.869 1.00 0.00 H new ATOM 0 HE1 HIS A 89 0.813 4.429 7.331 1.00 0.00 H new ATOM 0 HE2 HIS A 89 1.763 5.943 9.143 1.00 0.00 H new ATOM 1314 N VAL A 90 5.356 -0.744 8.017 1.00 0.00 N ATOM 1315 CA VAL A 90 6.256 -1.781 7.527 1.00 0.00 C ATOM 1316 C VAL A 90 7.113 -1.266 6.376 1.00 0.00 C ATOM 1317 O VAL A 90 7.039 -0.093 6.007 1.00 0.00 O ATOM 1318 CB VAL A 90 5.478 -3.024 7.057 1.00 0.00 C ATOM 1319 CG1 VAL A 90 4.675 -3.617 8.205 1.00 0.00 C ATOM 1320 CG2 VAL A 90 4.571 -2.673 5.887 1.00 0.00 C ATOM 0 H VAL A 90 4.365 -0.949 7.886 1.00 0.00 H new ATOM 0 HA VAL A 90 6.901 -2.059 8.360 1.00 0.00 H new ATOM 0 HB VAL A 90 6.194 -3.774 6.721 1.00 0.00 H new ATOM 0 HG11 VAL A 90 4.132 -4.494 7.854 1.00 0.00 H new ATOM 0 HG12 VAL A 90 5.350 -3.906 9.010 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.967 -2.876 8.575 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.029 -3.563 5.567 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.860 -1.906 6.195 1.00 0.00 H new ATOM 0 HG23 VAL A 90 5.173 -2.298 5.059 1.00 0.00 H new ATOM 1330 N THR A 91 7.927 -2.151 5.809 1.00 0.00 N ATOM 1331 CA THR A 91 8.799 -1.787 4.699 1.00 0.00 C ATOM 1332 C THR A 91 7.992 -1.281 3.509 1.00 0.00 C ATOM 1333 O THR A 91 6.944 -1.834 3.177 1.00 0.00 O ATOM 1334 CB THR A 91 9.663 -2.980 4.249 1.00 0.00 C ATOM 1335 OG1 THR A 91 10.421 -3.481 5.356 1.00 0.00 O ATOM 1336 CG2 THR A 91 10.606 -2.572 3.127 1.00 0.00 C ATOM 0 H THR A 91 8.000 -3.126 6.101 1.00 0.00 H new ATOM 0 HA THR A 91 9.451 -0.990 5.057 1.00 0.00 H new ATOM 0 HB THR A 91 8.999 -3.762 3.879 1.00 0.00 H new ATOM 0 HG1 THR A 91 10.966 -4.240 5.062 1.00 0.00 H new ATOM 0 HG21 THR A 91 11.206 -3.431 2.826 1.00 0.00 H new ATOM 0 HG22 THR A 91 10.026 -2.218 2.275 1.00 0.00 H new ATOM 0 HG23 THR A 91 11.263 -1.775 3.475 1.00 0.00 H new ATOM 1344 N GLY A 92 8.487 -0.226 2.869 1.00 0.00 N ATOM 1345 CA GLY A 92 7.799 0.336 1.722 1.00 0.00 C ATOM 1346 C GLY A 92 6.402 0.815 2.062 1.00 0.00 C ATOM 1347 O GLY A 92 5.500 0.765 1.225 1.00 0.00 O ATOM 0 H GLY A 92 9.352 0.249 3.125 1.00 0.00 H new ATOM 0 HA2 GLY A 92 8.379 1.170 1.327 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.741 -0.414 0.934 1.00 0.00 H new ATOM 1351 N SER A 93 6.220 1.280 3.293 1.00 0.00 N ATOM 1352 CA SER A 93 4.921 1.765 3.744 1.00 0.00 C ATOM 1353 C SER A 93 5.025 3.197 4.260 1.00 0.00 C ATOM 1354 O SER A 93 6.006 3.586 4.894 1.00 0.00 O ATOM 1355 CB SER A 93 4.365 0.855 4.841 1.00 0.00 C ATOM 1356 OG SER A 93 2.949 0.829 4.813 1.00 0.00 O ATOM 0 H SER A 93 6.956 1.331 3.997 1.00 0.00 H new ATOM 0 HA SER A 93 4.241 1.752 2.892 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.753 -0.155 4.711 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.706 1.205 5.815 1.00 0.00 H new ATOM 0 HG SER A 93 2.615 0.356 5.604 1.00 0.00 H new ATOM 1362 N PRO A 94 3.988 4.002 3.983 1.00 0.00 N ATOM 1363 CA PRO A 94 2.815 3.550 3.229 1.00 0.00 C ATOM 1364 C PRO A 94 3.134 3.292 1.760 1.00 0.00 C ATOM 1365 O PRO A 94 4.233 3.588 1.292 1.00 0.00 O ATOM 1366 CB PRO A 94 1.834 4.717 3.366 1.00 0.00 C ATOM 1367 CG PRO A 94 2.695 5.909 3.604 1.00 0.00 C ATOM 1368 CD PRO A 94 3.882 5.415 4.383 1.00 0.00 C ATOM 0 HA PRO A 94 2.428 2.603 3.606 1.00 0.00 H new ATOM 0 HB2 PRO A 94 1.233 4.837 2.465 1.00 0.00 H new ATOM 0 HB3 PRO A 94 1.142 4.557 4.193 1.00 0.00 H new ATOM 0 HG2 PRO A 94 3.007 6.359 2.662 1.00 0.00 H new ATOM 0 HG3 PRO A 94 2.155 6.675 4.160 1.00 0.00 H new ATOM 0 HD2 PRO A 94 4.786 5.972 4.135 1.00 0.00 H new ATOM 0 HD3 PRO A 94 3.729 5.518 5.457 1.00 0.00 H new ATOM 1376 N PHE A 95 2.166 2.739 1.037 1.00 0.00 N ATOM 1377 CA PHE A 95 2.344 2.440 -0.379 1.00 0.00 C ATOM 1378 C PHE A 95 1.613 3.462 -1.246 1.00 0.00 C ATOM 1379 O PHE A 95 0.517 3.907 -0.907 1.00 0.00 O ATOM 1380 CB PHE A 95 1.836 1.032 -0.693 1.00 0.00 C ATOM 1381 CG PHE A 95 2.710 -0.058 -0.140 1.00 0.00 C ATOM 1382 CD1 PHE A 95 3.864 -0.442 -0.804 1.00 0.00 C ATOM 1383 CD2 PHE A 95 2.377 -0.698 1.043 1.00 0.00 C ATOM 1384 CE1 PHE A 95 4.670 -1.444 -0.298 1.00 0.00 C ATOM 1385 CE2 PHE A 95 3.180 -1.700 1.554 1.00 0.00 C ATOM 1386 CZ PHE A 95 4.327 -2.074 0.882 1.00 0.00 C ATOM 0 H PHE A 95 1.250 2.489 1.409 1.00 0.00 H new ATOM 0 HA PHE A 95 3.409 2.493 -0.605 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.830 0.919 -0.290 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.762 0.914 -1.774 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.137 0.047 -1.727 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.480 -0.411 1.572 1.00 0.00 H new ATOM 0 HE1 PHE A 95 5.567 -1.734 -0.825 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.911 -2.190 2.478 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.955 -2.858 1.279 1.00 0.00 H new ATOM 1396 N GLN A 96 2.230 3.828 -2.365 1.00 0.00 N ATOM 1397 CA GLN A 96 1.639 4.797 -3.280 1.00 0.00 C ATOM 1398 C GLN A 96 1.573 4.238 -4.697 1.00 0.00 C ATOM 1399 O GLN A 96 2.580 3.792 -5.247 1.00 0.00 O ATOM 1400 CB GLN A 96 2.445 6.097 -3.269 1.00 0.00 C ATOM 1401 CG GLN A 96 1.972 7.098 -2.227 1.00 0.00 C ATOM 1402 CD GLN A 96 2.871 8.315 -2.135 1.00 0.00 C ATOM 1403 OE1 GLN A 96 4.093 8.208 -2.243 1.00 0.00 O ATOM 1404 NE2 GLN A 96 2.269 9.482 -1.936 1.00 0.00 N ATOM 0 H GLN A 96 3.138 3.468 -2.659 1.00 0.00 H new ATOM 0 HA GLN A 96 0.623 5.004 -2.943 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.494 5.863 -3.086 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.389 6.558 -4.255 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.959 7.417 -2.470 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.928 6.610 -1.254 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.253 9.524 -1.852 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.822 10.336 -1.867 1.00 0.00 H new ATOM 1413 N PHE A 97 0.381 4.265 -5.284 1.00 0.00 N ATOM 1414 CA PHE A 97 0.183 3.760 -6.637 1.00 0.00 C ATOM 1415 C PHE A 97 -0.971 4.483 -7.325 1.00 0.00 C ATOM 1416 O PHE A 97 -1.965 4.837 -6.690 1.00 0.00 O ATOM 1417 CB PHE A 97 -0.090 2.254 -6.607 1.00 0.00 C ATOM 1418 CG PHE A 97 -1.506 1.909 -6.245 1.00 0.00 C ATOM 1419 CD1 PHE A 97 -1.908 1.880 -4.919 1.00 0.00 C ATOM 1420 CD2 PHE A 97 -2.435 1.613 -7.229 1.00 0.00 C ATOM 1421 CE1 PHE A 97 -3.210 1.562 -4.583 1.00 0.00 C ATOM 1422 CE2 PHE A 97 -3.738 1.294 -6.899 1.00 0.00 C ATOM 1423 CZ PHE A 97 -4.127 1.269 -5.574 1.00 0.00 C ATOM 0 H PHE A 97 -0.463 4.632 -4.843 1.00 0.00 H new ATOM 0 HA PHE A 97 1.095 3.947 -7.204 1.00 0.00 H new ATOM 0 HB2 PHE A 97 0.140 1.832 -7.585 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.584 1.785 -5.891 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -1.196 2.108 -4.140 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -2.137 1.632 -8.267 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.511 1.542 -3.546 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -4.452 1.064 -7.676 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.145 1.021 -5.313 1.00 0.00 H new ATOM 1433 N THR A 98 -0.832 4.702 -8.629 1.00 0.00 N ATOM 1434 CA THR A 98 -1.860 5.384 -9.404 1.00 0.00 C ATOM 1435 C THR A 98 -2.764 4.386 -10.118 1.00 0.00 C ATOM 1436 O THR A 98 -2.290 3.514 -10.846 1.00 0.00 O ATOM 1437 CB THR A 98 -1.240 6.335 -10.446 1.00 0.00 C ATOM 1438 OG1 THR A 98 -0.345 7.249 -9.803 1.00 0.00 O ATOM 1439 CG2 THR A 98 -2.323 7.109 -11.183 1.00 0.00 C ATOM 0 H THR A 98 -0.016 4.416 -9.171 1.00 0.00 H new ATOM 0 HA THR A 98 -2.453 5.966 -8.699 1.00 0.00 H new ATOM 0 HB THR A 98 -0.688 5.736 -11.170 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.046 7.849 -10.472 1.00 0.00 H new ATOM 0 HG21 THR A 98 -1.862 7.774 -11.913 1.00 0.00 H new ATOM 0 HG22 THR A 98 -2.985 6.411 -11.695 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.899 7.698 -10.469 1.00 0.00 H new ATOM 1447 N VAL A 99 -4.070 4.520 -9.905 1.00 0.00 N ATOM 1448 CA VAL A 99 -5.041 3.630 -10.530 1.00 0.00 C ATOM 1449 C VAL A 99 -5.252 3.990 -11.996 1.00 0.00 C ATOM 1450 O VAL A 99 -4.876 5.074 -12.441 1.00 0.00 O ATOM 1451 CB VAL A 99 -6.397 3.678 -9.801 1.00 0.00 C ATOM 1452 CG1 VAL A 99 -7.281 2.521 -10.240 1.00 0.00 C ATOM 1453 CG2 VAL A 99 -6.192 3.661 -8.294 1.00 0.00 C ATOM 0 H VAL A 99 -4.479 5.236 -9.305 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.635 2.621 -10.461 1.00 0.00 H new ATOM 0 HB VAL A 99 -6.900 4.608 -10.066 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -8.234 2.572 -9.714 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.455 2.583 -11.314 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.788 1.577 -10.007 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -7.160 3.695 -7.795 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.669 2.749 -8.008 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.600 4.527 -7.998 1.00 0.00 H new ATOM 1463 N GLY A 100 -5.857 3.072 -12.744 1.00 0.00 N ATOM 1464 CA GLY A 100 -6.108 3.311 -14.153 1.00 0.00 C ATOM 1465 C GLY A 100 -7.517 2.931 -14.564 1.00 0.00 C ATOM 1466 O GLY A 100 -8.084 1.950 -14.082 1.00 0.00 O ATOM 0 H GLY A 100 -6.178 2.167 -12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.940 4.365 -14.375 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -5.393 2.742 -14.748 1.00 0.00 H new ATOM 1470 N PRO A 101 -8.106 3.721 -15.475 1.00 0.00 N ATOM 1471 CA PRO A 101 -9.465 3.482 -15.969 1.00 0.00 C ATOM 1472 C PRO A 101 -9.552 2.238 -16.847 1.00 0.00 C ATOM 1473 O PRO A 101 -8.585 1.487 -16.976 1.00 0.00 O ATOM 1474 CB PRO A 101 -9.770 4.738 -16.789 1.00 0.00 C ATOM 1475 CG PRO A 101 -8.435 5.249 -17.210 1.00 0.00 C ATOM 1476 CD PRO A 101 -7.489 4.907 -16.092 1.00 0.00 C ATOM 0 HA PRO A 101 -10.169 3.306 -15.156 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -10.395 4.506 -17.651 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -10.308 5.477 -16.196 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.117 4.787 -18.145 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.465 6.325 -17.380 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -6.488 4.691 -16.465 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.394 5.727 -15.380 1.00 0.00 H new ATOM 1484 N LEU A 102 -10.717 2.026 -17.449 1.00 0.00 N ATOM 1485 CA LEU A 102 -10.931 0.873 -18.317 1.00 0.00 C ATOM 1486 C LEU A 102 -10.664 1.231 -19.775 1.00 0.00 C ATOM 1487 O LEU A 102 -10.766 2.392 -20.168 1.00 0.00 O ATOM 1488 CB LEU A 102 -12.361 0.351 -18.162 1.00 0.00 C ATOM 1489 CG LEU A 102 -12.573 -0.714 -17.085 1.00 0.00 C ATOM 1490 CD1 LEU A 102 -14.046 -0.816 -16.719 1.00 0.00 C ATOM 1491 CD2 LEU A 102 -12.044 -2.061 -17.556 1.00 0.00 C ATOM 0 H LEU A 102 -11.528 2.637 -17.352 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.231 0.092 -18.020 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -13.013 1.196 -17.942 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -12.682 -0.060 -19.119 1.00 0.00 H new ATOM 0 HG LEU A 102 -12.018 -0.419 -16.195 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -14.178 -1.579 -15.951 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -14.394 0.145 -16.340 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -14.623 -1.087 -17.603 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.203 -2.807 -16.777 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.572 -2.363 -18.461 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -10.978 -1.979 -17.768 1.00 0.00 H new ATOM 1503 N GLY A 103 -10.323 0.224 -20.574 1.00 0.00 N ATOM 1504 CA GLY A 103 -10.048 0.453 -21.980 1.00 0.00 C ATOM 1505 C GLY A 103 -8.596 0.204 -22.336 1.00 0.00 C ATOM 1506 O GLY A 103 -7.720 0.265 -21.473 1.00 0.00 O ATOM 0 H GLY A 103 -10.232 -0.746 -20.272 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -10.683 -0.198 -22.582 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -10.310 1.480 -22.236 1.00 0.00 H new ATOM 1510 N GLU A 104 -8.340 -0.079 -23.609 1.00 0.00 N ATOM 1511 CA GLU A 104 -6.983 -0.341 -24.075 1.00 0.00 C ATOM 1512 C GLU A 104 -6.295 0.953 -24.502 1.00 0.00 C ATOM 1513 O GLU A 104 -6.908 1.818 -25.125 1.00 0.00 O ATOM 1514 CB GLU A 104 -7.003 -1.330 -25.242 1.00 0.00 C ATOM 1515 CG GLU A 104 -7.672 -0.783 -26.492 1.00 0.00 C ATOM 1516 CD GLU A 104 -8.043 -1.872 -27.480 1.00 0.00 C ATOM 1517 OE1 GLU A 104 -9.139 -2.453 -27.338 1.00 0.00 O ATOM 1518 OE2 GLU A 104 -7.237 -2.143 -28.394 1.00 0.00 O ATOM 0 H GLU A 104 -9.054 -0.133 -24.336 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.420 -0.776 -23.249 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -5.979 -1.615 -25.483 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.521 -2.237 -24.930 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.570 -0.234 -26.208 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -7.003 -0.071 -26.976 1.00 0.00 H new ATOM 1525 N GLY A 105 -5.016 1.077 -24.160 1.00 0.00 N ATOM 1526 CA GLY A 105 -4.266 2.267 -24.514 1.00 0.00 C ATOM 1527 C GLY A 105 -4.665 3.473 -23.687 1.00 0.00 C ATOM 1528 O GLY A 105 -5.657 3.434 -22.959 1.00 0.00 O ATOM 0 H GLY A 105 -4.486 0.374 -23.644 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -3.202 2.075 -24.380 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.419 2.488 -25.570 1.00 0.00 H new ATOM 1532 N GLY A 106 -3.890 4.547 -23.796 1.00 0.00 N ATOM 1533 CA GLY A 106 -4.184 5.754 -23.045 1.00 0.00 C ATOM 1534 C GLY A 106 -3.756 7.011 -23.776 1.00 0.00 C ATOM 1535 O GLY A 106 -4.352 7.383 -24.786 1.00 0.00 O ATOM 0 H GLY A 106 -3.063 4.603 -24.391 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -5.254 5.801 -22.844 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -3.680 5.709 -22.080 1.00 0.00 H new TER 1539 GLY A 106