USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1089 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 100 TYR OH : rot 180:sc= -0.136 USER MOD Set 1.2: A 104 MET CE :methyl 163:sc= -1.82 (180deg=-3.13!) USER MOD Set 2.1: A 78 LYS NZ :NH3+ -175:sc= 0.283 (180deg=0.465) USER MOD Set 2.2: A 91 TYR OH : rot 117:sc= 0.818 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0389 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -52:sc= 0.144 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -117:sc= 0.0208 (180deg=-0.0671) USER MOD Single : A 14 HIS : no HD1:sc= -3.57! C(o=-3.6!,f=-4.9!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0175) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 31 HIS : no HD1:sc= -0.796 X(o=-0.8,f=-0.65) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -1.44! C(o=-1.4!,f=-8.8!) USER MOD Single : A 55 GLN : amide:sc= -5.31! C(o=-5.3!,f=-3.4!) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 CYS SG : rot -20:sc= -7.5! USER MOD Single : A 69 ASN : amide:sc= -0.113 K(o=-0.11,f=-2.2!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot -0:sc= 0.239 USER MOD Single : A 83 SER OG : rot 29:sc= 0.152 USER MOD Single : A 87 MET CE :methyl 169:sc= -2.82! (180deg=-2.96!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 114:sc= -2.32 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 GLN : amide:sc= -0.0506 K(o=-0.051,f=-1.8!) USER MOD Single : A 99 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 158:sc= -0.0744 (180deg=-0.383) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -164:sc= -0.0102 (180deg=-0.869) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot -71:sc= 0.261 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.106 K(o=-0.11,f=-0.93) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -1.4 K(o=-1.4,f=-2) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.172 -16.597 17.023 1.00 0.00 N ATOM 2 CA GLY A 1 13.780 -15.356 17.665 1.00 0.00 C ATOM 3 C GLY A 1 13.309 -14.312 16.672 1.00 0.00 C ATOM 4 O GLY A 1 13.991 -14.032 15.686 1.00 0.00 O ATOM 0 H1 GLY A 1 14.486 -17.277 17.745 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.361 -16.991 16.505 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.951 -16.413 16.359 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.983 -15.557 18.381 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.624 -14.961 18.230 1.00 0.00 H new ATOM 8 N SER A 2 12.139 -13.736 16.930 1.00 0.00 N ATOM 9 CA SER A 2 11.575 -12.721 16.048 1.00 0.00 C ATOM 10 C SER A 2 12.652 -11.744 15.586 1.00 0.00 C ATOM 11 O SER A 2 12.917 -11.614 14.391 1.00 0.00 O ATOM 12 CB SER A 2 10.454 -11.963 16.760 1.00 0.00 C ATOM 13 OG SER A 2 10.887 -11.473 18.017 1.00 0.00 O ATOM 0 H SER A 2 11.563 -13.955 17.743 1.00 0.00 H new ATOM 0 HA SER A 2 11.165 -13.223 15.172 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.120 -11.132 16.138 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.597 -12.622 16.899 1.00 0.00 H new ATOM 0 HG SER A 2 10.152 -10.991 18.451 1.00 0.00 H new ATOM 19 N SER A 3 13.270 -11.058 16.543 1.00 0.00 N ATOM 20 CA SER A 3 14.315 -10.089 16.236 1.00 0.00 C ATOM 21 C SER A 3 15.312 -10.665 15.235 1.00 0.00 C ATOM 22 O SER A 3 15.742 -11.811 15.359 1.00 0.00 O ATOM 23 CB SER A 3 15.043 -9.670 17.515 1.00 0.00 C ATOM 24 OG SER A 3 15.799 -8.489 17.307 1.00 0.00 O ATOM 0 H SER A 3 13.065 -11.156 17.537 1.00 0.00 H new ATOM 0 HA SER A 3 13.845 -9.212 15.791 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.319 -9.506 18.313 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.702 -10.474 17.843 1.00 0.00 H new ATOM 0 HG SER A 3 16.253 -8.241 18.139 1.00 0.00 H new ATOM 30 N GLY A 4 15.677 -9.859 14.242 1.00 0.00 N ATOM 31 CA GLY A 4 16.621 -10.305 13.234 1.00 0.00 C ATOM 32 C GLY A 4 17.936 -9.554 13.298 1.00 0.00 C ATOM 33 O GLY A 4 18.110 -8.663 14.130 1.00 0.00 O ATOM 0 H GLY A 4 15.336 -8.906 14.118 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.808 -11.371 13.363 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.180 -10.176 12.245 1.00 0.00 H new ATOM 37 N SER A 5 18.865 -9.915 12.419 1.00 0.00 N ATOM 38 CA SER A 5 20.174 -9.272 12.383 1.00 0.00 C ATOM 39 C SER A 5 20.384 -8.542 11.060 1.00 0.00 C ATOM 40 O SER A 5 21.490 -8.518 10.521 1.00 0.00 O ATOM 41 CB SER A 5 21.280 -10.309 12.588 1.00 0.00 C ATOM 42 OG SER A 5 22.505 -9.686 12.934 1.00 0.00 O ATOM 0 H SER A 5 18.736 -10.649 11.722 1.00 0.00 H new ATOM 0 HA SER A 5 20.216 -8.542 13.191 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.988 -11.006 13.374 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.410 -10.892 11.676 1.00 0.00 H new ATOM 0 HG SER A 5 22.715 -8.990 12.277 1.00 0.00 H new ATOM 48 N SER A 6 19.314 -7.947 10.544 1.00 0.00 N ATOM 49 CA SER A 6 19.378 -7.218 9.282 1.00 0.00 C ATOM 50 C SER A 6 18.839 -5.800 9.445 1.00 0.00 C ATOM 51 O SER A 6 17.982 -5.544 10.290 1.00 0.00 O ATOM 52 CB SER A 6 18.586 -7.956 8.201 1.00 0.00 C ATOM 53 OG SER A 6 18.992 -7.551 6.905 1.00 0.00 O ATOM 0 H SER A 6 18.392 -7.955 10.980 1.00 0.00 H new ATOM 0 HA SER A 6 20.423 -7.158 8.979 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.729 -9.031 8.311 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.521 -7.761 8.329 1.00 0.00 H new ATOM 0 HG SER A 6 18.472 -8.038 6.232 1.00 0.00 H new ATOM 59 N GLY A 7 19.349 -4.882 8.630 1.00 0.00 N ATOM 60 CA GLY A 7 18.908 -3.501 8.699 1.00 0.00 C ATOM 61 C GLY A 7 17.398 -3.378 8.770 1.00 0.00 C ATOM 62 O GLY A 7 16.679 -4.358 8.575 1.00 0.00 O ATOM 0 H GLY A 7 20.060 -5.070 7.923 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.350 -3.025 9.574 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.273 -2.962 7.825 1.00 0.00 H new ATOM 66 N ILE A 8 16.918 -2.171 9.050 1.00 0.00 N ATOM 67 CA ILE A 8 15.484 -1.924 9.146 1.00 0.00 C ATOM 68 C ILE A 8 14.731 -2.608 8.010 1.00 0.00 C ATOM 69 O ILE A 8 15.084 -2.487 6.837 1.00 0.00 O ATOM 70 CB ILE A 8 15.170 -0.417 9.121 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.501 0.218 10.473 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.709 -0.186 8.764 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.082 1.668 10.579 1.00 0.00 C ATOM 0 H ILE A 8 17.500 -1.350 9.214 1.00 0.00 H new ATOM 0 HA ILE A 8 15.155 -2.340 10.098 1.00 0.00 H new ATOM 0 HB ILE A 8 15.789 0.055 8.358 1.00 0.00 H new ATOM 0 HG12 ILE A 8 15.011 -0.352 11.263 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.575 0.145 10.646 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.503 0.884 8.750 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.504 -0.608 7.780 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.073 -0.669 9.506 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.348 2.052 11.564 1.00 0.00 H new ATOM 0 HD12 ILE A 8 15.592 2.251 9.812 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.004 1.746 10.438 1.00 0.00 H new ATOM 85 N PRO A 9 13.667 -3.343 8.364 1.00 0.00 N ATOM 86 CA PRO A 9 12.839 -4.059 7.389 1.00 0.00 C ATOM 87 C PRO A 9 12.019 -3.113 6.519 1.00 0.00 C ATOM 88 O PRO A 9 11.223 -2.323 7.025 1.00 0.00 O ATOM 89 CB PRO A 9 11.918 -4.914 8.264 1.00 0.00 C ATOM 90 CG PRO A 9 11.847 -4.186 9.562 1.00 0.00 C ATOM 91 CD PRO A 9 13.188 -3.531 9.744 1.00 0.00 C ATOM 0 HA PRO A 9 13.443 -4.637 6.689 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.931 -5.020 7.815 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.318 -5.920 8.395 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.049 -3.444 9.550 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.633 -4.871 10.382 1.00 0.00 H new ATOM 0 HD2 PRO A 9 13.103 -2.581 10.272 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.866 -4.158 10.323 1.00 0.00 H new ATOM 99 N GLU A 10 12.219 -3.199 5.207 1.00 0.00 N ATOM 100 CA GLU A 10 11.497 -2.349 4.268 1.00 0.00 C ATOM 101 C GLU A 10 11.019 -3.154 3.063 1.00 0.00 C ATOM 102 O GLU A 10 11.754 -3.983 2.525 1.00 0.00 O ATOM 103 CB GLU A 10 12.387 -1.194 3.803 1.00 0.00 C ATOM 104 CG GLU A 10 12.733 -0.210 4.908 1.00 0.00 C ATOM 105 CD GLU A 10 14.053 0.497 4.667 1.00 0.00 C ATOM 106 OE1 GLU A 10 14.284 0.947 3.525 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.854 0.600 5.619 1.00 0.00 O ATOM 0 H GLU A 10 12.874 -3.848 4.771 1.00 0.00 H new ATOM 0 HA GLU A 10 10.625 -1.943 4.781 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.309 -1.601 3.388 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.884 -0.660 2.997 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.938 0.531 4.992 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.777 -0.739 5.860 1.00 0.00 H new ATOM 114 N LEU A 11 9.783 -2.904 2.644 1.00 0.00 N ATOM 115 CA LEU A 11 9.205 -3.605 1.503 1.00 0.00 C ATOM 116 C LEU A 11 9.415 -2.814 0.215 1.00 0.00 C ATOM 117 O LEU A 11 9.157 -1.611 0.163 1.00 0.00 O ATOM 118 CB LEU A 11 7.712 -3.845 1.730 1.00 0.00 C ATOM 119 CG LEU A 11 7.337 -5.180 2.375 1.00 0.00 C ATOM 120 CD1 LEU A 11 6.067 -5.038 3.198 1.00 0.00 C ATOM 121 CD2 LEU A 11 7.169 -6.257 1.313 1.00 0.00 C ATOM 0 H LEU A 11 9.162 -2.221 3.078 1.00 0.00 H new ATOM 0 HA LEU A 11 9.710 -4.566 1.404 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.326 -3.041 2.356 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.203 -3.773 0.769 1.00 0.00 H new ATOM 0 HG LEU A 11 8.146 -5.478 3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.816 -5.998 3.649 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.223 -4.298 3.983 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.250 -4.716 2.553 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.902 -7.200 1.790 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.380 -5.965 0.620 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.104 -6.379 0.767 1.00 0.00 H new ATOM 133 N LYS A 12 9.882 -3.498 -0.823 1.00 0.00 N ATOM 134 CA LYS A 12 10.123 -2.863 -2.113 1.00 0.00 C ATOM 135 C LYS A 12 9.291 -3.522 -3.209 1.00 0.00 C ATOM 136 O LYS A 12 9.581 -4.641 -3.632 1.00 0.00 O ATOM 137 CB LYS A 12 11.609 -2.936 -2.472 1.00 0.00 C ATOM 138 CG LYS A 12 12.528 -2.496 -1.346 1.00 0.00 C ATOM 139 CD LYS A 12 12.500 -0.988 -1.160 1.00 0.00 C ATOM 140 CE LYS A 12 13.815 -0.471 -0.596 1.00 0.00 C ATOM 141 NZ LYS A 12 13.990 -0.846 0.835 1.00 0.00 N ATOM 0 H LYS A 12 10.102 -4.494 -0.796 1.00 0.00 H new ATOM 0 HA LYS A 12 9.826 -1.817 -2.035 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.857 -3.960 -2.753 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.794 -2.312 -3.346 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.228 -2.983 -0.419 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.547 -2.818 -1.560 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.299 -0.506 -2.117 1.00 0.00 H new ATOM 0 HD3 LYS A 12 11.684 -0.718 -0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.643 -0.872 -1.180 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.851 0.614 -0.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.029 0.015 1.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.189 -1.434 1.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.875 -1.381 0.948 1.00 0.00 H new ATOM 155 N ASP A 13 8.259 -2.821 -3.665 1.00 0.00 N ATOM 156 CA ASP A 13 7.388 -3.338 -4.713 1.00 0.00 C ATOM 157 C ASP A 13 6.412 -2.265 -5.187 1.00 0.00 C ATOM 158 O ASP A 13 5.867 -1.508 -4.383 1.00 0.00 O ATOM 159 CB ASP A 13 6.617 -4.559 -4.210 1.00 0.00 C ATOM 160 CG ASP A 13 7.424 -5.838 -4.315 1.00 0.00 C ATOM 161 OD1 ASP A 13 8.075 -6.044 -5.361 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.405 -6.633 -3.353 1.00 0.00 O ATOM 0 H ASP A 13 8.005 -1.893 -3.325 1.00 0.00 H new ATOM 0 HA ASP A 13 8.012 -3.635 -5.556 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.328 -4.400 -3.171 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.697 -4.666 -4.784 1.00 0.00 H new ATOM 167 N HIS A 14 6.198 -2.204 -6.498 1.00 0.00 N ATOM 168 CA HIS A 14 5.288 -1.223 -7.079 1.00 0.00 C ATOM 169 C HIS A 14 3.937 -1.856 -7.395 1.00 0.00 C ATOM 170 O HIS A 14 3.836 -2.732 -8.255 1.00 0.00 O ATOM 171 CB HIS A 14 5.894 -0.624 -8.348 1.00 0.00 C ATOM 172 CG HIS A 14 4.878 -0.027 -9.273 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.345 -0.709 -10.347 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.295 1.195 -9.278 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.481 0.069 -10.974 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.431 1.229 -10.345 1.00 0.00 N ATOM 0 H HIS A 14 6.642 -2.822 -7.177 1.00 0.00 H new ATOM 0 HA HIS A 14 5.134 -0.428 -6.349 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.615 0.144 -8.069 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.445 -1.400 -8.879 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.476 1.994 -8.574 1.00 0.00 H new ATOM 0 HE1 HIS A 14 2.912 -0.198 -11.852 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.846 2.022 -10.609 1.00 0.00 H new ATOM 185 N LEU A 15 2.900 -1.408 -6.695 1.00 0.00 N ATOM 186 CA LEU A 15 1.554 -1.931 -6.901 1.00 0.00 C ATOM 187 C LEU A 15 0.833 -1.159 -8.002 1.00 0.00 C ATOM 188 O LEU A 15 1.418 -0.292 -8.651 1.00 0.00 O ATOM 189 CB LEU A 15 0.752 -1.856 -5.601 1.00 0.00 C ATOM 190 CG LEU A 15 1.432 -2.433 -4.359 1.00 0.00 C ATOM 191 CD1 LEU A 15 0.968 -1.703 -3.108 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.152 -3.925 -4.243 1.00 0.00 C ATOM 0 H LEU A 15 2.966 -0.684 -5.980 1.00 0.00 H new ATOM 0 HA LEU A 15 1.639 -2.973 -7.209 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.511 -0.811 -5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.193 -2.379 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 15 2.508 -2.292 -4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.463 -2.128 -2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.220 -0.646 -3.189 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.111 -1.812 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.643 -4.319 -3.354 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.077 -4.089 -4.166 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.535 -4.437 -5.126 1.00 0.00 H new ATOM 204 N ARG A 16 -0.441 -1.480 -8.205 1.00 0.00 N ATOM 205 CA ARG A 16 -1.243 -0.817 -9.226 1.00 0.00 C ATOM 206 C ARG A 16 -1.781 0.516 -8.714 1.00 0.00 C ATOM 207 O ARG A 16 -2.575 0.556 -7.773 1.00 0.00 O ATOM 208 CB ARG A 16 -2.403 -1.716 -9.658 1.00 0.00 C ATOM 209 CG ARG A 16 -1.970 -2.910 -10.492 1.00 0.00 C ATOM 210 CD ARG A 16 -3.114 -3.439 -11.343 1.00 0.00 C ATOM 211 NE ARG A 16 -3.890 -4.460 -10.644 1.00 0.00 N ATOM 212 CZ ARG A 16 -4.866 -5.157 -11.213 1.00 0.00 C ATOM 213 NH1 ARG A 16 -5.185 -4.946 -12.482 1.00 0.00 N ATOM 214 NH2 ARG A 16 -5.527 -6.070 -10.511 1.00 0.00 N ATOM 0 H ARG A 16 -0.940 -2.195 -7.676 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.603 -0.624 -10.087 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.924 -2.074 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.117 -1.124 -10.230 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -1.139 -2.623 -11.136 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -1.607 -3.701 -9.836 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -3.769 -2.614 -11.623 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -2.715 -3.857 -12.267 1.00 0.00 H new ATOM 0 HE ARG A 16 -3.670 -4.648 -9.666 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -4.680 -4.246 -13.025 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -5.936 -5.484 -12.915 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -5.285 -6.236 -9.534 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -6.277 -6.605 -10.949 1.00 0.00 H new ATOM 228 N ILE A 17 -1.344 1.604 -9.338 1.00 0.00 N ATOM 229 CA ILE A 17 -1.782 2.938 -8.946 1.00 0.00 C ATOM 230 C ILE A 17 -2.531 3.627 -10.082 1.00 0.00 C ATOM 231 O ILE A 17 -2.065 3.653 -11.221 1.00 0.00 O ATOM 232 CB ILE A 17 -0.593 3.819 -8.522 1.00 0.00 C ATOM 233 CG1 ILE A 17 -0.025 3.339 -7.184 1.00 0.00 C ATOM 234 CG2 ILE A 17 -1.020 5.277 -8.429 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.240 4.058 -6.772 1.00 0.00 C ATOM 0 H ILE A 17 -0.687 1.588 -10.118 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.452 2.812 -8.096 1.00 0.00 H new ATOM 0 HB ILE A 17 0.188 3.737 -9.278 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.779 3.474 -6.409 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.178 2.270 -7.247 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.168 5.887 -8.128 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.382 5.613 -9.401 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.816 5.377 -7.691 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.586 3.667 -5.815 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.010 3.902 -7.528 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.037 5.125 -6.676 1.00 0.00 H new ATOM 247 N PHE A 18 -3.694 4.185 -9.763 1.00 0.00 N ATOM 248 CA PHE A 18 -4.508 4.875 -10.757 1.00 0.00 C ATOM 249 C PHE A 18 -5.294 6.016 -10.118 1.00 0.00 C ATOM 250 O PHE A 18 -5.917 5.845 -9.070 1.00 0.00 O ATOM 251 CB PHE A 18 -5.469 3.894 -11.431 1.00 0.00 C ATOM 252 CG PHE A 18 -6.549 4.566 -12.231 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.247 5.222 -13.413 1.00 0.00 C ATOM 254 CD2 PHE A 18 -7.865 4.541 -11.800 1.00 0.00 C ATOM 255 CE1 PHE A 18 -7.238 5.841 -14.152 1.00 0.00 C ATOM 256 CE2 PHE A 18 -8.860 5.158 -12.535 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.546 5.809 -13.711 1.00 0.00 C ATOM 0 H PHE A 18 -4.094 4.173 -8.825 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.840 5.293 -11.510 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.901 3.233 -12.086 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.930 3.267 -10.668 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.225 5.250 -13.761 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.116 4.034 -10.880 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.990 6.349 -15.072 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -9.883 5.131 -12.189 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.322 6.293 -14.285 1.00 0.00 H new ATOM 267 N ARG A 19 -5.260 7.181 -10.757 1.00 0.00 N ATOM 268 CA ARG A 19 -5.967 8.351 -10.251 1.00 0.00 C ATOM 269 C ARG A 19 -6.783 9.014 -11.357 1.00 0.00 C ATOM 270 O ARG A 19 -6.280 9.830 -12.129 1.00 0.00 O ATOM 271 CB ARG A 19 -4.976 9.357 -9.662 1.00 0.00 C ATOM 272 CG ARG A 19 -4.364 8.908 -8.345 1.00 0.00 C ATOM 273 CD ARG A 19 -3.412 9.955 -7.788 1.00 0.00 C ATOM 274 NE ARG A 19 -4.117 11.154 -7.342 1.00 0.00 N ATOM 275 CZ ARG A 19 -3.638 11.991 -6.428 1.00 0.00 C ATOM 276 NH1 ARG A 19 -2.460 11.761 -5.866 1.00 0.00 N ATOM 277 NH2 ARG A 19 -4.339 13.061 -6.075 1.00 0.00 N ATOM 0 H ARG A 19 -4.750 7.339 -11.626 1.00 0.00 H new ATOM 0 HA ARG A 19 -6.649 8.021 -9.467 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -4.178 9.533 -10.383 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -5.484 10.309 -9.511 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -5.156 8.713 -7.622 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.829 7.970 -8.492 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -2.855 9.531 -6.953 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.684 10.226 -8.552 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.027 11.360 -7.755 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -1.918 10.940 -6.135 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.095 12.405 -5.165 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -5.246 13.241 -6.505 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -3.971 13.703 -5.373 1.00 0.00 H new ATOM 291 N PRO A 20 -8.073 8.655 -11.437 1.00 0.00 N ATOM 292 CA PRO A 20 -8.986 9.202 -12.445 1.00 0.00 C ATOM 293 C PRO A 20 -9.309 10.672 -12.197 1.00 0.00 C ATOM 294 O PRO A 20 -9.772 11.375 -13.095 1.00 0.00 O ATOM 295 CB PRO A 20 -10.244 8.344 -12.288 1.00 0.00 C ATOM 296 CG PRO A 20 -10.196 7.858 -10.880 1.00 0.00 C ATOM 297 CD PRO A 20 -8.739 7.687 -10.550 1.00 0.00 C ATOM 0 HA PRO A 20 -8.555 9.170 -13.446 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.146 8.926 -12.476 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.248 7.513 -12.994 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.668 8.572 -10.205 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.733 6.916 -10.774 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -8.537 7.899 -9.500 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.401 6.668 -10.740 1.00 0.00 H new ATOM 305 N ARG A 21 -9.061 11.129 -10.974 1.00 0.00 N ATOM 306 CA ARG A 21 -9.327 12.515 -10.609 1.00 0.00 C ATOM 307 C ARG A 21 -8.149 13.411 -10.982 1.00 0.00 C ATOM 308 O ARG A 21 -7.708 14.240 -10.185 1.00 0.00 O ATOM 309 CB ARG A 21 -9.609 12.625 -9.110 1.00 0.00 C ATOM 310 CG ARG A 21 -10.985 12.117 -8.711 1.00 0.00 C ATOM 311 CD ARG A 21 -11.160 12.110 -7.200 1.00 0.00 C ATOM 312 NE ARG A 21 -11.583 13.412 -6.692 1.00 0.00 N ATOM 313 CZ ARG A 21 -10.740 14.400 -6.411 1.00 0.00 C ATOM 314 NH1 ARG A 21 -9.436 14.234 -6.589 1.00 0.00 N ATOM 315 NH2 ARG A 21 -11.201 15.556 -5.952 1.00 0.00 N ATOM 0 H ARG A 21 -8.677 10.560 -10.220 1.00 0.00 H new ATOM 0 HA ARG A 21 -10.205 12.848 -11.163 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -8.851 12.063 -8.564 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -9.514 13.667 -8.806 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -11.752 12.746 -9.164 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.129 11.109 -9.100 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -11.897 11.356 -6.924 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -10.220 11.824 -6.728 1.00 0.00 H new ATOM 0 HE ARG A 21 -12.580 13.572 -6.545 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -9.078 13.346 -6.942 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.791 14.994 -6.373 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -12.203 15.687 -5.815 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -10.553 16.314 -5.737 1.00 0.00 H new ATOM 329 N LYS A 22 -7.643 13.239 -12.198 1.00 0.00 N ATOM 330 CA LYS A 22 -6.517 14.031 -12.679 1.00 0.00 C ATOM 331 C LYS A 22 -6.460 14.027 -14.203 1.00 0.00 C ATOM 332 O LYS A 22 -6.774 13.024 -14.844 1.00 0.00 O ATOM 333 CB LYS A 22 -5.205 13.488 -12.108 1.00 0.00 C ATOM 334 CG LYS A 22 -3.969 14.167 -12.673 1.00 0.00 C ATOM 335 CD LYS A 22 -3.673 15.473 -11.954 1.00 0.00 C ATOM 336 CE LYS A 22 -2.998 15.230 -10.613 1.00 0.00 C ATOM 337 NZ LYS A 22 -1.517 15.144 -10.744 1.00 0.00 N ATOM 0 H LYS A 22 -7.995 12.557 -12.870 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.657 15.058 -12.341 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.212 13.609 -11.025 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.146 12.418 -12.309 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.112 13.499 -12.583 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -4.113 14.360 -13.736 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -3.032 16.096 -12.578 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.601 16.024 -11.801 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.255 16.036 -9.926 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -3.378 14.306 -10.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.095 14.978 -9.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.270 14.359 -11.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.151 16.035 -11.136 1.00 0.00 H new ATOM 351 N LEU A 23 -6.057 15.155 -14.778 1.00 0.00 N ATOM 352 CA LEU A 23 -5.958 15.282 -16.228 1.00 0.00 C ATOM 353 C LEU A 23 -4.713 14.574 -16.752 1.00 0.00 C ATOM 354 O LEU A 23 -3.649 15.180 -16.883 1.00 0.00 O ATOM 355 CB LEU A 23 -5.927 16.757 -16.630 1.00 0.00 C ATOM 356 CG LEU A 23 -7.281 17.465 -16.692 1.00 0.00 C ATOM 357 CD1 LEU A 23 -7.695 17.948 -15.310 1.00 0.00 C ATOM 358 CD2 LEU A 23 -7.232 18.627 -17.673 1.00 0.00 C ATOM 0 H LEU A 23 -5.794 15.995 -14.262 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.835 14.810 -16.670 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.292 17.292 -15.924 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -5.453 16.836 -17.608 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.026 16.751 -17.043 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.661 18.449 -15.374 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.772 17.096 -14.635 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.949 18.645 -14.930 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -8.204 19.119 -17.704 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.474 19.342 -17.353 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.983 18.254 -18.666 1.00 0.00 H new ATOM 370 N THR A 24 -4.852 13.287 -17.054 1.00 0.00 N ATOM 371 CA THR A 24 -3.740 12.496 -17.565 1.00 0.00 C ATOM 372 C THR A 24 -4.226 11.173 -18.144 1.00 0.00 C ATOM 373 O THR A 24 -5.183 10.579 -17.645 1.00 0.00 O ATOM 374 CB THR A 24 -2.701 12.211 -16.464 1.00 0.00 C ATOM 375 OG1 THR A 24 -1.545 11.584 -17.032 1.00 0.00 O ATOM 376 CG2 THR A 24 -3.289 11.318 -15.383 1.00 0.00 C ATOM 0 H THR A 24 -5.725 12.770 -16.953 1.00 0.00 H new ATOM 0 HA THR A 24 -3.271 13.084 -18.354 1.00 0.00 H new ATOM 0 HB THR A 24 -2.414 13.160 -16.012 1.00 0.00 H new ATOM 0 HG1 THR A 24 -0.888 11.408 -16.326 1.00 0.00 H new ATOM 0 HG21 THR A 24 -2.537 11.131 -14.617 1.00 0.00 H new ATOM 0 HG22 THR A 24 -4.151 11.811 -14.933 1.00 0.00 H new ATOM 0 HG23 THR A 24 -3.602 10.371 -15.823 1.00 0.00 H new ATOM 384 N LEU A 25 -3.562 10.714 -19.199 1.00 0.00 N ATOM 385 CA LEU A 25 -3.926 9.458 -19.846 1.00 0.00 C ATOM 386 C LEU A 25 -4.281 8.395 -18.811 1.00 0.00 C ATOM 387 O LEU A 25 -3.413 7.898 -18.093 1.00 0.00 O ATOM 388 CB LEU A 25 -2.778 8.965 -20.728 1.00 0.00 C ATOM 389 CG LEU A 25 -2.853 7.503 -21.172 1.00 0.00 C ATOM 390 CD1 LEU A 25 -3.615 7.381 -22.482 1.00 0.00 C ATOM 391 CD2 LEU A 25 -1.456 6.915 -21.309 1.00 0.00 C ATOM 0 H LEU A 25 -2.768 11.193 -19.625 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.802 9.639 -20.469 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.735 9.593 -21.618 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.842 9.113 -20.188 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.390 6.939 -20.409 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.658 6.334 -22.782 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.628 7.763 -22.351 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.107 7.959 -23.254 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.529 5.875 -21.626 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.894 7.482 -22.051 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.944 6.967 -20.348 1.00 0.00 H new ATOM 403 N LYS A 26 -5.562 8.049 -18.742 1.00 0.00 N ATOM 404 CA LYS A 26 -6.033 7.042 -17.799 1.00 0.00 C ATOM 405 C LYS A 26 -5.210 5.762 -17.913 1.00 0.00 C ATOM 406 O LYS A 26 -4.637 5.473 -18.962 1.00 0.00 O ATOM 407 CB LYS A 26 -7.511 6.735 -18.045 1.00 0.00 C ATOM 408 CG LYS A 26 -7.765 5.951 -19.321 1.00 0.00 C ATOM 409 CD LYS A 26 -9.238 5.614 -19.484 1.00 0.00 C ATOM 410 CE LYS A 26 -10.022 6.796 -20.032 1.00 0.00 C ATOM 411 NZ LYS A 26 -9.800 6.980 -21.493 1.00 0.00 N ATOM 0 H LYS A 26 -6.293 8.452 -19.328 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.914 7.440 -16.791 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.902 6.171 -17.198 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.066 7.672 -18.088 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.426 6.531 -20.179 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.180 5.032 -19.307 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -9.345 4.762 -20.155 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -9.653 5.316 -18.521 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -11.085 6.646 -19.842 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.729 7.703 -19.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.451 7.706 -21.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.819 7.282 -21.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -9.975 6.081 -21.987 1.00 0.00 H new ATOM 425 N GLY A 27 -5.158 4.998 -16.826 1.00 0.00 N ATOM 426 CA GLY A 27 -4.405 3.758 -16.827 1.00 0.00 C ATOM 427 C GLY A 27 -3.336 3.729 -15.753 1.00 0.00 C ATOM 428 O GLY A 27 -3.282 4.612 -14.896 1.00 0.00 O ATOM 0 H GLY A 27 -5.624 5.216 -15.945 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.088 2.922 -16.678 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.939 3.620 -17.803 1.00 0.00 H new ATOM 432 N TYR A 28 -2.484 2.711 -15.797 1.00 0.00 N ATOM 433 CA TYR A 28 -1.413 2.567 -14.818 1.00 0.00 C ATOM 434 C TYR A 28 -0.048 2.771 -15.469 1.00 0.00 C ATOM 435 O TYR A 28 0.122 2.534 -16.665 1.00 0.00 O ATOM 436 CB TYR A 28 -1.476 1.188 -14.160 1.00 0.00 C ATOM 437 CG TYR A 28 -2.810 0.885 -13.514 1.00 0.00 C ATOM 438 CD1 TYR A 28 -3.893 0.467 -14.276 1.00 0.00 C ATOM 439 CD2 TYR A 28 -2.986 1.017 -12.142 1.00 0.00 C ATOM 440 CE1 TYR A 28 -5.114 0.190 -13.691 1.00 0.00 C ATOM 441 CE2 TYR A 28 -4.202 0.741 -11.548 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.263 0.329 -12.327 1.00 0.00 C ATOM 443 OH TYR A 28 -6.477 0.053 -11.740 1.00 0.00 O ATOM 0 H TYR A 28 -2.514 1.973 -16.500 1.00 0.00 H new ATOM 0 HA TYR A 28 -1.549 3.333 -14.054 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.264 0.427 -14.911 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.692 1.119 -13.406 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -3.779 0.356 -15.344 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.158 1.341 -11.529 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -5.946 -0.133 -14.298 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.321 0.847 -10.480 1.00 0.00 H new ATOM 0 HH TYR A 28 -6.414 0.200 -10.773 1.00 0.00 H new ATOM 453 N ARG A 29 0.921 3.209 -14.672 1.00 0.00 N ATOM 454 CA ARG A 29 2.271 3.445 -15.170 1.00 0.00 C ATOM 455 C ARG A 29 3.296 2.669 -14.349 1.00 0.00 C ATOM 456 O ARG A 29 2.980 2.139 -13.284 1.00 0.00 O ATOM 457 CB ARG A 29 2.597 4.939 -15.132 1.00 0.00 C ATOM 458 CG ARG A 29 3.628 5.364 -16.166 1.00 0.00 C ATOM 459 CD ARG A 29 3.450 6.820 -16.564 1.00 0.00 C ATOM 460 NE ARG A 29 4.700 7.417 -17.028 1.00 0.00 N ATOM 461 CZ ARG A 29 4.807 8.678 -17.431 1.00 0.00 C ATOM 462 NH1 ARG A 29 3.744 9.471 -17.427 1.00 0.00 N ATOM 463 NH2 ARG A 29 5.978 9.149 -17.840 1.00 0.00 N ATOM 0 H ARG A 29 0.797 3.408 -13.679 1.00 0.00 H new ATOM 0 HA ARG A 29 2.317 3.096 -16.202 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.680 5.507 -15.291 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.963 5.197 -14.138 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.630 5.215 -15.764 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.541 4.731 -17.049 1.00 0.00 H new ATOM 0 HD2 ARG A 29 2.700 6.891 -17.352 1.00 0.00 H new ATOM 0 HD3 ARG A 29 3.073 7.385 -15.712 1.00 0.00 H new ATOM 0 HE ARG A 29 5.536 6.833 -17.043 1.00 0.00 H new ATOM 0 HH11 ARG A 29 2.842 9.113 -17.114 1.00 0.00 H new ATOM 0 HH12 ARG A 29 3.829 10.439 -17.737 1.00 0.00 H new ATOM 0 HH21 ARG A 29 6.798 8.542 -17.845 1.00 0.00 H new ATOM 0 HH22 ARG A 29 6.058 10.118 -18.149 1.00 0.00 H new ATOM 477 N GLN A 30 4.525 2.605 -14.853 1.00 0.00 N ATOM 478 CA GLN A 30 5.595 1.893 -14.166 1.00 0.00 C ATOM 479 C GLN A 30 6.282 2.794 -13.146 1.00 0.00 C ATOM 480 O GLN A 30 7.280 3.447 -13.451 1.00 0.00 O ATOM 481 CB GLN A 30 6.620 1.372 -15.176 1.00 0.00 C ATOM 482 CG GLN A 30 7.570 0.336 -14.600 1.00 0.00 C ATOM 483 CD GLN A 30 8.141 -0.586 -15.659 1.00 0.00 C ATOM 484 OE1 GLN A 30 8.336 -0.186 -16.807 1.00 0.00 O ATOM 485 NE2 GLN A 30 8.411 -1.830 -15.279 1.00 0.00 N ATOM 0 H GLN A 30 4.803 3.037 -15.734 1.00 0.00 H new ATOM 0 HA GLN A 30 5.154 1.048 -13.638 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.092 0.937 -16.025 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.200 2.212 -15.558 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.387 0.843 -14.087 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.044 -0.258 -13.852 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.234 -2.119 -14.317 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.796 -2.496 -15.949 1.00 0.00 H new ATOM 494 N HIS A 31 5.741 2.825 -11.932 1.00 0.00 N ATOM 495 CA HIS A 31 6.303 3.646 -10.865 1.00 0.00 C ATOM 496 C HIS A 31 6.992 2.779 -9.816 1.00 0.00 C ATOM 497 O HIS A 31 6.863 1.555 -9.828 1.00 0.00 O ATOM 498 CB HIS A 31 5.207 4.487 -10.209 1.00 0.00 C ATOM 499 CG HIS A 31 4.711 5.605 -11.074 1.00 0.00 C ATOM 500 ND1 HIS A 31 3.976 6.665 -10.586 1.00 0.00 N ATOM 501 CD2 HIS A 31 4.849 5.825 -12.402 1.00 0.00 C ATOM 502 CE1 HIS A 31 3.683 7.487 -11.577 1.00 0.00 C ATOM 503 NE2 HIS A 31 4.201 7.001 -12.690 1.00 0.00 N ATOM 0 H HIS A 31 4.914 2.291 -11.663 1.00 0.00 H new ATOM 0 HA HIS A 31 7.046 4.310 -11.305 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.369 3.839 -9.951 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.588 4.902 -9.276 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.372 5.193 -13.105 1.00 0.00 H new ATOM 0 HE1 HIS A 31 3.116 8.402 -11.492 1.00 0.00 H new ATOM 0 HE2 HIS A 31 4.131 7.429 -13.613 1.00 0.00 H new ATOM 512 N TRP A 32 7.722 3.421 -8.912 1.00 0.00 N ATOM 513 CA TRP A 32 8.432 2.707 -7.857 1.00 0.00 C ATOM 514 C TRP A 32 7.884 3.080 -6.484 1.00 0.00 C ATOM 515 O TRP A 32 7.890 4.250 -6.099 1.00 0.00 O ATOM 516 CB TRP A 32 9.929 3.013 -7.923 1.00 0.00 C ATOM 517 CG TRP A 32 10.721 2.346 -6.839 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.450 2.959 -5.861 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.863 0.938 -6.625 1.00 0.00 C ATOM 520 NE1 TRP A 32 12.038 2.017 -5.052 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.692 0.769 -5.499 1.00 0.00 C ATOM 522 CE3 TRP A 32 10.369 -0.197 -7.274 1.00 0.00 C ATOM 523 CZ2 TRP A 32 12.038 -0.488 -5.011 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.713 -1.445 -6.788 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.540 -1.582 -5.665 1.00 0.00 C ATOM 0 H TRP A 32 7.838 4.434 -8.888 1.00 0.00 H new ATOM 0 HA TRP A 32 8.280 1.639 -8.010 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.315 2.696 -8.892 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.075 4.091 -7.859 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.550 4.028 -5.741 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.635 2.215 -4.249 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.730 -0.101 -8.139 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.677 -0.596 -4.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 10.338 -2.329 -7.282 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.789 -2.571 -5.309 1.00 0.00 H new ATOM 536 N VAL A 33 7.411 2.079 -5.748 1.00 0.00 N ATOM 537 CA VAL A 33 6.861 2.303 -4.416 1.00 0.00 C ATOM 538 C VAL A 33 7.742 1.672 -3.344 1.00 0.00 C ATOM 539 O VAL A 33 8.294 0.588 -3.538 1.00 0.00 O ATOM 540 CB VAL A 33 5.435 1.734 -4.295 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.757 2.254 -3.037 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.618 2.076 -5.531 1.00 0.00 C ATOM 0 H VAL A 33 7.398 1.105 -6.052 1.00 0.00 H new ATOM 0 HA VAL A 33 6.827 3.382 -4.265 1.00 0.00 H new ATOM 0 HB VAL A 33 5.501 0.649 -4.221 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.751 1.841 -2.969 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.333 1.952 -2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.701 3.342 -3.077 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.613 1.666 -5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.559 3.159 -5.640 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.096 1.649 -6.413 1.00 0.00 H new ATOM 552 N VAL A 34 7.870 2.356 -2.212 1.00 0.00 N ATOM 553 CA VAL A 34 8.683 1.861 -1.107 1.00 0.00 C ATOM 554 C VAL A 34 7.961 2.032 0.225 1.00 0.00 C ATOM 555 O VAL A 34 7.606 3.145 0.613 1.00 0.00 O ATOM 556 CB VAL A 34 10.040 2.586 -1.040 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.826 2.136 0.182 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.835 2.346 -2.314 1.00 0.00 C ATOM 0 H VAL A 34 7.421 3.255 -2.036 1.00 0.00 H new ATOM 0 HA VAL A 34 8.855 0.800 -1.290 1.00 0.00 H new ATOM 0 HB VAL A 34 9.857 3.657 -0.950 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.782 2.659 0.213 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.258 2.364 1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 34 11.002 1.062 0.126 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.791 2.866 -2.250 1.00 0.00 H new ATOM 0 HG22 VAL A 34 11.010 1.277 -2.438 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.274 2.723 -3.169 1.00 0.00 H new ATOM 568 N PHE A 35 7.748 0.921 0.923 1.00 0.00 N ATOM 569 CA PHE A 35 7.069 0.947 2.213 1.00 0.00 C ATOM 570 C PHE A 35 8.076 1.000 3.358 1.00 0.00 C ATOM 571 O PHE A 35 9.000 0.188 3.426 1.00 0.00 O ATOM 572 CB PHE A 35 6.171 -0.283 2.365 1.00 0.00 C ATOM 573 CG PHE A 35 5.612 -0.449 3.749 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.903 0.577 4.353 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.797 -1.632 4.447 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.388 0.426 5.627 1.00 0.00 C ATOM 577 CE2 PHE A 35 5.283 -1.788 5.721 1.00 0.00 C ATOM 578 CZ PHE A 35 4.579 -0.758 6.312 1.00 0.00 C ATOM 0 H PHE A 35 8.036 -0.008 0.617 1.00 0.00 H new ATOM 0 HA PHE A 35 6.453 1.846 2.253 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.347 -0.211 1.655 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.741 -1.174 2.103 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.751 1.505 3.822 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.349 -2.441 3.991 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.837 1.233 6.086 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.432 -2.716 6.254 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.178 -0.878 7.308 1.00 0.00 H new ATOM 588 N LYS A 36 7.893 1.962 4.256 1.00 0.00 N ATOM 589 CA LYS A 36 8.784 2.122 5.399 1.00 0.00 C ATOM 590 C LYS A 36 8.056 1.812 6.703 1.00 0.00 C ATOM 591 O LYS A 36 6.830 1.884 6.772 1.00 0.00 O ATOM 592 CB LYS A 36 9.342 3.547 5.440 1.00 0.00 C ATOM 593 CG LYS A 36 10.059 3.881 6.737 1.00 0.00 C ATOM 594 CD LYS A 36 11.308 3.035 6.917 1.00 0.00 C ATOM 595 CE LYS A 36 12.525 3.695 6.288 1.00 0.00 C ATOM 596 NZ LYS A 36 13.143 4.700 7.198 1.00 0.00 N ATOM 0 H LYS A 36 7.135 2.643 4.214 1.00 0.00 H new ATOM 0 HA LYS A 36 9.609 1.418 5.288 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.032 3.682 4.607 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.524 4.253 5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.330 4.937 6.743 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.385 3.720 7.578 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.489 2.874 7.980 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.152 2.054 6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.262 2.932 6.035 1.00 0.00 H new ATOM 0 HE3 LYS A 36 12.234 4.179 5.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.969 5.128 6.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.448 5.441 7.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.444 4.233 8.078 1.00 0.00 H new ATOM 610 N GLU A 37 8.821 1.468 7.735 1.00 0.00 N ATOM 611 CA GLU A 37 8.248 1.147 9.036 1.00 0.00 C ATOM 612 C GLU A 37 6.985 1.966 9.291 1.00 0.00 C ATOM 613 O GLU A 37 5.872 1.441 9.251 1.00 0.00 O ATOM 614 CB GLU A 37 9.269 1.406 10.146 1.00 0.00 C ATOM 615 CG GLU A 37 10.558 0.618 9.982 1.00 0.00 C ATOM 616 CD GLU A 37 10.325 -0.879 9.934 1.00 0.00 C ATOM 617 OE1 GLU A 37 9.777 -1.363 8.921 1.00 0.00 O ATOM 618 OE2 GLU A 37 10.691 -1.568 10.909 1.00 0.00 O ATOM 0 H GLU A 37 9.838 1.405 7.695 1.00 0.00 H new ATOM 0 HA GLU A 37 7.982 0.090 9.036 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.504 2.470 10.171 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.820 1.156 11.107 1.00 0.00 H new ATOM 0 HG2 GLU A 37 11.058 0.933 9.066 1.00 0.00 H new ATOM 0 HG3 GLU A 37 11.229 0.851 10.808 1.00 0.00 H new ATOM 625 N THR A 38 7.167 3.256 9.555 1.00 0.00 N ATOM 626 CA THR A 38 6.045 4.148 9.818 1.00 0.00 C ATOM 627 C THR A 38 5.962 5.252 8.771 1.00 0.00 C ATOM 628 O THR A 38 5.392 6.316 9.018 1.00 0.00 O ATOM 629 CB THR A 38 6.151 4.788 11.215 1.00 0.00 C ATOM 630 OG1 THR A 38 7.528 4.956 11.573 1.00 0.00 O ATOM 631 CG2 THR A 38 5.452 3.929 12.259 1.00 0.00 C ATOM 0 H THR A 38 8.081 3.706 9.592 1.00 0.00 H new ATOM 0 HA THR A 38 5.142 3.540 9.773 1.00 0.00 H new ATOM 0 HB THR A 38 5.662 5.762 11.182 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.587 5.365 12.462 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.540 4.401 13.237 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.398 3.826 11.999 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.916 2.943 12.289 1.00 0.00 H new ATOM 639 N THR A 39 6.535 4.994 7.599 1.00 0.00 N ATOM 640 CA THR A 39 6.526 5.967 6.514 1.00 0.00 C ATOM 641 C THR A 39 6.292 5.288 5.169 1.00 0.00 C ATOM 642 O THR A 39 6.330 4.061 5.066 1.00 0.00 O ATOM 643 CB THR A 39 7.849 6.754 6.455 1.00 0.00 C ATOM 644 OG1 THR A 39 8.268 7.107 7.778 1.00 0.00 O ATOM 645 CG2 THR A 39 7.692 8.013 5.615 1.00 0.00 C ATOM 0 H THR A 39 7.011 4.119 7.377 1.00 0.00 H new ATOM 0 HA THR A 39 5.708 6.659 6.716 1.00 0.00 H new ATOM 0 HB THR A 39 8.604 6.119 5.992 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.110 7.606 7.732 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.639 8.553 5.588 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.401 7.740 4.601 1.00 0.00 H new ATOM 0 HG23 THR A 39 6.924 8.650 6.054 1.00 0.00 H new ATOM 653 N LEU A 40 6.050 6.093 4.140 1.00 0.00 N ATOM 654 CA LEU A 40 5.810 5.569 2.800 1.00 0.00 C ATOM 655 C LEU A 40 6.131 6.618 1.740 1.00 0.00 C ATOM 656 O LEU A 40 5.825 7.799 1.908 1.00 0.00 O ATOM 657 CB LEU A 40 4.355 5.116 2.661 1.00 0.00 C ATOM 658 CG LEU A 40 4.057 4.161 1.504 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.769 3.396 1.762 1.00 0.00 C ATOM 660 CD2 LEU A 40 3.973 4.925 0.190 1.00 0.00 C ATOM 0 H LEU A 40 6.015 7.110 4.208 1.00 0.00 H new ATOM 0 HA LEU A 40 6.467 4.713 2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.055 4.633 3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.729 6.001 2.546 1.00 0.00 H new ATOM 0 HG LEU A 40 4.873 3.442 1.431 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.573 2.722 0.928 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.867 2.818 2.681 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.942 4.099 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.760 4.230 -0.622 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.177 5.667 0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.922 5.426 -0.001 1.00 0.00 H new ATOM 672 N SER A 41 6.748 6.179 0.648 1.00 0.00 N ATOM 673 CA SER A 41 7.112 7.080 -0.440 1.00 0.00 C ATOM 674 C SER A 41 6.994 6.379 -1.789 1.00 0.00 C ATOM 675 O SER A 41 6.985 5.150 -1.864 1.00 0.00 O ATOM 676 CB SER A 41 8.538 7.598 -0.244 1.00 0.00 C ATOM 677 OG SER A 41 9.356 6.621 0.375 1.00 0.00 O ATOM 0 H SER A 41 7.007 5.205 0.493 1.00 0.00 H new ATOM 0 HA SER A 41 6.421 7.923 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.963 7.874 -1.209 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.519 8.501 0.367 1.00 0.00 H new ATOM 0 HG SER A 41 10.262 6.977 0.487 1.00 0.00 H new ATOM 683 N TYR A 42 6.903 7.169 -2.853 1.00 0.00 N ATOM 684 CA TYR A 42 6.783 6.625 -4.201 1.00 0.00 C ATOM 685 C TYR A 42 7.435 7.552 -5.222 1.00 0.00 C ATOM 686 O TYR A 42 7.532 8.760 -5.008 1.00 0.00 O ATOM 687 CB TYR A 42 5.311 6.410 -4.557 1.00 0.00 C ATOM 688 CG TYR A 42 4.565 7.692 -4.848 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.557 8.738 -3.934 1.00 0.00 C ATOM 690 CD2 TYR A 42 3.868 7.858 -6.039 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.876 9.911 -4.196 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.185 9.028 -6.310 1.00 0.00 C ATOM 693 CZ TYR A 42 3.192 10.052 -5.385 1.00 0.00 C ATOM 694 OH TYR A 42 2.513 11.219 -5.650 1.00 0.00 O ATOM 0 H TYR A 42 6.910 8.188 -2.808 1.00 0.00 H new ATOM 0 HA TYR A 42 7.300 5.666 -4.226 1.00 0.00 H new ATOM 0 HB2 TYR A 42 5.248 5.757 -5.428 1.00 0.00 H new ATOM 0 HB3 TYR A 42 4.819 5.892 -3.734 1.00 0.00 H new ATOM 0 HD1 TYR A 42 5.093 8.632 -3.002 1.00 0.00 H new ATOM 0 HD2 TYR A 42 3.860 7.059 -6.765 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.879 10.714 -3.473 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.649 9.141 -7.241 1.00 0.00 H new ATOM 0 HH TYR A 42 2.086 11.156 -6.530 1.00 0.00 H new ATOM 704 N TYR A 43 7.879 6.977 -6.334 1.00 0.00 N ATOM 705 CA TYR A 43 8.523 7.749 -7.389 1.00 0.00 C ATOM 706 C TYR A 43 7.989 7.349 -8.761 1.00 0.00 C ATOM 707 O TYR A 43 7.288 6.346 -8.900 1.00 0.00 O ATOM 708 CB TYR A 43 10.039 7.551 -7.342 1.00 0.00 C ATOM 709 CG TYR A 43 10.630 7.724 -5.961 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.355 6.813 -4.948 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.462 8.797 -5.668 1.00 0.00 C ATOM 712 CE1 TYR A 43 10.891 6.967 -3.684 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.004 8.958 -4.408 1.00 0.00 C ATOM 714 CZ TYR A 43 11.716 8.041 -3.419 1.00 0.00 C ATOM 715 OH TYR A 43 12.252 8.198 -2.162 1.00 0.00 O ATOM 0 H TYR A 43 7.805 5.978 -6.528 1.00 0.00 H new ATOM 0 HA TYR A 43 8.295 8.802 -7.224 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.278 6.552 -7.708 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.511 8.261 -8.021 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.711 5.970 -5.152 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.689 9.518 -6.439 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.666 6.251 -2.908 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.650 9.798 -4.198 1.00 0.00 H new ATOM 0 HH TYR A 43 12.810 9.003 -2.143 1.00 0.00 H new ATOM 725 N LYS A 44 8.327 8.140 -9.774 1.00 0.00 N ATOM 726 CA LYS A 44 7.885 7.870 -11.137 1.00 0.00 C ATOM 727 C LYS A 44 8.834 6.901 -11.835 1.00 0.00 C ATOM 728 O LYS A 44 8.404 6.042 -12.605 1.00 0.00 O ATOM 729 CB LYS A 44 7.793 9.174 -11.933 1.00 0.00 C ATOM 730 CG LYS A 44 6.641 10.067 -11.507 1.00 0.00 C ATOM 731 CD LYS A 44 6.594 11.345 -12.328 1.00 0.00 C ATOM 732 CE LYS A 44 6.043 11.092 -13.722 1.00 0.00 C ATOM 733 NZ LYS A 44 5.625 12.355 -14.391 1.00 0.00 N ATOM 0 H LYS A 44 8.906 8.974 -9.676 1.00 0.00 H new ATOM 0 HA LYS A 44 6.897 7.411 -11.088 1.00 0.00 H new ATOM 0 HB2 LYS A 44 8.728 9.724 -11.823 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.686 8.937 -12.991 1.00 0.00 H new ATOM 0 HG2 LYS A 44 5.701 9.527 -11.618 1.00 0.00 H new ATOM 0 HG3 LYS A 44 6.743 10.315 -10.451 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.974 12.083 -11.819 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.596 11.768 -12.403 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.801 10.594 -14.327 1.00 0.00 H new ATOM 0 HE3 LYS A 44 5.191 10.415 -13.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.255 12.140 -15.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 4.884 12.818 -13.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.444 12.991 -14.475 1.00 0.00 H new ATOM 747 N SER A 45 10.126 7.044 -11.559 1.00 0.00 N ATOM 748 CA SER A 45 11.137 6.183 -12.163 1.00 0.00 C ATOM 749 C SER A 45 12.201 5.795 -11.141 1.00 0.00 C ATOM 750 O SER A 45 12.847 6.657 -10.546 1.00 0.00 O ATOM 751 CB SER A 45 11.790 6.885 -13.355 1.00 0.00 C ATOM 752 OG SER A 45 12.755 6.051 -13.972 1.00 0.00 O ATOM 0 H SER A 45 10.498 7.748 -10.921 1.00 0.00 H new ATOM 0 HA SER A 45 10.644 5.275 -12.511 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.026 7.161 -14.082 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.263 7.809 -13.022 1.00 0.00 H new ATOM 0 HG SER A 45 13.156 6.522 -14.732 1.00 0.00 H new ATOM 758 N GLN A 46 12.376 4.493 -10.944 1.00 0.00 N ATOM 759 CA GLN A 46 13.361 3.990 -9.993 1.00 0.00 C ATOM 760 C GLN A 46 14.666 4.773 -10.096 1.00 0.00 C ATOM 761 O GLN A 46 15.425 4.863 -9.131 1.00 0.00 O ATOM 762 CB GLN A 46 13.625 2.503 -10.237 1.00 0.00 C ATOM 763 CG GLN A 46 12.583 1.590 -9.610 1.00 0.00 C ATOM 764 CD GLN A 46 11.411 1.321 -10.533 1.00 0.00 C ATOM 765 OE1 GLN A 46 10.793 2.249 -11.057 1.00 0.00 O ATOM 766 NE2 GLN A 46 11.099 0.047 -10.738 1.00 0.00 N ATOM 0 H GLN A 46 11.849 3.767 -11.430 1.00 0.00 H new ATOM 0 HA GLN A 46 12.958 4.120 -8.989 1.00 0.00 H new ATOM 0 HB2 GLN A 46 13.658 2.320 -11.311 1.00 0.00 H new ATOM 0 HB3 GLN A 46 14.607 2.247 -9.840 1.00 0.00 H new ATOM 0 HG2 GLN A 46 13.051 0.644 -9.338 1.00 0.00 H new ATOM 0 HG3 GLN A 46 12.218 2.042 -8.688 1.00 0.00 H new ATOM 0 HE21 GLN A 46 11.638 -0.690 -10.283 1.00 0.00 H new ATOM 0 HE22 GLN A 46 10.320 -0.195 -11.350 1.00 0.00 H new ATOM 775 N ASP A 47 14.920 5.338 -11.272 1.00 0.00 N ATOM 776 CA ASP A 47 16.133 6.114 -11.501 1.00 0.00 C ATOM 777 C ASP A 47 16.123 7.396 -10.674 1.00 0.00 C ATOM 778 O ASP A 47 17.137 7.776 -10.090 1.00 0.00 O ATOM 779 CB ASP A 47 16.275 6.452 -12.986 1.00 0.00 C ATOM 780 CG ASP A 47 16.920 5.331 -13.776 1.00 0.00 C ATOM 781 OD1 ASP A 47 17.985 4.839 -13.347 1.00 0.00 O ATOM 782 OD2 ASP A 47 16.360 4.945 -14.823 1.00 0.00 O ATOM 0 H ASP A 47 14.302 5.273 -12.081 1.00 0.00 H new ATOM 0 HA ASP A 47 16.985 5.509 -11.190 1.00 0.00 H new ATOM 0 HB2 ASP A 47 15.291 6.666 -13.402 1.00 0.00 H new ATOM 0 HB3 ASP A 47 16.871 7.358 -13.094 1.00 0.00 H new ATOM 787 N GLU A 48 14.970 8.056 -10.630 1.00 0.00 N ATOM 788 CA GLU A 48 14.829 9.296 -9.875 1.00 0.00 C ATOM 789 C GLU A 48 15.053 9.055 -8.385 1.00 0.00 C ATOM 790 O GLU A 48 15.317 9.988 -7.627 1.00 0.00 O ATOM 791 CB GLU A 48 13.442 9.902 -10.102 1.00 0.00 C ATOM 792 CG GLU A 48 12.406 9.447 -9.088 1.00 0.00 C ATOM 793 CD GLU A 48 11.087 10.181 -9.233 1.00 0.00 C ATOM 794 OE1 GLU A 48 10.672 10.435 -10.383 1.00 0.00 O ATOM 795 OE2 GLU A 48 10.469 10.500 -8.195 1.00 0.00 O ATOM 0 H GLU A 48 14.121 7.753 -11.108 1.00 0.00 H new ATOM 0 HA GLU A 48 15.586 9.995 -10.230 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.519 10.989 -10.067 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.099 9.639 -11.103 1.00 0.00 H new ATOM 0 HG2 GLU A 48 12.236 8.376 -9.203 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.795 9.602 -8.082 1.00 0.00 H new ATOM 802 N ALA A 49 14.946 7.796 -7.973 1.00 0.00 N ATOM 803 CA ALA A 49 15.138 7.431 -6.575 1.00 0.00 C ATOM 804 C ALA A 49 16.564 6.951 -6.324 1.00 0.00 C ATOM 805 O ALA A 49 17.214 6.378 -7.198 1.00 0.00 O ATOM 806 CB ALA A 49 14.139 6.358 -6.167 1.00 0.00 C ATOM 0 H ALA A 49 14.727 7.012 -8.588 1.00 0.00 H new ATOM 0 HA ALA A 49 14.969 8.320 -5.967 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.294 6.095 -5.121 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.125 6.735 -6.300 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.281 5.474 -6.788 1.00 0.00 H new ATOM 812 N PRO A 50 17.063 7.191 -5.102 1.00 0.00 N ATOM 813 CA PRO A 50 16.298 7.873 -4.054 1.00 0.00 C ATOM 814 C PRO A 50 16.082 9.350 -4.363 1.00 0.00 C ATOM 815 O PRO A 50 14.965 9.858 -4.266 1.00 0.00 O ATOM 816 CB PRO A 50 17.175 7.708 -2.811 1.00 0.00 C ATOM 817 CG PRO A 50 18.557 7.541 -3.342 1.00 0.00 C ATOM 818 CD PRO A 50 18.413 6.814 -4.650 1.00 0.00 C ATOM 0 HA PRO A 50 15.297 7.457 -3.943 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.104 8.578 -2.158 1.00 0.00 H new ATOM 0 HB3 PRO A 50 16.870 6.843 -2.223 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.040 8.508 -3.484 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.176 6.974 -2.647 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.176 7.119 -5.366 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.508 5.736 -4.523 1.00 0.00 H new ATOM 826 N GLY A 51 17.158 10.036 -4.734 1.00 0.00 N ATOM 827 CA GLY A 51 17.065 11.449 -5.051 1.00 0.00 C ATOM 828 C GLY A 51 16.034 12.167 -4.202 1.00 0.00 C ATOM 829 O GLY A 51 16.308 12.532 -3.059 1.00 0.00 O ATOM 0 H GLY A 51 18.093 9.638 -4.821 1.00 0.00 H new ATOM 0 HA2 GLY A 51 18.039 11.916 -4.906 1.00 0.00 H new ATOM 0 HA3 GLY A 51 16.809 11.566 -6.104 1.00 0.00 H new ATOM 833 N ASP A 52 14.847 12.371 -4.762 1.00 0.00 N ATOM 834 CA ASP A 52 13.772 13.051 -4.049 1.00 0.00 C ATOM 835 C ASP A 52 12.413 12.480 -4.443 1.00 0.00 C ATOM 836 O ASP A 52 12.034 12.466 -5.614 1.00 0.00 O ATOM 837 CB ASP A 52 13.811 14.553 -4.336 1.00 0.00 C ATOM 838 CG ASP A 52 15.221 15.109 -4.321 1.00 0.00 C ATOM 839 OD1 ASP A 52 15.686 15.520 -3.237 1.00 0.00 O ATOM 840 OD2 ASP A 52 15.860 15.132 -5.393 1.00 0.00 O ATOM 0 H ASP A 52 14.605 12.075 -5.708 1.00 0.00 H new ATOM 0 HA ASP A 52 13.918 12.889 -2.981 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.358 14.746 -5.308 1.00 0.00 H new ATOM 0 HB3 ASP A 52 13.209 15.077 -3.594 1.00 0.00 H new ATOM 845 N PRO A 53 11.662 11.997 -3.442 1.00 0.00 N ATOM 846 CA PRO A 53 10.334 11.415 -3.659 1.00 0.00 C ATOM 847 C PRO A 53 9.301 12.463 -4.060 1.00 0.00 C ATOM 848 O PRO A 53 9.355 13.606 -3.606 1.00 0.00 O ATOM 849 CB PRO A 53 9.983 10.812 -2.297 1.00 0.00 C ATOM 850 CG PRO A 53 10.777 11.605 -1.316 1.00 0.00 C ATOM 851 CD PRO A 53 12.051 11.981 -2.022 1.00 0.00 C ATOM 0 HA PRO A 53 10.335 10.690 -4.473 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.915 10.887 -2.094 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.242 9.754 -2.254 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.230 12.493 -0.998 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.985 11.021 -0.420 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.420 12.953 -1.695 1.00 0.00 H new ATOM 0 HD3 PRO A 53 12.845 11.259 -1.831 1.00 0.00 H new ATOM 859 N ILE A 54 8.361 12.065 -4.911 1.00 0.00 N ATOM 860 CA ILE A 54 7.315 12.970 -5.370 1.00 0.00 C ATOM 861 C ILE A 54 6.682 13.717 -4.201 1.00 0.00 C ATOM 862 O ILE A 54 6.472 14.928 -4.267 1.00 0.00 O ATOM 863 CB ILE A 54 6.214 12.215 -6.139 1.00 0.00 C ATOM 864 CG1 ILE A 54 6.778 11.629 -7.435 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.044 13.141 -6.434 1.00 0.00 C ATOM 866 CD1 ILE A 54 5.937 10.509 -8.007 1.00 0.00 C ATOM 0 H ILE A 54 8.303 11.122 -5.296 1.00 0.00 H new ATOM 0 HA ILE A 54 7.790 13.686 -6.041 1.00 0.00 H new ATOM 0 HB ILE A 54 5.854 11.395 -5.518 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.864 12.423 -8.176 1.00 0.00 H new ATOM 0 HG13 ILE A 54 7.785 11.257 -7.248 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.274 12.593 -6.978 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.630 13.514 -5.497 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.388 13.980 -7.039 1.00 0.00 H new ATOM 0 HD11 ILE A 54 6.396 10.141 -8.925 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.872 9.697 -7.283 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.936 10.881 -8.226 1.00 0.00 H new ATOM 878 N GLN A 55 6.381 12.987 -3.132 1.00 0.00 N ATOM 879 CA GLN A 55 5.773 13.581 -1.948 1.00 0.00 C ATOM 880 C GLN A 55 5.671 12.561 -0.818 1.00 0.00 C ATOM 881 O GLN A 55 4.821 11.673 -0.848 1.00 0.00 O ATOM 882 CB GLN A 55 4.385 14.130 -2.282 1.00 0.00 C ATOM 883 CG GLN A 55 3.993 15.340 -1.450 1.00 0.00 C ATOM 884 CD GLN A 55 3.459 14.959 -0.083 1.00 0.00 C ATOM 885 OE1 GLN A 55 4.200 14.930 0.900 1.00 0.00 O ATOM 886 NE2 GLN A 55 2.166 14.665 -0.013 1.00 0.00 N ATOM 0 H GLN A 55 6.548 11.983 -3.062 1.00 0.00 H new ATOM 0 HA GLN A 55 6.410 14.401 -1.616 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.355 14.400 -3.338 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.646 13.342 -2.133 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.860 15.990 -1.329 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.236 15.914 -1.985 1.00 0.00 H new ATOM 0 HE21 GLN A 55 1.588 14.702 -0.853 1.00 0.00 H new ATOM 0 HE22 GLN A 55 1.750 14.402 0.881 1.00 0.00 H new ATOM 895 N GLN A 56 6.544 12.697 0.175 1.00 0.00 N ATOM 896 CA GLN A 56 6.552 11.786 1.313 1.00 0.00 C ATOM 897 C GLN A 56 5.287 11.948 2.149 1.00 0.00 C ATOM 898 O GLN A 56 4.754 13.050 2.281 1.00 0.00 O ATOM 899 CB GLN A 56 7.787 12.032 2.182 1.00 0.00 C ATOM 900 CG GLN A 56 7.898 13.461 2.689 1.00 0.00 C ATOM 901 CD GLN A 56 9.283 13.788 3.214 1.00 0.00 C ATOM 902 OE1 GLN A 56 10.184 14.131 2.449 1.00 0.00 O ATOM 903 NE2 GLN A 56 9.459 13.682 4.526 1.00 0.00 N ATOM 0 H GLN A 56 7.254 13.428 0.214 1.00 0.00 H new ATOM 0 HA GLN A 56 6.584 10.766 0.929 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.762 11.353 3.035 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.680 11.789 1.607 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.648 14.149 1.882 1.00 0.00 H new ATOM 0 HG3 GLN A 56 7.166 13.619 3.481 1.00 0.00 H new ATOM 0 HE21 GLN A 56 8.684 13.394 5.123 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.370 13.889 4.937 1.00 0.00 H new ATOM 912 N LEU A 57 4.811 10.843 2.713 1.00 0.00 N ATOM 913 CA LEU A 57 3.607 10.862 3.537 1.00 0.00 C ATOM 914 C LEU A 57 3.858 10.191 4.883 1.00 0.00 C ATOM 915 O LEU A 57 4.775 9.384 5.024 1.00 0.00 O ATOM 916 CB LEU A 57 2.457 10.162 2.811 1.00 0.00 C ATOM 917 CG LEU A 57 2.161 10.651 1.393 1.00 0.00 C ATOM 918 CD1 LEU A 57 0.892 10.005 0.859 1.00 0.00 C ATOM 919 CD2 LEU A 57 2.041 12.168 1.366 1.00 0.00 C ATOM 0 H LEU A 57 5.240 9.923 2.615 1.00 0.00 H new ATOM 0 HA LEU A 57 3.335 11.902 3.716 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.677 9.095 2.767 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.553 10.276 3.409 1.00 0.00 H new ATOM 0 HG LEU A 57 2.991 10.360 0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.698 10.365 -0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.015 8.922 0.841 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.053 10.264 1.504 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.830 12.498 0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.230 12.481 2.024 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.976 12.613 1.706 1.00 0.00 H new ATOM 931 N ASN A 58 3.034 10.529 5.870 1.00 0.00 N ATOM 932 CA ASN A 58 3.165 9.957 7.205 1.00 0.00 C ATOM 933 C ASN A 58 1.930 9.140 7.571 1.00 0.00 C ATOM 934 O ASN A 58 0.942 9.679 8.073 1.00 0.00 O ATOM 935 CB ASN A 58 3.382 11.065 8.237 1.00 0.00 C ATOM 936 CG ASN A 58 3.754 10.518 9.602 1.00 0.00 C ATOM 937 OD1 ASN A 58 4.292 9.417 9.717 1.00 0.00 O ATOM 938 ND2 ASN A 58 3.466 11.288 10.646 1.00 0.00 N ATOM 0 H ASN A 58 2.269 11.196 5.770 1.00 0.00 H new ATOM 0 HA ASN A 58 4.030 9.294 7.206 1.00 0.00 H new ATOM 0 HB2 ASN A 58 4.170 11.733 7.889 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.474 11.661 8.323 1.00 0.00 H new ATOM 0 HD21 ASN A 58 3.691 10.973 11.590 1.00 0.00 H new ATOM 0 HD22 ASN A 58 3.020 12.194 10.504 1.00 0.00 H new ATOM 945 N LEU A 59 1.992 7.838 7.317 1.00 0.00 N ATOM 946 CA LEU A 59 0.879 6.945 7.621 1.00 0.00 C ATOM 947 C LEU A 59 0.197 7.349 8.924 1.00 0.00 C ATOM 948 O LEU A 59 -1.031 7.357 9.018 1.00 0.00 O ATOM 949 CB LEU A 59 1.370 5.499 7.715 1.00 0.00 C ATOM 950 CG LEU A 59 1.670 4.804 6.386 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.737 3.737 6.571 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.402 4.197 5.804 1.00 0.00 C ATOM 0 H LEU A 59 2.801 7.377 6.901 1.00 0.00 H new ATOM 0 HA LEU A 59 0.152 7.023 6.813 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.275 5.482 8.323 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.618 4.915 8.246 1.00 0.00 H new ATOM 0 HG LEU A 59 2.048 5.549 5.685 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.937 3.253 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.652 4.198 6.943 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.388 2.994 7.288 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.634 3.707 4.859 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.005 3.465 6.502 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.333 4.984 5.634 1.00 0.00 H new ATOM 964 N LYS A 60 1.001 7.685 9.927 1.00 0.00 N ATOM 965 CA LYS A 60 0.476 8.093 11.225 1.00 0.00 C ATOM 966 C LYS A 60 -0.473 9.279 11.079 1.00 0.00 C ATOM 967 O LYS A 60 -0.040 10.409 10.856 1.00 0.00 O ATOM 968 CB LYS A 60 1.623 8.457 12.170 1.00 0.00 C ATOM 969 CG LYS A 60 2.190 7.268 12.926 1.00 0.00 C ATOM 970 CD LYS A 60 1.432 7.017 14.219 1.00 0.00 C ATOM 971 CE LYS A 60 1.997 7.843 15.364 1.00 0.00 C ATOM 972 NZ LYS A 60 1.400 7.456 16.673 1.00 0.00 N ATOM 0 H LYS A 60 2.019 7.683 9.866 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.080 7.255 11.645 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.422 8.925 11.595 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.270 9.198 12.887 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.142 6.379 12.297 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.242 7.445 13.148 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.379 7.260 14.078 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.483 5.958 14.473 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.079 7.714 15.406 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.809 8.900 15.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.810 8.041 17.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.371 7.602 16.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.601 6.454 16.864 1.00 0.00 H new ATOM 986 N GLY A 61 -1.769 9.013 11.209 1.00 0.00 N ATOM 987 CA GLY A 61 -2.758 10.068 11.090 1.00 0.00 C ATOM 988 C GLY A 61 -3.693 9.857 9.916 1.00 0.00 C ATOM 989 O GLY A 61 -4.785 10.426 9.874 1.00 0.00 O ATOM 0 H GLY A 61 -2.152 8.086 11.395 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.341 10.121 12.010 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.251 11.026 10.979 1.00 0.00 H new ATOM 993 N CYS A 62 -3.266 9.039 8.961 1.00 0.00 N ATOM 994 CA CYS A 62 -4.072 8.756 7.779 1.00 0.00 C ATOM 995 C CYS A 62 -5.191 7.773 8.107 1.00 0.00 C ATOM 996 O CYS A 62 -5.369 7.384 9.260 1.00 0.00 O ATOM 997 CB CYS A 62 -3.194 8.194 6.660 1.00 0.00 C ATOM 998 SG CYS A 62 -1.586 9.005 6.505 1.00 0.00 S ATOM 0 H CYS A 62 -2.366 8.560 8.982 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.521 9.691 7.443 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.037 7.130 6.836 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -3.727 8.285 5.714 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.632 10.172 7.076 1.00 0.00 H new ATOM 1004 N GLU A 63 -5.943 7.378 7.084 1.00 0.00 N ATOM 1005 CA GLU A 63 -7.046 6.442 7.265 1.00 0.00 C ATOM 1006 C GLU A 63 -6.871 5.215 6.375 1.00 0.00 C ATOM 1007 O GLU A 63 -6.162 5.259 5.370 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.380 7.125 6.954 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.549 6.567 7.747 1.00 0.00 C ATOM 1010 CD GLU A 63 -9.686 7.208 9.114 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -10.391 8.232 9.222 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -9.087 6.683 10.077 1.00 0.00 O ATOM 0 H GLU A 63 -5.808 7.691 6.123 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.046 6.117 8.306 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.289 8.192 7.159 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.592 7.022 5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.470 6.719 7.185 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.422 5.491 7.866 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.521 4.119 6.754 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.438 2.879 5.991 1.00 0.00 C ATOM 1021 C VAL A 64 -8.826 2.336 5.672 1.00 0.00 C ATOM 1022 O VAL A 64 -9.640 2.115 6.570 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.640 1.804 6.753 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.679 0.480 6.005 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -5.206 2.260 6.971 1.00 0.00 C ATOM 0 H VAL A 64 -8.111 4.065 7.585 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.921 3.113 5.061 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.102 1.657 7.729 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.110 -0.267 6.558 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.713 0.149 5.905 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.242 0.609 5.015 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.657 1.488 7.511 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.730 2.437 6.007 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.202 3.182 7.552 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.091 2.121 4.387 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.381 1.602 3.949 1.00 0.00 C ATOM 1037 C VAL A 65 -10.205 0.496 2.915 1.00 0.00 C ATOM 1038 O VAL A 65 -10.069 0.747 1.717 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.260 2.715 3.350 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.676 2.211 3.118 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.262 3.937 4.255 1.00 0.00 C ATOM 0 H VAL A 65 -8.429 2.298 3.631 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.875 1.195 4.831 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.841 3.005 2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.282 3.012 2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.654 1.368 2.427 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.108 1.891 4.066 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.888 4.714 3.816 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.655 3.664 5.234 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.244 4.311 4.364 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.209 -0.760 3.385 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.052 -1.931 2.517 1.00 0.00 C ATOM 1053 C PRO A 66 -11.268 -2.158 1.624 1.00 0.00 C ATOM 1054 O PRO A 66 -12.398 -2.235 2.106 1.00 0.00 O ATOM 1055 CB PRO A 66 -9.893 -3.088 3.507 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.576 -2.623 4.746 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.367 -1.134 4.800 1.00 0.00 C ATOM 0 HA PRO A 66 -9.212 -1.820 1.831 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.347 -4.002 3.124 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.842 -3.308 3.693 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.638 -2.867 4.721 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.158 -3.108 5.628 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.216 -0.626 5.258 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.485 -0.873 5.385 1.00 0.00 H new ATOM 1065 N ASP A 67 -11.027 -2.264 0.322 1.00 0.00 N ATOM 1066 CA ASP A 67 -12.102 -2.483 -0.639 1.00 0.00 C ATOM 1067 C ASP A 67 -12.134 -3.938 -1.096 1.00 0.00 C ATOM 1068 O ASP A 67 -12.768 -4.272 -2.097 1.00 0.00 O ATOM 1069 CB ASP A 67 -11.933 -1.559 -1.846 1.00 0.00 C ATOM 1070 CG ASP A 67 -13.243 -1.302 -2.565 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -14.246 -1.007 -1.884 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -13.264 -1.396 -3.811 1.00 0.00 O ATOM 0 H ASP A 67 -10.097 -2.202 -0.092 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.048 -2.255 -0.147 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.510 -0.610 -1.517 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -11.220 -2.002 -2.542 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.443 -4.801 -0.358 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.391 -6.220 -0.687 1.00 0.00 C ATOM 1079 C VAL A 68 -12.786 -6.772 -0.961 1.00 0.00 C ATOM 1080 O VAL A 68 -13.684 -6.658 -0.128 1.00 0.00 O ATOM 1081 CB VAL A 68 -10.741 -7.036 0.446 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -10.702 -8.514 0.085 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -9.344 -6.514 0.744 1.00 0.00 C ATOM 0 H VAL A 68 -10.911 -4.541 0.473 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.783 -6.314 -1.587 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.346 -6.922 1.346 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.239 -9.075 0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.718 -8.877 -0.074 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.121 -8.651 -0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.899 -7.102 1.547 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.726 -6.596 -0.150 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.403 -5.469 1.049 1.00 0.00 H new ATOM 1093 N ASN A 69 -12.960 -7.370 -2.135 1.00 0.00 N ATOM 1094 CA ASN A 69 -14.246 -7.941 -2.519 1.00 0.00 C ATOM 1095 C ASN A 69 -14.092 -9.401 -2.932 1.00 0.00 C ATOM 1096 O ASN A 69 -14.186 -9.737 -4.113 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.862 -7.137 -3.666 1.00 0.00 C ATOM 1098 CG ASN A 69 -15.696 -5.970 -3.172 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -15.907 -5.809 -1.970 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -16.175 -5.151 -4.101 1.00 0.00 N ATOM 0 H ASN A 69 -12.227 -7.472 -2.837 1.00 0.00 H new ATOM 0 HA ASN A 69 -14.908 -7.895 -1.655 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.067 -6.764 -4.312 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -15.485 -7.794 -4.273 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -16.744 -4.349 -3.830 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -15.974 -5.324 -5.086 1.00 0.00 H new ATOM 1107 N VAL A 70 -13.855 -10.266 -1.951 1.00 0.00 N ATOM 1108 CA VAL A 70 -13.690 -11.691 -2.211 1.00 0.00 C ATOM 1109 C VAL A 70 -14.612 -12.155 -3.333 1.00 0.00 C ATOM 1110 O VAL A 70 -14.232 -12.985 -4.160 1.00 0.00 O ATOM 1111 CB VAL A 70 -13.972 -12.529 -0.950 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -13.864 -14.014 -1.260 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -13.021 -12.140 0.171 1.00 0.00 C ATOM 0 H VAL A 70 -13.773 -10.005 -0.969 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.653 -11.839 -2.512 1.00 0.00 H new ATOM 0 HB VAL A 70 -14.990 -12.325 -0.620 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -14.066 -14.590 -0.357 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.589 -14.279 -2.029 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -12.859 -14.239 -1.616 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -13.234 -12.742 1.054 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.993 -12.314 -0.147 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -13.153 -11.085 0.410 1.00 0.00 H new ATOM 1123 N SER A 71 -15.825 -11.614 -3.356 1.00 0.00 N ATOM 1124 CA SER A 71 -16.804 -11.975 -4.375 1.00 0.00 C ATOM 1125 C SER A 71 -16.134 -12.151 -5.734 1.00 0.00 C ATOM 1126 O SER A 71 -16.307 -13.173 -6.397 1.00 0.00 O ATOM 1127 CB SER A 71 -17.895 -10.906 -4.467 1.00 0.00 C ATOM 1128 OG SER A 71 -18.863 -11.247 -5.444 1.00 0.00 O ATOM 0 H SER A 71 -16.154 -10.924 -2.681 1.00 0.00 H new ATOM 0 HA SER A 71 -17.258 -12.923 -4.087 1.00 0.00 H new ATOM 0 HB2 SER A 71 -18.378 -10.791 -3.497 1.00 0.00 H new ATOM 0 HB3 SER A 71 -17.446 -9.944 -4.716 1.00 0.00 H new ATOM 0 HG SER A 71 -19.550 -10.549 -5.482 1.00 0.00 H new ATOM 1134 N GLY A 72 -15.366 -11.145 -6.144 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.681 -11.207 -7.421 1.00 0.00 C ATOM 1136 C GLY A 72 -13.173 -11.189 -7.272 1.00 0.00 C ATOM 1137 O GLY A 72 -12.478 -10.494 -8.013 1.00 0.00 O ATOM 0 H GLY A 72 -15.207 -10.288 -5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.980 -12.114 -7.946 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.992 -10.364 -8.038 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.666 -11.953 -6.310 1.00 0.00 N ATOM 1142 CA GLN A 73 -11.230 -12.019 -6.064 1.00 0.00 C ATOM 1143 C GLN A 73 -10.579 -10.656 -6.271 1.00 0.00 C ATOM 1144 O GLN A 73 -9.630 -10.519 -7.043 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.581 -13.053 -6.987 1.00 0.00 C ATOM 1146 CG GLN A 73 -11.217 -14.431 -6.899 1.00 0.00 C ATOM 1147 CD GLN A 73 -10.748 -15.214 -5.689 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -9.554 -15.468 -5.524 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -11.687 -15.601 -4.834 1.00 0.00 N ATOM 0 H GLN A 73 -13.228 -12.535 -5.688 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.077 -12.320 -5.028 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.642 -12.699 -8.016 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.522 -13.134 -6.741 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -12.301 -14.325 -6.860 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.984 -14.993 -7.803 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -12.664 -15.368 -5.010 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.431 -16.131 -4.001 1.00 0.00 H new ATOM 1158 N LYS A 74 -11.095 -9.648 -5.576 1.00 0.00 N ATOM 1159 CA LYS A 74 -10.565 -8.294 -5.682 1.00 0.00 C ATOM 1160 C LYS A 74 -9.938 -7.851 -4.363 1.00 0.00 C ATOM 1161 O LYS A 74 -10.533 -8.011 -3.297 1.00 0.00 O ATOM 1162 CB LYS A 74 -11.673 -7.319 -6.085 1.00 0.00 C ATOM 1163 CG LYS A 74 -11.224 -5.869 -6.124 1.00 0.00 C ATOM 1164 CD LYS A 74 -12.039 -5.059 -7.118 1.00 0.00 C ATOM 1165 CE LYS A 74 -13.402 -4.691 -6.552 1.00 0.00 C ATOM 1166 NZ LYS A 74 -14.196 -3.871 -7.509 1.00 0.00 N ATOM 0 H LYS A 74 -11.881 -9.744 -4.933 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.792 -8.293 -6.451 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.052 -7.599 -7.068 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.502 -7.415 -5.384 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.320 -5.431 -5.131 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.169 -5.821 -6.393 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -11.496 -4.151 -7.381 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.168 -5.631 -8.037 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -13.952 -5.600 -6.309 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.272 -4.139 -5.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -15.118 -3.641 -7.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.683 -2.992 -7.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.342 -4.408 -8.388 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.736 -7.291 -4.443 1.00 0.00 N ATOM 1181 CA PHE A 75 -8.029 -6.824 -3.256 1.00 0.00 C ATOM 1182 C PHE A 75 -7.413 -5.449 -3.496 1.00 0.00 C ATOM 1183 O PHE A 75 -6.490 -5.301 -4.297 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.938 -7.822 -2.861 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.440 -9.229 -2.709 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -7.451 -10.095 -3.791 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.899 -9.687 -1.484 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -7.913 -11.391 -3.654 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -8.362 -10.982 -1.341 1.00 0.00 C ATOM 1190 CZ PHE A 75 -8.368 -11.835 -2.427 1.00 0.00 C ATOM 0 H PHE A 75 -8.231 -7.149 -5.318 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.750 -6.743 -2.442 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -6.151 -7.805 -3.615 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.487 -7.502 -1.922 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -7.095 -9.754 -4.752 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -7.895 -9.025 -0.631 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.918 -12.056 -4.505 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -8.718 -11.326 -0.381 1.00 0.00 H new ATOM 0 HZ PHE A 75 -8.728 -12.847 -2.318 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.932 -4.446 -2.796 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.434 -3.081 -2.933 1.00 0.00 C ATOM 1202 C CYS A 76 -7.192 -2.451 -1.565 1.00 0.00 C ATOM 1203 O CYS A 76 -7.789 -2.860 -0.568 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.426 -2.232 -3.730 1.00 0.00 C ATOM 1205 SG CYS A 76 -7.688 -0.786 -4.524 1.00 0.00 S ATOM 0 H CYS A 76 -8.696 -4.552 -2.129 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.486 -3.118 -3.469 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.890 -2.856 -4.494 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.222 -1.900 -3.063 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.419 -0.740 -4.247 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.312 -1.456 -1.525 1.00 0.00 N ATOM 1212 CA ILE A 77 -5.991 -0.771 -0.279 1.00 0.00 C ATOM 1213 C ILE A 77 -6.146 0.739 -0.427 1.00 0.00 C ATOM 1214 O ILE A 77 -5.259 1.418 -0.945 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.555 -1.086 0.182 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.301 -2.594 0.136 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.320 -0.546 1.585 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -2.879 -2.977 0.484 1.00 0.00 C ATOM 0 H ILE A 77 -5.809 -1.107 -2.341 1.00 0.00 H new ATOM 0 HA ILE A 77 -6.693 -1.134 0.472 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.855 -0.598 -0.496 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.982 -3.090 0.827 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.535 -2.964 -0.862 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.301 -0.776 1.897 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.465 0.534 1.588 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.025 -1.009 2.276 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.771 -4.060 0.431 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.193 -2.509 -0.222 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.648 -2.638 1.494 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.278 1.260 0.033 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.550 2.690 -0.044 1.00 0.00 C ATOM 1232 C LYS A 78 -6.685 3.462 0.947 1.00 0.00 C ATOM 1233 O LYS A 78 -6.725 3.209 2.152 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.030 2.964 0.233 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.564 4.197 -0.477 1.00 0.00 C ATOM 1236 CD LYS A 78 -11.036 4.421 -0.174 1.00 0.00 C ATOM 1237 CE LYS A 78 -11.497 5.793 -0.640 1.00 0.00 C ATOM 1238 NZ LYS A 78 -11.657 5.853 -2.119 1.00 0.00 N ATOM 0 H LYS A 78 -8.023 0.712 0.464 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.307 3.027 -1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.615 2.097 -0.073 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.174 3.082 1.307 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.991 5.072 -0.169 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.426 4.087 -1.553 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.631 3.650 -0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.207 4.323 0.898 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.445 6.039 -0.162 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.775 6.546 -0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.890 6.826 -2.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -10.770 5.561 -2.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.424 5.214 -2.411 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.904 4.406 0.433 1.00 0.00 N ATOM 1253 CA LEU A 79 -5.030 5.218 1.273 1.00 0.00 C ATOM 1254 C LEU A 79 -5.510 6.665 1.321 1.00 0.00 C ATOM 1255 O LEU A 79 -5.417 7.394 0.333 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.593 5.162 0.751 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.716 4.045 1.318 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -3.233 2.685 0.878 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.269 4.233 0.887 1.00 0.00 C ATOM 0 H LEU A 79 -5.858 4.628 -0.561 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.059 4.812 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.625 5.056 -0.333 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.113 6.117 0.964 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.759 4.092 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.596 1.903 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.253 2.550 1.237 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.221 2.626 -0.210 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.659 3.429 1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.208 4.213 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.902 5.192 1.253 1.00 0.00 H new ATOM 1271 N LEU A 80 -6.022 7.074 2.476 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.515 8.436 2.655 1.00 0.00 C ATOM 1273 C LEU A 80 -5.630 9.213 3.624 1.00 0.00 C ATOM 1274 O LEU A 80 -5.628 8.950 4.827 1.00 0.00 O ATOM 1275 CB LEU A 80 -7.956 8.414 3.168 1.00 0.00 C ATOM 1276 CG LEU A 80 -9.049 8.408 2.099 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -9.002 9.689 1.280 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -8.906 7.190 1.197 1.00 0.00 C ATOM 0 H LEU A 80 -6.107 6.483 3.303 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.488 8.936 1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.084 7.531 3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.106 9.284 3.808 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.017 8.355 2.597 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.787 9.667 0.524 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.154 10.546 1.936 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.031 9.773 0.792 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.692 7.202 0.442 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.932 7.212 0.707 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.991 6.283 1.795 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.879 10.173 3.092 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.992 10.991 3.910 1.00 0.00 C ATOM 1292 C VAL A 81 -4.415 12.455 3.884 1.00 0.00 C ATOM 1293 O VAL A 81 -4.480 13.090 2.831 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.531 10.881 3.434 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.609 11.666 4.356 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -2.104 9.423 3.356 1.00 0.00 C ATOM 0 H VAL A 81 -4.868 10.403 2.098 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.064 10.614 4.930 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.459 11.311 2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.581 11.577 4.004 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.903 12.716 4.357 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.682 11.268 5.368 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -1.069 9.364 3.018 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.190 8.965 4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.746 8.893 2.652 1.00 0.00 H new ATOM 1306 N PRO A 82 -4.710 13.007 5.070 1.00 0.00 N ATOM 1307 CA PRO A 82 -5.132 14.404 5.210 1.00 0.00 C ATOM 1308 C PRO A 82 -3.997 15.383 4.927 1.00 0.00 C ATOM 1309 O PRO A 82 -2.853 15.152 5.318 1.00 0.00 O ATOM 1310 CB PRO A 82 -5.565 14.498 6.675 1.00 0.00 C ATOM 1311 CG PRO A 82 -4.801 13.422 7.367 1.00 0.00 C ATOM 1312 CD PRO A 82 -4.655 12.310 6.366 1.00 0.00 C ATOM 0 HA PRO A 82 -5.917 14.666 4.501 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.335 15.478 7.093 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.640 14.350 6.780 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.826 13.784 7.694 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -5.328 13.079 8.257 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.714 11.775 6.495 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -5.455 11.576 6.462 1.00 0.00 H new ATOM 1320 N SER A 83 -4.322 16.477 4.245 1.00 0.00 N ATOM 1321 CA SER A 83 -3.329 17.489 3.907 1.00 0.00 C ATOM 1322 C SER A 83 -3.971 18.871 3.816 1.00 0.00 C ATOM 1323 O SER A 83 -5.161 19.013 3.532 1.00 0.00 O ATOM 1324 CB SER A 83 -2.648 17.143 2.581 1.00 0.00 C ATOM 1325 OG SER A 83 -1.519 16.313 2.790 1.00 0.00 O ATOM 0 H SER A 83 -5.265 16.685 3.916 1.00 0.00 H new ATOM 0 HA SER A 83 -2.580 17.506 4.699 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.357 16.639 1.925 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.342 18.059 2.076 1.00 0.00 H new ATOM 0 HG SER A 83 -1.655 15.773 3.597 1.00 0.00 H new ATOM 1331 N PRO A 84 -3.165 19.914 4.063 1.00 0.00 N ATOM 1332 CA PRO A 84 -3.631 21.303 4.015 1.00 0.00 C ATOM 1333 C PRO A 84 -3.949 21.759 2.595 1.00 0.00 C ATOM 1334 O PRO A 84 -4.395 22.886 2.381 1.00 0.00 O ATOM 1335 CB PRO A 84 -2.448 22.094 4.578 1.00 0.00 C ATOM 1336 CG PRO A 84 -1.258 21.240 4.307 1.00 0.00 C ATOM 1337 CD PRO A 84 -1.737 19.818 4.407 1.00 0.00 C ATOM 0 HA PRO A 84 -4.558 21.441 4.572 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.356 23.066 4.094 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -2.568 22.279 5.645 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -0.848 21.445 3.318 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -0.465 21.436 5.028 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -1.201 19.164 3.719 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.591 19.414 5.409 1.00 0.00 H new ATOM 1345 N GLU A 85 -3.718 20.876 1.629 1.00 0.00 N ATOM 1346 CA GLU A 85 -3.980 21.190 0.229 1.00 0.00 C ATOM 1347 C GLU A 85 -5.402 20.796 -0.160 1.00 0.00 C ATOM 1348 O GLU A 85 -6.110 21.556 -0.819 1.00 0.00 O ATOM 1349 CB GLU A 85 -2.975 20.472 -0.674 1.00 0.00 C ATOM 1350 CG GLU A 85 -3.160 20.775 -2.152 1.00 0.00 C ATOM 1351 CD GLU A 85 -2.439 22.037 -2.584 1.00 0.00 C ATOM 1352 OE1 GLU A 85 -2.686 23.099 -1.975 1.00 0.00 O ATOM 1353 OE2 GLU A 85 -1.628 21.963 -3.531 1.00 0.00 O ATOM 0 H GLU A 85 -3.350 19.938 1.790 1.00 0.00 H new ATOM 0 HA GLU A 85 -3.871 22.267 0.098 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -1.965 20.756 -0.377 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -3.063 19.397 -0.518 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.795 19.933 -2.740 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.224 20.877 -2.368 1.00 0.00 H new ATOM 1360 N GLY A 86 -5.813 19.601 0.253 1.00 0.00 N ATOM 1361 CA GLY A 86 -7.147 19.125 -0.061 1.00 0.00 C ATOM 1362 C GLY A 86 -7.375 17.696 0.390 1.00 0.00 C ATOM 1363 O GLY A 86 -7.992 17.457 1.427 1.00 0.00 O ATOM 0 H GLY A 86 -5.245 18.954 0.800 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -7.882 19.774 0.415 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.310 19.193 -1.137 1.00 0.00 H new ATOM 1367 N MET A 87 -6.878 16.744 -0.393 1.00 0.00 N ATOM 1368 CA MET A 87 -7.031 15.331 -0.068 1.00 0.00 C ATOM 1369 C MET A 87 -6.216 14.462 -1.021 1.00 0.00 C ATOM 1370 O MET A 87 -6.311 14.604 -2.240 1.00 0.00 O ATOM 1371 CB MET A 87 -8.506 14.929 -0.128 1.00 0.00 C ATOM 1372 CG MET A 87 -8.808 13.618 0.579 1.00 0.00 C ATOM 1373 SD MET A 87 -8.833 13.787 2.374 1.00 0.00 S ATOM 1374 CE MET A 87 -7.403 12.809 2.827 1.00 0.00 C ATOM 0 H MET A 87 -6.366 16.925 -1.256 1.00 0.00 H new ATOM 0 HA MET A 87 -6.660 15.175 0.945 1.00 0.00 H new ATOM 0 HB2 MET A 87 -9.108 15.720 0.319 1.00 0.00 H new ATOM 0 HB3 MET A 87 -8.810 14.848 -1.172 1.00 0.00 H new ATOM 0 HG2 MET A 87 -9.773 13.241 0.240 1.00 0.00 H new ATOM 0 HG3 MET A 87 -8.059 12.877 0.298 1.00 0.00 H new ATOM 0 HE1 MET A 87 -7.169 12.972 3.879 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.618 11.753 2.663 1.00 0.00 H new ATOM 0 HE3 MET A 87 -6.551 13.106 2.215 1.00 0.00 H new ATOM 1384 N SER A 88 -5.416 13.563 -0.457 1.00 0.00 N ATOM 1385 CA SER A 88 -4.581 12.674 -1.257 1.00 0.00 C ATOM 1386 C SER A 88 -5.127 11.250 -1.235 1.00 0.00 C ATOM 1387 O SER A 88 -4.835 10.477 -0.323 1.00 0.00 O ATOM 1388 CB SER A 88 -3.141 12.689 -0.740 1.00 0.00 C ATOM 1389 OG SER A 88 -2.440 13.824 -1.217 1.00 0.00 O ATOM 0 H SER A 88 -5.328 13.431 0.551 1.00 0.00 H new ATOM 0 HA SER A 88 -4.593 13.033 -2.286 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.143 12.690 0.350 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.628 11.781 -1.057 1.00 0.00 H new ATOM 0 HG SER A 88 -1.523 13.811 -0.871 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.922 10.911 -2.246 1.00 0.00 N ATOM 1396 CA GLU A 89 -6.509 9.580 -2.341 1.00 0.00 C ATOM 1397 C GLU A 89 -5.755 8.724 -3.354 1.00 0.00 C ATOM 1398 O GLU A 89 -5.733 9.029 -4.547 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.984 9.677 -2.738 1.00 0.00 C ATOM 1400 CG GLU A 89 -8.703 8.339 -2.740 1.00 0.00 C ATOM 1401 CD GLU A 89 -10.183 8.472 -3.040 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -10.542 8.553 -4.234 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.983 8.495 -2.082 1.00 0.00 O ATOM 0 H GLU A 89 -6.174 11.539 -3.009 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.433 9.106 -1.362 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.493 10.352 -2.050 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.056 10.120 -3.731 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -8.243 7.685 -3.481 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.575 7.860 -1.769 1.00 0.00 H new ATOM 1410 N ILE A 90 -5.137 7.652 -2.870 1.00 0.00 N ATOM 1411 CA ILE A 90 -4.381 6.752 -3.732 1.00 0.00 C ATOM 1412 C ILE A 90 -5.001 5.358 -3.748 1.00 0.00 C ATOM 1413 O ILE A 90 -5.416 4.840 -2.711 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.912 6.643 -3.283 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -2.195 7.980 -3.481 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -2.204 5.537 -4.051 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.893 8.086 -2.718 1.00 0.00 C ATOM 0 H ILE A 90 -5.145 7.386 -1.885 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.414 7.174 -4.736 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.889 6.394 -2.222 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.997 8.123 -4.543 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.857 8.788 -3.168 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.167 5.472 -3.722 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.704 4.587 -3.864 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.234 5.758 -5.118 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.440 9.059 -2.905 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.086 7.975 -1.651 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.213 7.300 -3.047 1.00 0.00 H new ATOM 1429 N TYR A 91 -5.058 4.756 -4.931 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.627 3.422 -5.083 1.00 0.00 C ATOM 1431 C TYR A 91 -4.536 2.393 -5.362 1.00 0.00 C ATOM 1432 O TYR A 91 -3.753 2.540 -6.302 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.657 3.410 -6.214 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.949 4.113 -5.863 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.642 3.797 -4.701 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -8.478 5.093 -6.695 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.823 4.435 -4.377 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.657 5.738 -6.378 1.00 0.00 C ATOM 1439 CZ TYR A 91 -10.326 5.406 -5.218 1.00 0.00 C ATOM 1440 OH TYR A 91 -11.503 6.045 -4.900 1.00 0.00 O ATOM 0 H TYR A 91 -4.717 5.171 -5.798 1.00 0.00 H new ATOM 0 HA TYR A 91 -6.121 3.156 -4.148 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.223 3.884 -7.095 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.877 2.377 -6.483 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -8.250 3.039 -4.039 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.958 5.354 -7.605 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.350 4.175 -3.471 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -10.053 6.498 -7.035 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.330 6.999 -4.760 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.491 1.351 -4.540 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.497 0.295 -4.698 1.00 0.00 C ATOM 1452 C LEU A 92 -4.167 -1.069 -4.834 1.00 0.00 C ATOM 1453 O LEU A 92 -4.799 -1.557 -3.896 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.538 0.288 -3.506 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.912 1.634 -3.140 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.016 1.492 -1.920 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -1.129 2.196 -4.317 1.00 0.00 C ATOM 0 H LEU A 92 -5.131 1.214 -3.757 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.933 0.494 -5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.075 -0.089 -2.636 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.735 -0.419 -3.716 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.714 2.331 -2.897 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.579 2.460 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.605 1.135 -1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.220 0.779 -2.134 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.691 3.154 -4.038 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.336 1.500 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.799 2.337 -5.166 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.024 -1.679 -6.005 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.615 -2.987 -6.263 1.00 0.00 C ATOM 1471 C ARG A 93 -3.537 -4.063 -6.348 1.00 0.00 C ATOM 1472 O ARG A 93 -2.574 -3.933 -7.104 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.424 -2.957 -7.561 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.109 -4.275 -7.882 1.00 0.00 C ATOM 1475 CD ARG A 93 -7.465 -4.379 -7.200 1.00 0.00 C ATOM 1476 NE ARG A 93 -8.189 -5.582 -7.602 1.00 0.00 N ATOM 1477 CZ ARG A 93 -8.731 -5.746 -8.803 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -8.631 -4.790 -9.716 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -9.375 -6.870 -9.094 1.00 0.00 N ATOM 0 H ARG A 93 -3.504 -1.289 -6.791 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.280 -3.228 -5.434 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.178 -2.173 -7.491 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.763 -2.691 -8.385 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -6.235 -4.368 -8.961 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -5.476 -5.103 -7.563 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.328 -4.383 -6.119 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -8.061 -3.499 -7.442 1.00 0.00 H new ATOM 0 HE ARG A 93 -8.283 -6.337 -6.923 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.137 -3.925 -9.497 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -9.049 -4.919 -10.638 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.454 -7.608 -8.395 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.791 -6.995 -10.017 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.705 -5.124 -5.567 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.746 -6.223 -5.552 1.00 0.00 C ATOM 1495 C CYS A 94 -3.184 -7.340 -6.495 1.00 0.00 C ATOM 1496 O CYS A 94 -4.317 -7.350 -6.974 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.587 -6.770 -4.133 1.00 0.00 C ATOM 1498 SG CYS A 94 -1.588 -5.726 -3.047 1.00 0.00 S ATOM 0 H CYS A 94 -4.497 -5.247 -4.936 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.785 -5.839 -5.895 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.575 -6.895 -3.691 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.134 -7.760 -4.185 1.00 0.00 H new ATOM 0 HG CYS A 94 -2.336 -5.245 -2.099 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.277 -8.276 -6.756 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.570 -9.395 -7.643 1.00 0.00 C ATOM 1506 C GLN A 95 -3.237 -10.535 -6.880 1.00 0.00 C ATOM 1507 O GLN A 95 -4.288 -11.033 -7.283 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.287 -9.894 -8.310 1.00 0.00 C ATOM 1509 CG GLN A 95 -0.237 -10.378 -7.322 1.00 0.00 C ATOM 1510 CD GLN A 95 1.164 -10.354 -7.902 1.00 0.00 C ATOM 1511 OE1 GLN A 95 1.408 -10.880 -8.988 1.00 0.00 O ATOM 1512 NE2 GLN A 95 2.094 -9.743 -7.177 1.00 0.00 N ATOM 0 H GLN A 95 -1.334 -8.281 -6.366 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.259 -9.045 -8.412 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.534 -10.707 -8.992 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.864 -9.090 -8.913 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -0.268 -9.753 -6.430 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.479 -11.393 -7.008 1.00 0.00 H new ATOM 0 HE21 GLN A 95 1.847 -9.320 -6.282 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.055 -9.696 -7.515 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.619 -10.943 -5.778 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.153 -12.024 -4.957 1.00 0.00 C ATOM 1523 C ASP A 96 -3.261 -11.596 -3.497 1.00 0.00 C ATOM 1524 O ASP A 96 -2.579 -10.669 -3.061 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.269 -13.266 -5.073 1.00 0.00 C ATOM 1526 CG ASP A 96 -2.587 -14.090 -6.305 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -3.680 -14.692 -6.350 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -1.742 -14.134 -7.224 1.00 0.00 O ATOM 0 H ASP A 96 -1.747 -10.542 -5.432 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.152 -12.263 -5.321 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -1.223 -12.962 -5.103 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -2.396 -13.883 -4.184 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.123 -12.276 -2.748 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.321 -11.964 -1.337 1.00 0.00 C ATOM 1535 C GLU A 97 -3.005 -12.056 -0.570 1.00 0.00 C ATOM 1536 O GLU A 97 -2.810 -11.367 0.431 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.351 -12.914 -0.722 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.951 -14.378 -0.798 1.00 0.00 C ATOM 1539 CD GLU A 97 -6.037 -15.306 -0.291 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -6.483 -15.124 0.861 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -6.440 -16.216 -1.046 1.00 0.00 O ATOM 0 H GLU A 97 -4.695 -13.046 -3.094 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.692 -10.942 -1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.505 -12.642 0.322 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.306 -12.780 -1.231 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.713 -14.633 -1.831 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.044 -14.534 -0.215 1.00 0.00 H new ATOM 1548 N GLN A 98 -2.107 -12.912 -1.047 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.811 -13.095 -0.405 1.00 0.00 C ATOM 1550 C GLN A 98 -0.069 -11.768 -0.289 1.00 0.00 C ATOM 1551 O GLN A 98 0.428 -11.417 0.781 1.00 0.00 O ATOM 1552 CB GLN A 98 0.034 -14.098 -1.193 1.00 0.00 C ATOM 1553 CG GLN A 98 -0.203 -15.544 -0.789 1.00 0.00 C ATOM 1554 CD GLN A 98 0.465 -15.900 0.525 1.00 0.00 C ATOM 1555 OE1 GLN A 98 1.386 -15.216 0.971 1.00 0.00 O ATOM 1556 NE2 GLN A 98 0.004 -16.976 1.151 1.00 0.00 N ATOM 0 H GLN A 98 -2.253 -13.489 -1.875 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.982 -13.483 0.599 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.182 -13.986 -2.256 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.089 -13.859 -1.055 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -1.275 -15.723 -0.708 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.172 -16.202 -1.573 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.762 -17.514 0.745 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.415 -17.265 2.038 1.00 0.00 H new ATOM 1565 N GLN A 99 0.002 -11.036 -1.395 1.00 0.00 N ATOM 1566 CA GLN A 99 0.684 -9.747 -1.416 1.00 0.00 C ATOM 1567 C GLN A 99 -0.133 -8.687 -0.686 1.00 0.00 C ATOM 1568 O GLN A 99 0.413 -7.871 0.058 1.00 0.00 O ATOM 1569 CB GLN A 99 0.942 -9.306 -2.858 1.00 0.00 C ATOM 1570 CG GLN A 99 1.588 -7.935 -2.968 1.00 0.00 C ATOM 1571 CD GLN A 99 3.103 -8.001 -2.961 1.00 0.00 C ATOM 1572 OE1 GLN A 99 3.701 -8.691 -2.136 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.731 -7.281 -3.883 1.00 0.00 N ATOM 0 H GLN A 99 -0.404 -11.313 -2.289 1.00 0.00 H new ATOM 0 HA GLN A 99 1.639 -9.861 -0.902 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.583 -10.041 -3.345 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.003 -9.298 -3.401 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.253 -7.453 -3.886 1.00 0.00 H new ATOM 0 HG3 GLN A 99 1.251 -7.312 -2.140 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.194 -6.723 -4.547 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.750 -7.286 -3.927 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.443 -8.703 -0.903 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.335 -7.740 -0.268 1.00 0.00 C ATOM 1584 C TYR A 100 -2.142 -7.735 1.245 1.00 0.00 C ATOM 1585 O TYR A 100 -1.981 -6.680 1.858 1.00 0.00 O ATOM 1586 CB TYR A 100 -3.792 -8.063 -0.606 1.00 0.00 C ATOM 1587 CG TYR A 100 -4.772 -7.626 0.459 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.069 -6.282 0.649 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.402 -8.558 1.275 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -5.963 -5.879 1.622 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.299 -8.163 2.249 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.575 -6.823 2.419 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.468 -6.425 3.388 1.00 0.00 O ATOM 0 H TYR A 100 -1.911 -9.372 -1.514 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.091 -6.749 -0.651 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.053 -7.581 -1.548 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.891 -9.138 -0.760 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.593 -5.540 0.025 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.187 -9.608 1.146 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.181 -4.830 1.758 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -6.781 -8.900 2.874 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.810 -7.212 3.860 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.159 -8.923 1.842 1.00 0.00 N ATOM 1604 CA ALA A 101 -1.983 -9.057 3.282 1.00 0.00 C ATOM 1605 C ALA A 101 -0.678 -8.413 3.738 1.00 0.00 C ATOM 1606 O ALA A 101 -0.660 -7.626 4.684 1.00 0.00 O ATOM 1607 CB ALA A 101 -2.019 -10.524 3.684 1.00 0.00 C ATOM 0 H ALA A 101 -2.293 -9.806 1.350 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.805 -8.537 3.774 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.886 -10.609 4.763 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.979 -10.955 3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.217 -11.060 3.176 1.00 0.00 H new ATOM 1613 N ARG A 102 0.413 -8.754 3.060 1.00 0.00 N ATOM 1614 CA ARG A 102 1.723 -8.211 3.397 1.00 0.00 C ATOM 1615 C ARG A 102 1.671 -6.690 3.501 1.00 0.00 C ATOM 1616 O ARG A 102 1.900 -6.122 4.569 1.00 0.00 O ATOM 1617 CB ARG A 102 2.757 -8.626 2.348 1.00 0.00 C ATOM 1618 CG ARG A 102 3.273 -10.044 2.530 1.00 0.00 C ATOM 1619 CD ARG A 102 4.368 -10.371 1.526 1.00 0.00 C ATOM 1620 NE ARG A 102 5.218 -11.468 1.982 1.00 0.00 N ATOM 1621 CZ ARG A 102 4.814 -12.732 2.048 1.00 0.00 C ATOM 1622 NH1 ARG A 102 3.579 -13.056 1.690 1.00 0.00 N ATOM 1623 NH2 ARG A 102 5.646 -13.674 2.473 1.00 0.00 N ATOM 0 H ARG A 102 0.415 -9.404 2.274 1.00 0.00 H new ATOM 0 HA ARG A 102 2.017 -8.615 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.313 -8.534 1.357 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.599 -7.934 2.386 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.658 -10.165 3.542 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.450 -10.749 2.415 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.916 -10.636 0.570 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.980 -9.485 1.355 1.00 0.00 H new ATOM 0 HE ARG A 102 6.174 -11.252 2.265 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.937 -12.334 1.363 1.00 0.00 H new ATOM 0 HH12 ARG A 102 3.271 -14.027 1.742 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.597 -13.428 2.749 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.335 -14.644 2.523 1.00 0.00 H new ATOM 1637 N TRP A 103 1.369 -6.036 2.385 1.00 0.00 N ATOM 1638 CA TRP A 103 1.287 -4.580 2.350 1.00 0.00 C ATOM 1639 C TRP A 103 0.209 -4.073 3.301 1.00 0.00 C ATOM 1640 O TRP A 103 0.499 -3.347 4.251 1.00 0.00 O ATOM 1641 CB TRP A 103 0.997 -4.099 0.927 1.00 0.00 C ATOM 1642 CG TRP A 103 2.217 -4.043 0.058 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.762 -5.070 -0.657 1.00 0.00 C ATOM 1644 CD2 TRP A 103 3.043 -2.899 -0.184 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.878 -4.635 -1.329 1.00 0.00 N ATOM 1646 CE2 TRP A 103 4.071 -3.306 -1.057 1.00 0.00 C ATOM 1647 CE3 TRP A 103 3.014 -1.571 0.249 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 5.059 -2.432 -1.502 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.995 -0.704 -0.194 1.00 0.00 C ATOM 1650 CH2 TRP A 103 5.006 -1.137 -1.062 1.00 0.00 C ATOM 0 H TRP A 103 1.177 -6.491 1.492 1.00 0.00 H new ATOM 0 HA TRP A 103 2.248 -4.179 2.673 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.264 -4.763 0.469 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.546 -3.108 0.971 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.373 -6.077 -0.690 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.467 -5.208 -1.933 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.239 -1.228 0.918 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.840 -2.764 -2.171 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.982 0.325 0.135 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.758 -0.435 -1.390 1.00 0.00 H new ATOM 1661 N MET A 104 -1.035 -4.460 3.040 1.00 0.00 N ATOM 1662 CA MET A 104 -2.156 -4.044 3.875 1.00 0.00 C ATOM 1663 C MET A 104 -1.744 -3.975 5.342 1.00 0.00 C ATOM 1664 O MET A 104 -1.663 -2.893 5.923 1.00 0.00 O ATOM 1665 CB MET A 104 -3.330 -5.011 3.708 1.00 0.00 C ATOM 1666 CG MET A 104 -4.406 -4.849 4.769 1.00 0.00 C ATOM 1667 SD MET A 104 -4.962 -3.142 4.940 1.00 0.00 S ATOM 1668 CE MET A 104 -6.336 -3.117 3.791 1.00 0.00 C ATOM 0 H MET A 104 -1.292 -5.061 2.257 1.00 0.00 H new ATOM 0 HA MET A 104 -2.466 -3.049 3.555 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.776 -4.862 2.724 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.954 -6.034 3.736 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.258 -5.481 4.517 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.022 -5.200 5.727 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.965 -2.250 3.995 1.00 0.00 H new ATOM 0 HE2 MET A 104 -5.956 -3.058 2.771 1.00 0.00 H new ATOM 0 HE3 MET A 104 -6.924 -4.027 3.907 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.485 -5.136 5.935 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.080 -5.206 7.333 1.00 0.00 C ATOM 1680 C ALA A 105 -0.058 -4.124 7.664 1.00 0.00 C ATOM 1681 O ALA A 105 -0.125 -3.494 8.718 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.515 -6.583 7.651 1.00 0.00 C ATOM 0 H ALA A 105 -1.549 -6.041 5.469 1.00 0.00 H new ATOM 0 HA ALA A 105 -1.963 -5.036 7.950 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.217 -6.621 8.699 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.276 -7.341 7.463 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.352 -6.775 7.020 1.00 0.00 H new ATOM 1688 N GLY A 106 0.890 -3.914 6.755 1.00 0.00 N ATOM 1689 CA GLY A 106 1.914 -2.908 6.969 1.00 0.00 C ATOM 1690 C GLY A 106 1.330 -1.537 7.247 1.00 0.00 C ATOM 1691 O GLY A 106 1.676 -0.897 8.240 1.00 0.00 O ATOM 0 H GLY A 106 0.967 -4.423 5.874 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.544 -3.208 7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.556 -2.855 6.090 1.00 0.00 H new ATOM 1695 N CYS A 107 0.443 -1.084 6.367 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.188 0.222 6.520 1.00 0.00 C ATOM 1697 C CYS A 107 -0.962 0.300 7.832 1.00 0.00 C ATOM 1698 O CYS A 107 -0.893 1.301 8.546 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.125 0.500 5.344 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.273 0.796 3.776 1.00 0.00 S ATOM 0 H CYS A 107 0.145 -1.602 5.540 1.00 0.00 H new ATOM 0 HA CYS A 107 0.597 0.978 6.536 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.801 -0.347 5.224 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -1.740 1.368 5.581 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.149 1.019 2.842 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.700 -0.761 8.142 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.490 -0.811 9.367 1.00 0.00 C ATOM 1708 C ARG A 108 -1.596 -0.675 10.596 1.00 0.00 C ATOM 1709 O ARG A 108 -1.977 -0.052 11.588 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.277 -2.120 9.438 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.540 -2.118 8.592 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.085 -3.525 8.402 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.143 -4.265 9.660 1.00 0.00 N ATOM 1714 CZ ARG A 108 -5.714 -5.457 9.785 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -6.274 -6.042 8.735 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -5.727 -6.067 10.964 1.00 0.00 N ATOM 0 H ARG A 108 -1.767 -1.597 7.562 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.189 0.025 9.353 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.634 -2.939 9.114 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.545 -2.317 10.476 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.297 -1.495 9.068 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.327 -1.675 7.619 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.083 -3.471 7.967 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.457 -4.064 7.693 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.722 -3.843 10.488 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -6.267 -5.576 7.828 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.712 -6.958 8.835 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.298 -5.620 11.774 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.166 -6.983 11.060 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.407 -1.261 10.524 1.00 0.00 N ATOM 1731 CA LEU A 109 0.542 -1.207 11.631 1.00 0.00 C ATOM 1732 C LEU A 109 1.052 0.215 11.841 1.00 0.00 C ATOM 1733 O LEU A 109 1.188 0.676 12.974 1.00 0.00 O ATOM 1734 CB LEU A 109 1.718 -2.149 11.368 1.00 0.00 C ATOM 1735 CG LEU A 109 1.413 -3.645 11.464 1.00 0.00 C ATOM 1736 CD1 LEU A 109 2.406 -4.445 10.635 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.436 -4.102 12.915 1.00 0.00 C ATOM 0 H LEU A 109 -0.076 -1.780 9.710 1.00 0.00 H new ATOM 0 HA LEU A 109 0.025 -1.526 12.536 1.00 0.00 H new ATOM 0 HB2 LEU A 109 2.109 -1.941 10.372 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.512 -1.914 12.077 1.00 0.00 H new ATOM 0 HG LEU A 109 0.414 -3.820 11.065 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.174 -5.507 10.715 1.00 0.00 H new ATOM 0 HD12 LEU A 109 2.341 -4.137 9.592 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.416 -4.265 11.004 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.217 -5.169 12.964 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.422 -3.914 13.340 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.686 -3.551 13.482 1.00 0.00 H new ATOM 1749 N ALA A 110 1.332 0.907 10.740 1.00 0.00 N ATOM 1750 CA ALA A 110 1.823 2.277 10.804 1.00 0.00 C ATOM 1751 C ALA A 110 0.700 3.247 11.156 1.00 0.00 C ATOM 1752 O ALA A 110 0.946 4.329 11.689 1.00 0.00 O ATOM 1753 CB ALA A 110 2.466 2.669 9.481 1.00 0.00 C ATOM 0 H ALA A 110 1.227 0.540 9.794 1.00 0.00 H new ATOM 0 HA ALA A 110 2.575 2.331 11.592 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.829 3.695 9.543 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.301 2.001 9.270 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.729 2.592 8.681 1.00 0.00 H new ATOM 1759 N SER A 111 -0.533 2.853 10.854 1.00 0.00 N ATOM 1760 CA SER A 111 -1.694 3.689 11.135 1.00 0.00 C ATOM 1761 C SER A 111 -1.762 4.043 12.618 1.00 0.00 C ATOM 1762 O SER A 111 -2.098 5.169 12.985 1.00 0.00 O ATOM 1763 CB SER A 111 -2.978 2.976 10.710 1.00 0.00 C ATOM 1764 OG SER A 111 -4.095 3.460 11.435 1.00 0.00 O ATOM 0 H SER A 111 -0.754 1.959 10.414 1.00 0.00 H new ATOM 0 HA SER A 111 -1.593 4.611 10.563 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.142 3.122 9.642 1.00 0.00 H new ATOM 0 HB3 SER A 111 -2.873 1.903 10.872 1.00 0.00 H new ATOM 0 HG SER A 111 -4.903 2.989 11.143 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.441 3.073 13.466 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.464 3.279 14.910 1.00 0.00 C ATOM 1772 C LYS A 112 -0.051 3.445 15.458 1.00 0.00 C ATOM 1773 O LYS A 112 0.140 3.672 16.652 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.156 2.103 15.603 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.565 1.843 15.097 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.557 2.838 15.673 1.00 0.00 C ATOM 1777 CE LYS A 112 -5.975 2.288 15.652 1.00 0.00 C ATOM 1778 NZ LYS A 112 -6.145 1.155 16.604 1.00 0.00 N ATOM 0 H LYS A 112 -1.161 2.135 13.179 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.023 4.192 15.113 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.556 1.204 15.461 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.194 2.295 16.675 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.578 1.903 14.009 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.867 0.830 15.364 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.276 3.082 16.697 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.517 3.765 15.102 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.677 3.083 15.905 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.220 1.955 14.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.152 1.051 16.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -5.801 0.278 16.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -5.601 1.345 17.470 1.00 0.00 H new ATOM 1792 N GLY A 113 0.939 3.332 14.577 1.00 0.00 N ATOM 1793 CA GLY A 113 2.322 3.474 14.992 1.00 0.00 C ATOM 1794 C GLY A 113 3.133 2.218 14.745 1.00 0.00 C ATOM 1795 O GLY A 113 4.251 2.283 14.234 1.00 0.00 O ATOM 0 H GLY A 113 0.807 3.145 13.583 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.776 4.307 14.455 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.356 3.722 16.053 1.00 0.00 H new ATOM 1799 N ARG A 114 2.570 1.071 15.111 1.00 0.00 N ATOM 1800 CA ARG A 114 3.250 -0.206 14.929 1.00 0.00 C ATOM 1801 C ARG A 114 3.976 -0.250 13.588 1.00 0.00 C ATOM 1802 O ARG A 114 3.588 0.430 12.637 1.00 0.00 O ATOM 1803 CB ARG A 114 2.248 -1.359 15.017 1.00 0.00 C ATOM 1804 CG ARG A 114 1.720 -1.601 16.421 1.00 0.00 C ATOM 1805 CD ARG A 114 0.503 -2.513 16.408 1.00 0.00 C ATOM 1806 NE ARG A 114 0.281 -3.147 17.705 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.641 -4.080 17.918 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.422 -4.484 16.926 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -0.783 -4.610 19.126 1.00 0.00 N ATOM 0 H ARG A 114 1.645 1.000 15.535 1.00 0.00 H new ATOM 0 HA ARG A 114 3.987 -0.313 15.725 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.409 -1.151 14.353 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.723 -2.271 14.655 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.504 -2.046 17.034 1.00 0.00 H new ATOM 0 HG3 ARG A 114 1.458 -0.649 16.882 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.379 -1.936 16.131 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.634 -3.282 15.646 1.00 0.00 H new ATOM 0 HE ARG A 114 0.865 -2.858 18.490 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.316 -4.079 15.996 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.129 -5.200 17.093 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.184 -4.301 19.892 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.491 -5.326 19.289 1.00 0.00 H new ATOM 1823 N THR A 115 5.033 -1.054 13.518 1.00 0.00 N ATOM 1824 CA THR A 115 5.814 -1.185 12.295 1.00 0.00 C ATOM 1825 C THR A 115 6.026 -2.650 11.932 1.00 0.00 C ATOM 1826 O THR A 115 5.780 -3.542 12.744 1.00 0.00 O ATOM 1827 CB THR A 115 7.185 -0.496 12.427 1.00 0.00 C ATOM 1828 OG1 THR A 115 8.031 -1.254 13.300 1.00 0.00 O ATOM 1829 CG2 THR A 115 7.031 0.919 12.965 1.00 0.00 C ATOM 0 H THR A 115 5.367 -1.624 14.295 1.00 0.00 H new ATOM 0 HA THR A 115 5.246 -0.697 11.504 1.00 0.00 H new ATOM 0 HB THR A 115 7.638 -0.443 11.437 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.902 -0.811 13.378 1.00 0.00 H new ATOM 0 HG21 THR A 115 8.013 1.385 13.049 1.00 0.00 H new ATOM 0 HG22 THR A 115 6.410 1.501 12.284 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.560 0.886 13.947 1.00 0.00 H new ATOM 1837 N MET A 116 6.486 -2.892 10.709 1.00 0.00 N ATOM 1838 CA MET A 116 6.734 -4.250 10.241 1.00 0.00 C ATOM 1839 C MET A 116 7.703 -4.977 11.168 1.00 0.00 C ATOM 1840 O MET A 116 7.594 -6.186 11.370 1.00 0.00 O ATOM 1841 CB MET A 116 7.292 -4.228 8.817 1.00 0.00 C ATOM 1842 CG MET A 116 6.973 -5.482 8.019 1.00 0.00 C ATOM 1843 SD MET A 116 8.225 -5.851 6.775 1.00 0.00 S ATOM 1844 CE MET A 116 8.460 -4.234 6.041 1.00 0.00 C ATOM 0 H MET A 116 6.694 -2.165 10.024 1.00 0.00 H new ATOM 0 HA MET A 116 5.785 -4.787 10.244 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.891 -3.361 8.292 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.374 -4.101 8.861 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.883 -6.328 8.700 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.006 -5.361 7.531 1.00 0.00 H new ATOM 0 HE1 MET A 116 8.977 -4.339 5.087 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.490 -3.764 5.878 1.00 0.00 H new ATOM 0 HE3 MET A 116 9.056 -3.614 6.711 1.00 0.00 H new ATOM 1854 N ALA A 117 8.649 -4.232 11.729 1.00 0.00 N ATOM 1855 CA ALA A 117 9.636 -4.805 12.636 1.00 0.00 C ATOM 1856 C ALA A 117 8.962 -5.605 13.745 1.00 0.00 C ATOM 1857 O ALA A 117 9.478 -6.633 14.184 1.00 0.00 O ATOM 1858 CB ALA A 117 10.508 -3.708 13.228 1.00 0.00 C ATOM 0 H ALA A 117 8.753 -3.230 11.571 1.00 0.00 H new ATOM 0 HA ALA A 117 10.267 -5.486 12.065 1.00 0.00 H new ATOM 0 HB1 ALA A 117 11.240 -4.150 13.903 1.00 0.00 H new ATOM 0 HB2 ALA A 117 11.025 -3.182 12.426 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.884 -3.005 13.780 1.00 0.00 H new ATOM 1864 N ASP A 118 7.807 -5.127 14.195 1.00 0.00 N ATOM 1865 CA ASP A 118 7.062 -5.798 15.254 1.00 0.00 C ATOM 1866 C ASP A 118 6.564 -7.163 14.787 1.00 0.00 C ATOM 1867 O ASP A 118 6.309 -7.369 13.600 1.00 0.00 O ATOM 1868 CB ASP A 118 5.881 -4.936 15.701 1.00 0.00 C ATOM 1869 CG ASP A 118 5.312 -5.379 17.035 1.00 0.00 C ATOM 1870 OD1 ASP A 118 5.928 -5.067 18.075 1.00 0.00 O ATOM 1871 OD2 ASP A 118 4.251 -6.037 17.038 1.00 0.00 O ATOM 0 H ASP A 118 7.366 -4.277 13.843 1.00 0.00 H new ATOM 0 HA ASP A 118 7.734 -5.946 16.099 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.201 -3.896 15.773 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.098 -4.977 14.944 1.00 0.00 H new ATOM 1876 N SER A 119 6.429 -8.091 15.728 1.00 0.00 N ATOM 1877 CA SER A 119 5.966 -9.438 15.412 1.00 0.00 C ATOM 1878 C SER A 119 4.495 -9.426 15.008 1.00 0.00 C ATOM 1879 O SER A 119 4.025 -10.323 14.309 1.00 0.00 O ATOM 1880 CB SER A 119 6.170 -10.364 16.612 1.00 0.00 C ATOM 1881 OG SER A 119 7.477 -10.912 16.618 1.00 0.00 O ATOM 0 H SER A 119 6.633 -7.936 16.715 1.00 0.00 H new ATOM 0 HA SER A 119 6.552 -9.810 14.572 1.00 0.00 H new ATOM 0 HB2 SER A 119 6.000 -9.810 17.535 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.435 -11.169 16.583 1.00 0.00 H new ATOM 0 HG SER A 119 7.582 -11.499 17.396 1.00 0.00 H new ATOM 1887 N SER A 120 3.774 -8.402 15.454 1.00 0.00 N ATOM 1888 CA SER A 120 2.355 -8.274 15.143 1.00 0.00 C ATOM 1889 C SER A 120 2.135 -8.182 13.636 1.00 0.00 C ATOM 1890 O SER A 120 1.047 -8.468 13.137 1.00 0.00 O ATOM 1891 CB SER A 120 1.770 -7.039 15.831 1.00 0.00 C ATOM 1892 OG SER A 120 0.364 -7.152 15.972 1.00 0.00 O ATOM 0 H SER A 120 4.149 -7.649 16.031 1.00 0.00 H new ATOM 0 HA SER A 120 1.846 -9.164 15.514 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.228 -6.914 16.812 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.010 -6.148 15.251 1.00 0.00 H new ATOM 0 HG SER A 120 -0.061 -7.062 15.094 1.00 0.00 H new ATOM 1898 N TYR A 121 3.177 -7.781 12.916 1.00 0.00 N ATOM 1899 CA TYR A 121 3.099 -7.648 11.466 1.00 0.00 C ATOM 1900 C TYR A 121 2.533 -8.916 10.833 1.00 0.00 C ATOM 1901 O TYR A 121 1.524 -8.875 10.128 1.00 0.00 O ATOM 1902 CB TYR A 121 4.482 -7.348 10.885 1.00 0.00 C ATOM 1903 CG TYR A 121 4.610 -7.691 9.418 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.926 -6.963 8.452 1.00 0.00 C ATOM 1905 CD2 TYR A 121 5.415 -8.742 8.998 1.00 0.00 C ATOM 1906 CE1 TYR A 121 4.039 -7.274 7.111 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.536 -9.059 7.659 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.845 -8.322 6.719 1.00 0.00 C ATOM 1909 OH TYR A 121 4.962 -8.634 5.384 1.00 0.00 O ATOM 0 H TYR A 121 4.086 -7.542 13.313 1.00 0.00 H new ATOM 0 HA TYR A 121 2.429 -6.819 11.238 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.703 -6.290 11.023 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.232 -7.906 11.447 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.295 -6.140 8.755 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.956 -9.322 9.731 1.00 0.00 H new ATOM 0 HE1 TYR A 121 3.499 -6.699 6.373 1.00 0.00 H new ATOM 0 HE2 TYR A 121 6.168 -9.879 7.350 1.00 0.00 H new ATOM 0 HH TYR A 121 5.568 -9.397 5.278 1.00 0.00 H new ATOM 1919 N THR A 122 3.191 -10.042 11.090 1.00 0.00 N ATOM 1920 CA THR A 122 2.755 -11.322 10.546 1.00 0.00 C ATOM 1921 C THR A 122 1.396 -11.724 11.107 1.00 0.00 C ATOM 1922 O THR A 122 0.571 -12.307 10.403 1.00 0.00 O ATOM 1923 CB THR A 122 3.773 -12.437 10.850 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.668 -13.477 9.870 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.544 -13.016 12.238 1.00 0.00 C ATOM 0 H THR A 122 4.028 -10.093 11.671 1.00 0.00 H new ATOM 0 HA THR A 122 2.676 -11.196 9.466 1.00 0.00 H new ATOM 0 HB THR A 122 4.773 -12.005 10.815 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.320 -14.181 10.069 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.275 -13.802 12.430 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.654 -12.228 12.983 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.539 -13.434 12.297 1.00 0.00 H new ATOM 1933 N SER A 123 1.169 -11.408 12.378 1.00 0.00 N ATOM 1934 CA SER A 123 -0.091 -11.740 13.034 1.00 0.00 C ATOM 1935 C SER A 123 -1.278 -11.259 12.206 1.00 0.00 C ATOM 1936 O SER A 123 -2.322 -11.910 12.162 1.00 0.00 O ATOM 1937 CB SER A 123 -0.142 -11.116 14.430 1.00 0.00 C ATOM 1938 OG SER A 123 0.457 -11.967 15.392 1.00 0.00 O ATOM 0 H SER A 123 1.840 -10.923 12.974 1.00 0.00 H new ATOM 0 HA SER A 123 -0.150 -12.825 13.125 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.371 -10.155 14.421 1.00 0.00 H new ATOM 0 HB3 SER A 123 -1.178 -10.922 14.707 1.00 0.00 H new ATOM 0 HG SER A 123 0.413 -11.544 16.275 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.110 -10.115 11.550 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.168 -9.546 10.724 1.00 0.00 C ATOM 1946 C GLU A 124 -2.299 -10.308 9.408 1.00 0.00 C ATOM 1947 O GLU A 124 -3.399 -10.684 9.002 1.00 0.00 O ATOM 1948 CB GLU A 124 -1.889 -8.068 10.444 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.471 -7.131 11.489 1.00 0.00 C ATOM 1950 CD GLU A 124 -1.864 -7.339 12.863 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -0.742 -6.844 13.096 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -2.511 -7.997 13.704 1.00 0.00 O ATOM 0 H GLU A 124 -0.252 -9.564 11.575 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.107 -9.633 11.271 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.811 -7.914 10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.297 -7.808 9.467 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.309 -6.099 11.177 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.549 -7.281 11.546 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.169 -10.531 8.745 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.156 -11.248 7.475 1.00 0.00 C ATOM 1961 C VAL A 125 -1.939 -12.552 7.573 1.00 0.00 C ATOM 1962 O VAL A 125 -2.660 -12.925 6.647 1.00 0.00 O ATOM 1963 CB VAL A 125 0.282 -11.558 7.021 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.272 -12.372 5.735 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.073 -10.272 6.840 1.00 0.00 C ATOM 0 H VAL A 125 -0.250 -10.226 9.066 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.629 -10.598 6.739 1.00 0.00 H new ATOM 0 HB VAL A 125 0.769 -12.151 7.795 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.297 -12.582 5.429 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.256 -13.311 5.903 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.232 -11.807 4.951 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.087 -10.511 6.519 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.590 -9.651 6.085 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.110 -9.731 7.786 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.794 -13.241 8.700 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.488 -14.505 8.918 1.00 0.00 C ATOM 1977 C GLN A 126 -3.983 -14.278 9.113 1.00 0.00 C ATOM 1978 O GLN A 126 -4.806 -14.845 8.396 1.00 0.00 O ATOM 1979 CB GLN A 126 -1.906 -15.227 10.134 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.386 -15.248 10.160 1.00 0.00 C ATOM 1981 CD GLN A 126 0.194 -16.443 9.429 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.340 -17.550 9.503 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.293 -16.225 8.717 1.00 0.00 N ATOM 0 H GLN A 126 -1.202 -12.945 9.476 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.346 -15.126 8.034 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.270 -14.744 11.041 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.275 -16.252 10.148 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.006 -14.331 9.709 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.044 -15.259 11.195 1.00 0.00 H new ATOM 0 HE21 GLN A 126 1.702 -15.291 8.684 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.728 -16.991 8.203 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.327 -13.444 10.090 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.723 -13.141 10.379 1.00 0.00 C ATOM 1994 C ALA A 127 -6.478 -12.765 9.108 1.00 0.00 C ATOM 1995 O ALA A 127 -7.633 -13.149 8.924 1.00 0.00 O ATOM 1996 CB ALA A 127 -5.819 -12.020 11.403 1.00 0.00 C ATOM 0 H ALA A 127 -3.658 -12.967 10.694 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.185 -14.037 10.793 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -6.867 -11.804 11.609 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.323 -12.326 12.324 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.335 -11.126 11.010 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.818 -12.011 8.235 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.427 -11.584 6.982 1.00 0.00 C ATOM 2004 C ILE A 128 -6.789 -12.781 6.110 1.00 0.00 C ATOM 2005 O ILE A 128 -7.966 -13.052 5.866 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.490 -10.652 6.190 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.310 -9.325 6.930 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -6.039 -10.414 4.791 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -4.081 -8.555 6.501 1.00 0.00 C ATOM 0 H ILE A 128 -4.862 -11.684 8.373 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.335 -11.039 7.242 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.515 -11.132 6.100 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.192 -8.705 6.768 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.251 -9.521 8.001 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.366 -9.754 4.244 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.121 -11.365 4.266 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.024 -9.952 4.860 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.018 -7.626 7.067 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.191 -9.156 6.689 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.147 -8.328 5.437 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.772 -13.497 5.644 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.982 -14.668 4.801 1.00 0.00 C ATOM 2023 C LEU A 129 -7.197 -15.464 5.268 1.00 0.00 C ATOM 2024 O LEU A 129 -7.991 -15.937 4.455 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.739 -15.560 4.812 1.00 0.00 C ATOM 2026 CG LEU A 129 -3.691 -15.263 3.740 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -3.387 -13.774 3.687 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -2.421 -16.059 4.001 1.00 0.00 C ATOM 0 H LEU A 129 -4.793 -13.287 5.836 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.165 -14.324 3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -4.264 -15.475 5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -5.059 -16.596 4.702 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.094 -15.565 2.773 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.639 -13.583 2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.298 -13.225 3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.006 -13.446 4.654 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.686 -15.835 3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.016 -15.789 4.976 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.650 -17.125 3.986 1.00 0.00 H new ATOM 2040 N ALA A 130 -7.336 -15.605 6.582 1.00 0.00 N ATOM 2041 CA ALA A 130 -8.456 -16.340 7.157 1.00 0.00 C ATOM 2042 C ALA A 130 -9.767 -15.586 6.958 1.00 0.00 C ATOM 2043 O ALA A 130 -10.658 -16.049 6.246 1.00 0.00 O ATOM 2044 CB ALA A 130 -8.213 -16.599 8.637 1.00 0.00 C ATOM 0 H ALA A 130 -6.687 -15.220 7.268 1.00 0.00 H new ATOM 0 HA ALA A 130 -8.535 -17.296 6.640 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -9.057 -17.149 9.054 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -7.302 -17.185 8.759 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -8.105 -15.649 9.160 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.878 -14.424 7.592 1.00 0.00 N ATOM 2051 CA PHE A 131 -11.081 -13.607 7.486 1.00 0.00 C ATOM 2052 C PHE A 131 -11.656 -13.667 6.074 1.00 0.00 C ATOM 2053 O PHE A 131 -12.856 -13.876 5.888 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.773 -12.156 7.861 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.894 -11.206 7.553 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -13.070 -11.240 8.285 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.773 -10.278 6.531 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -14.104 -10.367 8.005 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.804 -9.402 6.246 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.971 -9.448 6.983 1.00 0.00 C ATOM 0 H PHE A 131 -9.149 -14.027 8.185 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.822 -14.005 8.179 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -10.546 -12.105 8.926 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.878 -11.834 7.329 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -13.180 -11.958 9.084 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.863 -10.239 5.951 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -15.015 -10.403 8.585 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.697 -8.682 5.448 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.778 -8.766 6.760 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.793 -13.483 5.081 1.00 0.00 N ATOM 2071 CA LEU A 132 -11.214 -13.516 3.685 1.00 0.00 C ATOM 2072 C LEU A 132 -11.928 -14.825 3.362 1.00 0.00 C ATOM 2073 O LEU A 132 -13.008 -14.825 2.771 1.00 0.00 O ATOM 2074 CB LEU A 132 -10.006 -13.340 2.763 1.00 0.00 C ATOM 2075 CG LEU A 132 -9.157 -12.091 3.001 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.831 -12.198 2.263 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.911 -10.842 2.567 1.00 0.00 C ATOM 0 H LEU A 132 -9.797 -13.309 5.217 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.911 -12.694 3.522 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -9.365 -14.216 2.866 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -10.360 -13.323 1.732 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.951 -12.014 4.069 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.240 -11.300 2.444 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.284 -13.070 2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -8.017 -12.300 1.194 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -9.291 -9.963 2.744 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -10.149 -10.911 1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.834 -10.756 3.141 1.00 0.00 H new ATOM 2089 N SER A 133 -11.318 -15.938 3.756 1.00 0.00 N ATOM 2090 CA SER A 133 -11.895 -17.254 3.507 1.00 0.00 C ATOM 2091 C SER A 133 -13.296 -17.355 4.102 1.00 0.00 C ATOM 2092 O SER A 133 -14.197 -17.945 3.504 1.00 0.00 O ATOM 2093 CB SER A 133 -10.999 -18.346 4.096 1.00 0.00 C ATOM 2094 OG SER A 133 -11.127 -19.557 3.370 1.00 0.00 O ATOM 0 H SER A 133 -10.425 -15.955 4.249 1.00 0.00 H new ATOM 0 HA SER A 133 -11.967 -17.394 2.428 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.960 -18.017 4.080 1.00 0.00 H new ATOM 0 HB3 SER A 133 -11.264 -18.514 5.140 1.00 0.00 H new ATOM 0 HG SER A 133 -10.543 -20.238 3.765 1.00 0.00 H new ATOM 2100 N LEU A 134 -13.473 -16.774 5.284 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.765 -16.797 5.962 1.00 0.00 C ATOM 2102 C LEU A 134 -15.847 -16.166 5.093 1.00 0.00 C ATOM 2103 O LEU A 134 -16.967 -16.671 5.017 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.674 -16.060 7.299 1.00 0.00 C ATOM 2105 CG LEU A 134 -13.570 -16.526 8.249 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.525 -15.644 9.488 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -13.779 -17.982 8.637 1.00 0.00 C ATOM 0 H LEU A 134 -12.739 -16.282 5.792 1.00 0.00 H new ATOM 0 HA LEU A 134 -15.033 -17.837 6.145 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.528 -14.999 7.097 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -15.631 -16.158 7.811 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.614 -16.442 7.733 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.734 -15.990 10.153 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.327 -14.613 9.194 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.483 -15.696 10.006 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.984 -18.296 9.313 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -14.743 -18.091 9.134 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -13.760 -18.603 7.742 1.00 0.00 H new ATOM 2119 N GLN A 135 -15.504 -15.062 4.438 1.00 0.00 N ATOM 2120 CA GLN A 135 -16.447 -14.363 3.573 1.00 0.00 C ATOM 2121 C GLN A 135 -17.090 -15.326 2.579 1.00 0.00 C ATOM 2122 O GLN A 135 -18.315 -15.413 2.489 1.00 0.00 O ATOM 2123 CB GLN A 135 -15.742 -13.233 2.822 1.00 0.00 C ATOM 2124 CG GLN A 135 -15.064 -12.225 3.736 1.00 0.00 C ATOM 2125 CD GLN A 135 -15.997 -11.111 4.169 1.00 0.00 C ATOM 2126 OE1 GLN A 135 -17.217 -11.271 4.168 1.00 0.00 O ATOM 2127 NE2 GLN A 135 -15.425 -9.972 4.543 1.00 0.00 N ATOM 0 H GLN A 135 -14.580 -14.632 4.490 1.00 0.00 H new ATOM 0 HA GLN A 135 -17.231 -13.939 4.200 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.997 -13.663 2.152 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -16.469 -12.714 2.198 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.683 -12.739 4.619 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.204 -11.795 3.222 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -14.409 -9.883 4.528 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -16.002 -9.187 4.845 1.00 0.00 H new ATOM 2136 N ARG A 136 -16.256 -16.045 1.836 1.00 0.00 N ATOM 2137 CA ARG A 136 -16.744 -17.000 0.848 1.00 0.00 C ATOM 2138 C ARG A 136 -17.295 -18.251 1.526 1.00 0.00 C ATOM 2139 O ARG A 136 -16.975 -18.537 2.681 1.00 0.00 O ATOM 2140 CB ARG A 136 -15.622 -17.384 -0.119 1.00 0.00 C ATOM 2141 CG ARG A 136 -14.525 -18.219 0.522 1.00 0.00 C ATOM 2142 CD ARG A 136 -13.707 -18.960 -0.524 1.00 0.00 C ATOM 2143 NE ARG A 136 -14.461 -20.049 -1.139 1.00 0.00 N ATOM 2144 CZ ARG A 136 -13.984 -20.814 -2.115 1.00 0.00 C ATOM 2145 NH1 ARG A 136 -12.761 -20.610 -2.584 1.00 0.00 N ATOM 2146 NH2 ARG A 136 -14.731 -21.786 -2.623 1.00 0.00 N ATOM 0 H ARG A 136 -15.240 -15.985 1.899 1.00 0.00 H new ATOM 0 HA ARG A 136 -17.550 -16.525 0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -16.048 -17.939 -0.955 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -15.182 -16.476 -0.531 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.870 -17.574 1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -14.968 -18.935 1.214 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.386 -18.260 -1.296 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.805 -19.360 -0.062 1.00 0.00 H new ATOM 0 HE ARG A 136 -15.406 -20.232 -0.801 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -12.184 -19.864 -2.196 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -12.397 -21.199 -3.333 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -15.672 -21.946 -2.264 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -14.364 -22.373 -3.372 1.00 0.00 H new ATOM 2160 N THR A 137 -18.126 -18.994 0.802 1.00 0.00 N ATOM 2161 CA THR A 137 -18.723 -20.212 1.333 1.00 0.00 C ATOM 2162 C THR A 137 -18.292 -21.432 0.528 1.00 0.00 C ATOM 2163 O THR A 137 -18.232 -21.388 -0.701 1.00 0.00 O ATOM 2164 CB THR A 137 -20.262 -20.130 1.335 1.00 0.00 C ATOM 2165 OG1 THR A 137 -20.691 -19.012 2.120 1.00 0.00 O ATOM 2166 CG2 THR A 137 -20.872 -21.409 1.888 1.00 0.00 C ATOM 0 H THR A 137 -18.401 -18.773 -0.155 1.00 0.00 H new ATOM 0 HA THR A 137 -18.371 -20.314 2.359 1.00 0.00 H new ATOM 0 HB THR A 137 -20.599 -20.002 0.306 1.00 0.00 H new ATOM 0 HG1 THR A 137 -21.670 -18.965 2.115 1.00 0.00 H new ATOM 0 HG21 THR A 137 -21.959 -21.327 1.879 1.00 0.00 H new ATOM 0 HG22 THR A 137 -20.567 -22.254 1.271 1.00 0.00 H new ATOM 0 HG23 THR A 137 -20.528 -21.564 2.911 1.00 0.00 H new TER 2174 THR A 137