USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1180 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 105 MET CE :methyl 156:sc= -0.0726 (180deg=-0.673) USER MOD Set 1.2: B 7 THR OG1 : rot 70:sc= 1.03 USER MOD Set 2.1: A 103 HIS : no HD1:sc= -0.764 X(o=-2.1,f=-2.2) USER MOD Set 2.2: A 107 ASN : amide:sc= -1.31 X(o=-2.1,f=-2.5!) USER MOD Set 3.1: A 68 MET CE :methyl 177:sc= -0.118 (180deg=-0.0763) USER MOD Set 3.2: B 9 HIS : no HD1:sc= -0.0101 X(o=-0.13,f=-0.076) USER MOD Single : A 4 GLN : amide:sc= -0.088 K(o=-0.088,f=-2.9!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 80:sc=0.000582 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -12:sc= 1.07 USER MOD Single : A 24 THR OG1 : rot -69:sc= 0.983 USER MOD Single : A 25 THR OG1 : rot -149:sc= 0.0186 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 66:sc= 1.22 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.209 X(o=-0.21,f=0) USER MOD Single : A 38 ASN : amide:sc= -0.0137 X(o=-0.014,f=-0.18) USER MOD Single : A 40 THR OG1 : rot -47:sc= 0.71 USER MOD Single : A 45 GLN : amide:sc= -0.0874 K(o=-0.087,f=-2.3!) USER MOD Single : A 47 MET CE :methyl -164:sc= -1.25 (180deg=-1.44) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= 0.347 K(o=0.35,f=-3.4!) USER MOD Single : A 58 THR OG1 : rot -130:sc= -0.088 USER MOD Single : A 66 THR OG1 : rot 89:sc= 1.35 USER MOD Single : A 67 MET CE :methyl 162:sc= -0.0168 (180deg=-0.303) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -160:sc= 0.507 (180deg=0.0479) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.215 K(o=0.22,f=-3.9!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -65:sc= 0.282 USER MOD Single : A 106 THR OG1 : rot 89:sc= 1.21 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot -63:sc= 0.674 USER MOD Single : A 120 MET CE :methyl 156:sc= -1.48 (180deg=-3.46!) USER MOD Single : A 131 GLN : amide:sc= 0.218 X(o=0.22,f=0) USER MOD Single : A 133 ASN : amide:sc= 0.222 K(o=0.22,f=-7.2!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.375 K(o=-0.37,f=-1.2) USER MOD Single : A 140 MET CE :methyl -146:sc= -0.246 (180deg=-2.39) USER MOD Single : A 141 MET CE :methyl -140:sc= -0.0405 (180deg=-0.18) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 ARG N :NH3+ -152:sc= 1.31 (180deg=0.366) USER MOD Single : B 3 LYS NZ :NH3+ -138:sc= 0.812 (180deg=-0.0357) USER MOD Single : B 5 GLN : amide:sc= -0.523 X(o=-0.52,f=-0.056) USER MOD Single : B 6 LYS NZ :NH3+ -176:sc= 2.18 (180deg=1.77) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 2.336 0.197 17.832 1.00 0.00 N ATOM 30 CA GLU A 3 1.273 -0.644 17.376 1.00 0.00 C ATOM 31 C GLU A 3 1.253 -0.681 15.887 1.00 0.00 C ATOM 32 O GLU A 3 0.988 -1.689 15.234 1.00 0.00 O ATOM 33 CB GLU A 3 0.031 0.153 17.810 1.00 0.00 C ATOM 34 CG GLU A 3 -0.091 0.379 19.318 1.00 0.00 C ATOM 35 CD GLU A 3 0.313 1.787 19.731 1.00 0.00 C ATOM 36 OE1 GLU A 3 1.430 2.251 19.382 1.00 0.00 O ATOM 37 OE2 GLU A 3 -0.482 2.486 20.416 1.00 0.00 O ATOM 0 HA GLU A 3 1.346 -1.664 17.752 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.046 1.122 17.312 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.859 -0.371 17.462 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.120 0.194 19.628 1.00 0.00 H new ATOM 0 HG3 GLU A 3 0.535 -0.343 19.842 1.00 0.00 H new ATOM 44 N GLN A 4 1.606 0.492 15.331 1.00 0.00 N ATOM 45 CA GLN A 4 1.820 0.823 13.956 1.00 0.00 C ATOM 46 C GLN A 4 2.982 0.019 13.485 1.00 0.00 C ATOM 47 O GLN A 4 2.809 -0.813 12.596 1.00 0.00 O ATOM 48 CB GLN A 4 2.079 2.329 13.780 1.00 0.00 C ATOM 49 CG GLN A 4 0.822 3.191 13.909 1.00 0.00 C ATOM 50 CD GLN A 4 0.328 3.297 15.344 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.125 3.265 16.280 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.995 3.378 15.652 1.00 0.00 N ATOM 0 H GLN A 4 1.759 1.308 15.924 1.00 0.00 H new ATOM 0 HA GLN A 4 0.933 0.592 13.367 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.808 2.652 14.523 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.526 2.499 12.801 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.031 4.190 13.526 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.032 2.770 13.287 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.691 3.407 14.907 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -1.290 3.410 16.628 1.00 0.00 H new ATOM 61 N ILE A 5 4.204 0.110 14.039 1.00 0.00 N ATOM 62 CA ILE A 5 5.356 -0.687 13.750 1.00 0.00 C ATOM 63 C ILE A 5 5.008 -2.135 13.695 1.00 0.00 C ATOM 64 O ILE A 5 5.391 -2.794 12.729 1.00 0.00 O ATOM 65 CB ILE A 5 6.404 -0.543 14.814 1.00 0.00 C ATOM 66 CG1 ILE A 5 7.080 0.838 14.786 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.501 -1.604 14.626 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.724 1.272 13.470 1.00 0.00 C ATOM 0 H ILE A 5 4.402 0.808 14.756 1.00 0.00 H new ATOM 0 HA ILE A 5 5.731 -0.337 12.788 1.00 0.00 H new ATOM 0 HB ILE A 5 5.893 -0.669 15.769 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.335 1.585 15.060 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.848 0.854 15.560 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.256 -1.489 15.404 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.060 -2.599 14.692 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.966 -1.477 13.648 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.163 2.263 13.589 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.503 0.561 13.194 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.966 1.303 12.687 1.00 0.00 H new ATOM 80 N ALA A 6 4.277 -2.691 14.678 1.00 0.00 N ATOM 81 CA ALA A 6 3.799 -4.033 14.793 1.00 0.00 C ATOM 82 C ALA A 6 2.911 -4.373 13.646 1.00 0.00 C ATOM 83 O ALA A 6 3.087 -5.454 13.086 1.00 0.00 O ATOM 84 CB ALA A 6 3.045 -4.353 16.095 1.00 0.00 C ATOM 0 H ALA A 6 3.991 -2.132 15.482 1.00 0.00 H new ATOM 0 HA ALA A 6 4.705 -4.639 14.798 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.725 -5.395 16.083 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.703 -4.185 16.947 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.172 -3.706 16.178 1.00 0.00 H new ATOM 90 N GLU A 7 1.925 -3.547 13.254 1.00 0.00 N ATOM 91 CA GLU A 7 0.992 -3.716 12.183 1.00 0.00 C ATOM 92 C GLU A 7 1.678 -3.771 10.862 1.00 0.00 C ATOM 93 O GLU A 7 1.332 -4.591 10.013 1.00 0.00 O ATOM 94 CB GLU A 7 -0.053 -2.589 12.153 1.00 0.00 C ATOM 95 CG GLU A 7 -1.406 -2.770 11.462 1.00 0.00 C ATOM 96 CD GLU A 7 -2.454 -2.023 12.274 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.864 -2.516 13.358 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.844 -0.914 11.820 1.00 0.00 O ATOM 0 H GLU A 7 1.767 -2.666 13.742 1.00 0.00 H new ATOM 0 HA GLU A 7 0.488 -4.665 12.367 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.260 -2.322 13.189 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.426 -1.726 11.691 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.368 -2.385 10.443 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.660 -3.828 11.393 1.00 0.00 H new ATOM 105 N PHE A 8 2.702 -2.922 10.661 1.00 0.00 N ATOM 106 CA PHE A 8 3.551 -2.908 9.511 1.00 0.00 C ATOM 107 C PHE A 8 4.375 -4.150 9.544 1.00 0.00 C ATOM 108 O PHE A 8 4.531 -4.822 8.526 1.00 0.00 O ATOM 109 CB PHE A 8 4.522 -1.716 9.503 1.00 0.00 C ATOM 110 CG PHE A 8 3.814 -0.444 9.185 1.00 0.00 C ATOM 111 CD1 PHE A 8 2.812 -0.357 8.248 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.282 0.692 9.803 1.00 0.00 C ATOM 113 CE1 PHE A 8 2.205 0.856 8.026 1.00 0.00 C ATOM 114 CE2 PHE A 8 3.699 1.905 9.519 1.00 0.00 C ATOM 115 CZ PHE A 8 2.671 2.010 8.612 1.00 0.00 C ATOM 0 H PHE A 8 2.951 -2.204 11.341 1.00 0.00 H new ATOM 0 HA PHE A 8 2.916 -2.835 8.628 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.006 -1.632 10.476 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.309 -1.890 8.769 1.00 0.00 H new ATOM 0 HD1 PHE A 8 2.505 -1.231 7.693 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.100 0.632 10.505 1.00 0.00 H new ATOM 0 HE1 PHE A 8 1.343 0.904 7.377 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.056 2.793 10.019 1.00 0.00 H new ATOM 0 HZ PHE A 8 2.242 2.970 8.367 1.00 0.00 H new ATOM 125 N LYS A 9 4.950 -4.625 10.663 1.00 0.00 N ATOM 126 CA LYS A 9 5.681 -5.842 10.831 1.00 0.00 C ATOM 127 C LYS A 9 4.865 -7.052 10.528 1.00 0.00 C ATOM 128 O LYS A 9 5.308 -8.124 10.119 1.00 0.00 O ATOM 129 CB LYS A 9 6.381 -5.990 12.192 1.00 0.00 C ATOM 130 CG LYS A 9 7.573 -5.046 12.366 1.00 0.00 C ATOM 131 CD LYS A 9 8.300 -5.226 13.700 1.00 0.00 C ATOM 132 CE LYS A 9 9.792 -4.886 13.725 1.00 0.00 C ATOM 133 NZ LYS A 9 10.375 -5.221 15.043 1.00 0.00 N ATOM 0 H LYS A 9 4.896 -4.102 11.537 1.00 0.00 H new ATOM 0 HA LYS A 9 6.475 -5.767 10.088 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.659 -5.802 12.986 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.722 -7.019 12.308 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.278 -5.209 11.551 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.226 -4.016 12.286 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.799 -4.609 14.446 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.183 -6.263 14.013 1.00 0.00 H new ATOM 0 HE2 LYS A 9 10.310 -5.437 12.940 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.933 -3.826 13.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.388 -4.985 15.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.891 -4.676 15.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.256 -6.238 15.227 1.00 0.00 H new ATOM 147 N GLU A 10 3.544 -7.017 10.782 1.00 0.00 N ATOM 148 CA GLU A 10 2.666 -8.109 10.495 1.00 0.00 C ATOM 149 C GLU A 10 2.236 -8.224 9.074 1.00 0.00 C ATOM 150 O GLU A 10 1.925 -9.280 8.525 1.00 0.00 O ATOM 151 CB GLU A 10 1.371 -7.931 11.304 1.00 0.00 C ATOM 152 CG GLU A 10 0.373 -9.087 11.209 1.00 0.00 C ATOM 153 CD GLU A 10 -0.757 -9.172 12.226 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.372 -9.312 13.418 1.00 0.00 O ATOM 155 OE2 GLU A 10 -1.965 -9.368 11.926 1.00 0.00 O ATOM 0 H GLU A 10 3.076 -6.211 11.196 1.00 0.00 H new ATOM 0 HA GLU A 10 3.241 -9.000 10.748 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.634 -7.786 12.352 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.877 -7.019 10.970 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.079 -9.051 10.218 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.939 -10.016 11.268 1.00 0.00 H new ATOM 162 N ALA A 11 2.310 -7.084 8.363 1.00 0.00 N ATOM 163 CA ALA A 11 2.252 -6.968 6.939 1.00 0.00 C ATOM 164 C ALA A 11 3.540 -7.275 6.255 1.00 0.00 C ATOM 165 O ALA A 11 3.447 -7.922 5.213 1.00 0.00 O ATOM 166 CB ALA A 11 1.844 -5.517 6.634 1.00 0.00 C ATOM 0 H ALA A 11 2.418 -6.178 8.819 1.00 0.00 H new ATOM 0 HA ALA A 11 1.539 -7.700 6.561 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.785 -5.375 5.555 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.871 -5.311 7.081 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.586 -4.835 7.050 1.00 0.00 H new ATOM 172 N PHE A 12 4.687 -6.896 6.845 1.00 0.00 N ATOM 173 CA PHE A 12 5.954 -7.435 6.459 1.00 0.00 C ATOM 174 C PHE A 12 6.012 -8.916 6.310 1.00 0.00 C ATOM 175 O PHE A 12 6.389 -9.448 5.267 1.00 0.00 O ATOM 176 CB PHE A 12 7.019 -6.814 7.378 1.00 0.00 C ATOM 177 CG PHE A 12 8.474 -6.827 7.055 1.00 0.00 C ATOM 178 CD1 PHE A 12 8.904 -6.430 5.811 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.360 -7.042 8.084 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.260 -6.472 5.589 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.705 -7.025 7.795 1.00 0.00 C ATOM 182 CZ PHE A 12 11.208 -6.744 6.547 1.00 0.00 C ATOM 0 H PHE A 12 4.737 -6.209 7.597 1.00 0.00 H new ATOM 0 HA PHE A 12 6.162 -7.148 5.428 1.00 0.00 H new ATOM 0 HB2 PHE A 12 6.741 -5.769 7.513 1.00 0.00 H new ATOM 0 HB3 PHE A 12 6.913 -7.300 8.348 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.213 -6.102 5.048 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.010 -7.219 9.090 1.00 0.00 H new ATOM 0 HE1 PHE A 12 10.607 -6.276 4.585 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.402 -7.244 8.590 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.267 -6.737 6.335 1.00 0.00 H new ATOM 192 N SER A 13 5.604 -9.653 7.359 1.00 0.00 N ATOM 193 CA SER A 13 5.634 -11.080 7.448 1.00 0.00 C ATOM 194 C SER A 13 4.893 -11.902 6.451 1.00 0.00 C ATOM 195 O SER A 13 5.016 -13.119 6.315 1.00 0.00 O ATOM 196 CB SER A 13 5.275 -11.568 8.861 1.00 0.00 C ATOM 197 OG SER A 13 6.319 -11.262 9.774 1.00 0.00 O ATOM 0 H SER A 13 5.227 -9.221 8.203 1.00 0.00 H new ATOM 0 HA SER A 13 6.677 -11.258 7.188 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.348 -11.099 9.189 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.100 -12.644 8.847 1.00 0.00 H new ATOM 0 HG SER A 13 6.256 -10.321 10.039 1.00 0.00 H new ATOM 203 N LEU A 14 4.019 -11.237 5.674 1.00 0.00 N ATOM 204 CA LEU A 14 3.367 -11.825 4.546 1.00 0.00 C ATOM 205 C LEU A 14 4.320 -12.233 3.475 1.00 0.00 C ATOM 206 O LEU A 14 4.139 -13.261 2.825 1.00 0.00 O ATOM 207 CB LEU A 14 2.352 -10.783 4.047 1.00 0.00 C ATOM 208 CG LEU A 14 1.318 -10.349 5.099 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.440 -9.308 4.384 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.379 -11.488 5.530 1.00 0.00 C ATOM 0 H LEU A 14 3.759 -10.264 5.835 1.00 0.00 H new ATOM 0 HA LEU A 14 2.872 -12.752 4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.894 -9.902 3.703 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.825 -11.191 3.184 1.00 0.00 H new ATOM 0 HG LEU A 14 1.839 -9.995 5.988 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.327 -8.947 5.069 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.059 -8.472 4.058 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.035 -9.767 3.517 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.326 -11.116 6.273 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.169 -11.856 4.662 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.965 -12.300 5.960 1.00 0.00 H new ATOM 222 N PHE A 15 5.380 -11.411 3.367 1.00 0.00 N ATOM 223 CA PHE A 15 6.270 -11.489 2.251 1.00 0.00 C ATOM 224 C PHE A 15 7.398 -12.409 2.569 1.00 0.00 C ATOM 225 O PHE A 15 7.694 -13.189 1.665 1.00 0.00 O ATOM 226 CB PHE A 15 6.799 -10.075 1.960 1.00 0.00 C ATOM 227 CG PHE A 15 5.737 -9.208 1.376 1.00 0.00 C ATOM 228 CD1 PHE A 15 4.994 -8.357 2.160 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.702 -9.087 0.007 1.00 0.00 C ATOM 230 CE1 PHE A 15 4.136 -7.436 1.607 1.00 0.00 C ATOM 231 CE2 PHE A 15 4.825 -8.189 -0.554 1.00 0.00 C ATOM 232 CZ PHE A 15 4.023 -7.400 0.237 1.00 0.00 C ATOM 0 H PHE A 15 5.620 -10.694 4.051 1.00 0.00 H new ATOM 0 HA PHE A 15 5.749 -11.877 1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.171 -9.627 2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.642 -10.135 1.272 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.087 -8.413 3.235 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.351 -9.686 -0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 15 3.568 -6.761 2.230 1.00 0.00 H new ATOM 0 HE2 PHE A 15 4.765 -8.102 -1.629 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.297 -6.746 -0.222 1.00 0.00 H new ATOM 242 N ASP A 16 8.085 -12.305 3.720 1.00 0.00 N ATOM 243 CA ASP A 16 9.089 -13.161 4.272 1.00 0.00 C ATOM 244 C ASP A 16 8.560 -14.551 4.357 1.00 0.00 C ATOM 245 O ASP A 16 7.561 -14.818 5.023 1.00 0.00 O ATOM 246 CB ASP A 16 9.553 -12.691 5.661 1.00 0.00 C ATOM 247 CG ASP A 16 10.891 -13.249 6.124 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.025 -14.501 6.168 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.866 -12.458 6.225 1.00 0.00 O ATOM 0 H ASP A 16 7.910 -11.515 4.342 1.00 0.00 H new ATOM 0 HA ASP A 16 9.956 -13.128 3.613 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.614 -11.603 5.656 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.792 -12.964 6.392 1.00 0.00 H new ATOM 254 N LYS A 17 9.285 -15.554 3.830 1.00 0.00 N ATOM 255 CA LYS A 17 8.910 -16.929 3.708 1.00 0.00 C ATOM 256 C LYS A 17 8.792 -17.593 5.036 1.00 0.00 C ATOM 257 O LYS A 17 7.940 -18.464 5.206 1.00 0.00 O ATOM 258 CB LYS A 17 9.747 -17.669 2.651 1.00 0.00 C ATOM 259 CG LYS A 17 9.166 -19.079 2.524 1.00 0.00 C ATOM 260 CD LYS A 17 10.057 -19.969 1.655 1.00 0.00 C ATOM 261 CE LYS A 17 9.532 -21.404 1.724 1.00 0.00 C ATOM 262 NZ LYS A 17 10.425 -22.344 1.009 1.00 0.00 N ATOM 0 H LYS A 17 10.219 -15.385 3.456 1.00 0.00 H new ATOM 0 HA LYS A 17 7.898 -16.977 3.305 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.707 -17.148 1.694 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.795 -17.709 2.948 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.060 -19.522 3.514 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.167 -19.026 2.090 1.00 0.00 H new ATOM 0 HD2 LYS A 17 10.055 -19.615 0.624 1.00 0.00 H new ATOM 0 HD3 LYS A 17 11.089 -19.927 2.004 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.441 -21.709 2.766 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.533 -21.448 1.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 10.040 -23.308 1.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 10.492 -22.066 0.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 11.371 -22.319 1.440 1.00 0.00 H new ATOM 276 N ASP A 18 9.648 -17.162 5.979 1.00 0.00 N ATOM 277 CA ASP A 18 9.753 -17.779 7.266 1.00 0.00 C ATOM 278 C ASP A 18 9.262 -16.878 8.346 1.00 0.00 C ATOM 279 O ASP A 18 8.565 -17.329 9.255 1.00 0.00 O ATOM 280 CB ASP A 18 11.243 -17.935 7.615 1.00 0.00 C ATOM 281 CG ASP A 18 11.775 -19.210 6.977 1.00 0.00 C ATOM 282 OD1 ASP A 18 11.243 -20.349 7.071 1.00 0.00 O ATOM 283 OD2 ASP A 18 12.729 -18.993 6.183 1.00 0.00 O ATOM 0 H ASP A 18 10.279 -16.371 5.846 1.00 0.00 H new ATOM 0 HA ASP A 18 9.189 -18.710 7.214 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.805 -17.073 7.256 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.374 -17.973 8.696 1.00 0.00 H new ATOM 288 N GLY A 19 9.655 -15.593 8.295 1.00 0.00 N ATOM 289 CA GLY A 19 9.290 -14.503 9.145 1.00 0.00 C ATOM 290 C GLY A 19 10.481 -14.272 10.010 1.00 0.00 C ATOM 291 O GLY A 19 10.337 -14.106 11.220 1.00 0.00 O ATOM 0 H GLY A 19 10.305 -15.286 7.571 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.046 -13.614 8.564 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.410 -14.745 9.741 1.00 0.00 H new ATOM 295 N ASP A 20 11.666 -14.064 9.409 1.00 0.00 N ATOM 296 CA ASP A 20 12.827 -13.631 10.122 1.00 0.00 C ATOM 297 C ASP A 20 12.885 -12.142 10.095 1.00 0.00 C ATOM 298 O ASP A 20 13.127 -11.500 11.116 1.00 0.00 O ATOM 299 CB ASP A 20 14.023 -14.395 9.530 1.00 0.00 C ATOM 300 CG ASP A 20 14.117 -14.397 8.011 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.395 -13.310 7.436 1.00 0.00 O ATOM 302 OD2 ASP A 20 13.695 -15.408 7.389 1.00 0.00 O ATOM 0 H ASP A 20 11.821 -14.199 8.410 1.00 0.00 H new ATOM 0 HA ASP A 20 12.822 -13.866 11.186 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.940 -13.965 9.932 1.00 0.00 H new ATOM 0 HB3 ASP A 20 13.977 -15.428 9.874 1.00 0.00 H new ATOM 307 N GLY A 21 12.592 -11.538 8.930 1.00 0.00 N ATOM 308 CA GLY A 21 12.447 -10.138 8.680 1.00 0.00 C ATOM 309 C GLY A 21 13.612 -9.611 7.915 1.00 0.00 C ATOM 310 O GLY A 21 13.872 -8.412 7.837 1.00 0.00 O ATOM 0 H GLY A 21 12.443 -12.085 8.082 1.00 0.00 H new ATOM 0 HA2 GLY A 21 11.528 -9.957 8.122 1.00 0.00 H new ATOM 0 HA3 GLY A 21 12.356 -9.603 9.625 1.00 0.00 H new ATOM 314 N THR A 22 14.380 -10.494 7.252 1.00 0.00 N ATOM 315 CA THR A 22 15.337 -10.269 6.214 1.00 0.00 C ATOM 316 C THR A 22 14.849 -10.858 4.935 1.00 0.00 C ATOM 317 O THR A 22 14.819 -12.084 4.837 1.00 0.00 O ATOM 318 CB THR A 22 16.735 -10.754 6.460 1.00 0.00 C ATOM 319 OG1 THR A 22 16.856 -12.125 6.810 1.00 0.00 O ATOM 320 CG2 THR A 22 17.193 -10.043 7.745 1.00 0.00 C ATOM 0 H THR A 22 14.319 -11.487 7.475 1.00 0.00 H new ATOM 0 HA THR A 22 15.417 -9.183 6.175 1.00 0.00 H new ATOM 0 HB THR A 22 17.287 -10.573 5.538 1.00 0.00 H new ATOM 0 HG1 THR A 22 15.970 -12.488 7.020 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.210 -10.350 7.988 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.166 -8.964 7.593 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.528 -10.311 8.566 1.00 0.00 H new ATOM 328 N ILE A 23 14.259 -10.092 4.000 1.00 0.00 N ATOM 329 CA ILE A 23 13.568 -10.583 2.849 1.00 0.00 C ATOM 330 C ILE A 23 14.540 -10.545 1.720 1.00 0.00 C ATOM 331 O ILE A 23 14.918 -9.536 1.126 1.00 0.00 O ATOM 332 CB ILE A 23 12.328 -9.777 2.598 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.341 -9.978 3.760 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.619 -10.272 1.326 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.129 -9.062 3.595 1.00 0.00 C ATOM 0 H ILE A 23 14.265 -9.073 4.051 1.00 0.00 H new ATOM 0 HA ILE A 23 13.219 -11.607 2.984 1.00 0.00 H new ATOM 0 HB ILE A 23 12.620 -8.732 2.497 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.017 -11.018 3.794 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.837 -9.768 4.707 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.721 -9.678 1.156 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.289 -10.169 0.473 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.344 -11.320 1.447 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.440 -9.217 4.426 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.457 -8.023 3.585 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.624 -9.292 2.657 1.00 0.00 H new ATOM 347 N THR A 24 14.898 -11.758 1.262 1.00 0.00 N ATOM 348 CA THR A 24 15.793 -11.963 0.166 1.00 0.00 C ATOM 349 C THR A 24 15.065 -11.904 -1.133 1.00 0.00 C ATOM 350 O THR A 24 13.841 -12.007 -1.201 1.00 0.00 O ATOM 351 CB THR A 24 16.393 -13.337 0.228 1.00 0.00 C ATOM 352 OG1 THR A 24 15.435 -14.382 0.310 1.00 0.00 O ATOM 353 CG2 THR A 24 17.207 -13.628 1.499 1.00 0.00 C ATOM 0 H THR A 24 14.552 -12.627 1.669 1.00 0.00 H new ATOM 0 HA THR A 24 16.553 -11.184 0.234 1.00 0.00 H new ATOM 0 HB THR A 24 16.985 -13.327 -0.687 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.987 -14.347 1.181 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.601 -14.643 1.454 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.033 -12.921 1.572 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.565 -13.526 2.374 1.00 0.00 H new ATOM 361 N THR A 25 15.784 -11.816 -2.266 1.00 0.00 N ATOM 362 CA THR A 25 15.235 -11.860 -3.586 1.00 0.00 C ATOM 363 C THR A 25 14.372 -13.037 -3.888 1.00 0.00 C ATOM 364 O THR A 25 13.353 -12.893 -4.560 1.00 0.00 O ATOM 365 CB THR A 25 16.105 -11.738 -4.802 1.00 0.00 C ATOM 366 OG1 THR A 25 17.183 -12.662 -4.820 1.00 0.00 O ATOM 367 CG2 THR A 25 16.642 -10.302 -4.681 1.00 0.00 C ATOM 0 H THR A 25 16.798 -11.709 -2.261 1.00 0.00 H new ATOM 0 HA THR A 25 14.700 -10.918 -3.460 1.00 0.00 H new ATOM 0 HB THR A 25 15.553 -11.949 -5.718 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.945 -12.267 -5.293 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.300 -10.088 -5.523 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.808 -9.600 -4.685 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.199 -10.199 -3.750 1.00 0.00 H new ATOM 375 N LYS A 26 14.756 -14.238 -3.419 1.00 0.00 N ATOM 376 CA LYS A 26 13.976 -15.414 -3.646 1.00 0.00 C ATOM 377 C LYS A 26 12.637 -15.319 -2.999 1.00 0.00 C ATOM 378 O LYS A 26 11.610 -15.743 -3.526 1.00 0.00 O ATOM 379 CB LYS A 26 14.695 -16.567 -2.925 1.00 0.00 C ATOM 380 CG LYS A 26 16.081 -16.886 -3.487 1.00 0.00 C ATOM 381 CD LYS A 26 16.686 -18.019 -2.655 1.00 0.00 C ATOM 382 CE LYS A 26 17.418 -17.716 -1.346 1.00 0.00 C ATOM 383 NZ LYS A 26 18.565 -16.793 -1.496 1.00 0.00 N ATOM 0 H LYS A 26 15.609 -14.394 -2.881 1.00 0.00 H new ATOM 0 HA LYS A 26 13.860 -15.553 -4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.792 -16.317 -1.869 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.075 -17.462 -2.985 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.008 -17.181 -4.534 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.719 -16.003 -3.448 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.878 -18.712 -2.419 1.00 0.00 H new ATOM 0 HD3 LYS A 26 17.385 -18.553 -3.299 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.710 -17.287 -0.637 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.773 -18.652 -0.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.009 -16.637 -0.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 19.262 -17.208 -2.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.232 -15.885 -1.878 1.00 0.00 H new ATOM 397 N GLU A 27 12.528 -14.561 -1.894 1.00 0.00 N ATOM 398 CA GLU A 27 11.278 -14.511 -1.200 1.00 0.00 C ATOM 399 C GLU A 27 10.408 -13.482 -1.835 1.00 0.00 C ATOM 400 O GLU A 27 9.189 -13.644 -1.876 1.00 0.00 O ATOM 401 CB GLU A 27 11.422 -14.033 0.255 1.00 0.00 C ATOM 402 CG GLU A 27 12.095 -15.115 1.101 1.00 0.00 C ATOM 403 CD GLU A 27 12.632 -14.589 2.425 1.00 0.00 C ATOM 404 OE1 GLU A 27 11.935 -14.515 3.472 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.823 -14.186 2.514 1.00 0.00 O ATOM 0 H GLU A 27 13.278 -13.999 -1.490 1.00 0.00 H new ATOM 0 HA GLU A 27 10.876 -15.524 -1.236 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.011 -13.116 0.288 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.441 -13.797 0.667 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.378 -15.913 1.297 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.914 -15.555 0.533 1.00 0.00 H new ATOM 412 N LEU A 28 10.933 -12.353 -2.343 1.00 0.00 N ATOM 413 CA LEU A 28 10.157 -11.466 -3.153 1.00 0.00 C ATOM 414 C LEU A 28 9.551 -12.021 -4.396 1.00 0.00 C ATOM 415 O LEU A 28 8.362 -11.865 -4.670 1.00 0.00 O ATOM 416 CB LEU A 28 11.023 -10.299 -3.657 1.00 0.00 C ATOM 417 CG LEU A 28 11.620 -9.325 -2.628 1.00 0.00 C ATOM 418 CD1 LEU A 28 12.553 -8.334 -3.345 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.543 -8.524 -1.876 1.00 0.00 C ATOM 0 H LEU A 28 11.896 -12.054 -2.193 1.00 0.00 H new ATOM 0 HA LEU A 28 9.353 -11.197 -2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.849 -10.723 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.420 -9.716 -4.353 1.00 0.00 H new ATOM 0 HG LEU A 28 12.164 -9.925 -1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.977 -7.642 -2.617 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.357 -8.882 -3.837 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.987 -7.775 -4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.021 -7.853 -1.163 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.959 -7.941 -2.588 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.885 -9.210 -1.343 1.00 0.00 H new ATOM 431 N GLY A 29 10.357 -12.776 -5.164 1.00 0.00 N ATOM 432 CA GLY A 29 9.999 -13.373 -6.414 1.00 0.00 C ATOM 433 C GLY A 29 9.018 -14.476 -6.213 1.00 0.00 C ATOM 434 O GLY A 29 8.229 -14.772 -7.109 1.00 0.00 O ATOM 0 H GLY A 29 11.319 -12.982 -4.895 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.573 -12.617 -7.074 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.891 -13.759 -6.906 1.00 0.00 H new ATOM 438 N THR A 30 9.140 -15.141 -5.051 1.00 0.00 N ATOM 439 CA THR A 30 8.174 -16.081 -4.571 1.00 0.00 C ATOM 440 C THR A 30 6.789 -15.550 -4.438 1.00 0.00 C ATOM 441 O THR A 30 5.815 -16.194 -4.827 1.00 0.00 O ATOM 442 CB THR A 30 8.664 -16.878 -3.398 1.00 0.00 C ATOM 443 OG1 THR A 30 9.803 -17.657 -3.734 1.00 0.00 O ATOM 444 CG2 THR A 30 7.685 -17.974 -2.945 1.00 0.00 C ATOM 0 H THR A 30 9.936 -15.021 -4.425 1.00 0.00 H new ATOM 0 HA THR A 30 8.066 -16.807 -5.377 1.00 0.00 H new ATOM 0 HB THR A 30 8.833 -16.113 -2.640 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.554 -17.064 -3.945 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.106 -18.509 -2.093 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.738 -17.519 -2.656 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.516 -18.673 -3.765 1.00 0.00 H new ATOM 452 N VAL A 31 6.650 -14.401 -3.754 1.00 0.00 N ATOM 453 CA VAL A 31 5.390 -13.745 -3.582 1.00 0.00 C ATOM 454 C VAL A 31 4.892 -13.279 -4.907 1.00 0.00 C ATOM 455 O VAL A 31 3.801 -13.680 -5.308 1.00 0.00 O ATOM 456 CB VAL A 31 5.507 -12.594 -2.628 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.191 -11.802 -2.557 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.898 -13.158 -1.251 1.00 0.00 C ATOM 0 H VAL A 31 7.430 -13.916 -3.310 1.00 0.00 H new ATOM 0 HA VAL A 31 4.679 -14.453 -3.157 1.00 0.00 H new ATOM 0 HB VAL A 31 6.272 -11.897 -2.971 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.303 -10.973 -1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.947 -11.413 -3.546 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.390 -12.458 -2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.990 -12.341 -0.536 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.130 -13.853 -0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.851 -13.681 -1.329 1.00 0.00 H new ATOM 468 N MET A 32 5.680 -12.448 -5.613 1.00 0.00 N ATOM 469 CA MET A 32 5.354 -11.886 -6.887 1.00 0.00 C ATOM 470 C MET A 32 4.782 -12.825 -7.892 1.00 0.00 C ATOM 471 O MET A 32 3.733 -12.675 -8.517 1.00 0.00 O ATOM 472 CB MET A 32 6.518 -11.009 -7.378 1.00 0.00 C ATOM 473 CG MET A 32 6.644 -9.666 -6.655 1.00 0.00 C ATOM 474 SD MET A 32 8.346 -9.039 -6.538 1.00 0.00 S ATOM 475 CE MET A 32 8.073 -7.734 -5.305 1.00 0.00 C ATOM 0 H MET A 32 6.596 -12.152 -5.275 1.00 0.00 H new ATOM 0 HA MET A 32 4.492 -11.236 -6.739 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.450 -11.562 -7.258 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.393 -10.824 -8.445 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.032 -8.928 -7.174 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.236 -9.768 -5.649 1.00 0.00 H new ATOM 0 HE1 MET A 32 9.015 -7.227 -5.097 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.351 -7.015 -5.691 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.689 -8.176 -4.386 1.00 0.00 H new ATOM 485 N ARG A 33 5.488 -13.961 -8.041 1.00 0.00 N ATOM 486 CA ARG A 33 4.987 -15.043 -8.830 1.00 0.00 C ATOM 487 C ARG A 33 3.791 -15.797 -8.358 1.00 0.00 C ATOM 488 O ARG A 33 2.985 -16.226 -9.183 1.00 0.00 O ATOM 489 CB ARG A 33 6.088 -16.078 -9.113 1.00 0.00 C ATOM 490 CG ARG A 33 7.125 -15.630 -10.145 1.00 0.00 C ATOM 491 CD ARG A 33 8.139 -16.599 -10.757 1.00 0.00 C ATOM 492 NE ARG A 33 8.968 -16.977 -9.579 1.00 0.00 N ATOM 493 CZ ARG A 33 10.279 -16.652 -9.377 1.00 0.00 C ATOM 494 NH1 ARG A 33 11.024 -15.946 -10.277 1.00 0.00 N ATOM 495 NH2 ARG A 33 10.866 -17.066 -8.217 1.00 0.00 N ATOM 0 H ARG A 33 6.401 -14.129 -7.618 1.00 0.00 H new ATOM 0 HA ARG A 33 4.647 -14.499 -9.711 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.600 -16.311 -8.179 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.622 -17.000 -9.460 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.571 -15.191 -10.975 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.699 -14.826 -9.684 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.653 -17.465 -11.207 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.734 -16.125 -11.538 1.00 0.00 H new ATOM 0 HE ARG A 33 8.513 -17.532 -8.854 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.604 -15.633 -11.153 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.000 -15.731 -10.074 1.00 0.00 H new ATOM 0 HH21 ARG A 33 10.327 -17.600 -7.535 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.844 -16.842 -8.032 1.00 0.00 H new ATOM 509 N SER A 34 3.460 -15.801 -7.054 1.00 0.00 N ATOM 510 CA SER A 34 2.239 -16.254 -6.465 1.00 0.00 C ATOM 511 C SER A 34 1.083 -15.363 -6.766 1.00 0.00 C ATOM 512 O SER A 34 -0.054 -15.807 -6.920 1.00 0.00 O ATOM 513 CB SER A 34 2.331 -16.430 -4.940 1.00 0.00 C ATOM 514 OG SER A 34 1.361 -17.336 -4.435 1.00 0.00 O ATOM 0 H SER A 34 4.110 -15.454 -6.349 1.00 0.00 H new ATOM 0 HA SER A 34 2.071 -17.228 -6.924 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.327 -16.787 -4.679 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.203 -15.461 -4.458 1.00 0.00 H new ATOM 0 HG SER A 34 1.461 -17.415 -3.463 1.00 0.00 H new ATOM 520 N LEU A 35 1.351 -14.053 -6.904 1.00 0.00 N ATOM 521 CA LEU A 35 0.326 -13.089 -7.162 1.00 0.00 C ATOM 522 C LEU A 35 -0.095 -13.171 -8.589 1.00 0.00 C ATOM 523 O LEU A 35 -1.275 -13.211 -8.934 1.00 0.00 O ATOM 524 CB LEU A 35 0.823 -11.660 -6.887 1.00 0.00 C ATOM 525 CG LEU A 35 1.062 -11.484 -5.378 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.648 -10.067 -5.260 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.186 -11.693 -4.503 1.00 0.00 C ATOM 0 H LEU A 35 2.289 -13.657 -6.836 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.511 -13.311 -6.500 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.745 -11.472 -7.437 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.089 -10.934 -7.237 1.00 0.00 H new ATOM 0 HG LEU A 35 1.733 -12.253 -4.994 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.854 -9.845 -4.213 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.573 -10.007 -5.833 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.932 -9.344 -5.650 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.076 -11.549 -3.455 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.954 -10.974 -4.787 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.566 -12.705 -4.646 1.00 0.00 H new ATOM 539 N GLY A 36 0.877 -13.061 -9.512 1.00 0.00 N ATOM 540 CA GLY A 36 0.678 -13.117 -10.927 1.00 0.00 C ATOM 541 C GLY A 36 1.745 -12.420 -11.698 1.00 0.00 C ATOM 542 O GLY A 36 1.736 -12.621 -12.912 1.00 0.00 O ATOM 0 H GLY A 36 1.855 -12.926 -9.256 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.635 -14.160 -11.240 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.287 -12.671 -11.170 1.00 0.00 H new ATOM 546 N GLN A 37 2.715 -11.770 -11.032 1.00 0.00 N ATOM 547 CA GLN A 37 3.665 -10.943 -11.709 1.00 0.00 C ATOM 548 C GLN A 37 4.880 -11.633 -12.226 1.00 0.00 C ATOM 549 O GLN A 37 5.262 -12.722 -11.800 1.00 0.00 O ATOM 550 CB GLN A 37 4.091 -9.959 -10.607 1.00 0.00 C ATOM 551 CG GLN A 37 2.969 -9.173 -9.925 1.00 0.00 C ATOM 552 CD GLN A 37 2.159 -8.371 -10.934 1.00 0.00 C ATOM 553 OE1 GLN A 37 0.937 -8.249 -11.002 1.00 0.00 O ATOM 554 NE2 GLN A 37 2.860 -7.610 -11.816 1.00 0.00 N ATOM 0 H GLN A 37 2.842 -11.817 -10.021 1.00 0.00 H new ATOM 0 HA GLN A 37 3.211 -10.517 -12.604 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.632 -10.516 -9.842 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.794 -9.246 -11.039 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.312 -9.861 -9.394 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.395 -8.500 -9.181 1.00 0.00 H new ATOM 0 HE21 GLN A 37 3.879 -7.651 -11.827 1.00 0.00 H new ATOM 0 HE22 GLN A 37 2.367 -6.999 -12.467 1.00 0.00 H new ATOM 563 N ASN A 38 5.606 -11.002 -13.166 1.00 0.00 N ATOM 564 CA ASN A 38 6.826 -11.523 -13.700 1.00 0.00 C ATOM 565 C ASN A 38 7.995 -10.656 -13.381 1.00 0.00 C ATOM 566 O ASN A 38 8.494 -9.902 -14.216 1.00 0.00 O ATOM 567 CB ASN A 38 6.623 -11.652 -15.219 1.00 0.00 C ATOM 568 CG ASN A 38 7.819 -12.442 -15.731 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.244 -13.495 -15.257 1.00 0.00 O ATOM 570 ND2 ASN A 38 8.526 -11.912 -16.764 1.00 0.00 N ATOM 0 H ASN A 38 5.337 -10.103 -13.566 1.00 0.00 H new ATOM 0 HA ASN A 38 7.051 -12.490 -13.251 1.00 0.00 H new ATOM 0 HB2 ASN A 38 5.689 -12.165 -15.447 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.571 -10.671 -15.691 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.362 -12.386 -17.106 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.221 -11.040 -17.197 1.00 0.00 H new ATOM 577 N PRO A 39 8.571 -10.590 -12.218 1.00 0.00 N ATOM 578 CA PRO A 39 9.758 -9.792 -12.113 1.00 0.00 C ATOM 579 C PRO A 39 10.966 -10.535 -12.570 1.00 0.00 C ATOM 580 O PRO A 39 10.791 -11.688 -12.960 1.00 0.00 O ATOM 581 CB PRO A 39 9.909 -9.698 -10.596 1.00 0.00 C ATOM 582 CG PRO A 39 9.448 -11.082 -10.113 1.00 0.00 C ATOM 583 CD PRO A 39 8.182 -11.233 -10.972 1.00 0.00 C ATOM 0 HA PRO A 39 9.682 -8.867 -12.684 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.939 -9.492 -10.306 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.295 -8.900 -10.178 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.184 -11.862 -10.309 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.236 -11.105 -9.044 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.915 -12.279 -11.121 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.321 -10.746 -10.515 1.00 0.00 H new ATOM 591 N THR A 40 12.162 -9.920 -12.533 1.00 0.00 N ATOM 592 CA THR A 40 13.449 -10.521 -12.695 1.00 0.00 C ATOM 593 C THR A 40 14.131 -10.466 -11.372 1.00 0.00 C ATOM 594 O THR A 40 13.881 -9.538 -10.604 1.00 0.00 O ATOM 595 CB THR A 40 14.332 -10.023 -13.801 1.00 0.00 C ATOM 596 OG1 THR A 40 14.524 -8.617 -13.747 1.00 0.00 O ATOM 597 CG2 THR A 40 13.761 -10.378 -15.185 1.00 0.00 C ATOM 0 H THR A 40 12.232 -8.915 -12.376 1.00 0.00 H new ATOM 0 HA THR A 40 13.260 -11.539 -13.036 1.00 0.00 H new ATOM 0 HB THR A 40 15.291 -10.520 -13.656 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.660 -8.174 -13.617 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.427 -10.001 -15.961 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.674 -11.461 -15.276 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.777 -9.924 -15.300 1.00 0.00 H new ATOM 605 N GLU A 41 15.011 -11.418 -11.014 1.00 0.00 N ATOM 606 CA GLU A 41 15.951 -11.251 -9.949 1.00 0.00 C ATOM 607 C GLU A 41 16.715 -9.977 -10.057 1.00 0.00 C ATOM 608 O GLU A 41 16.779 -9.212 -9.096 1.00 0.00 O ATOM 609 CB GLU A 41 16.918 -12.419 -9.690 1.00 0.00 C ATOM 610 CG GLU A 41 17.515 -12.355 -8.283 1.00 0.00 C ATOM 611 CD GLU A 41 18.335 -13.570 -7.873 1.00 0.00 C ATOM 612 OE1 GLU A 41 18.200 -14.691 -8.434 1.00 0.00 O ATOM 613 OE2 GLU A 41 19.133 -13.444 -6.907 1.00 0.00 O ATOM 0 H GLU A 41 15.071 -12.326 -11.476 1.00 0.00 H new ATOM 0 HA GLU A 41 15.299 -11.223 -9.076 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.391 -13.364 -9.819 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.720 -12.398 -10.428 1.00 0.00 H new ATOM 0 HG2 GLU A 41 18.147 -11.469 -8.213 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.704 -12.225 -7.567 1.00 0.00 H new ATOM 620 N ALA A 42 17.059 -9.596 -11.300 1.00 0.00 N ATOM 621 CA ALA A 42 17.862 -8.463 -11.640 1.00 0.00 C ATOM 622 C ALA A 42 17.335 -7.170 -11.120 1.00 0.00 C ATOM 623 O ALA A 42 18.018 -6.319 -10.553 1.00 0.00 O ATOM 624 CB ALA A 42 18.056 -8.298 -13.157 1.00 0.00 C ATOM 0 H ALA A 42 16.755 -10.116 -12.123 1.00 0.00 H new ATOM 0 HA ALA A 42 18.814 -8.683 -11.158 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.674 -7.421 -13.352 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.547 -9.184 -13.560 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.085 -8.171 -13.636 1.00 0.00 H new ATOM 630 N GLU A 43 16.009 -7.023 -11.292 1.00 0.00 N ATOM 631 CA GLU A 43 15.379 -5.786 -10.947 1.00 0.00 C ATOM 632 C GLU A 43 14.996 -5.690 -9.510 1.00 0.00 C ATOM 633 O GLU A 43 15.005 -4.670 -8.823 1.00 0.00 O ATOM 634 CB GLU A 43 14.093 -5.615 -11.772 1.00 0.00 C ATOM 635 CG GLU A 43 12.720 -6.137 -11.342 1.00 0.00 C ATOM 636 CD GLU A 43 11.706 -6.351 -12.457 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.993 -7.232 -13.310 1.00 0.00 O ATOM 638 OE2 GLU A 43 10.677 -5.633 -12.566 1.00 0.00 O ATOM 0 H GLU A 43 15.386 -7.741 -11.661 1.00 0.00 H new ATOM 0 HA GLU A 43 16.115 -5.010 -11.157 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.974 -4.543 -11.930 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.296 -6.061 -12.746 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.861 -7.083 -10.820 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.296 -5.436 -10.623 1.00 0.00 H new ATOM 645 N LEU A 44 14.810 -6.852 -8.859 1.00 0.00 N ATOM 646 CA LEU A 44 14.557 -6.984 -7.457 1.00 0.00 C ATOM 647 C LEU A 44 15.769 -6.721 -6.632 1.00 0.00 C ATOM 648 O LEU A 44 15.727 -6.131 -5.553 1.00 0.00 O ATOM 649 CB LEU A 44 14.048 -8.392 -7.108 1.00 0.00 C ATOM 650 CG LEU A 44 12.615 -8.577 -7.635 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.162 -10.032 -7.429 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.560 -7.581 -7.126 1.00 0.00 C ATOM 0 H LEU A 44 14.838 -7.751 -9.339 1.00 0.00 H new ATOM 0 HA LEU A 44 13.796 -6.238 -7.227 1.00 0.00 H new ATOM 0 HB2 LEU A 44 14.705 -9.144 -7.545 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.069 -8.538 -6.028 1.00 0.00 H new ATOM 0 HG LEU A 44 12.679 -8.343 -8.698 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.146 -10.154 -7.805 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.831 -10.701 -7.969 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.187 -10.274 -6.366 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.593 -7.817 -7.570 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.488 -7.650 -6.041 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.850 -6.568 -7.406 1.00 0.00 H new ATOM 664 N GLN A 45 16.958 -7.215 -7.022 1.00 0.00 N ATOM 665 CA GLN A 45 18.193 -7.122 -6.307 1.00 0.00 C ATOM 666 C GLN A 45 18.555 -5.680 -6.206 1.00 0.00 C ATOM 667 O GLN A 45 18.966 -5.169 -5.166 1.00 0.00 O ATOM 668 CB GLN A 45 19.157 -8.097 -7.004 1.00 0.00 C ATOM 669 CG GLN A 45 20.587 -7.762 -6.574 1.00 0.00 C ATOM 670 CD GLN A 45 21.587 -8.898 -6.739 1.00 0.00 C ATOM 671 OE1 GLN A 45 21.127 -9.988 -7.075 1.00 0.00 O ATOM 672 NE2 GLN A 45 22.925 -8.729 -6.566 1.00 0.00 N ATOM 0 H GLN A 45 17.062 -7.717 -7.904 1.00 0.00 H new ATOM 0 HA GLN A 45 18.186 -7.439 -5.264 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.913 -9.125 -6.737 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.059 -8.017 -8.087 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.934 -6.905 -7.152 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.575 -7.457 -5.528 1.00 0.00 H new ATOM 0 HE21 GLN A 45 23.292 -7.819 -6.287 1.00 0.00 H new ATOM 0 HE22 GLN A 45 23.561 -9.512 -6.715 1.00 0.00 H new ATOM 681 N ASP A 46 18.443 -4.957 -7.335 1.00 0.00 N ATOM 682 CA ASP A 46 18.606 -3.545 -7.499 1.00 0.00 C ATOM 683 C ASP A 46 17.665 -2.701 -6.710 1.00 0.00 C ATOM 684 O ASP A 46 18.039 -1.709 -6.087 1.00 0.00 O ATOM 685 CB ASP A 46 18.174 -3.302 -8.955 1.00 0.00 C ATOM 686 CG ASP A 46 18.701 -1.944 -9.399 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.926 -1.698 -9.555 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.906 -0.976 -9.537 1.00 0.00 O ATOM 0 H ASP A 46 18.215 -5.409 -8.221 1.00 0.00 H new ATOM 0 HA ASP A 46 19.621 -3.285 -7.200 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.564 -4.089 -9.601 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.087 -3.331 -9.037 1.00 0.00 H new ATOM 693 N MET A 47 16.394 -3.126 -6.607 1.00 0.00 N ATOM 694 CA MET A 47 15.354 -2.515 -5.839 1.00 0.00 C ATOM 695 C MET A 47 15.673 -2.601 -4.386 1.00 0.00 C ATOM 696 O MET A 47 15.577 -1.538 -3.776 1.00 0.00 O ATOM 697 CB MET A 47 14.026 -3.256 -6.074 1.00 0.00 C ATOM 698 CG MET A 47 12.851 -2.818 -5.199 1.00 0.00 C ATOM 699 SD MET A 47 12.698 -3.406 -3.485 1.00 0.00 S ATOM 700 CE MET A 47 12.415 -5.191 -3.666 1.00 0.00 C ATOM 0 H MET A 47 16.070 -3.959 -7.098 1.00 0.00 H new ATOM 0 HA MET A 47 15.269 -1.473 -6.147 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.742 -3.130 -7.119 1.00 0.00 H new ATOM 0 HB3 MET A 47 14.194 -4.321 -5.916 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.866 -1.729 -5.164 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.938 -3.107 -5.720 1.00 0.00 H new ATOM 0 HE1 MET A 47 12.031 -5.595 -2.729 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.690 -5.366 -4.461 1.00 0.00 H new ATOM 0 HE3 MET A 47 13.354 -5.685 -3.916 1.00 0.00 H new ATOM 710 N ILE A 48 16.161 -3.758 -3.904 1.00 0.00 N ATOM 711 CA ILE A 48 16.732 -3.941 -2.606 1.00 0.00 C ATOM 712 C ILE A 48 17.858 -2.980 -2.440 1.00 0.00 C ATOM 713 O ILE A 48 17.761 -2.007 -1.694 1.00 0.00 O ATOM 714 CB ILE A 48 17.225 -5.321 -2.283 1.00 0.00 C ATOM 715 CG1 ILE A 48 16.022 -6.256 -2.074 1.00 0.00 C ATOM 716 CG2 ILE A 48 18.085 -5.375 -1.009 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.251 -7.767 -2.064 1.00 0.00 C ATOM 0 H ILE A 48 16.156 -4.617 -4.454 1.00 0.00 H new ATOM 0 HA ILE A 48 15.912 -3.766 -1.910 1.00 0.00 H new ATOM 0 HB ILE A 48 17.845 -5.632 -3.124 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.557 -5.987 -1.125 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.296 -6.038 -2.857 1.00 0.00 H new ATOM 0 HG21 ILE A 48 18.409 -6.401 -0.832 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.958 -4.734 -1.132 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.498 -5.028 -0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.301 -8.278 -1.906 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.675 -8.077 -3.019 1.00 0.00 H new ATOM 0 HD13 ILE A 48 16.940 -8.025 -1.260 1.00 0.00 H new ATOM 729 N ASN A 49 18.882 -3.078 -3.306 1.00 0.00 N ATOM 730 CA ASN A 49 20.054 -2.263 -3.213 1.00 0.00 C ATOM 731 C ASN A 49 19.839 -0.802 -3.015 1.00 0.00 C ATOM 732 O ASN A 49 20.464 -0.209 -2.138 1.00 0.00 O ATOM 733 CB ASN A 49 20.904 -2.657 -4.432 1.00 0.00 C ATOM 734 CG ASN A 49 22.295 -2.041 -4.491 1.00 0.00 C ATOM 735 OD1 ASN A 49 23.213 -2.381 -3.745 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.586 -1.136 -5.463 1.00 0.00 N ATOM 0 H ASN A 49 18.897 -3.735 -4.086 1.00 0.00 H new ATOM 0 HA ASN A 49 20.582 -2.462 -2.281 1.00 0.00 H new ATOM 0 HB2 ASN A 49 21.006 -3.742 -4.446 1.00 0.00 H new ATOM 0 HB3 ASN A 49 20.363 -2.376 -5.336 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.533 -0.768 -5.550 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.857 -0.825 -6.105 1.00 0.00 H new ATOM 743 N GLU A 50 18.892 -0.156 -3.719 1.00 0.00 N ATOM 744 CA GLU A 50 18.645 1.252 -3.680 1.00 0.00 C ATOM 745 C GLU A 50 18.386 1.718 -2.289 1.00 0.00 C ATOM 746 O GLU A 50 18.978 2.690 -1.823 1.00 0.00 O ATOM 747 CB GLU A 50 17.485 1.513 -4.656 1.00 0.00 C ATOM 748 CG GLU A 50 17.224 3.007 -4.860 1.00 0.00 C ATOM 749 CD GLU A 50 16.304 3.468 -5.982 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.647 2.605 -6.624 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.142 4.712 -6.098 1.00 0.00 O ATOM 0 H GLU A 50 18.262 -0.647 -4.353 1.00 0.00 H new ATOM 0 HA GLU A 50 19.514 1.830 -3.993 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.711 1.051 -5.617 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.581 1.037 -4.278 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.819 3.397 -3.926 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.190 3.488 -5.013 1.00 0.00 H new ATOM 758 N VAL A 51 17.485 1.075 -1.525 1.00 0.00 N ATOM 759 CA VAL A 51 17.216 1.370 -0.152 1.00 0.00 C ATOM 760 C VAL A 51 18.184 0.835 0.845 1.00 0.00 C ATOM 761 O VAL A 51 18.303 1.231 2.004 1.00 0.00 O ATOM 762 CB VAL A 51 15.806 1.024 0.226 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.726 1.900 -0.430 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.553 -0.414 -0.259 1.00 0.00 C ATOM 0 H VAL A 51 16.915 0.309 -1.884 1.00 0.00 H new ATOM 0 HA VAL A 51 17.354 2.450 -0.099 1.00 0.00 H new ATOM 0 HB VAL A 51 15.727 1.170 1.303 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.741 1.574 -0.096 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.880 2.941 -0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.791 1.807 -1.514 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.535 -0.710 -0.005 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.686 -0.462 -1.340 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.259 -1.090 0.223 1.00 0.00 H new ATOM 774 N ASP A 52 18.926 -0.234 0.503 1.00 0.00 N ATOM 775 CA ASP A 52 19.790 -0.961 1.381 1.00 0.00 C ATOM 776 C ASP A 52 20.968 -0.228 1.924 1.00 0.00 C ATOM 777 O ASP A 52 22.065 -0.205 1.369 1.00 0.00 O ATOM 778 CB ASP A 52 20.239 -2.167 0.540 1.00 0.00 C ATOM 779 CG ASP A 52 20.968 -3.335 1.189 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.429 -3.824 2.217 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.130 -3.614 0.790 1.00 0.00 O ATOM 0 H ASP A 52 18.922 -0.613 -0.444 1.00 0.00 H new ATOM 0 HA ASP A 52 19.243 -1.208 2.291 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.349 -2.572 0.058 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.884 -1.785 -0.251 1.00 0.00 H new ATOM 786 N ALA A 53 20.726 0.477 3.044 1.00 0.00 N ATOM 787 CA ALA A 53 21.509 1.236 3.969 1.00 0.00 C ATOM 788 C ALA A 53 22.725 0.526 4.456 1.00 0.00 C ATOM 789 O ALA A 53 23.862 0.880 4.149 1.00 0.00 O ATOM 790 CB ALA A 53 20.588 1.678 5.119 1.00 0.00 C ATOM 0 H ALA A 53 19.757 0.513 3.359 1.00 0.00 H new ATOM 0 HA ALA A 53 21.909 2.108 3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.161 2.260 5.841 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.777 2.289 4.722 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.172 0.799 5.611 1.00 0.00 H new ATOM 796 N ASP A 54 22.518 -0.561 5.221 1.00 0.00 N ATOM 797 CA ASP A 54 23.478 -1.462 5.780 1.00 0.00 C ATOM 798 C ASP A 54 24.561 -1.901 4.857 1.00 0.00 C ATOM 799 O ASP A 54 25.765 -1.700 5.008 1.00 0.00 O ATOM 800 CB ASP A 54 22.903 -2.574 6.675 1.00 0.00 C ATOM 801 CG ASP A 54 21.709 -3.263 6.032 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.729 -3.497 4.793 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.692 -3.531 6.726 1.00 0.00 O ATOM 0 H ASP A 54 21.569 -0.836 5.474 1.00 0.00 H new ATOM 0 HA ASP A 54 24.003 -0.822 6.489 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.679 -3.311 6.881 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.604 -2.150 7.633 1.00 0.00 H new ATOM 808 N GLY A 55 24.180 -2.669 3.821 1.00 0.00 N ATOM 809 CA GLY A 55 24.991 -3.127 2.735 1.00 0.00 C ATOM 810 C GLY A 55 24.808 -4.602 2.630 1.00 0.00 C ATOM 811 O GLY A 55 25.813 -5.179 2.217 1.00 0.00 O ATOM 0 H GLY A 55 23.218 -2.998 3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.699 -2.637 1.806 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.039 -2.882 2.909 1.00 0.00 H new ATOM 815 N ASN A 56 23.725 -5.205 3.151 1.00 0.00 N ATOM 816 CA ASN A 56 23.565 -6.624 3.217 1.00 0.00 C ATOM 817 C ASN A 56 22.959 -7.250 2.008 1.00 0.00 C ATOM 818 O ASN A 56 23.228 -8.420 1.741 1.00 0.00 O ATOM 819 CB ASN A 56 22.981 -7.082 4.564 1.00 0.00 C ATOM 820 CG ASN A 56 21.637 -6.525 5.011 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.820 -6.214 4.146 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.318 -6.530 6.334 1.00 0.00 N ATOM 0 H ASN A 56 22.935 -4.689 3.539 1.00 0.00 H new ATOM 0 HA ASN A 56 24.574 -7.035 3.189 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.894 -8.168 4.533 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.711 -6.843 5.338 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.378 -6.271 6.633 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.019 -6.793 7.027 1.00 0.00 H new ATOM 829 N GLY A 57 22.138 -6.485 1.266 1.00 0.00 N ATOM 830 CA GLY A 57 21.318 -6.938 0.186 1.00 0.00 C ATOM 831 C GLY A 57 20.159 -7.821 0.500 1.00 0.00 C ATOM 832 O GLY A 57 19.706 -8.528 -0.399 1.00 0.00 O ATOM 0 H GLY A 57 22.042 -5.483 1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.935 -6.059 -0.332 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.959 -7.469 -0.518 1.00 0.00 H new ATOM 836 N THR A 58 19.643 -7.708 1.737 1.00 0.00 N ATOM 837 CA THR A 58 18.283 -8.059 2.003 1.00 0.00 C ATOM 838 C THR A 58 17.537 -6.830 2.393 1.00 0.00 C ATOM 839 O THR A 58 18.134 -5.911 2.951 1.00 0.00 O ATOM 840 CB THR A 58 18.017 -9.131 3.019 1.00 0.00 C ATOM 841 OG1 THR A 58 18.383 -8.718 4.327 1.00 0.00 O ATOM 842 CG2 THR A 58 18.826 -10.347 2.536 1.00 0.00 C ATOM 0 H THR A 58 20.164 -7.376 2.548 1.00 0.00 H new ATOM 0 HA THR A 58 17.943 -8.502 1.067 1.00 0.00 H new ATOM 0 HB THR A 58 16.956 -9.368 3.096 1.00 0.00 H new ATOM 0 HG1 THR A 58 18.943 -9.406 4.743 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.684 -11.177 3.228 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.484 -10.640 1.543 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.884 -10.087 2.494 1.00 0.00 H new ATOM 850 N ILE A 59 16.224 -6.769 2.106 1.00 0.00 N ATOM 851 CA ILE A 59 15.544 -5.559 2.450 1.00 0.00 C ATOM 852 C ILE A 59 15.080 -5.646 3.863 1.00 0.00 C ATOM 853 O ILE A 59 14.220 -6.472 4.166 1.00 0.00 O ATOM 854 CB ILE A 59 14.396 -5.238 1.540 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.606 -3.971 1.909 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.510 -6.422 1.118 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.862 -3.413 0.696 1.00 0.00 C ATOM 0 H ILE A 59 15.665 -7.501 1.667 1.00 0.00 H new ATOM 0 HA ILE A 59 16.256 -4.742 2.330 1.00 0.00 H new ATOM 0 HB ILE A 59 14.918 -4.980 0.619 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.894 -4.201 2.702 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.287 -3.215 2.301 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.715 -6.066 0.462 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.115 -7.159 0.589 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.071 -6.882 2.003 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.312 -2.518 0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.578 -3.161 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.164 -4.162 0.321 1.00 0.00 H new ATOM 869 N ASP A 60 15.668 -4.919 4.831 1.00 0.00 N ATOM 870 CA ASP A 60 15.321 -4.988 6.216 1.00 0.00 C ATOM 871 C ASP A 60 14.135 -4.114 6.436 1.00 0.00 C ATOM 872 O ASP A 60 13.703 -3.347 5.577 1.00 0.00 O ATOM 873 CB ASP A 60 16.507 -4.565 7.100 1.00 0.00 C ATOM 874 CG ASP A 60 17.700 -5.505 7.002 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.371 -5.551 5.936 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.071 -6.097 8.050 1.00 0.00 O ATOM 0 H ASP A 60 16.418 -4.255 4.639 1.00 0.00 H new ATOM 0 HA ASP A 60 15.076 -6.013 6.494 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.821 -3.560 6.817 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.177 -4.515 8.138 1.00 0.00 H new ATOM 881 N PHE A 61 13.553 -4.078 7.649 1.00 0.00 N ATOM 882 CA PHE A 61 12.303 -3.458 7.959 1.00 0.00 C ATOM 883 C PHE A 61 12.207 -2.004 7.646 1.00 0.00 C ATOM 884 O PHE A 61 11.322 -1.539 6.929 1.00 0.00 O ATOM 885 CB PHE A 61 11.885 -3.883 9.377 1.00 0.00 C ATOM 886 CG PHE A 61 10.588 -3.282 9.797 1.00 0.00 C ATOM 887 CD1 PHE A 61 9.427 -3.430 9.076 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.497 -2.493 10.920 1.00 0.00 C ATOM 889 CE1 PHE A 61 8.194 -2.943 9.442 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.311 -1.967 11.374 1.00 0.00 C ATOM 891 CZ PHE A 61 8.201 -2.192 10.593 1.00 0.00 C ATOM 0 H PHE A 61 13.985 -4.511 8.465 1.00 0.00 H new ATOM 0 HA PHE A 61 11.549 -3.830 7.266 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.808 -4.969 9.419 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.662 -3.591 10.084 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.488 -3.974 8.145 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.400 -2.277 11.471 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.296 -3.135 8.873 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.254 -1.407 12.295 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.268 -1.747 10.907 1.00 0.00 H new ATOM 901 N PRO A 62 13.087 -1.156 8.089 1.00 0.00 N ATOM 902 CA PRO A 62 12.887 0.246 7.864 1.00 0.00 C ATOM 903 C PRO A 62 13.267 0.756 6.517 1.00 0.00 C ATOM 904 O PRO A 62 12.977 1.876 6.100 1.00 0.00 O ATOM 905 CB PRO A 62 13.754 0.899 8.937 1.00 0.00 C ATOM 906 CG PRO A 62 14.914 -0.083 9.165 1.00 0.00 C ATOM 907 CD PRO A 62 14.230 -1.441 8.943 1.00 0.00 C ATOM 0 HA PRO A 62 11.823 0.475 7.913 1.00 0.00 H new ATOM 0 HB2 PRO A 62 14.120 1.872 8.610 1.00 0.00 H new ATOM 0 HB3 PRO A 62 13.189 1.062 9.855 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.732 0.082 8.464 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.332 0.005 10.168 1.00 0.00 H new ATOM 0 HD2 PRO A 62 14.908 -2.151 8.470 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.915 -1.883 9.888 1.00 0.00 H new ATOM 915 N GLU A 63 13.912 -0.098 5.703 1.00 0.00 N ATOM 916 CA GLU A 63 14.269 0.146 4.340 1.00 0.00 C ATOM 917 C GLU A 63 13.010 0.024 3.553 1.00 0.00 C ATOM 918 O GLU A 63 12.591 0.919 2.820 1.00 0.00 O ATOM 919 CB GLU A 63 15.339 -0.788 3.750 1.00 0.00 C ATOM 920 CG GLU A 63 16.733 -0.698 4.375 1.00 0.00 C ATOM 921 CD GLU A 63 17.731 -1.846 4.421 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.406 -2.947 3.902 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.920 -1.708 4.815 1.00 0.00 O ATOM 0 H GLU A 63 14.204 -1.023 6.020 1.00 0.00 H new ATOM 0 HA GLU A 63 14.727 1.134 4.293 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.987 -1.815 3.844 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.427 -0.578 2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.240 0.123 3.867 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.581 -0.388 5.409 1.00 0.00 H new ATOM 930 N PHE A 64 12.303 -1.115 3.663 1.00 0.00 N ATOM 931 CA PHE A 64 10.952 -1.245 3.212 1.00 0.00 C ATOM 932 C PHE A 64 10.080 -0.090 3.569 1.00 0.00 C ATOM 933 O PHE A 64 9.438 0.543 2.732 1.00 0.00 O ATOM 934 CB PHE A 64 10.322 -2.566 3.683 1.00 0.00 C ATOM 935 CG PHE A 64 9.201 -2.958 2.783 1.00 0.00 C ATOM 936 CD1 PHE A 64 7.983 -2.366 3.023 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.349 -3.959 1.852 1.00 0.00 C ATOM 938 CE1 PHE A 64 6.903 -2.829 2.310 1.00 0.00 C ATOM 939 CE2 PHE A 64 8.268 -4.342 1.093 1.00 0.00 C ATOM 940 CZ PHE A 64 7.026 -3.814 1.358 1.00 0.00 C ATOM 0 H PHE A 64 12.680 -1.968 4.076 1.00 0.00 H new ATOM 0 HA PHE A 64 11.015 -1.253 2.124 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.077 -3.352 3.697 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.956 -2.458 4.704 1.00 0.00 H new ATOM 0 HD1 PHE A 64 7.879 -1.568 3.744 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.306 -4.441 1.718 1.00 0.00 H new ATOM 0 HE1 PHE A 64 5.928 -2.406 2.503 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.394 -5.055 0.292 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.157 -4.169 0.824 1.00 0.00 H new ATOM 950 N LEU A 65 9.990 0.397 4.819 1.00 0.00 N ATOM 951 CA LEU A 65 9.235 1.554 5.188 1.00 0.00 C ATOM 952 C LEU A 65 9.653 2.881 4.654 1.00 0.00 C ATOM 953 O LEU A 65 8.814 3.709 4.304 1.00 0.00 O ATOM 954 CB LEU A 65 9.067 1.689 6.711 1.00 0.00 C ATOM 955 CG LEU A 65 8.211 0.577 7.341 1.00 0.00 C ATOM 956 CD1 LEU A 65 7.848 0.908 8.798 1.00 0.00 C ATOM 957 CD2 LEU A 65 6.918 0.122 6.643 1.00 0.00 C ATOM 0 H LEU A 65 10.466 -0.037 5.610 1.00 0.00 H new ATOM 0 HA LEU A 65 8.295 1.327 4.685 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.052 1.685 7.178 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.613 2.655 6.933 1.00 0.00 H new ATOM 0 HG LEU A 65 8.893 -0.266 7.230 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.243 0.103 9.214 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.760 1.017 9.385 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.283 1.840 8.830 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.447 -0.667 7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.235 0.967 6.556 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.155 -0.256 5.649 1.00 0.00 H new ATOM 969 N THR A 66 10.949 3.115 4.379 1.00 0.00 N ATOM 970 CA THR A 66 11.484 4.258 3.708 1.00 0.00 C ATOM 971 C THR A 66 11.073 4.247 2.275 1.00 0.00 C ATOM 972 O THR A 66 10.985 5.303 1.650 1.00 0.00 O ATOM 973 CB THR A 66 12.963 4.285 3.955 1.00 0.00 C ATOM 974 OG1 THR A 66 13.333 4.401 5.321 1.00 0.00 O ATOM 975 CG2 THR A 66 13.678 5.432 3.221 1.00 0.00 C ATOM 0 H THR A 66 11.677 2.453 4.647 1.00 0.00 H new ATOM 0 HA THR A 66 11.085 5.195 4.096 1.00 0.00 H new ATOM 0 HB THR A 66 13.276 3.314 3.571 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.405 3.508 5.717 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.745 5.396 3.441 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.525 5.328 2.147 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.271 6.387 3.554 1.00 0.00 H new ATOM 983 N MET A 67 10.804 3.103 1.621 1.00 0.00 N ATOM 984 CA MET A 67 10.253 2.952 0.310 1.00 0.00 C ATOM 985 C MET A 67 8.798 3.269 0.270 1.00 0.00 C ATOM 986 O MET A 67 8.425 4.111 -0.546 1.00 0.00 O ATOM 987 CB MET A 67 10.546 1.507 -0.127 1.00 0.00 C ATOM 988 CG MET A 67 10.357 1.191 -1.612 1.00 0.00 C ATOM 989 SD MET A 67 10.333 -0.586 -1.993 1.00 0.00 S ATOM 990 CE MET A 67 8.698 -1.004 -1.323 1.00 0.00 C ATOM 0 H MET A 67 10.991 2.198 2.054 1.00 0.00 H new ATOM 0 HA MET A 67 10.710 3.660 -0.381 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.575 1.271 0.144 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.904 0.840 0.448 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.423 1.638 -1.952 1.00 0.00 H new ATOM 0 HG3 MET A 67 11.160 1.663 -2.178 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.368 -1.957 -1.737 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.759 -1.081 -0.237 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.985 -0.225 -1.592 1.00 0.00 H new ATOM 1000 N MET A 68 7.944 2.804 1.199 1.00 0.00 N ATOM 1001 CA MET A 68 6.546 3.054 1.367 1.00 0.00 C ATOM 1002 C MET A 68 6.239 4.482 1.661 1.00 0.00 C ATOM 1003 O MET A 68 5.162 5.035 1.442 1.00 0.00 O ATOM 1004 CB MET A 68 5.928 2.138 2.437 1.00 0.00 C ATOM 1005 CG MET A 68 6.207 0.640 2.299 1.00 0.00 C ATOM 1006 SD MET A 68 5.548 0.063 0.706 1.00 0.00 S ATOM 1007 CE MET A 68 3.852 -0.220 1.291 1.00 0.00 C ATOM 0 H MET A 68 8.282 2.171 1.924 1.00 0.00 H new ATOM 0 HA MET A 68 6.088 2.821 0.406 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.288 2.463 3.413 1.00 0.00 H new ATOM 0 HB3 MET A 68 4.848 2.286 2.430 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.279 0.449 2.355 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.743 0.093 3.119 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.227 -0.537 0.456 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.856 -0.996 2.056 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.454 0.703 1.713 1.00 0.00 H new ATOM 1017 N ALA A 69 7.213 5.129 2.326 1.00 0.00 N ATOM 1018 CA ALA A 69 7.213 6.517 2.669 1.00 0.00 C ATOM 1019 C ALA A 69 7.650 7.356 1.517 1.00 0.00 C ATOM 1020 O ALA A 69 7.383 8.555 1.461 1.00 0.00 O ATOM 1021 CB ALA A 69 8.304 6.755 3.727 1.00 0.00 C ATOM 0 H ALA A 69 8.055 4.650 2.644 1.00 0.00 H new ATOM 0 HA ALA A 69 6.205 6.772 2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.320 7.810 4.002 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.092 6.153 4.610 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.274 6.472 3.319 1.00 0.00 H new ATOM 1027 N ARG A 70 8.408 6.849 0.528 1.00 0.00 N ATOM 1028 CA ARG A 70 8.965 7.639 -0.526 1.00 0.00 C ATOM 1029 C ARG A 70 7.972 8.039 -1.563 1.00 0.00 C ATOM 1030 O ARG A 70 7.450 7.172 -2.262 1.00 0.00 O ATOM 1031 CB ARG A 70 10.173 6.917 -1.144 1.00 0.00 C ATOM 1032 CG ARG A 70 11.020 7.634 -2.197 1.00 0.00 C ATOM 1033 CD ARG A 70 12.179 6.866 -2.834 1.00 0.00 C ATOM 1034 NE ARG A 70 12.884 7.722 -3.830 1.00 0.00 N ATOM 1035 CZ ARG A 70 13.914 7.326 -4.632 1.00 0.00 C ATOM 1036 NH1 ARG A 70 14.427 6.065 -4.540 1.00 0.00 N ATOM 1037 NH2 ARG A 70 14.132 8.129 -5.715 1.00 0.00 N ATOM 0 H ARG A 70 8.641 5.858 0.460 1.00 0.00 H new ATOM 0 HA ARG A 70 9.300 8.575 -0.078 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.837 6.634 -0.328 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.807 5.993 -1.592 1.00 0.00 H new ATOM 0 HG2 ARG A 70 10.354 7.957 -2.997 1.00 0.00 H new ATOM 0 HG3 ARG A 70 11.429 8.535 -1.739 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.878 6.544 -2.062 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.804 5.965 -3.320 1.00 0.00 H new ATOM 0 HE ARG A 70 12.569 8.688 -3.920 1.00 0.00 H new ATOM 0 HH11 ARG A 70 14.040 5.405 -3.865 1.00 0.00 H new ATOM 0 HH12 ARG A 70 15.197 5.782 -5.146 1.00 0.00 H new ATOM 0 HH21 ARG A 70 13.544 8.948 -5.869 1.00 0.00 H new ATOM 0 HH22 ARG A 70 14.882 7.909 -6.370 1.00 0.00 H new ATOM 1051 N LYS A 71 7.706 9.347 -1.726 1.00 0.00 N ATOM 1052 CA LYS A 71 6.882 9.953 -2.724 1.00 0.00 C ATOM 1053 C LYS A 71 7.667 10.550 -3.841 1.00 0.00 C ATOM 1054 O LYS A 71 8.758 11.091 -3.670 1.00 0.00 O ATOM 1055 CB LYS A 71 6.064 11.076 -2.064 1.00 0.00 C ATOM 1056 CG LYS A 71 4.878 10.580 -1.233 1.00 0.00 C ATOM 1057 CD LYS A 71 4.037 11.732 -0.679 1.00 0.00 C ATOM 1058 CE LYS A 71 2.746 11.355 0.049 1.00 0.00 C ATOM 1059 NZ LYS A 71 2.925 10.313 1.085 1.00 0.00 N ATOM 0 H LYS A 71 8.107 10.044 -1.098 1.00 0.00 H new ATOM 0 HA LYS A 71 6.249 9.170 -3.142 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.723 11.662 -1.423 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.695 11.746 -2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.249 9.937 -1.849 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.245 9.971 -0.407 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.659 12.307 0.007 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.780 12.393 -1.506 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.328 12.248 0.514 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.017 11.006 -0.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.010 10.110 1.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.295 9.446 0.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.597 10.650 1.804 1.00 0.00 H new ATOM 1073 N MET A 72 7.092 10.436 -5.052 1.00 0.00 N ATOM 1074 CA MET A 72 7.724 10.673 -6.313 1.00 0.00 C ATOM 1075 C MET A 72 7.265 11.988 -6.842 1.00 0.00 C ATOM 1076 O MET A 72 7.073 13.015 -6.192 1.00 0.00 O ATOM 1077 CB MET A 72 7.303 9.482 -7.190 1.00 0.00 C ATOM 1078 CG MET A 72 7.616 8.079 -6.667 1.00 0.00 C ATOM 1079 SD MET A 72 9.301 7.606 -6.177 1.00 0.00 S ATOM 1080 CE MET A 72 10.256 7.964 -7.680 1.00 0.00 C ATOM 0 H MET A 72 6.116 10.158 -5.156 1.00 0.00 H new ATOM 0 HA MET A 72 8.811 10.734 -6.267 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.228 9.548 -7.355 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.782 9.594 -8.163 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.975 7.913 -5.801 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.300 7.375 -7.437 1.00 0.00 H new ATOM 0 HE1 MET A 72 11.304 7.718 -7.512 1.00 0.00 H new ATOM 0 HE2 MET A 72 9.871 7.367 -8.507 1.00 0.00 H new ATOM 0 HE3 MET A 72 10.166 9.022 -7.924 1.00 0.00 H new ATOM 1090 N LYS A 73 7.270 12.070 -8.184 1.00 0.00 N ATOM 1091 CA LYS A 73 7.016 13.208 -9.011 1.00 0.00 C ATOM 1092 C LYS A 73 5.555 13.477 -9.137 1.00 0.00 C ATOM 1093 O LYS A 73 5.111 14.617 -9.009 1.00 0.00 O ATOM 1094 CB LYS A 73 7.609 13.111 -10.427 1.00 0.00 C ATOM 1095 CG LYS A 73 7.170 14.130 -11.480 1.00 0.00 C ATOM 1096 CD LYS A 73 7.867 13.930 -12.827 1.00 0.00 C ATOM 1097 CE LYS A 73 7.570 12.553 -13.424 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.173 12.378 -13.879 1.00 0.00 N ATOM 0 H LYS A 73 7.475 11.246 -8.749 1.00 0.00 H new ATOM 0 HA LYS A 73 7.519 14.027 -8.496 1.00 0.00 H new ATOM 0 HB2 LYS A 73 8.693 13.176 -10.336 1.00 0.00 H new ATOM 0 HB3 LYS A 73 7.381 12.118 -10.813 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.091 14.059 -11.620 1.00 0.00 H new ATOM 0 HG3 LYS A 73 7.378 15.136 -11.114 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.543 14.705 -13.522 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.943 14.046 -12.700 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.239 12.383 -14.268 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.796 11.790 -12.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.955 11.363 -13.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.527 12.825 -13.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.053 12.822 -14.812 1.00 0.00 H new ATOM 1112 N ASP A 74 4.721 12.463 -9.429 1.00 0.00 N ATOM 1113 CA ASP A 74 3.295 12.559 -9.474 1.00 0.00 C ATOM 1114 C ASP A 74 2.638 12.122 -8.210 1.00 0.00 C ATOM 1115 O ASP A 74 3.190 11.537 -7.280 1.00 0.00 O ATOM 1116 CB ASP A 74 2.690 11.717 -10.609 1.00 0.00 C ATOM 1117 CG ASP A 74 3.655 11.778 -11.785 1.00 0.00 C ATOM 1118 OD1 ASP A 74 3.719 12.871 -12.408 1.00 0.00 O ATOM 1119 OD2 ASP A 74 4.253 10.710 -12.087 1.00 0.00 O ATOM 0 H ASP A 74 5.060 11.526 -9.645 1.00 0.00 H new ATOM 0 HA ASP A 74 3.105 13.620 -9.639 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.543 10.686 -10.286 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.712 12.104 -10.895 1.00 0.00 H new ATOM 1124 N THR A 75 1.331 12.401 -8.058 1.00 0.00 N ATOM 1125 CA THR A 75 0.520 12.412 -6.881 1.00 0.00 C ATOM 1126 C THR A 75 0.411 11.004 -6.404 1.00 0.00 C ATOM 1127 O THR A 75 -0.006 10.065 -7.080 1.00 0.00 O ATOM 1128 CB THR A 75 -0.835 13.030 -7.057 1.00 0.00 C ATOM 1129 OG1 THR A 75 -0.755 14.341 -7.597 1.00 0.00 O ATOM 1130 CG2 THR A 75 -1.647 13.031 -5.750 1.00 0.00 C ATOM 0 H THR A 75 0.773 12.652 -8.874 1.00 0.00 H new ATOM 0 HA THR A 75 1.005 13.053 -6.145 1.00 0.00 H new ATOM 0 HB THR A 75 -1.364 12.404 -7.775 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.658 14.709 -7.698 1.00 0.00 H new ATOM 0 HG21 THR A 75 -2.621 13.488 -5.927 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.785 12.006 -5.406 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.112 13.600 -4.990 1.00 0.00 H new ATOM 1138 N ASP A 76 0.639 10.781 -5.097 1.00 0.00 N ATOM 1139 CA ASP A 76 0.624 9.472 -4.521 1.00 0.00 C ATOM 1140 C ASP A 76 -0.669 8.733 -4.557 1.00 0.00 C ATOM 1141 O ASP A 76 -0.681 7.551 -4.897 1.00 0.00 O ATOM 1142 CB ASP A 76 1.190 9.636 -3.100 1.00 0.00 C ATOM 1143 CG ASP A 76 1.854 8.348 -2.634 1.00 0.00 C ATOM 1144 OD1 ASP A 76 2.653 7.739 -3.395 1.00 0.00 O ATOM 1145 OD2 ASP A 76 1.539 7.972 -1.474 1.00 0.00 O ATOM 0 H ASP A 76 0.838 11.524 -4.427 1.00 0.00 H new ATOM 0 HA ASP A 76 1.235 8.816 -5.141 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.914 10.451 -3.083 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.388 9.907 -2.413 1.00 0.00 H new ATOM 1150 N SER A 77 -1.808 9.341 -4.183 1.00 0.00 N ATOM 1151 CA SER A 77 -3.026 8.629 -3.951 1.00 0.00 C ATOM 1152 C SER A 77 -3.741 8.287 -5.213 1.00 0.00 C ATOM 1153 O SER A 77 -4.736 7.565 -5.190 1.00 0.00 O ATOM 1154 CB SER A 77 -3.924 9.571 -3.132 1.00 0.00 C ATOM 1155 OG SER A 77 -3.195 10.155 -2.062 1.00 0.00 O ATOM 0 H SER A 77 -1.885 10.348 -4.039 1.00 0.00 H new ATOM 0 HA SER A 77 -2.800 7.691 -3.444 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.322 10.354 -3.777 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.777 9.018 -2.738 1.00 0.00 H new ATOM 0 HG SER A 77 -3.782 10.752 -1.554 1.00 0.00 H new ATOM 1161 N GLU A 78 -3.243 8.843 -6.332 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.656 8.441 -7.641 1.00 0.00 C ATOM 1163 C GLU A 78 -2.988 7.184 -8.080 1.00 0.00 C ATOM 1164 O GLU A 78 -3.724 6.218 -8.274 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.320 9.545 -8.658 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.120 10.835 -8.468 1.00 0.00 C ATOM 1167 CD GLU A 78 -5.597 10.572 -8.723 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -5.950 9.493 -9.270 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -6.462 11.462 -8.503 1.00 0.00 O ATOM 0 H GLU A 78 -2.542 9.584 -6.328 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.731 8.267 -7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.257 9.776 -8.589 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.499 9.164 -9.664 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -3.979 11.215 -7.456 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.755 11.603 -9.150 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.647 7.271 -8.147 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.751 6.375 -8.808 1.00 0.00 C ATOM 1178 C GLU A 79 -0.646 5.141 -7.980 1.00 0.00 C ATOM 1179 O GLU A 79 -0.603 4.020 -8.486 1.00 0.00 O ATOM 1180 CB GLU A 79 0.636 7.030 -8.925 1.00 0.00 C ATOM 1181 CG GLU A 79 0.600 8.337 -9.720 1.00 0.00 C ATOM 1182 CD GLU A 79 0.195 7.983 -11.144 1.00 0.00 C ATOM 1183 OE1 GLU A 79 0.838 7.084 -11.748 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -0.671 8.670 -11.748 1.00 0.00 O ATOM 0 H GLU A 79 -1.148 8.038 -7.697 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.117 6.137 -9.807 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.027 7.226 -7.927 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.324 6.334 -9.406 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.111 9.036 -9.280 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.575 8.823 -9.706 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.463 5.237 -6.651 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.552 4.096 -5.793 1.00 0.00 C ATOM 1193 C GLU A 80 -1.790 3.272 -5.876 1.00 0.00 C ATOM 1194 O GLU A 80 -1.904 2.115 -6.277 1.00 0.00 O ATOM 1195 CB GLU A 80 -0.228 4.453 -4.332 1.00 0.00 C ATOM 1196 CG GLU A 80 -0.290 3.391 -3.232 1.00 0.00 C ATOM 1197 CD GLU A 80 0.160 3.841 -1.850 1.00 0.00 C ATOM 1198 OE1 GLU A 80 -0.343 4.935 -1.478 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.198 3.392 -1.296 1.00 0.00 O ATOM 0 H GLU A 80 -0.252 6.110 -6.168 1.00 0.00 H new ATOM 0 HA GLU A 80 0.218 3.439 -6.198 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.780 4.868 -4.320 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.906 5.255 -4.041 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -1.316 3.030 -3.159 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.325 2.544 -3.536 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.962 3.873 -5.606 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.167 3.185 -5.261 1.00 0.00 C ATOM 1208 C ILE A 81 -4.755 2.593 -6.496 1.00 0.00 C ATOM 1209 O ILE A 81 -5.282 1.482 -6.512 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.056 4.202 -4.609 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.523 4.509 -3.199 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.490 3.672 -4.438 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -5.277 5.571 -2.401 1.00 0.00 C ATOM 0 H ILE A 81 -3.075 4.886 -5.629 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.010 2.356 -4.570 1.00 0.00 H new ATOM 0 HB ILE A 81 -5.064 5.086 -5.246 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -4.527 3.583 -2.624 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.483 4.824 -3.288 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.106 4.435 -3.962 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.906 3.427 -5.415 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.475 2.778 -3.815 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.806 5.697 -1.426 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.252 6.518 -2.941 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.312 5.258 -2.266 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.652 3.282 -7.647 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.034 2.836 -8.950 1.00 0.00 C ATOM 1227 C ARG A 82 -4.541 1.460 -9.239 1.00 0.00 C ATOM 1228 O ARG A 82 -5.259 0.495 -9.498 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.611 3.845 -10.032 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.922 3.348 -11.445 1.00 0.00 C ATOM 1231 CD ARG A 82 -4.475 4.411 -12.450 1.00 0.00 C ATOM 1232 NE ARG A 82 -2.991 4.288 -12.502 1.00 0.00 N ATOM 1233 CZ ARG A 82 -2.197 5.384 -12.326 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -2.671 6.593 -11.907 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -0.870 5.292 -12.632 1.00 0.00 N ATOM 0 H ARG A 82 -4.270 4.228 -7.665 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.122 2.781 -8.968 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.123 4.792 -9.862 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.542 4.040 -9.945 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.406 2.407 -11.636 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.989 3.154 -11.551 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.920 4.240 -13.430 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.778 5.408 -12.131 1.00 0.00 H new ATOM 0 HE ARG A 82 -2.565 3.377 -12.671 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.665 6.710 -11.708 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.032 7.379 -11.792 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -0.488 4.415 -12.986 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.261 6.100 -12.507 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.203 1.319 -9.208 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.438 0.196 -9.654 1.00 0.00 C ATOM 1251 C GLU A 83 -2.476 -0.931 -8.680 1.00 0.00 C ATOM 1252 O GLU A 83 -2.440 -2.069 -9.146 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.004 0.652 -9.971 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.978 1.643 -11.136 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.559 1.140 -12.450 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -1.562 -0.065 -12.819 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.967 1.970 -13.306 1.00 0.00 O ATOM 0 H GLU A 83 -2.606 2.058 -8.837 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.886 -0.195 -10.568 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.564 1.115 -9.088 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.390 -0.215 -10.215 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.524 2.538 -10.839 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.055 1.943 -11.309 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.684 -0.594 -7.394 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.914 -1.505 -6.316 1.00 0.00 C ATOM 1266 C ALA A 84 -4.208 -2.238 -6.407 1.00 0.00 C ATOM 1267 O ALA A 84 -4.218 -3.437 -6.133 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.868 -0.645 -5.042 1.00 0.00 C ATOM 0 H ALA A 84 -2.692 0.379 -7.089 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.158 -2.290 -6.331 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.037 -1.277 -4.170 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.892 -0.167 -4.960 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.643 0.120 -5.091 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.265 -1.502 -6.794 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.565 -2.001 -7.119 1.00 0.00 C ATOM 1276 C PHE A 85 -6.486 -2.932 -8.280 1.00 0.00 C ATOM 1277 O PHE A 85 -7.049 -4.024 -8.223 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.461 -0.798 -7.462 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.876 -1.263 -7.500 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.614 -1.473 -6.359 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.528 -1.290 -8.711 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.980 -1.624 -6.418 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.887 -1.466 -8.818 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.598 -1.560 -7.645 1.00 0.00 C ATOM 0 H PHE A 85 -5.206 -0.488 -6.886 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.979 -2.552 -6.275 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.340 -0.011 -6.718 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.175 -0.374 -8.424 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.114 -1.520 -5.403 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.949 -1.168 -9.614 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.555 -1.789 -5.519 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.374 -1.528 -9.780 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.677 -1.584 -7.689 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.594 -2.690 -9.256 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.352 -3.566 -10.361 1.00 0.00 C ATOM 1296 C ARG A 86 -4.808 -4.910 -10.020 1.00 0.00 C ATOM 1297 O ARG A 86 -4.819 -5.880 -10.778 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.405 -2.822 -11.317 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.812 -3.173 -12.749 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.880 -2.728 -13.878 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.703 -1.252 -13.769 1.00 0.00 N ATOM 1302 CZ ARG A 86 -4.668 -0.363 -14.143 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -5.902 -0.803 -14.526 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -4.367 0.967 -14.084 1.00 0.00 N ATOM 0 H ARG A 86 -5.017 -1.849 -9.277 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.317 -3.796 -10.812 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.468 -1.746 -11.155 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.371 -3.112 -11.132 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.923 -4.256 -12.811 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.795 -2.741 -12.935 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.918 -3.235 -13.801 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.302 -2.991 -14.848 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.823 -0.891 -13.399 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.107 -1.802 -14.534 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -6.619 -0.133 -14.804 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.445 1.268 -13.768 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.064 1.660 -14.356 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.241 -5.045 -8.808 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.796 -6.314 -8.321 1.00 0.00 C ATOM 1320 C VAL A 87 -4.949 -7.119 -7.827 1.00 0.00 C ATOM 1321 O VAL A 87 -4.960 -8.336 -8.009 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.738 -6.211 -7.263 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.068 -7.561 -6.955 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.686 -5.154 -7.639 1.00 0.00 C ATOM 0 H VAL A 87 -4.090 -4.270 -8.162 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.334 -6.820 -9.169 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.242 -5.895 -6.350 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.312 -7.424 -6.182 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.820 -8.269 -6.605 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.597 -7.948 -7.859 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.930 -5.098 -6.856 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.213 -5.431 -8.581 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.169 -4.183 -7.747 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.886 -6.417 -7.165 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.982 -6.985 -6.443 1.00 0.00 C ATOM 1336 C PHE A 88 -8.061 -7.577 -7.282 1.00 0.00 C ATOM 1337 O PHE A 88 -8.457 -8.720 -7.054 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.569 -5.961 -5.457 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.637 -6.522 -4.078 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -8.345 -7.689 -3.917 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.939 -6.001 -3.013 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -8.381 -8.307 -2.689 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -7.064 -6.586 -1.775 1.00 0.00 C ATOM 1344 CZ PHE A 88 -7.756 -7.761 -1.593 1.00 0.00 C ATOM 0 H PHE A 88 -5.878 -5.398 -7.132 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.552 -7.828 -5.902 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -6.956 -5.060 -5.456 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.567 -5.668 -5.783 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.873 -8.121 -4.755 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.299 -5.141 -3.148 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.912 -9.242 -2.583 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.606 -6.109 -0.921 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.806 -8.237 -0.625 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.604 -6.783 -8.222 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.533 -7.183 -9.232 1.00 0.00 C ATOM 1356 C ASP A 89 -8.997 -8.087 -10.288 1.00 0.00 C ATOM 1357 O ASP A 89 -8.064 -7.765 -11.021 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.128 -5.875 -9.778 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.536 -6.116 -10.305 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.995 -7.251 -10.603 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.217 -5.090 -10.570 1.00 0.00 O ATOM 0 H ASP A 89 -8.376 -5.790 -8.279 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.297 -7.826 -8.794 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.151 -5.121 -8.991 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.496 -5.484 -10.575 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.386 -9.373 -10.227 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.930 -10.412 -11.098 1.00 0.00 C ATOM 1368 C LYS A 90 -9.490 -10.300 -12.475 1.00 0.00 C ATOM 1369 O LYS A 90 -8.907 -10.327 -13.557 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.369 -11.758 -10.497 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.698 -12.984 -11.119 1.00 0.00 C ATOM 1372 CD LYS A 90 -7.279 -13.267 -10.622 1.00 0.00 C ATOM 1373 CE LYS A 90 -6.786 -14.649 -11.056 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.787 -14.908 -12.513 1.00 0.00 N ATOM 0 H LYS A 90 -10.055 -9.706 -9.532 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.846 -10.331 -11.182 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.159 -11.749 -9.428 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.449 -11.856 -10.609 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.318 -13.858 -10.920 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.669 -12.854 -12.201 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.602 -12.504 -11.005 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.255 -13.198 -9.534 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.771 -14.785 -10.683 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.407 -15.403 -10.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.436 -15.870 -12.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.756 -14.818 -12.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.170 -14.219 -12.989 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.829 -10.187 -12.529 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.666 -10.070 -13.683 1.00 0.00 C ATOM 1390 C ASP A 91 -11.738 -8.715 -14.298 1.00 0.00 C ATOM 1391 O ASP A 91 -11.731 -8.667 -15.527 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.018 -10.649 -13.231 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.604 -10.058 -11.957 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.311 -10.507 -10.816 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.411 -9.101 -12.102 1.00 0.00 O ATOM 0 H ASP A 91 -11.381 -10.177 -11.671 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.248 -10.622 -14.524 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.738 -10.510 -14.037 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.902 -11.723 -13.089 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.704 -7.665 -13.457 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.623 -6.302 -13.881 1.00 0.00 C ATOM 1402 C GLY A 92 -12.983 -5.724 -14.067 1.00 0.00 C ATOM 1403 O GLY A 92 -13.178 -4.968 -15.017 1.00 0.00 O ATOM 0 H GLY A 92 -11.734 -7.770 -12.443 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.073 -5.719 -13.142 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.066 -6.240 -14.816 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.889 -5.988 -13.108 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.216 -5.496 -13.314 1.00 0.00 C ATOM 1409 C ASN A 93 -15.355 -4.241 -12.524 1.00 0.00 C ATOM 1410 O ASN A 93 -16.267 -3.450 -12.760 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.272 -6.472 -12.770 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.255 -6.937 -11.321 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.277 -6.952 -10.575 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.463 -7.380 -10.877 1.00 0.00 N ATOM 0 H ASN A 93 -13.723 -6.506 -12.245 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.370 -5.354 -14.384 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.246 -6.014 -12.944 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.225 -7.367 -13.390 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.560 -7.726 -9.922 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.271 -7.366 -11.499 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.502 -3.991 -11.514 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.462 -2.856 -10.645 1.00 0.00 C ATOM 1423 C GLY A 94 -15.023 -3.143 -9.294 1.00 0.00 C ATOM 1424 O GLY A 94 -15.154 -2.192 -8.527 1.00 0.00 O ATOM 0 H GLY A 94 -13.764 -4.656 -11.285 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.430 -2.520 -10.541 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.020 -2.037 -11.099 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.235 -4.419 -8.926 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.510 -4.760 -7.565 1.00 0.00 C ATOM 1430 C TYR A 95 -14.644 -5.889 -7.121 1.00 0.00 C ATOM 1431 O TYR A 95 -14.463 -6.871 -7.839 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.947 -5.281 -7.392 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.969 -4.292 -7.837 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.914 -2.972 -7.453 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.906 -4.697 -8.757 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.857 -2.079 -7.904 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.854 -3.817 -9.225 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.756 -2.496 -8.857 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.697 -1.632 -9.457 1.00 0.00 O ATOM 0 H TYR A 95 -15.216 -5.212 -9.568 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.339 -3.850 -6.990 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.067 -6.203 -7.960 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.117 -5.528 -6.344 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.127 -2.636 -6.794 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.898 -5.716 -9.116 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -18.891 -1.071 -7.518 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -20.655 -4.155 -9.865 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.234 -2.133 -10.105 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.107 -5.810 -5.890 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.426 -6.817 -5.136 1.00 0.00 C ATOM 1451 C ILE A 96 -14.536 -7.537 -4.451 1.00 0.00 C ATOM 1452 O ILE A 96 -15.374 -7.003 -3.726 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.381 -6.318 -4.182 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.407 -5.421 -4.962 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.626 -7.436 -3.443 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.525 -4.712 -3.935 1.00 0.00 C ATOM 0 H ILE A 96 -14.158 -4.937 -5.365 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.825 -7.451 -5.788 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.887 -5.755 -3.398 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.800 -6.015 -5.646 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.952 -4.696 -5.567 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.888 -6.995 -2.773 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.332 -8.031 -2.864 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.122 -8.075 -4.168 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.817 -4.063 -4.450 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.149 -4.114 -3.271 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.979 -5.453 -3.351 1.00 0.00 H new ATOM 1468 N SER A 97 -14.643 -8.850 -4.725 1.00 0.00 N ATOM 1469 CA SER A 97 -15.513 -9.775 -4.067 1.00 0.00 C ATOM 1470 C SER A 97 -14.963 -10.709 -3.045 1.00 0.00 C ATOM 1471 O SER A 97 -13.818 -10.521 -2.637 1.00 0.00 O ATOM 1472 CB SER A 97 -16.190 -10.696 -5.097 1.00 0.00 C ATOM 1473 OG SER A 97 -15.272 -11.594 -5.703 1.00 0.00 O ATOM 0 H SER A 97 -14.085 -9.293 -5.454 1.00 0.00 H new ATOM 0 HA SER A 97 -16.160 -9.079 -3.533 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.981 -11.264 -4.608 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.663 -10.089 -5.868 1.00 0.00 H new ATOM 0 HG SER A 97 -14.615 -11.088 -6.225 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.700 -11.700 -2.512 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.183 -12.446 -1.406 1.00 0.00 C ATOM 1481 C ALA A 98 -14.099 -13.408 -1.751 1.00 0.00 C ATOM 1482 O ALA A 98 -13.054 -13.580 -1.126 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.399 -13.145 -0.774 1.00 0.00 C ATOM 0 H ALA A 98 -16.627 -11.980 -2.834 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.687 -11.769 -0.711 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.074 -13.736 0.082 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.119 -12.396 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.866 -13.799 -1.510 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.254 -13.892 -2.996 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.291 -14.620 -3.764 1.00 0.00 C ATOM 1491 C ALA A 99 -11.910 -14.066 -3.841 1.00 0.00 C ATOM 1492 O ALA A 99 -10.929 -14.737 -3.524 1.00 0.00 O ATOM 1493 CB ALA A 99 -13.832 -14.774 -5.195 1.00 0.00 C ATOM 0 H ALA A 99 -15.127 -13.762 -3.507 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.173 -15.561 -3.227 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.112 -15.327 -5.799 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.777 -15.316 -5.170 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -13.991 -13.788 -5.632 1.00 0.00 H new ATOM 1499 N GLU A 100 -11.849 -12.831 -4.369 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.681 -12.025 -4.547 1.00 0.00 C ATOM 1501 C GLU A 100 -9.937 -11.763 -3.283 1.00 0.00 C ATOM 1502 O GLU A 100 -8.713 -11.847 -3.209 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.023 -10.806 -5.420 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.679 -11.231 -6.735 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.312 -10.119 -7.560 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.448 -9.668 -7.254 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.695 -9.580 -8.517 1.00 0.00 O ATOM 0 H GLU A 100 -12.690 -12.357 -4.699 1.00 0.00 H new ATOM 0 HA GLU A 100 -9.934 -12.586 -5.108 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.694 -10.142 -4.875 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.115 -10.240 -5.630 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.927 -11.727 -7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.447 -11.971 -6.511 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.623 -11.415 -2.179 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.027 -11.258 -0.888 1.00 0.00 C ATOM 1516 C LEU A 101 -9.412 -12.487 -0.313 1.00 0.00 C ATOM 1517 O LEU A 101 -8.284 -12.452 0.175 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.114 -10.691 0.041 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.625 -10.226 1.423 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.562 -9.115 1.384 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.872 -9.850 2.241 1.00 0.00 C ATOM 0 H LEU A 101 -11.627 -11.237 -2.185 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.178 -10.582 -0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.592 -9.848 -0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.880 -11.453 0.183 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.087 -11.043 1.905 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.276 -8.850 2.402 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.686 -9.469 0.841 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.970 -8.238 0.882 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.569 -9.513 3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.411 -9.049 1.735 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.521 -10.721 2.336 1.00 0.00 H new ATOM 1533 N ARG A 102 -9.998 -13.665 -0.589 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.497 -14.961 -0.252 1.00 0.00 C ATOM 1535 C ARG A 102 -8.300 -15.313 -1.066 1.00 0.00 C ATOM 1536 O ARG A 102 -7.169 -15.471 -0.609 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.491 -16.095 -0.555 1.00 0.00 C ATOM 1538 CG ARG A 102 -11.654 -15.989 0.434 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.944 -16.725 0.064 1.00 0.00 C ATOM 1540 NE ARG A 102 -12.661 -18.179 -0.093 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.869 -19.010 0.970 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.894 -18.776 1.840 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.249 -20.226 0.993 1.00 0.00 N ATOM 0 H ARG A 102 -10.888 -13.714 -1.085 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.287 -14.888 0.815 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -10.855 -16.018 -1.579 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.001 -17.064 -0.463 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.314 -16.364 1.399 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -11.891 -14.934 0.567 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.697 -16.572 0.837 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.352 -16.321 -0.863 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.318 -18.548 -0.980 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.511 -17.976 1.698 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.043 -19.401 2.632 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.640 -20.503 0.223 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.395 -20.858 1.780 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.380 -15.261 -2.408 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.346 -15.405 -3.385 1.00 0.00 C ATOM 1559 C HIS A 103 -6.155 -14.570 -3.061 1.00 0.00 C ATOM 1560 O HIS A 103 -5.059 -15.016 -2.724 1.00 0.00 O ATOM 1561 CB HIS A 103 -7.936 -15.134 -4.779 1.00 0.00 C ATOM 1562 CG HIS A 103 -6.917 -15.130 -5.879 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -6.401 -13.978 -6.439 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.466 -16.169 -6.632 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.628 -14.362 -7.490 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.647 -15.674 -7.626 1.00 0.00 N ATOM 0 H HIS A 103 -9.281 -15.098 -2.858 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.970 -16.428 -3.378 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.689 -15.891 -4.997 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.446 -14.171 -4.766 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.709 -17.210 -6.477 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.075 -13.686 -8.125 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.151 -16.219 -8.331 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.257 -13.231 -3.142 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.217 -12.350 -2.709 1.00 0.00 C ATOM 1576 C VAL A 104 -4.633 -12.564 -1.355 1.00 0.00 C ATOM 1577 O VAL A 104 -3.441 -12.823 -1.191 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.573 -10.909 -2.924 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.511 -9.839 -2.620 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.952 -10.786 -4.409 1.00 0.00 C ATOM 0 H VAL A 104 -7.076 -12.752 -3.515 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.399 -12.637 -3.370 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.361 -10.695 -2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.921 -8.850 -2.826 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.222 -9.901 -1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.636 -10.006 -3.248 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.223 -9.754 -4.631 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.103 -11.079 -5.027 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.799 -11.438 -4.624 1.00 0.00 H new ATOM 1590 N MET A 105 -5.437 -12.573 -0.277 1.00 0.00 N ATOM 1591 CA MET A 105 -4.811 -12.793 0.990 1.00 0.00 C ATOM 1592 C MET A 105 -4.093 -14.075 1.242 1.00 0.00 C ATOM 1593 O MET A 105 -3.151 -14.188 2.024 1.00 0.00 O ATOM 1594 CB MET A 105 -5.780 -12.587 2.167 1.00 0.00 C ATOM 1595 CG MET A 105 -6.189 -11.113 2.174 1.00 0.00 C ATOM 1596 SD MET A 105 -7.357 -10.772 3.525 1.00 0.00 S ATOM 1597 CE MET A 105 -6.155 -10.914 4.879 1.00 0.00 C ATOM 0 H MET A 105 -6.448 -12.439 -0.273 1.00 0.00 H new ATOM 0 HA MET A 105 -4.033 -12.033 0.926 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.656 -13.227 2.059 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.302 -12.857 3.109 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.304 -10.486 2.286 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.645 -10.853 1.219 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.509 -10.348 5.741 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.040 -11.962 5.155 1.00 0.00 H new ATOM 0 HE3 MET A 105 -5.193 -10.517 4.555 1.00 0.00 H new ATOM 1607 N THR A 106 -4.533 -15.139 0.547 1.00 0.00 N ATOM 1608 CA THR A 106 -3.865 -16.399 0.437 1.00 0.00 C ATOM 1609 C THR A 106 -2.588 -16.316 -0.326 1.00 0.00 C ATOM 1610 O THR A 106 -1.581 -16.914 0.052 1.00 0.00 O ATOM 1611 CB THR A 106 -4.704 -17.502 -0.137 1.00 0.00 C ATOM 1612 OG1 THR A 106 -5.901 -17.533 0.627 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.065 -18.893 0.012 1.00 0.00 C ATOM 0 H THR A 106 -5.411 -15.117 0.029 1.00 0.00 H new ATOM 0 HA THR A 106 -3.650 -16.654 1.475 1.00 0.00 H new ATOM 0 HB THR A 106 -4.842 -17.303 -1.200 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.561 -16.930 0.225 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.723 -19.644 -0.424 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.105 -18.909 -0.503 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.913 -19.112 1.069 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.617 -15.601 -1.465 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.472 -15.563 -2.321 1.00 0.00 C ATOM 1623 C ASN A 107 -0.403 -14.694 -1.752 1.00 0.00 C ATOM 1624 O ASN A 107 0.787 -14.833 -2.027 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.845 -15.082 -3.733 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.846 -16.094 -4.273 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.856 -17.251 -3.858 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.604 -15.629 -5.302 1.00 0.00 N ATOM 0 H ASN A 107 -3.417 -15.058 -1.789 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.090 -16.581 -2.394 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.279 -14.083 -3.702 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.963 -15.027 -4.372 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.241 -16.258 -5.791 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.536 -14.651 -5.585 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.792 -13.715 -0.914 1.00 0.00 N ATOM 1636 CA LEU A 108 0.075 -12.811 -0.224 1.00 0.00 C ATOM 1637 C LEU A 108 0.776 -13.491 0.901 1.00 0.00 C ATOM 1638 O LEU A 108 2.004 -13.559 0.908 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.716 -11.646 0.394 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.210 -10.570 -0.588 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -2.216 -9.657 0.134 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -0.074 -9.699 -1.152 1.00 0.00 C ATOM 0 H LEU A 108 -1.776 -13.545 -0.706 1.00 0.00 H new ATOM 0 HA LEU A 108 0.788 -12.448 -0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.580 -12.056 0.917 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.089 -11.164 1.144 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.670 -11.091 -1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.572 -8.891 -0.555 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.061 -10.251 0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.730 -9.181 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.488 -8.960 -1.838 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.435 -9.190 -0.333 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.638 -10.330 -1.685 1.00 0.00 H new ATOM 1654 N GLY A 109 0.012 -13.992 1.888 1.00 0.00 N ATOM 1655 CA GLY A 109 0.540 -14.836 2.914 1.00 0.00 C ATOM 1656 C GLY A 109 -0.047 -14.648 4.271 1.00 0.00 C ATOM 1657 O GLY A 109 0.660 -14.607 5.276 1.00 0.00 O ATOM 0 H GLY A 109 -0.988 -13.808 1.975 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.394 -15.874 2.616 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.616 -14.671 2.977 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.383 -14.522 4.360 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.182 -14.648 5.539 1.00 0.00 C ATOM 1663 C GLU A 110 -3.159 -15.771 5.462 1.00 0.00 C ATOM 1664 O GLU A 110 -3.686 -16.058 4.389 1.00 0.00 O ATOM 1665 CB GLU A 110 -2.890 -13.304 5.775 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.394 -13.077 7.202 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.309 -13.215 8.260 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -1.526 -12.262 8.516 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.165 -14.313 8.862 1.00 0.00 O ATOM 0 H GLU A 110 -1.950 -14.315 3.538 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.533 -14.891 6.380 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.202 -12.499 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.736 -13.232 5.092 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.831 -12.081 7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.190 -13.790 7.415 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.350 -16.520 6.563 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.218 -17.644 6.729 1.00 0.00 C ATOM 1678 C LYS A 111 -5.552 -17.156 7.178 1.00 0.00 C ATOM 1679 O LYS A 111 -5.635 -16.669 8.305 1.00 0.00 O ATOM 1680 CB LYS A 111 -3.640 -18.690 7.697 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.503 -19.511 7.084 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.832 -20.544 7.991 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.539 -21.137 7.428 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.263 -21.795 8.484 1.00 0.00 N ATOM 0 H LYS A 111 -2.843 -16.314 7.424 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.321 -18.154 5.771 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.275 -18.186 8.592 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.437 -19.363 8.013 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.893 -20.030 6.208 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -1.737 -18.820 6.731 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.615 -20.078 8.952 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.536 -21.354 8.181 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.779 -21.860 6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 111 0.051 -20.348 6.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.132 -22.186 8.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.512 -21.099 9.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.291 -22.564 8.913 1.00 0.00 H new ATOM 1698 N LEU A 112 -6.533 -17.024 6.268 1.00 0.00 N ATOM 1699 CA LEU A 112 -7.821 -16.420 6.418 1.00 0.00 C ATOM 1700 C LEU A 112 -8.839 -17.508 6.444 1.00 0.00 C ATOM 1701 O LEU A 112 -8.666 -18.519 5.765 1.00 0.00 O ATOM 1702 CB LEU A 112 -7.955 -15.446 5.235 1.00 0.00 C ATOM 1703 CG LEU A 112 -9.124 -14.447 5.190 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.776 -13.493 6.345 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.381 -13.880 3.784 1.00 0.00 C ATOM 0 H LEU A 112 -6.406 -17.382 5.321 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.961 -15.860 7.342 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.032 -14.868 5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.005 -16.045 4.326 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.120 -14.860 5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.542 -12.721 6.423 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.730 -14.054 7.279 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.809 -13.027 6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.218 -13.182 3.820 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.490 -13.360 3.433 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.618 -14.695 3.101 1.00 0.00 H new ATOM 1717 N THR A 113 -9.909 -17.368 7.247 1.00 0.00 N ATOM 1718 CA THR A 113 -10.951 -18.329 7.437 1.00 0.00 C ATOM 1719 C THR A 113 -12.222 -17.786 6.880 1.00 0.00 C ATOM 1720 O THR A 113 -12.386 -16.591 6.637 1.00 0.00 O ATOM 1721 CB THR A 113 -11.190 -18.892 8.806 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.679 -17.960 9.758 1.00 0.00 O ATOM 1723 CG2 THR A 113 -9.806 -19.368 9.280 1.00 0.00 C ATOM 0 H THR A 113 -10.055 -16.524 7.801 1.00 0.00 H new ATOM 0 HA THR A 113 -10.577 -19.201 6.901 1.00 0.00 H new ATOM 0 HB THR A 113 -11.955 -19.666 8.735 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.011 -17.258 9.901 1.00 0.00 H new ATOM 0 HG21 THR A 113 -9.891 -19.796 10.279 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.426 -20.124 8.593 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.119 -18.522 9.305 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.263 -18.618 6.701 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.547 -18.330 6.139 1.00 0.00 C ATOM 1733 C ASP A 114 -15.278 -17.265 6.882 1.00 0.00 C ATOM 1734 O ASP A 114 -15.839 -16.346 6.288 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.393 -19.613 6.081 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.012 -20.581 4.970 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.990 -20.181 3.775 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -14.657 -21.756 5.255 1.00 0.00 O ATOM 0 H ASP A 114 -13.195 -19.597 6.981 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.378 -17.951 5.131 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -15.310 -20.129 7.037 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.440 -19.335 5.958 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.296 -17.380 8.222 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.991 -16.430 9.033 1.00 0.00 C ATOM 1745 C GLU A 115 -15.386 -15.072 8.921 1.00 0.00 C ATOM 1746 O GLU A 115 -15.980 -13.995 8.937 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.870 -17.079 10.422 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.771 -16.472 11.500 1.00 0.00 C ATOM 1749 CD GLU A 115 -18.261 -16.554 11.205 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -18.889 -17.647 11.203 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -18.892 -15.496 10.938 1.00 0.00 O ATOM 0 H GLU A 115 -14.832 -18.126 8.741 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.028 -16.242 8.755 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.101 -18.140 10.332 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -14.834 -17.005 10.752 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.574 -16.977 12.446 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.498 -15.425 11.635 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.051 -14.978 8.791 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.325 -13.762 8.593 1.00 0.00 C ATOM 1760 C GLU A 116 -13.709 -13.063 7.335 1.00 0.00 C ATOM 1761 O GLU A 116 -13.952 -11.863 7.452 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.813 -14.032 8.664 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.393 -14.556 10.039 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.915 -14.923 10.031 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.591 -16.010 9.483 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.142 -14.035 10.480 1.00 0.00 O ATOM 0 H GLU A 116 -13.444 -15.797 8.826 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.592 -13.081 9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.537 -14.758 7.899 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.269 -13.114 8.443 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.583 -13.798 10.799 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.991 -15.429 10.302 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.752 -13.703 6.153 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.036 -13.072 4.902 1.00 0.00 C ATOM 1775 C VAL A 117 -15.224 -12.173 4.898 1.00 0.00 C ATOM 1776 O VAL A 117 -15.236 -11.037 4.425 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.193 -14.154 3.875 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.400 -13.509 2.494 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.070 -15.201 3.789 1.00 0.00 C ATOM 0 H VAL A 117 -13.581 -14.705 6.066 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.201 -12.408 4.679 1.00 0.00 H new ATOM 0 HB VAL A 117 -15.061 -14.724 4.208 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.515 -14.289 1.742 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.296 -12.888 2.513 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.536 -12.892 2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.306 -15.925 3.009 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.128 -14.706 3.552 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.978 -15.716 4.745 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.258 -12.725 5.557 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.500 -12.027 5.675 1.00 0.00 C ATOM 1791 C ASP A 118 -17.356 -10.781 6.479 1.00 0.00 C ATOM 1792 O ASP A 118 -17.786 -9.692 6.100 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.543 -12.993 6.261 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.897 -12.683 5.639 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.010 -12.823 4.392 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.854 -12.355 6.390 1.00 0.00 O ATOM 0 H ASP A 118 -16.236 -13.642 6.003 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.837 -11.698 4.692 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.260 -14.025 6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.591 -12.886 7.345 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.710 -10.853 7.657 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.433 -9.773 8.551 1.00 0.00 C ATOM 1803 C GLU A 119 -15.654 -8.626 8.004 1.00 0.00 C ATOM 1804 O GLU A 119 -15.962 -7.463 8.259 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.671 -10.358 9.752 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.805 -9.478 10.996 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.092 -10.178 12.145 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.549 -11.264 12.590 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.122 -9.547 12.642 1.00 0.00 O ATOM 0 H GLU A 119 -16.353 -11.741 8.011 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.403 -9.342 8.800 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.050 -11.356 9.971 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.617 -10.466 9.496 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.367 -8.496 10.817 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.856 -9.319 11.239 1.00 0.00 H new ATOM 1816 N MET A 120 -14.604 -8.956 7.231 1.00 0.00 N ATOM 1817 CA MET A 120 -13.707 -8.072 6.553 1.00 0.00 C ATOM 1818 C MET A 120 -14.441 -7.212 5.581 1.00 0.00 C ATOM 1819 O MET A 120 -14.283 -5.994 5.526 1.00 0.00 O ATOM 1820 CB MET A 120 -12.578 -8.875 5.885 1.00 0.00 C ATOM 1821 CG MET A 120 -11.509 -9.397 6.847 1.00 0.00 C ATOM 1822 SD MET A 120 -10.076 -10.138 6.010 1.00 0.00 S ATOM 1823 CE MET A 120 -9.631 -8.555 5.238 1.00 0.00 C ATOM 0 H MET A 120 -14.362 -9.933 7.067 1.00 0.00 H new ATOM 0 HA MET A 120 -13.249 -7.402 7.281 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.016 -9.722 5.357 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.097 -8.246 5.136 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.167 -8.576 7.477 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.958 -10.139 7.507 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.569 -8.555 4.993 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.213 -8.418 4.327 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.844 -7.740 5.930 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.381 -7.811 4.829 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.132 -7.133 3.819 1.00 0.00 C ATOM 1835 C ILE A 121 -17.060 -6.139 4.430 1.00 0.00 C ATOM 1836 O ILE A 121 -17.145 -5.001 3.971 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.892 -8.074 2.932 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.898 -8.831 2.035 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.977 -7.399 2.076 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.255 -8.023 0.908 1.00 0.00 C ATOM 0 H ILE A 121 -15.626 -8.796 4.926 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.409 -6.613 3.191 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.427 -8.761 3.588 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.104 -9.231 2.665 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.415 -9.683 1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.478 -8.150 1.465 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.706 -6.916 2.727 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.517 -6.652 1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.575 -8.662 0.345 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.031 -7.644 0.243 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.700 -7.186 1.331 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.808 -6.462 5.500 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.544 -5.497 6.256 1.00 0.00 C ATOM 1854 C ARG A 122 -17.853 -4.275 6.757 1.00 0.00 C ATOM 1855 O ARG A 122 -18.531 -3.267 6.949 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.345 -6.108 7.418 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.218 -7.338 7.166 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.638 -7.891 8.529 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.697 -9.373 8.394 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.088 -10.208 9.286 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -19.628 -9.774 10.496 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -19.983 -11.523 8.935 1.00 0.00 N ATOM 0 H ARG A 122 -17.904 -7.416 5.848 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.193 -5.139 5.457 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -18.635 -6.367 8.204 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.991 -5.325 7.817 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.094 -7.072 6.574 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -19.667 -8.090 6.600 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -19.924 -7.601 9.300 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.608 -7.491 8.826 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.209 -9.777 7.610 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -19.734 -8.795 10.761 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -19.178 -10.429 11.135 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.352 -11.843 8.039 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -19.536 -12.186 9.568 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.544 -4.268 7.063 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.859 -3.111 7.550 1.00 0.00 C ATOM 1878 C GLU A 123 -15.474 -2.157 6.473 1.00 0.00 C ATOM 1879 O GLU A 123 -15.434 -0.944 6.674 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.775 -3.331 8.619 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.863 -4.451 8.115 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.814 -4.662 9.197 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -13.039 -5.479 10.129 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.746 -3.995 9.147 1.00 0.00 O ATOM 0 H GLU A 123 -15.945 -5.089 6.969 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.631 -2.614 8.138 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.206 -2.416 8.784 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.226 -3.602 9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.430 -5.365 7.939 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.397 -4.177 7.169 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.182 -2.644 5.254 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.928 -1.824 4.111 1.00 0.00 C ATOM 1893 C ALA A 124 -16.130 -1.281 3.418 1.00 0.00 C ATOM 1894 O ALA A 124 -16.119 -0.122 3.006 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.146 -2.525 2.987 1.00 0.00 C ATOM 0 H ALA A 124 -15.121 -3.643 5.057 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.357 -1.026 4.586 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.998 -1.831 2.160 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.177 -2.850 3.366 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.708 -3.391 2.638 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.149 -2.141 3.244 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.312 -1.963 2.432 1.00 0.00 C ATOM 1903 C ASP A 125 -19.283 -1.107 3.170 1.00 0.00 C ATOM 1904 O ASP A 125 -19.746 -1.393 4.273 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.986 -3.316 2.147 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.337 -3.167 1.463 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.420 -2.306 0.547 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.261 -3.893 1.918 1.00 0.00 O ATOM 0 H ASP A 125 -17.157 -3.045 3.717 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.016 -1.502 1.490 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.330 -3.919 1.519 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.116 -3.857 3.084 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.684 0.008 2.534 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.473 1.093 3.030 1.00 0.00 C ATOM 1915 C ILE A 126 -21.860 1.004 2.493 1.00 0.00 C ATOM 1916 O ILE A 126 -22.806 1.008 3.278 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.876 2.397 2.591 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.440 2.502 3.133 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.643 3.573 3.219 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.766 3.745 2.554 1.00 0.00 C ATOM 0 H ILE A 126 -19.423 0.164 1.560 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.493 1.037 4.118 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.914 2.435 1.502 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.454 2.557 4.222 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.873 1.610 2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.199 4.513 2.892 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.686 3.536 2.905 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.588 3.505 4.305 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.749 3.819 2.938 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.739 3.671 1.467 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.329 4.632 2.844 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.042 1.046 1.161 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.354 1.012 0.594 1.00 0.00 C ATOM 1934 C ASP A 127 -24.169 -0.213 0.827 1.00 0.00 C ATOM 1935 O ASP A 127 -25.396 -0.187 0.902 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.298 1.325 -0.911 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.521 0.352 -1.787 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -21.275 0.522 -1.856 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -23.112 -0.663 -2.243 1.00 0.00 O ATOM 0 H ASP A 127 -21.285 1.103 0.480 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.884 1.787 1.148 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.320 1.377 -1.285 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -22.862 2.316 -1.036 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.553 -1.400 0.979 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.336 -2.475 1.504 1.00 0.00 C ATOM 1946 C GLY A 128 -24.486 -3.662 0.615 1.00 0.00 C ATOM 1947 O GLY A 128 -25.368 -4.499 0.803 1.00 0.00 O ATOM 0 H GLY A 128 -22.580 -1.609 0.756 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.888 -2.802 2.442 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.329 -2.094 1.741 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.626 -3.808 -0.409 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.640 -4.853 -1.384 1.00 0.00 C ATOM 1953 C ASP A 129 -22.699 -5.971 -1.092 1.00 0.00 C ATOM 1954 O ASP A 129 -22.902 -7.080 -1.584 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.374 -4.303 -2.795 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.954 -3.822 -3.057 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.181 -3.530 -2.106 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.652 -3.762 -4.279 1.00 0.00 O ATOM 0 H ASP A 129 -22.866 -3.146 -0.565 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.645 -5.271 -1.335 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.614 -5.081 -3.520 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.058 -3.475 -2.977 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.686 -5.852 -0.216 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.817 -6.877 0.273 1.00 0.00 C ATOM 1965 C GLY A 130 -19.694 -6.931 -0.705 1.00 0.00 C ATOM 1966 O GLY A 130 -18.987 -7.927 -0.847 1.00 0.00 O ATOM 0 H GLY A 130 -21.454 -4.945 0.189 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.457 -6.644 1.275 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.333 -7.835 0.335 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.517 -5.769 -1.359 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.474 -5.568 -2.316 1.00 0.00 C ATOM 1972 C GLN A 131 -17.681 -4.343 -2.017 1.00 0.00 C ATOM 1973 O GLN A 131 -18.189 -3.293 -1.627 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.881 -5.573 -3.800 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.589 -6.879 -4.167 1.00 0.00 C ATOM 1976 CD GLN A 131 -20.000 -6.980 -5.629 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -19.438 -7.719 -6.436 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.120 -6.276 -5.946 1.00 0.00 N ATOM 0 H GLN A 131 -20.111 -4.952 -1.220 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.865 -6.463 -2.192 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.539 -4.728 -4.004 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.997 -5.446 -4.424 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.931 -7.715 -3.928 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.477 -6.984 -3.544 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.558 -5.673 -5.249 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.522 -6.351 -6.880 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.344 -4.394 -2.156 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.524 -3.222 -2.159 1.00 0.00 C ATOM 1989 C VAL A 132 -15.316 -2.675 -3.529 1.00 0.00 C ATOM 1990 O VAL A 132 -14.644 -3.226 -4.400 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.219 -3.450 -1.456 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.188 -2.314 -1.560 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.533 -3.775 0.014 1.00 0.00 C ATOM 0 H VAL A 132 -15.823 -5.264 -2.268 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.071 -2.465 -1.597 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.727 -4.278 -1.967 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.286 -2.590 -1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.940 -2.142 -2.607 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.606 -1.403 -1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.603 -3.947 0.555 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.066 -2.939 0.466 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.153 -4.670 0.064 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.829 -1.458 -3.782 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.664 -0.637 -4.941 1.00 0.00 C ATOM 2005 C ASN A 133 -14.401 0.152 -4.897 1.00 0.00 C ATOM 2006 O ASN A 133 -13.613 0.138 -3.953 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.936 0.039 -5.480 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.320 1.312 -4.741 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.521 2.044 -4.157 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.647 1.580 -4.618 1.00 0.00 N ATOM 0 H ASN A 133 -16.427 -1.001 -3.094 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.502 -1.314 -5.780 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.792 0.273 -6.535 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.764 -0.668 -5.420 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.957 2.371 -4.053 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.332 0.991 -5.091 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.077 0.989 -5.899 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.874 1.761 -5.914 1.00 0.00 C ATOM 2019 C TYR A 134 -12.902 2.865 -4.914 1.00 0.00 C ATOM 2020 O TYR A 134 -11.904 3.143 -4.251 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.758 2.397 -7.310 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.430 3.057 -7.453 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -10.322 2.257 -7.603 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.329 4.418 -7.618 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.089 2.856 -7.712 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.101 4.981 -7.876 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.966 4.208 -7.929 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.729 4.858 -8.127 1.00 0.00 O ATOM 0 H TYR A 134 -14.666 1.132 -6.719 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.037 1.106 -5.673 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.880 1.634 -8.079 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.555 3.126 -7.455 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -10.418 1.182 -7.635 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.208 5.041 -7.546 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.198 2.251 -7.625 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.028 6.046 -8.039 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.881 5.817 -8.263 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.051 3.481 -4.583 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.226 4.502 -3.597 1.00 0.00 C ATOM 2040 C GLU A 135 -14.014 3.953 -2.228 1.00 0.00 C ATOM 2041 O GLU A 135 -13.437 4.629 -1.378 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.529 5.302 -3.766 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.400 6.470 -4.746 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.726 7.035 -5.232 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.782 6.375 -5.040 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.700 8.082 -5.933 1.00 0.00 O ATOM 0 H GLU A 135 -14.929 3.244 -5.044 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.450 5.251 -3.756 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.316 4.632 -4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.841 5.685 -2.794 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.833 7.268 -4.267 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.821 6.141 -5.609 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.529 2.725 -2.037 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.498 2.130 -0.737 1.00 0.00 C ATOM 2055 C GLU A 136 -13.134 1.591 -0.472 1.00 0.00 C ATOM 2056 O GLU A 136 -12.790 1.560 0.708 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.498 0.962 -0.690 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.952 1.429 -0.776 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.992 0.324 -0.894 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.762 -0.418 -1.886 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.011 0.110 -0.184 1.00 0.00 O ATOM 0 H GLU A 136 -14.958 2.154 -2.765 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.757 2.881 0.009 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.291 0.278 -1.513 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.354 0.402 0.234 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.177 2.022 0.110 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.052 2.091 -1.636 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.383 1.309 -1.551 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.010 0.906 -1.545 1.00 0.00 C ATOM 2070 C PHE A 137 -10.110 2.026 -1.153 1.00 0.00 C ATOM 2071 O PHE A 137 -9.184 1.795 -0.376 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.598 0.343 -2.916 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.240 -0.269 -2.948 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.014 -1.560 -2.532 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.170 0.483 -3.375 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.798 -2.151 -2.783 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.999 -0.133 -3.746 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.800 -1.454 -3.421 1.00 0.00 C ATOM 0 H PHE A 137 -12.763 1.367 -2.496 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.907 0.118 -0.799 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.328 -0.406 -3.222 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.639 1.146 -3.652 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.787 -2.106 -2.011 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.250 1.559 -3.419 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.626 -3.172 -2.476 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.242 0.415 -4.288 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.867 -1.940 -3.665 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.417 3.246 -1.627 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.647 4.400 -1.282 1.00 0.00 C ATOM 2090 C VAL A 138 -9.799 4.760 0.156 1.00 0.00 C ATOM 2091 O VAL A 138 -8.824 4.930 0.885 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.160 5.595 -2.030 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.570 6.946 -1.592 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.727 5.389 -3.491 1.00 0.00 C ATOM 0 H VAL A 138 -11.201 3.434 -2.251 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.611 4.157 -1.519 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.234 5.650 -1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -10.005 7.745 -2.193 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.797 7.118 -0.540 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.489 6.934 -1.732 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.071 6.229 -4.094 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.640 5.326 -3.543 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.163 4.466 -3.873 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.023 4.650 0.704 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.257 4.977 2.076 1.00 0.00 C ATOM 2106 C GLN A 139 -10.626 3.990 2.997 1.00 0.00 C ATOM 2107 O GLN A 139 -10.066 4.299 4.048 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.778 4.895 2.286 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.517 6.140 1.792 1.00 0.00 C ATOM 2110 CD GLN A 139 -15.018 5.898 1.864 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -15.647 6.088 2.904 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -15.593 5.346 0.762 1.00 0.00 N ATOM 0 H GLN A 139 -11.850 4.335 0.197 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.838 5.960 2.289 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.165 4.019 1.765 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -12.986 4.753 3.347 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.247 7.003 2.401 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.223 6.369 0.768 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.041 5.203 -0.084 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -16.576 5.075 0.781 1.00 0.00 H new ATOM 2121 N MET A 140 -10.479 2.731 2.546 1.00 0.00 N ATOM 2122 CA MET A 140 -9.844 1.687 3.289 1.00 0.00 C ATOM 2123 C MET A 140 -8.394 1.906 3.550 1.00 0.00 C ATOM 2124 O MET A 140 -7.890 1.734 4.659 1.00 0.00 O ATOM 2125 CB MET A 140 -10.202 0.447 2.453 1.00 0.00 C ATOM 2126 CG MET A 140 -9.722 -0.835 3.137 1.00 0.00 C ATOM 2127 SD MET A 140 -8.002 -1.281 2.753 1.00 0.00 S ATOM 2128 CE MET A 140 -8.271 -1.628 0.991 1.00 0.00 C ATOM 0 H MET A 140 -10.814 2.429 1.631 1.00 0.00 H new ATOM 0 HA MET A 140 -10.188 1.605 4.320 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.281 0.403 2.306 1.00 0.00 H new ATOM 0 HB3 MET A 140 -9.749 0.527 1.465 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.824 -0.718 4.216 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.374 -1.657 2.842 1.00 0.00 H new ATOM 0 HE1 MET A 140 -7.614 -2.438 0.675 1.00 0.00 H new ATOM 0 HE2 MET A 140 -9.309 -1.920 0.832 1.00 0.00 H new ATOM 0 HE3 MET A 140 -8.051 -0.735 0.407 1.00 0.00 H new ATOM 2138 N MET A 141 -7.683 2.566 2.618 1.00 0.00 N ATOM 2139 CA MET A 141 -6.355 3.061 2.811 1.00 0.00 C ATOM 2140 C MET A 141 -6.222 4.219 3.739 1.00 0.00 C ATOM 2141 O MET A 141 -5.455 4.191 4.700 1.00 0.00 O ATOM 2142 CB MET A 141 -5.724 3.425 1.457 1.00 0.00 C ATOM 2143 CG MET A 141 -5.634 2.304 0.419 1.00 0.00 C ATOM 2144 SD MET A 141 -4.390 0.996 0.640 1.00 0.00 S ATOM 2145 CE MET A 141 -4.729 0.467 -1.064 1.00 0.00 C ATOM 0 H MET A 141 -8.051 2.763 1.687 1.00 0.00 H new ATOM 0 HA MET A 141 -5.827 2.239 3.294 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.297 4.245 1.024 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.717 3.801 1.640 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.611 1.824 0.368 1.00 0.00 H new ATOM 0 HG3 MET A 141 -5.455 2.767 -0.551 1.00 0.00 H new ATOM 0 HE1 MET A 141 -4.732 -0.622 -1.113 1.00 0.00 H new ATOM 0 HE2 MET A 141 -5.702 0.847 -1.376 1.00 0.00 H new ATOM 0 HE3 MET A 141 -3.957 0.858 -1.727 1.00 0.00 H new ATOM 2155 N THR A 142 -6.872 5.317 3.314 1.00 0.00 N ATOM 2156 CA THR A 142 -6.622 6.657 3.747 1.00 0.00 C ATOM 2157 C THR A 142 -6.830 6.909 5.234 1.00 0.00 C ATOM 2158 O THR A 142 -5.905 7.535 5.817 1.00 0.00 O ATOM 2159 CB THR A 142 -7.481 7.643 3.013 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.869 7.442 3.238 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.224 7.787 1.504 1.00 0.00 C ATOM 0 H THR A 142 -7.621 5.265 2.623 1.00 0.00 H new ATOM 0 HA THR A 142 -5.563 6.793 3.526 1.00 0.00 H new ATOM 0 HB THR A 142 -7.164 8.586 3.459 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.382 8.111 2.739 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.906 8.528 1.088 1.00 0.00 H new ATOM 0 HG22 THR A 142 -6.195 8.108 1.339 1.00 0.00 H new ATOM 0 HG23 THR A 142 -7.388 6.827 1.014 1.00 0.00 H new ATOM 2170 N ARG B 1 -9.969 -2.082 9.986 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.197 -2.488 11.182 1.00 0.00 C ATOM 2172 C ARG B 1 -7.864 -3.038 10.807 1.00 0.00 C ATOM 2173 O ARG B 1 -7.290 -2.651 9.790 1.00 0.00 O ATOM 2174 CB ARG B 1 -10.109 -3.387 12.033 1.00 0.00 C ATOM 2175 CG ARG B 1 -11.423 -2.822 12.578 1.00 0.00 C ATOM 2176 CD ARG B 1 -12.130 -3.649 13.654 1.00 0.00 C ATOM 2177 NE ARG B 1 -12.510 -4.863 12.877 1.00 0.00 N ATOM 2178 CZ ARG B 1 -12.886 -6.127 13.228 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -12.613 -6.542 14.500 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -13.302 -7.053 12.316 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.623 -1.314 10.239 1.00 0.00 H new ATOM 0 H2 ARG B 1 -9.316 -1.751 9.247 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.511 -2.895 9.630 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.923 -1.642 11.812 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -10.353 -4.265 11.435 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -9.524 -3.734 12.885 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -11.225 -1.831 12.986 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -12.110 -2.691 11.742 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -11.473 -3.884 14.491 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -12.998 -3.134 14.065 1.00 0.00 H new ATOM 0 HE ARG B 1 -12.483 -4.718 11.868 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -12.143 -5.914 15.152 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -12.879 -7.480 14.798 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -13.341 -6.812 11.326 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -13.574 -7.986 12.625 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.230 -3.939 11.579 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.959 -4.527 11.293 1.00 0.00 C ATOM 2195 C ARG B 2 -5.811 -5.340 10.053 1.00 0.00 C ATOM 2196 O ARG B 2 -4.827 -5.286 9.317 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.411 -5.386 12.445 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.015 -5.946 12.165 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.310 -6.379 13.453 1.00 0.00 C ATOM 2200 NE ARG B 2 -2.726 -5.146 14.052 1.00 0.00 N ATOM 2201 CZ ARG B 2 -1.787 -5.140 15.043 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -1.354 -6.296 15.625 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.293 -3.939 15.463 1.00 0.00 N ATOM 0 H ARG B 2 -7.630 -4.276 12.455 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.387 -3.612 11.139 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.379 -4.786 13.354 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -6.097 -6.212 12.632 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.093 -6.798 11.489 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -3.415 -5.191 11.658 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.013 -6.849 14.141 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -2.533 -7.113 13.241 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.050 -4.246 13.698 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -1.733 -7.193 15.321 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -0.651 -6.263 16.364 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.626 -3.074 15.038 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -0.591 -3.907 16.202 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.800 -6.223 9.828 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.781 -7.157 8.746 1.00 0.00 C ATOM 2219 C LYS B 3 -6.706 -6.501 7.410 1.00 0.00 C ATOM 2220 O LYS B 3 -5.867 -6.820 6.569 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.882 -8.230 8.802 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.702 -9.108 10.042 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.910 -10.037 10.170 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.892 -10.875 11.450 1.00 0.00 C ATOM 2225 NZ LYS B 3 -10.147 -11.635 11.645 1.00 0.00 N ATOM 0 H LYS B 3 -7.633 -6.289 10.413 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.848 -7.702 8.888 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.863 -7.754 8.823 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.846 -8.846 7.903 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.785 -9.691 9.961 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.608 -8.487 10.933 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.823 -9.441 10.146 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.941 -10.703 9.308 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.052 -11.569 11.415 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -8.730 -10.221 12.307 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.431 -11.586 12.644 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -10.897 -11.226 11.052 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.997 -12.628 11.376 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.513 -5.485 7.059 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.482 -4.668 5.885 1.00 0.00 C ATOM 2241 C TRP B 4 -6.283 -3.784 5.866 1.00 0.00 C ATOM 2242 O TRP B 4 -5.819 -3.428 4.784 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.760 -3.868 5.582 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.793 -4.637 4.792 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.919 -5.092 5.416 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.916 -4.950 3.392 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.824 -5.506 4.475 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.217 -5.444 3.243 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.150 -4.734 2.280 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.719 -5.679 1.992 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.687 -4.972 1.036 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.970 -5.434 0.865 1.00 0.00 C ATOM 0 H TRP B 4 -8.277 -5.205 7.674 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.418 -5.391 5.071 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -9.205 -3.543 6.523 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.491 -2.968 5.029 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.072 -5.121 6.485 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.781 -5.808 4.657 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.134 -4.380 2.377 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.723 -6.064 1.888 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.079 -4.789 0.163 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.377 -5.599 -0.122 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.694 -3.343 6.992 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.630 -2.387 6.972 1.00 0.00 C ATOM 2265 C GLN B 5 -3.379 -3.032 6.482 1.00 0.00 C ATOM 2266 O GLN B 5 -2.654 -2.551 5.613 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.448 -1.693 8.332 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.355 -0.623 8.370 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.774 0.718 7.785 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -3.210 1.426 6.952 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -4.919 1.182 8.355 1.00 0.00 N ATOM 0 H GLN B 5 -5.959 -3.653 7.927 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.892 -1.591 6.274 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.394 -1.235 8.619 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.220 -2.450 9.082 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -3.044 -0.474 9.404 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -2.485 -0.989 7.825 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -5.409 0.617 9.049 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -5.288 2.095 8.088 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.169 -4.279 6.941 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.150 -5.179 6.498 1.00 0.00 C ATOM 2282 C LYS B 6 -2.382 -5.661 5.107 1.00 0.00 C ATOM 2283 O LYS B 6 -1.436 -5.747 4.326 1.00 0.00 O ATOM 2284 CB LYS B 6 -1.836 -6.313 7.487 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.703 -7.573 7.432 1.00 0.00 C ATOM 2286 CD LYS B 6 -2.407 -8.511 8.604 1.00 0.00 C ATOM 2287 CE LYS B 6 -3.576 -9.454 8.897 1.00 0.00 C ATOM 2288 NZ LYS B 6 -3.076 -10.581 9.716 1.00 0.00 N ATOM 0 H LYS B 6 -3.752 -4.685 7.672 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.236 -4.585 6.471 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.800 -6.613 7.333 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.903 -5.905 8.496 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.756 -7.292 7.447 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.526 -8.096 6.492 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.516 -9.098 8.382 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.187 -7.921 9.493 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -4.368 -8.923 9.426 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -4.007 -9.824 7.967 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.843 -11.267 9.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.288 -11.046 9.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.745 -10.223 10.635 1.00 0.00 H new ATOM 2302 N THR B 7 -3.619 -5.968 4.678 1.00 0.00 N ATOM 2303 CA THR B 7 -4.028 -6.208 3.329 1.00 0.00 C ATOM 2304 C THR B 7 -3.749 -5.108 2.363 1.00 0.00 C ATOM 2305 O THR B 7 -3.216 -5.250 1.264 1.00 0.00 O ATOM 2306 CB THR B 7 -5.477 -6.517 3.096 1.00 0.00 C ATOM 2307 OG1 THR B 7 -5.865 -7.638 3.875 1.00 0.00 O ATOM 2308 CG2 THR B 7 -5.926 -6.917 1.681 1.00 0.00 C ATOM 0 H THR B 7 -4.397 -6.055 5.331 1.00 0.00 H new ATOM 0 HA THR B 7 -3.409 -7.088 3.153 1.00 0.00 H new ATOM 0 HB THR B 7 -5.932 -5.558 3.342 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.875 -7.390 4.823 1.00 0.00 H new ATOM 0 HG21 THR B 7 -6.999 -7.107 1.680 1.00 0.00 H new ATOM 0 HG22 THR B 7 -5.700 -6.109 0.985 1.00 0.00 H new ATOM 0 HG23 THR B 7 -5.398 -7.819 1.373 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.974 -3.878 2.858 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.787 -2.616 2.212 1.00 0.00 C ATOM 2318 C GLY B 8 -2.335 -2.352 2.009 1.00 0.00 C ATOM 2319 O GLY B 8 -1.823 -2.123 0.914 1.00 0.00 O ATOM 0 H GLY B 8 -4.323 -3.758 3.809 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -4.303 -2.611 1.252 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.228 -1.822 2.815 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.521 -2.483 3.072 1.00 0.00 N ATOM 2324 CA HIS B 9 -0.105 -2.312 3.178 1.00 0.00 C ATOM 2325 C HIS B 9 0.601 -3.162 2.178 1.00 0.00 C ATOM 2326 O HIS B 9 1.502 -2.809 1.419 1.00 0.00 O ATOM 2327 CB HIS B 9 0.536 -2.677 4.527 1.00 0.00 C ATOM 2328 CG HIS B 9 1.924 -2.116 4.620 1.00 0.00 C ATOM 2329 ND1 HIS B 9 2.264 -0.796 4.835 1.00 0.00 N ATOM 2330 CD2 HIS B 9 3.084 -2.816 4.734 1.00 0.00 C ATOM 2331 CE1 HIS B 9 3.620 -0.698 4.869 1.00 0.00 C ATOM 2332 NE2 HIS B 9 4.121 -1.919 4.890 1.00 0.00 N ATOM 0 H HIS B 9 -1.914 -2.744 3.976 1.00 0.00 H new ATOM 0 HA HIS B 9 0.010 -1.239 3.025 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -0.074 -2.289 5.343 1.00 0.00 H new ATOM 0 HB3 HIS B 9 0.567 -3.761 4.640 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.178 -3.892 4.707 1.00 0.00 H new ATOM 0 HE1 HIS B 9 4.189 0.220 4.877 1.00 0.00 H new ATOM 0 HE2 HIS B 9 5.106 -2.159 5.002 1.00 0.00 H new ATOM 2340 N ALA B 10 0.158 -4.432 2.154 1.00 0.00 N ATOM 2341 CA ALA B 10 0.582 -5.477 1.275 1.00 0.00 C ATOM 2342 C ALA B 10 0.425 -5.185 -0.178 1.00 0.00 C ATOM 2343 O ALA B 10 1.389 -5.149 -0.941 1.00 0.00 O ATOM 2344 CB ALA B 10 -0.154 -6.797 1.564 1.00 0.00 C ATOM 0 H ALA B 10 -0.558 -4.753 2.806 1.00 0.00 H new ATOM 0 HA ALA B 10 1.649 -5.561 1.484 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.195 -7.567 0.876 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.047 -7.109 2.589 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -1.226 -6.652 1.432 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.823 -4.986 -0.636 1.00 0.00 N ATOM 2351 CA VAL B 11 -1.180 -4.770 -2.004 1.00 0.00 C ATOM 2352 C VAL B 11 -0.812 -3.424 -2.526 1.00 0.00 C ATOM 2353 O VAL B 11 -0.547 -3.267 -3.717 1.00 0.00 O ATOM 2354 CB VAL B 11 -2.646 -5.063 -2.127 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -3.499 -3.893 -1.609 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.985 -5.332 -3.603 1.00 0.00 C ATOM 0 H VAL B 11 -1.631 -4.975 -0.014 1.00 0.00 H new ATOM 0 HA VAL B 11 -0.600 -5.442 -2.636 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.873 -5.940 -1.520 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -4.556 -4.139 -1.713 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -3.270 -3.713 -0.559 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -3.277 -2.996 -2.188 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -4.050 -5.546 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.736 -4.454 -4.199 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -2.410 -6.187 -3.958 1.00 0.00 H new ATOM 2366 N ARG B 12 -0.639 -2.432 -1.634 1.00 0.00 N ATOM 2367 CA ARG B 12 -0.112 -1.170 -2.053 1.00 0.00 C ATOM 2368 C ARG B 12 1.353 -1.183 -2.320 1.00 0.00 C ATOM 2369 O ARG B 12 1.792 -0.479 -3.228 1.00 0.00 O ATOM 2370 CB ARG B 12 -0.594 0.006 -1.187 1.00 0.00 C ATOM 2371 CG ARG B 12 0.258 0.165 0.074 1.00 0.00 C ATOM 2372 CD ARG B 12 -0.299 1.044 1.195 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.561 2.432 0.721 1.00 0.00 N ATOM 2374 CZ ARG B 12 -1.353 3.317 1.394 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.971 2.855 2.520 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -1.428 4.608 0.957 1.00 0.00 N ATOM 0 H ARG B 12 -0.859 -2.500 -0.640 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.550 -0.987 -3.034 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.557 0.926 -1.770 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -1.635 -0.152 -0.906 1.00 0.00 H new ATOM 0 HG2 ARG B 12 0.441 -0.828 0.484 1.00 0.00 H new ATOM 0 HG3 ARG B 12 1.225 0.570 -0.222 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -1.223 0.608 1.576 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.408 1.069 2.025 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.127 2.736 -0.150 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.829 1.890 2.820 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -2.574 3.474 3.061 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -0.896 4.901 0.137 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -2.016 5.280 1.450 1.00 0.00 H new ATOM 2390 N ALA B 13 2.104 -2.007 -1.567 1.00 0.00 N ATOM 2391 CA ALA B 13 3.472 -2.281 -1.880 1.00 0.00 C ATOM 2392 C ALA B 13 3.589 -2.688 -3.308 1.00 0.00 C ATOM 2393 O ALA B 13 4.466 -2.199 -4.019 1.00 0.00 O ATOM 2394 CB ALA B 13 4.164 -3.305 -0.965 1.00 0.00 C ATOM 0 H ALA B 13 1.760 -2.487 -0.735 1.00 0.00 H new ATOM 0 HA ALA B 13 4.006 -1.348 -1.699 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.196 -3.441 -1.287 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.149 -2.943 0.063 1.00 0.00 H new ATOM 0 HB3 ALA B 13 3.638 -4.258 -1.022 1.00 0.00 H new ATOM 2400 N ILE B 14 2.742 -3.636 -3.748 1.00 0.00 N ATOM 2401 CA ILE B 14 2.662 -4.090 -5.101 1.00 0.00 C ATOM 2402 C ILE B 14 2.311 -3.037 -6.095 1.00 0.00 C ATOM 2403 O ILE B 14 2.999 -2.903 -7.106 1.00 0.00 O ATOM 2404 CB ILE B 14 1.789 -5.300 -5.254 1.00 0.00 C ATOM 2405 CG1 ILE B 14 2.169 -6.455 -4.313 1.00 0.00 C ATOM 2406 CG2 ILE B 14 1.785 -5.855 -6.688 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.562 -7.044 -4.532 1.00 0.00 C ATOM 0 H ILE B 14 2.082 -4.108 -3.130 1.00 0.00 H new ATOM 0 HA ILE B 14 3.685 -4.382 -5.339 1.00 0.00 H new ATOM 0 HB ILE B 14 0.797 -4.933 -4.992 1.00 0.00 H new ATOM 0 HG12 ILE B 14 2.100 -6.102 -3.284 1.00 0.00 H new ATOM 0 HG13 ILE B 14 1.434 -7.252 -4.427 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.136 -6.730 -6.738 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.417 -5.091 -7.373 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.799 -6.138 -6.971 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.732 -7.851 -3.819 1.00 0.00 H new ATOM 0 HD12 ILE B 14 3.636 -7.435 -5.547 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.313 -6.267 -4.387 1.00 0.00 H new ATOM 2419 N GLY B 15 1.213 -2.292 -5.874 1.00 0.00 N ATOM 2420 CA GLY B 15 0.940 -1.047 -6.522 1.00 0.00 C ATOM 2421 C GLY B 15 2.103 -0.155 -6.789 1.00 0.00 C ATOM 2422 O GLY B 15 2.298 0.464 -7.833 1.00 0.00 O ATOM 0 H GLY B 15 0.485 -2.569 -5.216 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.451 -1.260 -7.473 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.224 -0.497 -5.911 1.00 0.00 H new ATOM 2426 N ARG B 16 2.958 0.096 -5.781 1.00 0.00 N ATOM 2427 CA ARG B 16 4.155 0.852 -5.982 1.00 0.00 C ATOM 2428 C ARG B 16 5.263 0.173 -6.711 1.00 0.00 C ATOM 2429 O ARG B 16 5.962 0.862 -7.452 1.00 0.00 O ATOM 2430 CB ARG B 16 4.726 1.217 -4.601 1.00 0.00 C ATOM 2431 CG ARG B 16 3.903 2.124 -3.685 1.00 0.00 C ATOM 2432 CD ARG B 16 4.558 2.557 -2.372 1.00 0.00 C ATOM 2433 NE ARG B 16 5.100 3.941 -2.473 1.00 0.00 N ATOM 2434 CZ ARG B 16 4.359 5.082 -2.587 1.00 0.00 C ATOM 2435 NH1 ARG B 16 3.012 5.142 -2.378 1.00 0.00 N ATOM 2436 NH2 ARG B 16 5.013 6.209 -2.993 1.00 0.00 N ATOM 0 H ARG B 16 2.819 -0.226 -4.823 1.00 0.00 H new ATOM 0 HA ARG B 16 3.842 1.693 -6.600 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.914 0.287 -4.064 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.693 1.695 -4.758 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.638 3.021 -4.244 1.00 0.00 H new ATOM 0 HG3 ARG B 16 2.972 1.611 -3.447 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.828 2.507 -1.564 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.362 1.866 -2.118 1.00 0.00 H new ATOM 0 HE ARG B 16 6.114 4.045 -2.455 1.00 0.00 H new ATOM 0 HH11 ARG B 16 2.498 4.300 -2.119 1.00 0.00 H new ATOM 0 HH12 ARG B 16 2.519 6.029 -2.480 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.012 6.174 -3.196 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.503 7.087 -3.093 1.00 0.00 H new