USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 792 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 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 97 GLN : amide:sc= 0.0321 K(o=0.71,f=-0.86) USER MOD Set 1.3: A 101 ASN : amide:sc= 0.681 K(o=0.71,f=-0.37) USER MOD Set 2.1: A 29 CYS SG : rot 170:sc= -0.036 USER MOD Set 2.2: A 32 CYS SG : rot 68:sc= -0.692 USER MOD Set 3.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 10 SER OG : rot 180:sc= 0.318 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -92:sc= 1.24 USER MOD Single : A 16 SER OG : rot -82:sc= 1.23 USER MOD Single : A 33 LYS NZ :NH3+ -164:sc= 0.995 (180deg=0.813) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0.58 K(o=0.58,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 144:sc= 2.17 (180deg=1.28) USER MOD Single : A 51 LYS NZ :NH3+ 165:sc= 3.66 (180deg=3.43) USER MOD Single : A 54 LYS NZ :NH3+ 174:sc= 1.28 (180deg=1.17) USER MOD Single : A 60 ASN : amide:sc= 0.923 K(o=0.92,f=-6.3!) USER MOD Single : A 61 GLN : amide:sc= -2.06! C(o=-2.1!,f=-2.2!) USER MOD Single : A 63 THR OG1 : rot -53:sc= 0.759 USER MOD Single : A 66 LYS NZ :NH3+ -169:sc= 1.92 (180deg=1.67) USER MOD Single : A 67 TYR OH : rot -131:sc= 0.646 USER MOD Single : A 70 MET CE :methyl 156:sc= -0.0541 (180deg=-0.326) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 122:sc= 1.24 USER MOD Single : A 79 LYS NZ :NH3+ -155:sc= 2.23 (180deg=1.32) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 7:sc= 0.418 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 163:sc= 2.41 (180deg=2.39) USER MOD Single : A 102 LYS NZ :NH3+ 140:sc= 1.26 (180deg=0.823) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 30 N ILE A 3 -1.239 -4.486 -3.303 1.00 0.00 N ATOM 31 CA ILE A 3 -2.581 -4.865 -3.718 1.00 0.00 C ATOM 32 C ILE A 3 -3.045 -5.991 -2.776 1.00 0.00 C ATOM 33 O ILE A 3 -2.227 -6.734 -2.222 1.00 0.00 O ATOM 34 CB ILE A 3 -2.526 -5.273 -5.211 1.00 0.00 C ATOM 35 CG1 ILE A 3 -2.023 -4.065 -6.042 1.00 0.00 C ATOM 36 CG2 ILE A 3 -3.879 -5.796 -5.740 1.00 0.00 C ATOM 37 CD1 ILE A 3 -1.822 -4.343 -7.527 1.00 0.00 C ATOM 0 HA ILE A 3 -3.306 -4.054 -3.644 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.831 -6.106 -5.312 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.736 -3.247 -5.934 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.078 -3.722 -5.621 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.779 -6.066 -6.791 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.179 -6.673 -5.167 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.636 -5.018 -5.636 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.469 -3.438 -8.022 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.085 -5.136 -7.652 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.768 -4.654 -7.970 1.00 0.00 H new ATOM 49 N VAL A 4 -4.356 -6.127 -2.599 1.00 0.00 N ATOM 50 CA VAL A 4 -5.003 -7.029 -1.655 1.00 0.00 C ATOM 51 C VAL A 4 -6.052 -7.812 -2.460 1.00 0.00 C ATOM 52 O VAL A 4 -6.329 -7.489 -3.619 1.00 0.00 O ATOM 53 CB VAL A 4 -5.586 -6.190 -0.482 1.00 0.00 C ATOM 54 CG1 VAL A 4 -6.118 -7.046 0.679 1.00 0.00 C ATOM 55 CG2 VAL A 4 -4.550 -5.218 0.117 1.00 0.00 C ATOM 0 H VAL A 4 -5.029 -5.583 -3.138 1.00 0.00 H new ATOM 0 HA VAL A 4 -4.325 -7.746 -1.193 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.410 -5.643 -0.940 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.509 -6.395 1.461 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -6.914 -7.697 0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.309 -7.654 1.084 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.007 -4.656 0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.699 -5.783 0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.211 -4.527 -0.655 1.00 0.00 H new ATOM 65 N LYS A 5 -6.649 -8.852 -1.881 1.00 0.00 N ATOM 66 CA LYS A 5 -7.800 -9.540 -2.447 1.00 0.00 C ATOM 67 C LYS A 5 -8.802 -9.825 -1.337 1.00 0.00 C ATOM 68 O LYS A 5 -8.404 -9.938 -0.175 1.00 0.00 O ATOM 69 CB LYS A 5 -7.361 -10.801 -3.210 1.00 0.00 C ATOM 70 CG LYS A 5 -6.929 -12.032 -2.386 1.00 0.00 C ATOM 71 CD LYS A 5 -5.657 -11.882 -1.534 1.00 0.00 C ATOM 72 CE LYS A 5 -4.447 -11.436 -2.372 1.00 0.00 C ATOM 73 NZ LYS A 5 -3.179 -11.470 -1.597 1.00 0.00 N ATOM 0 H LYS A 5 -6.339 -9.244 -0.992 1.00 0.00 H new ATOM 0 HA LYS A 5 -8.295 -8.907 -3.183 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -8.185 -11.104 -3.856 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.530 -10.526 -3.860 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -7.751 -12.304 -1.724 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.782 -12.866 -3.072 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.836 -11.155 -0.742 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.431 -12.832 -1.050 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -4.354 -12.083 -3.244 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.617 -10.425 -2.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.393 -11.161 -2.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.255 -10.833 -0.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.001 -12.440 -1.266 1.00 0.00 H new ATOM 87 N ALA A 6 -10.080 -9.934 -1.687 1.00 0.00 N ATOM 88 CA ALA A 6 -11.158 -10.204 -0.748 1.00 0.00 C ATOM 89 C ALA A 6 -12.216 -11.085 -1.409 1.00 0.00 C ATOM 90 O ALA A 6 -12.149 -11.367 -2.608 1.00 0.00 O ATOM 91 CB ALA A 6 -11.769 -8.880 -0.271 1.00 0.00 C ATOM 0 H ALA A 6 -10.399 -9.835 -2.651 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.763 -10.736 0.118 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.576 -9.084 0.432 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.002 -8.282 0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -12.163 -8.332 -1.127 1.00 0.00 H new ATOM 97 N THR A 7 -13.215 -11.484 -0.626 1.00 0.00 N ATOM 98 CA THR A 7 -14.376 -12.239 -1.079 1.00 0.00 C ATOM 99 C THR A 7 -15.627 -11.579 -0.491 1.00 0.00 C ATOM 100 O THR A 7 -15.501 -10.652 0.309 1.00 0.00 O ATOM 101 CB THR A 7 -14.241 -13.715 -0.652 1.00 0.00 C ATOM 102 OG1 THR A 7 -14.099 -13.828 0.754 1.00 0.00 O ATOM 103 CG2 THR A 7 -13.063 -14.430 -1.325 1.00 0.00 C ATOM 0 H THR A 7 -13.238 -11.283 0.374 1.00 0.00 H new ATOM 0 HA THR A 7 -14.452 -12.230 -2.166 1.00 0.00 H new ATOM 0 HB THR A 7 -15.162 -14.200 -0.978 1.00 0.00 H new ATOM 0 HG1 THR A 7 -14.017 -14.773 1.000 1.00 0.00 H new ATOM 0 HG21 THR A 7 -13.022 -15.464 -0.983 1.00 0.00 H new ATOM 0 HG22 THR A 7 -13.195 -14.410 -2.407 1.00 0.00 H new ATOM 0 HG23 THR A 7 -12.133 -13.924 -1.064 1.00 0.00 H new ATOM 111 N ASP A 8 -16.834 -12.058 -0.805 1.00 0.00 N ATOM 112 CA ASP A 8 -18.078 -11.527 -0.227 1.00 0.00 C ATOM 113 C ASP A 8 -18.058 -11.520 1.307 1.00 0.00 C ATOM 114 O ASP A 8 -18.732 -10.712 1.947 1.00 0.00 O ATOM 115 CB ASP A 8 -19.291 -12.342 -0.695 1.00 0.00 C ATOM 116 CG ASP A 8 -20.587 -11.564 -0.418 1.00 0.00 C ATOM 117 OD1 ASP A 8 -20.797 -10.521 -1.082 1.00 0.00 O ATOM 118 OD2 ASP A 8 -21.397 -12.002 0.431 1.00 0.00 O ATOM 0 H ASP A 8 -16.979 -12.822 -1.465 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.157 -10.498 -0.577 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -19.206 -12.556 -1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -19.316 -13.301 -0.178 1.00 0.00 H new ATOM 123 N GLN A 9 -17.261 -12.420 1.893 1.00 0.00 N ATOM 124 CA GLN A 9 -17.112 -12.595 3.327 1.00 0.00 C ATOM 125 C GLN A 9 -16.301 -11.461 3.978 1.00 0.00 C ATOM 126 O GLN A 9 -16.473 -11.202 5.171 1.00 0.00 O ATOM 127 CB GLN A 9 -16.412 -13.941 3.598 1.00 0.00 C ATOM 128 CG GLN A 9 -16.898 -15.143 2.755 1.00 0.00 C ATOM 129 CD GLN A 9 -18.419 -15.336 2.730 1.00 0.00 C ATOM 130 OE1 GLN A 9 -19.103 -15.215 3.745 1.00 0.00 O ATOM 131 NE2 GLN A 9 -18.989 -15.642 1.571 1.00 0.00 N ATOM 0 H GLN A 9 -16.684 -13.066 1.355 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.109 -12.577 3.768 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -15.343 -13.812 3.427 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -16.539 -14.188 4.652 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.545 -15.018 1.731 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -16.437 -16.051 3.143 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -18.417 -15.741 0.732 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -19.999 -15.778 1.519 1.00 0.00 H new ATOM 140 N SER A 10 -15.430 -10.788 3.217 1.00 0.00 N ATOM 141 CA SER A 10 -14.416 -9.874 3.739 1.00 0.00 C ATOM 142 C SER A 10 -14.279 -8.545 2.997 1.00 0.00 C ATOM 143 O SER A 10 -13.663 -7.618 3.525 1.00 0.00 O ATOM 144 CB SER A 10 -13.092 -10.645 3.709 1.00 0.00 C ATOM 145 OG SER A 10 -12.838 -11.195 2.418 1.00 0.00 O ATOM 0 H SER A 10 -15.413 -10.868 2.200 1.00 0.00 H new ATOM 0 HA SER A 10 -14.718 -9.573 4.742 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.276 -9.980 3.989 1.00 0.00 H new ATOM 0 HB3 SER A 10 -13.119 -11.446 4.448 1.00 0.00 H new ATOM 0 HG SER A 10 -11.986 -11.679 2.431 1.00 0.00 H new ATOM 151 N PHE A 11 -14.888 -8.407 1.820 1.00 0.00 N ATOM 152 CA PHE A 11 -14.850 -7.193 1.016 1.00 0.00 C ATOM 153 C PHE A 11 -15.305 -5.984 1.834 1.00 0.00 C ATOM 154 O PHE A 11 -14.739 -4.898 1.698 1.00 0.00 O ATOM 155 CB PHE A 11 -15.734 -7.410 -0.220 1.00 0.00 C ATOM 156 CG PHE A 11 -15.686 -6.302 -1.249 1.00 0.00 C ATOM 157 CD1 PHE A 11 -14.705 -6.333 -2.257 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.642 -5.268 -1.232 1.00 0.00 C ATOM 159 CE1 PHE A 11 -14.689 -5.347 -3.254 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.621 -4.277 -2.228 1.00 0.00 C ATOM 161 CZ PHE A 11 -15.651 -4.321 -3.244 1.00 0.00 C ATOM 0 H PHE A 11 -15.433 -9.155 1.392 1.00 0.00 H new ATOM 0 HA PHE A 11 -13.829 -6.984 0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.437 -8.343 -0.700 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.766 -7.535 0.108 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -13.963 -7.118 -2.263 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -17.391 -5.237 -0.454 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -13.938 -5.375 -4.030 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -17.351 -3.481 -2.213 1.00 0.00 H new ATOM 0 HZ PHE A 11 -15.644 -3.567 -4.017 1.00 0.00 H new ATOM 171 N SER A 12 -16.278 -6.171 2.729 1.00 0.00 N ATOM 172 CA SER A 12 -16.832 -5.087 3.525 1.00 0.00 C ATOM 173 C SER A 12 -15.834 -4.597 4.576 1.00 0.00 C ATOM 174 O SER A 12 -15.774 -3.399 4.857 1.00 0.00 O ATOM 175 CB SER A 12 -18.138 -5.552 4.182 1.00 0.00 C ATOM 176 OG SER A 12 -18.981 -6.194 3.235 1.00 0.00 O ATOM 0 H SER A 12 -16.700 -7.080 2.918 1.00 0.00 H new ATOM 0 HA SER A 12 -17.043 -4.244 2.867 1.00 0.00 H new ATOM 0 HB2 SER A 12 -17.915 -6.237 5.000 1.00 0.00 H new ATOM 0 HB3 SER A 12 -18.656 -4.697 4.616 1.00 0.00 H new ATOM 0 HG SER A 12 -19.807 -6.484 3.676 1.00 0.00 H new ATOM 182 N ALA A 13 -15.027 -5.502 5.138 1.00 0.00 N ATOM 183 CA ALA A 13 -13.992 -5.167 6.101 1.00 0.00 C ATOM 184 C ALA A 13 -12.816 -4.471 5.409 1.00 0.00 C ATOM 185 O ALA A 13 -12.161 -3.620 6.009 1.00 0.00 O ATOM 186 CB ALA A 13 -13.513 -6.437 6.814 1.00 0.00 C ATOM 0 H ALA A 13 -15.081 -6.499 4.929 1.00 0.00 H new ATOM 0 HA ALA A 13 -14.409 -4.481 6.838 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -12.737 -6.179 7.535 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.351 -6.901 7.334 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.110 -7.136 6.081 1.00 0.00 H new ATOM 192 N GLU A 14 -12.530 -4.830 4.154 1.00 0.00 N ATOM 193 CA GLU A 14 -11.409 -4.269 3.420 1.00 0.00 C ATOM 194 C GLU A 14 -11.736 -2.885 2.873 1.00 0.00 C ATOM 195 O GLU A 14 -10.880 -2.001 2.918 1.00 0.00 O ATOM 196 CB GLU A 14 -10.986 -5.209 2.283 1.00 0.00 C ATOM 197 CG GLU A 14 -10.307 -6.470 2.832 1.00 0.00 C ATOM 198 CD GLU A 14 -8.958 -6.217 3.539 1.00 0.00 C ATOM 199 OE1 GLU A 14 -8.375 -5.117 3.400 1.00 0.00 O ATOM 200 OE2 GLU A 14 -8.477 -7.130 4.251 1.00 0.00 O ATOM 0 H GLU A 14 -13.071 -5.515 3.627 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.577 -4.163 4.116 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.860 -5.490 1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.304 -4.688 1.611 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -10.985 -6.955 3.534 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.146 -7.168 2.010 1.00 0.00 H new ATOM 207 N THR A 15 -12.955 -2.671 2.379 1.00 0.00 N ATOM 208 CA THR A 15 -13.324 -1.425 1.719 1.00 0.00 C ATOM 209 C THR A 15 -13.607 -0.285 2.708 1.00 0.00 C ATOM 210 O THR A 15 -13.885 0.837 2.281 1.00 0.00 O ATOM 211 CB THR A 15 -14.472 -1.672 0.727 1.00 0.00 C ATOM 212 OG1 THR A 15 -15.546 -2.380 1.313 1.00 0.00 O ATOM 213 CG2 THR A 15 -13.962 -2.454 -0.491 1.00 0.00 C ATOM 0 H THR A 15 -13.710 -3.355 2.426 1.00 0.00 H new ATOM 0 HA THR A 15 -12.464 -1.078 1.146 1.00 0.00 H new ATOM 0 HB THR A 15 -14.840 -0.693 0.420 1.00 0.00 H new ATOM 0 HG1 THR A 15 -15.425 -3.341 1.163 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.785 -2.622 -1.186 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.178 -1.882 -0.988 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.560 -3.413 -0.165 1.00 0.00 H new ATOM 221 N SER A 16 -13.506 -0.536 4.019 1.00 0.00 N ATOM 222 CA SER A 16 -13.957 0.375 5.068 1.00 0.00 C ATOM 223 C SER A 16 -12.798 0.995 5.856 1.00 0.00 C ATOM 224 O SER A 16 -12.934 1.305 7.040 1.00 0.00 O ATOM 225 CB SER A 16 -15.015 -0.342 5.915 1.00 0.00 C ATOM 226 OG SER A 16 -14.572 -1.603 6.375 1.00 0.00 O ATOM 0 H SER A 16 -13.099 -1.397 4.384 1.00 0.00 H new ATOM 0 HA SER A 16 -14.434 1.249 4.625 1.00 0.00 H new ATOM 0 HB2 SER A 16 -15.277 0.282 6.769 1.00 0.00 H new ATOM 0 HB3 SER A 16 -15.922 -0.472 5.325 1.00 0.00 H new ATOM 0 HG SER A 16 -14.689 -2.269 5.666 1.00 0.00 H new ATOM 232 N GLU A 17 -11.652 1.188 5.192 1.00 0.00 N ATOM 233 CA GLU A 17 -10.427 1.681 5.833 1.00 0.00 C ATOM 234 C GLU A 17 -9.757 2.837 5.072 1.00 0.00 C ATOM 235 O GLU A 17 -8.720 3.336 5.519 1.00 0.00 O ATOM 236 CB GLU A 17 -9.435 0.519 6.026 1.00 0.00 C ATOM 237 CG GLU A 17 -9.986 -0.632 6.882 1.00 0.00 C ATOM 238 CD GLU A 17 -8.888 -1.649 7.238 1.00 0.00 C ATOM 239 OE1 GLU A 17 -8.160 -2.104 6.327 1.00 0.00 O ATOM 240 OE2 GLU A 17 -8.746 -2.002 8.432 1.00 0.00 O ATOM 0 H GLU A 17 -11.548 1.006 4.194 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.721 2.087 6.801 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.152 0.129 5.048 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.527 0.903 6.491 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.421 -0.230 7.797 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -10.788 -1.136 6.343 1.00 0.00 H new ATOM 247 N GLY A 18 -10.309 3.283 3.940 1.00 0.00 N ATOM 248 CA GLY A 18 -9.670 4.294 3.103 1.00 0.00 C ATOM 249 C GLY A 18 -10.324 4.356 1.735 1.00 0.00 C ATOM 250 O GLY A 18 -11.424 3.825 1.566 1.00 0.00 O ATOM 0 H GLY A 18 -11.206 2.954 3.582 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.737 5.268 3.587 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.610 4.065 2.994 1.00 0.00 H new ATOM 254 N VAL A 19 -9.683 5.023 0.771 1.00 0.00 N ATOM 255 CA VAL A 19 -10.076 4.906 -0.629 1.00 0.00 C ATOM 256 C VAL A 19 -9.639 3.506 -1.052 1.00 0.00 C ATOM 257 O VAL A 19 -8.484 3.131 -0.833 1.00 0.00 O ATOM 258 CB VAL A 19 -9.389 5.982 -1.490 1.00 0.00 C ATOM 259 CG1 VAL A 19 -9.745 5.846 -2.980 1.00 0.00 C ATOM 260 CG2 VAL A 19 -9.778 7.393 -1.041 1.00 0.00 C ATOM 0 H VAL A 19 -8.893 5.646 0.937 1.00 0.00 H new ATOM 0 HA VAL A 19 -11.148 5.054 -0.761 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.318 5.828 -1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.238 6.626 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.427 4.868 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -10.823 5.947 -3.107 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -9.275 8.127 -1.671 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.857 7.518 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -9.479 7.540 -0.003 1.00 0.00 H new ATOM 270 N VAL A 20 -10.533 2.736 -1.663 1.00 0.00 N ATOM 271 CA VAL A 20 -10.267 1.365 -2.048 1.00 0.00 C ATOM 272 C VAL A 20 -10.745 1.196 -3.484 1.00 0.00 C ATOM 273 O VAL A 20 -11.929 1.356 -3.779 1.00 0.00 O ATOM 274 CB VAL A 20 -10.904 0.378 -1.049 1.00 0.00 C ATOM 275 CG1 VAL A 20 -10.465 -1.051 -1.389 1.00 0.00 C ATOM 276 CG2 VAL A 20 -10.502 0.703 0.403 1.00 0.00 C ATOM 0 H VAL A 20 -11.471 3.055 -1.905 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.202 1.136 -2.014 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.987 0.470 -1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.916 -1.748 -0.682 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.788 -1.300 -2.400 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.379 -1.123 -1.327 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.969 -0.013 1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.418 0.642 0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.834 1.710 0.656 1.00 0.00 H new ATOM 286 N LEU A 21 -9.807 0.905 -4.382 1.00 0.00 N ATOM 287 CA LEU A 21 -10.078 0.587 -5.770 1.00 0.00 C ATOM 288 C LEU A 21 -10.312 -0.917 -5.833 1.00 0.00 C ATOM 289 O LEU A 21 -9.364 -1.704 -5.846 1.00 0.00 O ATOM 290 CB LEU A 21 -8.880 1.020 -6.630 1.00 0.00 C ATOM 291 CG LEU A 21 -9.060 0.733 -8.131 1.00 0.00 C ATOM 292 CD1 LEU A 21 -10.238 1.514 -8.727 1.00 0.00 C ATOM 293 CD2 LEU A 21 -7.778 1.120 -8.874 1.00 0.00 C ATOM 0 H LEU A 21 -8.813 0.885 -4.152 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.953 1.111 -6.154 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.711 2.088 -6.491 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.986 0.507 -6.276 1.00 0.00 H new ATOM 0 HG LEU A 21 -9.269 -0.331 -8.245 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -10.329 1.282 -9.788 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.158 1.233 -8.214 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.066 2.583 -8.603 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.899 0.919 -9.938 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.578 2.181 -8.726 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -6.943 0.536 -8.487 1.00 0.00 H new ATOM 305 N ALA A 22 -11.571 -1.336 -5.812 1.00 0.00 N ATOM 306 CA ALA A 22 -11.901 -2.725 -6.062 1.00 0.00 C ATOM 307 C ALA A 22 -11.788 -2.991 -7.560 1.00 0.00 C ATOM 308 O ALA A 22 -12.089 -2.117 -8.376 1.00 0.00 O ATOM 309 CB ALA A 22 -13.309 -3.020 -5.561 1.00 0.00 C ATOM 0 H ALA A 22 -12.373 -0.734 -5.625 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.211 -3.379 -5.529 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.551 -4.065 -5.752 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.363 -2.825 -4.490 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.022 -2.381 -6.082 1.00 0.00 H new ATOM 315 N ASP A 23 -11.416 -4.218 -7.910 1.00 0.00 N ATOM 316 CA ASP A 23 -11.300 -4.697 -9.279 1.00 0.00 C ATOM 317 C ASP A 23 -11.984 -6.056 -9.346 1.00 0.00 C ATOM 318 O ASP A 23 -11.434 -7.081 -8.925 1.00 0.00 O ATOM 319 CB ASP A 23 -9.837 -4.765 -9.724 1.00 0.00 C ATOM 320 CG ASP A 23 -9.696 -5.426 -11.106 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.550 -5.186 -11.988 1.00 0.00 O ATOM 322 OD2 ASP A 23 -8.695 -6.151 -11.309 1.00 0.00 O ATOM 0 H ASP A 23 -11.179 -4.931 -7.221 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.785 -4.006 -9.968 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.419 -3.759 -9.757 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -9.259 -5.327 -8.991 1.00 0.00 H new ATOM 327 N PHE A 24 -13.239 -6.018 -9.785 1.00 0.00 N ATOM 328 CA PHE A 24 -14.049 -7.181 -10.078 1.00 0.00 C ATOM 329 C PHE A 24 -13.520 -7.740 -11.394 1.00 0.00 C ATOM 330 O PHE A 24 -13.613 -7.072 -12.429 1.00 0.00 O ATOM 331 CB PHE A 24 -15.531 -6.783 -10.155 1.00 0.00 C ATOM 332 CG PHE A 24 -16.110 -6.373 -8.811 1.00 0.00 C ATOM 333 CD1 PHE A 24 -15.882 -5.078 -8.304 1.00 0.00 C ATOM 334 CD2 PHE A 24 -16.817 -7.309 -8.032 1.00 0.00 C ATOM 335 CE1 PHE A 24 -16.323 -4.740 -7.012 1.00 0.00 C ATOM 336 CE2 PHE A 24 -17.266 -6.965 -6.745 1.00 0.00 C ATOM 337 CZ PHE A 24 -17.005 -5.686 -6.230 1.00 0.00 C ATOM 0 H PHE A 24 -13.732 -5.140 -9.950 1.00 0.00 H new ATOM 0 HA PHE A 24 -13.986 -7.942 -9.300 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.643 -5.958 -10.859 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -16.106 -7.620 -10.551 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -15.368 -4.345 -8.908 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -17.015 -8.295 -8.425 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -16.137 -3.751 -6.621 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -17.812 -7.685 -6.153 1.00 0.00 H new ATOM 0 HZ PHE A 24 -17.329 -5.429 -5.232 1.00 0.00 H new ATOM 347 N TRP A 25 -12.937 -8.938 -11.350 1.00 0.00 N ATOM 348 CA TRP A 25 -12.195 -9.513 -12.468 1.00 0.00 C ATOM 349 C TRP A 25 -12.534 -10.995 -12.631 1.00 0.00 C ATOM 350 O TRP A 25 -13.290 -11.556 -11.836 1.00 0.00 O ATOM 351 CB TRP A 25 -10.685 -9.289 -12.270 1.00 0.00 C ATOM 352 CG TRP A 25 -10.008 -10.196 -11.285 1.00 0.00 C ATOM 353 CD1 TRP A 25 -10.214 -10.192 -9.953 1.00 0.00 C ATOM 354 CD2 TRP A 25 -9.033 -11.259 -11.529 1.00 0.00 C ATOM 355 NE1 TRP A 25 -9.485 -11.200 -9.359 1.00 0.00 N ATOM 356 CE2 TRP A 25 -8.722 -11.881 -10.281 1.00 0.00 C ATOM 357 CE3 TRP A 25 -8.370 -11.757 -12.672 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -7.811 -12.942 -10.176 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -7.442 -12.811 -12.575 1.00 0.00 C ATOM 360 CH2 TRP A 25 -7.166 -13.409 -11.333 1.00 0.00 C ATOM 0 H TRP A 25 -12.968 -9.541 -10.528 1.00 0.00 H new ATOM 0 HA TRP A 25 -12.489 -9.010 -13.389 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -10.192 -9.401 -13.235 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -10.530 -8.258 -11.951 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -10.856 -9.500 -9.428 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -9.508 -11.414 -8.362 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -8.579 -11.321 -13.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -7.608 -13.395 -9.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -6.938 -13.163 -13.463 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -6.461 -14.224 -11.269 1.00 0.00 H new ATOM 371 N ALA A 26 -11.968 -11.619 -13.666 1.00 0.00 N ATOM 372 CA ALA A 26 -11.966 -13.056 -13.896 1.00 0.00 C ATOM 373 C ALA A 26 -10.750 -13.360 -14.783 1.00 0.00 C ATOM 374 O ALA A 26 -10.401 -12.517 -15.619 1.00 0.00 O ATOM 375 CB ALA A 26 -13.258 -13.491 -14.594 1.00 0.00 C ATOM 0 H ALA A 26 -11.476 -11.107 -14.399 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.909 -13.600 -12.953 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.238 -14.568 -14.758 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -14.113 -13.235 -13.969 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.343 -12.980 -15.553 1.00 0.00 H new ATOM 381 N PRO A 27 -10.106 -14.531 -14.651 1.00 0.00 N ATOM 382 CA PRO A 27 -8.829 -14.814 -15.301 1.00 0.00 C ATOM 383 C PRO A 27 -8.963 -15.106 -16.798 1.00 0.00 C ATOM 384 O PRO A 27 -7.982 -14.984 -17.534 1.00 0.00 O ATOM 385 CB PRO A 27 -8.262 -16.022 -14.546 1.00 0.00 C ATOM 386 CG PRO A 27 -9.512 -16.766 -14.075 1.00 0.00 C ATOM 387 CD PRO A 27 -10.499 -15.636 -13.786 1.00 0.00 C ATOM 0 HA PRO A 27 -8.173 -13.945 -15.256 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.643 -16.645 -15.192 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.638 -15.714 -13.707 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -9.889 -17.445 -14.840 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -9.314 -17.365 -13.186 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.522 -15.949 -13.993 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -10.461 -15.343 -12.737 1.00 0.00 H new ATOM 395 N TRP A 28 -10.154 -15.486 -17.270 1.00 0.00 N ATOM 396 CA TRP A 28 -10.393 -15.797 -18.675 1.00 0.00 C ATOM 397 C TRP A 28 -10.569 -14.534 -19.532 1.00 0.00 C ATOM 398 O TRP A 28 -10.642 -14.638 -20.757 1.00 0.00 O ATOM 399 CB TRP A 28 -11.592 -16.755 -18.781 1.00 0.00 C ATOM 400 CG TRP A 28 -12.830 -16.446 -17.980 1.00 0.00 C ATOM 401 CD1 TRP A 28 -13.378 -15.226 -17.773 1.00 0.00 C ATOM 402 CD2 TRP A 28 -13.704 -17.386 -17.276 1.00 0.00 C ATOM 403 NE1 TRP A 28 -14.533 -15.349 -17.027 1.00 0.00 N ATOM 404 CE2 TRP A 28 -14.774 -16.657 -16.674 1.00 0.00 C ATOM 405 CE3 TRP A 28 -13.699 -18.785 -17.084 1.00 0.00 C ATOM 406 CZ2 TRP A 28 -15.779 -17.281 -15.920 1.00 0.00 C ATOM 407 CZ3 TRP A 28 -14.704 -19.423 -16.331 1.00 0.00 C ATOM 408 CH2 TRP A 28 -15.743 -18.675 -15.748 1.00 0.00 C ATOM 0 H TRP A 28 -10.981 -15.586 -16.682 1.00 0.00 H new ATOM 0 HA TRP A 28 -9.512 -16.295 -19.081 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -11.881 -16.810 -19.831 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -11.249 -17.749 -18.492 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -12.972 -14.294 -18.138 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -15.134 -14.566 -16.769 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -12.910 -19.377 -17.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -16.572 -16.696 -15.477 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -14.677 -20.495 -16.200 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -16.510 -19.170 -15.171 1.00 0.00 H new ATOM 419 N CYS A 29 -10.644 -13.346 -18.917 1.00 0.00 N ATOM 420 CA CYS A 29 -10.845 -12.091 -19.623 1.00 0.00 C ATOM 421 C CYS A 29 -9.469 -11.459 -19.857 1.00 0.00 C ATOM 422 O CYS A 29 -8.734 -11.210 -18.897 1.00 0.00 O ATOM 423 CB CYS A 29 -11.760 -11.195 -18.782 1.00 0.00 C ATOM 424 SG CYS A 29 -12.125 -9.646 -19.655 1.00 0.00 S ATOM 0 H CYS A 29 -10.565 -13.237 -17.906 1.00 0.00 H new ATOM 0 HA CYS A 29 -11.326 -12.238 -20.590 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -12.689 -11.721 -18.562 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -11.283 -10.976 -17.827 1.00 0.00 H new ATOM 0 HG CYS A 29 -13.069 -9.008 -19.030 1.00 0.00 H new ATOM 430 N GLY A 30 -9.121 -11.198 -21.119 1.00 0.00 N ATOM 431 CA GLY A 30 -7.862 -10.562 -21.498 1.00 0.00 C ATOM 432 C GLY A 30 -7.678 -9.201 -20.822 1.00 0.00 C ATOM 433 O GLY A 30 -6.702 -9.033 -20.090 1.00 0.00 O ATOM 0 H GLY A 30 -9.716 -11.427 -21.916 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.031 -11.215 -21.230 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.831 -10.436 -22.580 1.00 0.00 H new ATOM 437 N PRO A 31 -8.601 -8.236 -20.997 1.00 0.00 N ATOM 438 CA PRO A 31 -8.536 -6.926 -20.357 1.00 0.00 C ATOM 439 C PRO A 31 -8.257 -6.933 -18.845 1.00 0.00 C ATOM 440 O PRO A 31 -7.506 -6.076 -18.381 1.00 0.00 O ATOM 441 CB PRO A 31 -9.852 -6.238 -20.718 1.00 0.00 C ATOM 442 CG PRO A 31 -10.139 -6.790 -22.112 1.00 0.00 C ATOM 443 CD PRO A 31 -9.642 -8.233 -22.018 1.00 0.00 C ATOM 0 HA PRO A 31 -7.666 -6.383 -20.728 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.646 -6.484 -20.012 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.755 -5.152 -20.723 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.201 -6.744 -22.354 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -9.611 -6.231 -22.884 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.454 -8.908 -21.749 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -9.249 -8.573 -22.976 1.00 0.00 H new ATOM 451 N CYS A 32 -8.775 -7.902 -18.074 1.00 0.00 N ATOM 452 CA CYS A 32 -8.464 -8.020 -16.644 1.00 0.00 C ATOM 453 C CYS A 32 -6.964 -8.211 -16.383 1.00 0.00 C ATOM 454 O CYS A 32 -6.453 -7.773 -15.352 1.00 0.00 O ATOM 455 CB CYS A 32 -9.207 -9.210 -16.024 1.00 0.00 C ATOM 456 SG CYS A 32 -11.001 -8.977 -16.084 1.00 0.00 S ATOM 0 H CYS A 32 -9.414 -8.617 -18.421 1.00 0.00 H new ATOM 0 HA CYS A 32 -8.785 -7.084 -16.188 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -8.940 -10.124 -16.555 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -8.890 -9.339 -14.989 1.00 0.00 H new ATOM 0 HG CYS A 32 -11.404 -9.027 -17.319 1.00 0.00 H new ATOM 462 N LYS A 33 -6.255 -8.870 -17.300 1.00 0.00 N ATOM 463 CA LYS A 33 -4.815 -9.086 -17.201 1.00 0.00 C ATOM 464 C LYS A 33 -4.072 -7.910 -17.834 1.00 0.00 C ATOM 465 O LYS A 33 -3.038 -7.507 -17.308 1.00 0.00 O ATOM 466 CB LYS A 33 -4.455 -10.431 -17.854 1.00 0.00 C ATOM 467 CG LYS A 33 -5.068 -11.601 -17.054 1.00 0.00 C ATOM 468 CD LYS A 33 -4.944 -12.968 -17.735 1.00 0.00 C ATOM 469 CE LYS A 33 -5.771 -13.028 -19.028 1.00 0.00 C ATOM 470 NZ LYS A 33 -5.998 -14.424 -19.475 1.00 0.00 N ATOM 0 H LYS A 33 -6.671 -9.272 -18.140 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.508 -9.135 -16.156 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.821 -10.453 -18.880 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.372 -10.542 -17.899 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.585 -11.650 -16.078 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.123 -11.391 -16.878 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.897 -13.170 -17.961 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.278 -13.748 -17.051 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.731 -12.537 -18.868 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.257 -12.474 -19.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.313 -14.424 -20.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.113 -14.963 -19.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.728 -14.865 -18.880 1.00 0.00 H new ATOM 484 N MET A 34 -4.613 -7.297 -18.893 1.00 0.00 N ATOM 485 CA MET A 34 -4.024 -6.107 -19.509 1.00 0.00 C ATOM 486 C MET A 34 -3.972 -4.937 -18.520 1.00 0.00 C ATOM 487 O MET A 34 -3.004 -4.180 -18.530 1.00 0.00 O ATOM 488 CB MET A 34 -4.807 -5.683 -20.760 1.00 0.00 C ATOM 489 CG MET A 34 -4.802 -6.743 -21.868 1.00 0.00 C ATOM 490 SD MET A 34 -5.926 -6.369 -23.241 1.00 0.00 S ATOM 491 CE MET A 34 -5.702 -7.874 -24.229 1.00 0.00 C ATOM 0 H MET A 34 -5.471 -7.613 -19.345 1.00 0.00 H new ATOM 0 HA MET A 34 -3.007 -6.369 -19.800 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.838 -5.466 -20.479 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.382 -4.758 -21.150 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.789 -6.844 -22.257 1.00 0.00 H new ATOM 0 HG3 MET A 34 -5.076 -7.706 -21.438 1.00 0.00 H new ATOM 0 HE1 MET A 34 -6.324 -7.819 -25.122 1.00 0.00 H new ATOM 0 HE2 MET A 34 -4.656 -7.966 -24.520 1.00 0.00 H new ATOM 0 HE3 MET A 34 -5.992 -8.743 -23.639 1.00 0.00 H new ATOM 501 N ILE A 35 -4.987 -4.779 -17.659 1.00 0.00 N ATOM 502 CA ILE A 35 -5.023 -3.693 -16.679 1.00 0.00 C ATOM 503 C ILE A 35 -4.156 -4.004 -15.443 1.00 0.00 C ATOM 504 O ILE A 35 -3.855 -3.092 -14.679 1.00 0.00 O ATOM 505 CB ILE A 35 -6.493 -3.323 -16.350 1.00 0.00 C ATOM 506 CG1 ILE A 35 -6.587 -1.888 -15.784 1.00 0.00 C ATOM 507 CG2 ILE A 35 -7.176 -4.354 -15.437 1.00 0.00 C ATOM 508 CD1 ILE A 35 -8.022 -1.401 -15.556 1.00 0.00 C ATOM 0 H ILE A 35 -5.798 -5.397 -17.625 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.568 -2.803 -17.113 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.048 -3.347 -17.288 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.045 -1.845 -14.839 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.087 -1.204 -16.470 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.202 -4.043 -15.241 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.179 -5.328 -15.927 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.631 -4.423 -14.495 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.003 -0.386 -15.158 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.564 -1.410 -16.502 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.521 -2.060 -14.846 1.00 0.00 H new ATOM 520 N ALA A 36 -3.718 -5.254 -15.234 1.00 0.00 N ATOM 521 CA ALA A 36 -2.923 -5.628 -14.066 1.00 0.00 C ATOM 522 C ALA A 36 -1.662 -4.759 -13.879 1.00 0.00 C ATOM 523 O ALA A 36 -1.491 -4.238 -12.776 1.00 0.00 O ATOM 524 CB ALA A 36 -2.593 -7.127 -14.086 1.00 0.00 C ATOM 0 H ALA A 36 -3.907 -6.028 -15.870 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.542 -5.429 -13.191 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.001 -7.381 -13.207 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.518 -7.703 -14.079 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.025 -7.363 -14.986 1.00 0.00 H new ATOM 530 N PRO A 37 -0.811 -4.506 -14.895 1.00 0.00 N ATOM 531 CA PRO A 37 0.327 -3.606 -14.722 1.00 0.00 C ATOM 532 C PRO A 37 -0.102 -2.159 -14.447 1.00 0.00 C ATOM 533 O PRO A 37 0.614 -1.446 -13.745 1.00 0.00 O ATOM 534 CB PRO A 37 1.169 -3.729 -15.996 1.00 0.00 C ATOM 535 CG PRO A 37 0.186 -4.259 -17.036 1.00 0.00 C ATOM 536 CD PRO A 37 -0.742 -5.140 -16.204 1.00 0.00 C ATOM 0 HA PRO A 37 0.907 -3.888 -13.843 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.586 -2.767 -16.294 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.008 -4.410 -15.856 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.356 -3.452 -17.529 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.691 -4.827 -17.817 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.730 -5.209 -16.659 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.355 -6.156 -16.128 1.00 0.00 H new ATOM 544 N VAL A 38 -1.262 -1.714 -14.942 1.00 0.00 N ATOM 545 CA VAL A 38 -1.789 -0.391 -14.626 1.00 0.00 C ATOM 546 C VAL A 38 -2.157 -0.334 -13.139 1.00 0.00 C ATOM 547 O VAL A 38 -1.872 0.663 -12.478 1.00 0.00 O ATOM 548 CB VAL A 38 -2.990 -0.027 -15.529 1.00 0.00 C ATOM 549 CG1 VAL A 38 -3.339 1.456 -15.370 1.00 0.00 C ATOM 550 CG2 VAL A 38 -2.709 -0.296 -17.017 1.00 0.00 C ATOM 0 H VAL A 38 -1.855 -2.259 -15.568 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.019 0.354 -14.825 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.819 -0.659 -15.212 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.186 1.701 -16.011 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.599 1.659 -14.331 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.481 2.064 -15.655 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.584 -0.024 -17.608 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.854 0.299 -17.339 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.490 -1.354 -17.160 1.00 0.00 H new ATOM 560 N LEU A 39 -2.747 -1.399 -12.587 1.00 0.00 N ATOM 561 CA LEU A 39 -3.056 -1.479 -11.167 1.00 0.00 C ATOM 562 C LEU A 39 -1.776 -1.529 -10.334 1.00 0.00 C ATOM 563 O LEU A 39 -1.744 -0.929 -9.265 1.00 0.00 O ATOM 564 CB LEU A 39 -3.963 -2.684 -10.863 1.00 0.00 C ATOM 565 CG LEU A 39 -5.377 -2.556 -11.466 1.00 0.00 C ATOM 566 CD1 LEU A 39 -6.116 -3.887 -11.326 1.00 0.00 C ATOM 567 CD2 LEU A 39 -6.203 -1.451 -10.798 1.00 0.00 C ATOM 0 H LEU A 39 -3.021 -2.226 -13.117 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.602 -0.577 -10.891 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -3.493 -3.589 -11.248 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.046 -2.803 -9.783 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.256 -2.290 -12.516 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.115 -3.795 -11.752 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.566 -4.666 -11.854 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.195 -4.150 -10.271 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.189 -1.404 -11.260 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.310 -1.669 -9.735 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.698 -0.493 -10.923 1.00 0.00 H new ATOM 579 N GLU A 40 -0.711 -2.184 -10.804 1.00 0.00 N ATOM 580 CA GLU A 40 0.577 -2.171 -10.114 1.00 0.00 C ATOM 581 C GLU A 40 1.218 -0.779 -10.158 1.00 0.00 C ATOM 582 O GLU A 40 1.846 -0.352 -9.188 1.00 0.00 O ATOM 583 CB GLU A 40 1.526 -3.230 -10.696 1.00 0.00 C ATOM 584 CG GLU A 40 1.094 -4.655 -10.323 1.00 0.00 C ATOM 585 CD GLU A 40 2.092 -5.703 -10.847 1.00 0.00 C ATOM 586 OE1 GLU A 40 3.056 -6.044 -10.123 1.00 0.00 O ATOM 587 OE2 GLU A 40 1.919 -6.214 -11.977 1.00 0.00 O ATOM 0 H GLU A 40 -0.718 -2.732 -11.664 1.00 0.00 H new ATOM 0 HA GLU A 40 0.394 -2.420 -9.069 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.556 -3.133 -11.781 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.537 -3.050 -10.331 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.012 -4.739 -9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.105 -4.856 -10.734 1.00 0.00 H new ATOM 594 N GLU A 41 1.061 -0.039 -11.255 1.00 0.00 N ATOM 595 CA GLU A 41 1.478 1.355 -11.332 1.00 0.00 C ATOM 596 C GLU A 41 0.669 2.197 -10.345 1.00 0.00 C ATOM 597 O GLU A 41 1.243 3.010 -9.625 1.00 0.00 O ATOM 598 CB GLU A 41 1.326 1.893 -12.762 1.00 0.00 C ATOM 599 CG GLU A 41 2.540 1.589 -13.653 1.00 0.00 C ATOM 600 CD GLU A 41 3.819 2.309 -13.188 1.00 0.00 C ATOM 601 OE1 GLU A 41 3.777 3.537 -12.944 1.00 0.00 O ATOM 602 OE2 GLU A 41 4.880 1.651 -13.087 1.00 0.00 O ATOM 0 H GLU A 41 0.640 -0.392 -12.115 1.00 0.00 H new ATOM 0 HA GLU A 41 2.532 1.419 -11.063 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.434 1.460 -13.214 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.172 2.971 -12.724 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.717 0.514 -13.662 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.315 1.884 -14.678 1.00 0.00 H new ATOM 609 N LEU A 42 -0.647 1.989 -10.266 1.00 0.00 N ATOM 610 CA LEU A 42 -1.507 2.682 -9.316 1.00 0.00 C ATOM 611 C LEU A 42 -1.128 2.338 -7.880 1.00 0.00 C ATOM 612 O LEU A 42 -1.173 3.209 -7.019 1.00 0.00 O ATOM 613 CB LEU A 42 -2.988 2.343 -9.574 1.00 0.00 C ATOM 614 CG LEU A 42 -3.818 3.484 -10.178 1.00 0.00 C ATOM 615 CD1 LEU A 42 -3.960 4.665 -9.210 1.00 0.00 C ATOM 616 CD2 LEU A 42 -3.263 3.973 -11.523 1.00 0.00 C ATOM 0 H LEU A 42 -1.145 1.330 -10.865 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.365 3.753 -9.458 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.037 1.484 -10.243 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.445 2.040 -8.632 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.807 3.062 -10.359 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.554 5.450 -9.678 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.454 4.330 -8.298 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.972 5.055 -8.965 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.889 4.780 -11.903 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.245 4.338 -11.386 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.260 3.149 -12.237 1.00 0.00 H new ATOM 628 N ASP A 43 -0.729 1.098 -7.605 1.00 0.00 N ATOM 629 CA ASP A 43 -0.268 0.690 -6.287 1.00 0.00 C ATOM 630 C ASP A 43 1.021 1.432 -5.931 1.00 0.00 C ATOM 631 O ASP A 43 1.146 1.953 -4.829 1.00 0.00 O ATOM 632 CB ASP A 43 -0.043 -0.820 -6.229 1.00 0.00 C ATOM 633 CG ASP A 43 0.541 -1.223 -4.868 1.00 0.00 C ATOM 634 OD1 ASP A 43 -0.166 -1.076 -3.848 1.00 0.00 O ATOM 635 OD2 ASP A 43 1.692 -1.714 -4.834 1.00 0.00 O ATOM 0 H ASP A 43 -0.718 0.347 -8.296 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.039 0.945 -5.560 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.986 -1.341 -6.396 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.635 -1.124 -7.027 1.00 0.00 H new ATOM 640 N GLN A 44 1.951 1.561 -6.876 1.00 0.00 N ATOM 641 CA GLN A 44 3.175 2.327 -6.675 1.00 0.00 C ATOM 642 C GLN A 44 2.902 3.831 -6.494 1.00 0.00 C ATOM 643 O GLN A 44 3.628 4.504 -5.762 1.00 0.00 O ATOM 644 CB GLN A 44 4.119 2.067 -7.856 1.00 0.00 C ATOM 645 CG GLN A 44 4.757 0.671 -7.778 1.00 0.00 C ATOM 646 CD GLN A 44 5.399 0.287 -9.109 1.00 0.00 C ATOM 647 OE1 GLN A 44 6.595 0.469 -9.327 1.00 0.00 O ATOM 648 NE2 GLN A 44 4.610 -0.242 -10.029 1.00 0.00 N ATOM 0 H GLN A 44 1.875 1.137 -7.801 1.00 0.00 H new ATOM 0 HA GLN A 44 3.646 1.996 -5.749 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.567 2.163 -8.791 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.902 2.825 -7.869 1.00 0.00 H new ATOM 0 HG2 GLN A 44 5.509 0.655 -6.989 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.999 -0.065 -7.510 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.620 -0.386 -9.830 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.992 -0.506 -10.937 1.00 0.00 H new ATOM 657 N GLU A 45 1.877 4.370 -7.159 1.00 0.00 N ATOM 658 CA GLU A 45 1.600 5.804 -7.215 1.00 0.00 C ATOM 659 C GLU A 45 0.690 6.268 -6.063 1.00 0.00 C ATOM 660 O GLU A 45 0.819 7.393 -5.573 1.00 0.00 O ATOM 661 CB GLU A 45 0.934 6.093 -8.574 1.00 0.00 C ATOM 662 CG GLU A 45 0.940 7.571 -8.977 1.00 0.00 C ATOM 663 CD GLU A 45 2.361 8.064 -9.311 1.00 0.00 C ATOM 664 OE1 GLU A 45 2.933 7.606 -10.327 1.00 0.00 O ATOM 665 OE2 GLU A 45 2.907 8.912 -8.570 1.00 0.00 O ATOM 0 H GLU A 45 1.205 3.810 -7.683 1.00 0.00 H new ATOM 0 HA GLU A 45 2.534 6.355 -7.108 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.444 5.516 -9.345 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.097 5.741 -8.542 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.292 7.715 -9.842 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.528 8.171 -8.166 1.00 0.00 H new ATOM 672 N MET A 46 -0.223 5.400 -5.617 1.00 0.00 N ATOM 673 CA MET A 46 -1.320 5.733 -4.713 1.00 0.00 C ATOM 674 C MET A 46 -1.509 4.692 -3.606 1.00 0.00 C ATOM 675 O MET A 46 -2.238 4.968 -2.661 1.00 0.00 O ATOM 676 CB MET A 46 -2.634 5.859 -5.515 1.00 0.00 C ATOM 677 CG MET A 46 -2.660 6.948 -6.595 1.00 0.00 C ATOM 678 SD MET A 46 -2.741 8.641 -5.958 1.00 0.00 S ATOM 679 CE MET A 46 -2.893 9.562 -7.508 1.00 0.00 C ATOM 0 H MET A 46 -0.216 4.416 -5.886 1.00 0.00 H new ATOM 0 HA MET A 46 -1.065 6.680 -4.237 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.841 4.900 -5.989 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.447 6.050 -4.815 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.768 6.849 -7.214 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.519 6.777 -7.244 1.00 0.00 H new ATOM 0 HE1 MET A 46 -2.955 10.629 -7.293 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.022 9.368 -8.134 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.794 9.245 -8.033 1.00 0.00 H new ATOM 689 N GLY A 47 -0.882 3.514 -3.660 1.00 0.00 N ATOM 690 CA GLY A 47 -1.135 2.408 -2.729 1.00 0.00 C ATOM 691 C GLY A 47 -0.609 2.638 -1.311 1.00 0.00 C ATOM 692 O GLY A 47 -0.681 1.751 -0.460 1.00 0.00 O ATOM 0 H GLY A 47 -0.174 3.297 -4.361 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.209 2.230 -2.680 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.680 1.502 -3.129 1.00 0.00 H new ATOM 696 N ASP A 48 -0.044 3.814 -1.061 1.00 0.00 N ATOM 697 CA ASP A 48 0.360 4.336 0.235 1.00 0.00 C ATOM 698 C ASP A 48 -0.772 5.130 0.908 1.00 0.00 C ATOM 699 O ASP A 48 -0.727 5.358 2.117 1.00 0.00 O ATOM 700 CB ASP A 48 1.591 5.239 0.058 1.00 0.00 C ATOM 701 CG ASP A 48 1.246 6.567 -0.634 1.00 0.00 C ATOM 702 OD1 ASP A 48 0.706 6.524 -1.764 1.00 0.00 O ATOM 703 OD2 ASP A 48 1.524 7.645 -0.063 1.00 0.00 O ATOM 0 H ASP A 48 0.157 4.473 -1.814 1.00 0.00 H new ATOM 0 HA ASP A 48 0.602 3.491 0.880 1.00 0.00 H new ATOM 0 HB2 ASP A 48 2.032 5.444 1.034 1.00 0.00 H new ATOM 0 HB3 ASP A 48 2.344 4.712 -0.527 1.00 0.00 H new ATOM 708 N LYS A 49 -1.791 5.543 0.144 1.00 0.00 N ATOM 709 CA LYS A 49 -2.900 6.401 0.546 1.00 0.00 C ATOM 710 C LYS A 49 -4.245 5.932 -0.032 1.00 0.00 C ATOM 711 O LYS A 49 -5.265 6.602 0.134 1.00 0.00 O ATOM 712 CB LYS A 49 -2.537 7.846 0.164 1.00 0.00 C ATOM 713 CG LYS A 49 -2.345 8.091 -1.343 1.00 0.00 C ATOM 714 CD LYS A 49 -1.699 9.461 -1.619 1.00 0.00 C ATOM 715 CE LYS A 49 -1.116 9.517 -3.039 1.00 0.00 C ATOM 716 NZ LYS A 49 0.203 8.844 -3.153 1.00 0.00 N ATOM 0 H LYS A 49 -1.862 5.265 -0.835 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.045 6.346 1.625 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.321 8.510 0.528 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.619 8.123 0.682 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.720 7.303 -1.763 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.310 8.036 -1.847 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.442 10.249 -1.495 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.910 9.649 -0.890 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.816 9.051 -3.732 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.013 10.559 -3.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.275 8.375 -4.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.962 9.550 -3.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.298 8.135 -2.398 1.00 0.00 H new ATOM 730 N LEU A 50 -4.250 4.772 -0.688 1.00 0.00 N ATOM 731 CA LEU A 50 -5.372 4.043 -1.253 1.00 0.00 C ATOM 732 C LEU A 50 -5.035 2.556 -1.090 1.00 0.00 C ATOM 733 O LEU A 50 -3.875 2.201 -0.863 1.00 0.00 O ATOM 734 CB LEU A 50 -5.619 4.511 -2.717 1.00 0.00 C ATOM 735 CG LEU A 50 -5.886 3.468 -3.831 1.00 0.00 C ATOM 736 CD1 LEU A 50 -6.426 4.167 -5.080 1.00 0.00 C ATOM 737 CD2 LEU A 50 -4.633 2.692 -4.268 1.00 0.00 C ATOM 0 H LEU A 50 -3.375 4.273 -0.850 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.319 4.233 -0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.470 5.192 -2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.750 5.095 -3.021 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.600 2.765 -3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.611 3.428 -5.859 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.357 4.679 -4.837 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.695 4.893 -5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.900 1.981 -5.050 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.888 3.390 -4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.222 2.154 -3.414 1.00 0.00 H new ATOM 749 N LYS A 51 -6.026 1.679 -1.226 1.00 0.00 N ATOM 750 CA LYS A 51 -5.869 0.225 -1.247 1.00 0.00 C ATOM 751 C LYS A 51 -6.422 -0.274 -2.581 1.00 0.00 C ATOM 752 O LYS A 51 -7.297 0.374 -3.151 1.00 0.00 O ATOM 753 CB LYS A 51 -6.634 -0.338 -0.036 1.00 0.00 C ATOM 754 CG LYS A 51 -6.454 -1.845 0.202 1.00 0.00 C ATOM 755 CD LYS A 51 -7.440 -2.385 1.250 1.00 0.00 C ATOM 756 CE LYS A 51 -7.272 -1.750 2.640 1.00 0.00 C ATOM 757 NZ LYS A 51 -8.185 -2.387 3.608 1.00 0.00 N ATOM 0 H LYS A 51 -6.998 1.971 -1.329 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.831 -0.099 -1.170 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.313 0.197 0.858 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.696 -0.130 -0.168 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.595 -2.380 -0.737 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.433 -2.041 0.530 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.458 -2.212 0.902 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.312 -3.464 1.335 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.241 -1.860 2.975 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.477 -0.681 2.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.894 -2.139 4.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.155 -2.052 3.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.151 -3.420 3.490 1.00 0.00 H new ATOM 771 N ILE A 52 -5.970 -1.424 -3.075 1.00 0.00 N ATOM 772 CA ILE A 52 -6.518 -2.049 -4.280 1.00 0.00 C ATOM 773 C ILE A 52 -6.951 -3.441 -3.845 1.00 0.00 C ATOM 774 O ILE A 52 -6.197 -4.094 -3.124 1.00 0.00 O ATOM 775 CB ILE A 52 -5.484 -2.054 -5.436 1.00 0.00 C ATOM 776 CG1 ILE A 52 -4.964 -0.616 -5.675 1.00 0.00 C ATOM 777 CG2 ILE A 52 -6.081 -2.672 -6.717 1.00 0.00 C ATOM 778 CD1 ILE A 52 -4.094 -0.401 -6.913 1.00 0.00 C ATOM 0 H ILE A 52 -5.209 -1.953 -2.649 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.366 -1.498 -4.688 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.638 -2.681 -5.154 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.824 0.051 -5.743 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.392 -0.310 -4.799 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.332 -2.661 -7.509 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.384 -3.700 -6.518 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.949 -2.092 -7.030 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.793 0.645 -6.969 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.207 -1.031 -6.848 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.661 -0.664 -7.806 1.00 0.00 H new ATOM 790 N VAL A 53 -8.139 -3.896 -4.248 1.00 0.00 N ATOM 791 CA VAL A 53 -8.696 -5.172 -3.800 1.00 0.00 C ATOM 792 C VAL A 53 -9.197 -5.929 -5.030 1.00 0.00 C ATOM 793 O VAL A 53 -10.181 -5.541 -5.659 1.00 0.00 O ATOM 794 CB VAL A 53 -9.814 -4.954 -2.751 1.00 0.00 C ATOM 795 CG1 VAL A 53 -10.462 -6.271 -2.296 1.00 0.00 C ATOM 796 CG2 VAL A 53 -9.302 -4.253 -1.484 1.00 0.00 C ATOM 0 H VAL A 53 -8.742 -3.389 -4.895 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.929 -5.766 -3.303 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.546 -4.329 -3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.239 -6.059 -1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.904 -6.775 -3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.704 -6.914 -1.848 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.125 -4.124 -0.781 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.522 -4.859 -1.023 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.894 -3.277 -1.748 1.00 0.00 H new ATOM 806 N LYS A 54 -8.524 -7.024 -5.373 1.00 0.00 N ATOM 807 CA LYS A 54 -8.997 -7.964 -6.381 1.00 0.00 C ATOM 808 C LYS A 54 -10.186 -8.736 -5.818 1.00 0.00 C ATOM 809 O LYS A 54 -10.163 -9.122 -4.644 1.00 0.00 O ATOM 810 CB LYS A 54 -7.860 -8.942 -6.723 1.00 0.00 C ATOM 811 CG LYS A 54 -6.655 -8.302 -7.425 1.00 0.00 C ATOM 812 CD LYS A 54 -7.082 -7.645 -8.741 1.00 0.00 C ATOM 813 CE LYS A 54 -5.877 -7.427 -9.657 1.00 0.00 C ATOM 814 NZ LYS A 54 -6.284 -7.418 -11.084 1.00 0.00 N ATOM 0 H LYS A 54 -7.630 -7.284 -4.956 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.302 -7.431 -7.281 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.518 -9.416 -5.803 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.258 -9.732 -7.360 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.200 -7.557 -6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.897 -9.060 -7.620 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.818 -8.273 -9.244 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.565 -6.690 -8.535 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.393 -6.482 -9.408 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.143 -8.215 -9.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.467 -7.168 -11.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.630 -8.361 -11.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -7.041 -6.719 -11.225 1.00 0.00 H new ATOM 828 N ILE A 55 -11.185 -9.025 -6.651 1.00 0.00 N ATOM 829 CA ILE A 55 -12.275 -9.926 -6.287 1.00 0.00 C ATOM 830 C ILE A 55 -12.761 -10.648 -7.556 1.00 0.00 C ATOM 831 O ILE A 55 -13.133 -10.018 -8.547 1.00 0.00 O ATOM 832 CB ILE A 55 -13.350 -9.150 -5.483 1.00 0.00 C ATOM 833 CG1 ILE A 55 -14.490 -10.097 -5.057 1.00 0.00 C ATOM 834 CG2 ILE A 55 -13.875 -7.892 -6.199 1.00 0.00 C ATOM 835 CD1 ILE A 55 -15.367 -9.529 -3.935 1.00 0.00 C ATOM 0 H ILE A 55 -11.261 -8.642 -7.593 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.954 -10.717 -5.609 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.859 -8.773 -4.586 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -15.116 -10.313 -5.923 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -14.062 -11.044 -4.729 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -14.623 -7.403 -5.575 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -13.049 -7.205 -6.380 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -14.326 -8.176 -7.150 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -16.148 -10.247 -3.685 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.753 -9.339 -3.054 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -15.824 -8.597 -4.267 1.00 0.00 H new ATOM 847 N ASP A 56 -12.670 -11.981 -7.560 1.00 0.00 N ATOM 848 CA ASP A 56 -13.034 -12.815 -8.710 1.00 0.00 C ATOM 849 C ASP A 56 -14.550 -12.992 -8.740 1.00 0.00 C ATOM 850 O ASP A 56 -15.114 -13.576 -7.810 1.00 0.00 O ATOM 851 CB ASP A 56 -12.336 -14.180 -8.612 1.00 0.00 C ATOM 852 CG ASP A 56 -12.722 -15.165 -9.736 1.00 0.00 C ATOM 853 OD1 ASP A 56 -13.444 -14.793 -10.688 1.00 0.00 O ATOM 854 OD2 ASP A 56 -12.262 -16.328 -9.666 1.00 0.00 O ATOM 0 H ASP A 56 -12.339 -12.517 -6.758 1.00 0.00 H new ATOM 0 HA ASP A 56 -12.711 -12.330 -9.631 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.257 -14.027 -8.632 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.576 -14.631 -7.649 1.00 0.00 H new ATOM 859 N VAL A 57 -15.224 -12.487 -9.775 1.00 0.00 N ATOM 860 CA VAL A 57 -16.681 -12.548 -9.876 1.00 0.00 C ATOM 861 C VAL A 57 -17.192 -13.992 -9.898 1.00 0.00 C ATOM 862 O VAL A 57 -18.279 -14.258 -9.385 1.00 0.00 O ATOM 863 CB VAL A 57 -17.203 -11.746 -11.089 1.00 0.00 C ATOM 864 CG1 VAL A 57 -16.776 -10.276 -10.991 1.00 0.00 C ATOM 865 CG2 VAL A 57 -16.765 -12.308 -12.452 1.00 0.00 C ATOM 0 H VAL A 57 -14.774 -12.025 -10.565 1.00 0.00 H new ATOM 0 HA VAL A 57 -17.081 -12.078 -8.977 1.00 0.00 H new ATOM 0 HB VAL A 57 -18.288 -11.835 -11.044 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.154 -9.729 -11.855 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.182 -9.839 -10.079 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.688 -10.214 -10.970 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -17.173 -11.688 -13.250 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -15.677 -12.308 -12.513 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -17.134 -13.328 -12.561 1.00 0.00 H new ATOM 875 N ASP A 58 -16.406 -14.935 -10.429 1.00 0.00 N ATOM 876 CA ASP A 58 -16.802 -16.337 -10.589 1.00 0.00 C ATOM 877 C ASP A 58 -16.756 -17.105 -9.257 1.00 0.00 C ATOM 878 O ASP A 58 -17.030 -18.303 -9.209 1.00 0.00 O ATOM 879 CB ASP A 58 -15.925 -17.004 -11.660 1.00 0.00 C ATOM 880 CG ASP A 58 -16.427 -18.410 -12.038 1.00 0.00 C ATOM 881 OD1 ASP A 58 -17.595 -18.546 -12.468 1.00 0.00 O ATOM 882 OD2 ASP A 58 -15.637 -19.380 -11.962 1.00 0.00 O ATOM 0 H ASP A 58 -15.462 -14.742 -10.765 1.00 0.00 H new ATOM 0 HA ASP A 58 -17.840 -16.365 -10.920 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -15.905 -16.377 -12.551 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -14.900 -17.073 -11.295 1.00 0.00 H new ATOM 887 N GLU A 59 -16.430 -16.407 -8.166 1.00 0.00 N ATOM 888 CA GLU A 59 -16.459 -16.907 -6.795 1.00 0.00 C ATOM 889 C GLU A 59 -17.227 -15.939 -5.878 1.00 0.00 C ATOM 890 O GLU A 59 -17.425 -16.247 -4.703 1.00 0.00 O ATOM 891 CB GLU A 59 -15.009 -17.084 -6.297 1.00 0.00 C ATOM 892 CG GLU A 59 -14.309 -18.345 -6.826 1.00 0.00 C ATOM 893 CD GLU A 59 -14.828 -19.631 -6.149 1.00 0.00 C ATOM 894 OE1 GLU A 59 -14.428 -19.919 -4.997 1.00 0.00 O ATOM 895 OE2 GLU A 59 -15.613 -20.386 -6.764 1.00 0.00 O ATOM 0 H GLU A 59 -16.126 -15.435 -8.220 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.975 -17.867 -6.772 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -14.427 -16.210 -6.590 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -15.012 -17.114 -5.207 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -14.461 -18.417 -7.903 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -13.235 -18.258 -6.661 1.00 0.00 H new ATOM 902 N ASN A 60 -17.676 -14.781 -6.386 1.00 0.00 N ATOM 903 CA ASN A 60 -18.200 -13.673 -5.580 1.00 0.00 C ATOM 904 C ASN A 60 -19.389 -13.034 -6.286 1.00 0.00 C ATOM 905 O ASN A 60 -19.485 -11.813 -6.434 1.00 0.00 O ATOM 906 CB ASN A 60 -17.092 -12.658 -5.276 1.00 0.00 C ATOM 907 CG ASN A 60 -16.015 -13.284 -4.407 1.00 0.00 C ATOM 908 OD1 ASN A 60 -16.208 -13.473 -3.211 1.00 0.00 O ATOM 909 ND2 ASN A 60 -14.884 -13.654 -4.987 1.00 0.00 N ATOM 0 H ASN A 60 -17.684 -14.587 -7.387 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.552 -14.057 -4.622 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -16.653 -12.301 -6.208 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -17.516 -11.790 -4.770 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -14.153 -14.106 -4.437 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.744 -13.487 -5.983 1.00 0.00 H new ATOM 916 N GLN A 61 -20.294 -13.899 -6.740 1.00 0.00 N ATOM 917 CA GLN A 61 -21.537 -13.550 -7.410 1.00 0.00 C ATOM 918 C GLN A 61 -22.312 -12.543 -6.554 1.00 0.00 C ATOM 919 O GLN A 61 -22.830 -11.551 -7.057 1.00 0.00 O ATOM 920 CB GLN A 61 -22.405 -14.809 -7.627 1.00 0.00 C ATOM 921 CG GLN A 61 -21.728 -16.039 -8.266 1.00 0.00 C ATOM 922 CD GLN A 61 -20.702 -16.797 -7.404 1.00 0.00 C ATOM 923 OE1 GLN A 61 -19.796 -17.421 -7.940 1.00 0.00 O ATOM 924 NE2 GLN A 61 -20.759 -16.770 -6.076 1.00 0.00 N ATOM 0 H GLN A 61 -20.171 -14.907 -6.645 1.00 0.00 H new ATOM 0 HA GLN A 61 -21.302 -13.111 -8.380 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -22.807 -15.111 -6.660 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -23.253 -14.529 -8.252 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -22.508 -16.741 -8.560 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -21.230 -15.715 -9.180 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -21.505 -16.256 -5.608 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -20.056 -17.263 -5.525 1.00 0.00 H new ATOM 933 N GLU A 62 -22.352 -12.802 -5.246 1.00 0.00 N ATOM 934 CA GLU A 62 -23.104 -12.064 -4.249 1.00 0.00 C ATOM 935 C GLU A 62 -22.561 -10.648 -4.058 1.00 0.00 C ATOM 936 O GLU A 62 -23.320 -9.751 -3.686 1.00 0.00 O ATOM 937 CB GLU A 62 -23.026 -12.829 -2.916 1.00 0.00 C ATOM 938 CG GLU A 62 -23.836 -14.140 -2.864 1.00 0.00 C ATOM 939 CD GLU A 62 -23.334 -15.287 -3.768 1.00 0.00 C ATOM 940 OE1 GLU A 62 -22.138 -15.324 -4.139 1.00 0.00 O ATOM 941 OE2 GLU A 62 -24.149 -16.174 -4.113 1.00 0.00 O ATOM 0 H GLU A 62 -21.829 -13.577 -4.839 1.00 0.00 H new ATOM 0 HA GLU A 62 -24.136 -11.975 -4.588 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -21.981 -13.058 -2.707 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -23.374 -12.173 -2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -23.847 -14.495 -1.834 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -24.868 -13.916 -3.135 1.00 0.00 H new ATOM 948 N THR A 63 -21.268 -10.424 -4.302 1.00 0.00 N ATOM 949 CA THR A 63 -20.660 -9.110 -4.177 1.00 0.00 C ATOM 950 C THR A 63 -20.788 -8.361 -5.494 1.00 0.00 C ATOM 951 O THR A 63 -21.206 -7.215 -5.496 1.00 0.00 O ATOM 952 CB THR A 63 -19.190 -9.197 -3.751 1.00 0.00 C ATOM 953 OG1 THR A 63 -18.946 -10.391 -3.053 1.00 0.00 O ATOM 954 CG2 THR A 63 -18.754 -8.030 -2.864 1.00 0.00 C ATOM 0 H THR A 63 -20.617 -11.154 -4.592 1.00 0.00 H new ATOM 0 HA THR A 63 -21.190 -8.567 -3.395 1.00 0.00 H new ATOM 0 HB THR A 63 -18.612 -9.162 -4.675 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.584 -10.474 -2.314 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.704 -8.149 -2.596 1.00 0.00 H new ATOM 0 HG22 THR A 63 -18.886 -7.093 -3.405 1.00 0.00 H new ATOM 0 HG23 THR A 63 -19.360 -8.015 -1.958 1.00 0.00 H new ATOM 962 N ALA A 64 -20.487 -8.995 -6.626 1.00 0.00 N ATOM 963 CA ALA A 64 -20.595 -8.330 -7.914 1.00 0.00 C ATOM 964 C ALA A 64 -22.058 -7.938 -8.173 1.00 0.00 C ATOM 965 O ALA A 64 -22.363 -6.775 -8.453 1.00 0.00 O ATOM 966 CB ALA A 64 -20.033 -9.277 -8.978 1.00 0.00 C ATOM 0 H ALA A 64 -20.169 -9.963 -6.673 1.00 0.00 H new ATOM 0 HA ALA A 64 -20.019 -7.405 -7.940 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -20.101 -8.804 -9.958 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.990 -9.499 -8.753 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.608 -10.203 -8.981 1.00 0.00 H new ATOM 972 N GLY A 65 -22.983 -8.876 -7.953 1.00 0.00 N ATOM 973 CA GLY A 65 -24.420 -8.656 -8.046 1.00 0.00 C ATOM 974 C GLY A 65 -24.927 -7.611 -7.049 1.00 0.00 C ATOM 975 O GLY A 65 -25.947 -6.976 -7.314 1.00 0.00 O ATOM 0 H GLY A 65 -22.742 -9.834 -7.699 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -24.669 -8.337 -9.058 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -24.939 -9.599 -7.872 1.00 0.00 H new ATOM 979 N LYS A 66 -24.199 -7.358 -5.952 1.00 0.00 N ATOM 980 CA LYS A 66 -24.515 -6.306 -4.981 1.00 0.00 C ATOM 981 C LYS A 66 -24.578 -4.923 -5.641 1.00 0.00 C ATOM 982 O LYS A 66 -25.276 -4.047 -5.129 1.00 0.00 O ATOM 983 CB LYS A 66 -23.481 -6.318 -3.838 1.00 0.00 C ATOM 984 CG LYS A 66 -24.110 -6.071 -2.463 1.00 0.00 C ATOM 985 CD LYS A 66 -23.055 -5.995 -1.345 1.00 0.00 C ATOM 986 CE LYS A 66 -22.084 -7.186 -1.235 1.00 0.00 C ATOM 987 NZ LYS A 66 -22.737 -8.518 -1.121 1.00 0.00 N ATOM 0 H LYS A 66 -23.361 -7.888 -5.713 1.00 0.00 H new ATOM 0 HA LYS A 66 -25.503 -6.512 -4.570 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -22.967 -7.279 -3.830 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -22.726 -5.555 -4.029 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -24.678 -5.141 -2.487 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -24.816 -6.871 -2.240 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -22.468 -5.088 -1.491 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -23.574 -5.889 -0.392 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -21.435 -7.189 -2.111 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -21.444 -7.035 -0.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -22.026 -9.233 -0.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -23.471 -8.483 -0.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -23.171 -8.771 -2.032 1.00 0.00 H new ATOM 1001 N TYR A 67 -23.900 -4.736 -6.781 1.00 0.00 N ATOM 1002 CA TYR A 67 -23.878 -3.490 -7.545 1.00 0.00 C ATOM 1003 C TYR A 67 -24.299 -3.750 -9.004 1.00 0.00 C ATOM 1004 O TYR A 67 -24.075 -2.909 -9.877 1.00 0.00 O ATOM 1005 CB TYR A 67 -22.486 -2.835 -7.444 1.00 0.00 C ATOM 1006 CG TYR A 67 -21.726 -3.108 -6.157 1.00 0.00 C ATOM 1007 CD1 TYR A 67 -21.972 -2.364 -4.987 1.00 0.00 C ATOM 1008 CD2 TYR A 67 -20.812 -4.177 -6.126 1.00 0.00 C ATOM 1009 CE1 TYR A 67 -21.312 -2.696 -3.789 1.00 0.00 C ATOM 1010 CE2 TYR A 67 -20.164 -4.526 -4.934 1.00 0.00 C ATOM 1011 CZ TYR A 67 -20.420 -3.793 -3.752 1.00 0.00 C ATOM 1012 OH TYR A 67 -19.854 -4.152 -2.568 1.00 0.00 O ATOM 0 H TYR A 67 -23.336 -5.472 -7.206 1.00 0.00 H new ATOM 0 HA TYR A 67 -24.599 -2.790 -7.124 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -21.880 -3.178 -8.283 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -22.602 -1.757 -7.555 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -22.668 -1.538 -5.009 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -20.608 -4.733 -7.029 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -21.487 -2.113 -2.897 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -19.470 -5.353 -4.918 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.888 -4.264 -2.688 1.00 0.00 H new ATOM 1022 N GLY A 68 -24.892 -4.919 -9.283 1.00 0.00 N ATOM 1023 CA GLY A 68 -25.347 -5.328 -10.608 1.00 0.00 C ATOM 1024 C GLY A 68 -24.212 -5.630 -11.592 1.00 0.00 C ATOM 1025 O GLY A 68 -24.439 -5.620 -12.803 1.00 0.00 O ATOM 0 H GLY A 68 -25.071 -5.623 -8.567 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -25.973 -6.215 -10.508 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -25.975 -4.540 -11.024 1.00 0.00 H new ATOM 1029 N VAL A 69 -22.997 -5.879 -11.103 1.00 0.00 N ATOM 1030 CA VAL A 69 -21.846 -6.228 -11.927 1.00 0.00 C ATOM 1031 C VAL A 69 -21.939 -7.724 -12.249 1.00 0.00 C ATOM 1032 O VAL A 69 -22.057 -8.548 -11.344 1.00 0.00 O ATOM 1033 CB VAL A 69 -20.537 -5.866 -11.181 1.00 0.00 C ATOM 1034 CG1 VAL A 69 -19.283 -6.233 -11.988 1.00 0.00 C ATOM 1035 CG2 VAL A 69 -20.482 -4.362 -10.866 1.00 0.00 C ATOM 0 H VAL A 69 -22.784 -5.842 -10.106 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.840 -5.667 -12.861 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.546 -6.447 -10.259 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -18.393 -5.959 -11.422 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -19.275 -7.306 -12.180 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -19.290 -5.695 -12.936 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -19.554 -4.134 -10.342 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.524 -3.794 -11.795 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.330 -4.091 -10.237 1.00 0.00 H new ATOM 1045 N MET A 70 -21.855 -8.068 -13.535 1.00 0.00 N ATOM 1046 CA MET A 70 -21.699 -9.432 -14.052 1.00 0.00 C ATOM 1047 C MET A 70 -20.864 -9.378 -15.350 1.00 0.00 C ATOM 1048 O MET A 70 -21.012 -10.209 -16.250 1.00 0.00 O ATOM 1049 CB MET A 70 -23.079 -10.114 -14.220 1.00 0.00 C ATOM 1050 CG MET A 70 -23.500 -10.956 -13.005 1.00 0.00 C ATOM 1051 SD MET A 70 -22.487 -12.441 -12.690 1.00 0.00 S ATOM 1052 CE MET A 70 -21.523 -11.946 -11.230 1.00 0.00 C ATOM 0 H MET A 70 -21.896 -7.373 -14.280 1.00 0.00 H new ATOM 0 HA MET A 70 -21.156 -10.056 -13.342 1.00 0.00 H new ATOM 0 HB2 MET A 70 -23.834 -9.349 -14.401 1.00 0.00 H new ATOM 0 HB3 MET A 70 -23.055 -10.752 -15.103 1.00 0.00 H new ATOM 0 HG2 MET A 70 -23.471 -10.323 -12.118 1.00 0.00 H new ATOM 0 HG3 MET A 70 -24.536 -11.266 -13.141 1.00 0.00 H new ATOM 0 HE1 MET A 70 -21.204 -12.835 -10.686 1.00 0.00 H new ATOM 0 HE2 MET A 70 -20.647 -11.381 -11.547 1.00 0.00 H new ATOM 0 HE3 MET A 70 -22.140 -11.325 -10.580 1.00 0.00 H new ATOM 1062 N SER A 71 -19.975 -8.385 -15.447 1.00 0.00 N ATOM 1063 CA SER A 71 -19.068 -8.137 -16.555 1.00 0.00 C ATOM 1064 C SER A 71 -17.756 -7.638 -15.947 1.00 0.00 C ATOM 1065 O SER A 71 -17.765 -7.066 -14.853 1.00 0.00 O ATOM 1066 CB SER A 71 -19.667 -7.088 -17.506 1.00 0.00 C ATOM 1067 OG SER A 71 -20.984 -7.428 -17.920 1.00 0.00 O ATOM 0 H SER A 71 -19.869 -7.694 -14.704 1.00 0.00 H new ATOM 0 HA SER A 71 -18.900 -9.042 -17.139 1.00 0.00 H new ATOM 0 HB2 SER A 71 -19.683 -6.118 -17.010 1.00 0.00 H new ATOM 0 HB3 SER A 71 -19.027 -6.987 -18.383 1.00 0.00 H new ATOM 0 HG SER A 71 -21.327 -6.735 -18.521 1.00 0.00 H new ATOM 1073 N ILE A 72 -16.632 -7.872 -16.625 1.00 0.00 N ATOM 1074 CA ILE A 72 -15.296 -7.625 -16.093 1.00 0.00 C ATOM 1075 C ILE A 72 -14.358 -7.164 -17.224 1.00 0.00 C ATOM 1076 O ILE A 72 -14.624 -7.498 -18.383 1.00 0.00 O ATOM 1077 CB ILE A 72 -14.742 -8.886 -15.382 1.00 0.00 C ATOM 1078 CG1 ILE A 72 -14.438 -10.114 -16.272 1.00 0.00 C ATOM 1079 CG2 ILE A 72 -15.584 -9.281 -14.158 1.00 0.00 C ATOM 1080 CD1 ILE A 72 -15.626 -10.932 -16.797 1.00 0.00 C ATOM 0 H ILE A 72 -16.627 -8.245 -17.575 1.00 0.00 H new ATOM 0 HA ILE A 72 -15.355 -6.831 -15.349 1.00 0.00 H new ATOM 0 HB ILE A 72 -13.757 -8.556 -15.051 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -13.863 -9.770 -17.132 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -13.793 -10.786 -15.706 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -15.156 -10.170 -13.694 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -15.587 -8.462 -13.439 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -16.606 -9.492 -14.472 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -15.258 -11.759 -17.404 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -16.197 -11.325 -15.956 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -16.268 -10.293 -17.404 1.00 0.00 H new ATOM 1092 N PRO A 73 -13.246 -6.461 -16.929 1.00 0.00 N ATOM 1093 CA PRO A 73 -12.907 -5.886 -15.632 1.00 0.00 C ATOM 1094 C PRO A 73 -13.879 -4.754 -15.304 1.00 0.00 C ATOM 1095 O PRO A 73 -14.243 -3.970 -16.185 1.00 0.00 O ATOM 1096 CB PRO A 73 -11.472 -5.366 -15.757 1.00 0.00 C ATOM 1097 CG PRO A 73 -11.309 -5.094 -17.250 1.00 0.00 C ATOM 1098 CD PRO A 73 -12.229 -6.121 -17.908 1.00 0.00 C ATOM 0 HA PRO A 73 -12.980 -6.617 -14.827 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -11.322 -4.462 -15.167 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -10.749 -6.101 -15.403 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -11.599 -4.075 -17.505 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -10.275 -5.220 -17.569 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.683 -5.711 -18.810 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.668 -7.007 -18.207 1.00 0.00 H new ATOM 1106 N THR A 74 -14.260 -4.656 -14.036 1.00 0.00 N ATOM 1107 CA THR A 74 -15.113 -3.598 -13.534 1.00 0.00 C ATOM 1108 C THR A 74 -14.440 -3.067 -12.277 1.00 0.00 C ATOM 1109 O THR A 74 -14.231 -3.792 -11.302 1.00 0.00 O ATOM 1110 CB THR A 74 -16.544 -4.113 -13.319 1.00 0.00 C ATOM 1111 OG1 THR A 74 -17.113 -4.460 -14.566 1.00 0.00 O ATOM 1112 CG2 THR A 74 -17.426 -3.045 -12.667 1.00 0.00 C ATOM 0 H THR A 74 -13.977 -5.324 -13.319 1.00 0.00 H new ATOM 0 HA THR A 74 -15.227 -2.778 -14.243 1.00 0.00 H new ATOM 0 HB THR A 74 -16.492 -4.981 -12.662 1.00 0.00 H new ATOM 0 HG1 THR A 74 -17.387 -5.401 -14.550 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.433 -3.440 -12.528 1.00 0.00 H new ATOM 0 HG22 THR A 74 -17.008 -2.769 -11.699 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.467 -2.165 -13.309 1.00 0.00 H new ATOM 1120 N LEU A 75 -14.045 -1.801 -12.336 1.00 0.00 N ATOM 1121 CA LEU A 75 -13.424 -1.100 -11.234 1.00 0.00 C ATOM 1122 C LEU A 75 -14.543 -0.429 -10.457 1.00 0.00 C ATOM 1123 O LEU A 75 -15.420 0.189 -11.063 1.00 0.00 O ATOM 1124 CB LEU A 75 -12.446 -0.035 -11.755 1.00 0.00 C ATOM 1125 CG LEU A 75 -11.234 -0.583 -12.533 1.00 0.00 C ATOM 1126 CD1 LEU A 75 -10.377 0.588 -13.023 1.00 0.00 C ATOM 1127 CD2 LEU A 75 -10.366 -1.528 -11.694 1.00 0.00 C ATOM 0 H LEU A 75 -14.153 -1.227 -13.172 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.860 -1.791 -10.607 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.992 0.652 -12.401 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -12.081 0.546 -10.908 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.623 -1.160 -13.372 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.518 0.205 -13.574 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -10.972 1.226 -13.676 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -10.030 1.168 -12.168 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.528 -1.882 -12.295 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.988 -0.996 -10.821 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -10.964 -2.379 -11.369 1.00 0.00 H new ATOM 1139 N LEU A 76 -14.490 -0.497 -9.132 1.00 0.00 N ATOM 1140 CA LEU A 76 -15.351 0.281 -8.252 1.00 0.00 C ATOM 1141 C LEU A 76 -14.405 1.109 -7.405 1.00 0.00 C ATOM 1142 O LEU A 76 -13.455 0.565 -6.838 1.00 0.00 O ATOM 1143 CB LEU A 76 -16.234 -0.606 -7.352 1.00 0.00 C ATOM 1144 CG LEU A 76 -17.682 -0.786 -7.840 1.00 0.00 C ATOM 1145 CD1 LEU A 76 -17.778 -1.631 -9.113 1.00 0.00 C ATOM 1146 CD2 LEU A 76 -18.525 -1.446 -6.743 1.00 0.00 C ATOM 0 H LEU A 76 -13.839 -1.103 -8.633 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.044 0.889 -8.833 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.770 -1.589 -7.268 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -16.254 -0.176 -6.351 1.00 0.00 H new ATOM 0 HG LEU A 76 -18.060 0.210 -8.072 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -18.823 -1.724 -9.410 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.215 -1.150 -9.913 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -17.365 -2.622 -8.924 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -19.549 -1.570 -7.096 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -18.105 -2.422 -6.499 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -18.522 -0.816 -5.853 1.00 0.00 H new ATOM 1158 N VAL A 77 -14.659 2.408 -7.307 1.00 0.00 N ATOM 1159 CA VAL A 77 -13.965 3.251 -6.354 1.00 0.00 C ATOM 1160 C VAL A 77 -14.894 3.246 -5.153 1.00 0.00 C ATOM 1161 O VAL A 77 -16.065 3.626 -5.272 1.00 0.00 O ATOM 1162 CB VAL A 77 -13.720 4.665 -6.915 1.00 0.00 C ATOM 1163 CG1 VAL A 77 -12.841 5.489 -5.961 1.00 0.00 C ATOM 1164 CG2 VAL A 77 -13.043 4.635 -8.296 1.00 0.00 C ATOM 0 H VAL A 77 -15.345 2.898 -7.881 1.00 0.00 H new ATOM 0 HA VAL A 77 -12.965 2.894 -6.106 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.702 5.127 -7.015 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -12.683 6.483 -6.379 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.337 5.577 -4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -11.879 4.992 -5.832 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.892 5.655 -8.649 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.080 4.131 -8.218 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -13.678 4.098 -9.001 1.00 0.00 H new ATOM 1174 N LEU A 78 -14.385 2.795 -4.013 1.00 0.00 N ATOM 1175 CA LEU A 78 -15.061 2.868 -2.732 1.00 0.00 C ATOM 1176 C LEU A 78 -14.232 3.778 -1.837 1.00 0.00 C ATOM 1177 O LEU A 78 -13.035 3.967 -2.070 1.00 0.00 O ATOM 1178 CB LEU A 78 -15.247 1.475 -2.094 1.00 0.00 C ATOM 1179 CG LEU A 78 -16.058 0.481 -2.958 1.00 0.00 C ATOM 1180 CD1 LEU A 78 -15.137 -0.482 -3.716 1.00 0.00 C ATOM 1181 CD2 LEU A 78 -17.042 -0.336 -2.111 1.00 0.00 C ATOM 0 H LEU A 78 -13.465 2.357 -3.957 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.066 3.269 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.265 1.046 -1.893 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.746 1.593 -1.132 1.00 0.00 H new ATOM 0 HG LEU A 78 -16.619 1.082 -3.673 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.739 -1.167 -4.313 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.476 0.086 -4.371 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.540 -1.051 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.593 -1.023 -2.754 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.492 -0.904 -1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.742 0.337 -1.616 1.00 0.00 H new ATOM 1193 N LYS A 79 -14.849 4.335 -0.802 1.00 0.00 N ATOM 1194 CA LYS A 79 -14.172 5.143 0.196 1.00 0.00 C ATOM 1195 C LYS A 79 -14.867 4.892 1.519 1.00 0.00 C ATOM 1196 O LYS A 79 -16.088 5.041 1.595 1.00 0.00 O ATOM 1197 CB LYS A 79 -14.216 6.622 -0.218 1.00 0.00 C ATOM 1198 CG LYS A 79 -13.298 7.487 0.659 1.00 0.00 C ATOM 1199 CD LYS A 79 -13.281 8.933 0.144 1.00 0.00 C ATOM 1200 CE LYS A 79 -12.152 9.743 0.795 1.00 0.00 C ATOM 1201 NZ LYS A 79 -12.088 11.118 0.250 1.00 0.00 N ATOM 0 H LYS A 79 -15.850 4.234 -0.633 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.119 4.878 0.289 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.916 6.716 -1.262 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.240 6.989 -0.146 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.644 7.465 1.692 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.287 7.079 0.653 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.155 8.934 -0.939 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.240 9.407 0.354 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.307 9.785 1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.199 9.240 0.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -11.124 11.491 0.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.339 11.103 -0.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.756 11.727 0.764 1.00 0.00 H new ATOM 1215 N ASP A 80 -14.096 4.511 2.541 1.00 0.00 N ATOM 1216 CA ASP A 80 -14.555 4.310 3.918 1.00 0.00 C ATOM 1217 C ASP A 80 -15.881 3.524 4.013 1.00 0.00 C ATOM 1218 O ASP A 80 -16.749 3.823 4.836 1.00 0.00 O ATOM 1219 CB ASP A 80 -14.582 5.668 4.644 1.00 0.00 C ATOM 1220 CG ASP A 80 -14.850 5.536 6.154 1.00 0.00 C ATOM 1221 OD1 ASP A 80 -14.212 4.690 6.819 1.00 0.00 O ATOM 1222 OD2 ASP A 80 -15.653 6.328 6.701 1.00 0.00 O ATOM 0 H ASP A 80 -13.099 4.327 2.428 1.00 0.00 H new ATOM 0 HA ASP A 80 -13.843 3.665 4.433 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -13.629 6.174 4.492 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -15.352 6.298 4.197 1.00 0.00 H new ATOM 1227 N GLY A 81 -16.053 2.514 3.151 1.00 0.00 N ATOM 1228 CA GLY A 81 -17.138 1.543 3.240 1.00 0.00 C ATOM 1229 C GLY A 81 -18.311 1.820 2.298 1.00 0.00 C ATOM 1230 O GLY A 81 -19.319 1.116 2.389 1.00 0.00 O ATOM 0 H GLY A 81 -15.429 2.351 2.361 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.741 0.551 3.024 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.508 1.522 4.265 1.00 0.00 H new ATOM 1234 N GLU A 82 -18.211 2.801 1.395 1.00 0.00 N ATOM 1235 CA GLU A 82 -19.270 3.139 0.444 1.00 0.00 C ATOM 1236 C GLU A 82 -18.673 3.189 -0.957 1.00 0.00 C ATOM 1237 O GLU A 82 -17.575 3.716 -1.127 1.00 0.00 O ATOM 1238 CB GLU A 82 -19.881 4.514 0.774 1.00 0.00 C ATOM 1239 CG GLU A 82 -20.507 4.587 2.170 1.00 0.00 C ATOM 1240 CD GLU A 82 -21.267 5.908 2.380 1.00 0.00 C ATOM 1241 OE1 GLU A 82 -20.663 6.904 2.842 1.00 0.00 O ATOM 1242 OE2 GLU A 82 -22.489 5.963 2.109 1.00 0.00 O ATOM 0 H GLU A 82 -17.382 3.388 1.305 1.00 0.00 H new ATOM 0 HA GLU A 82 -20.053 2.383 0.504 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -19.106 5.276 0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -20.642 4.752 0.031 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -21.189 3.748 2.308 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.727 4.491 2.925 1.00 0.00 H new ATOM 1249 N VAL A 83 -19.373 2.656 -1.962 1.00 0.00 N ATOM 1250 CA VAL A 83 -19.022 2.872 -3.361 1.00 0.00 C ATOM 1251 C VAL A 83 -19.307 4.341 -3.672 1.00 0.00 C ATOM 1252 O VAL A 83 -20.342 4.889 -3.281 1.00 0.00 O ATOM 1253 CB VAL A 83 -19.742 1.849 -4.272 1.00 0.00 C ATOM 1254 CG1 VAL A 83 -21.274 1.839 -4.146 1.00 0.00 C ATOM 1255 CG2 VAL A 83 -19.347 2.033 -5.745 1.00 0.00 C ATOM 0 H VAL A 83 -20.194 2.066 -1.826 1.00 0.00 H new ATOM 0 HA VAL A 83 -17.965 2.692 -3.559 1.00 0.00 H new ATOM 0 HB VAL A 83 -19.399 0.879 -3.911 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -21.690 1.091 -4.822 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -21.553 1.597 -3.121 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -21.667 2.822 -4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -19.871 1.298 -6.357 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -19.618 3.037 -6.072 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.271 1.894 -5.853 1.00 0.00 H new ATOM 1265 N VAL A 84 -18.368 4.971 -4.374 1.00 0.00 N ATOM 1266 CA VAL A 84 -18.437 6.365 -4.777 1.00 0.00 C ATOM 1267 C VAL A 84 -18.258 6.494 -6.292 1.00 0.00 C ATOM 1268 O VAL A 84 -18.697 7.502 -6.843 1.00 0.00 O ATOM 1269 CB VAL A 84 -17.441 7.230 -3.970 1.00 0.00 C ATOM 1270 CG1 VAL A 84 -17.677 7.115 -2.453 1.00 0.00 C ATOM 1271 CG2 VAL A 84 -15.969 6.909 -4.278 1.00 0.00 C ATOM 0 H VAL A 84 -17.514 4.508 -4.685 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.429 6.753 -4.544 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.635 8.254 -4.290 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -16.956 7.738 -1.924 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -18.687 7.448 -2.216 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.555 6.077 -2.143 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.323 7.551 -3.679 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.766 5.865 -4.038 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.772 7.083 -5.336 1.00 0.00 H new ATOM 1281 N GLU A 85 -17.688 5.490 -6.981 1.00 0.00 N ATOM 1282 CA GLU A 85 -17.609 5.511 -8.445 1.00 0.00 C ATOM 1283 C GLU A 85 -17.507 4.093 -9.014 1.00 0.00 C ATOM 1284 O GLU A 85 -17.273 3.131 -8.282 1.00 0.00 O ATOM 1285 CB GLU A 85 -16.428 6.392 -8.918 1.00 0.00 C ATOM 1286 CG GLU A 85 -16.872 7.652 -9.675 1.00 0.00 C ATOM 1287 CD GLU A 85 -17.466 7.377 -11.069 1.00 0.00 C ATOM 1288 OE1 GLU A 85 -18.434 6.593 -11.183 1.00 0.00 O ATOM 1289 OE2 GLU A 85 -16.991 7.974 -12.061 1.00 0.00 O ATOM 0 H GLU A 85 -17.279 4.662 -6.548 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.530 5.951 -8.826 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.835 6.687 -8.052 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.778 5.800 -9.562 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.613 8.180 -9.075 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.016 8.318 -9.783 1.00 0.00 H new ATOM 1296 N THR A 86 -17.688 3.951 -10.326 1.00 0.00 N ATOM 1297 CA THR A 86 -17.603 2.694 -11.064 1.00 0.00 C ATOM 1298 C THR A 86 -17.060 2.983 -12.474 1.00 0.00 C ATOM 1299 O THR A 86 -17.271 4.068 -13.021 1.00 0.00 O ATOM 1300 CB THR A 86 -19.001 2.043 -11.082 1.00 0.00 C ATOM 1301 OG1 THR A 86 -19.421 1.779 -9.756 1.00 0.00 O ATOM 1302 CG2 THR A 86 -19.080 0.730 -11.871 1.00 0.00 C ATOM 0 H THR A 86 -17.907 4.744 -10.929 1.00 0.00 H new ATOM 0 HA THR A 86 -16.917 1.992 -10.590 1.00 0.00 H new ATOM 0 HB THR A 86 -19.648 2.762 -11.585 1.00 0.00 H new ATOM 0 HG1 THR A 86 -20.310 1.367 -9.770 1.00 0.00 H new ATOM 0 HG21 THR A 86 -20.098 0.342 -11.831 1.00 0.00 H new ATOM 0 HG22 THR A 86 -18.802 0.912 -12.909 1.00 0.00 H new ATOM 0 HG23 THR A 86 -18.397 0.002 -11.434 1.00 0.00 H new ATOM 1310 N SER A 87 -16.338 2.031 -13.067 1.00 0.00 N ATOM 1311 CA SER A 87 -15.874 2.057 -14.453 1.00 0.00 C ATOM 1312 C SER A 87 -15.763 0.615 -14.961 1.00 0.00 C ATOM 1313 O SER A 87 -15.602 -0.306 -14.160 1.00 0.00 O ATOM 1314 CB SER A 87 -14.517 2.770 -14.522 1.00 0.00 C ATOM 1315 OG SER A 87 -14.659 4.144 -14.211 1.00 0.00 O ATOM 0 H SER A 87 -16.049 1.186 -12.573 1.00 0.00 H new ATOM 0 HA SER A 87 -16.578 2.601 -15.083 1.00 0.00 H new ATOM 0 HB2 SER A 87 -13.820 2.304 -13.826 1.00 0.00 H new ATOM 0 HB3 SER A 87 -14.092 2.660 -15.520 1.00 0.00 H new ATOM 0 HG SER A 87 -15.578 4.320 -13.919 1.00 0.00 H new ATOM 1321 N VAL A 88 -15.832 0.403 -16.276 1.00 0.00 N ATOM 1322 CA VAL A 88 -15.798 -0.923 -16.892 1.00 0.00 C ATOM 1323 C VAL A 88 -14.793 -0.875 -18.048 1.00 0.00 C ATOM 1324 O VAL A 88 -14.682 0.145 -18.736 1.00 0.00 O ATOM 1325 CB VAL A 88 -17.219 -1.334 -17.355 1.00 0.00 C ATOM 1326 CG1 VAL A 88 -17.256 -2.769 -17.903 1.00 0.00 C ATOM 1327 CG2 VAL A 88 -18.258 -1.240 -16.223 1.00 0.00 C ATOM 0 H VAL A 88 -15.914 1.161 -16.954 1.00 0.00 H new ATOM 0 HA VAL A 88 -15.477 -1.682 -16.179 1.00 0.00 H new ATOM 0 HB VAL A 88 -17.473 -0.626 -18.144 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -18.271 -3.013 -18.215 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -16.584 -2.850 -18.758 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.939 -3.464 -17.125 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -19.236 -1.539 -16.601 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -17.967 -1.901 -15.406 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -18.308 -0.214 -15.859 1.00 0.00 H new ATOM 1337 N GLY A 89 -14.072 -1.977 -18.263 1.00 0.00 N ATOM 1338 CA GLY A 89 -13.063 -2.099 -19.304 1.00 0.00 C ATOM 1339 C GLY A 89 -11.715 -1.535 -18.854 1.00 0.00 C ATOM 1340 O GLY A 89 -11.555 -1.066 -17.722 1.00 0.00 O ATOM 0 H GLY A 89 -14.179 -2.824 -17.704 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.946 -3.148 -19.576 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.397 -1.573 -20.198 1.00 0.00 H new ATOM 1344 N PHE A 90 -10.727 -1.619 -19.748 1.00 0.00 N ATOM 1345 CA PHE A 90 -9.387 -1.081 -19.532 1.00 0.00 C ATOM 1346 C PHE A 90 -9.440 0.443 -19.343 1.00 0.00 C ATOM 1347 O PHE A 90 -10.285 1.120 -19.939 1.00 0.00 O ATOM 1348 CB PHE A 90 -8.503 -1.466 -20.731 1.00 0.00 C ATOM 1349 CG PHE A 90 -7.066 -0.983 -20.643 1.00 0.00 C ATOM 1350 CD1 PHE A 90 -6.096 -1.768 -19.991 1.00 0.00 C ATOM 1351 CD2 PHE A 90 -6.698 0.253 -21.212 1.00 0.00 C ATOM 1352 CE1 PHE A 90 -4.767 -1.313 -19.903 1.00 0.00 C ATOM 1353 CE2 PHE A 90 -5.371 0.710 -21.116 1.00 0.00 C ATOM 1354 CZ PHE A 90 -4.405 -0.075 -20.460 1.00 0.00 C ATOM 0 H PHE A 90 -10.840 -2.070 -20.656 1.00 0.00 H new ATOM 0 HA PHE A 90 -8.960 -1.503 -18.622 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -8.501 -2.552 -20.830 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -8.952 -1.064 -21.639 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.371 -2.719 -19.559 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.437 0.851 -21.723 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.023 -1.918 -19.406 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.094 1.662 -21.545 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.386 0.274 -20.385 1.00 0.00 H new ATOM 1364 N LYS A 91 -8.492 0.989 -18.575 1.00 0.00 N ATOM 1365 CA LYS A 91 -8.230 2.422 -18.458 1.00 0.00 C ATOM 1366 C LYS A 91 -6.714 2.609 -18.395 1.00 0.00 C ATOM 1367 O LYS A 91 -6.043 1.767 -17.794 1.00 0.00 O ATOM 1368 CB LYS A 91 -8.875 3.022 -17.193 1.00 0.00 C ATOM 1369 CG LYS A 91 -10.270 3.590 -17.483 1.00 0.00 C ATOM 1370 CD LYS A 91 -10.868 4.250 -16.231 1.00 0.00 C ATOM 1371 CE LYS A 91 -12.288 4.789 -16.473 1.00 0.00 C ATOM 1372 NZ LYS A 91 -12.329 5.961 -17.385 1.00 0.00 N ATOM 0 H LYS A 91 -7.867 0.425 -18.000 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.662 2.937 -19.316 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.947 2.255 -16.422 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.236 3.811 -16.798 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.208 4.321 -18.289 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.927 2.791 -17.826 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.891 3.525 -15.418 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.222 5.067 -15.911 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -12.904 3.992 -16.890 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.731 5.067 -15.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.314 6.273 -17.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.767 6.736 -16.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.935 5.695 -18.310 1.00 0.00 H new ATOM 1386 N PRO A 92 -6.172 3.692 -18.976 1.00 0.00 N ATOM 1387 CA PRO A 92 -4.763 4.028 -18.848 1.00 0.00 C ATOM 1388 C PRO A 92 -4.465 4.545 -17.436 1.00 0.00 C ATOM 1389 O PRO A 92 -5.367 4.998 -16.721 1.00 0.00 O ATOM 1390 CB PRO A 92 -4.522 5.095 -19.920 1.00 0.00 C ATOM 1391 CG PRO A 92 -5.860 5.822 -20.010 1.00 0.00 C ATOM 1392 CD PRO A 92 -6.872 4.706 -19.755 1.00 0.00 C ATOM 0 HA PRO A 92 -4.104 3.171 -18.990 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.716 5.772 -19.637 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -4.243 4.649 -20.875 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.939 6.616 -19.268 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -6.004 6.283 -20.987 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.739 5.083 -19.213 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -7.239 4.291 -20.694 1.00 0.00 H new ATOM 1400 N LYS A 93 -3.180 4.530 -17.053 1.00 0.00 N ATOM 1401 CA LYS A 93 -2.736 4.964 -15.727 1.00 0.00 C ATOM 1402 C LYS A 93 -3.207 6.380 -15.432 1.00 0.00 C ATOM 1403 O LYS A 93 -3.729 6.619 -14.349 1.00 0.00 O ATOM 1404 CB LYS A 93 -1.198 4.877 -15.617 1.00 0.00 C ATOM 1405 CG LYS A 93 -0.691 5.236 -14.211 1.00 0.00 C ATOM 1406 CD LYS A 93 0.828 5.434 -14.190 1.00 0.00 C ATOM 1407 CE LYS A 93 1.224 5.928 -12.794 1.00 0.00 C ATOM 1408 NZ LYS A 93 2.689 6.073 -12.634 1.00 0.00 N ATOM 0 H LYS A 93 -2.421 4.216 -17.657 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.178 4.296 -14.987 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.875 3.867 -15.870 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.745 5.549 -16.346 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.182 6.147 -13.869 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.965 4.445 -13.513 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.337 4.498 -14.421 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.128 6.156 -14.949 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.745 6.888 -12.603 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.848 5.230 -12.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.891 6.667 -11.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.118 5.135 -12.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.089 6.519 -13.484 1.00 0.00 H new ATOM 1422 N GLU A 94 -3.021 7.314 -16.366 1.00 0.00 N ATOM 1423 CA GLU A 94 -3.219 8.726 -16.091 1.00 0.00 C ATOM 1424 C GLU A 94 -4.670 9.028 -15.734 1.00 0.00 C ATOM 1425 O GLU A 94 -4.927 9.728 -14.755 1.00 0.00 O ATOM 1426 CB GLU A 94 -2.720 9.537 -17.298 1.00 0.00 C ATOM 1427 CG GLU A 94 -2.666 11.032 -16.977 1.00 0.00 C ATOM 1428 CD GLU A 94 -2.084 11.844 -18.147 1.00 0.00 C ATOM 1429 OE1 GLU A 94 -2.847 12.249 -19.054 1.00 0.00 O ATOM 1430 OE2 GLU A 94 -0.859 12.105 -18.167 1.00 0.00 O ATOM 0 H GLU A 94 -2.732 7.110 -17.323 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.639 9.018 -15.216 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.729 9.189 -17.588 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.379 9.369 -18.150 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -3.669 11.392 -16.748 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.059 11.191 -16.086 1.00 0.00 H new ATOM 1437 N ALA A 95 -5.607 8.445 -16.481 1.00 0.00 N ATOM 1438 CA ALA A 95 -7.028 8.609 -16.240 1.00 0.00 C ATOM 1439 C ALA A 95 -7.434 7.971 -14.914 1.00 0.00 C ATOM 1440 O ALA A 95 -8.208 8.550 -14.155 1.00 0.00 O ATOM 1441 CB ALA A 95 -7.786 7.940 -17.382 1.00 0.00 C ATOM 0 H ALA A 95 -5.393 7.842 -17.275 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.265 9.672 -16.189 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.858 8.051 -17.221 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.510 8.410 -18.326 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.532 6.881 -17.416 1.00 0.00 H new ATOM 1447 N LEU A 96 -6.916 6.775 -14.630 1.00 0.00 N ATOM 1448 CA LEU A 96 -7.255 6.050 -13.421 1.00 0.00 C ATOM 1449 C LEU A 96 -6.701 6.777 -12.194 1.00 0.00 C ATOM 1450 O LEU A 96 -7.413 6.933 -11.202 1.00 0.00 O ATOM 1451 CB LEU A 96 -6.737 4.609 -13.540 1.00 0.00 C ATOM 1452 CG LEU A 96 -7.046 3.730 -12.314 1.00 0.00 C ATOM 1453 CD1 LEU A 96 -8.540 3.684 -11.970 1.00 0.00 C ATOM 1454 CD2 LEU A 96 -6.540 2.311 -12.593 1.00 0.00 C ATOM 0 H LEU A 96 -6.253 6.290 -15.234 1.00 0.00 H new ATOM 0 HA LEU A 96 -8.337 6.007 -13.294 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -7.176 4.148 -14.425 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.658 4.633 -13.695 1.00 0.00 H new ATOM 0 HG LEU A 96 -6.541 4.169 -11.454 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -8.693 3.049 -11.097 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -8.894 4.691 -11.752 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -9.096 3.279 -12.816 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.751 1.674 -11.734 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -7.044 1.912 -13.473 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.465 2.336 -12.771 1.00 0.00 H new ATOM 1466 N GLN A 97 -5.464 7.281 -12.254 1.00 0.00 N ATOM 1467 CA GLN A 97 -4.925 8.021 -11.125 1.00 0.00 C ATOM 1468 C GLN A 97 -5.657 9.355 -10.990 1.00 0.00 C ATOM 1469 O GLN A 97 -5.910 9.783 -9.869 1.00 0.00 O ATOM 1470 CB GLN A 97 -3.388 8.107 -11.131 1.00 0.00 C ATOM 1471 CG GLN A 97 -2.745 9.032 -12.171 1.00 0.00 C ATOM 1472 CD GLN A 97 -2.885 10.524 -11.860 1.00 0.00 C ATOM 1473 OE1 GLN A 97 -2.512 10.997 -10.789 1.00 0.00 O ATOM 1474 NE2 GLN A 97 -3.452 11.293 -12.777 1.00 0.00 N ATOM 0 H GLN A 97 -4.837 7.190 -13.053 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.122 7.465 -10.208 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -3.063 8.432 -10.142 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.993 7.102 -11.282 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.686 8.788 -12.252 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.193 8.832 -13.144 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -3.758 10.890 -13.663 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.583 12.289 -12.598 1.00 0.00 H new ATOM 1483 N GLU A 98 -6.073 9.991 -12.092 1.00 0.00 N ATOM 1484 CA GLU A 98 -6.847 11.228 -12.040 1.00 0.00 C ATOM 1485 C GLU A 98 -8.147 10.956 -11.285 1.00 0.00 C ATOM 1486 O GLU A 98 -8.484 11.693 -10.361 1.00 0.00 O ATOM 1487 CB GLU A 98 -7.095 11.762 -13.461 1.00 0.00 C ATOM 1488 CG GLU A 98 -7.907 13.061 -13.449 1.00 0.00 C ATOM 1489 CD GLU A 98 -8.272 13.525 -14.868 1.00 0.00 C ATOM 1490 OE1 GLU A 98 -7.402 14.061 -15.589 1.00 0.00 O ATOM 1491 OE2 GLU A 98 -9.457 13.390 -15.248 1.00 0.00 O ATOM 0 H GLU A 98 -5.882 9.661 -13.038 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.296 12.003 -11.508 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.139 11.936 -13.956 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.624 11.009 -14.045 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.819 12.913 -12.870 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.335 13.842 -12.948 1.00 0.00 H new ATOM 1498 N LEU A 99 -8.817 9.851 -11.616 1.00 0.00 N ATOM 1499 CA LEU A 99 -10.029 9.409 -10.936 1.00 0.00 C ATOM 1500 C LEU A 99 -9.771 9.201 -9.439 1.00 0.00 C ATOM 1501 O LEU A 99 -10.606 9.587 -8.623 1.00 0.00 O ATOM 1502 CB LEU A 99 -10.571 8.135 -11.610 1.00 0.00 C ATOM 1503 CG LEU A 99 -11.877 7.595 -10.995 1.00 0.00 C ATOM 1504 CD1 LEU A 99 -13.034 8.588 -11.138 1.00 0.00 C ATOM 1505 CD2 LEU A 99 -12.257 6.274 -11.678 1.00 0.00 C ATOM 0 H LEU A 99 -8.527 9.232 -12.373 1.00 0.00 H new ATOM 0 HA LEU A 99 -10.790 10.185 -11.021 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.740 8.342 -12.667 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.809 7.357 -11.555 1.00 0.00 H new ATOM 0 HG LEU A 99 -11.700 7.438 -9.931 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -13.934 8.165 -10.691 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.779 9.519 -10.631 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.214 8.788 -12.194 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.181 5.892 -11.243 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -12.402 6.444 -12.745 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.459 5.546 -11.532 1.00 0.00 H new ATOM 1517 N VAL A 100 -8.616 8.642 -9.060 1.00 0.00 N ATOM 1518 CA VAL A 100 -8.249 8.506 -7.654 1.00 0.00 C ATOM 1519 C VAL A 100 -8.094 9.888 -7.002 1.00 0.00 C ATOM 1520 O VAL A 100 -8.703 10.116 -5.959 1.00 0.00 O ATOM 1521 CB VAL A 100 -7.010 7.597 -7.500 1.00 0.00 C ATOM 1522 CG1 VAL A 100 -6.429 7.626 -6.081 1.00 0.00 C ATOM 1523 CG2 VAL A 100 -7.375 6.143 -7.845 1.00 0.00 C ATOM 0 H VAL A 100 -7.921 8.277 -9.712 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.053 8.007 -7.112 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.256 7.982 -8.186 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.560 6.969 -6.030 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.130 8.644 -5.831 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -7.183 7.285 -5.372 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.494 5.510 -7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.159 5.795 -7.173 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.730 6.091 -8.874 1.00 0.00 H new ATOM 1533 N ASN A 101 -7.355 10.838 -7.598 1.00 0.00 N ATOM 1534 CA ASN A 101 -7.196 12.184 -7.009 1.00 0.00 C ATOM 1535 C ASN A 101 -8.560 12.835 -6.828 1.00 0.00 C ATOM 1536 O ASN A 101 -8.820 13.492 -5.821 1.00 0.00 O ATOM 1537 CB ASN A 101 -6.391 13.179 -7.869 1.00 0.00 C ATOM 1538 CG ASN A 101 -4.925 12.854 -8.060 1.00 0.00 C ATOM 1539 OD1 ASN A 101 -4.048 13.340 -7.354 1.00 0.00 O ATOM 1540 ND2 ASN A 101 -4.655 12.050 -9.064 1.00 0.00 N ATOM 0 H ASN A 101 -6.861 10.704 -8.480 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.660 12.004 -6.077 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.860 13.242 -8.851 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -6.468 14.167 -7.415 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -3.687 11.810 -9.279 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -5.413 11.666 -9.628 1.00 0.00 H new ATOM 1547 N LYS A 102 -9.425 12.650 -7.827 1.00 0.00 N ATOM 1548 CA LYS A 102 -10.773 13.217 -7.850 1.00 0.00 C ATOM 1549 C LYS A 102 -11.664 12.699 -6.714 1.00 0.00 C ATOM 1550 O LYS A 102 -12.702 13.315 -6.469 1.00 0.00 O ATOM 1551 CB LYS A 102 -11.427 12.991 -9.226 1.00 0.00 C ATOM 1552 CG LYS A 102 -10.925 14.014 -10.257 1.00 0.00 C ATOM 1553 CD LYS A 102 -11.496 13.741 -11.655 1.00 0.00 C ATOM 1554 CE LYS A 102 -11.175 14.924 -12.580 1.00 0.00 C ATOM 1555 NZ LYS A 102 -11.571 14.677 -13.988 1.00 0.00 N ATOM 0 H LYS A 102 -9.205 12.094 -8.654 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.670 14.289 -7.682 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.207 11.982 -9.575 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.510 13.067 -9.133 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -11.206 15.018 -9.939 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.836 13.985 -10.297 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.070 12.823 -12.060 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -12.574 13.594 -11.596 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -11.687 15.814 -12.214 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -10.106 15.131 -12.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -11.978 15.545 -14.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.735 14.397 -14.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -12.279 13.915 -14.021 1.00 0.00 H new ATOM 1569 N HIS A 103 -11.285 11.627 -6.007 1.00 0.00 N ATOM 1570 CA HIS A 103 -12.079 11.075 -4.906 1.00 0.00 C ATOM 1571 C HIS A 103 -11.323 10.966 -3.578 1.00 0.00 C ATOM 1572 O HIS A 103 -11.978 10.878 -2.536 1.00 0.00 O ATOM 1573 CB HIS A 103 -12.683 9.724 -5.319 1.00 0.00 C ATOM 1574 CG HIS A 103 -13.877 9.885 -6.227 1.00 0.00 C ATOM 1575 ND1 HIS A 103 -15.193 9.996 -5.829 1.00 0.00 N ATOM 1576 CD2 HIS A 103 -13.856 10.032 -7.587 1.00 0.00 C ATOM 1577 CE1 HIS A 103 -15.942 10.199 -6.924 1.00 0.00 C ATOM 1578 NE2 HIS A 103 -15.170 10.241 -8.026 1.00 0.00 N ATOM 0 H HIS A 103 -10.418 11.119 -6.184 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.879 11.790 -4.715 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -11.923 9.128 -5.824 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -12.980 9.173 -4.427 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -12.978 9.994 -8.214 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -17.016 10.313 -6.921 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -15.479 10.394 -8.986 1.00 0.00 H new ATOM 1586 N LEU A 104 -9.986 10.976 -3.560 1.00 0.00 N ATOM 1587 CA LEU A 104 -9.218 10.911 -2.324 1.00 0.00 C ATOM 1588 C LEU A 104 -9.358 12.221 -1.556 1.00 0.00 C ATOM 1589 O LEU A 104 -9.297 13.307 -2.167 1.00 0.00 O ATOM 1590 CB LEU A 104 -7.786 10.403 -2.587 1.00 0.00 C ATOM 1591 CG LEU A 104 -6.690 11.456 -2.793 1.00 0.00 C ATOM 1592 CD1 LEU A 104 -6.139 11.946 -1.447 1.00 0.00 C ATOM 1593 CD2 LEU A 104 -5.527 10.818 -3.561 1.00 0.00 C ATOM 1594 OXT LEU A 104 -9.592 12.144 -0.331 1.00 0.00 O ATOM 0 H LEU A 104 -9.413 11.029 -4.402 1.00 0.00 H new ATOM 0 HA LEU A 104 -9.624 10.158 -1.648 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.493 9.772 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.812 9.766 -3.471 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.122 12.295 -3.339 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.363 12.692 -1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.945 12.390 -0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.716 11.104 -0.899 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.742 11.558 -3.713 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.130 9.980 -2.989 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.882 10.462 -4.528 1.00 0.00 H new