USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 708 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 Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0663 USER MOD Single : A 42 GLN : amide:sc= -0.593 K(o=-0.59,f=-3.2!) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.0036) USER MOD Single : A 45 LYS NZ :NH3+ 175:sc= 1.16 (180deg=1.15) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 172:sc= -0.099 (180deg=-0.293) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -148:sc= 1.14 (180deg=0.487) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 THR OG1 : rot 170:sc= -0.0575 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 42 GLN : amide:sc= -0.223 K(o=-0.22,f=-1.6) USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= 0.391 X(o=0.39,f=0) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 MET CE :methyl 169:sc= -1.53 (180deg=-1.7) USER MOD Single : B 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 56 SER OG : rot 140:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 60 TYR OH : rot 180:sc= 0 USER MOD Single : B 62 LYS NZ :NH3+ -149:sc= 0.859 (180deg=0.293) USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 15 N ARG A 32 -7.233 10.531 -11.158 1.00 0.00 N ATOM 16 CA ARG A 32 -6.415 10.376 -9.942 1.00 0.00 C ATOM 17 C ARG A 32 -4.946 10.123 -10.282 1.00 0.00 C ATOM 18 O ARG A 32 -4.583 9.033 -10.719 1.00 0.00 O ATOM 19 CB ARG A 32 -6.993 9.265 -9.043 1.00 0.00 C ATOM 20 CG ARG A 32 -8.414 9.545 -8.531 1.00 0.00 C ATOM 21 CD ARG A 32 -8.480 10.759 -7.595 1.00 0.00 C ATOM 22 NE ARG A 32 -9.874 11.080 -7.245 1.00 0.00 N ATOM 23 CZ ARG A 32 -10.291 11.926 -6.318 1.00 0.00 C ATOM 24 NH1 ARG A 32 -9.462 12.573 -5.547 1.00 0.00 N ATOM 25 NH2 ARG A 32 -11.564 12.143 -6.148 1.00 0.00 N ATOM 0 HA ARG A 32 -6.452 11.312 -9.385 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.998 8.328 -9.600 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.332 9.124 -8.188 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.076 9.711 -9.381 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.786 8.666 -8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.911 10.555 -6.688 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -8.015 11.619 -8.076 1.00 0.00 H new ATOM 0 HE ARG A 32 -10.598 10.596 -7.776 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -8.457 12.434 -5.649 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -9.819 13.218 -4.842 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -12.246 11.659 -6.732 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -11.879 12.797 -5.431 1.00 0.00 H new ATOM 39 N ALA A 33 -4.102 11.133 -10.089 1.00 0.00 N ATOM 40 CA ALA A 33 -2.649 10.993 -10.164 1.00 0.00 C ATOM 41 C ALA A 33 -2.128 9.994 -9.106 1.00 0.00 C ATOM 42 O ALA A 33 -2.494 10.072 -7.930 1.00 0.00 O ATOM 43 CB ALA A 33 -2.016 12.379 -9.996 1.00 0.00 C ATOM 0 H ALA A 33 -4.410 12.081 -9.874 1.00 0.00 H new ATOM 0 HA ALA A 33 -2.368 10.587 -11.136 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -0.931 12.292 -10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -2.367 13.038 -10.790 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -2.300 12.794 -9.029 1.00 0.00 H new ATOM 49 N VAL A 34 -1.264 9.067 -9.523 1.00 0.00 N ATOM 50 CA VAL A 34 -0.656 8.002 -8.710 1.00 0.00 C ATOM 51 C VAL A 34 0.840 7.984 -8.984 1.00 0.00 C ATOM 52 O VAL A 34 1.297 7.416 -9.969 1.00 0.00 O ATOM 53 CB VAL A 34 -1.316 6.635 -8.971 1.00 0.00 C ATOM 54 CG1 VAL A 34 -0.608 5.488 -8.241 1.00 0.00 C ATOM 55 CG2 VAL A 34 -2.772 6.649 -8.484 1.00 0.00 C ATOM 0 H VAL A 34 -0.949 9.034 -10.493 1.00 0.00 H new ATOM 0 HA VAL A 34 -0.822 8.208 -7.653 1.00 0.00 H new ATOM 0 HB VAL A 34 -1.251 6.469 -10.046 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -1.115 4.549 -8.461 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.428 5.428 -8.576 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.632 5.671 -7.167 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.228 5.678 -8.674 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.796 6.859 -7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.327 7.421 -9.018 1.00 0.00 H new ATOM 65 N SER A 35 1.593 8.669 -8.132 1.00 0.00 N ATOM 66 CA SER A 35 3.028 8.925 -8.283 1.00 0.00 C ATOM 67 C SER A 35 3.814 8.245 -7.167 1.00 0.00 C ATOM 68 O SER A 35 3.696 8.614 -5.994 1.00 0.00 O ATOM 69 CB SER A 35 3.283 10.429 -8.321 1.00 0.00 C ATOM 70 OG SER A 35 4.660 10.715 -8.510 1.00 0.00 O ATOM 0 H SER A 35 1.209 9.080 -7.281 1.00 0.00 H new ATOM 0 HA SER A 35 3.373 8.500 -9.226 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.702 10.878 -9.127 1.00 0.00 H new ATOM 0 HB3 SER A 35 2.940 10.882 -7.391 1.00 0.00 H new ATOM 0 HG SER A 35 4.792 11.686 -8.532 1.00 0.00 H new ATOM 76 N LEU A 36 4.550 7.194 -7.532 1.00 0.00 N ATOM 77 CA LEU A 36 5.120 6.215 -6.603 1.00 0.00 C ATOM 78 C LEU A 36 6.635 6.044 -6.770 1.00 0.00 C ATOM 79 O LEU A 36 7.221 6.409 -7.792 1.00 0.00 O ATOM 80 CB LEU A 36 4.377 4.875 -6.778 1.00 0.00 C ATOM 81 CG LEU A 36 2.860 4.935 -6.511 1.00 0.00 C ATOM 82 CD1 LEU A 36 2.230 3.573 -6.785 1.00 0.00 C ATOM 83 CD2 LEU A 36 2.538 5.316 -5.065 1.00 0.00 C ATOM 0 H LEU A 36 4.772 6.994 -8.507 1.00 0.00 H new ATOM 0 HA LEU A 36 4.981 6.585 -5.587 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.538 4.517 -7.795 1.00 0.00 H new ATOM 0 HB3 LEU A 36 4.821 4.140 -6.107 1.00 0.00 H new ATOM 0 HG LEU A 36 2.456 5.700 -7.175 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.158 3.623 -6.594 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.401 3.296 -7.825 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.680 2.826 -6.132 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.457 5.345 -4.928 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.970 4.578 -4.389 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.958 6.298 -4.845 1.00 0.00 H new ATOM 95 N TYR A 37 7.251 5.450 -5.746 1.00 0.00 N ATOM 96 CA TYR A 37 8.700 5.371 -5.547 1.00 0.00 C ATOM 97 C TYR A 37 9.128 3.913 -5.335 1.00 0.00 C ATOM 98 O TYR A 37 9.283 3.434 -4.207 1.00 0.00 O ATOM 99 CB TYR A 37 9.107 6.323 -4.410 1.00 0.00 C ATOM 100 CG TYR A 37 8.715 7.768 -4.675 1.00 0.00 C ATOM 101 CD1 TYR A 37 9.494 8.556 -5.544 1.00 0.00 C ATOM 102 CD2 TYR A 37 7.544 8.307 -4.104 1.00 0.00 C ATOM 103 CE1 TYR A 37 9.111 9.878 -5.840 1.00 0.00 C ATOM 104 CE2 TYR A 37 7.151 9.626 -4.404 1.00 0.00 C ATOM 105 CZ TYR A 37 7.936 10.417 -5.273 1.00 0.00 C ATOM 106 OH TYR A 37 7.572 11.696 -5.564 1.00 0.00 O ATOM 0 H TYR A 37 6.730 4.990 -4.999 1.00 0.00 H new ATOM 0 HA TYR A 37 9.235 5.704 -6.437 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.642 5.991 -3.482 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.186 6.266 -4.265 1.00 0.00 H new ATOM 0 HD1 TYR A 37 10.390 8.144 -5.986 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.946 7.707 -3.434 1.00 0.00 H new ATOM 0 HE1 TYR A 37 9.716 10.480 -6.501 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.250 10.033 -3.970 1.00 0.00 H new ATOM 0 HH TYR A 37 6.740 11.914 -5.095 1.00 0.00 H new ATOM 116 N PHE A 38 9.223 3.178 -6.443 1.00 0.00 N ATOM 117 CA PHE A 38 9.636 1.784 -6.526 1.00 0.00 C ATOM 118 C PHE A 38 11.164 1.643 -6.400 1.00 0.00 C ATOM 119 O PHE A 38 11.898 2.622 -6.547 1.00 0.00 O ATOM 120 CB PHE A 38 9.133 1.268 -7.879 1.00 0.00 C ATOM 121 CG PHE A 38 7.672 0.849 -7.868 1.00 0.00 C ATOM 122 CD1 PHE A 38 6.641 1.803 -7.973 1.00 0.00 C ATOM 123 CD2 PHE A 38 7.343 -0.512 -7.735 1.00 0.00 C ATOM 124 CE1 PHE A 38 5.295 1.394 -7.951 1.00 0.00 C ATOM 125 CE2 PHE A 38 6.000 -0.922 -7.705 1.00 0.00 C ATOM 126 CZ PHE A 38 4.973 0.032 -7.810 1.00 0.00 C ATOM 0 H PHE A 38 9.000 3.567 -7.359 1.00 0.00 H new ATOM 0 HA PHE A 38 9.216 1.201 -5.706 1.00 0.00 H new ATOM 0 HB2 PHE A 38 9.273 2.046 -8.629 1.00 0.00 H new ATOM 0 HB3 PHE A 38 9.743 0.418 -8.183 1.00 0.00 H new ATOM 0 HD1 PHE A 38 6.884 2.851 -8.071 1.00 0.00 H new ATOM 0 HD2 PHE A 38 8.130 -1.248 -7.655 1.00 0.00 H new ATOM 0 HE1 PHE A 38 4.507 2.127 -8.043 1.00 0.00 H new ATOM 0 HE2 PHE A 38 5.757 -1.969 -7.601 1.00 0.00 H new ATOM 0 HZ PHE A 38 3.939 -0.280 -7.782 1.00 0.00 H new ATOM 136 N SER A 39 11.656 0.419 -6.178 1.00 0.00 N ATOM 137 CA SER A 39 13.093 0.133 -6.083 1.00 0.00 C ATOM 138 C SER A 39 13.527 -0.913 -7.108 1.00 0.00 C ATOM 139 O SER A 39 12.702 -1.455 -7.845 1.00 0.00 O ATOM 140 CB SER A 39 13.472 -0.240 -4.643 1.00 0.00 C ATOM 141 OG SER A 39 14.874 -0.114 -4.441 1.00 0.00 O ATOM 0 H SER A 39 11.067 -0.405 -6.059 1.00 0.00 H new ATOM 0 HA SER A 39 13.646 1.038 -6.333 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.940 0.405 -3.944 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.160 -1.263 -4.434 1.00 0.00 H new ATOM 0 HG SER A 39 15.094 -0.355 -3.517 1.00 0.00 H new ATOM 147 N ASP A 40 14.837 -1.128 -7.212 1.00 0.00 N ATOM 148 CA ASP A 40 15.492 -1.748 -8.365 1.00 0.00 C ATOM 149 C ASP A 40 14.888 -3.107 -8.730 1.00 0.00 C ATOM 150 O ASP A 40 14.426 -3.277 -9.853 1.00 0.00 O ATOM 151 CB ASP A 40 17.006 -1.827 -8.126 1.00 0.00 C ATOM 152 CG ASP A 40 17.669 -0.436 -8.094 1.00 0.00 C ATOM 153 OD1 ASP A 40 17.262 0.456 -8.878 1.00 0.00 O ATOM 154 OD2 ASP A 40 18.609 -0.238 -7.288 1.00 0.00 O ATOM 0 H ASP A 40 15.493 -0.868 -6.475 1.00 0.00 H new ATOM 0 HA ASP A 40 15.314 -1.113 -9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 40 17.196 -2.339 -7.183 1.00 0.00 H new ATOM 0 HB3 ASP A 40 17.464 -2.427 -8.912 1.00 0.00 H new ATOM 159 N GLU A 41 14.802 -4.049 -7.787 1.00 0.00 N ATOM 160 CA GLU A 41 14.193 -5.369 -7.997 1.00 0.00 C ATOM 161 C GLU A 41 12.752 -5.282 -8.491 1.00 0.00 C ATOM 162 O GLU A 41 12.407 -5.875 -9.514 1.00 0.00 O ATOM 163 CB GLU A 41 14.202 -6.142 -6.676 1.00 0.00 C ATOM 164 CG GLU A 41 15.615 -6.509 -6.225 1.00 0.00 C ATOM 165 CD GLU A 41 16.067 -7.878 -6.774 1.00 0.00 C ATOM 166 OE1 GLU A 41 15.735 -8.215 -7.939 1.00 0.00 O ATOM 167 OE2 GLU A 41 16.764 -8.626 -6.044 1.00 0.00 O ATOM 0 H GLU A 41 15.159 -3.916 -6.841 1.00 0.00 H new ATOM 0 HA GLU A 41 14.781 -5.875 -8.763 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.722 -5.541 -5.904 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.611 -7.051 -6.786 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.311 -5.739 -6.557 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.654 -6.526 -5.136 1.00 0.00 H new ATOM 174 N GLN A 42 11.918 -4.534 -7.764 1.00 0.00 N ATOM 175 CA GLN A 42 10.497 -4.358 -8.068 1.00 0.00 C ATOM 176 C GLN A 42 10.303 -3.764 -9.477 1.00 0.00 C ATOM 177 O GLN A 42 9.440 -4.219 -10.231 1.00 0.00 O ATOM 178 CB GLN A 42 9.812 -3.485 -7.005 1.00 0.00 C ATOM 179 CG GLN A 42 9.745 -4.116 -5.600 1.00 0.00 C ATOM 180 CD GLN A 42 11.089 -4.234 -4.880 1.00 0.00 C ATOM 181 OE1 GLN A 42 11.991 -3.423 -5.037 1.00 0.00 O ATOM 182 NE2 GLN A 42 11.287 -5.255 -4.076 1.00 0.00 N ATOM 0 H GLN A 42 12.218 -4.025 -6.933 1.00 0.00 H new ATOM 0 HA GLN A 42 10.026 -5.341 -8.051 1.00 0.00 H new ATOM 0 HB2 GLN A 42 10.343 -2.535 -6.937 1.00 0.00 H new ATOM 0 HB3 GLN A 42 8.798 -3.261 -7.337 1.00 0.00 H new ATOM 0 HG2 GLN A 42 9.070 -3.522 -4.983 1.00 0.00 H new ATOM 0 HG3 GLN A 42 9.307 -5.110 -5.685 1.00 0.00 H new ATOM 0 HE21 GLN A 42 10.547 -5.942 -3.932 1.00 0.00 H new ATOM 0 HE22 GLN A 42 12.181 -5.360 -3.596 1.00 0.00 H new ATOM 191 N TYR A 43 11.130 -2.784 -9.862 1.00 0.00 N ATOM 192 CA TYR A 43 11.092 -2.161 -11.189 1.00 0.00 C ATOM 193 C TYR A 43 11.584 -3.101 -12.289 1.00 0.00 C ATOM 194 O TYR A 43 10.931 -3.273 -13.314 1.00 0.00 O ATOM 195 CB TYR A 43 11.947 -0.889 -11.188 1.00 0.00 C ATOM 196 CG TYR A 43 11.501 0.119 -12.233 1.00 0.00 C ATOM 197 CD1 TYR A 43 10.239 0.736 -12.118 1.00 0.00 C ATOM 198 CD2 TYR A 43 12.318 0.405 -13.345 1.00 0.00 C ATOM 199 CE1 TYR A 43 9.788 1.621 -13.117 1.00 0.00 C ATOM 200 CE2 TYR A 43 11.877 1.299 -14.339 1.00 0.00 C ATOM 201 CZ TYR A 43 10.609 1.907 -14.230 1.00 0.00 C ATOM 202 OH TYR A 43 10.185 2.761 -15.202 1.00 0.00 O ATOM 0 H TYR A 43 11.852 -2.398 -9.254 1.00 0.00 H new ATOM 0 HA TYR A 43 10.051 -1.920 -11.403 1.00 0.00 H new ATOM 0 HB2 TYR A 43 11.902 -0.427 -10.202 1.00 0.00 H new ATOM 0 HB3 TYR A 43 12.988 -1.156 -11.368 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.615 0.530 -11.261 1.00 0.00 H new ATOM 0 HD2 TYR A 43 13.287 -0.064 -13.435 1.00 0.00 H new ATOM 0 HE1 TYR A 43 8.814 2.081 -13.032 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.510 1.519 -15.186 1.00 0.00 H new ATOM 0 HH TYR A 43 10.877 2.842 -15.891 1.00 0.00 H new ATOM 212 N GLN A 44 12.741 -3.720 -12.068 1.00 0.00 N ATOM 213 CA GLN A 44 13.390 -4.648 -13.006 1.00 0.00 C ATOM 214 C GLN A 44 12.523 -5.875 -13.320 1.00 0.00 C ATOM 215 O GLN A 44 12.449 -6.290 -14.477 1.00 0.00 O ATOM 216 CB GLN A 44 14.778 -5.103 -12.514 1.00 0.00 C ATOM 217 CG GLN A 44 15.957 -4.258 -13.033 1.00 0.00 C ATOM 218 CD GLN A 44 16.072 -2.858 -12.430 1.00 0.00 C ATOM 219 OE1 GLN A 44 16.927 -2.571 -11.604 1.00 0.00 O ATOM 220 NE2 GLN A 44 15.267 -1.909 -12.856 1.00 0.00 N ATOM 0 H GLN A 44 13.273 -3.590 -11.208 1.00 0.00 H new ATOM 0 HA GLN A 44 13.519 -4.080 -13.928 1.00 0.00 H new ATOM 0 HB2 GLN A 44 14.786 -5.082 -11.424 1.00 0.00 H new ATOM 0 HB3 GLN A 44 14.932 -6.139 -12.814 1.00 0.00 H new ATOM 0 HG2 GLN A 44 16.884 -4.798 -12.837 1.00 0.00 H new ATOM 0 HG3 GLN A 44 15.866 -4.163 -14.115 1.00 0.00 H new ATOM 0 HE21 GLN A 44 14.546 -2.123 -13.545 1.00 0.00 H new ATOM 0 HE22 GLN A 44 15.364 -0.959 -12.498 1.00 0.00 H new ATOM 229 N LYS A 45 11.827 -6.441 -12.325 1.00 0.00 N ATOM 230 CA LYS A 45 10.836 -7.497 -12.540 1.00 0.00 C ATOM 231 C LYS A 45 9.700 -6.999 -13.441 1.00 0.00 C ATOM 232 O LYS A 45 9.319 -7.696 -14.380 1.00 0.00 O ATOM 233 CB LYS A 45 10.319 -7.994 -11.183 1.00 0.00 C ATOM 234 CG LYS A 45 10.863 -9.360 -10.723 1.00 0.00 C ATOM 235 CD LYS A 45 12.219 -9.341 -9.994 1.00 0.00 C ATOM 236 CE LYS A 45 13.404 -8.980 -10.899 1.00 0.00 C ATOM 237 NZ LYS A 45 14.708 -9.318 -10.266 1.00 0.00 N ATOM 0 H LYS A 45 11.938 -6.177 -11.346 1.00 0.00 H new ATOM 0 HA LYS A 45 11.302 -8.337 -13.055 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.567 -7.251 -10.425 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.232 -8.053 -11.228 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.126 -9.818 -10.063 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.953 -10.005 -11.597 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.170 -8.625 -9.173 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.397 -10.321 -9.552 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.312 -9.511 -11.847 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.376 -7.914 -11.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 15.479 -9.138 -10.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 14.845 -8.730 -9.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 14.713 -10.322 -9.995 1.00 0.00 H new ATOM 251 N LEU A 46 9.210 -5.775 -13.218 1.00 0.00 N ATOM 252 CA LEU A 46 8.200 -5.161 -14.078 1.00 0.00 C ATOM 253 C LEU A 46 8.701 -4.861 -15.490 1.00 0.00 C ATOM 254 O LEU A 46 7.950 -5.003 -16.443 1.00 0.00 O ATOM 255 CB LEU A 46 7.570 -3.922 -13.412 1.00 0.00 C ATOM 256 CG LEU A 46 6.087 -4.223 -13.181 1.00 0.00 C ATOM 257 CD1 LEU A 46 5.365 -3.171 -12.355 1.00 0.00 C ATOM 258 CD2 LEU A 46 5.304 -4.291 -14.495 1.00 0.00 C ATOM 0 H LEU A 46 9.503 -5.186 -12.438 1.00 0.00 H new ATOM 0 HA LEU A 46 7.415 -5.907 -14.202 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.067 -3.701 -12.468 1.00 0.00 H new ATOM 0 HB3 LEU A 46 7.688 -3.044 -14.048 1.00 0.00 H new ATOM 0 HG LEU A 46 6.107 -5.177 -12.655 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.320 -3.456 -12.236 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.834 -3.093 -11.374 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.423 -2.208 -12.862 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.257 -4.507 -14.284 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.380 -3.335 -15.014 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.717 -5.079 -15.124 1.00 0.00 H new ATOM 270 N GLU A 47 9.973 -4.521 -15.659 1.00 0.00 N ATOM 271 CA GLU A 47 10.604 -4.388 -16.977 1.00 0.00 C ATOM 272 C GLU A 47 10.671 -5.729 -17.726 1.00 0.00 C ATOM 273 O GLU A 47 10.361 -5.791 -18.919 1.00 0.00 O ATOM 274 CB GLU A 47 11.981 -3.731 -16.825 1.00 0.00 C ATOM 275 CG GLU A 47 12.591 -3.309 -18.168 1.00 0.00 C ATOM 276 CD GLU A 47 13.963 -2.642 -17.956 1.00 0.00 C ATOM 277 OE1 GLU A 47 14.986 -3.365 -17.876 1.00 0.00 O ATOM 278 OE2 GLU A 47 14.030 -1.392 -17.866 1.00 0.00 O ATOM 0 H GLU A 47 10.605 -4.327 -14.882 1.00 0.00 H new ATOM 0 HA GLU A 47 9.983 -3.740 -17.596 1.00 0.00 H new ATOM 0 HB2 GLU A 47 11.892 -2.856 -16.181 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.657 -4.426 -16.327 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.700 -4.181 -18.813 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.920 -2.618 -18.677 1.00 0.00 H new ATOM 285 N LYS A 48 10.998 -6.822 -17.024 1.00 0.00 N ATOM 286 CA LYS A 48 10.993 -8.186 -17.574 1.00 0.00 C ATOM 287 C LYS A 48 9.595 -8.645 -18.002 1.00 0.00 C ATOM 288 O LYS A 48 9.457 -9.300 -19.033 1.00 0.00 O ATOM 289 CB LYS A 48 11.628 -9.171 -16.573 1.00 0.00 C ATOM 290 CG LYS A 48 13.165 -9.105 -16.553 1.00 0.00 C ATOM 291 CD LYS A 48 13.789 -9.809 -17.774 1.00 0.00 C ATOM 292 CE LYS A 48 15.323 -9.857 -17.714 1.00 0.00 C ATOM 293 NZ LYS A 48 15.943 -8.526 -17.957 1.00 0.00 N ATOM 0 H LYS A 48 11.278 -6.784 -16.044 1.00 0.00 H new ATOM 0 HA LYS A 48 11.598 -8.172 -18.480 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.248 -8.959 -15.574 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.317 -10.185 -16.824 1.00 0.00 H new ATOM 0 HG2 LYS A 48 13.483 -8.063 -16.534 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.536 -9.568 -15.639 1.00 0.00 H new ATOM 0 HD2 LYS A 48 13.401 -10.825 -17.839 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.482 -9.291 -18.683 1.00 0.00 H new ATOM 0 HE2 LYS A 48 15.634 -10.227 -16.737 1.00 0.00 H new ATOM 0 HE3 LYS A 48 15.691 -10.567 -18.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 16.978 -8.611 -17.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.670 -8.183 -18.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 15.615 -7.853 -17.235 1.00 0.00 H new ATOM 307 N MET A 49 8.555 -8.257 -17.259 1.00 0.00 N ATOM 308 CA MET A 49 7.150 -8.449 -17.591 1.00 0.00 C ATOM 309 C MET A 49 6.732 -7.575 -18.787 1.00 0.00 C ATOM 310 O MET A 49 6.128 -8.058 -19.743 1.00 0.00 O ATOM 311 CB MET A 49 6.359 -8.067 -16.338 1.00 0.00 C ATOM 312 CG MET A 49 6.446 -9.089 -15.197 1.00 0.00 C ATOM 313 SD MET A 49 6.024 -8.420 -13.558 1.00 0.00 S ATOM 314 CE MET A 49 4.354 -7.790 -13.866 1.00 0.00 C ATOM 0 H MET A 49 8.681 -7.778 -16.368 1.00 0.00 H new ATOM 0 HA MET A 49 6.958 -9.481 -17.884 1.00 0.00 H new ATOM 0 HB2 MET A 49 6.719 -7.104 -15.975 1.00 0.00 H new ATOM 0 HB3 MET A 49 5.312 -7.933 -16.611 1.00 0.00 H new ATOM 0 HG2 MET A 49 5.779 -9.922 -15.419 1.00 0.00 H new ATOM 0 HG3 MET A 49 7.458 -9.492 -15.162 1.00 0.00 H new ATOM 0 HE1 MET A 49 3.904 -7.477 -12.924 1.00 0.00 H new ATOM 0 HE2 MET A 49 4.406 -6.938 -14.544 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.746 -8.575 -14.316 1.00 0.00 H new ATOM 324 N ALA A 50 7.099 -6.292 -18.766 1.00 0.00 N ATOM 325 CA ALA A 50 6.783 -5.285 -19.775 1.00 0.00 C ATOM 326 C ALA A 50 7.349 -5.600 -21.159 1.00 0.00 C ATOM 327 O ALA A 50 6.756 -5.184 -22.148 1.00 0.00 O ATOM 328 CB ALA A 50 7.247 -3.916 -19.278 1.00 0.00 C ATOM 0 H ALA A 50 7.655 -5.909 -18.001 1.00 0.00 H new ATOM 0 HA ALA A 50 5.701 -5.285 -19.909 1.00 0.00 H new ATOM 0 HB1 ALA A 50 7.014 -3.159 -20.027 1.00 0.00 H new ATOM 0 HB2 ALA A 50 6.735 -3.674 -18.346 1.00 0.00 H new ATOM 0 HB3 ALA A 50 8.323 -3.937 -19.106 1.00 0.00 H new ATOM 334 N ASN A 51 8.427 -6.376 -21.268 1.00 0.00 N ATOM 335 CA ASN A 51 8.922 -6.884 -22.547 1.00 0.00 C ATOM 336 C ASN A 51 7.869 -7.723 -23.309 1.00 0.00 C ATOM 337 O ASN A 51 7.884 -7.745 -24.538 1.00 0.00 O ATOM 338 CB ASN A 51 10.219 -7.658 -22.283 1.00 0.00 C ATOM 339 CG ASN A 51 10.896 -8.103 -23.571 1.00 0.00 C ATOM 340 OD1 ASN A 51 11.332 -7.296 -24.381 1.00 0.00 O ATOM 341 ND2 ASN A 51 11.019 -9.391 -23.801 1.00 0.00 N ATOM 0 H ASN A 51 8.985 -6.672 -20.467 1.00 0.00 H new ATOM 0 HA ASN A 51 9.130 -6.045 -23.211 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.904 -7.031 -21.712 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.000 -8.532 -21.669 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.477 -9.716 -24.653 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.657 -10.066 -23.128 1.00 0.00 H new ATOM 348 N GLU A 52 6.903 -8.337 -22.614 1.00 0.00 N ATOM 349 CA GLU A 52 5.761 -9.027 -23.228 1.00 0.00 C ATOM 350 C GLU A 52 4.689 -8.064 -23.787 1.00 0.00 C ATOM 351 O GLU A 52 3.982 -8.401 -24.737 1.00 0.00 O ATOM 352 CB GLU A 52 5.118 -10.022 -22.247 1.00 0.00 C ATOM 353 CG GLU A 52 6.107 -11.094 -21.762 1.00 0.00 C ATOM 354 CD GLU A 52 5.390 -12.186 -20.944 1.00 0.00 C ATOM 355 OE1 GLU A 52 4.770 -13.095 -21.551 1.00 0.00 O ATOM 356 OE2 GLU A 52 5.458 -12.162 -19.690 1.00 0.00 O ATOM 0 H GLU A 52 6.893 -8.369 -21.595 1.00 0.00 H new ATOM 0 HA GLU A 52 6.170 -9.573 -24.078 1.00 0.00 H new ATOM 0 HB2 GLU A 52 4.727 -9.478 -21.387 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.270 -10.507 -22.730 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.606 -11.547 -22.619 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.881 -10.629 -21.152 1.00 0.00 H new ATOM 363 N GLU A 53 4.602 -6.843 -23.245 1.00 0.00 N ATOM 364 CA GLU A 53 3.853 -5.695 -23.796 1.00 0.00 C ATOM 365 C GLU A 53 4.702 -4.876 -24.802 1.00 0.00 C ATOM 366 O GLU A 53 4.238 -3.880 -25.359 1.00 0.00 O ATOM 367 CB GLU A 53 3.369 -4.823 -22.619 1.00 0.00 C ATOM 368 CG GLU A 53 2.147 -3.927 -22.880 1.00 0.00 C ATOM 369 CD GLU A 53 0.818 -4.706 -22.828 1.00 0.00 C ATOM 370 OE1 GLU A 53 0.488 -5.440 -23.790 1.00 0.00 O ATOM 371 OE2 GLU A 53 0.066 -4.570 -21.833 1.00 0.00 O ATOM 0 H GLU A 53 5.072 -6.613 -22.370 1.00 0.00 H new ATOM 0 HA GLU A 53 2.995 -6.061 -24.360 1.00 0.00 H new ATOM 0 HB2 GLU A 53 3.136 -5.481 -21.782 1.00 0.00 H new ATOM 0 HB3 GLU A 53 4.196 -4.187 -22.304 1.00 0.00 H new ATOM 0 HG2 GLU A 53 2.124 -3.127 -22.141 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.249 -3.455 -23.857 1.00 0.00 H new ATOM 378 N GLU A 54 5.946 -5.306 -25.051 1.00 0.00 N ATOM 379 CA GLU A 54 6.958 -4.706 -25.938 1.00 0.00 C ATOM 380 C GLU A 54 7.579 -3.419 -25.342 1.00 0.00 C ATOM 381 O GLU A 54 7.772 -2.405 -26.014 1.00 0.00 O ATOM 382 CB GLU A 54 6.427 -4.579 -27.382 1.00 0.00 C ATOM 383 CG GLU A 54 7.562 -4.650 -28.410 1.00 0.00 C ATOM 384 CD GLU A 54 7.029 -4.454 -29.842 1.00 0.00 C ATOM 385 OE1 GLU A 54 6.615 -5.450 -30.485 1.00 0.00 O ATOM 386 OE2 GLU A 54 7.030 -3.303 -30.348 1.00 0.00 O ATOM 0 H GLU A 54 6.302 -6.150 -24.602 1.00 0.00 H new ATOM 0 HA GLU A 54 7.806 -5.388 -26.007 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.708 -5.375 -27.577 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.894 -3.635 -27.492 1.00 0.00 H new ATOM 0 HG2 GLU A 54 8.306 -3.885 -28.188 1.00 0.00 H new ATOM 0 HG3 GLU A 54 8.065 -5.614 -28.335 1.00 0.00 H new ATOM 393 N GLU A 55 7.913 -3.501 -24.049 1.00 0.00 N ATOM 394 CA GLU A 55 8.441 -2.468 -23.148 1.00 0.00 C ATOM 395 C GLU A 55 7.509 -1.251 -22.999 1.00 0.00 C ATOM 396 O GLU A 55 7.566 -0.270 -23.744 1.00 0.00 O ATOM 397 CB GLU A 55 9.885 -2.080 -23.481 1.00 0.00 C ATOM 398 CG GLU A 55 10.846 -3.275 -23.562 1.00 0.00 C ATOM 399 CD GLU A 55 12.289 -2.798 -23.815 1.00 0.00 C ATOM 400 OE1 GLU A 55 12.691 -2.654 -24.997 1.00 0.00 O ATOM 401 OE2 GLU A 55 13.037 -2.563 -22.835 1.00 0.00 O ATOM 0 H GLU A 55 7.809 -4.387 -23.555 1.00 0.00 H new ATOM 0 HA GLU A 55 8.471 -2.926 -22.159 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.898 -1.550 -24.433 1.00 0.00 H new ATOM 0 HB3 GLU A 55 10.248 -1.385 -22.724 1.00 0.00 H new ATOM 0 HG2 GLU A 55 10.804 -3.845 -22.634 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.534 -3.945 -24.363 1.00 0.00 H new ATOM 408 N SER A 56 6.640 -1.332 -21.990 1.00 0.00 N ATOM 409 CA SER A 56 5.590 -0.362 -21.653 1.00 0.00 C ATOM 410 C SER A 56 5.489 -0.205 -20.126 1.00 0.00 C ATOM 411 O SER A 56 4.399 -0.166 -19.543 1.00 0.00 O ATOM 412 CB SER A 56 4.273 -0.811 -22.303 1.00 0.00 C ATOM 413 OG SER A 56 3.335 0.250 -22.330 1.00 0.00 O ATOM 0 H SER A 56 6.649 -2.123 -21.346 1.00 0.00 H new ATOM 0 HA SER A 56 5.832 0.625 -22.047 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.464 -1.159 -23.318 1.00 0.00 H new ATOM 0 HB3 SER A 56 3.859 -1.654 -21.750 1.00 0.00 H new ATOM 0 HG SER A 56 2.505 -0.058 -22.749 1.00 0.00 H new ATOM 419 N VAL A 57 6.653 -0.186 -19.460 1.00 0.00 N ATOM 420 CA VAL A 57 6.781 -0.098 -17.995 1.00 0.00 C ATOM 421 C VAL A 57 6.007 1.105 -17.435 1.00 0.00 C ATOM 422 O VAL A 57 6.012 2.195 -18.010 1.00 0.00 O ATOM 423 CB VAL A 57 8.246 -0.015 -17.508 1.00 0.00 C ATOM 424 CG1 VAL A 57 8.867 -1.403 -17.384 1.00 0.00 C ATOM 425 CG2 VAL A 57 9.159 0.819 -18.412 1.00 0.00 C ATOM 0 H VAL A 57 7.554 -0.232 -19.935 1.00 0.00 H new ATOM 0 HA VAL A 57 6.354 -1.028 -17.618 1.00 0.00 H new ATOM 0 HB VAL A 57 8.181 0.478 -16.538 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.897 -1.311 -17.040 1.00 0.00 H new ATOM 0 HG12 VAL A 57 8.296 -1.994 -16.668 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.852 -1.896 -18.356 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.169 0.827 -18.001 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.178 0.384 -19.411 1.00 0.00 H new ATOM 0 HG23 VAL A 57 8.781 1.840 -18.468 1.00 0.00 H new ATOM 435 N GLY A 58 5.317 0.902 -16.313 1.00 0.00 N ATOM 436 CA GLY A 58 4.434 1.880 -15.671 1.00 0.00 C ATOM 437 C GLY A 58 2.987 1.660 -16.099 1.00 0.00 C ATOM 438 O GLY A 58 2.124 1.409 -15.266 1.00 0.00 O ATOM 0 H GLY A 58 5.358 0.018 -15.805 1.00 0.00 H new ATOM 0 HA2 GLY A 58 4.515 1.795 -14.587 1.00 0.00 H new ATOM 0 HA3 GLY A 58 4.748 2.890 -15.936 1.00 0.00 H new ATOM 442 N SER A 59 2.716 1.634 -17.401 1.00 0.00 N ATOM 443 CA SER A 59 1.380 1.277 -17.914 1.00 0.00 C ATOM 444 C SER A 59 1.014 -0.164 -17.543 1.00 0.00 C ATOM 445 O SER A 59 -0.098 -0.435 -17.087 1.00 0.00 O ATOM 446 CB SER A 59 1.322 1.469 -19.427 1.00 0.00 C ATOM 447 OG SER A 59 -0.012 1.354 -19.893 1.00 0.00 O ATOM 0 H SER A 59 3.398 1.855 -18.127 1.00 0.00 H new ATOM 0 HA SER A 59 0.651 1.941 -17.449 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.722 2.448 -19.691 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.950 0.725 -19.918 1.00 0.00 H new ATOM 0 HG SER A 59 -0.031 1.481 -20.865 1.00 0.00 H new ATOM 453 N TYR A 60 1.994 -1.073 -17.620 1.00 0.00 N ATOM 454 CA TYR A 60 1.884 -2.451 -17.131 1.00 0.00 C ATOM 455 C TYR A 60 1.493 -2.526 -15.645 1.00 0.00 C ATOM 456 O TYR A 60 0.679 -3.364 -15.271 1.00 0.00 O ATOM 457 CB TYR A 60 3.209 -3.179 -17.373 1.00 0.00 C ATOM 458 CG TYR A 60 3.073 -4.675 -17.611 1.00 0.00 C ATOM 459 CD1 TYR A 60 2.740 -5.551 -16.558 1.00 0.00 C ATOM 460 CD2 TYR A 60 3.288 -5.196 -18.901 1.00 0.00 C ATOM 461 CE1 TYR A 60 2.649 -6.938 -16.790 1.00 0.00 C ATOM 462 CE2 TYR A 60 3.209 -6.583 -19.135 1.00 0.00 C ATOM 463 CZ TYR A 60 2.892 -7.459 -18.076 1.00 0.00 C ATOM 464 OH TYR A 60 2.823 -8.802 -18.283 1.00 0.00 O ATOM 0 H TYR A 60 2.904 -0.866 -18.033 1.00 0.00 H new ATOM 0 HA TYR A 60 1.081 -2.937 -17.686 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.703 -2.730 -18.235 1.00 0.00 H new ATOM 0 HB3 TYR A 60 3.859 -3.018 -16.513 1.00 0.00 H new ATOM 0 HD1 TYR A 60 2.554 -5.158 -15.570 1.00 0.00 H new ATOM 0 HD2 TYR A 60 3.515 -4.527 -19.718 1.00 0.00 H new ATOM 0 HE1 TYR A 60 2.392 -7.604 -15.979 1.00 0.00 H new ATOM 0 HE2 TYR A 60 3.391 -6.975 -20.125 1.00 0.00 H new ATOM 0 HH TYR A 60 3.015 -8.998 -19.224 1.00 0.00 H new ATOM 474 N ILE A 61 2.023 -1.623 -14.806 1.00 0.00 N ATOM 475 CA ILE A 61 1.643 -1.485 -13.378 1.00 0.00 C ATOM 476 C ILE A 61 0.136 -1.349 -13.261 1.00 0.00 C ATOM 477 O ILE A 61 -0.522 -2.142 -12.587 1.00 0.00 O ATOM 478 CB ILE A 61 2.391 -0.312 -12.665 1.00 0.00 C ATOM 479 CG1 ILE A 61 3.072 -0.795 -11.374 1.00 0.00 C ATOM 480 CG2 ILE A 61 1.584 0.937 -12.227 1.00 0.00 C ATOM 481 CD1 ILE A 61 4.364 -0.031 -11.091 1.00 0.00 C ATOM 0 H ILE A 61 2.738 -0.956 -15.097 1.00 0.00 H new ATOM 0 HA ILE A 61 1.956 -2.390 -12.858 1.00 0.00 H new ATOM 0 HB ILE A 61 3.060 -0.000 -13.467 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.387 -0.673 -10.535 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.290 -1.860 -11.455 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.253 1.653 -11.749 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.124 1.398 -13.101 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.807 0.640 -11.522 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.813 -0.404 -10.170 1.00 0.00 H new ATOM 0 HD12 ILE A 61 5.060 -0.174 -11.918 1.00 0.00 H new ATOM 0 HD13 ILE A 61 4.143 1.031 -10.983 1.00 0.00 H new ATOM 493 N LYS A 62 -0.416 -0.368 -13.980 1.00 0.00 N ATOM 494 CA LYS A 62 -1.839 -0.085 -13.941 1.00 0.00 C ATOM 495 C LYS A 62 -2.621 -1.275 -14.483 1.00 0.00 C ATOM 496 O LYS A 62 -3.491 -1.785 -13.791 1.00 0.00 O ATOM 497 CB LYS A 62 -2.141 1.239 -14.671 1.00 0.00 C ATOM 498 CG LYS A 62 -3.401 1.895 -14.091 1.00 0.00 C ATOM 499 CD LYS A 62 -3.722 3.269 -14.697 1.00 0.00 C ATOM 500 CE LYS A 62 -4.340 3.146 -16.096 1.00 0.00 C ATOM 501 NZ LYS A 62 -4.585 4.481 -16.704 1.00 0.00 N ATOM 0 H LYS A 62 0.114 0.245 -14.600 1.00 0.00 H new ATOM 0 HA LYS A 62 -2.166 0.056 -12.911 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.293 1.917 -14.574 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.278 1.051 -15.736 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -4.251 1.231 -14.250 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -3.279 2.004 -13.013 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.410 3.803 -14.042 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.810 3.863 -14.754 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.675 2.569 -16.739 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.279 2.596 -16.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.424 4.435 -17.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.745 5.181 -15.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.758 4.762 -17.269 1.00 0.00 H new ATOM 515 N ARG A 63 -2.247 -1.798 -15.656 1.00 0.00 N ATOM 516 CA ARG A 63 -2.840 -2.998 -16.281 1.00 0.00 C ATOM 517 C ARG A 63 -2.950 -4.157 -15.286 1.00 0.00 C ATOM 518 O ARG A 63 -3.998 -4.789 -15.213 1.00 0.00 O ATOM 519 CB ARG A 63 -2.026 -3.421 -17.523 1.00 0.00 C ATOM 520 CG ARG A 63 -2.069 -2.408 -18.684 1.00 0.00 C ATOM 521 CD ARG A 63 -3.052 -2.809 -19.792 1.00 0.00 C ATOM 522 NE ARG A 63 -2.506 -3.880 -20.652 1.00 0.00 N ATOM 523 CZ ARG A 63 -3.162 -4.787 -21.349 1.00 0.00 C ATOM 524 NH1 ARG A 63 -4.461 -4.905 -21.313 1.00 0.00 N ATOM 525 NH2 ARG A 63 -2.495 -5.595 -22.113 1.00 0.00 N ATOM 0 H ARG A 63 -1.501 -1.389 -16.218 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.851 -2.740 -16.598 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.988 -3.574 -17.228 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.401 -4.381 -17.879 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.348 -1.429 -18.295 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -1.071 -2.309 -19.110 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.987 -3.145 -19.344 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.286 -1.937 -20.403 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.489 -3.923 -20.714 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.014 -4.279 -20.727 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.924 -5.623 -21.871 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.479 -5.523 -22.168 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.986 -6.303 -22.659 1.00 0.00 H new ATOM 539 N TYR A 64 -1.919 -4.397 -14.478 1.00 0.00 N ATOM 540 CA TYR A 64 -1.866 -5.495 -13.512 1.00 0.00 C ATOM 541 C TYR A 64 -2.700 -5.259 -12.247 1.00 0.00 C ATOM 542 O TYR A 64 -3.364 -6.168 -11.753 1.00 0.00 O ATOM 543 CB TYR A 64 -0.411 -5.783 -13.140 1.00 0.00 C ATOM 544 CG TYR A 64 -0.163 -7.275 -13.080 1.00 0.00 C ATOM 545 CD1 TYR A 64 -0.378 -7.987 -11.884 1.00 0.00 C ATOM 546 CD2 TYR A 64 0.137 -7.970 -14.267 1.00 0.00 C ATOM 547 CE1 TYR A 64 -0.297 -9.394 -11.877 1.00 0.00 C ATOM 548 CE2 TYR A 64 0.241 -9.373 -14.261 1.00 0.00 C ATOM 549 CZ TYR A 64 0.014 -10.090 -13.067 1.00 0.00 C ATOM 550 OH TYR A 64 0.067 -11.450 -13.079 1.00 0.00 O ATOM 0 H TYR A 64 -1.077 -3.821 -14.476 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.314 -6.358 -14.004 1.00 0.00 H new ATOM 0 HB2 TYR A 64 0.255 -5.327 -13.873 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.180 -5.331 -12.175 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -0.605 -7.455 -10.972 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.288 -7.424 -15.186 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -0.473 -9.940 -10.962 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.494 -9.900 -15.169 1.00 0.00 H new ATOM 0 HH TYR A 64 0.293 -11.761 -13.980 1.00 0.00 H new ATOM 560 N ILE A 65 -2.712 -4.023 -11.753 1.00 0.00 N ATOM 561 CA ILE A 65 -3.609 -3.565 -10.678 1.00 0.00 C ATOM 562 C ILE A 65 -5.068 -3.698 -11.124 1.00 0.00 C ATOM 563 O ILE A 65 -5.907 -4.192 -10.378 1.00 0.00 O ATOM 564 CB ILE A 65 -3.279 -2.117 -10.246 1.00 0.00 C ATOM 565 CG1 ILE A 65 -1.938 -2.000 -9.489 1.00 0.00 C ATOM 566 CG2 ILE A 65 -4.397 -1.484 -9.399 1.00 0.00 C ATOM 567 CD1 ILE A 65 -1.899 -2.671 -8.111 1.00 0.00 C ATOM 0 H ILE A 65 -2.087 -3.291 -12.092 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.455 -4.199 -9.805 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.191 -1.565 -11.182 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.152 -2.434 -10.108 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -1.701 -0.943 -9.366 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.114 -0.468 -9.123 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.321 -1.459 -9.977 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -4.549 -2.076 -8.497 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.914 -2.530 -7.665 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.656 -2.224 -7.467 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.099 -3.737 -8.220 1.00 0.00 H new ATOM 579 N LEU A 66 -5.377 -3.322 -12.365 1.00 0.00 N ATOM 580 CA LEU A 66 -6.723 -3.398 -12.931 1.00 0.00 C ATOM 581 C LEU A 66 -7.121 -4.868 -13.134 1.00 0.00 C ATOM 582 O LEU A 66 -8.248 -5.258 -12.822 1.00 0.00 O ATOM 583 CB LEU A 66 -6.741 -2.587 -14.238 1.00 0.00 C ATOM 584 CG LEU A 66 -6.865 -1.048 -14.097 1.00 0.00 C ATOM 585 CD1 LEU A 66 -6.331 -0.399 -12.813 1.00 0.00 C ATOM 586 CD2 LEU A 66 -6.171 -0.396 -15.298 1.00 0.00 C ATOM 0 H LEU A 66 -4.686 -2.949 -13.016 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.462 -2.969 -12.255 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -5.826 -2.806 -14.788 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -7.572 -2.942 -14.848 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.940 -0.872 -14.051 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.487 0.679 -12.858 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.861 -0.806 -11.952 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.266 -0.608 -12.716 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.247 0.688 -15.218 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.120 -0.686 -15.313 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.651 -0.726 -16.219 1.00 0.00 H new ATOM 598 N LYS A 67 -6.170 -5.706 -13.564 1.00 0.00 N ATOM 599 CA LYS A 67 -6.315 -7.161 -13.690 1.00 0.00 C ATOM 600 C LYS A 67 -6.599 -7.842 -12.347 1.00 0.00 C ATOM 601 O LYS A 67 -7.449 -8.728 -12.275 1.00 0.00 O ATOM 602 CB LYS A 67 -5.064 -7.726 -14.375 1.00 0.00 C ATOM 603 CG LYS A 67 -5.235 -9.205 -14.747 1.00 0.00 C ATOM 604 CD LYS A 67 -4.110 -9.684 -15.674 1.00 0.00 C ATOM 605 CE LYS A 67 -4.351 -11.147 -16.069 1.00 0.00 C ATOM 606 NZ LYS A 67 -3.327 -11.635 -17.029 1.00 0.00 N ATOM 0 H LYS A 67 -5.246 -5.378 -13.844 1.00 0.00 H new ATOM 0 HA LYS A 67 -7.187 -7.375 -14.307 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.850 -7.148 -15.274 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.206 -7.615 -13.712 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.244 -9.811 -13.841 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.198 -9.349 -15.237 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.070 -9.059 -16.566 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.147 -9.587 -15.173 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -4.339 -11.771 -15.176 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -5.342 -11.245 -16.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -3.524 -12.627 -17.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.356 -11.055 -17.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -2.384 -11.565 -16.596 1.00 0.00 H new ATOM 620 N ALA A 68 -5.941 -7.390 -11.278 1.00 0.00 N ATOM 621 CA ALA A 68 -6.248 -7.777 -9.903 1.00 0.00 C ATOM 622 C ALA A 68 -7.672 -7.354 -9.513 1.00 0.00 C ATOM 623 O ALA A 68 -8.457 -8.179 -9.053 1.00 0.00 O ATOM 624 CB ALA A 68 -5.195 -7.187 -8.960 1.00 0.00 C ATOM 0 H ALA A 68 -5.165 -6.732 -11.347 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.213 -8.863 -9.819 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.423 -7.475 -7.934 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.210 -7.565 -9.233 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.202 -6.100 -9.042 1.00 0.00 H new ATOM 630 N LEU A 69 -8.033 -6.088 -9.738 1.00 0.00 N ATOM 631 CA LEU A 69 -9.286 -5.466 -9.305 1.00 0.00 C ATOM 632 C LEU A 69 -10.532 -6.089 -9.939 1.00 0.00 C ATOM 633 O LEU A 69 -11.595 -6.107 -9.315 1.00 0.00 O ATOM 634 CB LEU A 69 -9.199 -3.957 -9.602 1.00 0.00 C ATOM 635 CG LEU A 69 -8.993 -3.073 -8.364 1.00 0.00 C ATOM 636 CD1 LEU A 69 -7.681 -3.332 -7.627 1.00 0.00 C ATOM 637 CD2 LEU A 69 -8.991 -1.606 -8.787 1.00 0.00 C ATOM 0 H LEU A 69 -7.433 -5.441 -10.249 1.00 0.00 H new ATOM 0 HA LEU A 69 -9.402 -5.641 -8.235 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.377 -3.784 -10.297 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.114 -3.646 -10.106 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.812 -3.316 -7.687 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.611 -2.668 -6.765 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.651 -4.368 -7.290 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.843 -3.144 -8.299 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -8.845 -0.975 -7.910 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.183 -1.433 -9.497 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.944 -1.361 -9.256 1.00 0.00 H new ATOM 649 N ARG A 70 -10.388 -6.660 -11.139 1.00 0.00 N ATOM 650 CA ARG A 70 -11.420 -7.465 -11.801 1.00 0.00 C ATOM 651 C ARG A 70 -11.880 -8.669 -10.965 1.00 0.00 C ATOM 652 O ARG A 70 -13.060 -9.022 -11.026 1.00 0.00 O ATOM 653 CB ARG A 70 -10.948 -7.903 -13.198 1.00 0.00 C ATOM 654 CG ARG A 70 -11.076 -6.764 -14.221 1.00 0.00 C ATOM 655 CD ARG A 70 -10.523 -7.186 -15.587 1.00 0.00 C ATOM 656 NE ARG A 70 -10.760 -6.146 -16.610 1.00 0.00 N ATOM 657 CZ ARG A 70 -11.836 -5.980 -17.362 1.00 0.00 C ATOM 658 NH1 ARG A 70 -12.874 -6.764 -17.277 1.00 0.00 N ATOM 659 NH2 ARG A 70 -11.894 -5.005 -18.224 1.00 0.00 N ATOM 0 H ARG A 70 -9.533 -6.574 -11.689 1.00 0.00 H new ATOM 0 HA ARG A 70 -12.296 -6.825 -11.909 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -9.910 -8.231 -13.146 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -11.536 -8.759 -13.530 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.123 -6.477 -14.322 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -10.538 -5.886 -13.862 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -9.454 -7.380 -15.504 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -10.993 -8.119 -15.899 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.004 -5.476 -16.753 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.875 -7.538 -16.613 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -13.685 -6.603 -17.874 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -11.107 -4.364 -18.322 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.727 -4.883 -18.801 1.00 0.00 H new ATOM 673 N LYS A 71 -10.978 -9.287 -10.185 1.00 0.00 N ATOM 674 CA LYS A 71 -11.248 -10.447 -9.310 1.00 0.00 C ATOM 675 C LYS A 71 -10.210 -10.600 -8.175 1.00 0.00 C ATOM 676 O LYS A 71 -9.426 -11.551 -8.161 1.00 0.00 O ATOM 677 CB LYS A 71 -11.390 -11.707 -10.184 1.00 0.00 C ATOM 678 CG LYS A 71 -12.102 -12.866 -9.469 1.00 0.00 C ATOM 679 CD LYS A 71 -12.291 -14.055 -10.421 1.00 0.00 C ATOM 680 CE LYS A 71 -13.053 -15.184 -9.720 1.00 0.00 C ATOM 681 NZ LYS A 71 -13.282 -16.337 -10.631 1.00 0.00 N ATOM 0 H LYS A 71 -10.005 -8.984 -10.143 1.00 0.00 H new ATOM 0 HA LYS A 71 -12.189 -10.284 -8.785 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.943 -11.453 -11.088 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.400 -12.037 -10.498 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -11.520 -13.177 -8.601 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -13.071 -12.532 -9.100 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.837 -13.735 -11.308 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -11.320 -14.417 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.491 -15.515 -8.847 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.011 -14.808 -9.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -13.800 -17.083 -10.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -13.839 -16.025 -11.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.367 -16.710 -10.955 1.00 0.00 H new ATOM 695 N ILE A 72 -10.194 -9.658 -7.220 1.00 0.00 N ATOM 696 CA ILE A 72 -9.250 -9.657 -6.081 1.00 0.00 C ATOM 697 C ILE A 72 -9.388 -10.922 -5.207 1.00 0.00 C ATOM 698 O ILE A 72 -8.388 -11.567 -4.882 1.00 0.00 O ATOM 699 CB ILE A 72 -9.416 -8.379 -5.219 1.00 0.00 C ATOM 700 CG1 ILE A 72 -9.375 -7.109 -6.096 1.00 0.00 C ATOM 701 CG2 ILE A 72 -8.323 -8.315 -4.132 1.00 0.00 C ATOM 702 CD1 ILE A 72 -9.444 -5.786 -5.332 1.00 0.00 C ATOM 0 H ILE A 72 -10.839 -8.868 -7.212 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.246 -9.662 -6.505 1.00 0.00 H new ATOM 0 HB ILE A 72 -10.391 -8.425 -4.733 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -8.457 -7.123 -6.684 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -10.206 -7.147 -6.801 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.455 -7.412 -3.536 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -8.400 -9.190 -3.486 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -7.341 -8.298 -4.604 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -9.408 -4.956 -6.038 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -10.374 -5.741 -4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -8.599 -5.717 -4.647 1.00 0.00 H new ATOM 714 N GLU A 73 -10.621 -11.264 -4.807 1.00 0.00 N ATOM 715 CA GLU A 73 -10.963 -12.392 -3.915 1.00 0.00 C ATOM 716 C GLU A 73 -10.671 -13.775 -4.540 1.00 0.00 C ATOM 717 O GLU A 73 -9.886 -14.542 -3.939 1.00 0.00 O ATOM 718 CB GLU A 73 -12.430 -12.245 -3.460 1.00 0.00 C ATOM 719 CG GLU A 73 -12.784 -12.992 -2.159 1.00 0.00 C ATOM 720 CD GLU A 73 -12.967 -14.521 -2.311 1.00 0.00 C ATOM 721 OE1 GLU A 73 -13.830 -14.968 -3.109 1.00 0.00 O ATOM 722 OE2 GLU A 73 -12.311 -15.295 -1.568 1.00 0.00 O ATOM 0 H GLU A 73 -11.445 -10.743 -5.106 1.00 0.00 H new ATOM 0 HA GLU A 73 -10.313 -12.347 -3.041 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -12.649 -11.186 -3.325 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -13.080 -12.605 -4.257 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.999 -12.806 -1.426 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -13.704 -12.570 -1.754 1.00 0.00 H new ATOM 730 N THR B 31 16.083 6.590 -5.696 1.00 0.00 N ATOM 731 CA THR B 31 14.895 5.767 -5.977 1.00 0.00 C ATOM 732 C THR B 31 14.409 5.975 -7.418 1.00 0.00 C ATOM 733 O THR B 31 14.904 6.844 -8.145 1.00 0.00 O ATOM 734 CB THR B 31 13.789 6.065 -4.944 1.00 0.00 C ATOM 735 OG1 THR B 31 12.739 5.137 -5.046 1.00 0.00 O ATOM 736 CG2 THR B 31 13.195 7.474 -5.032 1.00 0.00 C ATOM 0 HA THR B 31 15.164 4.715 -5.884 1.00 0.00 H new ATOM 0 HB THR B 31 14.293 5.985 -3.981 1.00 0.00 H new ATOM 0 HG1 THR B 31 12.132 5.245 -4.284 1.00 0.00 H new ATOM 0 HG21 THR B 31 12.426 7.593 -4.269 1.00 0.00 H new ATOM 0 HG22 THR B 31 13.982 8.211 -4.873 1.00 0.00 H new ATOM 0 HG23 THR B 31 12.754 7.622 -6.018 1.00 0.00 H new ATOM 744 N ARG B 32 13.432 5.172 -7.832 1.00 0.00 N ATOM 745 CA ARG B 32 12.710 5.264 -9.107 1.00 0.00 C ATOM 746 C ARG B 32 11.456 6.138 -8.964 1.00 0.00 C ATOM 747 O ARG B 32 11.031 6.451 -7.853 1.00 0.00 O ATOM 748 CB ARG B 32 12.411 3.826 -9.592 1.00 0.00 C ATOM 749 CG ARG B 32 12.698 3.621 -11.085 1.00 0.00 C ATOM 750 CD ARG B 32 14.186 3.744 -11.455 1.00 0.00 C ATOM 751 NE ARG B 32 14.984 2.541 -11.121 1.00 0.00 N ATOM 752 CZ ARG B 32 15.691 1.791 -11.950 1.00 0.00 C ATOM 753 NH1 ARG B 32 15.626 1.927 -13.245 1.00 0.00 N ATOM 754 NH2 ARG B 32 16.495 0.874 -11.501 1.00 0.00 N ATOM 0 H ARG B 32 13.102 4.396 -7.259 1.00 0.00 H new ATOM 0 HA ARG B 32 13.317 5.759 -9.865 1.00 0.00 H new ATOM 0 HB2 ARG B 32 13.009 3.122 -9.013 1.00 0.00 H new ATOM 0 HB3 ARG B 32 11.365 3.593 -9.394 1.00 0.00 H new ATOM 0 HG2 ARG B 32 12.340 2.635 -11.382 1.00 0.00 H new ATOM 0 HG3 ARG B 32 12.129 4.353 -11.658 1.00 0.00 H new ATOM 0 HD2 ARG B 32 14.271 3.940 -12.524 1.00 0.00 H new ATOM 0 HD3 ARG B 32 14.610 4.605 -10.939 1.00 0.00 H new ATOM 0 HE ARG B 32 14.989 2.259 -10.141 1.00 0.00 H new ATOM 0 HH11 ARG B 32 15.013 2.632 -13.654 1.00 0.00 H new ATOM 0 HH12 ARG B 32 16.188 1.328 -13.850 1.00 0.00 H new ATOM 0 HH21 ARG B 32 16.588 0.724 -10.496 1.00 0.00 H new ATOM 0 HH22 ARG B 32 17.033 0.304 -12.153 1.00 0.00 H new ATOM 768 N ALA B 33 10.863 6.541 -10.086 1.00 0.00 N ATOM 769 CA ALA B 33 9.719 7.457 -10.154 1.00 0.00 C ATOM 770 C ALA B 33 8.671 6.948 -11.159 1.00 0.00 C ATOM 771 O ALA B 33 8.971 6.771 -12.343 1.00 0.00 O ATOM 772 CB ALA B 33 10.230 8.860 -10.508 1.00 0.00 C ATOM 0 H ALA B 33 11.174 6.230 -11.006 1.00 0.00 H new ATOM 0 HA ALA B 33 9.220 7.504 -9.186 1.00 0.00 H new ATOM 0 HB1 ALA B 33 9.389 9.551 -10.562 1.00 0.00 H new ATOM 0 HB2 ALA B 33 10.928 9.197 -9.742 1.00 0.00 H new ATOM 0 HB3 ALA B 33 10.737 8.830 -11.473 1.00 0.00 H new ATOM 778 N VAL B 34 7.456 6.666 -10.677 1.00 0.00 N ATOM 779 CA VAL B 34 6.417 5.904 -11.387 1.00 0.00 C ATOM 780 C VAL B 34 5.067 6.619 -11.278 1.00 0.00 C ATOM 781 O VAL B 34 4.323 6.423 -10.319 1.00 0.00 O ATOM 782 CB VAL B 34 6.362 4.441 -10.890 1.00 0.00 C ATOM 783 CG1 VAL B 34 5.512 3.591 -11.838 1.00 0.00 C ATOM 784 CG2 VAL B 34 7.755 3.791 -10.819 1.00 0.00 C ATOM 0 H VAL B 34 7.156 6.971 -9.751 1.00 0.00 H new ATOM 0 HA VAL B 34 6.672 5.857 -12.446 1.00 0.00 H new ATOM 0 HB VAL B 34 5.931 4.476 -9.890 1.00 0.00 H new ATOM 0 HG11 VAL B 34 5.481 2.563 -11.477 1.00 0.00 H new ATOM 0 HG12 VAL B 34 4.499 3.992 -11.877 1.00 0.00 H new ATOM 0 HG13 VAL B 34 5.949 3.612 -12.836 1.00 0.00 H new ATOM 0 HG21 VAL B 34 7.660 2.765 -10.464 1.00 0.00 H new ATOM 0 HG22 VAL B 34 8.208 3.792 -11.810 1.00 0.00 H new ATOM 0 HG23 VAL B 34 8.385 4.355 -10.132 1.00 0.00 H new ATOM 794 N SER B 35 4.789 7.500 -12.242 1.00 0.00 N ATOM 795 CA SER B 35 3.593 8.359 -12.312 1.00 0.00 C ATOM 796 C SER B 35 2.531 7.827 -13.283 1.00 0.00 C ATOM 797 O SER B 35 2.779 7.695 -14.485 1.00 0.00 O ATOM 798 CB SER B 35 3.988 9.784 -12.692 1.00 0.00 C ATOM 799 OG SER B 35 2.871 10.658 -12.639 1.00 0.00 O ATOM 0 H SER B 35 5.417 7.644 -13.033 1.00 0.00 H new ATOM 0 HA SER B 35 3.143 8.354 -11.319 1.00 0.00 H new ATOM 0 HB2 SER B 35 4.765 10.141 -12.016 1.00 0.00 H new ATOM 0 HB3 SER B 35 4.411 9.791 -13.696 1.00 0.00 H new ATOM 0 HG SER B 35 3.152 11.564 -12.885 1.00 0.00 H new ATOM 805 N LEU B 36 1.346 7.525 -12.747 1.00 0.00 N ATOM 806 CA LEU B 36 0.167 6.990 -13.437 1.00 0.00 C ATOM 807 C LEU B 36 -1.085 7.855 -13.209 1.00 0.00 C ATOM 808 O LEU B 36 -1.103 8.777 -12.392 1.00 0.00 O ATOM 809 CB LEU B 36 -0.094 5.533 -12.974 1.00 0.00 C ATOM 810 CG LEU B 36 0.673 4.411 -13.692 1.00 0.00 C ATOM 811 CD1 LEU B 36 0.490 4.467 -15.212 1.00 0.00 C ATOM 812 CD2 LEU B 36 2.156 4.374 -13.340 1.00 0.00 C ATOM 0 H LEU B 36 1.172 7.656 -11.751 1.00 0.00 H new ATOM 0 HA LEU B 36 0.375 7.005 -14.507 1.00 0.00 H new ATOM 0 HB2 LEU B 36 0.138 5.472 -11.911 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -1.160 5.332 -13.080 1.00 0.00 H new ATOM 0 HG LEU B 36 0.231 3.485 -13.325 1.00 0.00 H new ATOM 0 HD11 LEU B 36 1.050 3.655 -15.676 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -0.567 4.364 -15.455 1.00 0.00 H new ATOM 0 HD13 LEU B 36 0.857 5.422 -15.588 1.00 0.00 H new ATOM 0 HD21 LEU B 36 2.638 3.559 -13.881 1.00 0.00 H new ATOM 0 HD22 LEU B 36 2.620 5.320 -13.620 1.00 0.00 H new ATOM 0 HD23 LEU B 36 2.272 4.216 -12.268 1.00 0.00 H new ATOM 824 N TYR B 37 -2.149 7.501 -13.934 1.00 0.00 N ATOM 825 CA TYR B 37 -3.455 8.161 -13.965 1.00 0.00 C ATOM 826 C TYR B 37 -4.572 7.122 -13.788 1.00 0.00 C ATOM 827 O TYR B 37 -5.031 6.499 -14.751 1.00 0.00 O ATOM 828 CB TYR B 37 -3.578 8.955 -15.273 1.00 0.00 C ATOM 829 CG TYR B 37 -2.645 10.149 -15.338 1.00 0.00 C ATOM 830 CD1 TYR B 37 -3.010 11.356 -14.709 1.00 0.00 C ATOM 831 CD2 TYR B 37 -1.401 10.049 -15.994 1.00 0.00 C ATOM 832 CE1 TYR B 37 -2.146 12.465 -14.746 1.00 0.00 C ATOM 833 CE2 TYR B 37 -0.526 11.152 -16.020 1.00 0.00 C ATOM 834 CZ TYR B 37 -0.898 12.365 -15.400 1.00 0.00 C ATOM 835 OH TYR B 37 -0.052 13.432 -15.441 1.00 0.00 O ATOM 0 H TYR B 37 -2.118 6.693 -14.555 1.00 0.00 H new ATOM 0 HA TYR B 37 -3.553 8.865 -13.139 1.00 0.00 H new ATOM 0 HB2 TYR B 37 -3.369 8.293 -16.113 1.00 0.00 H new ATOM 0 HB3 TYR B 37 -4.606 9.299 -15.386 1.00 0.00 H new ATOM 0 HD1 TYR B 37 -3.958 11.430 -14.196 1.00 0.00 H new ATOM 0 HD2 TYR B 37 -1.119 9.125 -16.477 1.00 0.00 H new ATOM 0 HE1 TYR B 37 -2.436 13.392 -14.275 1.00 0.00 H new ATOM 0 HE2 TYR B 37 0.431 11.070 -16.515 1.00 0.00 H new ATOM 0 HH TYR B 37 0.761 13.186 -15.930 1.00 0.00 H new ATOM 845 N PHE B 38 -4.960 6.882 -12.537 1.00 0.00 N ATOM 846 CA PHE B 38 -6.072 6.038 -12.122 1.00 0.00 C ATOM 847 C PHE B 38 -7.419 6.747 -12.310 1.00 0.00 C ATOM 848 O PHE B 38 -7.480 7.951 -12.586 1.00 0.00 O ATOM 849 CB PHE B 38 -5.865 5.706 -10.636 1.00 0.00 C ATOM 850 CG PHE B 38 -5.001 4.486 -10.364 1.00 0.00 C ATOM 851 CD1 PHE B 38 -3.720 4.355 -10.934 1.00 0.00 C ATOM 852 CD2 PHE B 38 -5.507 3.441 -9.568 1.00 0.00 C ATOM 853 CE1 PHE B 38 -2.977 3.183 -10.720 1.00 0.00 C ATOM 854 CE2 PHE B 38 -4.775 2.253 -9.395 1.00 0.00 C ATOM 855 CZ PHE B 38 -3.501 2.128 -9.964 1.00 0.00 C ATOM 0 H PHE B 38 -4.476 7.297 -11.741 1.00 0.00 H new ATOM 0 HA PHE B 38 -6.094 5.136 -12.733 1.00 0.00 H new ATOM 0 HB2 PHE B 38 -5.413 6.569 -10.146 1.00 0.00 H new ATOM 0 HB3 PHE B 38 -6.840 5.552 -10.175 1.00 0.00 H new ATOM 0 HD1 PHE B 38 -3.310 5.154 -11.534 1.00 0.00 H new ATOM 0 HD2 PHE B 38 -6.467 3.553 -9.086 1.00 0.00 H new ATOM 0 HE1 PHE B 38 -1.988 3.094 -11.144 1.00 0.00 H new ATOM 0 HE2 PHE B 38 -5.194 1.438 -8.824 1.00 0.00 H new ATOM 0 HZ PHE B 38 -2.927 1.224 -9.820 1.00 0.00 H new ATOM 865 N SER B 39 -8.507 6.013 -12.070 1.00 0.00 N ATOM 866 CA SER B 39 -9.856 6.558 -11.967 1.00 0.00 C ATOM 867 C SER B 39 -10.473 6.402 -10.584 1.00 0.00 C ATOM 868 O SER B 39 -9.914 5.753 -9.698 1.00 0.00 O ATOM 869 CB SER B 39 -10.752 5.948 -13.054 1.00 0.00 C ATOM 870 OG SER B 39 -11.044 4.593 -12.743 1.00 0.00 O ATOM 0 H SER B 39 -8.471 5.002 -11.940 1.00 0.00 H new ATOM 0 HA SER B 39 -9.777 7.633 -12.127 1.00 0.00 H new ATOM 0 HB2 SER B 39 -11.677 6.518 -13.135 1.00 0.00 H new ATOM 0 HB3 SER B 39 -10.255 6.008 -14.022 1.00 0.00 H new ATOM 0 HG SER B 39 -11.617 4.213 -13.441 1.00 0.00 H new ATOM 876 N ASP B 40 -11.642 7.018 -10.401 1.00 0.00 N ATOM 877 CA ASP B 40 -12.420 7.003 -9.164 1.00 0.00 C ATOM 878 C ASP B 40 -12.664 5.569 -8.659 1.00 0.00 C ATOM 879 O ASP B 40 -12.465 5.291 -7.480 1.00 0.00 O ATOM 880 CB ASP B 40 -13.725 7.775 -9.424 1.00 0.00 C ATOM 881 CG ASP B 40 -14.503 8.119 -8.145 1.00 0.00 C ATOM 882 OD1 ASP B 40 -13.910 8.727 -7.221 1.00 0.00 O ATOM 883 OD2 ASP B 40 -15.720 7.826 -8.087 1.00 0.00 O ATOM 0 H ASP B 40 -12.089 7.561 -11.140 1.00 0.00 H new ATOM 0 HA ASP B 40 -11.867 7.492 -8.362 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.492 8.697 -9.956 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -14.363 7.182 -10.079 1.00 0.00 H new ATOM 888 N GLU B 41 -13.029 4.631 -9.539 1.00 0.00 N ATOM 889 CA GLU B 41 -13.186 3.201 -9.229 1.00 0.00 C ATOM 890 C GLU B 41 -11.864 2.558 -8.785 1.00 0.00 C ATOM 891 O GLU B 41 -11.776 1.977 -7.704 1.00 0.00 O ATOM 892 CB GLU B 41 -13.709 2.456 -10.468 1.00 0.00 C ATOM 893 CG GLU B 41 -15.091 2.934 -10.935 1.00 0.00 C ATOM 894 CD GLU B 41 -16.223 2.055 -10.368 1.00 0.00 C ATOM 895 OE1 GLU B 41 -16.528 2.162 -9.155 1.00 0.00 O ATOM 896 OE2 GLU B 41 -16.815 1.252 -11.130 1.00 0.00 O ATOM 0 H GLU B 41 -13.230 4.849 -10.515 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.896 3.124 -8.406 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.996 2.580 -11.284 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -13.758 1.390 -10.247 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -15.243 3.967 -10.623 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -15.131 2.920 -12.024 1.00 0.00 H new ATOM 903 N GLN B 42 -10.831 2.672 -9.625 1.00 0.00 N ATOM 904 CA GLN B 42 -9.489 2.097 -9.444 1.00 0.00 C ATOM 905 C GLN B 42 -8.834 2.555 -8.130 1.00 0.00 C ATOM 906 O GLN B 42 -8.193 1.759 -7.440 1.00 0.00 O ATOM 907 CB GLN B 42 -8.637 2.447 -10.674 1.00 0.00 C ATOM 908 CG GLN B 42 -9.201 1.865 -11.987 1.00 0.00 C ATOM 909 CD GLN B 42 -8.547 2.442 -13.245 1.00 0.00 C ATOM 910 OE1 GLN B 42 -7.609 3.226 -13.212 1.00 0.00 O ATOM 911 NE2 GLN B 42 -9.022 2.073 -14.416 1.00 0.00 N ATOM 0 H GLN B 42 -10.910 3.195 -10.497 1.00 0.00 H new ATOM 0 HA GLN B 42 -9.570 1.013 -9.362 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -8.568 3.531 -10.764 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -7.624 2.075 -10.524 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -9.067 0.783 -11.982 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -10.274 2.053 -12.027 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -9.804 1.420 -14.466 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -8.608 2.440 -15.273 1.00 0.00 H new ATOM 920 N TYR B 43 -9.030 3.819 -7.756 1.00 0.00 N ATOM 921 CA TYR B 43 -8.571 4.396 -6.496 1.00 0.00 C ATOM 922 C TYR B 43 -9.399 3.886 -5.305 1.00 0.00 C ATOM 923 O TYR B 43 -8.836 3.435 -4.310 1.00 0.00 O ATOM 924 CB TYR B 43 -8.620 5.927 -6.610 1.00 0.00 C ATOM 925 CG TYR B 43 -7.736 6.654 -5.616 1.00 0.00 C ATOM 926 CD1 TYR B 43 -8.160 6.851 -4.287 1.00 0.00 C ATOM 927 CD2 TYR B 43 -6.482 7.142 -6.032 1.00 0.00 C ATOM 928 CE1 TYR B 43 -7.329 7.533 -3.376 1.00 0.00 C ATOM 929 CE2 TYR B 43 -5.659 7.845 -5.132 1.00 0.00 C ATOM 930 CZ TYR B 43 -6.078 8.037 -3.796 1.00 0.00 C ATOM 931 OH TYR B 43 -5.288 8.706 -2.913 1.00 0.00 O ATOM 0 H TYR B 43 -9.528 4.489 -8.341 1.00 0.00 H new ATOM 0 HA TYR B 43 -7.544 4.083 -6.307 1.00 0.00 H new ATOM 0 HB2 TYR B 43 -8.325 6.214 -7.619 1.00 0.00 H new ATOM 0 HB3 TYR B 43 -9.650 6.257 -6.473 1.00 0.00 H new ATOM 0 HD1 TYR B 43 -9.122 6.479 -3.966 1.00 0.00 H new ATOM 0 HD2 TYR B 43 -6.150 6.976 -7.046 1.00 0.00 H new ATOM 0 HE1 TYR B 43 -7.649 7.671 -2.354 1.00 0.00 H new ATOM 0 HE2 TYR B 43 -4.708 8.237 -5.462 1.00 0.00 H new ATOM 0 HH TYR B 43 -4.462 8.986 -3.360 1.00 0.00 H new ATOM 941 N GLN B 44 -10.734 3.906 -5.405 1.00 0.00 N ATOM 942 CA GLN B 44 -11.657 3.501 -4.334 1.00 0.00 C ATOM 943 C GLN B 44 -11.526 2.026 -3.962 1.00 0.00 C ATOM 944 O GLN B 44 -11.553 1.690 -2.777 1.00 0.00 O ATOM 945 CB GLN B 44 -13.113 3.765 -4.731 1.00 0.00 C ATOM 946 CG GLN B 44 -13.534 5.215 -4.459 1.00 0.00 C ATOM 947 CD GLN B 44 -14.918 5.507 -5.027 1.00 0.00 C ATOM 948 OE1 GLN B 44 -15.876 5.796 -4.318 1.00 0.00 O ATOM 949 NE2 GLN B 44 -15.065 5.441 -6.328 1.00 0.00 N ATOM 0 H GLN B 44 -11.215 4.211 -6.251 1.00 0.00 H new ATOM 0 HA GLN B 44 -11.381 4.104 -3.469 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -13.245 3.543 -5.790 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -13.766 3.089 -4.179 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -13.533 5.401 -3.385 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -12.806 5.896 -4.901 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -14.270 5.201 -6.920 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -15.975 5.630 -6.749 1.00 0.00 H new ATOM 958 N LYS B 45 -11.359 1.141 -4.951 1.00 0.00 N ATOM 959 CA LYS B 45 -11.122 -0.280 -4.720 1.00 0.00 C ATOM 960 C LYS B 45 -9.878 -0.497 -3.862 1.00 0.00 C ATOM 961 O LYS B 45 -9.936 -1.295 -2.927 1.00 0.00 O ATOM 962 CB LYS B 45 -11.022 -1.005 -6.070 1.00 0.00 C ATOM 963 CG LYS B 45 -12.242 -1.876 -6.404 1.00 0.00 C ATOM 964 CD LYS B 45 -13.529 -1.057 -6.604 1.00 0.00 C ATOM 965 CE LYS B 45 -14.680 -1.904 -7.173 1.00 0.00 C ATOM 966 NZ LYS B 45 -15.143 -2.959 -6.230 1.00 0.00 N ATOM 0 H LYS B 45 -11.385 1.396 -5.938 1.00 0.00 H new ATOM 0 HA LYS B 45 -11.960 -0.700 -4.164 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -10.890 -0.265 -6.859 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -10.130 -1.632 -6.069 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -12.037 -2.447 -7.310 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -12.398 -2.597 -5.601 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -13.835 -0.627 -5.650 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -13.326 -0.225 -7.278 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -15.517 -1.251 -7.420 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -14.355 -2.371 -8.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -15.919 -3.498 -6.666 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -14.354 -3.601 -6.013 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -15.480 -2.516 -5.352 1.00 0.00 H new ATOM 980 N LEU B 46 -8.788 0.241 -4.117 1.00 0.00 N ATOM 981 CA LEU B 46 -7.589 0.109 -3.282 1.00 0.00 C ATOM 982 C LEU B 46 -7.655 0.899 -1.973 1.00 0.00 C ATOM 983 O LEU B 46 -7.040 0.500 -0.990 1.00 0.00 O ATOM 984 CB LEU B 46 -6.312 0.387 -4.095 1.00 0.00 C ATOM 985 CG LEU B 46 -5.647 -0.952 -4.449 1.00 0.00 C ATOM 986 CD1 LEU B 46 -4.495 -0.802 -5.433 1.00 0.00 C ATOM 987 CD2 LEU B 46 -5.009 -1.634 -3.236 1.00 0.00 C ATOM 0 H LEU B 46 -8.712 0.919 -4.875 1.00 0.00 H new ATOM 0 HA LEU B 46 -7.548 -0.932 -2.962 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -6.556 0.939 -5.003 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.626 1.008 -3.519 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.469 -1.534 -4.867 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -4.066 -1.782 -5.644 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.863 -0.360 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.730 -0.156 -5.002 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -4.554 -2.575 -3.545 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -4.244 -0.983 -2.813 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -5.774 -1.830 -2.485 1.00 0.00 H new ATOM 999 N GLU B 47 -8.463 1.951 -1.903 1.00 0.00 N ATOM 1000 CA GLU B 47 -8.786 2.648 -0.653 1.00 0.00 C ATOM 1001 C GLU B 47 -9.567 1.763 0.332 1.00 0.00 C ATOM 1002 O GLU B 47 -9.253 1.728 1.525 1.00 0.00 O ATOM 1003 CB GLU B 47 -9.526 3.956 -0.963 1.00 0.00 C ATOM 1004 CG GLU B 47 -9.563 4.882 0.254 1.00 0.00 C ATOM 1005 CD GLU B 47 -10.438 6.121 -0.015 1.00 0.00 C ATOM 1006 OE1 GLU B 47 -11.674 6.052 0.199 1.00 0.00 O ATOM 1007 OE2 GLU B 47 -9.899 7.173 -0.436 1.00 0.00 O ATOM 0 H GLU B 47 -8.921 2.353 -2.721 1.00 0.00 H new ATOM 0 HA GLU B 47 -7.849 2.889 -0.150 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -9.036 4.464 -1.793 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -10.544 3.732 -1.282 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -9.952 4.339 1.116 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -8.550 5.197 0.506 1.00 0.00 H new ATOM 1014 N LYS B 48 -10.536 0.985 -0.167 1.00 0.00 N ATOM 1015 CA LYS B 48 -11.308 0.007 0.610 1.00 0.00 C ATOM 1016 C LYS B 48 -10.400 -1.044 1.261 1.00 0.00 C ATOM 1017 O LYS B 48 -10.593 -1.404 2.421 1.00 0.00 O ATOM 1018 CB LYS B 48 -12.383 -0.622 -0.296 1.00 0.00 C ATOM 1019 CG LYS B 48 -13.309 -1.585 0.469 1.00 0.00 C ATOM 1020 CD LYS B 48 -14.439 -2.149 -0.409 1.00 0.00 C ATOM 1021 CE LYS B 48 -15.496 -1.114 -0.830 1.00 0.00 C ATOM 1022 NZ LYS B 48 -16.321 -0.643 0.316 1.00 0.00 N ATOM 0 H LYS B 48 -10.812 1.019 -1.148 1.00 0.00 H new ATOM 0 HA LYS B 48 -11.807 0.516 1.435 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -12.981 0.169 -0.748 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -11.898 -1.160 -1.110 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.718 -2.410 0.867 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -13.744 -1.063 1.322 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -14.001 -2.588 -1.306 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -14.934 -2.956 0.132 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -15.000 -0.260 -1.292 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -16.147 -1.552 -1.587 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -17.017 0.052 -0.020 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -16.817 -1.452 0.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -15.706 -0.200 1.028 1.00 0.00 H new ATOM 1036 N MET B 49 -9.380 -1.495 0.530 1.00 0.00 N ATOM 1037 CA MET B 49 -8.347 -2.410 0.979 1.00 0.00 C ATOM 1038 C MET B 49 -7.342 -1.748 1.930 1.00 0.00 C ATOM 1039 O MET B 49 -6.955 -2.348 2.929 1.00 0.00 O ATOM 1040 CB MET B 49 -7.624 -2.881 -0.274 1.00 0.00 C ATOM 1041 CG MET B 49 -8.474 -3.780 -1.178 1.00 0.00 C ATOM 1042 SD MET B 49 -7.739 -4.042 -2.807 1.00 0.00 S ATOM 1043 CE MET B 49 -6.161 -4.784 -2.328 1.00 0.00 C ATOM 0 H MET B 49 -9.252 -1.213 -0.442 1.00 0.00 H new ATOM 0 HA MET B 49 -8.802 -3.228 1.537 1.00 0.00 H new ATOM 0 HB2 MET B 49 -7.300 -2.010 -0.844 1.00 0.00 H new ATOM 0 HB3 MET B 49 -6.725 -3.423 0.019 1.00 0.00 H new ATOM 0 HG2 MET B 49 -8.617 -4.745 -0.691 1.00 0.00 H new ATOM 0 HG3 MET B 49 -9.461 -3.335 -1.299 1.00 0.00 H new ATOM 0 HE1 MET B 49 -5.665 -5.186 -3.211 1.00 0.00 H new ATOM 0 HE2 MET B 49 -5.527 -4.025 -1.869 1.00 0.00 H new ATOM 0 HE3 MET B 49 -6.339 -5.588 -1.614 1.00 0.00 H new ATOM 1053 N ALA B 50 -6.940 -0.501 1.665 1.00 0.00 N ATOM 1054 CA ALA B 50 -6.013 0.261 2.498 1.00 0.00 C ATOM 1055 C ALA B 50 -6.509 0.447 3.940 1.00 0.00 C ATOM 1056 O ALA B 50 -5.694 0.518 4.856 1.00 0.00 O ATOM 1057 CB ALA B 50 -5.721 1.594 1.810 1.00 0.00 C ATOM 0 H ALA B 50 -7.259 0.016 0.846 1.00 0.00 H new ATOM 0 HA ALA B 50 -5.089 -0.308 2.597 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.030 2.175 2.421 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -5.275 1.409 0.833 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -6.650 2.150 1.685 1.00 0.00 H new ATOM 1063 N ASN B 51 -7.823 0.446 4.179 1.00 0.00 N ATOM 1064 CA ASN B 51 -8.406 0.424 5.523 1.00 0.00 C ATOM 1065 C ASN B 51 -7.965 -0.800 6.361 1.00 0.00 C ATOM 1066 O ASN B 51 -7.908 -0.706 7.586 1.00 0.00 O ATOM 1067 CB ASN B 51 -9.930 0.511 5.381 1.00 0.00 C ATOM 1068 CG ASN B 51 -10.634 0.594 6.726 1.00 0.00 C ATOM 1069 OD1 ASN B 51 -10.508 1.563 7.461 1.00 0.00 O ATOM 1070 ND2 ASN B 51 -11.404 -0.408 7.091 1.00 0.00 N ATOM 0 H ASN B 51 -8.521 0.461 3.435 1.00 0.00 H new ATOM 0 HA ASN B 51 -8.034 1.283 6.082 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -10.187 1.387 4.785 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -10.292 -0.362 4.838 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -11.894 -0.375 7.985 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -11.511 -1.218 6.480 1.00 0.00 H new ATOM 1077 N GLU B 52 -7.581 -1.917 5.733 1.00 0.00 N ATOM 1078 CA GLU B 52 -7.024 -3.097 6.411 1.00 0.00 C ATOM 1079 C GLU B 52 -5.589 -2.879 6.941 1.00 0.00 C ATOM 1080 O GLU B 52 -5.188 -3.509 7.920 1.00 0.00 O ATOM 1081 CB GLU B 52 -7.063 -4.338 5.502 1.00 0.00 C ATOM 1082 CG GLU B 52 -8.485 -4.692 5.037 1.00 0.00 C ATOM 1083 CD GLU B 52 -8.500 -6.007 4.234 1.00 0.00 C ATOM 1084 OE1 GLU B 52 -8.416 -7.099 4.850 1.00 0.00 O ATOM 1085 OE2 GLU B 52 -8.618 -5.965 2.985 1.00 0.00 O ATOM 0 H GLU B 52 -7.649 -2.030 4.722 1.00 0.00 H new ATOM 0 HA GLU B 52 -7.665 -3.264 7.277 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -6.433 -4.163 4.630 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -6.638 -5.188 6.037 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -9.141 -4.785 5.903 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -8.881 -3.883 4.422 1.00 0.00 H new ATOM 1092 N GLU B 53 -4.828 -1.954 6.340 1.00 0.00 N ATOM 1093 CA GLU B 53 -3.543 -1.434 6.850 1.00 0.00 C ATOM 1094 C GLU B 53 -3.723 -0.134 7.678 1.00 0.00 C ATOM 1095 O GLU B 53 -2.778 0.373 8.281 1.00 0.00 O ATOM 1096 CB GLU B 53 -2.576 -1.269 5.660 1.00 0.00 C ATOM 1097 CG GLU B 53 -1.127 -0.957 6.078 1.00 0.00 C ATOM 1098 CD GLU B 53 -0.089 -1.096 4.947 1.00 0.00 C ATOM 1099 OE1 GLU B 53 -0.222 -1.971 4.060 1.00 0.00 O ATOM 1100 OE2 GLU B 53 0.952 -0.396 4.990 1.00 0.00 O ATOM 0 H GLU B 53 -5.097 -1.529 5.452 1.00 0.00 H new ATOM 0 HA GLU B 53 -3.111 -2.147 7.552 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -2.585 -2.183 5.067 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -2.940 -0.468 5.016 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -1.086 0.060 6.468 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -0.847 -1.623 6.894 1.00 0.00 H new ATOM 1107 N GLU B 54 -4.961 0.365 7.764 1.00 0.00 N ATOM 1108 CA GLU B 54 -5.418 1.571 8.472 1.00 0.00 C ATOM 1109 C GLU B 54 -5.081 2.866 7.698 1.00 0.00 C ATOM 1110 O GLU B 54 -4.547 3.838 8.234 1.00 0.00 O ATOM 1111 CB GLU B 54 -4.994 1.550 9.955 1.00 0.00 C ATOM 1112 CG GLU B 54 -5.961 2.356 10.829 1.00 0.00 C ATOM 1113 CD GLU B 54 -5.492 2.383 12.297 1.00 0.00 C ATOM 1114 OE1 GLU B 54 -5.845 1.458 13.070 1.00 0.00 O ATOM 1115 OE2 GLU B 54 -4.776 3.334 12.697 1.00 0.00 O ATOM 0 H GLU B 54 -5.739 -0.104 7.300 1.00 0.00 H new ATOM 0 HA GLU B 54 -6.508 1.565 8.500 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -4.956 0.520 10.309 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -3.988 1.958 10.052 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -6.036 3.375 10.449 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -6.958 1.920 10.771 1.00 0.00 H new ATOM 1122 N GLU B 55 -5.445 2.861 6.410 1.00 0.00 N ATOM 1123 CA GLU B 55 -5.282 3.896 5.380 1.00 0.00 C ATOM 1124 C GLU B 55 -3.815 4.202 5.018 1.00 0.00 C ATOM 1125 O GLU B 55 -3.096 4.934 5.703 1.00 0.00 O ATOM 1126 CB GLU B 55 -6.090 5.162 5.681 1.00 0.00 C ATOM 1127 CG GLU B 55 -7.575 4.898 5.970 1.00 0.00 C ATOM 1128 CD GLU B 55 -8.332 6.222 6.192 1.00 0.00 C ATOM 1129 OE1 GLU B 55 -8.817 6.824 5.202 1.00 0.00 O ATOM 1130 OE2 GLU B 55 -8.455 6.671 7.358 1.00 0.00 O ATOM 0 H GLU B 55 -5.912 2.042 6.021 1.00 0.00 H new ATOM 0 HA GLU B 55 -5.709 3.459 4.477 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -5.647 5.668 6.539 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -6.010 5.842 4.833 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -8.021 4.354 5.138 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.672 4.266 6.853 1.00 0.00 H new ATOM 1137 N SER B 56 -3.380 3.631 3.894 1.00 0.00 N ATOM 1138 CA SER B 56 -2.020 3.655 3.343 1.00 0.00 C ATOM 1139 C SER B 56 -2.055 3.732 1.808 1.00 0.00 C ATOM 1140 O SER B 56 -1.207 3.159 1.119 1.00 0.00 O ATOM 1141 CB SER B 56 -1.259 2.414 3.837 1.00 0.00 C ATOM 1142 OG SER B 56 -1.848 1.230 3.325 1.00 0.00 O ATOM 0 H SER B 56 -4.015 3.099 3.299 1.00 0.00 H new ATOM 0 HA SER B 56 -1.497 4.546 3.690 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.216 2.472 3.525 1.00 0.00 H new ATOM 0 HB3 SER B 56 -1.264 2.387 4.927 1.00 0.00 H new ATOM 0 HG SER B 56 -1.144 0.598 3.069 1.00 0.00 H new ATOM 1148 N VAL B 57 -3.091 4.373 1.246 1.00 0.00 N ATOM 1149 CA VAL B 57 -3.301 4.441 -0.211 1.00 0.00 C ATOM 1150 C VAL B 57 -2.072 5.026 -0.926 1.00 0.00 C ATOM 1151 O VAL B 57 -1.428 5.956 -0.435 1.00 0.00 O ATOM 1152 CB VAL B 57 -4.552 5.244 -0.630 1.00 0.00 C ATOM 1153 CG1 VAL B 57 -5.790 4.354 -0.622 1.00 0.00 C ATOM 1154 CG2 VAL B 57 -4.841 6.466 0.246 1.00 0.00 C ATOM 0 H VAL B 57 -3.807 4.859 1.787 1.00 0.00 H new ATOM 0 HA VAL B 57 -3.461 3.407 -0.517 1.00 0.00 H new ATOM 0 HB VAL B 57 -4.327 5.605 -1.633 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -6.660 4.939 -0.920 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -5.650 3.530 -1.321 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -5.946 3.957 0.381 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -5.735 6.971 -0.118 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -4.999 6.146 1.276 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -3.995 7.152 0.205 1.00 0.00 H new ATOM 1164 N GLY B 58 -1.717 4.450 -2.075 1.00 0.00 N ATOM 1165 CA GLY B 58 -0.467 4.715 -2.798 1.00 0.00 C ATOM 1166 C GLY B 58 0.620 3.722 -2.393 1.00 0.00 C ATOM 1167 O GLY B 58 1.168 3.007 -3.232 1.00 0.00 O ATOM 0 H GLY B 58 -2.308 3.764 -2.545 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -0.643 4.649 -3.872 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -0.132 5.731 -2.591 1.00 0.00 H new ATOM 1171 N SER B 59 0.858 3.589 -1.089 1.00 0.00 N ATOM 1172 CA SER B 59 1.738 2.544 -0.550 1.00 0.00 C ATOM 1173 C SER B 59 1.152 1.157 -0.821 1.00 0.00 C ATOM 1174 O SER B 59 1.862 0.280 -1.301 1.00 0.00 O ATOM 1175 CB SER B 59 1.992 2.755 0.945 1.00 0.00 C ATOM 1176 OG SER B 59 3.156 2.060 1.362 1.00 0.00 O ATOM 0 H SER B 59 0.451 4.196 -0.378 1.00 0.00 H new ATOM 0 HA SER B 59 2.699 2.611 -1.059 1.00 0.00 H new ATOM 0 HB2 SER B 59 2.105 3.819 1.153 1.00 0.00 H new ATOM 0 HB3 SER B 59 1.131 2.408 1.517 1.00 0.00 H new ATOM 0 HG SER B 59 3.301 2.210 2.320 1.00 0.00 H new ATOM 1182 N TYR B 60 -0.157 0.965 -0.615 1.00 0.00 N ATOM 1183 CA TYR B 60 -0.848 -0.287 -0.955 1.00 0.00 C ATOM 1184 C TYR B 60 -0.790 -0.608 -2.460 1.00 0.00 C ATOM 1185 O TYR B 60 -0.589 -1.758 -2.844 1.00 0.00 O ATOM 1186 CB TYR B 60 -2.301 -0.249 -0.460 1.00 0.00 C ATOM 1187 CG TYR B 60 -2.805 -1.589 0.064 1.00 0.00 C ATOM 1188 CD1 TYR B 60 -2.953 -2.693 -0.803 1.00 0.00 C ATOM 1189 CD2 TYR B 60 -3.104 -1.744 1.433 1.00 0.00 C ATOM 1190 CE1 TYR B 60 -3.405 -3.933 -0.313 1.00 0.00 C ATOM 1191 CE2 TYR B 60 -3.581 -2.976 1.924 1.00 0.00 C ATOM 1192 CZ TYR B 60 -3.734 -4.074 1.051 1.00 0.00 C ATOM 1193 OH TYR B 60 -4.188 -5.272 1.512 1.00 0.00 O ATOM 0 H TYR B 60 -0.768 1.673 -0.208 1.00 0.00 H new ATOM 0 HA TYR B 60 -0.320 -1.092 -0.444 1.00 0.00 H new ATOM 0 HB2 TYR B 60 -2.387 0.496 0.331 1.00 0.00 H new ATOM 0 HB3 TYR B 60 -2.945 0.077 -1.276 1.00 0.00 H new ATOM 0 HD1 TYR B 60 -2.717 -2.586 -1.851 1.00 0.00 H new ATOM 0 HD2 TYR B 60 -2.967 -0.914 2.110 1.00 0.00 H new ATOM 0 HE1 TYR B 60 -3.500 -4.776 -0.981 1.00 0.00 H new ATOM 0 HE2 TYR B 60 -3.830 -3.080 2.970 1.00 0.00 H new ATOM 0 HH TYR B 60 -4.369 -5.205 2.473 1.00 0.00 H new ATOM 1203 N ILE B 61 -0.902 0.414 -3.320 1.00 0.00 N ATOM 1204 CA ILE B 61 -0.747 0.292 -4.787 1.00 0.00 C ATOM 1205 C ILE B 61 0.633 -0.296 -5.099 1.00 0.00 C ATOM 1206 O ILE B 61 0.740 -1.286 -5.828 1.00 0.00 O ATOM 1207 CB ILE B 61 -0.973 1.642 -5.527 1.00 0.00 C ATOM 1208 CG1 ILE B 61 -2.396 2.205 -5.298 1.00 0.00 C ATOM 1209 CG2 ILE B 61 -0.709 1.518 -7.041 1.00 0.00 C ATOM 1210 CD1 ILE B 61 -2.625 3.610 -5.866 1.00 0.00 C ATOM 0 H ILE B 61 -1.106 1.366 -3.017 1.00 0.00 H new ATOM 0 HA ILE B 61 -1.520 -0.381 -5.158 1.00 0.00 H new ATOM 0 HB ILE B 61 -0.253 2.339 -5.099 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -3.119 1.524 -5.747 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -2.597 2.223 -4.227 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -0.878 2.482 -7.520 1.00 0.00 H new ATOM 0 HG22 ILE B 61 0.322 1.207 -7.206 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -1.384 0.777 -7.469 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -3.648 3.924 -5.659 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -1.930 4.309 -5.400 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -2.460 3.598 -6.943 1.00 0.00 H new ATOM 1222 N LYS B 62 1.683 0.263 -4.486 1.00 0.00 N ATOM 1223 CA LYS B 62 3.043 -0.271 -4.587 1.00 0.00 C ATOM 1224 C LYS B 62 3.136 -1.709 -4.063 1.00 0.00 C ATOM 1225 O LYS B 62 3.586 -2.591 -4.795 1.00 0.00 O ATOM 1226 CB LYS B 62 4.030 0.669 -3.873 1.00 0.00 C ATOM 1227 CG LYS B 62 5.488 0.404 -4.292 1.00 0.00 C ATOM 1228 CD LYS B 62 6.527 0.798 -3.233 1.00 0.00 C ATOM 1229 CE LYS B 62 6.463 2.287 -2.867 1.00 0.00 C ATOM 1230 NZ LYS B 62 7.607 2.685 -2.003 1.00 0.00 N ATOM 0 H LYS B 62 1.612 1.099 -3.906 1.00 0.00 H new ATOM 0 HA LYS B 62 3.316 -0.316 -5.641 1.00 0.00 H new ATOM 0 HB2 LYS B 62 3.771 1.704 -4.097 1.00 0.00 H new ATOM 0 HB3 LYS B 62 3.934 0.543 -2.795 1.00 0.00 H new ATOM 0 HG2 LYS B 62 5.602 -0.656 -4.520 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.696 0.952 -5.211 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.370 0.200 -2.335 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.525 0.561 -3.603 1.00 0.00 H new ATOM 0 HE2 LYS B 62 6.467 2.887 -3.777 1.00 0.00 H new ATOM 0 HE3 LYS B 62 5.526 2.496 -2.351 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 7.311 3.453 -1.367 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.917 1.868 -1.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 8.394 3.013 -2.598 1.00 0.00 H new ATOM 1244 N ARG B 63 2.667 -1.957 -2.830 1.00 0.00 N ATOM 1245 CA ARG B 63 2.661 -3.269 -2.152 1.00 0.00 C ATOM 1246 C ARG B 63 2.052 -4.355 -3.020 1.00 0.00 C ATOM 1247 O ARG B 63 2.610 -5.439 -3.100 1.00 0.00 O ATOM 1248 CB ARG B 63 1.904 -3.262 -0.812 1.00 0.00 C ATOM 1249 CG ARG B 63 2.631 -2.591 0.361 1.00 0.00 C ATOM 1250 CD ARG B 63 1.994 -3.086 1.669 1.00 0.00 C ATOM 1251 NE ARG B 63 2.323 -2.254 2.837 1.00 0.00 N ATOM 1252 CZ ARG B 63 3.457 -2.134 3.495 1.00 0.00 C ATOM 1253 NH1 ARG B 63 4.549 -2.754 3.146 1.00 0.00 N ATOM 1254 NH2 ARG B 63 3.497 -1.374 4.547 1.00 0.00 N ATOM 0 H ARG B 63 2.264 -1.220 -2.251 1.00 0.00 H new ATOM 0 HA ARG B 63 3.714 -3.479 -1.962 1.00 0.00 H new ATOM 0 HB2 ARG B 63 0.948 -2.759 -0.959 1.00 0.00 H new ATOM 0 HB3 ARG B 63 1.682 -4.293 -0.536 1.00 0.00 H new ATOM 0 HG2 ARG B 63 3.693 -2.835 0.339 1.00 0.00 H new ATOM 0 HG3 ARG B 63 2.552 -1.506 0.287 1.00 0.00 H new ATOM 0 HD2 ARG B 63 0.911 -3.115 1.548 1.00 0.00 H new ATOM 0 HD3 ARG B 63 2.321 -4.108 1.858 1.00 0.00 H new ATOM 0 HE ARG B 63 1.555 -1.683 3.191 1.00 0.00 H new ATOM 0 HH11 ARG B 63 4.550 -3.365 2.330 1.00 0.00 H new ATOM 0 HH12 ARG B 63 5.403 -2.628 3.689 1.00 0.00 H new ATOM 0 HH21 ARG B 63 2.658 -0.881 4.852 1.00 0.00 H new ATOM 0 HH22 ARG B 63 4.368 -1.270 5.068 1.00 0.00 H new ATOM 1268 N TYR B 64 0.928 -4.084 -3.675 1.00 0.00 N ATOM 1269 CA TYR B 64 0.138 -5.099 -4.370 1.00 0.00 C ATOM 1270 C TYR B 64 0.908 -5.720 -5.533 1.00 0.00 C ATOM 1271 O TYR B 64 0.957 -6.934 -5.714 1.00 0.00 O ATOM 1272 CB TYR B 64 -1.164 -4.480 -4.878 1.00 0.00 C ATOM 1273 CG TYR B 64 -2.203 -5.558 -5.124 1.00 0.00 C ATOM 1274 CD1 TYR B 64 -2.164 -6.326 -6.304 1.00 0.00 C ATOM 1275 CD2 TYR B 64 -3.103 -5.899 -4.097 1.00 0.00 C ATOM 1276 CE1 TYR B 64 -2.994 -7.455 -6.441 1.00 0.00 C ATOM 1277 CE2 TYR B 64 -3.957 -7.012 -4.241 1.00 0.00 C ATOM 1278 CZ TYR B 64 -3.897 -7.799 -5.411 1.00 0.00 C ATOM 1279 OH TYR B 64 -4.694 -8.897 -5.525 1.00 0.00 O ATOM 0 H TYR B 64 0.534 -3.145 -3.740 1.00 0.00 H new ATOM 0 HA TYR B 64 -0.084 -5.895 -3.659 1.00 0.00 H new ATOM 0 HB2 TYR B 64 -1.541 -3.762 -4.149 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -0.977 -3.930 -5.800 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -1.496 -6.048 -7.106 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -3.140 -5.306 -3.195 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -2.940 -8.059 -7.335 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -4.656 -7.262 -3.457 1.00 0.00 H new ATOM 0 HH TYR B 64 -5.251 -8.982 -4.723 1.00 0.00 H new ATOM 1289 N ILE B 65 1.561 -4.849 -6.292 1.00 0.00 N ATOM 1290 CA ILE B 65 2.483 -5.181 -7.375 1.00 0.00 C ATOM 1291 C ILE B 65 3.644 -6.008 -6.843 1.00 0.00 C ATOM 1292 O ILE B 65 3.910 -7.089 -7.364 1.00 0.00 O ATOM 1293 CB ILE B 65 2.947 -3.887 -8.072 1.00 0.00 C ATOM 1294 CG1 ILE B 65 1.811 -3.316 -8.941 1.00 0.00 C ATOM 1295 CG2 ILE B 65 4.247 -4.028 -8.876 1.00 0.00 C ATOM 1296 CD1 ILE B 65 1.502 -4.087 -10.233 1.00 0.00 C ATOM 0 H ILE B 65 1.458 -3.842 -6.164 1.00 0.00 H new ATOM 0 HA ILE B 65 1.977 -5.793 -8.122 1.00 0.00 H new ATOM 0 HB ILE B 65 3.188 -3.184 -7.275 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.904 -3.277 -8.338 1.00 0.00 H new ATOM 0 HG13 ILE B 65 2.063 -2.289 -9.205 1.00 0.00 H new ATOM 0 HG21 ILE B 65 4.498 -3.070 -9.332 1.00 0.00 H new ATOM 0 HG22 ILE B 65 5.054 -4.337 -8.212 1.00 0.00 H new ATOM 0 HG23 ILE B 65 4.113 -4.777 -9.656 1.00 0.00 H new ATOM 0 HD11 ILE B 65 0.687 -3.596 -10.764 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.389 -4.105 -10.867 1.00 0.00 H new ATOM 0 HD13 ILE B 65 1.211 -5.108 -9.987 1.00 0.00 H new ATOM 1308 N LEU B 66 4.318 -5.545 -5.785 1.00 0.00 N ATOM 1309 CA LEU B 66 5.508 -6.239 -5.296 1.00 0.00 C ATOM 1310 C LEU B 66 5.169 -7.540 -4.537 1.00 0.00 C ATOM 1311 O LEU B 66 5.989 -8.455 -4.470 1.00 0.00 O ATOM 1312 CB LEU B 66 6.445 -5.245 -4.595 1.00 0.00 C ATOM 1313 CG LEU B 66 5.921 -4.514 -3.354 1.00 0.00 C ATOM 1314 CD1 LEU B 66 5.908 -5.406 -2.123 1.00 0.00 C ATOM 1315 CD2 LEU B 66 6.778 -3.287 -3.047 1.00 0.00 C ATOM 0 H LEU B 66 4.064 -4.708 -5.261 1.00 0.00 H new ATOM 0 HA LEU B 66 6.088 -6.622 -6.136 1.00 0.00 H new ATOM 0 HB2 LEU B 66 7.349 -5.783 -4.309 1.00 0.00 H new ATOM 0 HB3 LEU B 66 6.740 -4.492 -5.326 1.00 0.00 H new ATOM 0 HG LEU B 66 4.898 -4.216 -3.584 1.00 0.00 H new ATOM 0 HD11 LEU B 66 5.529 -4.843 -1.270 1.00 0.00 H new ATOM 0 HD12 LEU B 66 5.265 -6.267 -2.304 1.00 0.00 H new ATOM 0 HD13 LEU B 66 6.921 -5.748 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU B 66 6.388 -2.783 -2.162 1.00 0.00 H new ATOM 0 HD22 LEU B 66 7.806 -3.598 -2.864 1.00 0.00 H new ATOM 0 HD23 LEU B 66 6.751 -2.603 -3.895 1.00 0.00 H new ATOM 1327 N LYS B 67 3.920 -7.672 -4.071 1.00 0.00 N ATOM 1328 CA LYS B 67 3.289 -8.882 -3.535 1.00 0.00 C ATOM 1329 C LYS B 67 2.974 -9.890 -4.642 1.00 0.00 C ATOM 1330 O LYS B 67 3.279 -11.073 -4.498 1.00 0.00 O ATOM 1331 CB LYS B 67 2.029 -8.464 -2.755 1.00 0.00 C ATOM 1332 CG LYS B 67 1.315 -9.625 -2.050 1.00 0.00 C ATOM 1333 CD LYS B 67 0.109 -9.102 -1.253 1.00 0.00 C ATOM 1334 CE LYS B 67 -0.625 -10.258 -0.561 1.00 0.00 C ATOM 1335 NZ LYS B 67 -1.796 -9.774 0.217 1.00 0.00 N ATOM 0 H LYS B 67 3.280 -6.878 -4.059 1.00 0.00 H new ATOM 0 HA LYS B 67 3.978 -9.390 -2.860 1.00 0.00 H new ATOM 0 HB2 LYS B 67 2.306 -7.717 -2.011 1.00 0.00 H new ATOM 0 HB3 LYS B 67 1.331 -7.986 -3.442 1.00 0.00 H new ATOM 0 HG2 LYS B 67 0.984 -10.358 -2.786 1.00 0.00 H new ATOM 0 HG3 LYS B 67 2.008 -10.135 -1.381 1.00 0.00 H new ATOM 0 HD2 LYS B 67 0.444 -8.380 -0.509 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -0.575 -8.578 -1.921 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -0.957 -10.979 -1.308 1.00 0.00 H new ATOM 0 HE3 LYS B 67 0.063 -10.781 0.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -2.269 -10.581 0.671 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -1.476 -9.105 0.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -2.464 -9.297 -0.422 1.00 0.00 H new ATOM 1349 N ALA B 68 2.409 -9.429 -5.759 1.00 0.00 N ATOM 1350 CA ALA B 68 2.146 -10.248 -6.945 1.00 0.00 C ATOM 1351 C ALA B 68 3.445 -10.757 -7.600 1.00 0.00 C ATOM 1352 O ALA B 68 3.520 -11.910 -8.024 1.00 0.00 O ATOM 1353 CB ALA B 68 1.296 -9.433 -7.929 1.00 0.00 C ATOM 0 H ALA B 68 2.116 -8.458 -5.867 1.00 0.00 H new ATOM 0 HA ALA B 68 1.596 -11.140 -6.644 1.00 0.00 H new ATOM 0 HB1 ALA B 68 1.093 -10.032 -8.817 1.00 0.00 H new ATOM 0 HB2 ALA B 68 0.354 -9.157 -7.454 1.00 0.00 H new ATOM 0 HB3 ALA B 68 1.836 -8.531 -8.216 1.00 0.00 H new ATOM 1359 N LEU B 69 4.503 -9.938 -7.607 1.00 0.00 N ATOM 1360 CA LEU B 69 5.822 -10.213 -8.185 1.00 0.00 C ATOM 1361 C LEU B 69 6.416 -11.514 -7.643 1.00 0.00 C ATOM 1362 O LEU B 69 6.979 -12.307 -8.394 1.00 0.00 O ATOM 1363 CB LEU B 69 6.741 -9.020 -7.867 1.00 0.00 C ATOM 1364 CG LEU B 69 7.249 -8.248 -9.091 1.00 0.00 C ATOM 1365 CD1 LEU B 69 6.147 -7.532 -9.870 1.00 0.00 C ATOM 1366 CD2 LEU B 69 8.220 -7.174 -8.606 1.00 0.00 C ATOM 0 H LEU B 69 4.458 -9.011 -7.184 1.00 0.00 H new ATOM 0 HA LEU B 69 5.725 -10.339 -9.263 1.00 0.00 H new ATOM 0 HB2 LEU B 69 6.203 -8.329 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU B 69 7.600 -9.383 -7.303 1.00 0.00 H new ATOM 0 HG LEU B 69 7.706 -8.981 -9.755 1.00 0.00 H new ATOM 0 HD11 LEU B 69 6.584 -7.009 -10.721 1.00 0.00 H new ATOM 0 HD12 LEU B 69 5.421 -8.262 -10.227 1.00 0.00 H new ATOM 0 HD13 LEU B 69 5.649 -6.814 -9.219 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.596 -6.611 -9.460 1.00 0.00 H new ATOM 0 HD22 LEU B 69 7.704 -6.498 -7.924 1.00 0.00 H new ATOM 0 HD23 LEU B 69 9.055 -7.646 -8.087 1.00 0.00 H new ATOM 1378 N ARG B 70 6.219 -11.753 -6.341 1.00 0.00 N ATOM 1379 CA ARG B 70 6.655 -12.947 -5.603 1.00 0.00 C ATOM 1380 C ARG B 70 6.057 -14.265 -6.127 1.00 0.00 C ATOM 1381 O ARG B 70 6.609 -15.330 -5.851 1.00 0.00 O ATOM 1382 CB ARG B 70 6.375 -12.765 -4.100 1.00 0.00 C ATOM 1383 CG ARG B 70 7.238 -11.650 -3.480 1.00 0.00 C ATOM 1384 CD ARG B 70 6.802 -11.281 -2.057 1.00 0.00 C ATOM 1385 NE ARG B 70 7.000 -12.394 -1.106 1.00 0.00 N ATOM 1386 CZ ARG B 70 6.087 -13.072 -0.430 1.00 0.00 C ATOM 1387 NH1 ARG B 70 4.811 -12.832 -0.546 1.00 0.00 N ATOM 1388 NH2 ARG B 70 6.446 -14.019 0.386 1.00 0.00 N ATOM 0 H ARG B 70 5.728 -11.088 -5.744 1.00 0.00 H new ATOM 0 HA ARG B 70 7.728 -13.039 -5.768 1.00 0.00 H new ATOM 0 HB2 ARG B 70 5.321 -12.530 -3.954 1.00 0.00 H new ATOM 0 HB3 ARG B 70 6.567 -13.703 -3.580 1.00 0.00 H new ATOM 0 HG2 ARG B 70 8.280 -11.970 -3.464 1.00 0.00 H new ATOM 0 HG3 ARG B 70 7.186 -10.763 -4.112 1.00 0.00 H new ATOM 0 HD2 ARG B 70 7.367 -10.412 -1.720 1.00 0.00 H new ATOM 0 HD3 ARG B 70 5.750 -10.994 -2.064 1.00 0.00 H new ATOM 0 HE ARG B 70 7.968 -12.677 -0.950 1.00 0.00 H new ATOM 0 HH11 ARG B 70 4.485 -12.099 -1.176 1.00 0.00 H new ATOM 0 HH12 ARG B 70 4.138 -13.377 -0.007 1.00 0.00 H new ATOM 0 HH21 ARG B 70 7.434 -14.241 0.506 1.00 0.00 H new ATOM 0 HH22 ARG B 70 5.739 -14.540 0.906 1.00 0.00 H new ATOM 1402 N LYS B 71 4.954 -14.201 -6.889 1.00 0.00 N ATOM 1403 CA LYS B 71 4.307 -15.327 -7.594 1.00 0.00 C ATOM 1404 C LYS B 71 4.499 -15.280 -9.122 1.00 0.00 C ATOM 1405 O LYS B 71 4.546 -16.336 -9.754 1.00 0.00 O ATOM 1406 CB LYS B 71 2.818 -15.408 -7.231 1.00 0.00 C ATOM 1407 CG LYS B 71 2.504 -16.159 -5.921 1.00 0.00 C ATOM 1408 CD LYS B 71 2.946 -15.480 -4.611 1.00 0.00 C ATOM 1409 CE LYS B 71 2.319 -14.098 -4.365 1.00 0.00 C ATOM 1410 NZ LYS B 71 0.853 -14.179 -4.124 1.00 0.00 N ATOM 0 H LYS B 71 4.462 -13.320 -7.040 1.00 0.00 H new ATOM 0 HA LYS B 71 4.807 -16.234 -7.253 1.00 0.00 H new ATOM 0 HB2 LYS B 71 2.423 -14.395 -7.155 1.00 0.00 H new ATOM 0 HB3 LYS B 71 2.287 -15.896 -8.048 1.00 0.00 H new ATOM 0 HG2 LYS B 71 1.428 -16.323 -5.873 1.00 0.00 H new ATOM 0 HG3 LYS B 71 2.974 -17.141 -5.971 1.00 0.00 H new ATOM 0 HD2 LYS B 71 2.694 -16.133 -3.775 1.00 0.00 H new ATOM 0 HD3 LYS B 71 4.031 -15.376 -4.619 1.00 0.00 H new ATOM 0 HE2 LYS B 71 2.801 -13.630 -3.507 1.00 0.00 H new ATOM 0 HE3 LYS B 71 2.509 -13.457 -5.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 0.474 -13.224 -3.963 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 0.388 -14.601 -4.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 0.671 -14.769 -3.287 1.00 0.00 H new