USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1063 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 7 TYR OH : rot -105:sc= -0.88! USER MOD Set 1.2: A 103 HIS : no HD1:sc= -3.68! C(o=-4.6!,f=-6.8!) USER MOD Set 2.1: A 94 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 98 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Set 3.1: A 34 TYR OH : rot 171:sc= 0.854 USER MOD Set 3.2: A 47 THR OG1 : rot -59:sc= 0.167 USER MOD Set 3.3: A 80 TYR OH : rot 90:sc= 0.0512 USER MOD Set 3.4: A 83 LYS NZ :NH3+ 127:sc= 0.398! (180deg=-1.75!) USER MOD Set 4.1: A 56 LYS NZ :NH3+ 149:sc= 0.0061 (180deg=0) USER MOD Set 4.2: A 61 LYS NZ :NH3+ -158:sc= 0.131 (180deg=0.071) USER MOD Set 5.1: A 54 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 58 HIS : no HE2:sc= -6.16! C(o=-6.2!,f=-6.8!) USER MOD Single : A 6 LYS NZ :NH3+ 152:sc= -0.178 (180deg=-0.685) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 98:sc= 1.33 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 58:sc= -1.32 USER MOD Single : A 38 SER OG : rot -71:sc= -0.013 USER MOD Single : A 49 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.23) USER MOD Single : A 60 SER OG : rot 174:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 68 CYS SG : rot -150:sc= -3.08! USER MOD Single : A 69 THR OG1 : rot 134:sc= 0.957 USER MOD Single : A 84 MET CE :methyl -153:sc= -0.0161 (180deg=-0.478) USER MOD Single : A 93 GLN : amide:sc= -7.56! C(o=-7.6!,f=-20!) USER MOD Single : A 99 LYS NZ :NH3+ -149:sc= -0.234 (180deg=-1.13!) USER MOD Single : A 101 SER OG : rot 120:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 153:sc= -0.0347 (180deg=-0.368) USER MOD Single : A 105 ASN : amide:sc= -2.56 K(o=-2.6,f=-3.2) USER MOD Single : A 108 SER OG : rot 48:sc= 1.17 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= -1.38 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.961 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 100:sc= -0.749! USER MOD Single : A 133 LYS NZ :NH3+ -157:sc= -0.152 (180deg=-0.621) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -2.604 13.130 3.683 1.00 0.00 N ATOM 22 CA LEU A 4 -2.842 12.043 2.739 1.00 0.00 C ATOM 23 C LEU A 4 -3.746 12.503 1.598 1.00 0.00 C ATOM 24 O LEU A 4 -3.685 11.971 0.490 1.00 0.00 O ATOM 25 CB LEU A 4 -3.466 10.839 3.450 1.00 0.00 C ATOM 26 CG LEU A 4 -2.501 9.691 3.757 1.00 0.00 C ATOM 27 CD1 LEU A 4 -3.259 8.487 4.299 1.00 0.00 C ATOM 28 CD2 LEU A 4 -1.713 9.307 2.512 1.00 0.00 C ATOM 0 HA LEU A 4 -1.881 11.744 2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.909 11.180 4.386 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -4.279 10.454 2.834 1.00 0.00 H new ATOM 0 HG LEU A 4 -1.798 10.028 4.519 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.557 7.681 4.512 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.779 8.767 5.215 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.985 8.150 3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -1.032 8.489 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.402 8.990 1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -1.140 10.167 2.165 1.00 0.00 H new ATOM 40 N ASP A 5 -4.582 13.501 1.877 1.00 0.00 N ATOM 41 CA ASP A 5 -5.493 14.038 0.873 1.00 0.00 C ATOM 42 C ASP A 5 -4.729 14.482 -0.370 1.00 0.00 C ATOM 43 O ASP A 5 -5.219 14.350 -1.492 1.00 0.00 O ATOM 44 CB ASP A 5 -6.283 15.213 1.449 1.00 0.00 C ATOM 45 CG ASP A 5 -7.499 14.764 2.235 1.00 0.00 C ATOM 46 OD1 ASP A 5 -7.362 14.521 3.453 1.00 0.00 O ATOM 47 OD2 ASP A 5 -8.588 14.655 1.635 1.00 0.00 O ATOM 0 H ASP A 5 -4.646 13.953 2.789 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.188 13.249 0.587 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -5.633 15.802 2.096 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -6.600 15.867 0.637 1.00 0.00 H new ATOM 52 N LYS A 6 -3.525 15.009 -0.164 1.00 0.00 N ATOM 53 CA LYS A 6 -2.695 15.471 -1.271 1.00 0.00 C ATOM 54 C LYS A 6 -1.941 14.312 -1.925 1.00 0.00 C ATOM 55 O LYS A 6 -1.290 14.490 -2.955 1.00 0.00 O ATOM 56 CB LYS A 6 -1.704 16.531 -0.787 1.00 0.00 C ATOM 57 CG LYS A 6 -0.657 15.995 0.176 1.00 0.00 C ATOM 58 CD LYS A 6 0.735 16.499 -0.173 1.00 0.00 C ATOM 59 CE LYS A 6 0.863 17.994 0.070 1.00 0.00 C ATOM 60 NZ LYS A 6 0.319 18.390 1.397 1.00 0.00 N ATOM 0 H LYS A 6 -3.104 15.126 0.757 1.00 0.00 H new ATOM 0 HA LYS A 6 -3.355 15.911 -2.019 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -1.201 16.967 -1.650 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.255 17.335 -0.300 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.909 16.296 1.193 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -0.666 14.905 0.155 1.00 0.00 H new ATOM 0 HD2 LYS A 6 1.476 15.967 0.424 1.00 0.00 H new ATOM 0 HD3 LYS A 6 0.951 16.279 -1.219 1.00 0.00 H new ATOM 0 HE2 LYS A 6 1.912 18.283 0.007 1.00 0.00 H new ATOM 0 HE3 LYS A 6 0.335 18.536 -0.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.812 19.241 1.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.698 18.591 1.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 0.462 17.615 2.076 1.00 0.00 H new ATOM 74 N TYR A 7 -2.027 13.125 -1.326 1.00 0.00 N ATOM 75 CA TYR A 7 -1.347 11.950 -1.860 1.00 0.00 C ATOM 76 C TYR A 7 -2.285 11.119 -2.732 1.00 0.00 C ATOM 77 O TYR A 7 -1.986 10.845 -3.893 1.00 0.00 O ATOM 78 CB TYR A 7 -0.801 11.088 -0.720 1.00 0.00 C ATOM 79 CG TYR A 7 0.409 11.682 -0.036 1.00 0.00 C ATOM 80 CD1 TYR A 7 0.275 12.726 0.870 1.00 0.00 C ATOM 81 CD2 TYR A 7 1.686 11.198 -0.295 1.00 0.00 C ATOM 82 CE1 TYR A 7 1.379 13.272 1.498 1.00 0.00 C ATOM 83 CE2 TYR A 7 2.793 11.738 0.329 1.00 0.00 C ATOM 84 CZ TYR A 7 2.635 12.774 1.224 1.00 0.00 C ATOM 85 OH TYR A 7 3.736 13.315 1.848 1.00 0.00 O ATOM 0 H TYR A 7 -2.560 12.954 -0.473 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.519 12.296 -2.478 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -1.588 10.937 0.019 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -0.540 10.105 -1.112 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.708 13.118 1.088 1.00 0.00 H new ATOM 0 HD2 TYR A 7 1.814 10.386 -0.996 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.258 14.084 2.199 1.00 0.00 H new ATOM 0 HE2 TYR A 7 3.778 11.350 0.117 1.00 0.00 H new ATOM 0 HH TYR A 7 4.227 13.878 1.214 1.00 0.00 H new ATOM 135 N ILE A 11 -10.749 10.399 -2.118 1.00 0.00 N ATOM 136 CA ILE A 11 -11.352 10.441 -3.444 1.00 0.00 C ATOM 137 C ILE A 11 -12.828 10.052 -3.384 1.00 0.00 C ATOM 138 O ILE A 11 -13.706 10.915 -3.377 1.00 0.00 O ATOM 139 CB ILE A 11 -10.605 9.510 -4.429 1.00 0.00 C ATOM 140 CG1 ILE A 11 -9.219 10.080 -4.741 1.00 0.00 C ATOM 141 CG2 ILE A 11 -11.405 9.317 -5.710 1.00 0.00 C ATOM 142 CD1 ILE A 11 -8.405 9.218 -5.682 1.00 0.00 C ATOM 0 HA ILE A 11 -11.271 11.466 -3.806 1.00 0.00 H new ATOM 0 HB ILE A 11 -10.487 8.534 -3.958 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.334 11.072 -5.178 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.669 10.205 -3.808 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.858 8.659 -6.385 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -12.371 8.871 -5.472 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -11.560 10.283 -6.191 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.436 9.685 -5.857 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.258 8.233 -5.238 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.934 9.114 -6.629 1.00 0.00 H new ATOM 154 N GLU A 12 -13.094 8.751 -3.340 1.00 0.00 N ATOM 155 CA GLU A 12 -14.463 8.255 -3.281 1.00 0.00 C ATOM 156 C GLU A 12 -14.528 6.923 -2.538 1.00 0.00 C ATOM 157 O GLU A 12 -14.866 6.879 -1.355 1.00 0.00 O ATOM 158 CB GLU A 12 -15.035 8.102 -4.693 1.00 0.00 C ATOM 159 CG GLU A 12 -16.058 9.167 -5.053 1.00 0.00 C ATOM 160 CD GLU A 12 -17.412 8.911 -4.421 1.00 0.00 C ATOM 161 OE1 GLU A 12 -18.217 8.168 -5.022 1.00 0.00 O ATOM 162 OE2 GLU A 12 -17.668 9.454 -3.326 1.00 0.00 O ATOM 0 H GLU A 12 -12.380 8.022 -3.344 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.064 8.981 -2.734 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.217 8.137 -5.413 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.498 7.119 -4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.690 10.142 -4.733 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.169 9.208 -6.137 1.00 0.00 H new ATOM 169 N LYS A 13 -14.201 5.840 -3.237 1.00 0.00 N ATOM 170 CA LYS A 13 -14.225 4.507 -2.632 1.00 0.00 C ATOM 171 C LYS A 13 -13.166 3.604 -3.256 1.00 0.00 C ATOM 172 O LYS A 13 -12.678 3.866 -4.355 1.00 0.00 O ATOM 173 CB LYS A 13 -15.607 3.872 -2.801 1.00 0.00 C ATOM 174 CG LYS A 13 -16.588 4.244 -1.700 1.00 0.00 C ATOM 175 CD LYS A 13 -17.992 4.438 -2.248 1.00 0.00 C ATOM 176 CE LYS A 13 -18.835 5.305 -1.325 1.00 0.00 C ATOM 177 NZ LYS A 13 -20.070 5.796 -1.998 1.00 0.00 N ATOM 0 H LYS A 13 -13.918 5.856 -4.217 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.006 4.617 -1.570 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.021 4.175 -3.763 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.498 2.788 -2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.598 3.462 -0.940 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -16.257 5.160 -1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.938 4.899 -3.234 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.471 3.467 -2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -19.108 4.733 -0.438 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.244 6.156 -0.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -20.616 6.383 -1.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.810 6.364 -2.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -20.647 4.985 -2.299 1.00 0.00 H new ATOM 191 N LEU A 14 -12.819 2.537 -2.544 1.00 0.00 N ATOM 192 CA LEU A 14 -11.820 1.586 -3.018 1.00 0.00 C ATOM 193 C LEU A 14 -12.465 0.243 -3.349 1.00 0.00 C ATOM 194 O LEU A 14 -13.601 -0.023 -2.956 1.00 0.00 O ATOM 195 CB LEU A 14 -10.729 1.396 -1.964 1.00 0.00 C ATOM 196 CG LEU A 14 -9.895 2.642 -1.663 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.019 2.415 -0.441 1.00 0.00 C ATOM 198 CD2 LEU A 14 -9.044 3.018 -2.867 1.00 0.00 C ATOM 0 H LEU A 14 -13.217 2.309 -1.633 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.371 1.987 -3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.194 1.057 -1.039 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.060 0.601 -2.295 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.574 3.467 -1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.433 3.312 -0.242 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.648 2.194 0.421 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.348 1.576 -0.625 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.457 3.907 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.373 2.194 -3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.691 3.223 -3.720 1.00 0.00 H new ATOM 210 N ARG A 15 -11.732 -0.603 -4.067 1.00 0.00 N ATOM 211 CA ARG A 15 -12.231 -1.914 -4.440 1.00 0.00 C ATOM 212 C ARG A 15 -11.846 -2.947 -3.403 1.00 0.00 C ATOM 213 O ARG A 15 -10.730 -3.467 -3.390 1.00 0.00 O ATOM 214 CB ARG A 15 -11.707 -2.348 -5.797 1.00 0.00 C ATOM 215 CG ARG A 15 -11.873 -1.304 -6.889 1.00 0.00 C ATOM 216 CD ARG A 15 -10.790 -1.430 -7.948 1.00 0.00 C ATOM 217 NE ARG A 15 -11.111 -2.455 -8.939 1.00 0.00 N ATOM 218 CZ ARG A 15 -12.128 -2.369 -9.794 1.00 0.00 C ATOM 219 NH1 ARG A 15 -12.927 -1.310 -9.781 1.00 0.00 N ATOM 220 NH2 ARG A 15 -12.347 -3.346 -10.663 1.00 0.00 N ATOM 0 H ARG A 15 -10.790 -0.400 -4.400 1.00 0.00 H new ATOM 0 HA ARG A 15 -13.317 -1.839 -4.496 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.650 -2.596 -5.704 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -12.223 -3.259 -6.099 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.853 -1.415 -7.354 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -11.839 -0.307 -6.449 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.658 -0.471 -8.448 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -9.841 -1.673 -7.469 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.521 -3.286 -8.978 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -12.764 -0.556 -9.114 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.705 -1.250 -10.438 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -11.737 -4.163 -10.676 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -13.126 -3.281 -11.318 1.00 0.00 H new ATOM 234 N ARG A 16 -12.792 -3.230 -2.545 1.00 0.00 N ATOM 235 CA ARG A 16 -12.611 -4.204 -1.475 1.00 0.00 C ATOM 236 C ARG A 16 -13.399 -5.478 -1.767 1.00 0.00 C ATOM 237 O ARG A 16 -14.290 -5.486 -2.616 1.00 0.00 O ATOM 238 CB ARG A 16 -13.052 -3.609 -0.135 1.00 0.00 C ATOM 239 CG ARG A 16 -12.874 -4.555 1.042 1.00 0.00 C ATOM 240 CD ARG A 16 -12.838 -3.803 2.363 1.00 0.00 C ATOM 241 NE ARG A 16 -13.737 -4.391 3.352 1.00 0.00 N ATOM 242 CZ ARG A 16 -13.505 -5.546 3.973 1.00 0.00 C ATOM 243 NH1 ARG A 16 -12.402 -6.237 3.712 1.00 0.00 N ATOM 244 NH2 ARG A 16 -14.375 -6.009 4.859 1.00 0.00 N ATOM 0 H ARG A 16 -13.715 -2.796 -2.560 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.552 -4.457 -1.418 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.483 -2.698 0.053 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.101 -3.321 -0.203 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.690 -5.277 1.056 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -11.950 -5.120 0.919 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.820 -3.804 2.753 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.115 -2.762 2.195 1.00 0.00 H new ATOM 0 HE ARG A 16 -14.594 -3.887 3.581 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -11.728 -5.884 3.033 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -12.229 -7.121 4.190 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -15.223 -5.481 5.066 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -14.197 -6.894 5.334 1.00 0.00 H new ATOM 258 N GLY A 17 -13.062 -6.556 -1.064 1.00 0.00 N ATOM 259 CA GLY A 17 -13.749 -7.820 -1.267 1.00 0.00 C ATOM 260 C GLY A 17 -15.259 -7.684 -1.200 1.00 0.00 C ATOM 261 O GLY A 17 -15.784 -6.967 -0.349 1.00 0.00 O ATOM 0 H GLY A 17 -12.326 -6.577 -0.358 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.468 -8.230 -2.237 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.419 -8.534 -0.512 1.00 0.00 H new ATOM 265 N ASP A 18 -15.954 -8.386 -2.092 1.00 0.00 N ATOM 266 CA ASP A 18 -17.409 -8.365 -2.145 1.00 0.00 C ATOM 267 C ASP A 18 -17.942 -7.003 -2.579 1.00 0.00 C ATOM 268 O ASP A 18 -18.702 -6.900 -3.542 1.00 0.00 O ATOM 269 CB ASP A 18 -17.962 -8.752 -0.785 1.00 0.00 C ATOM 270 CG ASP A 18 -19.338 -9.384 -0.870 1.00 0.00 C ATOM 271 OD1 ASP A 18 -20.062 -9.097 -1.847 1.00 0.00 O ATOM 272 OD2 ASP A 18 -19.691 -10.165 0.038 1.00 0.00 O ATOM 0 H ASP A 18 -15.522 -8.984 -2.797 1.00 0.00 H new ATOM 0 HA ASP A 18 -17.739 -9.085 -2.893 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.276 -9.449 -0.303 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -18.012 -7.866 -0.152 1.00 0.00 H new ATOM 277 N GLY A 19 -17.539 -5.965 -1.867 1.00 0.00 N ATOM 278 CA GLY A 19 -17.980 -4.620 -2.189 1.00 0.00 C ATOM 279 C GLY A 19 -16.937 -3.575 -1.849 1.00 0.00 C ATOM 280 O GLY A 19 -15.812 -3.909 -1.481 1.00 0.00 O ATOM 0 H GLY A 19 -16.910 -6.027 -1.066 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.216 -4.562 -3.252 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.900 -4.402 -1.646 1.00 0.00 H new ATOM 284 N GLU A 20 -17.309 -2.305 -1.974 1.00 0.00 N ATOM 285 CA GLU A 20 -16.394 -1.210 -1.677 1.00 0.00 C ATOM 286 C GLU A 20 -16.611 -0.687 -0.261 1.00 0.00 C ATOM 287 O GLU A 20 -17.679 -0.873 0.322 1.00 0.00 O ATOM 288 CB GLU A 20 -16.574 -0.081 -2.698 1.00 0.00 C ATOM 289 CG GLU A 20 -17.838 0.746 -2.498 1.00 0.00 C ATOM 290 CD GLU A 20 -19.071 0.077 -3.073 1.00 0.00 C ATOM 291 OE1 GLU A 20 -18.924 -0.724 -4.020 1.00 0.00 O ATOM 292 OE2 GLU A 20 -20.183 0.356 -2.577 1.00 0.00 O ATOM 0 H GLU A 20 -18.237 -2.010 -2.279 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.374 -1.587 -1.744 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.709 0.580 -2.648 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.589 -0.511 -3.700 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -17.988 0.921 -1.433 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -17.707 1.722 -2.966 1.00 0.00 H new ATOM 299 N VAL A 21 -15.593 -0.034 0.289 1.00 0.00 N ATOM 300 CA VAL A 21 -15.678 0.514 1.637 1.00 0.00 C ATOM 301 C VAL A 21 -15.435 2.018 1.635 1.00 0.00 C ATOM 302 O VAL A 21 -14.544 2.513 0.945 1.00 0.00 O ATOM 303 CB VAL A 21 -14.666 -0.156 2.584 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.142 -1.545 2.980 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.290 -0.219 1.939 1.00 0.00 C ATOM 0 H VAL A 21 -14.701 0.128 -0.177 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.687 0.311 1.996 1.00 0.00 H new ATOM 0 HB VAL A 21 -14.590 0.447 3.489 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.413 -2.002 3.649 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.104 -1.469 3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.251 -2.161 2.087 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.589 -0.696 2.624 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.347 -0.797 1.017 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.947 0.791 1.714 1.00 0.00 H new ATOM 315 N GLU A 22 -16.233 2.741 2.413 1.00 0.00 N ATOM 316 CA GLU A 22 -16.105 4.190 2.502 1.00 0.00 C ATOM 317 C GLU A 22 -14.705 4.585 2.961 1.00 0.00 C ATOM 318 O GLU A 22 -14.158 3.996 3.893 1.00 0.00 O ATOM 319 CB GLU A 22 -17.149 4.758 3.466 1.00 0.00 C ATOM 320 CG GLU A 22 -18.475 5.087 2.800 1.00 0.00 C ATOM 321 CD GLU A 22 -19.136 6.318 3.391 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.418 7.302 3.668 1.00 0.00 O ATOM 323 OE2 GLU A 22 -20.370 6.297 3.580 1.00 0.00 O ATOM 0 H GLU A 22 -16.975 2.347 2.991 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.274 4.606 1.509 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.322 4.038 4.266 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.751 5.661 3.930 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.313 5.243 1.734 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -19.148 4.235 2.899 1.00 0.00 H new ATOM 330 N VAL A 23 -14.131 5.584 2.300 1.00 0.00 N ATOM 331 CA VAL A 23 -12.795 6.060 2.638 1.00 0.00 C ATOM 332 C VAL A 23 -12.712 6.465 4.109 1.00 0.00 C ATOM 333 O VAL A 23 -11.647 6.401 4.723 1.00 0.00 O ATOM 334 CB VAL A 23 -12.391 7.255 1.750 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.058 7.837 2.199 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.332 6.837 0.288 1.00 0.00 C ATOM 0 H VAL A 23 -14.571 6.081 1.525 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.103 5.237 2.459 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.150 8.031 1.855 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.794 8.678 1.558 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.139 8.178 3.231 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.285 7.072 2.130 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.046 7.692 -0.324 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.597 6.041 0.166 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.311 6.477 -0.027 1.00 0.00 H new ATOM 346 N LYS A 24 -13.844 6.882 4.665 1.00 0.00 N ATOM 347 CA LYS A 24 -13.914 7.300 6.062 1.00 0.00 C ATOM 348 C LYS A 24 -13.321 6.241 6.990 1.00 0.00 C ATOM 349 O LYS A 24 -12.836 6.558 8.077 1.00 0.00 O ATOM 350 CB LYS A 24 -15.364 7.584 6.458 1.00 0.00 C ATOM 351 CG LYS A 24 -15.934 8.840 5.817 1.00 0.00 C ATOM 352 CD LYS A 24 -15.391 10.097 6.477 1.00 0.00 C ATOM 353 CE LYS A 24 -14.103 10.561 5.817 1.00 0.00 C ATOM 354 NZ LYS A 24 -14.023 12.046 5.737 1.00 0.00 N ATOM 0 H LYS A 24 -14.732 6.940 4.166 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.326 8.212 6.166 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.982 6.731 6.179 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.424 7.680 7.542 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.690 8.851 4.755 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -17.021 8.828 5.894 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.136 10.890 6.420 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -15.210 9.905 7.535 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -13.250 10.181 6.379 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -14.037 10.139 4.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.130 12.321 5.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -14.823 12.407 5.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.060 12.448 6.696 1.00 0.00 H new ATOM 368 N SER A 25 -13.368 4.984 6.561 1.00 0.00 N ATOM 369 CA SER A 25 -12.840 3.882 7.361 1.00 0.00 C ATOM 370 C SER A 25 -11.347 4.058 7.634 1.00 0.00 C ATOM 371 O SER A 25 -10.800 3.442 8.549 1.00 0.00 O ATOM 372 CB SER A 25 -13.086 2.549 6.652 1.00 0.00 C ATOM 373 OG SER A 25 -14.365 2.524 6.041 1.00 0.00 O ATOM 0 H SER A 25 -13.766 4.702 5.665 1.00 0.00 H new ATOM 0 HA SER A 25 -13.363 3.884 8.318 1.00 0.00 H new ATOM 0 HB2 SER A 25 -12.316 2.387 5.898 1.00 0.00 H new ATOM 0 HB3 SER A 25 -13.006 1.732 7.369 1.00 0.00 H new ATOM 0 HG SER A 25 -14.278 2.747 5.091 1.00 0.00 H new ATOM 379 N LEU A 26 -10.691 4.903 6.843 1.00 0.00 N ATOM 380 CA LEU A 26 -9.266 5.161 7.013 1.00 0.00 C ATOM 381 C LEU A 26 -9.054 6.465 7.772 1.00 0.00 C ATOM 382 O LEU A 26 -8.192 7.269 7.421 1.00 0.00 O ATOM 383 CB LEU A 26 -8.561 5.226 5.652 1.00 0.00 C ATOM 384 CG LEU A 26 -8.908 4.102 4.669 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.840 3.991 3.592 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.071 2.775 5.395 1.00 0.00 C ATOM 0 H LEU A 26 -11.125 5.420 6.078 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.836 4.341 7.588 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.802 6.180 5.184 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.484 5.217 5.821 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.858 4.347 4.194 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.101 3.189 2.902 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.775 4.932 3.046 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.878 3.773 4.055 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.317 1.994 4.675 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.140 2.521 5.902 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.873 2.858 6.129 1.00 0.00 H new ATOM 398 N ALA A 27 -9.854 6.666 8.811 1.00 0.00 N ATOM 399 CA ALA A 27 -9.776 7.858 9.623 1.00 0.00 C ATOM 400 C ALA A 27 -9.065 7.583 10.930 1.00 0.00 C ATOM 401 O ALA A 27 -9.681 7.319 11.963 1.00 0.00 O ATOM 402 CB ALA A 27 -11.154 8.389 9.889 1.00 0.00 C ATOM 0 H ALA A 27 -10.571 6.005 9.108 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.201 8.605 9.075 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.086 9.288 10.502 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.640 8.631 8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.739 7.635 10.415 1.00 0.00 H new ATOM 408 N GLY A 28 -7.767 7.660 10.853 1.00 0.00 N ATOM 409 CA GLY A 28 -6.918 7.435 12.010 1.00 0.00 C ATOM 410 C GLY A 28 -6.358 6.028 12.074 1.00 0.00 C ATOM 411 O GLY A 28 -6.536 5.325 13.069 1.00 0.00 O ATOM 0 H GLY A 28 -7.260 7.879 9.995 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.093 8.147 11.991 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.490 7.633 12.917 1.00 0.00 H new ATOM 415 N LYS A 29 -5.671 5.618 11.012 1.00 0.00 N ATOM 416 CA LYS A 29 -5.072 4.292 10.953 1.00 0.00 C ATOM 417 C LYS A 29 -3.845 4.293 10.044 1.00 0.00 C ATOM 418 O LYS A 29 -3.627 5.237 9.284 1.00 0.00 O ATOM 419 CB LYS A 29 -6.105 3.267 10.472 1.00 0.00 C ATOM 420 CG LYS A 29 -6.323 3.249 8.964 1.00 0.00 C ATOM 421 CD LYS A 29 -6.979 1.950 8.518 1.00 0.00 C ATOM 422 CE LYS A 29 -8.485 1.984 8.724 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.964 0.816 9.514 1.00 0.00 N ATOM 0 H LYS A 29 -5.516 6.187 10.180 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.747 4.012 11.955 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.789 2.274 10.793 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -7.057 3.472 10.962 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.948 4.093 8.674 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.367 3.370 8.454 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.759 1.773 7.465 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.554 1.116 9.077 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.761 2.906 9.236 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.984 1.996 7.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.995 0.876 9.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.724 -0.064 9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.508 0.818 10.449 1.00 0.00 H new ATOM 437 N LEU A 30 -3.048 3.233 10.124 1.00 0.00 N ATOM 438 CA LEU A 30 -1.847 3.120 9.304 1.00 0.00 C ATOM 439 C LEU A 30 -2.141 2.361 8.016 1.00 0.00 C ATOM 440 O LEU A 30 -2.051 1.134 7.970 1.00 0.00 O ATOM 441 CB LEU A 30 -0.732 2.420 10.085 1.00 0.00 C ATOM 442 CG LEU A 30 0.661 2.530 9.464 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.169 3.961 9.544 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.627 1.580 10.155 1.00 0.00 C ATOM 0 H LEU A 30 -3.211 2.442 10.747 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.517 4.126 9.044 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.698 2.836 11.092 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.986 1.365 10.185 1.00 0.00 H new ATOM 0 HG LEU A 30 0.594 2.249 8.413 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.162 4.020 9.097 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.488 4.619 9.004 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.222 4.271 10.588 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.614 1.671 9.701 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.690 1.832 11.214 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.270 0.556 10.046 1.00 0.00 H new ATOM 456 N VAL A 31 -2.497 3.101 6.970 1.00 0.00 N ATOM 457 CA VAL A 31 -2.810 2.500 5.678 1.00 0.00 C ATOM 458 C VAL A 31 -1.556 2.339 4.825 1.00 0.00 C ATOM 459 O VAL A 31 -0.899 3.319 4.478 1.00 0.00 O ATOM 460 CB VAL A 31 -3.837 3.342 4.899 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.351 2.575 3.690 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.988 3.758 5.806 1.00 0.00 C ATOM 0 H VAL A 31 -2.576 4.118 6.992 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.236 1.518 5.885 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.342 4.245 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -5.076 3.186 3.152 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.517 2.335 3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.829 1.653 4.020 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.703 4.352 5.237 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.484 2.869 6.196 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.602 4.351 6.635 1.00 0.00 H new ATOM 472 N PHE A 32 -1.234 1.097 4.486 1.00 0.00 N ATOM 473 CA PHE A 32 -0.062 0.808 3.669 1.00 0.00 C ATOM 474 C PHE A 32 -0.420 0.862 2.186 1.00 0.00 C ATOM 475 O PHE A 32 -1.568 0.632 1.811 1.00 0.00 O ATOM 476 CB PHE A 32 0.517 -0.557 4.046 1.00 0.00 C ATOM 477 CG PHE A 32 1.356 -0.511 5.291 1.00 0.00 C ATOM 478 CD1 PHE A 32 0.759 -0.436 6.539 1.00 0.00 C ATOM 479 CD2 PHE A 32 2.740 -0.529 5.214 1.00 0.00 C ATOM 480 CE1 PHE A 32 1.525 -0.385 7.687 1.00 0.00 C ATOM 481 CE2 PHE A 32 3.512 -0.476 6.360 1.00 0.00 C ATOM 482 CZ PHE A 32 2.904 -0.403 7.598 1.00 0.00 C ATOM 0 H PHE A 32 -1.768 0.274 4.764 1.00 0.00 H new ATOM 0 HA PHE A 32 0.698 1.566 3.858 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.299 -1.265 4.190 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.122 -0.931 3.220 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -0.318 -0.417 6.615 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.221 -0.585 4.248 1.00 0.00 H new ATOM 0 HE1 PHE A 32 1.047 -0.331 8.654 1.00 0.00 H new ATOM 0 HE2 PHE A 32 4.589 -0.492 6.287 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.505 -0.360 8.494 1.00 0.00 H new ATOM 492 N PHE A 33 0.565 1.179 1.347 1.00 0.00 N ATOM 493 CA PHE A 33 0.342 1.279 -0.087 1.00 0.00 C ATOM 494 C PHE A 33 1.376 0.472 -0.859 1.00 0.00 C ATOM 495 O PHE A 33 2.538 0.863 -0.966 1.00 0.00 O ATOM 496 CB PHE A 33 0.393 2.743 -0.539 1.00 0.00 C ATOM 497 CG PHE A 33 -0.582 3.642 0.172 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.822 3.171 0.573 1.00 0.00 C ATOM 499 CD2 PHE A 33 -0.254 4.962 0.438 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.717 3.999 1.223 1.00 0.00 C ATOM 501 CE2 PHE A 33 -1.145 5.796 1.087 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.379 5.313 1.481 1.00 0.00 C ATOM 0 H PHE A 33 1.523 1.370 1.639 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.647 0.872 -0.297 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.402 3.125 -0.383 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.197 2.788 -1.610 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.092 2.144 0.375 1.00 0.00 H new ATOM 0 HD2 PHE A 33 0.710 5.344 0.134 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.680 3.619 1.529 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -0.878 6.823 1.286 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.077 5.962 1.989 1.00 0.00 H new ATOM 512 N TYR A 34 0.934 -0.649 -1.402 1.00 0.00 N ATOM 513 CA TYR A 34 1.801 -1.525 -2.180 1.00 0.00 C ATOM 514 C TYR A 34 1.719 -1.174 -3.665 1.00 0.00 C ATOM 515 O TYR A 34 0.634 -1.137 -4.245 1.00 0.00 O ATOM 516 CB TYR A 34 1.401 -2.985 -1.965 1.00 0.00 C ATOM 517 CG TYR A 34 2.416 -3.978 -2.482 1.00 0.00 C ATOM 518 CD1 TYR A 34 2.559 -4.209 -3.844 1.00 0.00 C ATOM 519 CD2 TYR A 34 3.229 -4.688 -1.607 1.00 0.00 C ATOM 520 CE1 TYR A 34 3.482 -5.120 -4.320 1.00 0.00 C ATOM 521 CE2 TYR A 34 4.155 -5.599 -2.075 1.00 0.00 C ATOM 522 CZ TYR A 34 4.279 -5.812 -3.432 1.00 0.00 C ATOM 523 OH TYR A 34 5.200 -6.722 -3.901 1.00 0.00 O ATOM 0 H TYR A 34 -0.028 -0.978 -1.319 1.00 0.00 H new ATOM 0 HA TYR A 34 2.828 -1.385 -1.844 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.248 -3.157 -0.900 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.446 -3.167 -2.457 1.00 0.00 H new ATOM 0 HD1 TYR A 34 1.938 -3.667 -4.543 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.135 -4.525 -0.544 1.00 0.00 H new ATOM 0 HE1 TYR A 34 3.579 -5.290 -5.382 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.780 -6.142 -1.381 1.00 0.00 H new ATOM 0 HH TYR A 34 5.779 -7.011 -3.165 1.00 0.00 H new ATOM 533 N PHE A 35 2.873 -0.908 -4.272 1.00 0.00 N ATOM 534 CA PHE A 35 2.932 -0.552 -5.686 1.00 0.00 C ATOM 535 C PHE A 35 3.447 -1.723 -6.520 1.00 0.00 C ATOM 536 O PHE A 35 4.421 -2.377 -6.146 1.00 0.00 O ATOM 537 CB PHE A 35 3.834 0.673 -5.887 1.00 0.00 C ATOM 538 CG PHE A 35 3.464 1.852 -5.026 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.554 1.782 -3.645 1.00 0.00 C ATOM 540 CD2 PHE A 35 3.025 3.034 -5.603 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.214 2.866 -2.857 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.683 4.120 -4.821 1.00 0.00 C ATOM 543 CZ PHE A 35 2.777 4.036 -3.446 1.00 0.00 C ATOM 0 H PHE A 35 3.780 -0.932 -3.806 1.00 0.00 H new ATOM 0 HA PHE A 35 1.923 -0.310 -6.019 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.865 0.391 -5.676 1.00 0.00 H new ATOM 0 HB3 PHE A 35 3.794 0.974 -6.934 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.894 0.869 -3.178 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.949 3.106 -6.678 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.290 2.798 -1.782 1.00 0.00 H new ATOM 0 HE2 PHE A 35 2.342 5.034 -5.285 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.509 4.884 -2.832 1.00 0.00 H new ATOM 553 N SER A 36 2.791 -1.991 -7.652 1.00 0.00 N ATOM 554 CA SER A 36 3.201 -3.090 -8.520 1.00 0.00 C ATOM 555 C SER A 36 2.392 -3.105 -9.812 1.00 0.00 C ATOM 556 O SER A 36 1.335 -2.483 -9.905 1.00 0.00 O ATOM 557 CB SER A 36 3.043 -4.425 -7.790 1.00 0.00 C ATOM 558 OG SER A 36 4.306 -4.973 -7.456 1.00 0.00 O ATOM 0 H SER A 36 1.982 -1.466 -7.984 1.00 0.00 H new ATOM 0 HA SER A 36 4.250 -2.942 -8.777 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.454 -4.281 -6.884 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.494 -5.125 -8.419 1.00 0.00 H new ATOM 0 HG SER A 36 4.801 -4.338 -6.897 1.00 0.00 H new ATOM 564 N ALA A 37 2.899 -3.829 -10.804 1.00 0.00 N ATOM 565 CA ALA A 37 2.232 -3.940 -12.096 1.00 0.00 C ATOM 566 C ALA A 37 2.164 -5.398 -12.541 1.00 0.00 C ATOM 567 O ALA A 37 2.810 -6.261 -11.951 1.00 0.00 O ATOM 568 CB ALA A 37 2.960 -3.094 -13.132 1.00 0.00 C ATOM 0 H ALA A 37 3.773 -4.350 -10.737 1.00 0.00 H new ATOM 0 HA ALA A 37 1.212 -3.569 -11.998 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.455 -3.183 -14.094 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.958 -2.051 -12.816 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.988 -3.442 -13.228 1.00 0.00 H new ATOM 574 N SER A 38 1.375 -5.672 -13.576 1.00 0.00 N ATOM 575 CA SER A 38 1.231 -7.032 -14.084 1.00 0.00 C ATOM 576 C SER A 38 2.265 -7.341 -15.169 1.00 0.00 C ATOM 577 O SER A 38 2.248 -8.422 -15.758 1.00 0.00 O ATOM 578 CB SER A 38 -0.179 -7.241 -14.638 1.00 0.00 C ATOM 579 OG SER A 38 -0.284 -6.747 -15.962 1.00 0.00 O ATOM 0 H SER A 38 0.827 -4.973 -14.078 1.00 0.00 H new ATOM 0 HA SER A 38 1.401 -7.715 -13.252 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.426 -8.302 -14.622 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.903 -6.735 -13.999 1.00 0.00 H new ATOM 0 HG SER A 38 -0.263 -5.767 -15.948 1.00 0.00 H new ATOM 585 N TRP A 39 3.160 -6.391 -15.437 1.00 0.00 N ATOM 586 CA TRP A 39 4.184 -6.579 -16.458 1.00 0.00 C ATOM 587 C TRP A 39 5.595 -6.458 -15.877 1.00 0.00 C ATOM 588 O TRP A 39 6.581 -6.652 -16.590 1.00 0.00 O ATOM 589 CB TRP A 39 3.992 -5.559 -17.581 1.00 0.00 C ATOM 590 CG TRP A 39 4.278 -4.146 -17.166 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.549 -3.383 -16.300 1.00 0.00 C ATOM 592 CD2 TRP A 39 5.371 -3.328 -17.600 1.00 0.00 C ATOM 593 NE1 TRP A 39 4.120 -2.141 -16.172 1.00 0.00 N ATOM 594 CE2 TRP A 39 5.240 -2.083 -16.959 1.00 0.00 C ATOM 595 CE3 TRP A 39 6.447 -3.529 -18.470 1.00 0.00 C ATOM 596 CZ2 TRP A 39 6.145 -1.043 -17.160 1.00 0.00 C ATOM 597 CZ3 TRP A 39 7.345 -2.496 -18.667 1.00 0.00 C ATOM 598 CH2 TRP A 39 7.189 -1.267 -18.014 1.00 0.00 C ATOM 0 H TRP A 39 3.195 -5.489 -14.963 1.00 0.00 H new ATOM 0 HA TRP A 39 4.076 -7.588 -16.856 1.00 0.00 H new ATOM 0 HB2 TRP A 39 4.643 -5.823 -18.415 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.967 -5.621 -17.945 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.654 -3.709 -15.790 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.768 -1.384 -15.586 1.00 0.00 H new ATOM 0 HE3 TRP A 39 6.574 -4.473 -18.979 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.026 -0.094 -16.659 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 8.181 -2.639 -19.336 1.00 0.00 H new ATOM 0 HH2 TRP A 39 7.908 -0.480 -18.189 1.00 0.00 H new ATOM 609 N CYS A 40 5.693 -6.133 -14.590 1.00 0.00 N ATOM 610 CA CYS A 40 6.992 -5.988 -13.940 1.00 0.00 C ATOM 611 C CYS A 40 7.810 -7.279 -14.045 1.00 0.00 C ATOM 612 O CYS A 40 7.253 -8.365 -14.211 1.00 0.00 O ATOM 613 CB CYS A 40 6.812 -5.559 -12.478 1.00 0.00 C ATOM 614 SG CYS A 40 6.300 -6.881 -11.330 1.00 0.00 S ATOM 0 H CYS A 40 4.893 -5.966 -13.980 1.00 0.00 H new ATOM 0 HA CYS A 40 7.550 -5.207 -14.457 1.00 0.00 H new ATOM 0 HB2 CYS A 40 7.752 -5.137 -12.123 1.00 0.00 H new ATOM 0 HB3 CYS A 40 6.070 -4.761 -12.440 1.00 0.00 H new ATOM 619 N PRO A 41 9.153 -7.172 -13.978 1.00 0.00 N ATOM 620 CA PRO A 41 10.049 -8.332 -14.094 1.00 0.00 C ATOM 621 C PRO A 41 9.783 -9.415 -13.048 1.00 0.00 C ATOM 622 O PRO A 41 9.614 -10.584 -13.397 1.00 0.00 O ATOM 623 CB PRO A 41 11.452 -7.739 -13.922 1.00 0.00 C ATOM 624 CG PRO A 41 11.300 -6.284 -14.216 1.00 0.00 C ATOM 625 CD PRO A 41 9.900 -5.914 -13.810 1.00 0.00 C ATOM 0 HA PRO A 41 9.905 -8.841 -15.047 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.826 -7.900 -12.911 1.00 0.00 H new ATOM 0 HB3 PRO A 41 12.163 -8.206 -14.603 1.00 0.00 H new ATOM 0 HG2 PRO A 41 12.033 -5.697 -13.663 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.464 -6.082 -15.275 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.861 -5.558 -12.781 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.496 -5.120 -14.438 1.00 0.00 H new ATOM 633 N PRO A 42 9.732 -9.060 -11.750 1.00 0.00 N ATOM 634 CA PRO A 42 9.475 -10.032 -10.685 1.00 0.00 C ATOM 635 C PRO A 42 8.009 -10.442 -10.660 1.00 0.00 C ATOM 636 O PRO A 42 7.656 -11.568 -11.012 1.00 0.00 O ATOM 637 CB PRO A 42 9.849 -9.283 -9.393 1.00 0.00 C ATOM 638 CG PRO A 42 10.437 -7.977 -9.830 1.00 0.00 C ATOM 639 CD PRO A 42 9.901 -7.708 -11.206 1.00 0.00 C ATOM 0 HA PRO A 42 10.044 -10.952 -10.819 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.972 -9.126 -8.765 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.565 -9.856 -8.803 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.160 -7.178 -9.143 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.526 -8.026 -9.840 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.958 -7.162 -11.175 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.593 -7.114 -11.802 1.00 0.00 H new ATOM 647 N CYS A 43 7.161 -9.500 -10.269 1.00 0.00 N ATOM 648 CA CYS A 43 5.712 -9.726 -10.225 1.00 0.00 C ATOM 649 C CYS A 43 5.374 -11.058 -9.557 1.00 0.00 C ATOM 650 O CYS A 43 4.346 -11.665 -9.854 1.00 0.00 O ATOM 651 CB CYS A 43 5.169 -9.704 -11.652 1.00 0.00 C ATOM 652 SG CYS A 43 5.004 -8.037 -12.386 1.00 0.00 S ATOM 0 H CYS A 43 7.448 -8.566 -9.975 1.00 0.00 H new ATOM 0 HA CYS A 43 5.251 -8.936 -9.633 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.826 -10.301 -12.285 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.192 -10.188 -11.661 1.00 0.00 H new ATOM 657 N ARG A 44 6.242 -11.504 -8.652 1.00 0.00 N ATOM 658 CA ARG A 44 6.032 -12.762 -7.941 1.00 0.00 C ATOM 659 C ARG A 44 7.204 -13.066 -7.012 1.00 0.00 C ATOM 660 O ARG A 44 8.206 -13.643 -7.434 1.00 0.00 O ATOM 661 CB ARG A 44 5.847 -13.915 -8.933 1.00 0.00 C ATOM 662 CG ARG A 44 5.652 -15.268 -8.266 1.00 0.00 C ATOM 663 CD ARG A 44 6.553 -16.329 -8.877 1.00 0.00 C ATOM 664 NE ARG A 44 6.531 -16.291 -10.338 1.00 0.00 N ATOM 665 CZ ARG A 44 5.543 -16.790 -11.077 1.00 0.00 C ATOM 666 NH1 ARG A 44 4.495 -17.364 -10.498 1.00 0.00 N ATOM 667 NH2 ARG A 44 5.601 -16.713 -12.400 1.00 0.00 N ATOM 0 H ARG A 44 7.098 -11.012 -8.394 1.00 0.00 H new ATOM 0 HA ARG A 44 5.128 -12.659 -7.340 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.985 -13.704 -9.566 1.00 0.00 H new ATOM 0 HB3 ARG A 44 6.718 -13.964 -9.587 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.862 -15.182 -7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.611 -15.575 -8.362 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.575 -16.183 -8.526 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.236 -17.314 -8.535 1.00 0.00 H new ATOM 0 HE ARG A 44 7.319 -15.857 -10.819 1.00 0.00 H new ATOM 0 HH11 ARG A 44 4.444 -17.424 -9.481 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.741 -17.744 -11.070 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.403 -16.272 -12.851 1.00 0.00 H new ATOM 0 HH22 ARG A 44 4.844 -17.095 -12.967 1.00 0.00 H new ATOM 681 N GLY A 45 7.071 -12.681 -5.746 1.00 0.00 N ATOM 682 CA GLY A 45 8.131 -12.933 -4.786 1.00 0.00 C ATOM 683 C GLY A 45 8.228 -11.866 -3.711 1.00 0.00 C ATOM 684 O GLY A 45 9.328 -11.485 -3.310 1.00 0.00 O ATOM 0 H GLY A 45 6.253 -12.202 -5.369 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.963 -13.901 -4.314 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.083 -12.996 -5.313 1.00 0.00 H new ATOM 688 N PHE A 46 7.081 -11.388 -3.234 1.00 0.00 N ATOM 689 CA PHE A 46 7.055 -10.365 -2.191 1.00 0.00 C ATOM 690 C PHE A 46 5.628 -9.901 -1.897 1.00 0.00 C ATOM 691 O PHE A 46 5.198 -9.886 -0.744 1.00 0.00 O ATOM 692 CB PHE A 46 7.917 -9.162 -2.592 1.00 0.00 C ATOM 693 CG PHE A 46 7.686 -7.952 -1.730 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.721 -8.058 -0.350 1.00 0.00 C ATOM 695 CD2 PHE A 46 7.422 -6.717 -2.299 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.496 -6.953 0.448 1.00 0.00 C ATOM 697 CE2 PHE A 46 7.198 -5.608 -1.506 1.00 0.00 C ATOM 698 CZ PHE A 46 7.234 -5.727 -0.129 1.00 0.00 C ATOM 0 H PHE A 46 6.160 -11.691 -3.552 1.00 0.00 H new ATOM 0 HA PHE A 46 7.464 -10.814 -1.285 1.00 0.00 H new ATOM 0 HB2 PHE A 46 8.969 -9.443 -2.538 1.00 0.00 H new ATOM 0 HB3 PHE A 46 7.709 -8.905 -3.631 1.00 0.00 H new ATOM 0 HD1 PHE A 46 7.926 -9.015 0.107 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.391 -6.620 -3.374 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.525 -7.049 1.523 1.00 0.00 H new ATOM 0 HE2 PHE A 46 6.995 -4.650 -1.961 1.00 0.00 H new ATOM 0 HZ PHE A 46 7.057 -4.862 0.494 1.00 0.00 H new ATOM 708 N THR A 47 4.910 -9.500 -2.942 1.00 0.00 N ATOM 709 CA THR A 47 3.539 -9.009 -2.800 1.00 0.00 C ATOM 710 C THR A 47 2.729 -9.833 -1.796 1.00 0.00 C ATOM 711 O THR A 47 2.136 -9.282 -0.869 1.00 0.00 O ATOM 712 CB THR A 47 2.832 -9.005 -4.157 1.00 0.00 C ATOM 713 OG1 THR A 47 3.767 -9.147 -5.211 1.00 0.00 O ATOM 714 CG2 THR A 47 2.042 -7.739 -4.411 1.00 0.00 C ATOM 0 H THR A 47 5.255 -9.505 -3.902 1.00 0.00 H new ATOM 0 HA THR A 47 3.602 -7.991 -2.417 1.00 0.00 H new ATOM 0 HB THR A 47 2.142 -9.848 -4.128 1.00 0.00 H new ATOM 0 HG1 THR A 47 4.409 -8.407 -5.181 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.565 -7.798 -5.389 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.279 -7.626 -3.641 1.00 0.00 H new ATOM 0 HG23 THR A 47 2.713 -6.880 -4.386 1.00 0.00 H new ATOM 722 N PRO A 48 2.683 -11.164 -1.970 1.00 0.00 N ATOM 723 CA PRO A 48 1.930 -12.047 -1.080 1.00 0.00 C ATOM 724 C PRO A 48 2.655 -12.349 0.232 1.00 0.00 C ATOM 725 O PRO A 48 2.162 -13.123 1.053 1.00 0.00 O ATOM 726 CB PRO A 48 1.780 -13.320 -1.909 1.00 0.00 C ATOM 727 CG PRO A 48 2.995 -13.350 -2.771 1.00 0.00 C ATOM 728 CD PRO A 48 3.348 -11.912 -3.056 1.00 0.00 C ATOM 0 HA PRO A 48 0.988 -11.595 -0.770 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.723 -14.203 -1.273 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.869 -13.299 -2.508 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.816 -13.859 -2.267 1.00 0.00 H new ATOM 0 HG3 PRO A 48 2.802 -13.894 -3.696 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.427 -11.756 -3.047 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.988 -11.599 -4.036 1.00 0.00 H new ATOM 736 N GLN A 49 3.821 -11.741 0.433 1.00 0.00 N ATOM 737 CA GLN A 49 4.590 -11.960 1.652 1.00 0.00 C ATOM 738 C GLN A 49 4.006 -11.169 2.816 1.00 0.00 C ATOM 739 O GLN A 49 4.119 -11.575 3.973 1.00 0.00 O ATOM 740 CB GLN A 49 6.055 -11.574 1.446 1.00 0.00 C ATOM 741 CG GLN A 49 6.779 -12.444 0.433 1.00 0.00 C ATOM 742 CD GLN A 49 6.668 -13.923 0.748 1.00 0.00 C ATOM 743 OE1 GLN A 49 6.182 -14.708 -0.067 1.00 0.00 O ATOM 744 NE2 GLN A 49 7.117 -14.311 1.936 1.00 0.00 N ATOM 0 H GLN A 49 4.251 -11.096 -0.230 1.00 0.00 H new ATOM 0 HA GLN A 49 4.535 -13.022 1.890 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.105 -10.535 1.121 1.00 0.00 H new ATOM 0 HB3 GLN A 49 6.575 -11.635 2.402 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.370 -12.256 -0.560 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.831 -12.161 0.403 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.512 -13.626 2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.067 -15.294 2.204 1.00 0.00 H new ATOM 753 N LEU A 50 3.396 -10.031 2.505 1.00 0.00 N ATOM 754 CA LEU A 50 2.814 -9.174 3.516 1.00 0.00 C ATOM 755 C LEU A 50 1.469 -9.714 4.005 1.00 0.00 C ATOM 756 O LEU A 50 1.057 -9.423 5.129 1.00 0.00 O ATOM 757 CB LEU A 50 2.746 -7.739 2.979 1.00 0.00 C ATOM 758 CG LEU A 50 1.384 -7.037 2.969 1.00 0.00 C ATOM 759 CD1 LEU A 50 1.227 -6.150 4.193 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.257 -6.230 1.688 1.00 0.00 C ATOM 0 H LEU A 50 3.294 -9.684 1.551 1.00 0.00 H new ATOM 0 HA LEU A 50 3.448 -9.163 4.402 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.431 -7.129 3.568 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.125 -7.747 1.957 1.00 0.00 H new ATOM 0 HG LEU A 50 0.588 -7.781 3.004 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.253 -5.661 4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.303 -6.758 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.012 -5.394 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.291 -5.726 1.670 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.054 -5.488 1.645 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.335 -6.896 0.829 1.00 0.00 H new ATOM 772 N ILE A 51 0.783 -10.506 3.173 1.00 0.00 N ATOM 773 CA ILE A 51 -0.506 -11.069 3.573 1.00 0.00 C ATOM 774 C ILE A 51 -0.383 -11.749 4.936 1.00 0.00 C ATOM 775 O ILE A 51 -1.217 -11.548 5.819 1.00 0.00 O ATOM 776 CB ILE A 51 -1.037 -12.098 2.544 1.00 0.00 C ATOM 777 CG1 ILE A 51 -1.563 -11.392 1.294 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.134 -12.961 3.159 1.00 0.00 C ATOM 779 CD1 ILE A 51 -1.250 -12.125 0.009 1.00 0.00 C ATOM 0 H ILE A 51 1.093 -10.766 2.237 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.213 -10.241 3.625 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.207 -12.743 2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -2.643 -11.273 1.381 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.135 -10.391 1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -2.492 -13.676 2.419 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.735 -13.498 4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.960 -12.326 3.479 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -1.653 -11.567 -0.836 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.170 -12.221 -0.101 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.701 -13.117 0.037 1.00 0.00 H new ATOM 791 N GLU A 52 0.669 -12.542 5.102 1.00 0.00 N ATOM 792 CA GLU A 52 0.907 -13.237 6.359 1.00 0.00 C ATOM 793 C GLU A 52 1.200 -12.233 7.466 1.00 0.00 C ATOM 794 O GLU A 52 0.738 -12.385 8.597 1.00 0.00 O ATOM 795 CB GLU A 52 2.070 -14.220 6.217 1.00 0.00 C ATOM 796 CG GLU A 52 1.802 -15.341 5.226 1.00 0.00 C ATOM 797 CD GLU A 52 3.071 -15.873 4.590 1.00 0.00 C ATOM 798 OE1 GLU A 52 4.128 -15.842 5.257 1.00 0.00 O ATOM 799 OE2 GLU A 52 3.009 -16.322 3.426 1.00 0.00 O ATOM 0 H GLU A 52 1.370 -12.719 4.382 1.00 0.00 H new ATOM 0 HA GLU A 52 0.010 -13.798 6.620 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.960 -13.674 5.903 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.289 -14.654 7.193 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.286 -16.155 5.735 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.133 -14.979 4.445 1.00 0.00 H new ATOM 806 N PHE A 53 1.964 -11.199 7.126 1.00 0.00 N ATOM 807 CA PHE A 53 2.313 -10.156 8.082 1.00 0.00 C ATOM 808 C PHE A 53 1.069 -9.377 8.503 1.00 0.00 C ATOM 809 O PHE A 53 1.012 -8.821 9.599 1.00 0.00 O ATOM 810 CB PHE A 53 3.349 -9.202 7.478 1.00 0.00 C ATOM 811 CG PHE A 53 3.664 -8.022 8.356 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.463 -8.169 9.479 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.156 -6.767 8.061 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.749 -7.088 10.291 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.438 -5.682 8.868 1.00 0.00 C ATOM 816 CZ PHE A 53 4.236 -5.842 9.983 1.00 0.00 C ATOM 0 H PHE A 53 2.353 -11.062 6.193 1.00 0.00 H new ATOM 0 HA PHE A 53 2.743 -10.631 8.964 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.268 -9.754 7.282 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.982 -8.842 6.517 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.867 -9.141 9.722 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.532 -6.636 7.189 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.372 -7.216 11.164 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.035 -4.710 8.627 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.459 -4.994 10.614 1.00 0.00 H new ATOM 826 N TYR A 54 0.081 -9.330 7.613 1.00 0.00 N ATOM 827 CA TYR A 54 -1.159 -8.611 7.880 1.00 0.00 C ATOM 828 C TYR A 54 -2.157 -9.472 8.658 1.00 0.00 C ATOM 829 O TYR A 54 -2.532 -9.137 9.779 1.00 0.00 O ATOM 830 CB TYR A 54 -1.783 -8.145 6.560 1.00 0.00 C ATOM 831 CG TYR A 54 -3.207 -7.648 6.689 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.486 -6.429 7.293 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.271 -8.397 6.201 1.00 0.00 C ATOM 834 CE1 TYR A 54 -4.785 -5.971 7.410 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.571 -7.946 6.311 1.00 0.00 C ATOM 836 CZ TYR A 54 -5.823 -6.733 6.917 1.00 0.00 C ATOM 837 OH TYR A 54 -7.118 -6.280 7.030 1.00 0.00 O ATOM 0 H TYR A 54 0.116 -9.783 6.700 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.919 -7.745 8.497 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.168 -7.348 6.142 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.761 -8.971 5.849 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.675 -5.829 7.678 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.077 -9.348 5.728 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -4.986 -5.022 7.885 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.386 -8.540 5.925 1.00 0.00 H new ATOM 0 HH TYR A 54 -7.729 -6.934 6.632 1.00 0.00 H new ATOM 847 N ASP A 55 -2.597 -10.569 8.051 1.00 0.00 N ATOM 848 CA ASP A 55 -3.574 -11.455 8.683 1.00 0.00 C ATOM 849 C ASP A 55 -3.114 -11.931 10.061 1.00 0.00 C ATOM 850 O ASP A 55 -3.935 -12.273 10.913 1.00 0.00 O ATOM 851 CB ASP A 55 -3.844 -12.663 7.785 1.00 0.00 C ATOM 852 CG ASP A 55 -5.275 -13.153 7.891 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.590 -13.855 8.875 1.00 0.00 O ATOM 854 OD2 ASP A 55 -6.080 -12.835 6.990 1.00 0.00 O ATOM 0 H ASP A 55 -2.295 -10.868 7.124 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.491 -10.882 8.819 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.629 -12.398 6.750 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.165 -13.472 8.055 1.00 0.00 H new ATOM 859 N LYS A 56 -1.805 -11.978 10.267 1.00 0.00 N ATOM 860 CA LYS A 56 -1.242 -12.441 11.535 1.00 0.00 C ATOM 861 C LYS A 56 -1.688 -11.604 12.735 1.00 0.00 C ATOM 862 O LYS A 56 -2.047 -12.153 13.777 1.00 0.00 O ATOM 863 CB LYS A 56 0.285 -12.444 11.473 1.00 0.00 C ATOM 864 CG LYS A 56 0.893 -11.110 11.073 1.00 0.00 C ATOM 865 CD LYS A 56 1.599 -10.442 12.242 1.00 0.00 C ATOM 866 CE LYS A 56 3.093 -10.717 12.223 1.00 0.00 C ATOM 867 NZ LYS A 56 3.866 -9.636 12.896 1.00 0.00 N ATOM 0 H LYS A 56 -1.110 -11.702 9.574 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.621 -13.453 11.679 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.677 -12.732 12.449 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.607 -13.205 10.763 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.601 -11.262 10.259 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.110 -10.452 10.696 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.426 -9.366 12.206 1.00 0.00 H new ATOM 0 HD3 LYS A 56 1.174 -10.802 13.179 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.293 -11.668 12.717 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.431 -10.816 11.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.722 -10.039 13.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.137 -8.916 12.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.279 -9.197 13.634 1.00 0.00 H new ATOM 881 N PHE A 57 -1.622 -10.284 12.610 1.00 0.00 N ATOM 882 CA PHE A 57 -1.975 -9.400 13.717 1.00 0.00 C ATOM 883 C PHE A 57 -2.902 -8.263 13.290 1.00 0.00 C ATOM 884 O PHE A 57 -3.211 -7.380 14.090 1.00 0.00 O ATOM 885 CB PHE A 57 -0.705 -8.829 14.351 1.00 0.00 C ATOM 886 CG PHE A 57 -0.579 -9.121 15.820 1.00 0.00 C ATOM 887 CD1 PHE A 57 -1.693 -9.092 16.645 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.654 -9.422 16.376 1.00 0.00 C ATOM 889 CE1 PHE A 57 -1.578 -9.360 17.996 1.00 0.00 C ATOM 890 CE2 PHE A 57 0.774 -9.691 17.726 1.00 0.00 C ATOM 891 CZ PHE A 57 -0.344 -9.659 18.537 1.00 0.00 C ATOM 0 H PHE A 57 -1.329 -9.803 11.759 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.520 -9.999 14.447 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.164 -9.236 13.833 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.689 -7.749 14.201 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -2.661 -8.857 16.227 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.531 -9.447 15.747 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -2.453 -9.335 18.628 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.741 -9.926 18.147 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.252 -9.868 19.593 1.00 0.00 H new ATOM 901 N HIS A 58 -3.327 -8.264 12.031 1.00 0.00 N ATOM 902 CA HIS A 58 -4.193 -7.201 11.528 1.00 0.00 C ATOM 903 C HIS A 58 -5.380 -6.960 12.461 1.00 0.00 C ATOM 904 O HIS A 58 -5.933 -5.860 12.499 1.00 0.00 O ATOM 905 CB HIS A 58 -4.716 -7.543 10.132 1.00 0.00 C ATOM 906 CG HIS A 58 -5.469 -8.836 10.079 1.00 0.00 C ATOM 907 ND1 HIS A 58 -6.444 -9.101 9.139 1.00 0.00 N ATOM 908 CD2 HIS A 58 -5.392 -9.942 10.859 1.00 0.00 C ATOM 909 CE1 HIS A 58 -6.933 -10.312 9.345 1.00 0.00 C ATOM 910 NE2 HIS A 58 -6.311 -10.843 10.381 1.00 0.00 N ATOM 0 H HIS A 58 -3.090 -8.981 11.345 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.592 -6.293 11.480 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.366 -6.738 9.789 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -3.876 -7.592 9.439 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -6.741 -8.463 8.401 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -4.731 -10.087 11.700 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -7.710 -10.786 8.764 1.00 0.00 H new ATOM 919 N GLU A 59 -5.766 -7.985 13.212 1.00 0.00 N ATOM 920 CA GLU A 59 -6.884 -7.867 14.139 1.00 0.00 C ATOM 921 C GLU A 59 -6.508 -7.003 15.339 1.00 0.00 C ATOM 922 O GLU A 59 -7.351 -6.306 15.903 1.00 0.00 O ATOM 923 CB GLU A 59 -7.334 -9.251 14.612 1.00 0.00 C ATOM 924 CG GLU A 59 -7.849 -10.138 13.490 1.00 0.00 C ATOM 925 CD GLU A 59 -9.186 -10.775 13.815 1.00 0.00 C ATOM 926 OE1 GLU A 59 -9.209 -11.732 14.616 1.00 0.00 O ATOM 927 OE2 GLU A 59 -10.211 -10.316 13.268 1.00 0.00 O ATOM 0 H GLU A 59 -5.323 -8.904 13.197 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.709 -7.387 13.612 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.497 -9.748 15.102 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.118 -9.133 15.360 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.945 -9.546 12.579 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.118 -10.921 13.286 1.00 0.00 H new ATOM 934 N SER A 60 -5.235 -7.051 15.722 1.00 0.00 N ATOM 935 CA SER A 60 -4.749 -6.269 16.852 1.00 0.00 C ATOM 936 C SER A 60 -4.208 -4.922 16.384 1.00 0.00 C ATOM 937 O SER A 60 -4.568 -3.875 16.924 1.00 0.00 O ATOM 938 CB SER A 60 -3.660 -7.037 17.602 1.00 0.00 C ATOM 939 OG SER A 60 -3.574 -6.613 18.952 1.00 0.00 O ATOM 0 H SER A 60 -4.523 -7.623 15.267 1.00 0.00 H new ATOM 0 HA SER A 60 -5.586 -6.091 17.527 1.00 0.00 H new ATOM 0 HB2 SER A 60 -3.874 -8.105 17.566 1.00 0.00 H new ATOM 0 HB3 SER A 60 -2.700 -6.887 17.109 1.00 0.00 H new ATOM 0 HG SER A 60 -2.939 -7.183 19.434 1.00 0.00 H new ATOM 945 N LYS A 61 -3.345 -4.956 15.375 1.00 0.00 N ATOM 946 CA LYS A 61 -2.756 -3.738 14.832 1.00 0.00 C ATOM 947 C LYS A 61 -3.832 -2.830 14.242 1.00 0.00 C ATOM 948 O LYS A 61 -3.660 -1.613 14.169 1.00 0.00 O ATOM 949 CB LYS A 61 -1.717 -4.082 13.762 1.00 0.00 C ATOM 950 CG LYS A 61 -0.476 -4.788 14.335 1.00 0.00 C ATOM 951 CD LYS A 61 0.732 -4.846 13.380 1.00 0.00 C ATOM 952 CE LYS A 61 1.761 -5.897 13.868 1.00 0.00 C ATOM 953 NZ LYS A 61 2.953 -5.950 12.978 1.00 0.00 N ATOM 0 H LYS A 61 -3.038 -5.814 14.917 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.265 -3.206 15.647 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.177 -4.722 13.009 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.407 -3.167 13.257 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.174 -4.277 15.249 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.750 -5.805 14.614 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.396 -5.098 12.374 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.205 -3.865 13.322 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.075 -5.656 14.884 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.290 -6.879 13.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.428 -6.869 13.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.654 -5.831 11.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.612 -5.187 13.234 1.00 0.00 H new ATOM 967 N ASN A 62 -4.947 -3.429 13.830 1.00 0.00 N ATOM 968 CA ASN A 62 -6.059 -2.679 13.255 1.00 0.00 C ATOM 969 C ASN A 62 -5.583 -1.695 12.186 1.00 0.00 C ATOM 970 O ASN A 62 -5.733 -0.483 12.333 1.00 0.00 O ATOM 971 CB ASN A 62 -6.808 -1.935 14.358 1.00 0.00 C ATOM 972 CG ASN A 62 -8.263 -1.692 14.010 1.00 0.00 C ATOM 973 OD1 ASN A 62 -8.615 -1.532 12.841 1.00 0.00 O ATOM 974 ND2 ASN A 62 -9.119 -1.665 15.025 1.00 0.00 N ATOM 0 H ASN A 62 -5.104 -4.435 13.884 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.731 -3.390 12.774 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.750 -2.509 15.283 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.318 -0.979 14.545 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -10.112 -1.507 14.851 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -8.784 -1.802 15.979 1.00 0.00 H new ATOM 981 N PHE A 63 -5.020 -2.228 11.106 1.00 0.00 N ATOM 982 CA PHE A 63 -4.536 -1.400 10.007 1.00 0.00 C ATOM 983 C PHE A 63 -5.035 -1.939 8.672 1.00 0.00 C ATOM 984 O PHE A 63 -5.604 -3.028 8.609 1.00 0.00 O ATOM 985 CB PHE A 63 -3.008 -1.322 10.016 1.00 0.00 C ATOM 986 CG PHE A 63 -2.324 -2.641 9.793 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.367 -3.632 10.758 1.00 0.00 C ATOM 988 CD2 PHE A 63 -1.627 -2.882 8.619 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.729 -4.842 10.558 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.988 -4.089 8.413 1.00 0.00 C ATOM 991 CZ PHE A 63 -1.038 -5.070 9.384 1.00 0.00 C ATOM 0 H PHE A 63 -4.888 -3.230 10.969 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.929 -0.392 10.142 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.686 -0.623 9.244 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.682 -0.913 10.972 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.905 -3.458 11.678 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -1.583 -2.118 7.857 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.771 -5.608 11.318 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.450 -4.266 7.493 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.538 -6.014 9.226 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.831 -1.171 7.605 1.00 0.00 N ATOM 1002 CA GLU A 64 -5.267 -1.568 6.289 1.00 0.00 C ATOM 1003 C GLU A 64 -4.122 -1.465 5.296 1.00 0.00 C ATOM 1004 O GLU A 64 -3.069 -0.893 5.580 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.441 -0.697 5.835 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.634 -1.494 5.335 1.00 0.00 C ATOM 1007 CD GLU A 64 -8.100 -2.535 6.335 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.844 -2.353 7.545 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -8.722 -3.531 5.910 1.00 0.00 O ATOM 0 H GLU A 64 -4.362 -0.266 7.637 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.596 -2.606 6.332 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.758 -0.068 6.667 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.102 -0.030 5.042 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -8.456 -0.812 5.116 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.371 -1.987 4.399 1.00 0.00 H new ATOM 1016 N VAL A 65 -4.353 -2.030 4.134 1.00 0.00 N ATOM 1017 CA VAL A 65 -3.375 -2.037 3.052 1.00 0.00 C ATOM 1018 C VAL A 65 -4.058 -1.826 1.706 1.00 0.00 C ATOM 1019 O VAL A 65 -5.029 -2.509 1.380 1.00 0.00 O ATOM 1020 CB VAL A 65 -2.603 -3.370 3.004 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.556 -3.359 1.894 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.962 -3.670 4.351 1.00 0.00 C ATOM 0 H VAL A 65 -5.227 -2.502 3.904 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.678 -1.222 3.247 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.316 -4.164 2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -1.027 -4.312 1.884 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -2.046 -3.206 0.933 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.846 -2.551 2.072 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.422 -4.615 4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.268 -2.871 4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.736 -3.739 5.115 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.542 -0.888 0.922 1.00 0.00 N ATOM 1033 CA VAL A 66 -4.107 -0.610 -0.393 1.00 0.00 C ATOM 1034 C VAL A 66 -3.228 -1.201 -1.491 1.00 0.00 C ATOM 1035 O VAL A 66 -2.001 -1.184 -1.388 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.272 0.903 -0.636 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -5.108 1.155 -1.882 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.894 1.576 0.578 1.00 0.00 C ATOM 0 H VAL A 66 -2.739 -0.310 1.171 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.093 -1.074 -0.421 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.285 1.336 -0.795 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.214 2.229 -2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.616 0.710 -2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -6.094 0.708 -1.755 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.002 2.644 0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.874 1.141 0.773 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.252 1.426 1.446 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.853 -1.735 -2.538 1.00 0.00 N ATOM 1049 CA PHE A 67 -3.106 -2.336 -3.635 1.00 0.00 C ATOM 1050 C PHE A 67 -3.024 -1.395 -4.832 1.00 0.00 C ATOM 1051 O PHE A 67 -3.949 -1.319 -5.639 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.749 -3.658 -4.057 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.913 -4.448 -5.024 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.555 -4.619 -4.808 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -3.486 -5.019 -6.149 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.784 -5.344 -5.695 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -2.720 -5.746 -7.041 1.00 0.00 C ATOM 1058 CZ PHE A 67 -1.367 -5.909 -6.813 1.00 0.00 C ATOM 0 H PHE A 67 -4.867 -1.763 -2.648 1.00 0.00 H new ATOM 0 HA PHE A 67 -2.093 -2.526 -3.280 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.933 -4.263 -3.169 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.719 -3.453 -4.510 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.094 -4.180 -3.936 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -4.543 -4.895 -6.331 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.274 -5.469 -5.515 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -3.178 -6.186 -7.915 1.00 0.00 H new ATOM 0 HZ PHE A 67 -0.766 -6.477 -7.508 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.903 -0.691 -4.945 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.693 0.233 -6.053 1.00 0.00 C ATOM 1070 C CYS A 68 -1.221 -0.530 -7.284 1.00 0.00 C ATOM 1071 O CYS A 68 -0.643 -1.612 -7.173 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.676 1.320 -5.667 1.00 0.00 C ATOM 1073 SG CYS A 68 0.561 1.697 -6.937 1.00 0.00 S ATOM 0 H CYS A 68 -1.127 -0.742 -4.284 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.639 0.722 -6.285 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -1.218 2.235 -5.426 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -0.159 1.007 -4.759 1.00 0.00 H new ATOM 0 HG CYS A 68 1.665 2.080 -6.367 1.00 0.00 H new ATOM 1079 N THR A 69 -1.465 0.040 -8.455 1.00 0.00 N ATOM 1080 CA THR A 69 -1.059 -0.587 -9.702 1.00 0.00 C ATOM 1081 C THR A 69 -0.003 0.250 -10.419 1.00 0.00 C ATOM 1082 O THR A 69 0.111 1.456 -10.198 1.00 0.00 O ATOM 1083 CB THR A 69 -2.275 -0.800 -10.608 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.993 -1.763 -11.606 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.737 0.461 -11.305 1.00 0.00 C ATOM 0 H THR A 69 -1.942 0.935 -8.567 1.00 0.00 H new ATOM 0 HA THR A 69 -0.619 -1.556 -9.467 1.00 0.00 H new ATOM 0 HB THR A 69 -3.071 -1.138 -9.944 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.735 -2.401 -11.664 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.601 0.236 -11.930 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.012 1.208 -10.561 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.931 0.849 -11.928 1.00 0.00 H new ATOM 1093 N TRP A 70 0.758 -0.404 -11.283 1.00 0.00 N ATOM 1094 CA TRP A 70 1.806 0.258 -12.053 1.00 0.00 C ATOM 1095 C TRP A 70 1.883 -0.327 -13.461 1.00 0.00 C ATOM 1096 O TRP A 70 2.966 -0.497 -14.021 1.00 0.00 O ATOM 1097 CB TRP A 70 3.156 0.113 -11.344 1.00 0.00 C ATOM 1098 CG TRP A 70 3.620 1.379 -10.692 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.287 1.828 -9.448 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.500 2.360 -11.252 1.00 0.00 C ATOM 1101 NE1 TRP A 70 3.907 3.029 -9.199 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.657 3.376 -10.291 1.00 0.00 C ATOM 1103 CE3 TRP A 70 5.171 2.478 -12.473 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.457 4.494 -10.513 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 5.966 3.588 -12.692 1.00 0.00 C ATOM 1106 CH2 TRP A 70 6.103 4.583 -11.716 1.00 0.00 C ATOM 0 H TRP A 70 0.670 -1.403 -11.471 1.00 0.00 H new ATOM 0 HA TRP A 70 1.563 1.318 -12.131 1.00 0.00 H new ATOM 0 HB2 TRP A 70 3.080 -0.670 -10.589 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.905 -0.212 -12.066 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.632 1.315 -8.759 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.822 3.573 -8.341 1.00 0.00 H new ATOM 0 HE3 TRP A 70 5.070 1.716 -13.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.564 5.263 -9.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 6.490 3.689 -13.631 1.00 0.00 H new ATOM 0 HH2 TRP A 70 6.731 5.438 -11.917 1.00 0.00 H new ATOM 1117 N ASP A 71 0.720 -0.637 -14.022 1.00 0.00 N ATOM 1118 CA ASP A 71 0.632 -1.210 -15.361 1.00 0.00 C ATOM 1119 C ASP A 71 0.076 -0.192 -16.351 1.00 0.00 C ATOM 1120 O ASP A 71 -0.444 0.852 -15.957 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.255 -2.461 -15.348 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.007 -3.361 -16.543 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.441 -3.003 -17.657 1.00 0.00 O ATOM 1124 OD2 ASP A 71 0.619 -4.427 -16.362 1.00 0.00 O ATOM 0 H ASP A 71 -0.182 -0.500 -13.566 1.00 0.00 H new ATOM 0 HA ASP A 71 1.637 -1.489 -15.677 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.073 -3.022 -14.431 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.302 -2.160 -15.335 1.00 0.00 H new ATOM 1129 N GLU A 72 0.186 -0.505 -17.637 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.308 0.381 -18.685 1.00 0.00 C ATOM 1131 C GLU A 72 -1.649 -0.108 -19.228 1.00 0.00 C ATOM 1132 O GLU A 72 -2.453 0.683 -19.721 1.00 0.00 O ATOM 1133 CB GLU A 72 0.711 0.478 -19.822 1.00 0.00 C ATOM 1134 CG GLU A 72 0.977 -0.848 -20.516 1.00 0.00 C ATOM 1135 CD GLU A 72 2.443 -1.049 -20.846 1.00 0.00 C ATOM 1136 OE1 GLU A 72 3.296 -0.663 -20.020 1.00 0.00 O ATOM 1137 OE2 GLU A 72 2.738 -1.593 -21.931 1.00 0.00 O ATOM 0 H GLU A 72 0.613 -1.366 -17.979 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.453 1.370 -18.250 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.354 1.198 -20.558 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.649 0.866 -19.426 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.637 -1.663 -19.877 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.392 -0.897 -21.434 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.882 -1.414 -19.139 1.00 0.00 N ATOM 1145 CA GLU A 73 -3.125 -2.004 -19.624 1.00 0.00 C ATOM 1146 C GLU A 73 -4.019 -2.431 -18.464 1.00 0.00 C ATOM 1147 O GLU A 73 -3.537 -2.912 -17.438 1.00 0.00 O ATOM 1148 CB GLU A 73 -2.826 -3.206 -20.522 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.009 -3.637 -21.374 1.00 0.00 C ATOM 1150 CD GLU A 73 -3.599 -4.059 -22.771 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -2.476 -4.586 -22.927 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -4.398 -3.862 -23.710 1.00 0.00 O ATOM 0 H GLU A 73 -1.227 -2.084 -18.736 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.653 -1.247 -20.203 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.988 -2.962 -21.175 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -2.512 -4.044 -19.900 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.522 -4.465 -20.884 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.722 -2.815 -21.441 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.325 -2.252 -18.635 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.292 -2.618 -17.604 1.00 0.00 C ATOM 1161 C GLU A 74 -6.446 -4.133 -17.512 1.00 0.00 C ATOM 1162 O GLU A 74 -6.732 -4.673 -16.443 1.00 0.00 O ATOM 1163 CB GLU A 74 -7.650 -1.975 -17.896 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.554 -0.532 -18.368 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.612 0.357 -17.744 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -8.914 0.169 -16.547 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.137 1.240 -18.453 1.00 0.00 O ATOM 0 H GLU A 74 -5.739 -1.855 -19.479 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.920 -2.250 -16.648 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.165 -2.563 -18.656 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.262 -2.013 -16.995 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -6.566 -0.140 -18.126 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.653 -0.501 -19.453 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.258 -4.813 -18.638 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.380 -6.267 -18.685 1.00 0.00 C ATOM 1176 C ASP A 75 -5.451 -6.930 -17.672 1.00 0.00 C ATOM 1177 O ASP A 75 -5.798 -7.946 -17.069 1.00 0.00 O ATOM 1178 CB ASP A 75 -6.064 -6.780 -20.092 1.00 0.00 C ATOM 1179 CG ASP A 75 -6.271 -8.276 -20.222 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -7.425 -8.697 -20.446 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -5.280 -9.025 -20.100 1.00 0.00 O ATOM 0 H ASP A 75 -6.020 -4.381 -19.531 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.408 -6.526 -18.430 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.697 -6.264 -20.814 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.031 -6.536 -20.341 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.269 -6.349 -17.489 1.00 0.00 N ATOM 1187 CA GLY A 76 -3.311 -6.900 -16.550 1.00 0.00 C ATOM 1188 C GLY A 76 -3.672 -6.603 -15.106 1.00 0.00 C ATOM 1189 O GLY A 76 -3.806 -7.518 -14.293 1.00 0.00 O ATOM 0 H GLY A 76 -3.959 -5.507 -17.974 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.249 -7.979 -16.691 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.323 -6.494 -16.765 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.829 -5.322 -14.787 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.176 -4.901 -13.433 1.00 0.00 C ATOM 1195 C PHE A 77 -5.409 -5.649 -12.924 1.00 0.00 C ATOM 1196 O PHE A 77 -5.574 -5.849 -11.721 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.421 -3.387 -13.404 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.113 -2.896 -12.161 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -4.530 -3.058 -10.915 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.347 -2.270 -12.244 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -5.165 -2.606 -9.773 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -6.986 -1.816 -11.106 1.00 0.00 C ATOM 1203 CZ PHE A 77 -6.395 -1.983 -9.870 1.00 0.00 C ATOM 0 H PHE A 77 -3.721 -4.555 -15.450 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.342 -5.141 -12.774 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.464 -2.874 -13.500 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.019 -3.111 -14.272 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.568 -3.543 -10.835 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.814 -2.136 -13.208 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.701 -2.739 -8.807 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -7.948 -1.331 -11.184 1.00 0.00 H new ATOM 0 HZ PHE A 77 -6.893 -1.627 -8.980 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.272 -6.054 -13.849 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.491 -6.775 -13.499 1.00 0.00 C ATOM 1215 C ALA A 78 -7.220 -8.246 -13.263 1.00 0.00 C ATOM 1216 O ALA A 78 -7.544 -8.790 -12.207 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.480 -6.650 -14.616 1.00 0.00 C ATOM 0 H ALA A 78 -6.150 -5.895 -14.849 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.883 -6.339 -12.580 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.392 -7.188 -14.357 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.714 -5.598 -14.779 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.056 -7.073 -15.527 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.587 -8.880 -14.246 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.243 -10.275 -14.117 1.00 0.00 C ATOM 1225 C GLY A 79 -5.353 -10.479 -12.919 1.00 0.00 C ATOM 1226 O GLY A 79 -5.147 -11.601 -12.457 1.00 0.00 O ATOM 0 H GLY A 79 -6.309 -8.448 -15.127 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.148 -10.873 -14.013 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.736 -10.618 -15.019 1.00 0.00 H new ATOM 1230 N TYR A 80 -4.825 -9.366 -12.421 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.937 -9.394 -11.261 1.00 0.00 C ATOM 1232 C TYR A 80 -4.699 -9.128 -9.961 1.00 0.00 C ATOM 1233 O TYR A 80 -4.135 -9.234 -8.872 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.810 -8.370 -11.419 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.451 -8.880 -10.984 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -1.331 -9.962 -10.116 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -0.285 -8.279 -11.444 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -0.090 -10.427 -9.723 1.00 0.00 C ATOM 1239 CE2 TYR A 80 0.958 -8.740 -11.053 1.00 0.00 C ATOM 1240 CZ TYR A 80 1.050 -9.813 -10.193 1.00 0.00 C ATOM 1241 OH TYR A 80 2.286 -10.275 -9.804 1.00 0.00 O ATOM 0 H TYR A 80 -4.995 -8.435 -12.800 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.508 -10.395 -11.206 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.755 -8.064 -12.464 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.056 -7.481 -10.839 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.222 -10.446 -9.744 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -0.351 -7.438 -12.118 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -0.014 -11.268 -9.050 1.00 0.00 H new ATOM 0 HE2 TYR A 80 1.854 -8.261 -11.420 1.00 0.00 H new ATOM 0 HH TYR A 80 2.591 -10.962 -10.433 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.978 -8.785 -10.078 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.809 -8.506 -8.909 1.00 0.00 C ATOM 1253 C PHE A 81 -6.790 -9.670 -7.919 1.00 0.00 C ATOM 1254 O PHE A 81 -7.082 -9.492 -6.736 1.00 0.00 O ATOM 1255 CB PHE A 81 -8.248 -8.216 -9.340 1.00 0.00 C ATOM 1256 CG PHE A 81 -9.163 -7.882 -8.196 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -9.799 -8.889 -7.485 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.387 -6.565 -7.831 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -10.641 -8.585 -6.433 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -10.229 -6.255 -6.780 1.00 0.00 C ATOM 1261 CZ PHE A 81 -10.856 -7.268 -6.079 1.00 0.00 C ATOM 0 H PHE A 81 -6.463 -8.693 -10.971 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.396 -7.629 -8.410 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -8.246 -7.386 -10.047 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.642 -9.084 -9.868 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.634 -9.921 -7.757 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -8.898 -5.770 -8.374 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.131 -9.378 -5.887 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -10.397 -5.224 -6.507 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.513 -7.030 -5.256 1.00 0.00 H new ATOM 1271 N ALA A 82 -6.450 -10.863 -8.408 1.00 0.00 N ATOM 1272 CA ALA A 82 -6.400 -12.055 -7.564 1.00 0.00 C ATOM 1273 C ALA A 82 -5.673 -11.784 -6.248 1.00 0.00 C ATOM 1274 O ALA A 82 -5.969 -12.406 -5.227 1.00 0.00 O ATOM 1275 CB ALA A 82 -5.728 -13.198 -8.310 1.00 0.00 C ATOM 0 H ALA A 82 -6.205 -11.029 -9.384 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.426 -12.336 -7.324 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.696 -14.081 -7.671 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.293 -13.424 -9.214 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.712 -12.909 -8.580 1.00 0.00 H new ATOM 1281 N LYS A 83 -4.726 -10.853 -6.277 1.00 0.00 N ATOM 1282 CA LYS A 83 -3.960 -10.501 -5.085 1.00 0.00 C ATOM 1283 C LYS A 83 -4.884 -10.024 -3.968 1.00 0.00 C ATOM 1284 O LYS A 83 -6.107 -10.063 -4.104 1.00 0.00 O ATOM 1285 CB LYS A 83 -2.933 -9.418 -5.418 1.00 0.00 C ATOM 1286 CG LYS A 83 -1.662 -9.963 -6.048 1.00 0.00 C ATOM 1287 CD LYS A 83 -0.757 -8.844 -6.537 1.00 0.00 C ATOM 1288 CE LYS A 83 0.647 -9.349 -6.823 1.00 0.00 C ATOM 1289 NZ LYS A 83 1.439 -8.369 -7.618 1.00 0.00 N ATOM 0 H LYS A 83 -4.470 -10.328 -7.113 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.436 -11.392 -4.740 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.385 -8.696 -6.098 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.675 -8.880 -4.506 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -1.127 -10.573 -5.320 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -1.919 -10.615 -6.883 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.177 -8.403 -7.441 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.715 -8.054 -5.787 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.159 -9.551 -5.882 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.590 -10.294 -7.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.339 -8.176 -7.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.630 -8.761 -8.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.901 -7.484 -7.714 1.00 0.00 H new ATOM 1303 N MET A 84 -4.295 -9.577 -2.859 1.00 0.00 N ATOM 1304 CA MET A 84 -5.072 -9.096 -1.719 1.00 0.00 C ATOM 1305 C MET A 84 -6.169 -8.126 -2.167 1.00 0.00 C ATOM 1306 O MET A 84 -5.886 -7.117 -2.813 1.00 0.00 O ATOM 1307 CB MET A 84 -4.166 -8.400 -0.709 1.00 0.00 C ATOM 1308 CG MET A 84 -3.477 -9.351 0.251 1.00 0.00 C ATOM 1309 SD MET A 84 -4.052 -9.161 1.951 1.00 0.00 S ATOM 1310 CE MET A 84 -5.266 -10.475 2.047 1.00 0.00 C ATOM 0 H MET A 84 -3.284 -9.538 -2.727 1.00 0.00 H new ATOM 0 HA MET A 84 -5.539 -9.963 -1.251 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.409 -7.829 -1.247 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.757 -7.685 -0.136 1.00 0.00 H new ATOM 0 HG2 MET A 84 -3.649 -10.377 -0.074 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.401 -9.181 0.215 1.00 0.00 H new ATOM 0 HE1 MET A 84 -6.021 -10.219 2.790 1.00 0.00 H new ATOM 0 HE2 MET A 84 -5.742 -10.602 1.075 1.00 0.00 H new ATOM 0 HE3 MET A 84 -4.774 -11.404 2.334 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.437 -8.426 -1.840 1.00 0.00 N ATOM 1321 CA PRO A 85 -8.572 -7.587 -2.220 1.00 0.00 C ATOM 1322 C PRO A 85 -8.893 -6.490 -1.207 1.00 0.00 C ATOM 1323 O PRO A 85 -9.705 -5.609 -1.485 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.713 -8.592 -2.264 1.00 0.00 C ATOM 1325 CG PRO A 85 -9.377 -9.600 -1.215 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.872 -9.618 -1.088 1.00 0.00 C ATOM 0 HA PRO A 85 -8.381 -7.050 -3.149 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -10.670 -8.112 -2.059 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.793 -9.056 -3.247 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.841 -9.337 -0.265 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.753 -10.585 -1.492 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -7.559 -9.569 -0.045 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.447 -10.531 -1.506 1.00 0.00 H new ATOM 1334 N TRP A 86 -8.279 -6.569 -0.027 1.00 0.00 N ATOM 1335 CA TRP A 86 -8.519 -5.599 1.052 1.00 0.00 C ATOM 1336 C TRP A 86 -8.932 -4.217 0.527 1.00 0.00 C ATOM 1337 O TRP A 86 -10.116 -3.881 0.549 1.00 0.00 O ATOM 1338 CB TRP A 86 -7.305 -5.496 1.984 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.973 -5.576 1.293 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.700 -5.355 -0.030 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -4.727 -5.920 1.904 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.356 -5.506 -0.265 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.737 -5.864 0.905 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -4.352 -6.262 3.207 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.398 -6.137 1.169 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -3.023 -6.536 3.465 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -2.062 -6.472 2.452 1.00 0.00 C ATOM 0 H TRP A 86 -7.607 -7.298 0.211 1.00 0.00 H new ATOM 0 HA TRP A 86 -9.363 -5.978 1.628 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -7.361 -4.553 2.528 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -7.364 -6.294 2.724 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.435 -5.099 -0.779 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.893 -5.373 -1.164 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -5.087 -6.311 3.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.652 -6.086 0.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -2.721 -6.804 4.467 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -1.031 -6.692 2.688 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.979 -3.417 0.042 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.302 -2.108 -0.485 1.00 0.00 C ATOM 1360 C LEU A 87 -7.486 -1.834 -1.740 1.00 0.00 C ATOM 1361 O LEU A 87 -6.278 -2.058 -1.760 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.050 -1.020 0.559 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.154 -0.860 1.607 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -8.775 0.211 2.620 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.482 -0.522 0.940 1.00 0.00 C ATOM 0 H LEU A 87 -6.989 -3.658 0.007 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.362 -2.094 -0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.113 -1.239 1.071 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -7.917 -0.068 0.045 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.268 -1.807 2.134 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.571 0.312 3.358 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.850 -0.073 3.121 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.633 1.162 2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.254 -0.412 1.702 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.384 0.411 0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.759 -1.323 0.255 1.00 0.00 H new ATOM 1377 N ALA A 88 -8.143 -1.379 -2.794 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.457 -1.111 -4.041 1.00 0.00 C ATOM 1379 C ALA A 88 -8.106 0.028 -4.816 1.00 0.00 C ATOM 1380 O ALA A 88 -9.328 0.083 -4.955 1.00 0.00 O ATOM 1381 CB ALA A 88 -7.455 -2.373 -4.868 1.00 0.00 C ATOM 0 H ALA A 88 -9.145 -1.189 -2.809 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.436 -0.800 -3.818 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.942 -2.189 -5.812 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.940 -3.164 -4.323 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.482 -2.679 -5.067 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.276 0.929 -5.333 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.768 2.059 -6.111 1.00 0.00 C ATOM 1389 C VAL A 89 -7.913 1.674 -7.582 1.00 0.00 C ATOM 1390 O VAL A 89 -6.924 1.346 -8.239 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.831 3.278 -6.007 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.443 4.485 -6.707 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.525 3.595 -4.552 1.00 0.00 C ATOM 0 H VAL A 89 -6.262 0.898 -5.227 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.740 2.329 -5.698 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.893 3.035 -6.506 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.767 5.336 -6.623 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.604 4.252 -7.760 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.396 4.732 -6.240 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.862 4.459 -4.499 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -7.453 3.817 -4.025 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -6.040 2.737 -4.087 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.141 1.705 -8.128 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.379 1.352 -9.528 1.00 0.00 C ATOM 1405 C PRO A 90 -8.535 2.194 -10.475 1.00 0.00 C ATOM 1406 O PRO A 90 -8.091 3.285 -10.122 1.00 0.00 O ATOM 1407 CB PRO A 90 -10.873 1.634 -9.744 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.315 2.431 -8.562 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.384 2.083 -7.436 1.00 0.00 C ATOM 0 HA PRO A 90 -9.108 0.316 -9.734 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.036 2.186 -10.670 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.438 0.705 -9.822 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.278 3.499 -8.779 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.346 2.195 -8.299 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -10.230 2.929 -6.766 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.773 1.264 -6.831 1.00 0.00 H new ATOM 1417 N PHE A 91 -8.315 1.680 -11.679 1.00 0.00 N ATOM 1418 CA PHE A 91 -7.522 2.392 -12.677 1.00 0.00 C ATOM 1419 C PHE A 91 -8.059 3.807 -12.894 1.00 0.00 C ATOM 1420 O PHE A 91 -7.335 4.694 -13.343 1.00 0.00 O ATOM 1421 CB PHE A 91 -7.518 1.625 -14.003 1.00 0.00 C ATOM 1422 CG PHE A 91 -6.255 1.795 -14.811 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -5.332 2.783 -14.500 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -5.995 0.959 -15.887 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -4.177 2.934 -15.244 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -4.842 1.108 -16.635 1.00 0.00 C ATOM 1427 CZ PHE A 91 -3.932 2.095 -16.313 1.00 0.00 C ATOM 0 H PHE A 91 -8.672 0.776 -11.988 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.500 2.464 -12.306 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -7.665 0.565 -13.797 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -8.367 1.954 -14.603 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.518 3.443 -13.666 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.701 0.183 -16.143 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.467 3.707 -14.990 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -4.653 0.452 -17.472 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.030 2.211 -16.896 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.337 4.007 -12.577 1.00 0.00 N ATOM 1438 CA ALA A 92 -9.976 5.309 -12.743 1.00 0.00 C ATOM 1439 C ALA A 92 -9.176 6.428 -12.076 1.00 0.00 C ATOM 1440 O ALA A 92 -9.104 7.539 -12.600 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.391 5.270 -12.186 1.00 0.00 C ATOM 0 H ALA A 92 -9.950 3.282 -12.203 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.012 5.525 -13.811 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -11.860 6.246 -12.314 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -11.971 4.516 -12.718 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.358 5.020 -11.126 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.578 6.141 -10.920 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.795 7.144 -10.205 1.00 0.00 C ATOM 1449 C GLN A 93 -6.300 6.868 -10.331 1.00 0.00 C ATOM 1450 O GLN A 93 -5.547 7.038 -9.373 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.189 7.182 -8.727 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.680 7.021 -8.482 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.066 5.597 -8.140 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.424 4.645 -8.584 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.119 5.443 -7.347 1.00 0.00 N ATOM 0 H GLN A 93 -8.621 5.230 -10.463 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.009 8.113 -10.657 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.657 6.391 -8.199 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.861 8.129 -8.298 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.984 7.681 -7.669 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.226 7.338 -9.370 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -11.622 6.261 -7.002 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -11.426 4.507 -7.082 1.00 0.00 H new ATOM 1464 N SER A 94 -5.874 6.442 -11.515 1.00 0.00 N ATOM 1465 CA SER A 94 -4.466 6.148 -11.749 1.00 0.00 C ATOM 1466 C SER A 94 -3.624 7.411 -11.608 1.00 0.00 C ATOM 1467 O SER A 94 -2.479 7.358 -11.159 1.00 0.00 O ATOM 1468 CB SER A 94 -4.268 5.520 -13.131 1.00 0.00 C ATOM 1469 OG SER A 94 -3.466 6.336 -13.968 1.00 0.00 O ATOM 0 H SER A 94 -6.479 6.293 -12.322 1.00 0.00 H new ATOM 0 HA SER A 94 -4.137 5.431 -10.997 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.801 4.541 -13.022 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.239 5.360 -13.601 1.00 0.00 H new ATOM 0 HG SER A 94 -3.359 5.904 -14.841 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.202 8.549 -11.982 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.504 9.825 -11.883 1.00 0.00 C ATOM 1477 C GLU A 95 -2.991 10.035 -10.464 1.00 0.00 C ATOM 1478 O GLU A 95 -1.944 10.648 -10.252 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.433 10.974 -12.280 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.772 12.341 -12.214 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.687 13.403 -11.636 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -4.717 13.549 -10.396 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -5.373 14.089 -12.423 1.00 0.00 O ATOM 0 H GLU A 95 -5.149 8.613 -12.355 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.656 9.810 -12.567 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.795 10.803 -13.294 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.304 10.969 -11.625 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.869 12.275 -11.607 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.462 12.639 -13.215 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.735 9.508 -9.496 1.00 0.00 N ATOM 1491 CA ALA A 96 -3.361 9.617 -8.094 1.00 0.00 C ATOM 1492 C ALA A 96 -2.189 8.711 -7.775 1.00 0.00 C ATOM 1493 O ALA A 96 -1.308 9.066 -6.999 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.525 9.241 -7.201 1.00 0.00 C ATOM 0 H ALA A 96 -4.604 9.000 -9.660 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.077 10.653 -7.910 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -4.226 9.329 -6.157 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.364 9.910 -7.395 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.825 8.214 -7.407 1.00 0.00 H new ATOM 1500 N VAL A 97 -2.196 7.529 -8.371 1.00 0.00 N ATOM 1501 CA VAL A 97 -1.138 6.562 -8.140 1.00 0.00 C ATOM 1502 C VAL A 97 0.208 7.136 -8.561 1.00 0.00 C ATOM 1503 O VAL A 97 1.230 6.894 -7.921 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.401 5.240 -8.888 1.00 0.00 C ATOM 1505 CG1 VAL A 97 -0.277 4.259 -8.620 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.746 4.649 -8.481 1.00 0.00 C ATOM 0 H VAL A 97 -2.922 7.218 -9.017 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.120 6.347 -7.072 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.435 5.444 -9.958 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.472 3.328 -9.153 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.666 4.683 -8.964 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.216 4.059 -7.550 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.912 3.717 -9.020 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.748 4.453 -7.409 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.541 5.354 -8.722 1.00 0.00 H new ATOM 1516 N GLN A 98 0.189 7.913 -9.633 1.00 0.00 N ATOM 1517 CA GLN A 98 1.397 8.549 -10.142 1.00 0.00 C ATOM 1518 C GLN A 98 1.702 9.816 -9.349 1.00 0.00 C ATOM 1519 O GLN A 98 2.864 10.160 -9.129 1.00 0.00 O ATOM 1520 CB GLN A 98 1.237 8.885 -11.626 1.00 0.00 C ATOM 1521 CG GLN A 98 0.807 7.699 -12.475 1.00 0.00 C ATOM 1522 CD GLN A 98 0.851 8.000 -13.960 1.00 0.00 C ATOM 1523 OE1 GLN A 98 1.826 8.555 -14.465 1.00 0.00 O ATOM 1524 NE2 GLN A 98 -0.211 7.635 -14.669 1.00 0.00 N ATOM 0 H GLN A 98 -0.653 8.120 -10.170 1.00 0.00 H new ATOM 0 HA GLN A 98 2.229 7.854 -10.028 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.502 9.683 -11.732 1.00 0.00 H new ATOM 0 HB3 GLN A 98 2.183 9.270 -12.007 1.00 0.00 H new ATOM 0 HG2 GLN A 98 1.455 6.849 -12.261 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.205 7.406 -12.197 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.998 7.177 -14.210 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.239 7.813 -15.673 1.00 0.00 H new ATOM 1533 N LYS A 99 0.647 10.505 -8.915 1.00 0.00 N ATOM 1534 CA LYS A 99 0.797 11.728 -8.141 1.00 0.00 C ATOM 1535 C LYS A 99 1.216 11.410 -6.711 1.00 0.00 C ATOM 1536 O LYS A 99 1.992 12.149 -6.104 1.00 0.00 O ATOM 1537 CB LYS A 99 -0.513 12.519 -8.138 1.00 0.00 C ATOM 1538 CG LYS A 99 -0.809 13.212 -9.458 1.00 0.00 C ATOM 1539 CD LYS A 99 0.041 14.459 -9.636 1.00 0.00 C ATOM 1540 CE LYS A 99 -0.736 15.718 -9.290 1.00 0.00 C ATOM 1541 NZ LYS A 99 -1.978 15.845 -10.102 1.00 0.00 N ATOM 0 H LYS A 99 -0.321 10.233 -9.089 1.00 0.00 H new ATOM 0 HA LYS A 99 1.575 12.333 -8.606 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -1.335 11.844 -7.900 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -0.474 13.266 -7.346 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.622 12.523 -10.282 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -1.864 13.481 -9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 99 0.926 14.391 -9.003 1.00 0.00 H new ATOM 0 HD3 LYS A 99 0.391 14.518 -10.667 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -0.994 15.706 -8.231 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -0.104 16.591 -9.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.192 16.851 -10.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.841 15.378 -11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.769 15.394 -9.599 1.00 0.00 H new ATOM 1555 N LEU A 100 0.713 10.298 -6.180 1.00 0.00 N ATOM 1556 CA LEU A 100 1.061 9.888 -4.821 1.00 0.00 C ATOM 1557 C LEU A 100 2.423 9.206 -4.825 1.00 0.00 C ATOM 1558 O LEU A 100 3.303 9.539 -4.030 1.00 0.00 O ATOM 1559 CB LEU A 100 -0.021 8.964 -4.218 1.00 0.00 C ATOM 1560 CG LEU A 100 0.372 7.495 -4.017 1.00 0.00 C ATOM 1561 CD1 LEU A 100 1.408 7.370 -2.912 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.855 6.654 -3.696 1.00 0.00 C ATOM 0 H LEU A 100 0.070 9.671 -6.663 1.00 0.00 H new ATOM 0 HA LEU A 100 1.112 10.776 -4.191 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.320 9.373 -3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.898 8.998 -4.864 1.00 0.00 H new ATOM 0 HG LEU A 100 0.809 7.124 -4.944 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.676 6.322 -2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 100 2.297 7.941 -3.180 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.995 7.757 -1.981 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.557 5.615 -3.557 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.321 7.024 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.567 6.720 -4.519 1.00 0.00 H new ATOM 1574 N SER A 101 2.582 8.247 -5.728 1.00 0.00 N ATOM 1575 CA SER A 101 3.833 7.503 -5.851 1.00 0.00 C ATOM 1576 C SER A 101 5.024 8.451 -5.949 1.00 0.00 C ATOM 1577 O SER A 101 6.053 8.238 -5.309 1.00 0.00 O ATOM 1578 CB SER A 101 3.793 6.591 -7.078 1.00 0.00 C ATOM 1579 OG SER A 101 5.012 5.885 -7.230 1.00 0.00 O ATOM 0 H SER A 101 1.859 7.964 -6.389 1.00 0.00 H new ATOM 0 HA SER A 101 3.949 6.892 -4.956 1.00 0.00 H new ATOM 0 HB2 SER A 101 2.969 5.884 -6.982 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.600 7.186 -7.971 1.00 0.00 H new ATOM 0 HG SER A 101 4.839 4.921 -7.191 1.00 0.00 H new ATOM 1585 N LYS A 102 4.873 9.504 -6.746 1.00 0.00 N ATOM 1586 CA LYS A 102 5.934 10.489 -6.918 1.00 0.00 C ATOM 1587 C LYS A 102 6.335 11.082 -5.572 1.00 0.00 C ATOM 1588 O LYS A 102 7.485 11.474 -5.369 1.00 0.00 O ATOM 1589 CB LYS A 102 5.481 11.601 -7.865 1.00 0.00 C ATOM 1590 CG LYS A 102 5.679 11.267 -9.335 1.00 0.00 C ATOM 1591 CD LYS A 102 6.947 11.899 -9.884 1.00 0.00 C ATOM 1592 CE LYS A 102 6.738 12.430 -11.294 1.00 0.00 C ATOM 1593 NZ LYS A 102 5.772 13.561 -11.325 1.00 0.00 N ATOM 0 H LYS A 102 4.027 9.697 -7.282 1.00 0.00 H new ATOM 0 HA LYS A 102 6.799 9.988 -7.352 1.00 0.00 H new ATOM 0 HB2 LYS A 102 4.426 11.811 -7.688 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.031 12.513 -7.631 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.727 10.185 -9.460 1.00 0.00 H new ATOM 0 HG3 LYS A 102 4.820 11.616 -9.907 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.262 12.712 -9.230 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.751 11.163 -9.886 1.00 0.00 H new ATOM 0 HE2 LYS A 102 7.694 12.758 -11.704 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.376 11.626 -11.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.981 14.173 -12.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.805 13.189 -11.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.855 14.112 -10.447 1.00 0.00 H new ATOM 1607 N HIS A 103 5.377 11.137 -4.653 1.00 0.00 N ATOM 1608 CA HIS A 103 5.620 11.673 -3.320 1.00 0.00 C ATOM 1609 C HIS A 103 6.349 10.654 -2.449 1.00 0.00 C ATOM 1610 O HIS A 103 7.035 11.017 -1.493 1.00 0.00 O ATOM 1611 CB HIS A 103 4.298 12.069 -2.660 1.00 0.00 C ATOM 1612 CG HIS A 103 4.427 13.210 -1.699 1.00 0.00 C ATOM 1613 ND1 HIS A 103 3.471 14.197 -1.570 1.00 0.00 N ATOM 1614 CD2 HIS A 103 5.406 13.519 -0.816 1.00 0.00 C ATOM 1615 CE1 HIS A 103 3.858 15.063 -0.650 1.00 0.00 C ATOM 1616 NE2 HIS A 103 5.028 14.675 -0.177 1.00 0.00 N ATOM 0 H HIS A 103 4.422 10.815 -4.809 1.00 0.00 H new ATOM 0 HA HIS A 103 6.250 12.557 -3.420 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.580 12.337 -3.435 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.891 11.206 -2.134 1.00 0.00 H new ATOM 0 HD2 HIS A 103 6.315 12.961 -0.646 1.00 0.00 H new ATOM 0 HE1 HIS A 103 3.310 15.940 -0.338 1.00 0.00 H new ATOM 0 HE2 HIS A 103 5.564 15.155 0.546 1.00 0.00 H new ATOM 1625 N PHE A 104 6.196 9.376 -2.785 1.00 0.00 N ATOM 1626 CA PHE A 104 6.840 8.305 -2.032 1.00 0.00 C ATOM 1627 C PHE A 104 8.228 7.990 -2.588 1.00 0.00 C ATOM 1628 O PHE A 104 8.845 6.997 -2.203 1.00 0.00 O ATOM 1629 CB PHE A 104 5.968 7.047 -2.062 1.00 0.00 C ATOM 1630 CG PHE A 104 4.807 7.085 -1.103 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.340 8.288 -0.594 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.180 5.912 -0.714 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.273 8.319 0.284 1.00 0.00 C ATOM 1634 CE2 PHE A 104 3.113 5.937 0.164 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.659 7.142 0.663 1.00 0.00 C ATOM 0 H PHE A 104 5.632 9.058 -3.573 1.00 0.00 H new ATOM 0 HA PHE A 104 6.958 8.641 -1.002 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.587 6.905 -3.073 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.589 6.181 -1.831 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.816 9.212 -0.887 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.530 4.967 -1.102 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.920 9.263 0.673 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.635 5.015 0.460 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.825 7.164 1.349 1.00 0.00 H new ATOM 1645 N ASN A 105 8.714 8.838 -3.495 1.00 0.00 N ATOM 1646 CA ASN A 105 10.029 8.655 -4.105 1.00 0.00 C ATOM 1647 C ASN A 105 10.260 7.201 -4.512 1.00 0.00 C ATOM 1648 O ASN A 105 11.389 6.712 -4.489 1.00 0.00 O ATOM 1649 CB ASN A 105 11.128 9.116 -3.144 1.00 0.00 C ATOM 1650 CG ASN A 105 11.232 8.240 -1.910 1.00 0.00 C ATOM 1651 OD1 ASN A 105 10.605 8.512 -0.886 1.00 0.00 O ATOM 1652 ND2 ASN A 105 12.028 7.181 -2.002 1.00 0.00 N ATOM 0 H ASN A 105 8.212 9.663 -3.824 1.00 0.00 H new ATOM 0 HA ASN A 105 10.065 9.264 -5.008 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.085 9.116 -3.666 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.931 10.144 -2.839 1.00 0.00 H new ATOM 0 HD21 ASN A 105 12.138 6.555 -1.204 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.529 6.993 -2.871 1.00 0.00 H new ATOM 1659 N VAL A 106 9.182 6.518 -4.886 1.00 0.00 N ATOM 1660 CA VAL A 106 9.269 5.121 -5.301 1.00 0.00 C ATOM 1661 C VAL A 106 10.303 4.939 -6.408 1.00 0.00 C ATOM 1662 O VAL A 106 10.038 5.234 -7.573 1.00 0.00 O ATOM 1663 CB VAL A 106 7.908 4.590 -5.794 1.00 0.00 C ATOM 1664 CG1 VAL A 106 7.993 3.101 -6.098 1.00 0.00 C ATOM 1665 CG2 VAL A 106 6.821 4.869 -4.767 1.00 0.00 C ATOM 0 H VAL A 106 8.240 6.908 -4.910 1.00 0.00 H new ATOM 0 HA VAL A 106 9.574 4.552 -4.423 1.00 0.00 H new ATOM 0 HB VAL A 106 7.649 5.112 -6.715 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.023 2.744 -6.445 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.740 2.930 -6.873 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.277 2.561 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.868 4.487 -5.133 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.073 4.377 -3.828 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.742 5.944 -4.603 1.00 0.00 H new ATOM 1675 N GLU A 107 11.482 4.452 -6.034 1.00 0.00 N ATOM 1676 CA GLU A 107 12.558 4.231 -6.995 1.00 0.00 C ATOM 1677 C GLU A 107 12.099 3.309 -8.119 1.00 0.00 C ATOM 1678 O GLU A 107 12.398 3.544 -9.290 1.00 0.00 O ATOM 1679 CB GLU A 107 13.780 3.633 -6.296 1.00 0.00 C ATOM 1680 CG GLU A 107 14.751 4.677 -5.769 1.00 0.00 C ATOM 1681 CD GLU A 107 16.198 4.318 -6.043 1.00 0.00 C ATOM 1682 OE1 GLU A 107 16.701 3.360 -5.419 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.830 4.995 -6.881 1.00 0.00 O ATOM 0 H GLU A 107 11.717 4.203 -5.073 1.00 0.00 H new ATOM 0 HA GLU A 107 12.831 5.194 -7.426 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.445 3.009 -5.467 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.305 2.981 -6.994 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.527 5.640 -6.227 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.606 4.793 -4.695 1.00 0.00 H new ATOM 1690 N SER A 108 11.367 2.261 -7.755 1.00 0.00 N ATOM 1691 CA SER A 108 10.862 1.302 -8.731 1.00 0.00 C ATOM 1692 C SER A 108 10.049 0.208 -8.049 1.00 0.00 C ATOM 1693 O SER A 108 10.254 -0.090 -6.871 1.00 0.00 O ATOM 1694 CB SER A 108 12.017 0.679 -9.516 1.00 0.00 C ATOM 1695 OG SER A 108 12.348 1.465 -10.648 1.00 0.00 O ATOM 0 H SER A 108 11.110 2.054 -6.790 1.00 0.00 H new ATOM 0 HA SER A 108 10.211 1.838 -9.422 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.889 0.582 -8.870 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.743 -0.327 -9.835 1.00 0.00 H new ATOM 0 HG SER A 108 12.434 2.404 -10.380 1.00 0.00 H new ATOM 1701 N ILE A 109 9.132 -0.391 -8.799 1.00 0.00 N ATOM 1702 CA ILE A 109 8.290 -1.459 -8.274 1.00 0.00 C ATOM 1703 C ILE A 109 8.970 -2.816 -8.438 1.00 0.00 C ATOM 1704 O ILE A 109 9.843 -2.979 -9.290 1.00 0.00 O ATOM 1705 CB ILE A 109 6.917 -1.490 -8.975 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.093 -1.455 -10.503 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.050 -0.335 -8.488 1.00 0.00 C ATOM 1708 CD1 ILE A 109 6.963 -0.075 -11.121 1.00 0.00 C ATOM 0 H ILE A 109 8.952 -0.155 -9.775 1.00 0.00 H new ATOM 0 HA ILE A 109 8.138 -1.256 -7.214 1.00 0.00 H new ATOM 0 HB ILE A 109 6.410 -2.421 -8.720 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.074 -1.860 -10.752 1.00 0.00 H new ATOM 0 HG13 ILE A 109 6.352 -2.113 -10.956 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.083 -0.368 -8.991 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.902 -0.420 -7.411 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.543 0.610 -8.713 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.101 -0.145 -12.200 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.973 0.328 -10.907 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.721 0.585 -10.700 1.00 0.00 H new ATOM 1720 N PRO A 110 8.584 -3.816 -7.622 1.00 0.00 N ATOM 1721 CA PRO A 110 7.548 -3.669 -6.592 1.00 0.00 C ATOM 1722 C PRO A 110 8.054 -2.945 -5.348 1.00 0.00 C ATOM 1723 O PRO A 110 9.254 -2.916 -5.078 1.00 0.00 O ATOM 1724 CB PRO A 110 7.196 -5.116 -6.254 1.00 0.00 C ATOM 1725 CG PRO A 110 8.456 -5.870 -6.497 1.00 0.00 C ATOM 1726 CD PRO A 110 9.138 -5.184 -7.651 1.00 0.00 C ATOM 0 HA PRO A 110 6.706 -3.071 -6.942 1.00 0.00 H new ATOM 0 HB2 PRO A 110 6.868 -5.214 -5.219 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.385 -5.485 -6.882 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.090 -5.865 -5.611 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.246 -6.913 -6.733 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.221 -5.180 -7.531 1.00 0.00 H new ATOM 0 HD3 PRO A 110 8.924 -5.683 -8.596 1.00 0.00 H new ATOM 1734 N THR A 111 7.126 -2.366 -4.590 1.00 0.00 N ATOM 1735 CA THR A 111 7.474 -1.648 -3.370 1.00 0.00 C ATOM 1736 C THR A 111 6.325 -1.699 -2.364 1.00 0.00 C ATOM 1737 O THR A 111 5.196 -2.049 -2.711 1.00 0.00 O ATOM 1738 CB THR A 111 7.847 -0.192 -3.694 1.00 0.00 C ATOM 1739 OG1 THR A 111 8.854 0.272 -2.813 1.00 0.00 O ATOM 1740 CG2 THR A 111 6.684 0.776 -3.608 1.00 0.00 C ATOM 0 H THR A 111 6.128 -2.381 -4.800 1.00 0.00 H new ATOM 0 HA THR A 111 8.339 -2.135 -2.920 1.00 0.00 H new ATOM 0 HB THR A 111 8.194 -0.215 -4.727 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.080 1.199 -3.034 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.029 1.781 -3.850 1.00 0.00 H new ATOM 0 HG22 THR A 111 5.909 0.478 -4.315 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.276 0.766 -2.597 1.00 0.00 H new ATOM 1748 N LEU A 112 6.615 -1.327 -1.123 1.00 0.00 N ATOM 1749 CA LEU A 112 5.593 -1.308 -0.068 1.00 0.00 C ATOM 1750 C LEU A 112 5.882 -0.180 0.917 1.00 0.00 C ATOM 1751 O LEU A 112 6.997 -0.060 1.416 1.00 0.00 O ATOM 1752 CB LEU A 112 5.495 -2.677 0.662 1.00 0.00 C ATOM 1753 CG LEU A 112 4.613 -2.732 1.925 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.395 -1.843 1.824 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.164 -4.148 2.217 1.00 0.00 C ATOM 0 H LEU A 112 7.543 -1.035 -0.817 1.00 0.00 H new ATOM 0 HA LEU A 112 4.625 -1.127 -0.536 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.118 -3.414 -0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.503 -2.987 0.938 1.00 0.00 H new ATOM 0 HG LEU A 112 5.237 -2.366 2.740 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.810 -1.921 2.741 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.710 -0.809 1.681 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.785 -2.157 0.977 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.544 -4.155 3.113 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.588 -4.528 1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.037 -4.781 2.375 1.00 0.00 H new ATOM 1767 N ILE A 113 4.885 0.661 1.177 1.00 0.00 N ATOM 1768 CA ILE A 113 5.061 1.786 2.092 1.00 0.00 C ATOM 1769 C ILE A 113 3.868 1.940 3.037 1.00 0.00 C ATOM 1770 O ILE A 113 2.755 1.523 2.717 1.00 0.00 O ATOM 1771 CB ILE A 113 5.279 3.100 1.311 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.531 2.983 0.436 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.400 4.276 2.267 1.00 0.00 C ATOM 1774 CD1 ILE A 113 6.909 4.267 -0.275 1.00 0.00 C ATOM 0 H ILE A 113 3.953 0.586 0.770 1.00 0.00 H new ATOM 0 HA ILE A 113 5.946 1.574 2.692 1.00 0.00 H new ATOM 0 HB ILE A 113 4.417 3.276 0.668 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.368 2.664 1.058 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.371 2.202 -0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.553 5.193 1.698 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.486 4.362 2.855 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.247 4.117 2.934 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.805 4.101 -0.873 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.091 4.577 -0.925 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.103 5.047 0.461 1.00 0.00 H new ATOM 1786 N GLY A 114 4.106 2.549 4.201 1.00 0.00 N ATOM 1787 CA GLY A 114 3.041 2.751 5.164 1.00 0.00 C ATOM 1788 C GLY A 114 2.914 4.202 5.587 1.00 0.00 C ATOM 1789 O GLY A 114 3.914 4.865 5.856 1.00 0.00 O ATOM 0 H GLY A 114 5.018 2.904 4.490 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.097 2.417 4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.227 2.134 6.043 1.00 0.00 H new ATOM 1793 N VAL A 115 1.681 4.698 5.648 1.00 0.00 N ATOM 1794 CA VAL A 115 1.433 6.071 6.041 1.00 0.00 C ATOM 1795 C VAL A 115 0.310 6.150 7.066 1.00 0.00 C ATOM 1796 O VAL A 115 -0.467 5.209 7.233 1.00 0.00 O ATOM 1797 CB VAL A 115 1.077 6.954 4.828 1.00 0.00 C ATOM 1798 CG1 VAL A 115 2.193 6.914 3.796 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.244 6.520 4.212 1.00 0.00 C ATOM 0 H VAL A 115 0.840 4.164 5.429 1.00 0.00 H new ATOM 0 HA VAL A 115 2.355 6.444 6.486 1.00 0.00 H new ATOM 0 HB VAL A 115 0.965 7.982 5.173 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.926 7.542 2.946 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.116 7.282 4.244 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.338 5.888 3.457 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.474 7.157 3.358 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.168 5.484 3.882 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.038 6.607 4.954 1.00 0.00 H new ATOM 1809 N ASP A 116 0.235 7.281 7.743 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.791 7.507 8.756 1.00 0.00 C ATOM 1811 C ASP A 116 -1.889 8.418 8.219 1.00 0.00 C ATOM 1812 O ASP A 116 -1.653 9.593 7.943 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.173 8.122 10.014 1.00 0.00 C ATOM 1814 CG ASP A 116 0.807 9.236 9.698 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.735 9.791 8.581 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.646 9.553 10.566 1.00 0.00 O ATOM 0 H ASP A 116 0.875 8.065 7.612 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.232 6.544 9.012 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -0.967 8.512 10.651 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.338 7.344 10.581 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.089 7.870 8.072 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.220 8.637 7.567 1.00 0.00 C ATOM 1823 C ALA A 117 -4.565 9.790 8.502 1.00 0.00 C ATOM 1824 O ALA A 117 -4.974 10.862 8.059 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.427 7.733 7.377 1.00 0.00 C ATOM 0 H ALA A 117 -3.304 6.898 8.295 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.938 9.058 6.602 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.265 8.319 6.999 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.184 6.946 6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.700 7.284 8.332 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.401 9.558 9.801 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.698 10.575 10.805 1.00 0.00 C ATOM 1833 C ASP A 118 -3.936 11.867 10.523 1.00 0.00 C ATOM 1834 O ASP A 118 -4.537 12.911 10.270 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.347 10.058 12.202 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.369 10.469 13.244 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -6.535 10.034 13.137 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -5.003 11.225 14.168 1.00 0.00 O ATOM 0 H ASP A 118 -4.064 8.674 10.183 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.766 10.790 10.759 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.275 8.971 12.177 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.366 10.436 12.490 1.00 0.00 H new ATOM 1843 N SER A 119 -2.610 11.790 10.570 1.00 0.00 N ATOM 1844 CA SER A 119 -1.768 12.955 10.319 1.00 0.00 C ATOM 1845 C SER A 119 -1.615 13.203 8.822 1.00 0.00 C ATOM 1846 O SER A 119 -1.694 14.342 8.360 1.00 0.00 O ATOM 1847 CB SER A 119 -0.392 12.763 10.960 1.00 0.00 C ATOM 1848 OG SER A 119 0.442 11.954 10.147 1.00 0.00 O ATOM 0 H SER A 119 -2.096 10.934 10.779 1.00 0.00 H new ATOM 0 HA SER A 119 -2.251 13.825 10.765 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.078 13.734 11.116 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.506 12.302 11.941 1.00 0.00 H new ATOM 0 HG SER A 119 1.315 11.848 10.578 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.395 12.130 8.071 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.234 12.249 6.633 1.00 0.00 C ATOM 1856 C GLY A 120 0.220 12.203 6.206 1.00 0.00 C ATOM 1857 O GLY A 120 0.546 11.664 5.148 1.00 0.00 O ATOM 0 H GLY A 120 -1.325 11.179 8.432 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.779 11.443 6.142 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.679 13.186 6.297 1.00 0.00 H new ATOM 1861 N ASP A 121 1.095 12.768 7.031 1.00 0.00 N ATOM 1862 CA ASP A 121 2.522 12.787 6.733 1.00 0.00 C ATOM 1863 C ASP A 121 3.064 11.370 6.582 1.00 0.00 C ATOM 1864 O ASP A 121 2.808 10.505 7.420 1.00 0.00 O ATOM 1865 CB ASP A 121 3.286 13.523 7.835 1.00 0.00 C ATOM 1866 CG ASP A 121 3.003 15.013 7.840 1.00 0.00 C ATOM 1867 OD1 ASP A 121 2.050 15.434 8.531 1.00 0.00 O ATOM 1868 OD2 ASP A 121 3.733 15.758 7.154 1.00 0.00 O ATOM 0 H ASP A 121 0.841 13.218 7.910 1.00 0.00 H new ATOM 0 HA ASP A 121 2.663 13.314 5.789 1.00 0.00 H new ATOM 0 HB2 ASP A 121 3.016 13.102 8.803 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.356 13.360 7.703 1.00 0.00 H new ATOM 1873 N VAL A 122 3.812 11.138 5.509 1.00 0.00 N ATOM 1874 CA VAL A 122 4.388 9.825 5.249 1.00 0.00 C ATOM 1875 C VAL A 122 5.252 9.361 6.416 1.00 0.00 C ATOM 1876 O VAL A 122 6.255 9.992 6.748 1.00 0.00 O ATOM 1877 CB VAL A 122 5.238 9.829 3.965 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.669 8.417 3.604 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.472 10.472 2.818 1.00 0.00 C ATOM 0 H VAL A 122 4.033 11.843 4.805 1.00 0.00 H new ATOM 0 HA VAL A 122 3.554 9.134 5.122 1.00 0.00 H new ATOM 0 HB VAL A 122 6.135 10.421 4.148 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.269 8.441 2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.261 7.998 4.418 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.787 7.798 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.089 10.465 1.920 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.556 9.911 2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.222 11.500 3.079 1.00 0.00 H new ATOM 1889 N VAL A 123 4.853 8.255 7.036 1.00 0.00 N ATOM 1890 CA VAL A 123 5.588 7.706 8.168 1.00 0.00 C ATOM 1891 C VAL A 123 6.699 6.772 7.704 1.00 0.00 C ATOM 1892 O VAL A 123 7.788 6.756 8.276 1.00 0.00 O ATOM 1893 CB VAL A 123 4.656 6.944 9.130 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.401 6.551 10.396 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.431 7.783 9.461 1.00 0.00 C ATOM 0 H VAL A 123 4.024 7.722 6.773 1.00 0.00 H new ATOM 0 HA VAL A 123 6.028 8.551 8.697 1.00 0.00 H new ATOM 0 HB VAL A 123 4.321 6.032 8.637 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.727 6.014 11.063 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.243 5.909 10.138 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.768 7.448 10.896 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.784 7.229 10.141 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.744 8.713 9.935 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.886 8.008 8.544 1.00 0.00 H new ATOM 1905 N THR A 124 6.422 6.001 6.659 1.00 0.00 N ATOM 1906 CA THR A 124 7.401 5.069 6.116 1.00 0.00 C ATOM 1907 C THR A 124 7.539 5.273 4.611 1.00 0.00 C ATOM 1908 O THR A 124 6.685 5.901 3.986 1.00 0.00 O ATOM 1909 CB THR A 124 7.005 3.612 6.419 1.00 0.00 C ATOM 1910 OG1 THR A 124 6.435 2.993 5.279 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.009 3.463 7.556 1.00 0.00 C ATOM 0 H THR A 124 5.526 6.003 6.171 1.00 0.00 H new ATOM 0 HA THR A 124 8.361 5.266 6.594 1.00 0.00 H new ATOM 0 HB THR A 124 7.939 3.133 6.714 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.193 2.068 5.496 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.783 2.407 7.705 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.436 3.875 8.470 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.093 3.999 7.310 1.00 0.00 H new ATOM 1919 N THR A 125 8.614 4.745 4.035 1.00 0.00 N ATOM 1920 CA THR A 125 8.849 4.877 2.600 1.00 0.00 C ATOM 1921 C THR A 125 9.780 3.782 2.084 1.00 0.00 C ATOM 1922 O THR A 125 10.618 4.026 1.216 1.00 0.00 O ATOM 1923 CB THR A 125 9.434 6.254 2.288 1.00 0.00 C ATOM 1924 OG1 THR A 125 10.596 6.494 3.062 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.462 7.382 2.554 1.00 0.00 C ATOM 0 H THR A 125 9.334 4.224 4.536 1.00 0.00 H new ATOM 0 HA THR A 125 7.891 4.769 2.092 1.00 0.00 H new ATOM 0 HB THR A 125 9.670 6.238 1.224 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.956 7.380 2.846 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.935 8.334 2.314 1.00 0.00 H new ATOM 0 HG22 THR A 125 7.575 7.251 1.935 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.175 7.375 3.606 1.00 0.00 H new ATOM 1933 N ARG A 126 9.619 2.573 2.615 1.00 0.00 N ATOM 1934 CA ARG A 126 10.434 1.432 2.204 1.00 0.00 C ATOM 1935 C ARG A 126 10.094 0.204 3.041 1.00 0.00 C ATOM 1936 O ARG A 126 10.967 -0.395 3.671 1.00 0.00 O ATOM 1937 CB ARG A 126 11.937 1.745 2.306 1.00 0.00 C ATOM 1938 CG ARG A 126 12.308 2.787 3.355 1.00 0.00 C ATOM 1939 CD ARG A 126 11.780 2.423 4.733 1.00 0.00 C ATOM 1940 NE ARG A 126 11.295 3.593 5.457 1.00 0.00 N ATOM 1941 CZ ARG A 126 10.935 3.573 6.736 1.00 0.00 C ATOM 1942 NH1 ARG A 126 11.016 2.450 7.438 1.00 0.00 N ATOM 1943 NH2 ARG A 126 10.493 4.681 7.316 1.00 0.00 N ATOM 0 H ARG A 126 8.929 2.357 3.334 1.00 0.00 H new ATOM 0 HA ARG A 126 10.205 1.224 1.159 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.471 0.821 2.529 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.288 2.090 1.333 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.392 2.888 3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.909 3.757 3.059 1.00 0.00 H new ATOM 0 HD2 ARG A 126 10.972 1.698 4.632 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.570 1.942 5.309 1.00 0.00 H new ATOM 0 HE ARG A 126 11.228 4.477 4.953 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.356 1.596 6.996 1.00 0.00 H new ATOM 0 HH12 ARG A 126 10.738 2.441 8.419 1.00 0.00 H new ATOM 0 HH21 ARG A 126 10.430 5.547 6.780 1.00 0.00 H new ATOM 0 HH22 ARG A 126 10.216 4.667 8.298 1.00 0.00 H new ATOM 1957 N ALA A 127 8.818 -0.168 3.043 1.00 0.00 N ATOM 1958 CA ALA A 127 8.356 -1.324 3.800 1.00 0.00 C ATOM 1959 C ALA A 127 8.727 -2.629 3.104 1.00 0.00 C ATOM 1960 O ALA A 127 8.492 -3.713 3.637 1.00 0.00 O ATOM 1961 CB ALA A 127 6.849 -1.245 4.030 1.00 0.00 C ATOM 0 H ALA A 127 8.084 0.317 2.527 1.00 0.00 H new ATOM 0 HA ALA A 127 8.857 -1.311 4.768 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.521 -2.116 4.597 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.613 -0.339 4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.335 -1.223 3.069 1.00 0.00 H new ATOM 1967 N ARG A 128 9.316 -2.524 1.916 1.00 0.00 N ATOM 1968 CA ARG A 128 9.721 -3.702 1.167 1.00 0.00 C ATOM 1969 C ARG A 128 10.753 -4.504 1.951 1.00 0.00 C ATOM 1970 O ARG A 128 10.710 -5.730 1.971 1.00 0.00 O ATOM 1971 CB ARG A 128 10.290 -3.302 -0.197 1.00 0.00 C ATOM 1972 CG ARG A 128 11.289 -2.156 -0.131 1.00 0.00 C ATOM 1973 CD ARG A 128 12.674 -2.594 -0.579 1.00 0.00 C ATOM 1974 NE ARG A 128 12.696 -2.983 -1.988 1.00 0.00 N ATOM 1975 CZ ARG A 128 13.770 -3.466 -2.607 1.00 0.00 C ATOM 1976 NH1 ARG A 128 14.911 -3.621 -1.947 1.00 0.00 N ATOM 1977 NH2 ARG A 128 13.703 -3.796 -3.889 1.00 0.00 N ATOM 0 H ARG A 128 9.521 -1.637 1.456 1.00 0.00 H new ATOM 0 HA ARG A 128 8.841 -4.325 1.008 1.00 0.00 H new ATOM 0 HB2 ARG A 128 10.774 -4.169 -0.647 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.468 -3.018 -0.855 1.00 0.00 H new ATOM 0 HG2 ARG A 128 10.945 -1.336 -0.761 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.340 -1.775 0.889 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.382 -1.781 -0.416 1.00 0.00 H new ATOM 0 HD3 ARG A 128 13.005 -3.432 0.034 1.00 0.00 H new ATOM 0 HE ARG A 128 11.837 -2.878 -2.528 1.00 0.00 H new ATOM 0 HH11 ARG A 128 14.968 -3.369 -0.960 1.00 0.00 H new ATOM 0 HH12 ARG A 128 15.731 -3.992 -2.427 1.00 0.00 H new ATOM 0 HH21 ARG A 128 12.828 -3.680 -4.401 1.00 0.00 H new ATOM 0 HH22 ARG A 128 14.526 -4.166 -4.364 1.00 0.00 H new ATOM 1991 N ALA A 129 11.681 -3.798 2.591 1.00 0.00 N ATOM 1992 CA ALA A 129 12.729 -4.434 3.380 1.00 0.00 C ATOM 1993 C ALA A 129 12.266 -4.744 4.802 1.00 0.00 C ATOM 1994 O ALA A 129 12.309 -5.889 5.250 1.00 0.00 O ATOM 1995 CB ALA A 129 13.957 -3.538 3.423 1.00 0.00 C ATOM 0 H ALA A 129 11.727 -2.779 2.577 1.00 0.00 H new ATOM 0 HA ALA A 129 12.976 -5.380 2.899 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.737 -4.018 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.321 -3.370 2.409 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.694 -2.582 3.877 1.00 0.00 H new ATOM 2001 N THR A 130 11.848 -3.700 5.508 1.00 0.00 N ATOM 2002 CA THR A 130 11.403 -3.801 6.878 1.00 0.00 C ATOM 2003 C THR A 130 10.347 -4.873 7.075 1.00 0.00 C ATOM 2004 O THR A 130 10.457 -5.698 7.980 1.00 0.00 O ATOM 2005 CB THR A 130 10.886 -2.442 7.322 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.929 -1.946 6.405 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.986 -1.408 7.454 1.00 0.00 C ATOM 0 H THR A 130 11.811 -2.752 5.134 1.00 0.00 H new ATOM 0 HA THR A 130 12.252 -4.101 7.493 1.00 0.00 H new ATOM 0 HB THR A 130 10.438 -2.602 8.303 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.028 -2.100 6.757 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.556 -0.459 7.774 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.714 -1.744 8.192 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.480 -1.277 6.491 1.00 0.00 H new ATOM 2015 N LEU A 131 9.328 -4.868 6.239 1.00 0.00 N ATOM 2016 CA LEU A 131 8.266 -5.853 6.355 1.00 0.00 C ATOM 2017 C LEU A 131 8.833 -7.270 6.391 1.00 0.00 C ATOM 2018 O LEU A 131 8.291 -8.146 7.067 1.00 0.00 O ATOM 2019 CB LEU A 131 7.289 -5.707 5.188 1.00 0.00 C ATOM 2020 CG LEU A 131 6.155 -6.733 5.162 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.808 -6.048 5.330 1.00 0.00 C ATOM 2022 CD2 LEU A 131 6.193 -7.532 3.867 1.00 0.00 C ATOM 0 H LEU A 131 9.211 -4.200 5.477 1.00 0.00 H new ATOM 0 HA LEU A 131 7.737 -5.676 7.291 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.854 -4.708 5.221 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.847 -5.781 4.255 1.00 0.00 H new ATOM 0 HG LEU A 131 6.293 -7.421 5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.015 -6.795 5.309 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.784 -5.521 6.284 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.658 -5.336 4.518 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.380 -8.258 3.863 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.080 -6.856 3.019 1.00 0.00 H new ATOM 0 HD23 LEU A 131 7.146 -8.055 3.790 1.00 0.00 H new ATOM 2034 N VAL A 132 9.927 -7.494 5.667 1.00 0.00 N ATOM 2035 CA VAL A 132 10.560 -8.800 5.625 1.00 0.00 C ATOM 2036 C VAL A 132 11.612 -8.952 6.716 1.00 0.00 C ATOM 2037 O VAL A 132 11.788 -10.029 7.286 1.00 0.00 O ATOM 2038 CB VAL A 132 11.232 -9.068 4.263 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.844 -10.437 3.724 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.910 -7.982 3.256 1.00 0.00 C ATOM 0 H VAL A 132 10.391 -6.783 5.102 1.00 0.00 H new ATOM 0 HA VAL A 132 9.761 -9.524 5.785 1.00 0.00 H new ATOM 0 HB VAL A 132 12.310 -9.057 4.425 1.00 0.00 H new ATOM 0 HG11 VAL A 132 11.331 -10.601 2.763 1.00 0.00 H new ATOM 0 HG12 VAL A 132 11.160 -11.208 4.427 1.00 0.00 H new ATOM 0 HG13 VAL A 132 9.763 -10.484 3.595 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.401 -8.206 2.309 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.832 -7.936 3.103 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.265 -7.022 3.630 1.00 0.00 H new ATOM 2050 N LYS A 133 12.351 -7.872 6.955 1.00 0.00 N ATOM 2051 CA LYS A 133 13.439 -7.882 7.922 1.00 0.00 C ATOM 2052 C LYS A 133 13.030 -7.329 9.288 1.00 0.00 C ATOM 2053 O LYS A 133 13.883 -6.965 10.097 1.00 0.00 O ATOM 2054 CB LYS A 133 14.615 -7.090 7.348 1.00 0.00 C ATOM 2055 CG LYS A 133 14.919 -7.434 5.896 1.00 0.00 C ATOM 2056 CD LYS A 133 15.975 -6.507 5.315 1.00 0.00 C ATOM 2057 CE LYS A 133 16.512 -7.034 3.994 1.00 0.00 C ATOM 2058 NZ LYS A 133 17.172 -8.359 4.151 1.00 0.00 N ATOM 0 H LYS A 133 12.213 -6.976 6.488 1.00 0.00 H new ATOM 0 HA LYS A 133 13.727 -8.919 8.093 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.399 -6.024 7.424 1.00 0.00 H new ATOM 0 HB3 LYS A 133 15.502 -7.279 7.953 1.00 0.00 H new ATOM 0 HG2 LYS A 133 15.263 -8.466 5.829 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.006 -7.363 5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.548 -5.515 5.166 1.00 0.00 H new ATOM 0 HD3 LYS A 133 16.795 -6.397 6.025 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.695 -7.118 3.278 1.00 0.00 H new ATOM 0 HE3 LYS A 133 17.225 -6.320 3.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 17.843 -8.507 3.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 17.683 -8.387 5.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 16.452 -9.109 4.136 1.00 0.00 H new ATOM 2072 N ASP A 134 11.729 -7.291 9.551 1.00 0.00 N ATOM 2073 CA ASP A 134 11.221 -6.807 10.835 1.00 0.00 C ATOM 2074 C ASP A 134 10.285 -7.840 11.460 1.00 0.00 C ATOM 2075 O ASP A 134 9.068 -7.659 11.476 1.00 0.00 O ATOM 2076 CB ASP A 134 10.487 -5.472 10.671 1.00 0.00 C ATOM 2077 CG ASP A 134 11.395 -4.367 10.167 1.00 0.00 C ATOM 2078 OD1 ASP A 134 12.467 -4.684 9.611 1.00 0.00 O ATOM 2079 OD2 ASP A 134 11.032 -3.183 10.328 1.00 0.00 O ATOM 0 H ASP A 134 11.006 -7.588 8.896 1.00 0.00 H new ATOM 0 HA ASP A 134 12.075 -6.651 11.495 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.657 -5.601 9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.058 -5.177 11.629 1.00 0.00 H new ATOM 2084 N PRO A 135 10.847 -8.950 11.970 1.00 0.00 N ATOM 2085 CA PRO A 135 10.064 -10.025 12.581 1.00 0.00 C ATOM 2086 C PRO A 135 9.738 -9.777 14.053 1.00 0.00 C ATOM 2087 O PRO A 135 9.322 -10.694 14.761 1.00 0.00 O ATOM 2088 CB PRO A 135 10.993 -11.226 12.439 1.00 0.00 C ATOM 2089 CG PRO A 135 12.365 -10.652 12.543 1.00 0.00 C ATOM 2090 CD PRO A 135 12.291 -9.255 11.974 1.00 0.00 C ATOM 0 HA PRO A 135 9.089 -10.139 12.107 1.00 0.00 H new ATOM 0 HB2 PRO A 135 10.811 -11.963 13.221 1.00 0.00 H new ATOM 0 HB3 PRO A 135 10.845 -11.731 11.484 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.699 -10.631 13.580 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.082 -11.259 11.990 1.00 0.00 H new ATOM 0 HD2 PRO A 135 12.848 -8.545 12.585 1.00 0.00 H new ATOM 0 HD3 PRO A 135 12.712 -9.210 10.970 1.00 0.00 H new ATOM 2098 N GLU A 136 9.921 -8.543 14.515 1.00 0.00 N ATOM 2099 CA GLU A 136 9.636 -8.206 15.900 1.00 0.00 C ATOM 2100 C GLU A 136 8.475 -7.223 15.986 1.00 0.00 C ATOM 2101 O GLU A 136 7.766 -7.170 16.989 1.00 0.00 O ATOM 2102 CB GLU A 136 10.876 -7.608 16.566 1.00 0.00 C ATOM 2103 CG GLU A 136 12.118 -8.472 16.422 1.00 0.00 C ATOM 2104 CD GLU A 136 12.073 -9.710 17.295 1.00 0.00 C ATOM 2105 OE1 GLU A 136 11.452 -9.651 18.377 1.00 0.00 O ATOM 2106 OE2 GLU A 136 12.659 -10.738 16.898 1.00 0.00 O ATOM 0 H GLU A 136 10.264 -7.765 13.951 1.00 0.00 H new ATOM 0 HA GLU A 136 9.358 -9.120 16.424 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.073 -6.627 16.134 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.671 -7.454 17.625 1.00 0.00 H new ATOM 0 HG2 GLU A 136 12.229 -8.771 15.380 1.00 0.00 H new ATOM 0 HG3 GLU A 136 12.998 -7.882 16.680 1.00 0.00 H new ATOM 2113 N GLY A 137 8.292 -6.436 14.927 1.00 0.00 N ATOM 2114 CA GLY A 137 7.224 -5.459 14.911 1.00 0.00 C ATOM 2115 C GLY A 137 7.322 -4.494 16.074 1.00 0.00 C ATOM 2116 O GLY A 137 6.341 -3.853 16.445 1.00 0.00 O ATOM 0 H GLY A 137 8.865 -6.460 14.083 1.00 0.00 H new ATOM 0 HA2 GLY A 137 7.255 -4.903 13.974 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.263 -5.972 14.945 1.00 0.00 H new ATOM 2120 N GLU A 138 8.517 -4.398 16.655 1.00 0.00 N ATOM 2121 CA GLU A 138 8.739 -3.509 17.791 1.00 0.00 C ATOM 2122 C GLU A 138 8.605 -2.040 17.388 1.00 0.00 C ATOM 2123 O GLU A 138 8.482 -1.164 18.245 1.00 0.00 O ATOM 2124 CB GLU A 138 10.115 -3.770 18.417 1.00 0.00 C ATOM 2125 CG GLU A 138 11.291 -3.317 17.563 1.00 0.00 C ATOM 2126 CD GLU A 138 12.562 -4.084 17.870 1.00 0.00 C ATOM 2127 OE1 GLU A 138 12.945 -4.147 19.057 1.00 0.00 O ATOM 2128 OE2 GLU A 138 13.174 -4.620 16.923 1.00 0.00 O ATOM 0 H GLU A 138 9.341 -4.922 16.359 1.00 0.00 H new ATOM 0 HA GLU A 138 7.969 -3.721 18.533 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.164 -3.262 19.380 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.215 -4.837 18.614 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.040 -3.443 16.510 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.465 -2.253 17.725 1.00 0.00 H new ATOM 2135 N GLN A 139 8.627 -1.773 16.084 1.00 0.00 N ATOM 2136 CA GLN A 139 8.507 -0.415 15.577 1.00 0.00 C ATOM 2137 C GLN A 139 7.674 -0.390 14.301 1.00 0.00 C ATOM 2138 O GLN A 139 7.816 0.515 13.491 1.00 0.00 O ATOM 2139 CB GLN A 139 9.894 0.151 15.270 1.00 0.00 C ATOM 2140 CG GLN A 139 11.023 -0.436 16.109 1.00 0.00 C ATOM 2141 CD GLN A 139 12.207 0.504 16.228 1.00 0.00 C ATOM 2142 OE1 GLN A 139 12.241 1.368 17.104 1.00 0.00 O ATOM 2143 NE2 GLN A 139 13.183 0.339 15.345 1.00 0.00 N ATOM 0 H GLN A 139 8.727 -2.484 15.360 1.00 0.00 H new ATOM 0 HA GLN A 139 8.017 0.190 16.340 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.116 -0.020 14.217 1.00 0.00 H new ATOM 0 HB3 GLN A 139 9.872 1.230 15.420 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.647 -0.670 17.105 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.352 -1.375 15.664 1.00 0.00 H new ATOM 0 HE21 GLN A 139 13.111 -0.391 14.636 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.005 0.942 15.375 1.00 0.00 H new ATOM 2152 N PHE A 140 6.828 -1.408 14.130 1.00 0.00 N ATOM 2153 CA PHE A 140 5.970 -1.559 12.941 1.00 0.00 C ATOM 2154 C PHE A 140 5.848 -0.304 12.090 1.00 0.00 C ATOM 2155 O PHE A 140 6.203 -0.334 10.913 1.00 0.00 O ATOM 2156 CB PHE A 140 4.606 -2.114 13.333 1.00 0.00 C ATOM 2157 CG PHE A 140 3.597 -2.124 12.219 1.00 0.00 C ATOM 2158 CD1 PHE A 140 3.969 -2.475 10.931 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.275 -1.789 12.463 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.043 -2.491 9.907 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.343 -1.804 11.443 1.00 0.00 C ATOM 2162 CZ PHE A 140 1.727 -2.154 10.163 1.00 0.00 C ATOM 0 H PHE A 140 6.714 -2.157 14.813 1.00 0.00 H new ATOM 0 HA PHE A 140 6.473 -2.279 12.296 1.00 0.00 H new ATOM 0 HB2 PHE A 140 4.733 -3.132 13.701 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.211 -1.524 14.160 1.00 0.00 H new ATOM 0 HD1 PHE A 140 4.996 -2.739 10.726 1.00 0.00 H new ATOM 0 HD2 PHE A 140 1.970 -1.513 13.461 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.346 -2.766 8.908 1.00 0.00 H new ATOM 0 HE2 PHE A 140 0.315 -1.542 11.646 1.00 0.00 H new ATOM 0 HZ PHE A 140 1.001 -2.164 9.364 1.00 0.00 H new ATOM 2172 N PRO A 141 5.381 0.826 12.635 1.00 0.00 N ATOM 2173 CA PRO A 141 5.289 2.053 11.846 1.00 0.00 C ATOM 2174 C PRO A 141 6.658 2.473 11.300 1.00 0.00 C ATOM 2175 O PRO A 141 6.789 3.541 10.703 1.00 0.00 O ATOM 2176 CB PRO A 141 4.765 3.095 12.840 1.00 0.00 C ATOM 2177 CG PRO A 141 5.017 2.510 14.191 1.00 0.00 C ATOM 2178 CD PRO A 141 4.937 1.018 14.023 1.00 0.00 C ATOM 0 HA PRO A 141 4.646 1.933 10.974 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.282 4.047 12.721 1.00 0.00 H new ATOM 0 HB3 PRO A 141 3.703 3.287 12.686 1.00 0.00 H new ATOM 0 HG2 PRO A 141 5.996 2.807 14.568 1.00 0.00 H new ATOM 0 HG3 PRO A 141 4.278 2.861 14.911 1.00 0.00 H new ATOM 0 HD2 PRO A 141 5.581 0.496 14.730 1.00 0.00 H new ATOM 0 HD3 PRO A 141 3.924 0.646 14.179 1.00 0.00 H new ATOM 2186 N TRP A 142 7.670 1.610 11.520 1.00 0.00 N ATOM 2187 CA TRP A 142 9.052 1.833 11.077 1.00 0.00 C ATOM 2188 C TRP A 142 9.255 3.213 10.466 1.00 0.00 C ATOM 2189 O TRP A 142 9.500 3.352 9.269 1.00 0.00 O ATOM 2190 CB TRP A 142 9.466 0.734 10.091 1.00 0.00 C ATOM 2191 CG TRP A 142 8.893 -0.608 10.445 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.904 -1.205 11.675 1.00 0.00 C ATOM 2193 CD2 TRP A 142 8.221 -1.516 9.564 1.00 0.00 C ATOM 2194 NE1 TRP A 142 8.258 -2.417 11.617 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.838 -2.633 10.330 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.899 -1.489 8.204 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 7.150 -3.712 9.781 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 7.219 -2.562 7.660 1.00 0.00 C ATOM 2199 CH2 TRP A 142 6.851 -3.661 8.448 1.00 0.00 C ATOM 0 H TRP A 142 7.544 0.728 12.017 1.00 0.00 H new ATOM 0 HA TRP A 142 9.691 1.788 11.959 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.141 1.010 9.088 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.554 0.665 10.066 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.354 -0.786 12.562 1.00 0.00 H new ATOM 0 HE1 TRP A 142 8.115 -3.052 12.403 1.00 0.00 H new ATOM 0 HE3 TRP A 142 8.177 -0.645 7.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 6.863 -4.559 10.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 6.967 -2.554 6.610 1.00 0.00 H new ATOM 0 HH2 TRP A 142 6.320 -4.484 7.993 1.00 0.00 H new ATOM 2210 N LYS A 143 9.140 4.229 11.311 1.00 0.00 N ATOM 2211 CA LYS A 143 9.302 5.613 10.878 1.00 0.00 C ATOM 2212 C LYS A 143 10.757 5.917 10.534 1.00 0.00 C ATOM 2213 O LYS A 143 11.627 5.056 10.662 1.00 0.00 O ATOM 2214 CB LYS A 143 8.812 6.569 11.968 1.00 0.00 C ATOM 2215 CG LYS A 143 9.525 6.393 13.299 1.00 0.00 C ATOM 2216 CD LYS A 143 10.713 7.334 13.423 1.00 0.00 C ATOM 2217 CE LYS A 143 11.053 7.617 14.879 1.00 0.00 C ATOM 2218 NZ LYS A 143 11.077 9.078 15.170 1.00 0.00 N ATOM 0 H LYS A 143 8.934 4.121 12.304 1.00 0.00 H new ATOM 0 HA LYS A 143 8.702 5.756 9.979 1.00 0.00 H new ATOM 0 HB2 LYS A 143 8.947 7.595 11.626 1.00 0.00 H new ATOM 0 HB3 LYS A 143 7.742 6.420 12.116 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.826 6.578 14.115 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.864 5.362 13.398 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.578 6.896 12.925 1.00 0.00 H new ATOM 0 HD3 LYS A 143 10.491 8.271 12.912 1.00 0.00 H new ATOM 0 HE2 LYS A 143 10.321 7.130 15.524 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.025 7.184 15.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 11.312 9.229 16.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 11.793 9.539 14.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 10.142 9.487 14.969 1.00 0.00 H new