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 34 TYR OH : rot 163:sc= 1.52 USER MOD Set 1.2: A 36 SER OG : rot -165:sc= 1.96 USER MOD Set 1.3: A 47 THR OG1 : rot 180:sc= 0.0158 USER MOD Set 1.4: A 80 TYR OH : rot 97:sc= 0.747 USER MOD Single : A 6 LYS NZ :NH3+ 169:sc= -0.251 (180deg=-0.328) USER MOD Single : A 7 TYR OH : rot 166:sc= -1.63! USER MOD Single : A 13 LYS NZ :NH3+ 159:sc= -0.106 (180deg=-0.579) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 85:sc= 0.0791 USER MOD Single : A 29 LYS NZ :NH3+ -116:sc= -0.204 (180deg=-1.17) USER MOD Single : A 38 SER OG : rot -56:sc= 0.247 USER MOD Single : A 49 GLN : amide:sc= -2.08 K(o=-2.1,f=-1) USER MOD Single : A 54 TYR OH : rot -141:sc= 1.28 USER MOD Single : A 56 LYS NZ :NH3+ 162:sc= -0.016 (180deg=-0.15) USER MOD Single : A 58 HIS : no HD1:sc= -6 K(o=-6,f=-3.6!) USER MOD Single : A 60 SER OG : rot -154:sc= 0.371 USER MOD Single : A 61 LYS NZ :NH3+ 159:sc= -1.64! (180deg=-1.67!) USER MOD Single : A 62 ASN : amide:sc= -4.6 K(o=-4.6,f=-6!) USER MOD Single : A 68 CYS SG : rot 169:sc= -0.582 USER MOD Single : A 69 THR OG1 : rot 126:sc= 1.18 USER MOD Single : A 83 LYS NZ :NH3+ 162:sc= -0.0133 (180deg=-0.177) USER MOD Single : A 84 MET CE :methyl -134:sc= -11! (180deg=-17.7!) USER MOD Single : A 93 GLN : amide:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.078 X(o=-0.078,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 173:sc= -0.324 (180deg=-0.382) USER MOD Single : A 101 SER OG : rot -84:sc= -0.063 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.244 X(o=-0.24,f=-0.65) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 114:sc= 0.263 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ -108:sc=-0.00334 (180deg=-0.357) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -4.478 10.320 3.763 1.00 0.00 N ATOM 22 CA LEU A 4 -4.543 9.608 2.493 1.00 0.00 C ATOM 23 C LEU A 4 -5.106 10.504 1.395 1.00 0.00 C ATOM 24 O LEU A 4 -4.748 10.370 0.225 1.00 0.00 O ATOM 25 CB LEU A 4 -5.409 8.350 2.633 1.00 0.00 C ATOM 26 CG LEU A 4 -4.912 7.285 3.629 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.621 5.974 2.911 1.00 0.00 C ATOM 28 CD2 LEU A 4 -3.677 7.752 4.391 1.00 0.00 C ATOM 0 HA LEU A 4 -3.530 9.316 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.411 8.657 2.932 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.498 7.885 1.651 1.00 0.00 H new ATOM 0 HG LEU A 4 -5.709 7.124 4.355 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.271 5.235 3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.531 5.612 2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.853 6.136 2.155 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.359 6.972 5.082 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.872 7.962 3.686 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -3.915 8.657 4.950 1.00 0.00 H new ATOM 40 N ASP A 5 -5.994 11.414 1.782 1.00 0.00 N ATOM 41 CA ASP A 5 -6.614 12.331 0.833 1.00 0.00 C ATOM 42 C ASP A 5 -5.736 13.555 0.586 1.00 0.00 C ATOM 43 O ASP A 5 -5.853 14.213 -0.448 1.00 0.00 O ATOM 44 CB ASP A 5 -7.983 12.774 1.347 1.00 0.00 C ATOM 45 CG ASP A 5 -8.931 11.607 1.550 1.00 0.00 C ATOM 46 OD1 ASP A 5 -8.445 10.462 1.667 1.00 0.00 O ATOM 47 OD2 ASP A 5 -10.158 11.839 1.589 1.00 0.00 O ATOM 0 H ASP A 5 -6.300 11.536 2.747 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.734 11.801 -0.112 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -7.859 13.306 2.290 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -8.423 13.477 0.640 1.00 0.00 H new ATOM 52 N LYS A 6 -4.861 13.861 1.541 1.00 0.00 N ATOM 53 CA LYS A 6 -3.973 15.016 1.415 1.00 0.00 C ATOM 54 C LYS A 6 -3.185 14.961 0.109 1.00 0.00 C ATOM 55 O LYS A 6 -2.834 15.996 -0.456 1.00 0.00 O ATOM 56 CB LYS A 6 -3.005 15.103 2.600 1.00 0.00 C ATOM 57 CG LYS A 6 -2.019 13.947 2.669 1.00 0.00 C ATOM 58 CD LYS A 6 -0.604 14.402 2.351 1.00 0.00 C ATOM 59 CE LYS A 6 0.302 13.222 2.033 1.00 0.00 C ATOM 60 NZ LYS A 6 0.461 13.024 0.566 1.00 0.00 N ATOM 0 H LYS A 6 -4.747 13.330 2.405 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.600 15.908 1.411 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.450 16.039 2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.580 15.135 3.526 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.045 13.504 3.665 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.319 13.169 1.967 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.623 15.087 1.503 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -0.199 14.955 3.199 1.00 0.00 H new ATOM 0 HE2 LYS A 6 1.280 13.383 2.486 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.111 12.317 2.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 1.223 12.339 0.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.429 12.664 0.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 0.700 13.931 0.117 1.00 0.00 H new ATOM 74 N TYR A 7 -2.913 13.749 -0.372 1.00 0.00 N ATOM 75 CA TYR A 7 -2.171 13.579 -1.618 1.00 0.00 C ATOM 76 C TYR A 7 -2.861 14.326 -2.758 1.00 0.00 C ATOM 77 O TYR A 7 -2.418 15.398 -3.170 1.00 0.00 O ATOM 78 CB TYR A 7 -2.030 12.090 -1.973 1.00 0.00 C ATOM 79 CG TYR A 7 -1.612 11.846 -3.407 1.00 0.00 C ATOM 80 CD1 TYR A 7 -0.707 12.692 -4.038 1.00 0.00 C ATOM 81 CD2 TYR A 7 -2.125 10.778 -4.130 1.00 0.00 C ATOM 82 CE1 TYR A 7 -0.327 12.480 -5.349 1.00 0.00 C ATOM 83 CE2 TYR A 7 -1.752 10.561 -5.443 1.00 0.00 C ATOM 84 CZ TYR A 7 -0.851 11.414 -6.048 1.00 0.00 C ATOM 85 OH TYR A 7 -0.476 11.205 -7.355 1.00 0.00 O ATOM 0 H TYR A 7 -3.193 12.878 0.078 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.174 13.996 -1.476 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -1.297 11.634 -1.307 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.981 11.590 -1.790 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.294 13.529 -3.494 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.827 10.106 -3.659 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.378 13.147 -5.824 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.164 9.728 -5.993 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.754 10.308 -7.636 1.00 0.00 H new ATOM 135 N ILE A 11 -9.626 10.002 -5.074 1.00 0.00 N ATOM 136 CA ILE A 11 -9.731 8.568 -4.819 1.00 0.00 C ATOM 137 C ILE A 11 -11.167 8.179 -4.470 1.00 0.00 C ATOM 138 O ILE A 11 -11.651 7.122 -4.874 1.00 0.00 O ATOM 139 CB ILE A 11 -8.787 8.125 -3.681 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.342 8.547 -3.981 1.00 0.00 C ATOM 141 CG2 ILE A 11 -8.868 6.618 -3.477 1.00 0.00 C ATOM 142 CD1 ILE A 11 -6.876 8.187 -5.379 1.00 0.00 C ATOM 0 HA ILE A 11 -9.434 8.058 -5.735 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.105 8.617 -2.762 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.253 9.625 -3.845 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.678 8.078 -3.255 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.196 6.323 -2.671 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.890 6.340 -3.218 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.576 6.110 -4.396 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.846 8.517 -5.516 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.932 7.107 -5.514 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.515 8.678 -6.113 1.00 0.00 H new ATOM 154 N GLU A 12 -11.845 9.050 -3.727 1.00 0.00 N ATOM 155 CA GLU A 12 -13.230 8.812 -3.332 1.00 0.00 C ATOM 156 C GLU A 12 -13.360 7.574 -2.447 1.00 0.00 C ATOM 157 O GLU A 12 -13.484 7.683 -1.228 1.00 0.00 O ATOM 158 CB GLU A 12 -14.115 8.664 -4.573 1.00 0.00 C ATOM 159 CG GLU A 12 -14.794 9.957 -4.993 1.00 0.00 C ATOM 160 CD GLU A 12 -14.886 10.105 -6.499 1.00 0.00 C ATOM 161 OE1 GLU A 12 -15.682 9.369 -7.120 1.00 0.00 O ATOM 162 OE2 GLU A 12 -14.162 10.955 -7.058 1.00 0.00 O ATOM 0 H GLU A 12 -11.456 9.929 -3.386 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.561 9.673 -2.752 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -13.508 8.297 -5.400 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -14.877 7.910 -4.378 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.796 9.992 -4.566 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.243 10.803 -4.582 1.00 0.00 H new ATOM 169 N LYS A 13 -13.345 6.399 -3.068 1.00 0.00 N ATOM 170 CA LYS A 13 -13.474 5.142 -2.333 1.00 0.00 C ATOM 171 C LYS A 13 -12.405 4.142 -2.761 1.00 0.00 C ATOM 172 O LYS A 13 -11.735 4.327 -3.778 1.00 0.00 O ATOM 173 CB LYS A 13 -14.863 4.540 -2.551 1.00 0.00 C ATOM 174 CG LYS A 13 -15.993 5.420 -2.042 1.00 0.00 C ATOM 175 CD LYS A 13 -17.217 5.333 -2.939 1.00 0.00 C ATOM 176 CE LYS A 13 -17.944 4.009 -2.765 1.00 0.00 C ATOM 177 NZ LYS A 13 -18.417 3.816 -1.366 1.00 0.00 N ATOM 0 H LYS A 13 -13.245 6.289 -4.077 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.338 5.359 -1.273 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.008 4.357 -3.616 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.913 3.573 -2.051 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.261 5.119 -1.029 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.653 6.454 -1.988 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.896 6.155 -2.710 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.915 5.449 -3.980 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -18.795 3.970 -3.445 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.279 3.190 -3.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.186 3.116 -1.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.630 3.476 -0.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.766 4.721 -0.990 1.00 0.00 H new ATOM 191 N LEU A 14 -12.251 3.082 -1.973 1.00 0.00 N ATOM 192 CA LEU A 14 -11.264 2.048 -2.260 1.00 0.00 C ATOM 193 C LEU A 14 -11.920 0.829 -2.905 1.00 0.00 C ATOM 194 O LEU A 14 -13.143 0.685 -2.884 1.00 0.00 O ATOM 195 CB LEU A 14 -10.540 1.635 -0.978 1.00 0.00 C ATOM 196 CG LEU A 14 -9.477 2.620 -0.489 1.00 0.00 C ATOM 197 CD1 LEU A 14 -8.778 2.080 0.748 1.00 0.00 C ATOM 198 CD2 LEU A 14 -8.469 2.904 -1.593 1.00 0.00 C ATOM 0 H LEU A 14 -12.799 2.917 -1.129 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.539 2.459 -2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.279 1.500 -0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.068 0.666 -1.141 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.969 3.556 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.025 2.794 1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.509 1.927 1.541 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.297 1.131 0.509 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.719 3.607 -1.229 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.982 1.975 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.983 3.334 -2.453 1.00 0.00 H new ATOM 210 N ARG A 15 -11.096 -0.043 -3.477 1.00 0.00 N ATOM 211 CA ARG A 15 -11.581 -1.244 -4.128 1.00 0.00 C ATOM 212 C ARG A 15 -11.461 -2.444 -3.210 1.00 0.00 C ATOM 213 O ARG A 15 -10.386 -3.015 -3.028 1.00 0.00 O ATOM 214 CB ARG A 15 -10.821 -1.520 -5.417 1.00 0.00 C ATOM 215 CG ARG A 15 -10.962 -0.421 -6.460 1.00 0.00 C ATOM 216 CD ARG A 15 -11.376 -0.983 -7.811 1.00 0.00 C ATOM 217 NE ARG A 15 -12.525 -1.881 -7.701 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.096 -2.484 -8.741 1.00 0.00 C ATOM 219 NH1 ARG A 15 -12.631 -2.288 -9.969 1.00 0.00 N ATOM 220 NH2 ARG A 15 -14.135 -3.285 -8.554 1.00 0.00 N ATOM 0 H ARG A 15 -10.082 0.066 -3.500 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.631 -1.078 -4.367 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.765 -1.653 -5.184 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.174 -2.459 -5.842 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -11.702 0.306 -6.126 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.015 0.110 -6.560 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -11.620 -0.163 -8.486 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.537 -1.520 -8.253 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.911 -2.055 -6.773 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.832 -1.672 -10.119 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.073 -2.753 -10.762 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.497 -3.439 -7.613 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.573 -3.747 -9.351 1.00 0.00 H new ATOM 234 N ARG A 16 -12.586 -2.808 -2.647 1.00 0.00 N ATOM 235 CA ARG A 16 -12.675 -3.946 -1.737 1.00 0.00 C ATOM 236 C ARG A 16 -12.983 -5.226 -2.505 1.00 0.00 C ATOM 237 O ARG A 16 -13.056 -5.221 -3.735 1.00 0.00 O ATOM 238 CB ARG A 16 -13.761 -3.702 -0.686 1.00 0.00 C ATOM 239 CG ARG A 16 -13.264 -2.980 0.554 1.00 0.00 C ATOM 240 CD ARG A 16 -12.184 -3.776 1.269 1.00 0.00 C ATOM 241 NE ARG A 16 -12.593 -5.157 1.513 1.00 0.00 N ATOM 242 CZ ARG A 16 -13.463 -5.517 2.454 1.00 0.00 C ATOM 243 NH1 ARG A 16 -14.016 -4.601 3.241 1.00 0.00 N ATOM 244 NH2 ARG A 16 -13.782 -6.794 2.608 1.00 0.00 N ATOM 0 H ARG A 16 -13.473 -2.329 -2.801 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.712 -4.058 -1.238 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -14.565 -3.119 -1.136 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -14.189 -4.660 -0.390 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -12.871 -2.003 0.274 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -14.098 -2.806 1.233 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.272 -3.768 0.672 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -11.947 -3.295 2.218 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.188 -5.888 0.928 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -13.775 -3.617 3.126 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -14.682 -4.882 3.961 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -13.361 -7.501 2.005 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -14.449 -7.070 3.329 1.00 0.00 H new ATOM 258 N GLY A 17 -13.169 -6.319 -1.775 1.00 0.00 N ATOM 259 CA GLY A 17 -13.473 -7.588 -2.408 1.00 0.00 C ATOM 260 C GLY A 17 -14.903 -7.647 -2.911 1.00 0.00 C ATOM 261 O GLY A 17 -15.180 -7.288 -4.056 1.00 0.00 O ATOM 0 H GLY A 17 -13.115 -6.349 -0.757 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.789 -7.750 -3.241 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.306 -8.397 -1.697 1.00 0.00 H new ATOM 265 N ASP A 18 -15.812 -8.099 -2.053 1.00 0.00 N ATOM 266 CA ASP A 18 -17.218 -8.208 -2.407 1.00 0.00 C ATOM 267 C ASP A 18 -17.726 -6.926 -3.064 1.00 0.00 C ATOM 268 O ASP A 18 -18.544 -6.969 -3.983 1.00 0.00 O ATOM 269 CB ASP A 18 -18.055 -8.523 -1.165 1.00 0.00 C ATOM 270 CG ASP A 18 -17.969 -7.431 -0.118 1.00 0.00 C ATOM 271 OD1 ASP A 18 -18.538 -6.343 -0.347 1.00 0.00 O ATOM 272 OD2 ASP A 18 -17.333 -7.663 0.932 1.00 0.00 O ATOM 0 H ASP A 18 -15.595 -8.397 -1.102 1.00 0.00 H new ATOM 0 HA ASP A 18 -17.319 -9.022 -3.125 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -19.096 -8.661 -1.457 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.718 -9.465 -0.732 1.00 0.00 H new ATOM 277 N GLY A 19 -17.234 -5.789 -2.585 1.00 0.00 N ATOM 278 CA GLY A 19 -17.648 -4.510 -3.134 1.00 0.00 C ATOM 279 C GLY A 19 -16.643 -3.407 -2.864 1.00 0.00 C ATOM 280 O GLY A 19 -15.451 -3.566 -3.130 1.00 0.00 O ATOM 0 H GLY A 19 -16.555 -5.729 -1.826 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.792 -4.610 -4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -18.612 -4.231 -2.708 1.00 0.00 H new ATOM 284 N GLU A 20 -17.124 -2.286 -2.337 1.00 0.00 N ATOM 285 CA GLU A 20 -16.260 -1.150 -2.033 1.00 0.00 C ATOM 286 C GLU A 20 -16.597 -0.559 -0.666 1.00 0.00 C ATOM 287 O GLU A 20 -17.732 -0.655 -0.200 1.00 0.00 O ATOM 288 CB GLU A 20 -16.396 -0.075 -3.113 1.00 0.00 C ATOM 289 CG GLU A 20 -15.401 -0.228 -4.251 1.00 0.00 C ATOM 290 CD GLU A 20 -16.023 -0.835 -5.494 1.00 0.00 C ATOM 291 OE1 GLU A 20 -16.180 -2.073 -5.535 1.00 0.00 O ATOM 292 OE2 GLU A 20 -16.354 -0.071 -6.425 1.00 0.00 O ATOM 0 H GLU A 20 -18.108 -2.139 -2.111 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.230 -1.506 -2.011 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -17.407 -0.105 -3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.265 0.906 -2.656 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.984 0.749 -4.498 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.572 -0.854 -3.922 1.00 0.00 H new ATOM 299 N VAL A 21 -15.603 0.056 -0.031 1.00 0.00 N ATOM 300 CA VAL A 21 -15.800 0.664 1.281 1.00 0.00 C ATOM 301 C VAL A 21 -15.343 2.119 1.286 1.00 0.00 C ATOM 302 O VAL A 21 -14.329 2.465 0.680 1.00 0.00 O ATOM 303 CB VAL A 21 -15.047 -0.105 2.383 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.676 -1.472 2.605 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.572 -0.239 2.034 1.00 0.00 C ATOM 0 H VAL A 21 -14.657 0.146 -0.402 1.00 0.00 H new ATOM 0 HA VAL A 21 -16.869 0.620 1.490 1.00 0.00 H new ATOM 0 HB VAL A 21 -15.125 0.461 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -15.131 -2.001 3.387 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.716 -1.349 2.907 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.633 -2.047 1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.059 -0.785 2.826 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.468 -0.780 1.094 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.131 0.752 1.932 1.00 0.00 H new ATOM 315 N GLU A 22 -16.101 2.967 1.973 1.00 0.00 N ATOM 316 CA GLU A 22 -15.781 4.387 2.056 1.00 0.00 C ATOM 317 C GLU A 22 -14.421 4.608 2.709 1.00 0.00 C ATOM 318 O GLU A 22 -13.963 3.795 3.511 1.00 0.00 O ATOM 319 CB GLU A 22 -16.863 5.126 2.847 1.00 0.00 C ATOM 320 CG GLU A 22 -18.004 5.639 1.984 1.00 0.00 C ATOM 321 CD GLU A 22 -18.551 6.966 2.471 1.00 0.00 C ATOM 322 OE1 GLU A 22 -17.905 8.004 2.215 1.00 0.00 O ATOM 323 OE2 GLU A 22 -19.626 6.968 3.107 1.00 0.00 O ATOM 0 H GLU A 22 -16.943 2.695 2.481 1.00 0.00 H new ATOM 0 HA GLU A 22 -15.742 4.783 1.041 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.266 4.457 3.607 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.408 5.967 3.371 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -17.657 5.748 0.956 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -18.806 4.901 1.973 1.00 0.00 H new ATOM 330 N VAL A 23 -13.783 5.721 2.359 1.00 0.00 N ATOM 331 CA VAL A 23 -12.477 6.066 2.908 1.00 0.00 C ATOM 332 C VAL A 23 -12.515 6.107 4.435 1.00 0.00 C ATOM 333 O VAL A 23 -11.502 5.882 5.098 1.00 0.00 O ATOM 334 CB VAL A 23 -11.988 7.428 2.371 1.00 0.00 C ATOM 335 CG1 VAL A 23 -10.703 7.856 3.065 1.00 0.00 C ATOM 336 CG2 VAL A 23 -11.789 7.365 0.863 1.00 0.00 C ATOM 0 H VAL A 23 -14.152 6.402 1.695 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.780 5.290 2.591 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.752 8.174 2.588 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.379 8.818 2.669 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.881 7.946 4.137 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.928 7.111 2.887 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.444 8.333 0.501 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.046 6.603 0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -12.734 7.113 0.382 1.00 0.00 H new ATOM 346 N LYS A 24 -13.689 6.398 4.985 1.00 0.00 N ATOM 347 CA LYS A 24 -13.865 6.476 6.433 1.00 0.00 C ATOM 348 C LYS A 24 -13.327 5.223 7.121 1.00 0.00 C ATOM 349 O LYS A 24 -12.913 5.270 8.278 1.00 0.00 O ATOM 350 CB LYS A 24 -15.343 6.664 6.777 1.00 0.00 C ATOM 351 CG LYS A 24 -15.780 8.120 6.809 1.00 0.00 C ATOM 352 CD LYS A 24 -15.292 8.820 8.067 1.00 0.00 C ATOM 353 CE LYS A 24 -14.867 10.251 7.777 1.00 0.00 C ATOM 354 NZ LYS A 24 -13.761 10.693 8.671 1.00 0.00 N ATOM 0 H LYS A 24 -14.536 6.585 4.449 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.300 7.335 6.794 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.949 6.128 6.046 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.542 6.212 7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.393 8.637 5.931 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -16.867 8.176 6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.084 8.819 8.816 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -14.452 8.268 8.490 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.548 10.332 6.738 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -15.722 10.916 7.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.500 11.673 8.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -14.073 10.640 9.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.936 10.074 8.535 1.00 0.00 H new ATOM 368 N SER A 25 -13.330 4.106 6.400 1.00 0.00 N ATOM 369 CA SER A 25 -12.837 2.845 6.946 1.00 0.00 C ATOM 370 C SER A 25 -11.362 2.957 7.336 1.00 0.00 C ATOM 371 O SER A 25 -10.851 2.141 8.102 1.00 0.00 O ATOM 372 CB SER A 25 -13.023 1.717 5.929 1.00 0.00 C ATOM 373 OG SER A 25 -14.392 1.540 5.609 1.00 0.00 O ATOM 0 H SER A 25 -13.667 4.048 5.439 1.00 0.00 H new ATOM 0 HA SER A 25 -13.414 2.617 7.842 1.00 0.00 H new ATOM 0 HB2 SER A 25 -12.461 1.943 5.023 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.618 0.789 6.332 1.00 0.00 H new ATOM 0 HG SER A 25 -14.645 2.164 4.897 1.00 0.00 H new ATOM 379 N LEU A 26 -10.688 3.980 6.815 1.00 0.00 N ATOM 380 CA LEU A 26 -9.279 4.207 7.119 1.00 0.00 C ATOM 381 C LEU A 26 -9.114 5.551 7.822 1.00 0.00 C ATOM 382 O LEU A 26 -8.314 6.392 7.410 1.00 0.00 O ATOM 383 CB LEU A 26 -8.424 4.175 5.842 1.00 0.00 C ATOM 384 CG LEU A 26 -8.942 3.287 4.701 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.858 3.092 3.653 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.418 1.939 5.229 1.00 0.00 C ATOM 0 H LEU A 26 -11.097 4.665 6.179 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.937 3.407 7.776 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.330 5.194 5.467 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.422 3.840 6.109 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.793 3.788 4.240 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.238 2.461 2.850 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.566 4.060 3.247 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.991 2.615 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.779 1.331 4.400 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.590 1.428 5.720 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.225 2.093 5.945 1.00 0.00 H new ATOM 398 N ALA A 27 -9.891 5.746 8.882 1.00 0.00 N ATOM 399 CA ALA A 27 -9.867 6.967 9.649 1.00 0.00 C ATOM 400 C ALA A 27 -9.180 6.760 10.982 1.00 0.00 C ATOM 401 O ALA A 27 -9.804 6.423 11.989 1.00 0.00 O ATOM 402 CB ALA A 27 -11.268 7.462 9.862 1.00 0.00 C ATOM 0 H ALA A 27 -10.555 5.053 9.227 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.301 7.712 9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.244 8.385 10.442 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.737 7.652 8.897 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.842 6.709 10.402 1.00 0.00 H new ATOM 408 N GLY A 28 -7.896 6.973 10.955 1.00 0.00 N ATOM 409 CA GLY A 28 -7.072 6.828 12.142 1.00 0.00 C ATOM 410 C GLY A 28 -6.366 5.489 12.212 1.00 0.00 C ATOM 411 O GLY A 28 -6.481 4.766 13.203 1.00 0.00 O ATOM 0 H GLY A 28 -7.383 7.251 10.118 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.329 7.626 12.162 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.695 6.951 13.028 1.00 0.00 H new ATOM 415 N LYS A 29 -5.629 5.163 11.157 1.00 0.00 N ATOM 416 CA LYS A 29 -4.889 3.912 11.088 1.00 0.00 C ATOM 417 C LYS A 29 -3.665 4.068 10.190 1.00 0.00 C ATOM 418 O LYS A 29 -3.595 4.993 9.381 1.00 0.00 O ATOM 419 CB LYS A 29 -5.798 2.796 10.569 1.00 0.00 C ATOM 420 CG LYS A 29 -6.039 2.841 9.067 1.00 0.00 C ATOM 421 CD LYS A 29 -6.837 1.637 8.595 1.00 0.00 C ATOM 422 CE LYS A 29 -8.195 1.566 9.277 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.152 0.738 10.513 1.00 0.00 N ATOM 0 H LYS A 29 -5.529 5.754 10.332 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.547 3.648 12.089 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.357 1.833 10.827 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.758 2.855 11.082 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.573 3.756 8.810 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.083 2.873 8.545 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.973 1.690 7.515 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.277 0.725 8.801 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.529 2.573 9.526 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.927 1.149 8.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.760 -0.097 10.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.174 0.431 10.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.491 1.300 11.319 1.00 0.00 H new ATOM 437 N LEU A 30 -2.703 3.161 10.328 1.00 0.00 N ATOM 438 CA LEU A 30 -1.496 3.214 9.515 1.00 0.00 C ATOM 439 C LEU A 30 -1.756 2.604 8.145 1.00 0.00 C ATOM 440 O LEU A 30 -1.689 1.386 7.975 1.00 0.00 O ATOM 441 CB LEU A 30 -0.342 2.485 10.205 1.00 0.00 C ATOM 442 CG LEU A 30 0.996 2.551 9.465 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.606 3.938 9.589 1.00 0.00 C ATOM 444 CD2 LEU A 30 1.958 1.498 9.996 1.00 0.00 C ATOM 0 H LEU A 30 -2.736 2.386 10.991 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.215 4.260 9.390 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.210 2.905 11.202 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.618 1.438 10.334 1.00 0.00 H new ATOM 0 HG LEU A 30 0.812 2.346 8.410 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.557 3.966 9.057 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.927 4.674 9.158 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.772 4.170 10.641 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.903 1.563 9.456 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.135 1.669 11.058 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.527 0.507 9.855 1.00 0.00 H new ATOM 456 N VAL A 31 -2.066 3.454 7.172 1.00 0.00 N ATOM 457 CA VAL A 31 -2.346 2.988 5.823 1.00 0.00 C ATOM 458 C VAL A 31 -1.064 2.835 5.015 1.00 0.00 C ATOM 459 O VAL A 31 -0.120 3.608 5.174 1.00 0.00 O ATOM 460 CB VAL A 31 -3.305 3.932 5.072 1.00 0.00 C ATOM 461 CG1 VAL A 31 -3.876 3.240 3.842 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.422 4.410 5.991 1.00 0.00 C ATOM 0 H VAL A 31 -2.129 4.465 7.293 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.827 2.016 5.928 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.741 4.806 4.744 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.551 3.920 3.323 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.063 2.956 3.174 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.423 2.348 4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.087 5.075 5.440 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.987 3.551 6.354 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.993 4.946 6.837 1.00 0.00 H new ATOM 472 N PHE A 32 -1.043 1.830 4.151 1.00 0.00 N ATOM 473 CA PHE A 32 0.118 1.561 3.312 1.00 0.00 C ATOM 474 C PHE A 32 -0.221 1.738 1.839 1.00 0.00 C ATOM 475 O PHE A 32 -1.388 1.702 1.449 1.00 0.00 O ATOM 476 CB PHE A 32 0.630 0.136 3.549 1.00 0.00 C ATOM 477 CG PHE A 32 1.760 0.064 4.536 1.00 0.00 C ATOM 478 CD1 PHE A 32 2.980 0.658 4.257 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.599 -0.592 5.745 1.00 0.00 C ATOM 480 CE1 PHE A 32 4.020 0.598 5.165 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.634 -0.657 6.657 1.00 0.00 C ATOM 482 CZ PHE A 32 3.846 -0.061 6.367 1.00 0.00 C ATOM 0 H PHE A 32 -1.820 1.184 4.012 1.00 0.00 H new ATOM 0 HA PHE A 32 0.896 2.275 3.582 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.193 -0.483 3.905 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.959 -0.286 2.600 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.120 1.174 3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.653 -1.058 5.977 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.966 1.065 4.936 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.496 -1.173 7.596 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.657 -0.110 7.079 1.00 0.00 H new ATOM 492 N PHE A 33 0.811 1.904 1.026 1.00 0.00 N ATOM 493 CA PHE A 33 0.629 2.055 -0.409 1.00 0.00 C ATOM 494 C PHE A 33 1.620 1.165 -1.148 1.00 0.00 C ATOM 495 O PHE A 33 2.814 1.453 -1.210 1.00 0.00 O ATOM 496 CB PHE A 33 0.807 3.519 -0.832 1.00 0.00 C ATOM 497 CG PHE A 33 -0.338 4.409 -0.436 1.00 0.00 C ATOM 498 CD1 PHE A 33 -0.613 4.652 0.900 1.00 0.00 C ATOM 499 CD2 PHE A 33 -1.137 5.003 -1.400 1.00 0.00 C ATOM 500 CE1 PHE A 33 -1.664 5.471 1.266 1.00 0.00 C ATOM 501 CE2 PHE A 33 -2.189 5.823 -1.039 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.452 6.058 0.296 1.00 0.00 C ATOM 0 H PHE A 33 1.782 1.938 1.335 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.386 1.752 -0.666 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.725 3.906 -0.390 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.931 3.562 -1.914 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.000 4.197 1.663 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -0.935 4.823 -2.446 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.869 5.652 2.311 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.805 6.279 -1.800 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.273 6.700 0.581 1.00 0.00 H new ATOM 512 N TYR A 34 1.105 0.071 -1.690 1.00 0.00 N ATOM 513 CA TYR A 34 1.919 -0.894 -2.416 1.00 0.00 C ATOM 514 C TYR A 34 1.873 -0.634 -3.920 1.00 0.00 C ATOM 515 O TYR A 34 0.857 -0.871 -4.571 1.00 0.00 O ATOM 516 CB TYR A 34 1.419 -2.307 -2.102 1.00 0.00 C ATOM 517 CG TYR A 34 1.950 -3.381 -3.029 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.310 -3.648 -3.115 1.00 0.00 C ATOM 519 CD2 TYR A 34 1.086 -4.127 -3.820 1.00 0.00 C ATOM 520 CE1 TYR A 34 3.793 -4.628 -3.963 1.00 0.00 C ATOM 521 CE2 TYR A 34 1.560 -5.108 -4.668 1.00 0.00 C ATOM 522 CZ TYR A 34 2.914 -5.354 -4.737 1.00 0.00 C ATOM 523 OH TYR A 34 3.391 -6.329 -5.582 1.00 0.00 O ATOM 0 H TYR A 34 0.116 -0.172 -1.640 1.00 0.00 H new ATOM 0 HA TYR A 34 2.956 -0.792 -2.097 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.697 -2.558 -1.078 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.330 -2.312 -2.147 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.002 -3.081 -2.510 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.024 -3.936 -3.771 1.00 0.00 H new ATOM 0 HE1 TYR A 34 4.854 -4.823 -4.018 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.873 -5.680 -5.274 1.00 0.00 H new ATOM 0 HH TYR A 34 2.656 -6.922 -5.846 1.00 0.00 H new ATOM 533 N PHE A 35 2.985 -0.151 -4.465 1.00 0.00 N ATOM 534 CA PHE A 35 3.073 0.136 -5.895 1.00 0.00 C ATOM 535 C PHE A 35 3.685 -1.042 -6.647 1.00 0.00 C ATOM 536 O PHE A 35 4.779 -1.497 -6.313 1.00 0.00 O ATOM 537 CB PHE A 35 3.904 1.398 -6.132 1.00 0.00 C ATOM 538 CG PHE A 35 3.341 2.620 -5.465 1.00 0.00 C ATOM 539 CD1 PHE A 35 3.546 2.842 -4.112 1.00 0.00 C ATOM 540 CD2 PHE A 35 2.605 3.545 -6.189 1.00 0.00 C ATOM 541 CE1 PHE A 35 3.028 3.964 -3.494 1.00 0.00 C ATOM 542 CE2 PHE A 35 2.084 4.668 -5.575 1.00 0.00 C ATOM 543 CZ PHE A 35 2.296 4.878 -4.227 1.00 0.00 C ATOM 0 H PHE A 35 3.837 0.050 -3.941 1.00 0.00 H new ATOM 0 HA PHE A 35 2.064 0.300 -6.273 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.918 1.230 -5.768 1.00 0.00 H new ATOM 0 HB3 PHE A 35 3.976 1.580 -7.204 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.117 2.130 -3.535 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.437 3.386 -7.244 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.195 4.126 -2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.511 5.381 -6.149 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.890 5.756 -3.746 1.00 0.00 H new ATOM 553 N SER A 36 2.979 -1.538 -7.664 1.00 0.00 N ATOM 554 CA SER A 36 3.473 -2.664 -8.447 1.00 0.00 C ATOM 555 C SER A 36 2.557 -2.950 -9.630 1.00 0.00 C ATOM 556 O SER A 36 1.476 -2.374 -9.747 1.00 0.00 O ATOM 557 CB SER A 36 3.592 -3.910 -7.567 1.00 0.00 C ATOM 558 OG SER A 36 2.334 -4.540 -7.402 1.00 0.00 O ATOM 0 H SER A 36 2.071 -1.179 -7.961 1.00 0.00 H new ATOM 0 HA SER A 36 4.459 -2.401 -8.831 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.297 -4.610 -8.016 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.994 -3.634 -6.592 1.00 0.00 H new ATOM 0 HG SER A 36 2.385 -5.184 -6.665 1.00 0.00 H new ATOM 564 N ALA A 37 2.998 -3.848 -10.504 1.00 0.00 N ATOM 565 CA ALA A 37 2.220 -4.217 -11.678 1.00 0.00 C ATOM 566 C ALA A 37 2.436 -5.683 -12.032 1.00 0.00 C ATOM 567 O ALA A 37 3.551 -6.193 -11.946 1.00 0.00 O ATOM 568 CB ALA A 37 2.588 -3.327 -12.853 1.00 0.00 C ATOM 0 H ALA A 37 3.891 -4.334 -10.420 1.00 0.00 H new ATOM 0 HA ALA A 37 1.164 -4.076 -11.449 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.999 -3.613 -13.725 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.381 -2.287 -12.601 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.648 -3.441 -13.078 1.00 0.00 H new ATOM 574 N SER A 38 1.365 -6.356 -12.432 1.00 0.00 N ATOM 575 CA SER A 38 1.442 -7.766 -12.798 1.00 0.00 C ATOM 576 C SER A 38 2.427 -7.988 -13.943 1.00 0.00 C ATOM 577 O SER A 38 2.895 -9.107 -14.160 1.00 0.00 O ATOM 578 CB SER A 38 0.059 -8.286 -13.193 1.00 0.00 C ATOM 579 OG SER A 38 -0.292 -7.861 -14.499 1.00 0.00 O ATOM 0 H SER A 38 0.433 -5.949 -12.512 1.00 0.00 H new ATOM 0 HA SER A 38 1.800 -8.318 -11.929 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.050 -9.375 -13.147 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.684 -7.930 -12.479 1.00 0.00 H new ATOM 0 HG SER A 38 -0.244 -6.883 -14.549 1.00 0.00 H new ATOM 585 N TRP A 39 2.737 -6.924 -14.680 1.00 0.00 N ATOM 586 CA TRP A 39 3.663 -7.020 -15.803 1.00 0.00 C ATOM 587 C TRP A 39 5.079 -6.604 -15.404 1.00 0.00 C ATOM 588 O TRP A 39 5.930 -6.378 -16.266 1.00 0.00 O ATOM 589 CB TRP A 39 3.169 -6.159 -16.971 1.00 0.00 C ATOM 590 CG TRP A 39 3.388 -4.689 -16.773 1.00 0.00 C ATOM 591 CD1 TRP A 39 2.770 -3.881 -15.863 1.00 0.00 C ATOM 592 CD2 TRP A 39 4.292 -3.851 -17.504 1.00 0.00 C ATOM 593 NE1 TRP A 39 3.233 -2.593 -15.982 1.00 0.00 N ATOM 594 CE2 TRP A 39 4.168 -2.549 -16.983 1.00 0.00 C ATOM 595 CE3 TRP A 39 5.194 -4.077 -18.548 1.00 0.00 C ATOM 596 CZ2 TRP A 39 4.913 -1.478 -17.472 1.00 0.00 C ATOM 597 CZ3 TRP A 39 5.932 -3.012 -19.031 1.00 0.00 C ATOM 598 CH2 TRP A 39 5.787 -1.727 -18.493 1.00 0.00 C ATOM 0 H TRP A 39 2.362 -5.989 -14.520 1.00 0.00 H new ATOM 0 HA TRP A 39 3.699 -8.064 -16.115 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.677 -6.473 -17.883 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.105 -6.342 -17.120 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.025 -4.207 -15.152 1.00 0.00 H new ATOM 0 HE1 TRP A 39 2.930 -1.799 -15.418 1.00 0.00 H new ATOM 0 HE3 TRP A 39 5.312 -5.064 -18.969 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 4.804 -0.486 -17.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 6.632 -3.174 -19.837 1.00 0.00 H new ATOM 0 HH2 TRP A 39 6.378 -0.916 -18.893 1.00 0.00 H new ATOM 609 N CYS A 40 5.335 -6.504 -14.102 1.00 0.00 N ATOM 610 CA CYS A 40 6.657 -6.117 -13.619 1.00 0.00 C ATOM 611 C CYS A 40 7.666 -7.244 -13.863 1.00 0.00 C ATOM 612 O CYS A 40 7.279 -8.401 -14.035 1.00 0.00 O ATOM 613 CB CYS A 40 6.593 -5.728 -12.132 1.00 0.00 C ATOM 614 SG CYS A 40 7.019 -7.056 -10.955 1.00 0.00 S ATOM 0 H CYS A 40 4.650 -6.684 -13.368 1.00 0.00 H new ATOM 0 HA CYS A 40 6.995 -5.243 -14.176 1.00 0.00 H new ATOM 0 HB2 CYS A 40 7.267 -4.888 -11.965 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.585 -5.378 -11.909 1.00 0.00 H new ATOM 619 N PRO A 41 8.973 -6.923 -13.903 1.00 0.00 N ATOM 620 CA PRO A 41 10.018 -7.920 -14.155 1.00 0.00 C ATOM 621 C PRO A 41 10.120 -8.977 -13.052 1.00 0.00 C ATOM 622 O PRO A 41 10.004 -10.170 -13.332 1.00 0.00 O ATOM 623 CB PRO A 41 11.312 -7.099 -14.256 1.00 0.00 C ATOM 624 CG PRO A 41 10.878 -5.675 -14.389 1.00 0.00 C ATOM 625 CD PRO A 41 9.530 -5.574 -13.733 1.00 0.00 C ATOM 0 HA PRO A 41 9.804 -8.492 -15.057 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.934 -7.238 -13.372 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.906 -7.409 -15.115 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.593 -5.006 -13.910 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.821 -5.384 -15.438 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.613 -5.302 -12.681 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.906 -4.818 -14.209 1.00 0.00 H new ATOM 633 N PRO A 42 10.337 -8.577 -11.782 1.00 0.00 N ATOM 634 CA PRO A 42 10.444 -9.537 -10.678 1.00 0.00 C ATOM 635 C PRO A 42 9.121 -10.259 -10.415 1.00 0.00 C ATOM 636 O PRO A 42 8.959 -11.419 -10.791 1.00 0.00 O ATOM 637 CB PRO A 42 10.855 -8.680 -9.468 1.00 0.00 C ATOM 638 CG PRO A 42 11.256 -7.355 -10.030 1.00 0.00 C ATOM 639 CD PRO A 42 10.492 -7.190 -11.311 1.00 0.00 C ATOM 0 HA PRO A 42 11.161 -10.328 -10.898 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.029 -8.573 -8.765 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.680 -9.140 -8.924 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.023 -6.551 -9.332 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.330 -7.319 -10.211 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.528 -6.709 -11.147 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.036 -6.577 -12.030 1.00 0.00 H new ATOM 647 N CYS A 43 8.178 -9.557 -9.780 1.00 0.00 N ATOM 648 CA CYS A 43 6.848 -10.119 -9.469 1.00 0.00 C ATOM 649 C CYS A 43 6.914 -11.622 -9.211 1.00 0.00 C ATOM 650 O CYS A 43 6.585 -12.429 -10.081 1.00 0.00 O ATOM 651 CB CYS A 43 5.884 -9.847 -10.618 1.00 0.00 C ATOM 652 SG CYS A 43 5.307 -8.121 -10.731 1.00 0.00 S ATOM 0 H CYS A 43 8.306 -8.594 -9.468 1.00 0.00 H new ATOM 0 HA CYS A 43 6.492 -9.633 -8.561 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.371 -10.116 -11.555 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.018 -10.500 -10.511 1.00 0.00 H new ATOM 657 N ARG A 44 7.341 -11.985 -8.012 1.00 0.00 N ATOM 658 CA ARG A 44 7.455 -13.391 -7.628 1.00 0.00 C ATOM 659 C ARG A 44 8.095 -13.536 -6.248 1.00 0.00 C ATOM 660 O ARG A 44 8.895 -14.444 -6.020 1.00 0.00 O ATOM 661 CB ARG A 44 8.276 -14.167 -8.664 1.00 0.00 C ATOM 662 CG ARG A 44 7.608 -15.449 -9.134 1.00 0.00 C ATOM 663 CD ARG A 44 8.616 -16.574 -9.304 1.00 0.00 C ATOM 664 NE ARG A 44 9.673 -16.224 -10.250 1.00 0.00 N ATOM 665 CZ ARG A 44 9.532 -16.281 -11.574 1.00 0.00 C ATOM 666 NH1 ARG A 44 8.383 -16.673 -12.110 1.00 0.00 N ATOM 667 NH2 ARG A 44 10.544 -15.945 -12.363 1.00 0.00 N ATOM 0 H ARG A 44 7.616 -11.327 -7.283 1.00 0.00 H new ATOM 0 HA ARG A 44 6.448 -13.805 -7.587 1.00 0.00 H new ATOM 0 HB2 ARG A 44 8.458 -13.525 -9.526 1.00 0.00 H new ATOM 0 HB3 ARG A 44 9.249 -14.410 -8.236 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.846 -15.748 -8.414 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.099 -15.269 -10.081 1.00 0.00 H new ATOM 0 HD2 ARG A 44 9.059 -16.813 -8.337 1.00 0.00 H new ATOM 0 HD3 ARG A 44 8.103 -17.471 -9.650 1.00 0.00 H new ATOM 0 HE ARG A 44 10.571 -15.918 -9.875 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.602 -16.933 -11.508 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.281 -16.715 -13.124 1.00 0.00 H new ATOM 0 HH21 ARG A 44 11.429 -15.643 -11.956 1.00 0.00 H new ATOM 0 HH22 ARG A 44 10.437 -15.988 -13.376 1.00 0.00 H new ATOM 681 N GLY A 45 7.740 -12.642 -5.331 1.00 0.00 N ATOM 682 CA GLY A 45 8.297 -12.703 -3.992 1.00 0.00 C ATOM 683 C GLY A 45 8.124 -11.409 -3.220 1.00 0.00 C ATOM 684 O GLY A 45 9.105 -10.748 -2.878 1.00 0.00 O ATOM 0 H GLY A 45 7.080 -11.880 -5.489 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.820 -13.514 -3.442 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.358 -12.942 -4.056 1.00 0.00 H new ATOM 688 N PHE A 46 6.876 -11.051 -2.936 1.00 0.00 N ATOM 689 CA PHE A 46 6.579 -9.831 -2.189 1.00 0.00 C ATOM 690 C PHE A 46 5.075 -9.648 -1.994 1.00 0.00 C ATOM 691 O PHE A 46 4.637 -9.075 -0.996 1.00 0.00 O ATOM 692 CB PHE A 46 7.156 -8.604 -2.897 1.00 0.00 C ATOM 693 CG PHE A 46 6.975 -7.335 -2.116 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.273 -7.295 -0.763 1.00 0.00 C ATOM 695 CD2 PHE A 46 6.500 -6.187 -2.728 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.101 -6.133 -0.035 1.00 0.00 C ATOM 697 CE2 PHE A 46 6.327 -5.021 -2.005 1.00 0.00 C ATOM 698 CZ PHE A 46 6.628 -4.995 -0.657 1.00 0.00 C ATOM 0 H PHE A 46 6.053 -11.587 -3.211 1.00 0.00 H new ATOM 0 HA PHE A 46 7.047 -9.932 -1.210 1.00 0.00 H new ATOM 0 HB2 PHE A 46 8.219 -8.763 -3.079 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.678 -8.496 -3.871 1.00 0.00 H new ATOM 0 HD1 PHE A 46 7.644 -8.182 -0.272 1.00 0.00 H new ATOM 0 HD2 PHE A 46 6.262 -6.203 -3.781 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.336 -6.115 1.019 1.00 0.00 H new ATOM 0 HE2 PHE A 46 5.957 -4.132 -2.494 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.493 -4.085 -0.090 1.00 0.00 H new ATOM 708 N THR A 47 4.288 -10.129 -2.953 1.00 0.00 N ATOM 709 CA THR A 47 2.837 -10.006 -2.880 1.00 0.00 C ATOM 710 C THR A 47 2.240 -10.814 -1.720 1.00 0.00 C ATOM 711 O THR A 47 1.234 -10.403 -1.140 1.00 0.00 O ATOM 712 CB THR A 47 2.192 -10.423 -4.208 1.00 0.00 C ATOM 713 OG1 THR A 47 0.838 -10.011 -4.255 1.00 0.00 O ATOM 714 CG2 THR A 47 2.222 -11.915 -4.466 1.00 0.00 C ATOM 0 H THR A 47 4.631 -10.606 -3.787 1.00 0.00 H new ATOM 0 HA THR A 47 2.616 -8.956 -2.690 1.00 0.00 H new ATOM 0 HB THR A 47 2.790 -9.933 -4.976 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.443 -10.284 -5.109 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.747 -12.128 -5.424 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.256 -12.260 -4.489 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.685 -12.433 -3.671 1.00 0.00 H new ATOM 722 N PRO A 48 2.833 -11.971 -1.354 1.00 0.00 N ATOM 723 CA PRO A 48 2.316 -12.792 -0.262 1.00 0.00 C ATOM 724 C PRO A 48 2.838 -12.355 1.106 1.00 0.00 C ATOM 725 O PRO A 48 2.437 -12.902 2.133 1.00 0.00 O ATOM 726 CB PRO A 48 2.833 -14.183 -0.615 1.00 0.00 C ATOM 727 CG PRO A 48 4.127 -13.942 -1.317 1.00 0.00 C ATOM 728 CD PRO A 48 4.035 -12.579 -1.961 1.00 0.00 C ATOM 0 HA PRO A 48 1.232 -12.725 -0.174 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.975 -14.791 0.279 1.00 0.00 H new ATOM 0 HB3 PRO A 48 2.129 -14.716 -1.254 1.00 0.00 H new ATOM 0 HG2 PRO A 48 4.960 -13.981 -0.614 1.00 0.00 H new ATOM 0 HG3 PRO A 48 4.307 -14.711 -2.068 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.926 -11.984 -1.762 1.00 0.00 H new ATOM 0 HD3 PRO A 48 3.939 -12.656 -3.044 1.00 0.00 H new ATOM 736 N GLN A 49 3.727 -11.364 1.117 1.00 0.00 N ATOM 737 CA GLN A 49 4.287 -10.860 2.366 1.00 0.00 C ATOM 738 C GLN A 49 3.283 -9.950 3.066 1.00 0.00 C ATOM 739 O GLN A 49 3.186 -9.942 4.292 1.00 0.00 O ATOM 740 CB GLN A 49 5.607 -10.123 2.107 1.00 0.00 C ATOM 741 CG GLN A 49 6.542 -10.869 1.168 1.00 0.00 C ATOM 742 CD GLN A 49 6.786 -12.303 1.598 1.00 0.00 C ATOM 743 OE1 GLN A 49 6.863 -13.207 0.767 1.00 0.00 O ATOM 744 NE2 GLN A 49 6.908 -12.521 2.904 1.00 0.00 N ATOM 0 H GLN A 49 4.073 -10.897 0.279 1.00 0.00 H new ATOM 0 HA GLN A 49 4.497 -11.706 3.021 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.390 -9.141 1.687 1.00 0.00 H new ATOM 0 HB3 GLN A 49 6.115 -9.958 3.057 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.121 -10.863 0.163 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.495 -10.342 1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.838 -11.743 3.560 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.072 -13.466 3.250 1.00 0.00 H new ATOM 753 N LEU A 50 2.531 -9.191 2.273 1.00 0.00 N ATOM 754 CA LEU A 50 1.527 -8.284 2.804 1.00 0.00 C ATOM 755 C LEU A 50 0.387 -9.052 3.457 1.00 0.00 C ATOM 756 O LEU A 50 -0.020 -8.756 4.581 1.00 0.00 O ATOM 757 CB LEU A 50 0.966 -7.441 1.666 1.00 0.00 C ATOM 758 CG LEU A 50 0.816 -5.953 1.954 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.256 -5.714 3.353 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.151 -5.252 1.771 1.00 0.00 C ATOM 0 H LEU A 50 2.602 -9.189 1.255 1.00 0.00 H new ATOM 0 HA LEU A 50 1.997 -7.651 3.556 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.614 -7.560 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.011 -7.839 1.392 1.00 0.00 H new ATOM 0 HG LEU A 50 0.103 -5.534 1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.161 -4.642 3.529 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.724 -6.184 3.438 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.930 -6.144 4.093 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.035 -4.188 1.979 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.883 -5.678 2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.495 -5.386 0.745 1.00 0.00 H new ATOM 772 N ILE A 51 -0.125 -10.033 2.731 1.00 0.00 N ATOM 773 CA ILE A 51 -1.230 -10.851 3.218 1.00 0.00 C ATOM 774 C ILE A 51 -0.870 -11.549 4.527 1.00 0.00 C ATOM 775 O ILE A 51 -1.661 -11.564 5.468 1.00 0.00 O ATOM 776 CB ILE A 51 -1.657 -11.906 2.172 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.208 -11.218 0.920 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.691 -12.857 2.761 1.00 0.00 C ATOM 779 CD1 ILE A 51 -1.646 -11.772 -0.370 1.00 0.00 C ATOM 0 H ILE A 51 0.206 -10.284 1.800 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.067 -10.176 3.397 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.781 -12.489 1.890 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.293 -11.319 0.907 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.988 -10.152 0.975 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -2.979 -13.592 2.010 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.265 -13.368 3.624 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.570 -12.292 3.071 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.080 -11.238 -1.215 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.563 -11.646 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.889 -12.832 -0.447 1.00 0.00 H new ATOM 791 N GLU A 52 0.325 -12.127 4.581 1.00 0.00 N ATOM 792 CA GLU A 52 0.775 -12.821 5.779 1.00 0.00 C ATOM 793 C GLU A 52 0.995 -11.839 6.922 1.00 0.00 C ATOM 794 O GLU A 52 0.486 -12.030 8.025 1.00 0.00 O ATOM 795 CB GLU A 52 2.064 -13.595 5.495 1.00 0.00 C ATOM 796 CG GLU A 52 2.381 -14.653 6.539 1.00 0.00 C ATOM 797 CD GLU A 52 3.218 -15.789 5.982 1.00 0.00 C ATOM 798 OE1 GLU A 52 2.850 -16.331 4.919 1.00 0.00 O ATOM 799 OE2 GLU A 52 4.241 -16.135 6.609 1.00 0.00 O ATOM 0 H GLU A 52 0.996 -12.128 3.812 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.002 -13.526 6.075 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.983 -14.073 4.519 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.895 -12.892 5.438 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.911 -14.190 7.371 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.450 -15.055 6.939 1.00 0.00 H new ATOM 806 N PHE A 53 1.754 -10.783 6.650 1.00 0.00 N ATOM 807 CA PHE A 53 2.032 -9.771 7.659 1.00 0.00 C ATOM 808 C PHE A 53 0.746 -9.081 8.097 1.00 0.00 C ATOM 809 O PHE A 53 0.608 -8.672 9.250 1.00 0.00 O ATOM 810 CB PHE A 53 3.018 -8.733 7.122 1.00 0.00 C ATOM 811 CG PHE A 53 3.448 -7.737 8.158 1.00 0.00 C ATOM 812 CD1 PHE A 53 3.935 -8.162 9.384 1.00 0.00 C ATOM 813 CD2 PHE A 53 3.359 -6.376 7.912 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.326 -7.250 10.345 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.748 -5.459 8.869 1.00 0.00 C ATOM 816 CZ PHE A 53 4.232 -5.897 10.087 1.00 0.00 C ATOM 0 H PHE A 53 2.186 -10.607 5.743 1.00 0.00 H new ATOM 0 HA PHE A 53 2.476 -10.268 8.521 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.898 -9.245 6.732 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.560 -8.204 6.286 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.010 -9.219 9.591 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.981 -6.029 6.962 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.704 -7.595 11.296 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.674 -4.401 8.666 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.536 -5.181 10.836 1.00 0.00 H new ATOM 826 N TYR A 54 -0.192 -8.950 7.164 1.00 0.00 N ATOM 827 CA TYR A 54 -1.468 -8.304 7.443 1.00 0.00 C ATOM 828 C TYR A 54 -2.441 -9.261 8.129 1.00 0.00 C ATOM 829 O TYR A 54 -2.917 -8.991 9.226 1.00 0.00 O ATOM 830 CB TYR A 54 -2.082 -7.772 6.145 1.00 0.00 C ATOM 831 CG TYR A 54 -3.480 -7.214 6.310 1.00 0.00 C ATOM 832 CD1 TYR A 54 -4.578 -8.061 6.410 1.00 0.00 C ATOM 833 CD2 TYR A 54 -3.701 -5.844 6.364 1.00 0.00 C ATOM 834 CE1 TYR A 54 -5.856 -7.556 6.560 1.00 0.00 C ATOM 835 CE2 TYR A 54 -4.975 -5.332 6.514 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.050 -6.192 6.612 1.00 0.00 C ATOM 837 OH TYR A 54 -7.320 -5.686 6.760 1.00 0.00 O ATOM 0 H TYR A 54 -0.091 -9.284 6.206 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.281 -7.472 8.122 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.436 -6.992 5.742 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.107 -8.577 5.410 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -4.430 -9.130 6.370 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -2.863 -5.168 6.287 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -6.699 -8.227 6.636 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.129 -4.264 6.554 1.00 0.00 H new ATOM 0 HH TYR A 54 -7.418 -4.882 6.209 1.00 0.00 H new ATOM 847 N ASP A 55 -2.745 -10.371 7.474 1.00 0.00 N ATOM 848 CA ASP A 55 -3.679 -11.350 8.022 1.00 0.00 C ATOM 849 C ASP A 55 -3.259 -11.829 9.411 1.00 0.00 C ATOM 850 O ASP A 55 -4.094 -12.277 10.199 1.00 0.00 O ATOM 851 CB ASP A 55 -3.799 -12.548 7.078 1.00 0.00 C ATOM 852 CG ASP A 55 -5.112 -13.288 7.247 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.239 -14.058 8.221 1.00 0.00 O ATOM 854 OD2 ASP A 55 -6.014 -13.097 6.403 1.00 0.00 O ATOM 0 H ASP A 55 -2.360 -10.619 6.562 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.646 -10.857 8.119 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.708 -12.205 6.047 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.972 -13.235 7.260 1.00 0.00 H new ATOM 859 N LYS A 56 -1.965 -11.767 9.697 1.00 0.00 N ATOM 860 CA LYS A 56 -1.441 -12.232 10.976 1.00 0.00 C ATOM 861 C LYS A 56 -1.585 -11.210 12.107 1.00 0.00 C ATOM 862 O LYS A 56 -1.677 -11.596 13.273 1.00 0.00 O ATOM 863 CB LYS A 56 0.031 -12.611 10.830 1.00 0.00 C ATOM 864 CG LYS A 56 0.252 -13.934 10.113 1.00 0.00 C ATOM 865 CD LYS A 56 1.731 -14.275 10.016 1.00 0.00 C ATOM 866 CE LYS A 56 2.138 -15.299 11.064 1.00 0.00 C ATOM 867 NZ LYS A 56 1.579 -16.647 10.768 1.00 0.00 N ATOM 0 H LYS A 56 -1.258 -11.399 9.060 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.041 -13.099 11.251 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.548 -11.821 10.285 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.484 -12.664 11.820 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.272 -14.729 10.644 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.177 -13.883 9.112 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.951 -14.664 9.022 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.323 -13.369 10.142 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.225 -15.359 11.110 1.00 0.00 H new ATOM 0 HE3 LYS A 56 1.795 -14.971 12.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.105 -17.366 11.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.576 -16.675 11.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.665 -16.842 9.750 1.00 0.00 H new ATOM 881 N PHE A 57 -1.566 -9.916 11.789 1.00 0.00 N ATOM 882 CA PHE A 57 -1.655 -8.897 12.833 1.00 0.00 C ATOM 883 C PHE A 57 -2.636 -7.778 12.487 1.00 0.00 C ATOM 884 O PHE A 57 -2.771 -6.816 13.243 1.00 0.00 O ATOM 885 CB PHE A 57 -0.269 -8.301 13.092 1.00 0.00 C ATOM 886 CG PHE A 57 0.504 -9.008 14.170 1.00 0.00 C ATOM 887 CD1 PHE A 57 0.885 -10.332 14.017 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.851 -8.347 15.337 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.597 -10.982 15.007 1.00 0.00 C ATOM 890 CE2 PHE A 57 1.562 -8.991 16.331 1.00 0.00 C ATOM 891 CZ PHE A 57 1.935 -10.311 16.166 1.00 0.00 C ATOM 0 H PHE A 57 -1.491 -9.554 10.838 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.032 -9.390 13.729 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.307 -8.329 12.167 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.380 -7.252 13.366 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.622 -10.862 13.113 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.562 -7.315 15.471 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.889 -12.013 14.875 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.826 -8.463 17.236 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.490 -10.817 16.942 1.00 0.00 H new ATOM 901 N HIS A 58 -3.309 -7.884 11.346 1.00 0.00 N ATOM 902 CA HIS A 58 -4.252 -6.855 10.931 1.00 0.00 C ATOM 903 C HIS A 58 -5.264 -6.556 12.033 1.00 0.00 C ATOM 904 O HIS A 58 -5.717 -5.423 12.182 1.00 0.00 O ATOM 905 CB HIS A 58 -4.989 -7.261 9.654 1.00 0.00 C ATOM 906 CG HIS A 58 -5.811 -8.506 9.803 1.00 0.00 C ATOM 907 ND1 HIS A 58 -7.146 -8.570 9.460 1.00 0.00 N ATOM 908 CD2 HIS A 58 -5.483 -9.738 10.261 1.00 0.00 C ATOM 909 CE1 HIS A 58 -7.603 -9.786 9.701 1.00 0.00 C ATOM 910 NE2 HIS A 58 -6.614 -10.513 10.187 1.00 0.00 N ATOM 0 H HIS A 58 -3.219 -8.666 10.697 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.674 -5.953 10.731 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.638 -6.442 9.344 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.261 -7.410 8.857 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -4.513 -10.052 10.618 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -8.613 -10.127 9.530 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -6.680 -11.493 10.463 1.00 0.00 H new ATOM 919 N GLU A 59 -5.614 -7.583 12.799 1.00 0.00 N ATOM 920 CA GLU A 59 -6.575 -7.431 13.886 1.00 0.00 C ATOM 921 C GLU A 59 -5.913 -6.834 15.125 1.00 0.00 C ATOM 922 O GLU A 59 -6.561 -6.149 15.916 1.00 0.00 O ATOM 923 CB GLU A 59 -7.200 -8.784 14.233 1.00 0.00 C ATOM 924 CG GLU A 59 -7.717 -9.546 13.023 1.00 0.00 C ATOM 925 CD GLU A 59 -7.848 -11.034 13.284 1.00 0.00 C ATOM 926 OE1 GLU A 59 -7.149 -11.543 14.186 1.00 0.00 O ATOM 927 OE2 GLU A 59 -8.650 -11.689 12.587 1.00 0.00 O ATOM 0 H GLU A 59 -5.248 -8.528 12.688 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.356 -6.749 13.551 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.459 -9.396 14.747 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.022 -8.626 14.931 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.688 -9.145 12.733 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.042 -9.386 12.182 1.00 0.00 H new ATOM 934 N SER A 60 -4.624 -7.106 15.292 1.00 0.00 N ATOM 935 CA SER A 60 -3.879 -6.604 16.441 1.00 0.00 C ATOM 936 C SER A 60 -3.454 -5.150 16.247 1.00 0.00 C ATOM 937 O SER A 60 -3.861 -4.270 17.007 1.00 0.00 O ATOM 938 CB SER A 60 -2.649 -7.478 16.695 1.00 0.00 C ATOM 939 OG SER A 60 -1.629 -7.210 15.751 1.00 0.00 O ATOM 0 H SER A 60 -4.073 -7.671 14.646 1.00 0.00 H new ATOM 0 HA SER A 60 -4.540 -6.646 17.307 1.00 0.00 H new ATOM 0 HB2 SER A 60 -2.273 -7.298 17.702 1.00 0.00 H new ATOM 0 HB3 SER A 60 -2.930 -8.530 16.643 1.00 0.00 H new ATOM 0 HG SER A 60 -1.064 -8.004 15.646 1.00 0.00 H new ATOM 945 N LYS A 61 -2.625 -4.901 15.236 1.00 0.00 N ATOM 946 CA LYS A 61 -2.140 -3.550 14.965 1.00 0.00 C ATOM 947 C LYS A 61 -3.202 -2.694 14.268 1.00 0.00 C ATOM 948 O LYS A 61 -3.011 -1.492 14.084 1.00 0.00 O ATOM 949 CB LYS A 61 -0.852 -3.603 14.128 1.00 0.00 C ATOM 950 CG LYS A 61 -1.082 -3.571 12.621 1.00 0.00 C ATOM 951 CD LYS A 61 0.162 -3.989 11.843 1.00 0.00 C ATOM 952 CE LYS A 61 0.499 -5.479 12.078 1.00 0.00 C ATOM 953 NZ LYS A 61 1.659 -5.918 11.253 1.00 0.00 N ATOM 0 H LYS A 61 -2.277 -5.613 14.594 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.920 -3.079 15.923 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -0.218 -2.761 14.405 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.305 -4.511 14.381 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.909 -4.234 12.366 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -1.376 -2.565 12.321 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.004 -3.814 10.779 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.007 -3.371 12.146 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.721 -5.640 13.133 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.371 -6.091 11.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.079 -6.772 11.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.338 -6.128 10.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.371 -5.160 11.224 1.00 0.00 H new ATOM 967 N ASN A 62 -4.321 -3.315 13.890 1.00 0.00 N ATOM 968 CA ASN A 62 -5.412 -2.609 13.225 1.00 0.00 C ATOM 969 C ASN A 62 -4.894 -1.638 12.167 1.00 0.00 C ATOM 970 O ASN A 62 -4.881 -0.424 12.369 1.00 0.00 O ATOM 971 CB ASN A 62 -6.260 -1.876 14.262 1.00 0.00 C ATOM 972 CG ASN A 62 -5.502 -0.770 14.973 1.00 0.00 C ATOM 973 OD1 ASN A 62 -4.680 -1.030 15.851 1.00 0.00 O ATOM 974 ND2 ASN A 62 -5.778 0.474 14.597 1.00 0.00 N ATOM 0 H ASN A 62 -4.493 -4.310 14.035 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.030 -3.345 12.711 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -7.136 -1.452 13.772 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -6.622 -2.593 14.999 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.301 1.259 15.041 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.467 0.644 13.864 1.00 0.00 H new ATOM 981 N PHE A 63 -4.468 -2.185 11.033 1.00 0.00 N ATOM 982 CA PHE A 63 -3.949 -1.369 9.939 1.00 0.00 C ATOM 983 C PHE A 63 -4.571 -1.781 8.607 1.00 0.00 C ATOM 984 O PHE A 63 -5.260 -2.798 8.521 1.00 0.00 O ATOM 985 CB PHE A 63 -2.419 -1.462 9.874 1.00 0.00 C ATOM 986 CG PHE A 63 -1.900 -2.684 9.168 1.00 0.00 C ATOM 987 CD1 PHE A 63 -2.217 -3.955 9.621 1.00 0.00 C ATOM 988 CD2 PHE A 63 -1.090 -2.558 8.050 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.736 -5.076 8.970 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.607 -3.675 7.396 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.930 -4.936 7.857 1.00 0.00 C ATOM 0 H PHE A 63 -4.472 -3.188 10.847 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.222 -0.332 10.132 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -2.034 -0.575 9.370 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -2.023 -1.448 10.889 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.846 -4.071 10.491 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.833 -1.574 7.686 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.991 -6.061 9.332 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.022 -3.562 6.526 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.553 -5.811 7.348 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.324 -0.985 7.572 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.855 -1.261 6.254 1.00 0.00 C ATOM 1003 C GLU A 64 -3.802 -0.999 5.186 1.00 0.00 C ATOM 1004 O GLU A 64 -3.090 0.003 5.227 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.089 -0.404 5.981 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.104 -1.076 5.071 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.647 -2.365 5.654 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.017 -3.424 5.443 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -8.702 -2.319 6.321 1.00 0.00 O ATOM 0 H GLU A 64 -3.755 -0.140 7.628 1.00 0.00 H new ATOM 0 HA GLU A 64 -5.140 -2.313 6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.569 -0.159 6.929 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.775 0.537 5.530 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.930 -0.390 4.885 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.640 -1.285 4.107 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.713 -1.911 4.239 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.755 -1.803 3.146 1.00 0.00 C ATOM 1018 C VAL A 65 -3.466 -1.566 1.818 1.00 0.00 C ATOM 1019 O VAL A 65 -4.351 -2.328 1.433 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.881 -3.075 3.051 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -1.020 -3.069 1.790 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.017 -3.211 4.298 1.00 0.00 C ATOM 0 H VAL A 65 -4.298 -2.746 4.201 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.112 -0.949 3.356 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.544 -3.938 2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.419 -3.977 1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.663 -3.026 0.911 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.363 -2.199 1.802 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.406 -4.110 4.221 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.370 -2.339 4.389 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.657 -3.282 5.178 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.075 -0.506 1.119 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.676 -0.182 -0.167 1.00 0.00 C ATOM 1034 C VAL A 66 -2.737 -0.565 -1.308 1.00 0.00 C ATOM 1035 O VAL A 66 -1.520 -0.415 -1.190 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.013 1.318 -0.271 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.823 1.598 -1.528 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.759 1.784 0.969 1.00 0.00 C ATOM 0 H VAL A 66 -2.347 0.141 1.421 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.601 -0.754 -0.245 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.080 1.878 -0.337 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.051 2.662 -1.584 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.247 1.304 -2.405 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.752 1.029 -1.497 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.989 2.846 0.878 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.686 1.219 1.070 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.138 1.621 1.850 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.293 -1.070 -2.409 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.475 -1.474 -3.546 1.00 0.00 C ATOM 1050 C PHE A 67 -2.562 -0.469 -4.689 1.00 0.00 C ATOM 1051 O PHE A 67 -3.621 -0.281 -5.289 1.00 0.00 O ATOM 1052 CB PHE A 67 -2.887 -2.861 -4.034 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.490 -3.159 -5.455 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.180 -2.989 -5.872 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -3.428 -3.609 -6.370 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.812 -3.263 -7.175 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -3.065 -3.885 -7.675 1.00 0.00 C ATOM 1058 CZ PHE A 67 -1.755 -3.712 -8.078 1.00 0.00 C ATOM 0 H PHE A 67 -4.296 -1.207 -2.535 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.439 -1.507 -3.208 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -2.442 -3.611 -3.380 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.969 -2.959 -3.943 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -0.438 -2.638 -5.170 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -4.454 -3.746 -6.060 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.213 -3.126 -7.487 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -3.805 -4.236 -8.379 1.00 0.00 H new ATOM 0 HZ PHE A 67 -1.469 -3.927 -9.097 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.431 0.150 -5.003 1.00 0.00 N ATOM 1069 CA CYS A 68 -1.362 1.110 -6.095 1.00 0.00 C ATOM 1070 C CYS A 68 -0.865 0.406 -7.350 1.00 0.00 C ATOM 1071 O CYS A 68 0.326 0.138 -7.494 1.00 0.00 O ATOM 1072 CB CYS A 68 -0.436 2.274 -5.742 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.454 2.735 -3.994 1.00 0.00 S ATOM 0 H CYS A 68 -0.547 0.003 -4.515 1.00 0.00 H new ATOM 0 HA CYS A 68 -2.358 1.516 -6.271 1.00 0.00 H new ATOM 0 HB2 CYS A 68 0.583 2.011 -6.026 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -0.719 3.142 -6.338 1.00 0.00 H new ATOM 0 HG CYS A 68 0.522 3.559 -3.752 1.00 0.00 H new ATOM 1079 N THR A 69 -1.788 0.084 -8.240 1.00 0.00 N ATOM 1080 CA THR A 69 -1.440 -0.621 -9.470 1.00 0.00 C ATOM 1081 C THR A 69 -0.455 0.180 -10.318 1.00 0.00 C ATOM 1082 O THR A 69 -0.401 1.405 -10.247 1.00 0.00 O ATOM 1083 CB THR A 69 -2.687 -0.946 -10.301 1.00 0.00 C ATOM 1084 OG1 THR A 69 -2.395 -1.946 -11.262 1.00 0.00 O ATOM 1085 CG2 THR A 69 -3.228 0.251 -11.045 1.00 0.00 C ATOM 0 H THR A 69 -2.780 0.297 -8.138 1.00 0.00 H new ATOM 0 HA THR A 69 -0.963 -1.554 -9.171 1.00 0.00 H new ATOM 0 HB THR A 69 -3.437 -1.286 -9.587 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.027 -2.688 -11.164 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.110 -0.043 -11.614 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.499 1.030 -10.333 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.466 0.631 -11.726 1.00 0.00 H new ATOM 1093 N TRP A 70 0.305 -0.536 -11.129 1.00 0.00 N ATOM 1094 CA TRP A 70 1.289 0.072 -12.018 1.00 0.00 C ATOM 1095 C TRP A 70 1.318 -0.658 -13.361 1.00 0.00 C ATOM 1096 O TRP A 70 2.375 -0.820 -13.973 1.00 0.00 O ATOM 1097 CB TRP A 70 2.676 0.044 -11.371 1.00 0.00 C ATOM 1098 CG TRP A 70 3.137 1.385 -10.889 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.137 1.837 -9.601 1.00 0.00 C ATOM 1100 CD2 TRP A 70 3.666 2.449 -11.689 1.00 0.00 C ATOM 1101 NE1 TRP A 70 3.634 3.117 -9.550 1.00 0.00 N ATOM 1102 CE2 TRP A 70 3.966 3.515 -10.818 1.00 0.00 C ATOM 1103 CE3 TRP A 70 3.917 2.604 -13.055 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 4.503 4.717 -11.272 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 4.449 3.798 -13.504 1.00 0.00 C ATOM 1106 CH2 TRP A 70 4.738 4.840 -12.615 1.00 0.00 C ATOM 0 H TRP A 70 0.260 -1.553 -11.192 1.00 0.00 H new ATOM 0 HA TRP A 70 1.004 1.110 -12.193 1.00 0.00 H new ATOM 0 HB2 TRP A 70 2.662 -0.650 -10.531 1.00 0.00 H new ATOM 0 HB3 TRP A 70 3.397 -0.342 -12.092 1.00 0.00 H new ATOM 0 HD1 TRP A 70 2.796 1.271 -8.747 1.00 0.00 H new ATOM 0 HE1 TRP A 70 3.739 3.679 -8.705 1.00 0.00 H new ATOM 0 HE3 TRP A 70 3.699 1.805 -13.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 4.726 5.523 -10.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 4.645 3.929 -14.558 1.00 0.00 H new ATOM 0 HH2 TRP A 70 5.155 5.760 -12.997 1.00 0.00 H new ATOM 1117 N ASP A 71 0.147 -1.101 -13.809 1.00 0.00 N ATOM 1118 CA ASP A 71 0.023 -1.821 -15.073 1.00 0.00 C ATOM 1119 C ASP A 71 -0.416 -0.890 -16.197 1.00 0.00 C ATOM 1120 O ASP A 71 -0.712 0.282 -15.969 1.00 0.00 O ATOM 1121 CB ASP A 71 -0.982 -2.968 -14.932 1.00 0.00 C ATOM 1122 CG ASP A 71 -0.584 -3.963 -13.860 1.00 0.00 C ATOM 1123 OD1 ASP A 71 -0.833 -3.683 -12.669 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -0.022 -5.021 -14.211 1.00 0.00 O ATOM 0 H ASP A 71 -0.735 -0.973 -13.312 1.00 0.00 H new ATOM 0 HA ASP A 71 1.003 -2.226 -15.324 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.964 -2.559 -14.696 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.073 -3.485 -15.887 1.00 0.00 H new ATOM 1129 N GLU A 72 -0.460 -1.427 -17.412 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.871 -0.655 -18.578 1.00 0.00 C ATOM 1131 C GLU A 72 -2.279 -1.048 -19.012 1.00 0.00 C ATOM 1132 O GLU A 72 -3.031 -0.227 -19.537 1.00 0.00 O ATOM 1133 CB GLU A 72 0.112 -0.870 -19.730 1.00 0.00 C ATOM 1134 CG GLU A 72 0.311 0.361 -20.598 1.00 0.00 C ATOM 1135 CD GLU A 72 -0.521 0.322 -21.865 1.00 0.00 C ATOM 1136 OE1 GLU A 72 -1.533 -0.410 -21.889 1.00 0.00 O ATOM 1137 OE2 GLU A 72 -0.160 1.021 -22.835 1.00 0.00 O ATOM 0 H GLU A 72 -0.215 -2.396 -17.614 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.872 0.401 -18.307 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.075 -1.176 -19.322 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.245 -1.690 -20.353 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.052 1.251 -20.025 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.365 0.448 -20.862 1.00 0.00 H new ATOM 1144 N GLU A 73 -2.629 -2.311 -18.787 1.00 0.00 N ATOM 1145 CA GLU A 73 -3.946 -2.818 -19.150 1.00 0.00 C ATOM 1146 C GLU A 73 -4.744 -3.192 -17.904 1.00 0.00 C ATOM 1147 O GLU A 73 -4.187 -3.323 -16.815 1.00 0.00 O ATOM 1148 CB GLU A 73 -3.813 -4.035 -20.070 1.00 0.00 C ATOM 1149 CG GLU A 73 -4.851 -4.073 -21.179 1.00 0.00 C ATOM 1150 CD GLU A 73 -4.386 -3.365 -22.437 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -3.165 -3.352 -22.694 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -5.245 -2.822 -23.162 1.00 0.00 O ATOM 0 H GLU A 73 -2.017 -3.002 -18.354 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.479 -2.029 -19.680 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.818 -4.037 -20.515 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.898 -4.943 -19.473 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.086 -5.111 -21.416 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.772 -3.610 -20.825 1.00 0.00 H new ATOM 1159 N GLU A 74 -6.052 -3.359 -18.073 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.927 -3.714 -16.961 1.00 0.00 C ATOM 1161 C GLU A 74 -6.727 -5.171 -16.551 1.00 0.00 C ATOM 1162 O GLU A 74 -6.862 -5.518 -15.377 1.00 0.00 O ATOM 1163 CB GLU A 74 -8.390 -3.477 -17.341 1.00 0.00 C ATOM 1164 CG GLU A 74 -8.643 -2.116 -17.969 1.00 0.00 C ATOM 1165 CD GLU A 74 -9.608 -2.184 -19.136 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -9.157 -2.476 -20.264 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -10.816 -1.945 -18.922 1.00 0.00 O ATOM 0 H GLU A 74 -6.529 -3.254 -18.968 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.670 -3.079 -16.113 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.706 -4.254 -18.037 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.009 -3.577 -16.449 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.040 -1.439 -17.213 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.697 -1.695 -18.309 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.412 -6.018 -17.524 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.200 -7.439 -17.266 1.00 0.00 C ATOM 1176 C ASP A 75 -5.090 -7.660 -16.242 1.00 0.00 C ATOM 1177 O ASP A 75 -5.216 -8.496 -15.348 1.00 0.00 O ATOM 1178 CB ASP A 75 -5.859 -8.166 -18.569 1.00 0.00 C ATOM 1179 CG ASP A 75 -5.738 -9.666 -18.379 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -6.663 -10.267 -17.792 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -4.718 -10.239 -18.817 1.00 0.00 O ATOM 0 H ASP A 75 -6.297 -5.746 -18.500 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.125 -7.845 -16.856 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.630 -7.957 -19.311 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.921 -7.776 -18.965 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.001 -6.911 -16.384 1.00 0.00 N ATOM 1187 CA GLY A 76 -2.884 -7.047 -15.467 1.00 0.00 C ATOM 1188 C GLY A 76 -3.206 -6.552 -14.069 1.00 0.00 C ATOM 1189 O GLY A 76 -2.696 -7.084 -13.084 1.00 0.00 O ATOM 0 H GLY A 76 -3.872 -6.213 -17.117 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.587 -8.094 -15.417 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.031 -6.492 -15.856 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.047 -5.528 -13.984 1.00 0.00 N ATOM 1194 CA PHE A 77 -4.429 -4.957 -12.697 1.00 0.00 C ATOM 1195 C PHE A 77 -5.573 -5.745 -12.059 1.00 0.00 C ATOM 1196 O PHE A 77 -5.614 -5.917 -10.840 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.834 -3.488 -12.877 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.483 -2.878 -11.666 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -4.999 -3.142 -10.394 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.578 -2.040 -11.801 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -5.596 -2.581 -9.281 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.179 -1.476 -10.691 1.00 0.00 C ATOM 1203 CZ PHE A 77 -6.687 -1.747 -9.430 1.00 0.00 C ATOM 0 H PHE A 77 -4.478 -5.076 -14.791 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.569 -5.015 -12.030 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.948 -2.907 -13.133 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.520 -3.412 -13.721 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.146 -3.793 -10.272 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.967 -1.825 -12.785 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -5.210 -2.795 -8.295 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.032 -0.824 -10.810 1.00 0.00 H new ATOM 0 HZ PHE A 77 -7.154 -1.308 -8.561 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.502 -6.211 -12.886 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.652 -6.968 -12.398 1.00 0.00 C ATOM 1215 C ALA A 78 -7.279 -8.390 -12.037 1.00 0.00 C ATOM 1216 O ALA A 78 -7.517 -8.840 -10.917 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.707 -7.013 -13.461 1.00 0.00 C ATOM 0 H ALA A 78 -6.483 -6.079 -13.897 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.019 -6.466 -11.503 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.566 -7.578 -13.098 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -9.018 -5.998 -13.708 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.306 -7.496 -14.352 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.661 -9.087 -12.986 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.230 -10.442 -12.735 1.00 0.00 C ATOM 1225 C GLY A 79 -5.285 -10.477 -11.564 1.00 0.00 C ATOM 1226 O GLY A 79 -4.986 -11.537 -11.012 1.00 0.00 O ATOM 0 H GLY A 79 -6.453 -8.735 -13.921 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.094 -11.075 -12.534 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.739 -10.845 -13.621 1.00 0.00 H new ATOM 1230 N TYR A 80 -4.806 -9.292 -11.196 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.868 -9.159 -10.085 1.00 0.00 C ATOM 1232 C TYR A 80 -4.578 -8.798 -8.781 1.00 0.00 C ATOM 1233 O TYR A 80 -4.363 -9.439 -7.753 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.808 -8.105 -10.408 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.754 -7.962 -9.333 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -1.972 -7.158 -8.221 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -0.541 -8.631 -9.431 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -1.010 -7.026 -7.237 1.00 0.00 C ATOM 1239 CE2 TYR A 80 0.425 -8.504 -8.451 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.186 -7.702 -7.357 1.00 0.00 C ATOM 1241 OH TYR A 80 1.145 -7.574 -6.379 1.00 0.00 O ATOM 0 H TYR A 80 -5.051 -8.412 -11.650 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.387 -10.128 -9.947 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.323 -8.365 -11.349 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.297 -7.142 -10.557 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.908 -6.628 -8.124 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -0.349 -9.261 -10.287 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -1.194 -6.397 -6.379 1.00 0.00 H new ATOM 0 HE2 TYR A 80 1.363 -9.031 -8.542 1.00 0.00 H new ATOM 0 HH TYR A 80 1.076 -8.325 -5.753 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.410 -7.762 -8.822 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.130 -7.317 -7.631 1.00 0.00 C ATOM 1253 C PHE A 81 -7.350 -8.198 -7.337 1.00 0.00 C ATOM 1254 O PHE A 81 -7.941 -8.109 -6.261 1.00 0.00 O ATOM 1255 CB PHE A 81 -6.536 -5.837 -7.770 1.00 0.00 C ATOM 1256 CG PHE A 81 -7.984 -5.606 -8.120 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -8.974 -5.739 -7.158 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -8.351 -5.249 -9.408 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -10.302 -5.521 -7.476 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -9.676 -5.031 -9.730 1.00 0.00 C ATOM 1261 CZ PHE A 81 -10.653 -5.167 -8.763 1.00 0.00 C ATOM 0 H PHE A 81 -5.603 -7.216 -9.662 1.00 0.00 H new ATOM 0 HA PHE A 81 -5.455 -7.414 -6.781 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.318 -5.326 -6.832 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.914 -5.375 -8.537 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -8.705 -6.016 -6.149 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -7.592 -5.140 -10.169 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.064 -5.628 -6.718 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -9.948 -4.754 -10.738 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.690 -4.997 -9.014 1.00 0.00 H new ATOM 1271 N ALA A 82 -7.730 -9.035 -8.295 1.00 0.00 N ATOM 1272 CA ALA A 82 -8.884 -9.910 -8.127 1.00 0.00 C ATOM 1273 C ALA A 82 -8.603 -11.057 -7.157 1.00 0.00 C ATOM 1274 O ALA A 82 -9.517 -11.787 -6.774 1.00 0.00 O ATOM 1275 CB ALA A 82 -9.309 -10.460 -9.478 1.00 0.00 C ATOM 0 H ALA A 82 -7.257 -9.126 -9.194 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.691 -9.316 -7.698 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.172 -11.114 -9.350 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.574 -9.635 -10.140 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.487 -11.026 -9.915 1.00 0.00 H new ATOM 1281 N LYS A 83 -7.340 -11.230 -6.769 1.00 0.00 N ATOM 1282 CA LYS A 83 -6.967 -12.307 -5.859 1.00 0.00 C ATOM 1283 C LYS A 83 -6.384 -11.781 -4.546 1.00 0.00 C ATOM 1284 O LYS A 83 -5.877 -12.558 -3.736 1.00 0.00 O ATOM 1285 CB LYS A 83 -5.958 -13.229 -6.539 1.00 0.00 C ATOM 1286 CG LYS A 83 -6.410 -13.718 -7.905 1.00 0.00 C ATOM 1287 CD LYS A 83 -5.332 -14.543 -8.588 1.00 0.00 C ATOM 1288 CE LYS A 83 -5.568 -16.033 -8.397 1.00 0.00 C ATOM 1289 NZ LYS A 83 -6.738 -16.515 -9.182 1.00 0.00 N ATOM 0 H LYS A 83 -6.563 -10.641 -7.070 1.00 0.00 H new ATOM 0 HA LYS A 83 -7.875 -12.859 -5.615 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -5.010 -12.702 -6.646 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -5.773 -14.090 -5.896 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -7.314 -14.317 -7.797 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -6.667 -12.864 -8.531 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.313 -14.310 -9.653 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.356 -14.273 -8.185 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -4.677 -16.583 -8.699 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -5.729 -16.242 -7.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.690 -17.550 -9.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.617 -16.252 -8.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -6.725 -16.080 -10.127 1.00 0.00 H new ATOM 1303 N MET A 84 -6.448 -10.469 -4.336 1.00 0.00 N ATOM 1304 CA MET A 84 -5.912 -9.870 -3.118 1.00 0.00 C ATOM 1305 C MET A 84 -7.024 -9.294 -2.239 1.00 0.00 C ATOM 1306 O MET A 84 -8.021 -8.777 -2.742 1.00 0.00 O ATOM 1307 CB MET A 84 -4.906 -8.777 -3.473 1.00 0.00 C ATOM 1308 CG MET A 84 -5.475 -7.679 -4.358 1.00 0.00 C ATOM 1309 SD MET A 84 -6.443 -6.465 -3.441 1.00 0.00 S ATOM 1310 CE MET A 84 -6.103 -4.982 -4.382 1.00 0.00 C ATOM 0 H MET A 84 -6.863 -9.804 -4.989 1.00 0.00 H new ATOM 0 HA MET A 84 -5.411 -10.655 -2.551 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.530 -8.330 -2.553 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.054 -9.232 -3.978 1.00 0.00 H new ATOM 0 HG2 MET A 84 -4.657 -7.172 -4.869 1.00 0.00 H new ATOM 0 HG3 MET A 84 -6.102 -8.129 -5.128 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.866 -4.165 -3.700 1.00 0.00 H new ATOM 0 HE2 MET A 84 -5.256 -5.158 -5.045 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.979 -4.718 -4.974 1.00 0.00 H new ATOM 1320 N PRO A 85 -6.864 -9.385 -0.904 1.00 0.00 N ATOM 1321 CA PRO A 85 -7.851 -8.877 0.050 1.00 0.00 C ATOM 1322 C PRO A 85 -7.682 -7.385 0.342 1.00 0.00 C ATOM 1323 O PRO A 85 -8.657 -6.634 0.365 1.00 0.00 O ATOM 1324 CB PRO A 85 -7.557 -9.702 1.299 1.00 0.00 C ATOM 1325 CG PRO A 85 -6.088 -9.958 1.243 1.00 0.00 C ATOM 1326 CD PRO A 85 -5.710 -10.002 -0.220 1.00 0.00 C ATOM 0 HA PRO A 85 -8.871 -8.968 -0.323 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.831 -9.161 2.205 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -8.122 -10.634 1.301 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -5.538 -9.172 1.761 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.840 -10.898 1.735 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -4.790 -9.450 -0.412 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.544 -11.025 -0.559 1.00 0.00 H new ATOM 1334 N TRP A 86 -6.437 -6.963 0.566 1.00 0.00 N ATOM 1335 CA TRP A 86 -6.125 -5.563 0.860 1.00 0.00 C ATOM 1336 C TRP A 86 -6.885 -4.618 -0.066 1.00 0.00 C ATOM 1337 O TRP A 86 -7.392 -5.046 -1.103 1.00 0.00 O ATOM 1338 CB TRP A 86 -4.620 -5.330 0.718 1.00 0.00 C ATOM 1339 CG TRP A 86 -4.087 -5.561 -0.659 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -4.350 -4.814 -1.767 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.182 -6.591 -1.070 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -3.668 -5.316 -2.846 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -2.944 -6.409 -2.445 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.551 -7.649 -0.411 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.101 -7.245 -3.172 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -1.714 -8.478 -1.134 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.496 -8.272 -2.502 1.00 0.00 C ATOM 0 H TRP A 86 -5.622 -7.576 0.549 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.435 -5.353 1.884 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -4.394 -4.306 1.015 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -4.096 -5.987 1.412 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -5.001 -3.952 -1.792 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -3.695 -4.938 -3.793 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.714 -7.816 0.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -1.931 -7.088 -4.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.220 -9.299 -0.635 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -0.837 -8.938 -3.039 1.00 0.00 H new ATOM 1358 N LEU A 87 -6.988 -3.336 0.304 1.00 0.00 N ATOM 1359 CA LEU A 87 -7.709 -2.400 -0.521 1.00 0.00 C ATOM 1360 C LEU A 87 -6.836 -1.854 -1.647 1.00 0.00 C ATOM 1361 O LEU A 87 -5.611 -1.836 -1.547 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.250 -1.241 0.320 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.294 -1.624 1.373 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -8.954 -1.001 2.721 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.680 -1.194 0.919 1.00 0.00 C ATOM 0 H LEU A 87 -6.585 -2.943 1.154 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.544 -2.940 -0.967 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.412 -0.757 0.823 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.689 -0.502 -0.350 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.286 -2.708 1.490 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.709 -1.286 3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.977 -1.355 3.049 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.933 0.085 2.625 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.413 -1.472 1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.697 -0.114 0.776 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.924 -1.688 -0.021 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.480 -1.430 -2.730 1.00 0.00 N ATOM 1378 CA ALA A 88 -6.775 -0.900 -3.884 1.00 0.00 C ATOM 1379 C ALA A 88 -7.537 0.258 -4.516 1.00 0.00 C ATOM 1380 O ALA A 88 -8.748 0.380 -4.351 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.583 -2.006 -4.897 1.00 0.00 C ATOM 0 H ALA A 88 -8.495 -1.445 -2.829 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.807 -0.521 -3.557 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.054 -1.615 -5.766 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.001 -2.812 -4.450 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.555 -2.389 -5.206 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.822 1.100 -5.255 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.443 2.238 -5.924 1.00 0.00 C ATOM 1389 C VAL A 89 -8.009 1.821 -7.280 1.00 0.00 C ATOM 1390 O VAL A 89 -7.337 1.144 -8.057 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.443 3.394 -6.136 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.113 4.565 -6.849 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.852 3.837 -4.807 1.00 0.00 C ATOM 0 H VAL A 89 -5.817 1.017 -5.406 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.247 2.586 -5.276 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.631 3.034 -6.768 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.390 5.368 -6.988 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.482 4.237 -7.821 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.947 4.928 -6.248 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.149 4.653 -4.975 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.651 4.177 -4.149 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.331 2.999 -4.343 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.253 2.226 -7.589 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.888 1.892 -8.866 1.00 0.00 C ATOM 1405 C PRO A 90 -9.124 2.476 -10.045 1.00 0.00 C ATOM 1406 O PRO A 90 -8.558 3.565 -9.949 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.281 2.528 -8.760 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.152 3.567 -7.700 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.128 3.045 -6.734 1.00 0.00 C ATOM 0 HA PRO A 90 -9.918 0.816 -9.040 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.587 2.968 -9.709 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.034 1.786 -8.496 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.838 4.521 -8.124 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.107 3.738 -7.203 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.579 3.854 -6.252 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.586 2.454 -5.941 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.107 1.751 -11.161 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.408 2.207 -12.358 1.00 0.00 C ATOM 1419 C PHE A 91 -8.763 3.658 -12.670 1.00 0.00 C ATOM 1420 O PHE A 91 -7.960 4.399 -13.237 1.00 0.00 O ATOM 1421 CB PHE A 91 -8.757 1.316 -13.551 1.00 0.00 C ATOM 1422 CG PHE A 91 -7.604 1.084 -14.485 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -6.449 0.463 -14.041 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -7.676 1.489 -15.809 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -5.386 0.248 -14.898 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -6.617 1.278 -16.671 1.00 0.00 C ATOM 1427 CZ PHE A 91 -5.470 0.656 -16.215 1.00 0.00 C ATOM 0 H PHE A 91 -9.569 0.847 -11.261 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.336 2.143 -12.171 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.115 0.354 -13.183 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -9.578 1.771 -14.106 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.378 0.143 -13.012 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -8.570 1.975 -16.171 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -4.491 -0.238 -14.538 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.685 1.599 -17.700 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.641 0.489 -16.887 1.00 0.00 H new ATOM 1437 N ALA A 92 -9.976 4.052 -12.295 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.450 5.411 -12.530 1.00 0.00 C ATOM 1439 C ALA A 92 -9.481 6.460 -11.982 1.00 0.00 C ATOM 1440 O ALA A 92 -9.301 7.516 -12.588 1.00 0.00 O ATOM 1441 CB ALA A 92 -11.829 5.597 -11.915 1.00 0.00 C ATOM 0 H ALA A 92 -10.650 3.447 -11.826 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.511 5.556 -13.609 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.174 6.615 -12.096 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.527 4.892 -12.366 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -11.776 5.418 -10.841 1.00 0.00 H new ATOM 1447 N GLN A 93 -8.863 6.176 -10.835 1.00 0.00 N ATOM 1448 CA GLN A 93 -7.928 7.116 -10.230 1.00 0.00 C ATOM 1449 C GLN A 93 -6.490 6.621 -10.343 1.00 0.00 C ATOM 1450 O GLN A 93 -5.644 6.955 -9.514 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.289 7.349 -8.764 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.757 7.679 -8.549 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.112 9.080 -9.009 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -11.040 9.271 -9.796 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -9.373 10.070 -8.522 1.00 0.00 N ATOM 0 H GLN A 93 -8.993 5.310 -10.313 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.003 8.058 -10.773 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -8.037 6.458 -8.189 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.680 8.164 -8.373 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.371 6.957 -9.088 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -9.998 7.576 -7.491 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.613 9.867 -7.872 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.565 11.033 -8.798 1.00 0.00 H new ATOM 1464 N SER A 94 -6.217 5.830 -11.375 1.00 0.00 N ATOM 1465 CA SER A 94 -4.875 5.303 -11.590 1.00 0.00 C ATOM 1466 C SER A 94 -3.894 6.439 -11.864 1.00 0.00 C ATOM 1467 O SER A 94 -2.703 6.328 -11.577 1.00 0.00 O ATOM 1468 CB SER A 94 -4.869 4.312 -12.754 1.00 0.00 C ATOM 1469 OG SER A 94 -4.868 4.985 -14.001 1.00 0.00 O ATOM 0 H SER A 94 -6.903 5.541 -12.072 1.00 0.00 H new ATOM 0 HA SER A 94 -4.563 4.781 -10.685 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.991 3.670 -12.684 1.00 0.00 H new ATOM 0 HB3 SER A 94 -5.743 3.664 -12.688 1.00 0.00 H new ATOM 0 HG SER A 94 -4.863 4.327 -14.728 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.408 7.537 -12.415 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.585 8.702 -12.720 1.00 0.00 C ATOM 1477 C GLU A 95 -2.827 9.157 -11.475 1.00 0.00 C ATOM 1478 O GLU A 95 -1.722 9.691 -11.562 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.467 9.834 -13.273 1.00 0.00 C ATOM 1480 CG GLU A 95 -4.408 11.137 -12.485 1.00 0.00 C ATOM 1481 CD GLU A 95 -3.100 11.879 -12.676 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -2.439 11.658 -13.713 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -2.736 12.679 -11.789 1.00 0.00 O ATOM 0 H GLU A 95 -5.393 7.643 -12.659 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.852 8.433 -13.480 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.171 10.035 -14.303 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.501 9.489 -13.300 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.233 11.780 -12.792 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.548 10.922 -11.425 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.434 8.937 -10.316 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.826 9.315 -9.048 1.00 0.00 C ATOM 1492 C ALA A 96 -1.663 8.400 -8.704 1.00 0.00 C ATOM 1493 O ALA A 96 -0.646 8.839 -8.179 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.854 9.253 -7.933 1.00 0.00 C ATOM 0 H ALA A 96 -4.350 8.497 -10.228 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.454 10.335 -9.150 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.386 9.538 -6.991 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.672 9.939 -8.154 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.243 8.238 -7.853 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.839 7.120 -8.987 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.828 6.116 -8.692 1.00 0.00 C ATOM 1502 C VAL A 97 0.502 6.418 -9.370 1.00 0.00 C ATOM 1503 O VAL A 97 1.568 6.142 -8.818 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.323 4.729 -9.108 1.00 0.00 C ATOM 1505 CG1 VAL A 97 -0.241 3.685 -8.897 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.576 4.397 -8.322 1.00 0.00 C ATOM 0 H VAL A 97 -2.682 6.748 -9.425 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.658 6.137 -7.616 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.563 4.729 -10.171 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.615 2.707 -9.199 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.633 3.940 -9.496 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.037 3.657 -7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.936 3.410 -8.612 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.349 4.402 -7.256 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.345 5.140 -8.532 1.00 0.00 H new ATOM 1516 N GLN A 98 0.433 6.978 -10.563 1.00 0.00 N ATOM 1517 CA GLN A 98 1.640 7.311 -11.318 1.00 0.00 C ATOM 1518 C GLN A 98 2.350 8.519 -10.714 1.00 0.00 C ATOM 1519 O GLN A 98 3.576 8.548 -10.622 1.00 0.00 O ATOM 1520 CB GLN A 98 1.316 7.576 -12.795 1.00 0.00 C ATOM 1521 CG GLN A 98 0.279 8.664 -13.030 1.00 0.00 C ATOM 1522 CD GLN A 98 0.448 9.343 -14.375 1.00 0.00 C ATOM 1523 OE1 GLN A 98 -0.244 9.019 -15.339 1.00 0.00 O ATOM 1524 NE2 GLN A 98 1.374 10.294 -14.445 1.00 0.00 N ATOM 0 H GLN A 98 -0.440 7.214 -11.034 1.00 0.00 H new ATOM 0 HA GLN A 98 2.307 6.451 -11.260 1.00 0.00 H new ATOM 0 HB2 GLN A 98 2.236 7.851 -13.312 1.00 0.00 H new ATOM 0 HB3 GLN A 98 0.961 6.650 -13.247 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.719 8.230 -12.968 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.353 9.409 -12.238 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.925 10.531 -13.620 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.533 10.787 -15.324 1.00 0.00 H new ATOM 1533 N LYS A 99 1.571 9.513 -10.306 1.00 0.00 N ATOM 1534 CA LYS A 99 2.126 10.724 -9.712 1.00 0.00 C ATOM 1535 C LYS A 99 2.434 10.519 -8.232 1.00 0.00 C ATOM 1536 O LYS A 99 3.417 11.050 -7.713 1.00 0.00 O ATOM 1537 CB LYS A 99 1.156 11.893 -9.899 1.00 0.00 C ATOM 1538 CG LYS A 99 1.011 12.339 -11.348 1.00 0.00 C ATOM 1539 CD LYS A 99 2.114 13.306 -11.746 1.00 0.00 C ATOM 1540 CE LYS A 99 1.646 14.750 -11.659 1.00 0.00 C ATOM 1541 NZ LYS A 99 1.002 15.046 -10.349 1.00 0.00 N ATOM 0 H LYS A 99 0.553 9.505 -10.375 1.00 0.00 H new ATOM 0 HA LYS A 99 3.062 10.955 -10.220 1.00 0.00 H new ATOM 0 HB2 LYS A 99 0.177 11.606 -9.516 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.498 12.737 -9.300 1.00 0.00 H new ATOM 0 HG2 LYS A 99 1.036 11.468 -12.002 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.040 12.815 -11.488 1.00 0.00 H new ATOM 0 HD2 LYS A 99 2.977 13.162 -11.096 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.441 13.089 -12.763 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.496 15.417 -11.805 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.940 14.952 -12.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 0.804 16.065 -10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 0.111 14.514 -10.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 1.640 14.766 -9.577 1.00 0.00 H new ATOM 1555 N LEU A 100 1.586 9.748 -7.558 1.00 0.00 N ATOM 1556 CA LEU A 100 1.765 9.472 -6.125 1.00 0.00 C ATOM 1557 C LEU A 100 3.179 8.974 -5.839 1.00 0.00 C ATOM 1558 O LEU A 100 3.782 9.330 -4.827 1.00 0.00 O ATOM 1559 CB LEU A 100 0.746 8.431 -5.644 1.00 0.00 C ATOM 1560 CG LEU A 100 0.600 8.268 -4.130 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.615 9.619 -3.428 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.685 7.509 -3.815 1.00 0.00 C ATOM 0 H LEU A 100 0.769 9.302 -7.974 1.00 0.00 H new ATOM 0 HA LEU A 100 1.605 10.405 -5.584 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.229 8.693 -6.055 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.020 7.464 -6.066 1.00 0.00 H new ATOM 0 HG LEU A 100 1.450 7.696 -3.759 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.509 9.472 -2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.558 10.126 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.212 10.228 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.785 7.395 -2.736 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.540 8.064 -4.202 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.650 6.525 -4.282 1.00 0.00 H new ATOM 1574 N SER A 101 3.701 8.144 -6.739 1.00 0.00 N ATOM 1575 CA SER A 101 5.042 7.592 -6.585 1.00 0.00 C ATOM 1576 C SER A 101 6.081 8.703 -6.459 1.00 0.00 C ATOM 1577 O SER A 101 6.909 8.691 -5.549 1.00 0.00 O ATOM 1578 CB SER A 101 5.384 6.691 -7.774 1.00 0.00 C ATOM 1579 OG SER A 101 5.836 7.453 -8.880 1.00 0.00 O ATOM 0 H SER A 101 3.215 7.840 -7.582 1.00 0.00 H new ATOM 0 HA SER A 101 5.060 7.000 -5.670 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.153 5.976 -7.483 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.505 6.114 -8.061 1.00 0.00 H new ATOM 0 HG SER A 101 5.065 7.785 -9.386 1.00 0.00 H new ATOM 1585 N LYS A 102 6.028 9.664 -7.377 1.00 0.00 N ATOM 1586 CA LYS A 102 6.963 10.783 -7.365 1.00 0.00 C ATOM 1587 C LYS A 102 6.883 11.544 -6.046 1.00 0.00 C ATOM 1588 O LYS A 102 7.866 12.137 -5.598 1.00 0.00 O ATOM 1589 CB LYS A 102 6.672 11.729 -8.531 1.00 0.00 C ATOM 1590 CG LYS A 102 7.641 12.896 -8.625 1.00 0.00 C ATOM 1591 CD LYS A 102 7.146 14.097 -7.835 1.00 0.00 C ATOM 1592 CE LYS A 102 6.485 15.124 -8.741 1.00 0.00 C ATOM 1593 NZ LYS A 102 6.589 16.501 -8.187 1.00 0.00 N ATOM 0 H LYS A 102 5.348 9.690 -8.137 1.00 0.00 H new ATOM 0 HA LYS A 102 7.971 10.383 -7.473 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.705 11.164 -9.463 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.658 12.117 -8.429 1.00 0.00 H new ATOM 0 HG2 LYS A 102 8.618 12.590 -8.250 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.774 13.176 -9.670 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.435 13.768 -7.077 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.982 14.558 -7.309 1.00 0.00 H new ATOM 0 HE2 LYS A 102 6.951 15.093 -9.726 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.435 14.866 -8.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.126 17.171 -8.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.122 16.538 -7.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.591 16.758 -8.081 1.00 0.00 H new ATOM 1607 N HIS A 103 5.707 11.525 -5.427 1.00 0.00 N ATOM 1608 CA HIS A 103 5.497 12.213 -4.160 1.00 0.00 C ATOM 1609 C HIS A 103 6.057 11.397 -2.997 1.00 0.00 C ATOM 1610 O HIS A 103 6.456 11.951 -1.973 1.00 0.00 O ATOM 1611 CB HIS A 103 4.007 12.482 -3.942 1.00 0.00 C ATOM 1612 CG HIS A 103 3.586 13.865 -4.332 1.00 0.00 C ATOM 1613 ND1 HIS A 103 4.359 14.693 -5.119 1.00 0.00 N ATOM 1614 CD2 HIS A 103 2.465 14.566 -4.039 1.00 0.00 C ATOM 1615 CE1 HIS A 103 3.732 15.843 -5.293 1.00 0.00 C ATOM 1616 NE2 HIS A 103 2.580 15.791 -4.649 1.00 0.00 N ATOM 0 H HIS A 103 4.884 11.039 -5.784 1.00 0.00 H new ATOM 0 HA HIS A 103 6.027 13.164 -4.199 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.428 11.759 -4.516 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.767 12.320 -2.891 1.00 0.00 H new ATOM 0 HD2 HIS A 103 1.635 14.225 -3.438 1.00 0.00 H new ATOM 0 HE1 HIS A 103 4.099 16.683 -5.865 1.00 0.00 H new ATOM 0 HE2 HIS A 103 1.888 16.539 -4.611 1.00 0.00 H new ATOM 1625 N PHE A 104 6.081 10.077 -3.162 1.00 0.00 N ATOM 1626 CA PHE A 104 6.591 9.189 -2.123 1.00 0.00 C ATOM 1627 C PHE A 104 8.015 8.728 -2.434 1.00 0.00 C ATOM 1628 O PHE A 104 8.543 7.833 -1.774 1.00 0.00 O ATOM 1629 CB PHE A 104 5.675 7.974 -1.968 1.00 0.00 C ATOM 1630 CG PHE A 104 4.354 8.295 -1.326 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.290 9.118 -0.213 1.00 0.00 C ATOM 1632 CD2 PHE A 104 3.177 7.772 -1.837 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.076 9.413 0.378 1.00 0.00 C ATOM 1634 CE2 PHE A 104 1.961 8.063 -1.250 1.00 0.00 C ATOM 1635 CZ PHE A 104 1.910 8.885 -0.141 1.00 0.00 C ATOM 0 H PHE A 104 5.754 9.601 -4.003 1.00 0.00 H new ATOM 0 HA PHE A 104 6.611 9.749 -1.188 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.496 7.537 -2.950 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.186 7.218 -1.371 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.199 9.533 0.197 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.211 7.129 -2.704 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.039 10.056 1.245 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.051 7.648 -1.658 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.960 9.114 0.319 1.00 0.00 H new ATOM 1645 N ASN A 105 8.636 9.345 -3.439 1.00 0.00 N ATOM 1646 CA ASN A 105 9.998 8.996 -3.829 1.00 0.00 C ATOM 1647 C ASN A 105 10.135 7.497 -4.084 1.00 0.00 C ATOM 1648 O ASN A 105 10.724 6.771 -3.282 1.00 0.00 O ATOM 1649 CB ASN A 105 10.984 9.434 -2.745 1.00 0.00 C ATOM 1650 CG ASN A 105 12.379 9.664 -3.291 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.620 10.621 -4.027 1.00 0.00 O ATOM 1652 ND2 ASN A 105 13.308 8.786 -2.932 1.00 0.00 N ATOM 0 H ASN A 105 8.216 10.089 -3.997 1.00 0.00 H new ATOM 0 HA ASN A 105 10.226 9.520 -4.757 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.624 10.351 -2.279 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.023 8.674 -1.965 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.265 8.890 -3.268 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.064 8.007 -2.320 1.00 0.00 H new ATOM 1659 N VAL A 106 9.591 7.039 -5.207 1.00 0.00 N ATOM 1660 CA VAL A 106 9.658 5.627 -5.569 1.00 0.00 C ATOM 1661 C VAL A 106 10.660 5.396 -6.695 1.00 0.00 C ATOM 1662 O VAL A 106 10.393 5.716 -7.853 1.00 0.00 O ATOM 1663 CB VAL A 106 8.283 5.082 -6.006 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.342 3.574 -6.199 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.213 5.454 -4.992 1.00 0.00 C ATOM 0 H VAL A 106 9.099 7.625 -5.882 1.00 0.00 H new ATOM 0 HA VAL A 106 9.982 5.093 -4.676 1.00 0.00 H new ATOM 0 HB VAL A 106 8.020 5.538 -6.961 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.363 3.208 -6.507 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.077 3.334 -6.967 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.629 3.098 -5.261 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.250 5.061 -5.318 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.468 5.029 -4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.152 6.539 -4.909 1.00 0.00 H new ATOM 1675 N GLU A 107 11.815 4.837 -6.347 1.00 0.00 N ATOM 1676 CA GLU A 107 12.857 4.560 -7.329 1.00 0.00 C ATOM 1677 C GLU A 107 12.330 3.650 -8.434 1.00 0.00 C ATOM 1678 O GLU A 107 12.561 3.896 -9.617 1.00 0.00 O ATOM 1679 CB GLU A 107 14.067 3.913 -6.651 1.00 0.00 C ATOM 1680 CG GLU A 107 15.399 4.367 -7.223 1.00 0.00 C ATOM 1681 CD GLU A 107 15.665 3.799 -8.603 1.00 0.00 C ATOM 1682 OE1 GLU A 107 15.952 2.588 -8.702 1.00 0.00 O ATOM 1683 OE2 GLU A 107 15.587 4.567 -9.585 1.00 0.00 O ATOM 0 H GLU A 107 12.053 4.567 -5.392 1.00 0.00 H new ATOM 0 HA GLU A 107 13.164 5.506 -7.776 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.042 4.142 -5.586 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.990 2.830 -6.746 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.417 5.456 -7.273 1.00 0.00 H new ATOM 0 HG3 GLU A 107 16.201 4.066 -6.549 1.00 0.00 H new ATOM 1690 N SER A 108 11.617 2.602 -8.037 1.00 0.00 N ATOM 1691 CA SER A 108 11.051 1.655 -8.990 1.00 0.00 C ATOM 1692 C SER A 108 10.217 0.598 -8.274 1.00 0.00 C ATOM 1693 O SER A 108 10.480 0.260 -7.120 1.00 0.00 O ATOM 1694 CB SER A 108 12.159 0.982 -9.799 1.00 0.00 C ATOM 1695 OG SER A 108 13.150 0.431 -8.949 1.00 0.00 O ATOM 0 H SER A 108 11.417 2.387 -7.060 1.00 0.00 H new ATOM 0 HA SER A 108 10.403 2.209 -9.669 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.732 0.196 -10.422 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.615 1.709 -10.471 1.00 0.00 H new ATOM 0 HG SER A 108 13.846 0.005 -9.491 1.00 0.00 H new ATOM 1701 N ILE A 109 9.208 0.084 -8.967 1.00 0.00 N ATOM 1702 CA ILE A 109 8.331 -0.932 -8.399 1.00 0.00 C ATOM 1703 C ILE A 109 8.954 -2.324 -8.492 1.00 0.00 C ATOM 1704 O ILE A 109 9.820 -2.571 -9.332 1.00 0.00 O ATOM 1705 CB ILE A 109 6.944 -0.939 -9.084 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.059 -0.828 -10.613 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.101 0.202 -8.544 1.00 0.00 C ATOM 1708 CD1 ILE A 109 8.132 -1.702 -11.226 1.00 0.00 C ATOM 0 H ILE A 109 8.977 0.354 -9.923 1.00 0.00 H new ATOM 0 HA ILE A 109 8.198 -0.675 -7.348 1.00 0.00 H new ATOM 0 HB ILE A 109 6.465 -1.892 -8.858 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.098 -1.089 -11.057 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.260 0.211 -10.875 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.125 0.194 -9.029 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.973 0.082 -7.468 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.599 1.150 -8.747 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.143 -1.561 -12.307 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.103 -1.428 -10.814 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.923 -2.747 -10.999 1.00 0.00 H new ATOM 1720 N PRO A 110 8.526 -3.258 -7.622 1.00 0.00 N ATOM 1721 CA PRO A 110 7.503 -3.011 -6.603 1.00 0.00 C ATOM 1722 C PRO A 110 8.055 -2.236 -5.410 1.00 0.00 C ATOM 1723 O PRO A 110 9.268 -2.154 -5.220 1.00 0.00 O ATOM 1724 CB PRO A 110 7.068 -4.422 -6.167 1.00 0.00 C ATOM 1725 CG PRO A 110 7.801 -5.376 -7.057 1.00 0.00 C ATOM 1726 CD PRO A 110 9.005 -4.640 -7.566 1.00 0.00 C ATOM 0 HA PRO A 110 6.685 -2.404 -6.991 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.313 -4.599 -5.120 1.00 0.00 H new ATOM 0 HB3 PRO A 110 5.990 -4.546 -6.267 1.00 0.00 H new ATOM 0 HG2 PRO A 110 8.096 -6.271 -6.508 1.00 0.00 H new ATOM 0 HG3 PRO A 110 7.168 -5.702 -7.882 1.00 0.00 H new ATOM 0 HD2 PRO A 110 9.860 -4.747 -6.898 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.319 -5.002 -8.545 1.00 0.00 H new ATOM 1734 N THR A 111 7.158 -1.672 -4.607 1.00 0.00 N ATOM 1735 CA THR A 111 7.560 -0.909 -3.432 1.00 0.00 C ATOM 1736 C THR A 111 6.447 -0.889 -2.387 1.00 0.00 C ATOM 1737 O THR A 111 5.350 -1.394 -2.624 1.00 0.00 O ATOM 1738 CB THR A 111 7.947 0.522 -3.828 1.00 0.00 C ATOM 1739 OG1 THR A 111 8.825 1.085 -2.871 1.00 0.00 O ATOM 1740 CG2 THR A 111 6.765 1.459 -3.970 1.00 0.00 C ATOM 0 H THR A 111 6.150 -1.729 -4.749 1.00 0.00 H new ATOM 0 HA THR A 111 8.430 -1.397 -2.993 1.00 0.00 H new ATOM 0 HB THR A 111 8.425 0.425 -4.803 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.062 1.997 -3.141 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.119 2.451 -4.251 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.092 1.082 -4.740 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.233 1.520 -3.021 1.00 0.00 H new ATOM 1748 N LEU A 112 6.732 -0.285 -1.240 1.00 0.00 N ATOM 1749 CA LEU A 112 5.743 -0.178 -0.160 1.00 0.00 C ATOM 1750 C LEU A 112 5.943 1.128 0.603 1.00 0.00 C ATOM 1751 O LEU A 112 7.016 1.376 1.153 1.00 0.00 O ATOM 1752 CB LEU A 112 5.827 -1.381 0.807 1.00 0.00 C ATOM 1753 CG LEU A 112 4.485 -1.993 1.228 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.549 -0.949 1.792 1.00 0.00 C ATOM 1755 CD2 LEU A 112 3.804 -2.682 0.071 1.00 0.00 C ATOM 0 H LEU A 112 7.635 0.139 -1.028 1.00 0.00 H new ATOM 0 HA LEU A 112 4.751 -0.184 -0.611 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.429 -2.159 0.337 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.359 -1.065 1.705 1.00 0.00 H new ATOM 0 HG LEU A 112 4.712 -2.726 2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.609 -1.420 2.079 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.005 -0.486 2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.357 -0.187 1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.856 -3.104 0.406 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.619 -1.960 -0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.444 -3.480 -0.305 1.00 0.00 H new ATOM 1767 N ILE A 113 4.912 1.964 0.627 1.00 0.00 N ATOM 1768 CA ILE A 113 4.985 3.248 1.319 1.00 0.00 C ATOM 1769 C ILE A 113 3.891 3.361 2.378 1.00 0.00 C ATOM 1770 O ILE A 113 2.702 3.304 2.067 1.00 0.00 O ATOM 1771 CB ILE A 113 4.877 4.423 0.315 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.247 4.711 -0.313 1.00 0.00 C ATOM 1773 CG2 ILE A 113 4.316 5.677 0.981 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.163 5.539 0.562 1.00 0.00 C ATOM 0 H ILE A 113 4.016 1.778 0.176 1.00 0.00 H new ATOM 0 HA ILE A 113 5.954 3.302 1.815 1.00 0.00 H new ATOM 0 HB ILE A 113 4.183 4.131 -0.473 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.737 3.764 -0.541 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.099 5.230 -1.260 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.254 6.481 0.248 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.321 5.466 1.374 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.972 5.980 1.797 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.111 5.699 0.048 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.696 6.502 0.770 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.343 5.014 1.500 1.00 0.00 H new ATOM 1786 N GLY A 114 4.304 3.522 3.632 1.00 0.00 N ATOM 1787 CA GLY A 114 3.349 3.641 4.719 1.00 0.00 C ATOM 1788 C GLY A 114 3.069 5.085 5.088 1.00 0.00 C ATOM 1789 O GLY A 114 3.988 5.900 5.175 1.00 0.00 O ATOM 0 H GLY A 114 5.283 3.572 3.914 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.416 3.154 4.434 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.730 3.113 5.593 1.00 0.00 H new ATOM 1793 N VAL A 115 1.797 5.402 5.309 1.00 0.00 N ATOM 1794 CA VAL A 115 1.398 6.748 5.672 1.00 0.00 C ATOM 1795 C VAL A 115 0.432 6.724 6.849 1.00 0.00 C ATOM 1796 O VAL A 115 -0.263 5.734 7.081 1.00 0.00 O ATOM 1797 CB VAL A 115 0.739 7.482 4.484 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.622 7.396 3.250 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.646 6.916 4.197 1.00 0.00 C ATOM 0 H VAL A 115 1.025 4.738 5.241 1.00 0.00 H new ATOM 0 HA VAL A 115 2.302 7.287 5.956 1.00 0.00 H new ATOM 0 HB VAL A 115 0.624 8.532 4.752 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.142 7.918 2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.587 7.858 3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 115 1.771 6.350 2.981 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.090 7.449 3.356 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.563 5.857 3.952 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.278 7.036 5.077 1.00 0.00 H new ATOM 1809 N ASP A 116 0.392 7.822 7.582 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.492 7.945 8.736 1.00 0.00 C ATOM 1811 C ASP A 116 -1.682 8.841 8.407 1.00 0.00 C ATOM 1812 O ASP A 116 -1.533 10.050 8.235 1.00 0.00 O ATOM 1813 CB ASP A 116 0.269 8.504 9.940 1.00 0.00 C ATOM 1814 CG ASP A 116 1.174 9.666 9.571 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.646 10.732 9.194 1.00 0.00 O ATOM 1816 OD2 ASP A 116 2.409 9.510 9.665 1.00 0.00 O ATOM 0 H ASP A 116 0.963 8.647 7.400 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.862 6.951 8.988 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -0.445 8.830 10.697 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.867 7.710 10.387 1.00 0.00 H new ATOM 1821 N ALA A 117 -2.862 8.238 8.317 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.077 8.980 8.003 1.00 0.00 C ATOM 1823 C ALA A 117 -4.333 10.081 9.029 1.00 0.00 C ATOM 1824 O ALA A 117 -4.538 11.241 8.670 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.267 8.036 7.933 1.00 0.00 C ATOM 0 H ALA A 117 -3.003 7.238 8.457 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.942 9.452 7.030 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.168 8.603 7.698 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.095 7.290 7.157 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.393 7.537 8.894 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.324 9.709 10.304 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.559 10.664 11.382 1.00 0.00 C ATOM 1833 C ASP A 118 -3.536 11.799 11.349 1.00 0.00 C ATOM 1834 O ASP A 118 -3.892 12.962 11.160 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.510 9.955 12.737 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.888 9.767 13.340 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -6.782 10.588 13.046 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.074 8.798 14.108 1.00 0.00 O ATOM 0 H ASP A 118 -4.157 8.753 10.617 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.550 11.095 11.238 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.032 8.982 12.618 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.891 10.532 13.424 1.00 0.00 H new ATOM 1843 N SER A 119 -2.267 11.452 11.539 1.00 0.00 N ATOM 1844 CA SER A 119 -1.195 12.442 11.537 1.00 0.00 C ATOM 1845 C SER A 119 -1.141 13.194 10.209 1.00 0.00 C ATOM 1846 O SER A 119 -0.996 14.416 10.184 1.00 0.00 O ATOM 1847 CB SER A 119 0.151 11.767 11.809 1.00 0.00 C ATOM 1848 OG SER A 119 0.502 11.864 13.180 1.00 0.00 O ATOM 0 H SER A 119 -1.956 10.493 11.696 1.00 0.00 H new ATOM 0 HA SER A 119 -1.402 13.162 12.329 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.101 10.718 11.516 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.925 12.232 11.198 1.00 0.00 H new ATOM 0 HG SER A 119 1.365 11.424 13.329 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.260 12.458 9.109 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.223 13.075 7.797 1.00 0.00 C ATOM 1856 C GLY A 120 0.095 12.850 7.080 1.00 0.00 C ATOM 1857 O GLY A 120 0.124 12.309 5.975 1.00 0.00 O ATOM 0 H GLY A 120 -1.381 11.445 9.103 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.035 12.676 7.189 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.398 14.146 7.899 1.00 0.00 H new ATOM 1861 N ASP A 121 1.188 13.269 7.709 1.00 0.00 N ATOM 1862 CA ASP A 121 2.516 13.114 7.123 1.00 0.00 C ATOM 1863 C ASP A 121 2.830 11.644 6.856 1.00 0.00 C ATOM 1864 O ASP A 121 2.018 10.764 7.140 1.00 0.00 O ATOM 1865 CB ASP A 121 3.577 13.713 8.048 1.00 0.00 C ATOM 1866 CG ASP A 121 3.335 15.182 8.331 1.00 0.00 C ATOM 1867 OD1 ASP A 121 2.203 15.533 8.722 1.00 0.00 O ATOM 1868 OD2 ASP A 121 4.278 15.982 8.160 1.00 0.00 O ATOM 0 H ASP A 121 1.181 13.719 8.625 1.00 0.00 H new ATOM 0 HA ASP A 121 2.528 13.646 6.172 1.00 0.00 H new ATOM 0 HB2 ASP A 121 3.588 13.162 8.988 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.561 13.590 7.595 1.00 0.00 H new ATOM 1873 N VAL A 122 4.014 11.388 6.309 1.00 0.00 N ATOM 1874 CA VAL A 122 4.438 10.029 6.004 1.00 0.00 C ATOM 1875 C VAL A 122 4.948 9.320 7.254 1.00 0.00 C ATOM 1876 O VAL A 122 5.410 9.960 8.198 1.00 0.00 O ATOM 1877 CB VAL A 122 5.542 10.016 4.932 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.832 8.594 4.486 1.00 0.00 C ATOM 1879 CG2 VAL A 122 5.146 10.884 3.746 1.00 0.00 C ATOM 0 H VAL A 122 4.697 12.106 6.068 1.00 0.00 H new ATOM 0 HA VAL A 122 3.564 9.501 5.622 1.00 0.00 H new ATOM 0 HB VAL A 122 6.452 10.430 5.367 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.615 8.603 3.728 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.162 8.005 5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.927 8.152 4.068 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.939 10.862 2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.224 10.503 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.991 11.910 4.081 1.00 0.00 H new ATOM 1889 N VAL A 123 4.856 7.993 7.255 1.00 0.00 N ATOM 1890 CA VAL A 123 5.302 7.197 8.391 1.00 0.00 C ATOM 1891 C VAL A 123 6.584 6.434 8.070 1.00 0.00 C ATOM 1892 O VAL A 123 7.457 6.281 8.925 1.00 0.00 O ATOM 1893 CB VAL A 123 4.219 6.196 8.832 1.00 0.00 C ATOM 1894 CG1 VAL A 123 4.628 5.497 10.120 1.00 0.00 C ATOM 1895 CG2 VAL A 123 2.879 6.896 9.000 1.00 0.00 C ATOM 0 H VAL A 123 4.476 7.448 6.481 1.00 0.00 H new ATOM 0 HA VAL A 123 5.498 7.895 9.205 1.00 0.00 H new ATOM 0 HB VAL A 123 4.113 5.440 8.054 1.00 0.00 H new ATOM 0 HG11 VAL A 123 3.849 4.794 10.415 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.562 4.959 9.961 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.766 6.237 10.908 1.00 0.00 H new ATOM 0 HG21 VAL A 123 2.127 6.172 9.312 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.968 7.675 9.757 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.581 7.343 8.052 1.00 0.00 H new ATOM 1905 N THR A 124 6.689 5.952 6.837 1.00 0.00 N ATOM 1906 CA THR A 124 7.864 5.200 6.406 1.00 0.00 C ATOM 1907 C THR A 124 8.045 5.305 4.894 1.00 0.00 C ATOM 1908 O THR A 124 7.079 5.496 4.156 1.00 0.00 O ATOM 1909 CB THR A 124 7.748 3.727 6.835 1.00 0.00 C ATOM 1910 OG1 THR A 124 8.222 2.862 5.817 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.333 3.299 7.174 1.00 0.00 C ATOM 0 H THR A 124 5.975 6.068 6.117 1.00 0.00 H new ATOM 0 HA THR A 124 8.742 5.631 6.886 1.00 0.00 H new ATOM 0 HB THR A 124 8.357 3.651 7.736 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.139 1.932 6.114 1.00 0.00 H new ATOM 0 HG21 THR A 124 6.331 2.249 7.467 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.956 3.906 7.997 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.693 3.433 6.302 1.00 0.00 H new ATOM 1919 N THR A 125 9.289 5.186 4.438 1.00 0.00 N ATOM 1920 CA THR A 125 9.591 5.275 3.013 1.00 0.00 C ATOM 1921 C THR A 125 10.462 4.110 2.555 1.00 0.00 C ATOM 1922 O THR A 125 11.435 4.296 1.823 1.00 0.00 O ATOM 1923 CB THR A 125 10.283 6.603 2.702 1.00 0.00 C ATOM 1924 OG1 THR A 125 11.529 6.687 3.370 1.00 0.00 O ATOM 1925 CG2 THR A 125 9.464 7.811 3.102 1.00 0.00 C ATOM 0 H THR A 125 10.102 5.028 5.033 1.00 0.00 H new ATOM 0 HA THR A 125 8.649 5.225 2.467 1.00 0.00 H new ATOM 0 HB THR A 125 10.414 6.615 1.620 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.957 7.542 3.157 1.00 0.00 H new ATOM 0 HG21 THR A 125 10.012 8.720 2.854 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.515 7.801 2.565 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.274 7.783 4.175 1.00 0.00 H new ATOM 1933 N ARG A 126 10.102 2.906 2.987 1.00 0.00 N ATOM 1934 CA ARG A 126 10.843 1.701 2.622 1.00 0.00 C ATOM 1935 C ARG A 126 10.272 0.485 3.343 1.00 0.00 C ATOM 1936 O ARG A 126 10.973 -0.199 4.088 1.00 0.00 O ATOM 1937 CB ARG A 126 12.332 1.859 2.951 1.00 0.00 C ATOM 1938 CG ARG A 126 12.601 2.546 4.283 1.00 0.00 C ATOM 1939 CD ARG A 126 12.547 1.564 5.443 1.00 0.00 C ATOM 1940 NE ARG A 126 13.291 0.338 5.159 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.620 0.273 5.107 1.00 0.00 C ATOM 1942 NH1 ARG A 126 15.354 1.358 5.321 1.00 0.00 N ATOM 1943 NH2 ARG A 126 15.216 -0.881 4.839 1.00 0.00 N ATOM 0 H ARG A 126 9.299 2.737 3.593 1.00 0.00 H new ATOM 0 HA ARG A 126 10.740 1.552 1.547 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.798 0.874 2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.811 2.430 2.156 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.581 3.023 4.255 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.866 3.336 4.440 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.955 2.036 6.337 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.508 1.315 5.659 1.00 0.00 H new ATOM 0 HE ARG A 126 12.761 -0.517 4.991 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.900 2.248 5.527 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.372 1.302 5.280 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.656 -1.718 4.673 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.234 -0.932 4.799 1.00 0.00 H new ATOM 1957 N ALA A 127 8.986 0.230 3.125 1.00 0.00 N ATOM 1958 CA ALA A 127 8.312 -0.894 3.763 1.00 0.00 C ATOM 1959 C ALA A 127 8.263 -2.118 2.857 1.00 0.00 C ATOM 1960 O ALA A 127 7.412 -2.989 3.030 1.00 0.00 O ATOM 1961 CB ALA A 127 6.904 -0.492 4.177 1.00 0.00 C ATOM 0 H ALA A 127 8.390 0.786 2.512 1.00 0.00 H new ATOM 0 HA ALA A 127 8.888 -1.164 4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.409 -1.339 4.653 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.955 0.340 4.879 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.338 -0.189 3.296 1.00 0.00 H new ATOM 1967 N ARG A 128 9.179 -2.192 1.900 1.00 0.00 N ATOM 1968 CA ARG A 128 9.221 -3.329 0.991 1.00 0.00 C ATOM 1969 C ARG A 128 9.965 -4.497 1.633 1.00 0.00 C ATOM 1970 O ARG A 128 9.500 -5.636 1.598 1.00 0.00 O ATOM 1971 CB ARG A 128 9.880 -2.939 -0.336 1.00 0.00 C ATOM 1972 CG ARG A 128 11.286 -2.375 -0.190 1.00 0.00 C ATOM 1973 CD ARG A 128 12.343 -3.428 -0.481 1.00 0.00 C ATOM 1974 NE ARG A 128 13.669 -3.011 -0.030 1.00 0.00 N ATOM 1975 CZ ARG A 128 14.754 -3.779 -0.108 1.00 0.00 C ATOM 1976 NH1 ARG A 128 14.674 -5.004 -0.614 1.00 0.00 N ATOM 1977 NH2 ARG A 128 15.922 -3.321 0.321 1.00 0.00 N ATOM 0 H ARG A 128 9.896 -1.486 1.734 1.00 0.00 H new ATOM 0 HA ARG A 128 8.197 -3.640 0.785 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.917 -3.816 -0.982 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.254 -2.200 -0.837 1.00 0.00 H new ATOM 0 HG2 ARG A 128 11.413 -1.533 -0.870 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.422 -1.992 0.821 1.00 0.00 H new ATOM 0 HD2 ARG A 128 12.070 -4.362 0.011 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.371 -3.628 -1.552 1.00 0.00 H new ATOM 0 HE ARG A 128 13.769 -2.077 0.368 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.778 -5.361 -0.946 1.00 0.00 H new ATOM 0 HH12 ARG A 128 15.509 -5.588 -0.671 1.00 0.00 H new ATOM 0 HH21 ARG A 128 15.989 -2.381 0.711 1.00 0.00 H new ATOM 0 HH22 ARG A 128 16.753 -3.909 0.261 1.00 0.00 H new ATOM 1991 N ALA A 129 11.120 -4.203 2.220 1.00 0.00 N ATOM 1992 CA ALA A 129 11.931 -5.220 2.876 1.00 0.00 C ATOM 1993 C ALA A 129 11.480 -5.464 4.314 1.00 0.00 C ATOM 1994 O ALA A 129 11.420 -6.602 4.773 1.00 0.00 O ATOM 1995 CB ALA A 129 13.395 -4.810 2.849 1.00 0.00 C ATOM 0 H ALA A 129 11.516 -3.264 2.254 1.00 0.00 H new ATOM 0 HA ALA A 129 11.803 -6.154 2.328 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.996 -5.575 3.341 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.723 -4.700 1.815 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.517 -3.861 3.371 1.00 0.00 H new ATOM 2001 N THR A 130 11.190 -4.381 5.027 1.00 0.00 N ATOM 2002 CA THR A 130 10.779 -4.452 6.409 1.00 0.00 C ATOM 2003 C THR A 130 9.419 -5.108 6.575 1.00 0.00 C ATOM 2004 O THR A 130 9.226 -5.927 7.469 1.00 0.00 O ATOM 2005 CB THR A 130 10.774 -3.048 6.989 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.883 -2.215 6.274 1.00 0.00 O ATOM 2007 CG2 THR A 130 12.136 -2.390 6.963 1.00 0.00 C ATOM 0 H THR A 130 11.236 -3.432 4.655 1.00 0.00 H new ATOM 0 HA THR A 130 11.489 -5.079 6.948 1.00 0.00 H new ATOM 0 HB THR A 130 10.460 -3.163 8.027 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.142 -1.951 6.858 1.00 0.00 H new ATOM 0 HG21 THR A 130 12.065 -1.390 7.391 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.839 -2.985 7.546 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.487 -2.320 5.933 1.00 0.00 H new ATOM 2015 N LEU A 131 8.476 -4.759 5.718 1.00 0.00 N ATOM 2016 CA LEU A 131 7.144 -5.337 5.803 1.00 0.00 C ATOM 2017 C LEU A 131 7.230 -6.859 5.838 1.00 0.00 C ATOM 2018 O LEU A 131 6.460 -7.521 6.535 1.00 0.00 O ATOM 2019 CB LEU A 131 6.298 -4.875 4.614 1.00 0.00 C ATOM 2020 CG LEU A 131 4.955 -5.589 4.447 1.00 0.00 C ATOM 2021 CD1 LEU A 131 3.832 -4.578 4.269 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.009 -6.543 3.264 1.00 0.00 C ATOM 0 H LEU A 131 8.604 -4.086 4.962 1.00 0.00 H new ATOM 0 HA LEU A 131 6.669 -4.998 6.724 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.112 -3.806 4.716 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.879 -5.012 3.702 1.00 0.00 H new ATOM 0 HG LEU A 131 4.754 -6.167 5.349 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.884 -5.104 4.152 1.00 0.00 H new ATOM 0 HD12 LEU A 131 3.782 -3.931 5.145 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.024 -3.974 3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.047 -7.044 3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.230 -5.983 2.355 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.789 -7.286 3.431 1.00 0.00 H new ATOM 2034 N VAL A 132 8.182 -7.404 5.090 1.00 0.00 N ATOM 2035 CA VAL A 132 8.383 -8.844 5.040 1.00 0.00 C ATOM 2036 C VAL A 132 9.356 -9.323 6.120 1.00 0.00 C ATOM 2037 O VAL A 132 9.083 -10.287 6.836 1.00 0.00 O ATOM 2038 CB VAL A 132 8.888 -9.291 3.648 1.00 0.00 C ATOM 2039 CG1 VAL A 132 9.952 -8.348 3.106 1.00 0.00 C ATOM 2040 CG2 VAL A 132 9.421 -10.713 3.698 1.00 0.00 C ATOM 0 H VAL A 132 8.827 -6.868 4.509 1.00 0.00 H new ATOM 0 HA VAL A 132 7.412 -9.301 5.229 1.00 0.00 H new ATOM 0 HB VAL A 132 8.036 -9.259 2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.282 -8.696 2.127 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.536 -7.345 3.014 1.00 0.00 H new ATOM 0 HG13 VAL A 132 10.802 -8.327 3.788 1.00 0.00 H new ATOM 0 HG21 VAL A 132 9.770 -11.006 2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 132 10.249 -10.767 4.405 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.627 -11.388 4.017 1.00 0.00 H new ATOM 2050 N LYS A 133 10.504 -8.660 6.203 1.00 0.00 N ATOM 2051 CA LYS A 133 11.548 -9.025 7.161 1.00 0.00 C ATOM 2052 C LYS A 133 11.325 -8.424 8.553 1.00 0.00 C ATOM 2053 O LYS A 133 12.259 -8.349 9.352 1.00 0.00 O ATOM 2054 CB LYS A 133 12.915 -8.595 6.627 1.00 0.00 C ATOM 2055 CG LYS A 133 13.530 -9.596 5.665 1.00 0.00 C ATOM 2056 CD LYS A 133 13.943 -10.874 6.379 1.00 0.00 C ATOM 2057 CE LYS A 133 13.748 -12.094 5.494 1.00 0.00 C ATOM 2058 NZ LYS A 133 15.020 -12.523 4.849 1.00 0.00 N ATOM 0 H LYS A 133 10.739 -7.861 5.615 1.00 0.00 H new ATOM 0 HA LYS A 133 11.507 -10.108 7.273 1.00 0.00 H new ATOM 0 HB2 LYS A 133 12.814 -7.634 6.123 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.594 -8.445 7.467 1.00 0.00 H new ATOM 0 HG2 LYS A 133 12.814 -9.833 4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.400 -9.151 5.182 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.989 -10.803 6.678 1.00 0.00 H new ATOM 0 HD3 LYS A 133 13.358 -10.988 7.291 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.349 -12.915 6.090 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.009 -11.870 4.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.843 -13.358 4.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.388 -11.749 4.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 15.718 -12.762 5.582 1.00 0.00 H new ATOM 2072 N ASP A 134 10.099 -8.013 8.853 1.00 0.00 N ATOM 2073 CA ASP A 134 9.787 -7.443 10.166 1.00 0.00 C ATOM 2074 C ASP A 134 8.659 -8.219 10.839 1.00 0.00 C ATOM 2075 O ASP A 134 7.539 -7.724 10.963 1.00 0.00 O ATOM 2076 CB ASP A 134 9.405 -5.967 10.045 1.00 0.00 C ATOM 2077 CG ASP A 134 9.338 -5.276 11.393 1.00 0.00 C ATOM 2078 OD1 ASP A 134 8.402 -5.572 12.165 1.00 0.00 O ATOM 2079 OD2 ASP A 134 10.220 -4.438 11.674 1.00 0.00 O ATOM 0 H ASP A 134 9.307 -8.061 8.213 1.00 0.00 H new ATOM 0 HA ASP A 134 10.683 -7.521 10.782 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.132 -5.457 9.414 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.438 -5.884 9.549 1.00 0.00 H new ATOM 2084 N PRO A 135 8.945 -9.455 11.285 1.00 0.00 N ATOM 2085 CA PRO A 135 7.959 -10.304 11.946 1.00 0.00 C ATOM 2086 C PRO A 135 7.855 -10.034 13.445 1.00 0.00 C ATOM 2087 O PRO A 135 7.248 -10.814 14.178 1.00 0.00 O ATOM 2088 CB PRO A 135 8.510 -11.703 11.692 1.00 0.00 C ATOM 2089 CG PRO A 135 9.992 -11.524 11.683 1.00 0.00 C ATOM 2090 CD PRO A 135 10.255 -10.126 11.174 1.00 0.00 C ATOM 0 HA PRO A 135 6.950 -10.139 11.569 1.00 0.00 H new ATOM 0 HB2 PRO A 135 8.199 -12.400 12.470 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.153 -12.104 10.744 1.00 0.00 H new ATOM 0 HG2 PRO A 135 10.404 -11.656 12.683 1.00 0.00 H new ATOM 0 HG3 PRO A 135 10.468 -12.266 11.042 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.015 -9.620 11.770 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.612 -10.136 10.144 1.00 0.00 H new ATOM 2098 N GLU A 136 8.442 -8.930 13.899 1.00 0.00 N ATOM 2099 CA GLU A 136 8.401 -8.574 15.302 1.00 0.00 C ATOM 2100 C GLU A 136 7.330 -7.519 15.543 1.00 0.00 C ATOM 2101 O GLU A 136 6.808 -7.388 16.651 1.00 0.00 O ATOM 2102 CB GLU A 136 9.774 -8.062 15.740 1.00 0.00 C ATOM 2103 CG GLU A 136 10.134 -6.698 15.169 1.00 0.00 C ATOM 2104 CD GLU A 136 11.471 -6.699 14.453 1.00 0.00 C ATOM 2105 OE1 GLU A 136 12.479 -7.088 15.078 1.00 0.00 O ATOM 2106 OE2 GLU A 136 11.509 -6.310 13.266 1.00 0.00 O ATOM 0 H GLU A 136 8.950 -8.270 13.310 1.00 0.00 H new ATOM 0 HA GLU A 136 8.150 -9.455 15.893 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.801 -8.008 16.828 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.533 -8.783 15.438 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.355 -6.382 14.475 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.159 -5.966 15.976 1.00 0.00 H new ATOM 2113 N GLY A 137 7.007 -6.764 14.493 1.00 0.00 N ATOM 2114 CA GLY A 137 6.000 -5.727 14.609 1.00 0.00 C ATOM 2115 C GLY A 137 6.305 -4.773 15.742 1.00 0.00 C ATOM 2116 O GLY A 137 5.405 -4.143 16.299 1.00 0.00 O ATOM 0 H GLY A 137 7.425 -6.854 13.567 1.00 0.00 H new ATOM 0 HA2 GLY A 137 5.940 -5.172 13.673 1.00 0.00 H new ATOM 0 HA3 GLY A 137 5.024 -6.184 14.772 1.00 0.00 H new ATOM 2120 N GLU A 138 7.584 -4.675 16.085 1.00 0.00 N ATOM 2121 CA GLU A 138 8.021 -3.797 17.167 1.00 0.00 C ATOM 2122 C GLU A 138 8.220 -2.373 16.674 1.00 0.00 C ATOM 2123 O GLU A 138 8.073 -1.414 17.432 1.00 0.00 O ATOM 2124 CB GLU A 138 9.322 -4.312 17.780 1.00 0.00 C ATOM 2125 CG GLU A 138 9.231 -5.742 18.273 1.00 0.00 C ATOM 2126 CD GLU A 138 10.539 -6.245 18.854 1.00 0.00 C ATOM 2127 OE1 GLU A 138 11.429 -6.626 18.066 1.00 0.00 O ATOM 2128 OE2 GLU A 138 10.672 -6.257 20.095 1.00 0.00 O ATOM 0 H GLU A 138 8.337 -5.192 15.631 1.00 0.00 H new ATOM 0 HA GLU A 138 7.239 -3.795 17.927 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.117 -4.241 17.038 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.604 -3.666 18.612 1.00 0.00 H new ATOM 0 HG2 GLU A 138 8.451 -5.812 19.031 1.00 0.00 H new ATOM 0 HG3 GLU A 138 8.932 -6.388 17.448 1.00 0.00 H new ATOM 2135 N GLN A 139 8.565 -2.244 15.402 1.00 0.00 N ATOM 2136 CA GLN A 139 8.796 -0.931 14.807 1.00 0.00 C ATOM 2137 C GLN A 139 7.988 -0.759 13.532 1.00 0.00 C ATOM 2138 O GLN A 139 8.434 -0.081 12.616 1.00 0.00 O ATOM 2139 CB GLN A 139 10.277 -0.745 14.462 1.00 0.00 C ATOM 2140 CG GLN A 139 11.243 -1.584 15.282 1.00 0.00 C ATOM 2141 CD GLN A 139 12.517 -0.836 15.622 1.00 0.00 C ATOM 2142 OE1 GLN A 139 13.399 -0.675 14.778 1.00 0.00 O ATOM 2143 NE2 GLN A 139 12.621 -0.375 16.862 1.00 0.00 N ATOM 0 H GLN A 139 8.692 -3.028 14.762 1.00 0.00 H new ATOM 0 HA GLN A 139 8.487 -0.188 15.542 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.420 -0.981 13.408 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.534 0.306 14.591 1.00 0.00 H new ATOM 0 HG2 GLN A 139 10.754 -1.899 16.204 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.493 -2.489 14.728 1.00 0.00 H new ATOM 0 HE21 GLN A 139 11.866 -0.531 17.529 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.456 0.136 17.148 1.00 0.00 H new ATOM 2152 N PHE A 140 6.820 -1.391 13.464 1.00 0.00 N ATOM 2153 CA PHE A 140 5.977 -1.327 12.267 1.00 0.00 C ATOM 2154 C PHE A 140 6.071 -0.007 11.510 1.00 0.00 C ATOM 2155 O PHE A 140 6.239 -0.023 10.292 1.00 0.00 O ATOM 2156 CB PHE A 140 4.531 -1.708 12.571 1.00 0.00 C ATOM 2157 CG PHE A 140 3.853 -0.860 13.610 1.00 0.00 C ATOM 2158 CD1 PHE A 140 4.263 -0.892 14.934 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.800 -0.032 13.259 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.635 -0.113 15.887 1.00 0.00 C ATOM 2161 CE2 PHE A 140 2.170 0.751 14.207 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.588 0.711 15.522 1.00 0.00 C ATOM 0 H PHE A 140 6.433 -1.954 14.221 1.00 0.00 H new ATOM 0 HA PHE A 140 6.383 -2.076 11.587 1.00 0.00 H new ATOM 0 HB2 PHE A 140 3.955 -1.653 11.647 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.507 -2.747 12.900 1.00 0.00 H new ATOM 0 HD1 PHE A 140 5.082 -1.533 15.224 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.467 0.002 12.232 1.00 0.00 H new ATOM 0 HE1 PHE A 140 3.962 -0.148 16.916 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.351 1.394 13.919 1.00 0.00 H new ATOM 0 HZ PHE A 140 2.097 1.323 16.264 1.00 0.00 H new ATOM 2172 N PRO A 141 6.010 1.160 12.171 1.00 0.00 N ATOM 2173 CA PRO A 141 6.147 2.428 11.453 1.00 0.00 C ATOM 2174 C PRO A 141 7.511 2.538 10.756 1.00 0.00 C ATOM 2175 O PRO A 141 7.818 3.567 10.154 1.00 0.00 O ATOM 2176 CB PRO A 141 6.023 3.486 12.556 1.00 0.00 C ATOM 2177 CG PRO A 141 6.343 2.763 13.819 1.00 0.00 C ATOM 2178 CD PRO A 141 5.841 1.363 13.622 1.00 0.00 C ATOM 0 HA PRO A 141 5.403 2.537 10.664 1.00 0.00 H new ATOM 0 HB2 PRO A 141 6.713 4.313 12.389 1.00 0.00 H new ATOM 0 HB3 PRO A 141 5.019 3.909 12.587 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.415 2.771 14.014 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.860 3.236 14.674 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.416 0.641 14.202 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.800 1.259 13.927 1.00 0.00 H new ATOM 2186 N TRP A 142 8.320 1.460 10.856 1.00 0.00 N ATOM 2187 CA TRP A 142 9.670 1.382 10.264 1.00 0.00 C ATOM 2188 C TRP A 142 10.109 2.693 9.619 1.00 0.00 C ATOM 2189 O TRP A 142 10.316 2.768 8.407 1.00 0.00 O ATOM 2190 CB TRP A 142 9.755 0.240 9.244 1.00 0.00 C ATOM 2191 CG TRP A 142 8.897 -0.941 9.591 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.949 -1.698 10.732 1.00 0.00 C ATOM 2193 CD2 TRP A 142 7.858 -1.504 8.783 1.00 0.00 C ATOM 2194 NE1 TRP A 142 7.980 -2.672 10.691 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.307 -2.579 9.502 1.00 0.00 C ATOM 2196 CE3 TRP A 142 7.335 -1.195 7.525 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.258 -3.345 9.004 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.295 -1.960 7.031 1.00 0.00 C ATOM 2199 CH2 TRP A 142 5.766 -3.023 7.770 1.00 0.00 C ATOM 0 H TRP A 142 8.050 0.613 11.355 1.00 0.00 H new ATOM 0 HA TRP A 142 10.355 1.181 11.088 1.00 0.00 H new ATOM 0 HB2 TRP A 142 9.461 0.617 8.264 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.792 -0.086 9.162 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.647 -1.551 11.543 1.00 0.00 H new ATOM 0 HE1 TRP A 142 7.793 -3.353 11.427 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.736 -0.374 6.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 5.847 -4.166 9.573 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 5.884 -1.733 6.058 1.00 0.00 H new ATOM 0 HH2 TRP A 142 4.952 -3.601 7.357 1.00 0.00 H new ATOM 2210 N LYS A 143 10.253 3.719 10.447 1.00 0.00 N ATOM 2211 CA LYS A 143 10.670 5.033 9.975 1.00 0.00 C ATOM 2212 C LYS A 143 12.180 5.208 10.132 1.00 0.00 C ATOM 2213 O LYS A 143 12.898 4.245 10.401 1.00 0.00 O ATOM 2214 CB LYS A 143 9.920 6.131 10.738 1.00 0.00 C ATOM 2215 CG LYS A 143 10.385 6.310 12.175 1.00 0.00 C ATOM 2216 CD LYS A 143 9.738 7.524 12.822 1.00 0.00 C ATOM 2217 CE LYS A 143 8.223 7.392 12.860 1.00 0.00 C ATOM 2218 NZ LYS A 143 7.575 8.096 11.719 1.00 0.00 N ATOM 0 H LYS A 143 10.087 3.666 11.452 1.00 0.00 H new ATOM 0 HA LYS A 143 10.426 5.114 8.916 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.040 7.075 10.207 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.855 5.898 10.737 1.00 0.00 H new ATOM 0 HG2 LYS A 143 10.143 5.417 12.751 1.00 0.00 H new ATOM 0 HG3 LYS A 143 11.469 6.419 12.197 1.00 0.00 H new ATOM 0 HD2 LYS A 143 10.120 7.644 13.836 1.00 0.00 H new ATOM 0 HD3 LYS A 143 10.013 8.422 12.269 1.00 0.00 H new ATOM 0 HE2 LYS A 143 7.950 6.337 12.838 1.00 0.00 H new ATOM 0 HE3 LYS A 143 7.847 7.799 13.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 7.097 8.952 12.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 8.297 8.362 11.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 6.877 7.466 11.274 1.00 0.00 H new