USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 759 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 112 SER OG : rot 13:sc= -0.602! USER MOD Set 1.2: A 114 SER OG : rot 180:sc= -0.0326 USER MOD Set 1.3: A 115 THR OG1 : rot -133:sc= 0.598! USER MOD Set 2.1: A 11 SER OG : rot 180:sc= -0.216 USER MOD Set 2.2: A 12 HIS : no HD1:sc= -4.24! C(o=-4.5!,f=-2.4!) USER MOD Single : A 6 SER OG : rot 30:sc= 0.581 USER MOD Single : A 7 LYS NZ :NH3+ 168:sc= 0.459 (180deg=0.399) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.381 USER MOD Single : A 21 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.305) USER MOD Single : A 22 SER OG : rot -75:sc= 0.557 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.708 K(o=-0.71,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -50:sc= 0.0262 USER MOD Single : A 37 ASN : amide:sc= -5.96! C(o=-6!,f=-4.1!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.824 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 128:sc= 0.46 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= -0.042 (180deg=-0.527) USER MOD Single : A 62 SER OG : rot -22:sc= 0.764 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 HIS : no HD1:sc= -0.343 X(o=-0.34,f=-0.058) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -159:sc= -1.63 (180deg=-2.85) USER MOD Single : A 91 ASN : amide:sc= 0.266 X(o=0.27,f=0) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0248 USER MOD Single : A 107 HIS : no HD1:sc= -0.555 K(o=-0.56,f=-0.046) USER MOD Single : A 110 SER OG : rot -108:sc= 0.53 USER MOD Single : A 121 LYS NZ :NH3+ 157:sc= -0.0865 (180deg=-0.64) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.228 X(o=-0.23,f=-0.27) USER MOD Single : A 126 ASN : amide:sc= -2.42 K(o=-2.4,f=-5.1!) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.561 15.290 0.665 1.00 0.00 N ATOM 81 CA SER A 6 -5.683 14.553 1.620 1.00 0.00 C ATOM 82 C SER A 6 -6.463 14.290 2.913 1.00 0.00 C ATOM 83 O SER A 6 -7.272 15.096 3.327 1.00 0.00 O ATOM 84 CB SER A 6 -4.439 15.394 1.925 1.00 0.00 C ATOM 85 OG SER A 6 -4.042 16.086 0.750 1.00 0.00 O ATOM 0 HA SER A 6 -5.372 13.605 1.182 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.652 16.104 2.724 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.629 14.753 2.275 1.00 0.00 H new ATOM 0 HG SER A 6 -4.830 16.271 0.198 1.00 0.00 H new ATOM 91 N LYS A 7 -6.238 13.167 3.549 1.00 0.00 N ATOM 92 CA LYS A 7 -6.983 12.859 4.812 1.00 0.00 C ATOM 93 C LYS A 7 -5.994 12.511 5.926 1.00 0.00 C ATOM 94 O LYS A 7 -5.045 11.785 5.721 1.00 0.00 O ATOM 95 CB LYS A 7 -7.919 11.672 4.573 1.00 0.00 C ATOM 96 CG LYS A 7 -8.979 12.058 3.535 1.00 0.00 C ATOM 97 CD LYS A 7 -10.153 11.071 3.588 1.00 0.00 C ATOM 98 CE LYS A 7 -9.787 9.790 2.836 1.00 0.00 C ATOM 99 NZ LYS A 7 -10.843 8.764 3.061 1.00 0.00 N ATOM 0 H LYS A 7 -5.574 12.452 3.251 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.565 13.732 5.108 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.350 10.811 4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.399 11.380 5.507 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -9.336 13.070 3.727 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.539 12.059 2.538 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.398 10.838 4.624 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.040 11.523 3.145 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -9.687 9.997 1.771 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.823 9.416 3.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -10.706 7.974 2.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.782 8.411 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.779 9.189 2.904 1.00 0.00 H new ATOM 113 N ALA A 8 -6.208 13.026 7.107 1.00 0.00 N ATOM 114 CA ALA A 8 -5.274 12.723 8.230 1.00 0.00 C ATOM 115 C ALA A 8 -5.621 11.368 8.850 1.00 0.00 C ATOM 116 O ALA A 8 -6.724 10.875 8.724 1.00 0.00 O ATOM 117 CB ALA A 8 -5.389 13.815 9.299 1.00 0.00 C ATOM 0 H ALA A 8 -6.987 13.641 7.342 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.255 12.690 7.846 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.707 13.594 10.120 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -5.131 14.780 8.863 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.411 13.849 9.676 1.00 0.00 H new ATOM 123 N TYR A 9 -4.680 10.768 9.524 1.00 0.00 N ATOM 124 CA TYR A 9 -4.933 9.449 10.167 1.00 0.00 C ATOM 125 C TYR A 9 -3.754 9.116 11.084 1.00 0.00 C ATOM 126 O TYR A 9 -2.611 9.149 10.678 1.00 0.00 O ATOM 127 CB TYR A 9 -5.077 8.369 9.086 1.00 0.00 C ATOM 128 CG TYR A 9 -5.994 7.273 9.581 1.00 0.00 C ATOM 129 CD1 TYR A 9 -5.650 6.532 10.718 1.00 0.00 C ATOM 130 CD2 TYR A 9 -7.189 6.997 8.902 1.00 0.00 C ATOM 131 CE1 TYR A 9 -6.499 5.516 11.177 1.00 0.00 C ATOM 132 CE2 TYR A 9 -8.036 5.980 9.360 1.00 0.00 C ATOM 133 CZ TYR A 9 -7.692 5.242 10.497 1.00 0.00 C ATOM 134 OH TYR A 9 -8.528 4.240 10.950 1.00 0.00 O ATOM 0 H TYR A 9 -3.739 11.138 9.658 1.00 0.00 H new ATOM 0 HA TYR A 9 -5.853 9.488 10.750 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -5.478 8.807 8.172 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.099 7.955 8.839 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.730 6.744 11.242 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.456 7.569 8.026 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.233 4.945 12.054 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -8.955 5.766 8.835 1.00 0.00 H new ATOM 0 HH TYR A 9 -9.313 4.180 10.366 1.00 0.00 H new ATOM 144 N GLY A 10 -4.017 8.806 12.320 1.00 0.00 N ATOM 145 CA GLY A 10 -2.903 8.484 13.254 1.00 0.00 C ATOM 146 C GLY A 10 -2.176 9.776 13.634 1.00 0.00 C ATOM 147 O GLY A 10 -2.219 10.211 14.766 1.00 0.00 O ATOM 0 H GLY A 10 -4.952 8.761 12.725 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.291 7.995 14.147 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.209 7.787 12.785 1.00 0.00 H new ATOM 151 N SER A 11 -1.516 10.398 12.693 1.00 0.00 N ATOM 152 CA SER A 11 -0.793 11.665 13.005 1.00 0.00 C ATOM 153 C SER A 11 -0.054 12.170 11.761 1.00 0.00 C ATOM 154 O SER A 11 0.945 12.854 11.862 1.00 0.00 O ATOM 155 CB SER A 11 0.216 11.411 14.128 1.00 0.00 C ATOM 156 OG SER A 11 0.809 10.130 13.946 1.00 0.00 O ATOM 0 H SER A 11 -1.447 10.084 11.725 1.00 0.00 H new ATOM 0 HA SER A 11 -1.515 12.419 13.321 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.984 12.184 14.124 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.281 11.460 15.097 1.00 0.00 H new ATOM 0 HG SER A 11 1.457 9.965 14.663 1.00 0.00 H new ATOM 162 N HIS A 12 -0.529 11.843 10.586 1.00 0.00 N ATOM 163 CA HIS A 12 0.154 12.311 9.350 1.00 0.00 C ATOM 164 C HIS A 12 -0.898 12.593 8.275 1.00 0.00 C ATOM 165 O HIS A 12 -1.974 12.032 8.285 1.00 0.00 O ATOM 166 CB HIS A 12 1.108 11.223 8.856 1.00 0.00 C ATOM 167 CG HIS A 12 2.004 10.780 9.979 1.00 0.00 C ATOM 168 ND1 HIS A 12 3.362 11.057 9.992 1.00 0.00 N ATOM 169 CD2 HIS A 12 1.755 10.074 11.131 1.00 0.00 C ATOM 170 CE1 HIS A 12 3.874 10.526 11.117 1.00 0.00 C ATOM 171 NE2 HIS A 12 2.937 9.916 11.847 1.00 0.00 N ATOM 0 H HIS A 12 -1.360 11.272 10.433 1.00 0.00 H new ATOM 0 HA HIS A 12 0.718 13.220 9.560 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.540 10.374 8.476 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.708 11.601 8.028 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.789 9.699 11.434 1.00 0.00 H new ATOM 0 HE1 HIS A 12 4.916 10.586 11.396 1.00 0.00 H new ATOM 0 HE2 HIS A 12 3.061 9.437 12.739 1.00 0.00 H new ATOM 179 N CYS A 13 -0.592 13.453 7.343 1.00 0.00 N ATOM 180 CA CYS A 13 -1.573 13.761 6.266 1.00 0.00 C ATOM 181 C CYS A 13 -1.417 12.739 5.141 1.00 0.00 C ATOM 182 O CYS A 13 -0.334 12.531 4.629 1.00 0.00 O ATOM 183 CB CYS A 13 -1.307 15.163 5.713 1.00 0.00 C ATOM 184 SG CYS A 13 -1.798 16.409 6.932 1.00 0.00 S ATOM 0 H CYS A 13 0.294 13.955 7.281 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.584 13.717 6.671 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.250 15.274 5.472 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -1.862 15.309 4.786 1.00 0.00 H new ATOM 0 HG CYS A 13 -1.567 17.596 6.456 1.00 0.00 H new ATOM 189 N TYR A 14 -2.484 12.097 4.755 1.00 0.00 N ATOM 190 CA TYR A 14 -2.392 11.085 3.666 1.00 0.00 C ATOM 191 C TYR A 14 -2.835 11.715 2.347 1.00 0.00 C ATOM 192 O TYR A 14 -3.811 12.434 2.294 1.00 0.00 O ATOM 193 CB TYR A 14 -3.297 9.892 3.987 1.00 0.00 C ATOM 194 CG TYR A 14 -2.735 9.131 5.166 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.680 9.737 6.428 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.264 7.822 4.998 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.157 9.034 7.518 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.742 7.120 6.090 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.688 7.726 7.349 1.00 0.00 C ATOM 200 OH TYR A 14 -1.172 7.035 8.427 1.00 0.00 O ATOM 0 H TYR A 14 -3.416 12.229 5.147 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.361 10.743 3.582 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.306 10.238 4.212 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.372 9.236 3.120 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.041 10.746 6.559 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.304 7.355 4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.115 9.501 8.491 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.381 6.110 5.961 1.00 0.00 H new ATOM 0 HH TYR A 14 -0.892 6.141 8.139 1.00 0.00 H new ATOM 210 N ALA A 15 -2.123 11.454 1.283 1.00 0.00 N ATOM 211 CA ALA A 15 -2.501 12.040 -0.036 1.00 0.00 C ATOM 212 C ALA A 15 -2.494 10.947 -1.106 1.00 0.00 C ATOM 213 O ALA A 15 -1.666 10.057 -1.096 1.00 0.00 O ATOM 214 CB ALA A 15 -1.496 13.129 -0.415 1.00 0.00 C ATOM 0 H ALA A 15 -1.294 10.859 1.271 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.500 12.471 0.033 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.771 13.558 -1.379 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.502 13.910 0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.498 12.696 -0.482 1.00 0.00 H new ATOM 220 N LEU A 16 -3.415 11.012 -2.028 1.00 0.00 N ATOM 221 CA LEU A 16 -3.480 9.985 -3.109 1.00 0.00 C ATOM 222 C LEU A 16 -2.907 10.578 -4.401 1.00 0.00 C ATOM 223 O LEU A 16 -3.381 11.584 -4.891 1.00 0.00 O ATOM 224 CB LEU A 16 -4.950 9.583 -3.318 1.00 0.00 C ATOM 225 CG LEU A 16 -5.151 8.936 -4.696 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.259 7.701 -4.825 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.616 8.522 -4.852 1.00 0.00 C ATOM 0 H LEU A 16 -4.131 11.737 -2.080 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.898 9.105 -2.834 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.255 8.887 -2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.588 10.462 -3.228 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.886 9.653 -5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.406 7.247 -5.805 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.215 7.993 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.519 6.982 -4.049 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.762 8.062 -5.829 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.877 7.807 -4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.254 9.402 -4.766 1.00 0.00 H new ATOM 239 N PHE A 17 -1.902 9.957 -4.962 1.00 0.00 N ATOM 240 CA PHE A 17 -1.313 10.469 -6.223 1.00 0.00 C ATOM 241 C PHE A 17 -1.761 9.558 -7.359 1.00 0.00 C ATOM 242 O PHE A 17 -1.375 8.407 -7.435 1.00 0.00 O ATOM 243 CB PHE A 17 0.217 10.453 -6.119 1.00 0.00 C ATOM 244 CG PHE A 17 0.695 11.720 -5.448 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.226 12.055 -4.171 1.00 0.00 C ATOM 246 CD2 PHE A 17 1.607 12.560 -6.101 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.669 13.229 -3.549 1.00 0.00 C ATOM 248 CE2 PHE A 17 2.048 13.734 -5.478 1.00 0.00 C ATOM 249 CZ PHE A 17 1.579 14.068 -4.203 1.00 0.00 C ATOM 0 H PHE A 17 -1.465 9.112 -4.594 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.642 11.492 -6.408 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.543 9.583 -5.549 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.658 10.367 -7.112 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.477 11.408 -3.667 1.00 0.00 H new ATOM 0 HD2 PHE A 17 1.970 12.302 -7.085 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.308 13.487 -2.564 1.00 0.00 H new ATOM 0 HE2 PHE A 17 2.750 14.382 -5.982 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.919 14.974 -3.723 1.00 0.00 H new ATOM 259 N LEU A 18 -2.562 10.061 -8.250 1.00 0.00 N ATOM 260 CA LEU A 18 -3.020 9.224 -9.384 1.00 0.00 C ATOM 261 C LEU A 18 -1.820 9.000 -10.285 1.00 0.00 C ATOM 262 O LEU A 18 -1.936 8.550 -11.408 1.00 0.00 O ATOM 263 CB LEU A 18 -4.126 9.955 -10.164 1.00 0.00 C ATOM 264 CG LEU A 18 -5.508 9.677 -9.548 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.014 8.299 -9.993 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.429 9.730 -8.017 1.00 0.00 C ATOM 0 H LEU A 18 -2.919 11.016 -8.241 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.424 8.277 -9.028 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.931 11.027 -10.160 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.116 9.633 -11.205 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.203 10.443 -9.893 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.993 8.111 -9.552 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.095 8.275 -11.080 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.314 7.531 -9.664 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.414 9.531 -7.595 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.724 8.978 -7.663 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -5.093 10.718 -7.704 1.00 0.00 H new ATOM 278 N SER A 19 -0.655 9.325 -9.791 1.00 0.00 N ATOM 279 CA SER A 19 0.574 9.145 -10.618 1.00 0.00 C ATOM 280 C SER A 19 1.229 7.792 -10.290 1.00 0.00 C ATOM 281 O SER A 19 1.522 7.508 -9.147 1.00 0.00 O ATOM 282 CB SER A 19 1.568 10.271 -10.325 1.00 0.00 C ATOM 283 OG SER A 19 1.040 11.114 -9.310 1.00 0.00 O ATOM 0 H SER A 19 -0.501 9.705 -8.857 1.00 0.00 H new ATOM 0 HA SER A 19 0.297 9.170 -11.672 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.523 9.854 -10.006 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.758 10.848 -11.230 1.00 0.00 H new ATOM 0 HG SER A 19 1.676 11.835 -9.120 1.00 0.00 H new ATOM 289 N PRO A 20 1.464 6.965 -11.282 1.00 0.00 N ATOM 290 CA PRO A 20 2.105 5.640 -11.046 1.00 0.00 C ATOM 291 C PRO A 20 3.534 5.777 -10.503 1.00 0.00 C ATOM 292 O PRO A 20 4.249 6.693 -10.852 1.00 0.00 O ATOM 293 CB PRO A 20 2.122 5.020 -12.445 1.00 0.00 C ATOM 294 CG PRO A 20 1.512 6.017 -13.441 1.00 0.00 C ATOM 295 CD PRO A 20 1.105 7.283 -12.691 1.00 0.00 C ATOM 0 HA PRO A 20 1.574 5.046 -10.301 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.143 4.775 -12.736 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.556 4.088 -12.451 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.233 6.258 -14.222 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.645 5.575 -13.932 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.641 8.159 -13.057 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.041 7.492 -12.799 1.00 0.00 H new ATOM 303 N LYS A 21 3.962 4.860 -9.671 1.00 0.00 N ATOM 304 CA LYS A 21 5.354 4.932 -9.121 1.00 0.00 C ATOM 305 C LYS A 21 5.755 3.548 -8.597 1.00 0.00 C ATOM 306 O LYS A 21 5.059 2.958 -7.801 1.00 0.00 O ATOM 307 CB LYS A 21 5.411 5.938 -7.959 1.00 0.00 C ATOM 308 CG LYS A 21 5.487 7.384 -8.477 1.00 0.00 C ATOM 309 CD LYS A 21 6.714 7.569 -9.380 1.00 0.00 C ATOM 310 CE LYS A 21 7.259 8.992 -9.226 1.00 0.00 C ATOM 311 NZ LYS A 21 6.167 9.971 -9.489 1.00 0.00 N ATOM 0 H LYS A 21 3.410 4.065 -9.348 1.00 0.00 H new ATOM 0 HA LYS A 21 6.035 5.252 -9.910 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.529 5.821 -7.330 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.279 5.727 -7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 21 4.580 7.626 -9.032 1.00 0.00 H new ATOM 0 HG3 LYS A 21 5.540 8.075 -7.636 1.00 0.00 H new ATOM 0 HD2 LYS A 21 7.484 6.844 -9.116 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.444 7.383 -10.420 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.656 9.134 -8.221 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.083 9.155 -9.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.578 10.909 -9.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.620 9.666 -10.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.540 10.022 -8.661 1.00 0.00 H new ATOM 325 N SER A 22 6.878 3.030 -9.022 1.00 0.00 N ATOM 326 CA SER A 22 7.315 1.689 -8.530 1.00 0.00 C ATOM 327 C SER A 22 7.158 1.631 -7.010 1.00 0.00 C ATOM 328 O SER A 22 7.269 2.630 -6.331 1.00 0.00 O ATOM 329 CB SER A 22 8.782 1.466 -8.895 1.00 0.00 C ATOM 330 OG SER A 22 8.929 1.510 -10.308 1.00 0.00 O ATOM 0 H SER A 22 7.510 3.476 -9.687 1.00 0.00 H new ATOM 0 HA SER A 22 6.702 0.915 -8.992 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.404 2.230 -8.430 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.121 0.503 -8.513 1.00 0.00 H new ATOM 0 HG SER A 22 8.588 0.678 -10.698 1.00 0.00 H new ATOM 336 N TRP A 23 6.907 0.470 -6.466 1.00 0.00 N ATOM 337 CA TRP A 23 6.757 0.373 -4.988 1.00 0.00 C ATOM 338 C TRP A 23 8.061 0.826 -4.344 1.00 0.00 C ATOM 339 O TRP A 23 8.101 1.226 -3.200 1.00 0.00 O ATOM 340 CB TRP A 23 6.471 -1.077 -4.588 1.00 0.00 C ATOM 341 CG TRP A 23 6.543 -1.207 -3.100 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.476 -1.262 -2.271 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.724 -1.298 -2.251 1.00 0.00 C ATOM 344 NE1 TRP A 23 5.925 -1.379 -0.967 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.304 -1.405 -0.903 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.107 -1.296 -2.515 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.222 -1.508 0.143 1.00 0.00 C ATOM 348 CZ3 TRP A 23 10.032 -1.399 -1.465 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.591 -1.504 -0.138 1.00 0.00 C ATOM 0 H TRP A 23 6.800 -0.407 -6.977 1.00 0.00 H new ATOM 0 HA TRP A 23 5.930 1.001 -4.656 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.484 -1.375 -4.943 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.194 -1.744 -5.057 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.441 -1.221 -2.577 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.313 -1.439 -0.153 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.458 -1.215 -3.533 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.877 -1.590 1.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.090 -1.397 -1.680 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.308 -1.582 0.666 1.00 0.00 H new ATOM 360 N THR A 24 9.129 0.764 -5.083 1.00 0.00 N ATOM 361 CA THR A 24 10.449 1.185 -4.540 1.00 0.00 C ATOM 362 C THR A 24 10.661 2.668 -4.842 1.00 0.00 C ATOM 363 O THR A 24 11.474 3.334 -4.233 1.00 0.00 O ATOM 364 CB THR A 24 11.552 0.354 -5.199 1.00 0.00 C ATOM 365 OG1 THR A 24 12.756 0.492 -4.456 1.00 0.00 O ATOM 366 CG2 THR A 24 11.779 0.831 -6.635 1.00 0.00 C ATOM 0 H THR A 24 9.146 0.437 -6.049 1.00 0.00 H new ATOM 0 HA THR A 24 10.479 1.028 -3.462 1.00 0.00 H new ATOM 0 HB THR A 24 11.250 -0.693 -5.215 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.463 -0.041 -4.876 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.566 0.234 -7.097 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.857 0.720 -7.205 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.076 1.880 -6.627 1.00 0.00 H new ATOM 374 N ASP A 25 9.927 3.181 -5.788 1.00 0.00 N ATOM 375 CA ASP A 25 10.063 4.616 -6.158 1.00 0.00 C ATOM 376 C ASP A 25 9.147 5.452 -5.273 1.00 0.00 C ATOM 377 O ASP A 25 9.527 6.501 -4.789 1.00 0.00 O ATOM 378 CB ASP A 25 9.675 4.811 -7.623 1.00 0.00 C ATOM 379 CG ASP A 25 9.732 6.299 -7.970 1.00 0.00 C ATOM 380 OD1 ASP A 25 9.026 7.064 -7.334 1.00 0.00 O ATOM 381 OD2 ASP A 25 10.481 6.650 -8.868 1.00 0.00 O ATOM 0 H ASP A 25 9.232 2.663 -6.326 1.00 0.00 H new ATOM 0 HA ASP A 25 11.097 4.931 -6.017 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.352 4.250 -8.268 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.672 4.423 -7.800 1.00 0.00 H new ATOM 386 N ALA A 26 7.949 4.991 -5.033 1.00 0.00 N ATOM 387 CA ALA A 26 7.040 5.759 -4.157 1.00 0.00 C ATOM 388 C ALA A 26 7.549 5.583 -2.738 1.00 0.00 C ATOM 389 O ALA A 26 7.427 6.451 -1.900 1.00 0.00 O ATOM 390 CB ALA A 26 5.622 5.212 -4.285 1.00 0.00 C ATOM 0 H ALA A 26 7.569 4.121 -5.406 1.00 0.00 H new ATOM 0 HA ALA A 26 7.018 6.814 -4.431 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.953 5.780 -3.638 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.289 5.302 -5.319 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.609 4.163 -3.989 1.00 0.00 H new ATOM 396 N ASP A 27 8.136 4.450 -2.473 1.00 0.00 N ATOM 397 CA ASP A 27 8.681 4.186 -1.123 1.00 0.00 C ATOM 398 C ASP A 27 9.816 5.172 -0.830 1.00 0.00 C ATOM 399 O ASP A 27 9.935 5.692 0.261 1.00 0.00 O ATOM 400 CB ASP A 27 9.223 2.760 -1.093 1.00 0.00 C ATOM 401 CG ASP A 27 9.970 2.516 0.220 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.549 3.061 1.227 1.00 0.00 O ATOM 403 OD2 ASP A 27 10.951 1.791 0.196 1.00 0.00 O ATOM 0 H ASP A 27 8.260 3.692 -3.144 1.00 0.00 H new ATOM 0 HA ASP A 27 7.901 4.307 -0.371 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.404 2.048 -1.194 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.892 2.598 -1.938 1.00 0.00 H new ATOM 408 N LEU A 28 10.655 5.428 -1.798 1.00 0.00 N ATOM 409 CA LEU A 28 11.789 6.372 -1.581 1.00 0.00 C ATOM 410 C LEU A 28 11.272 7.813 -1.521 1.00 0.00 C ATOM 411 O LEU A 28 11.627 8.573 -0.642 1.00 0.00 O ATOM 412 CB LEU A 28 12.786 6.239 -2.736 1.00 0.00 C ATOM 413 CG LEU A 28 14.099 6.949 -2.374 1.00 0.00 C ATOM 414 CD1 LEU A 28 14.990 6.012 -1.552 1.00 0.00 C ATOM 415 CD2 LEU A 28 14.835 7.343 -3.659 1.00 0.00 C ATOM 0 H LEU A 28 10.603 5.023 -2.733 1.00 0.00 H new ATOM 0 HA LEU A 28 12.279 6.130 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.977 5.186 -2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.366 6.673 -3.643 1.00 0.00 H new ATOM 0 HG LEU A 28 13.873 7.840 -1.788 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.919 6.523 -1.299 1.00 0.00 H new ATOM 0 HD12 LEU A 28 14.472 5.727 -0.636 1.00 0.00 H new ATOM 0 HD13 LEU A 28 15.214 5.119 -2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 28 15.767 7.847 -3.404 1.00 0.00 H new ATOM 0 HD22 LEU A 28 15.054 6.448 -4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.208 8.014 -4.246 1.00 0.00 H new ATOM 427 N ALA A 29 10.444 8.200 -2.451 1.00 0.00 N ATOM 428 CA ALA A 29 9.919 9.596 -2.445 1.00 0.00 C ATOM 429 C ALA A 29 9.044 9.814 -1.211 1.00 0.00 C ATOM 430 O ALA A 29 9.212 10.774 -0.486 1.00 0.00 O ATOM 431 CB ALA A 29 9.088 9.835 -3.702 1.00 0.00 C ATOM 0 H ALA A 29 10.108 7.612 -3.214 1.00 0.00 H new ATOM 0 HA ALA A 29 10.757 10.293 -2.423 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.705 10.855 -3.696 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.711 9.686 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.253 9.134 -3.725 1.00 0.00 H new ATOM 437 N CYS A 30 8.112 8.937 -0.956 1.00 0.00 N ATOM 438 CA CYS A 30 7.253 9.120 0.238 1.00 0.00 C ATOM 439 C CYS A 30 8.129 9.029 1.482 1.00 0.00 C ATOM 440 O CYS A 30 7.779 9.511 2.539 1.00 0.00 O ATOM 441 CB CYS A 30 6.173 8.040 0.251 1.00 0.00 C ATOM 442 SG CYS A 30 5.107 8.267 -1.191 1.00 0.00 S ATOM 0 H CYS A 30 7.912 8.110 -1.519 1.00 0.00 H new ATOM 0 HA CYS A 30 6.764 10.094 0.217 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.629 7.050 0.232 1.00 0.00 H new ATOM 0 HB3 CYS A 30 5.587 8.103 1.168 1.00 0.00 H new ATOM 447 N GLN A 31 9.289 8.444 1.355 1.00 0.00 N ATOM 448 CA GLN A 31 10.208 8.360 2.522 1.00 0.00 C ATOM 449 C GLN A 31 10.913 9.706 2.655 1.00 0.00 C ATOM 450 O GLN A 31 11.291 10.125 3.730 1.00 0.00 O ATOM 451 CB GLN A 31 11.243 7.254 2.295 1.00 0.00 C ATOM 452 CG GLN A 31 12.329 7.339 3.371 1.00 0.00 C ATOM 453 CD GLN A 31 13.155 6.052 3.366 1.00 0.00 C ATOM 454 OE1 GLN A 31 13.768 5.706 4.356 1.00 0.00 O ATOM 455 NE2 GLN A 31 13.197 5.324 2.284 1.00 0.00 N ATOM 0 H GLN A 31 9.638 8.022 0.495 1.00 0.00 H new ATOM 0 HA GLN A 31 9.650 8.127 3.429 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.760 6.277 2.328 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.688 7.356 1.305 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.974 8.198 3.185 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.874 7.488 4.350 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.682 5.615 1.453 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.745 4.464 2.269 1.00 0.00 H new ATOM 464 N LYS A 32 11.077 10.389 1.556 1.00 0.00 N ATOM 465 CA LYS A 32 11.739 11.714 1.588 1.00 0.00 C ATOM 466 C LYS A 32 10.797 12.720 2.256 1.00 0.00 C ATOM 467 O LYS A 32 11.158 13.852 2.515 1.00 0.00 O ATOM 468 CB LYS A 32 12.049 12.153 0.152 1.00 0.00 C ATOM 469 CG LYS A 32 12.393 13.642 0.122 1.00 0.00 C ATOM 470 CD LYS A 32 13.072 13.982 -1.206 1.00 0.00 C ATOM 471 CE LYS A 32 12.135 13.630 -2.366 1.00 0.00 C ATOM 472 NZ LYS A 32 12.550 14.382 -3.584 1.00 0.00 N ATOM 0 H LYS A 32 10.777 10.079 0.632 1.00 0.00 H new ATOM 0 HA LYS A 32 12.670 11.661 2.153 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.882 11.571 -0.243 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.190 11.957 -0.490 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.488 14.238 0.243 1.00 0.00 H new ATOM 0 HG3 LYS A 32 13.052 13.891 0.954 1.00 0.00 H new ATOM 0 HD2 LYS A 32 13.323 15.042 -1.237 1.00 0.00 H new ATOM 0 HD3 LYS A 32 14.007 13.430 -1.300 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.165 12.558 -2.560 1.00 0.00 H new ATOM 0 HE3 LYS A 32 11.106 13.878 -2.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 11.915 14.144 -4.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 12.500 15.403 -3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.526 14.124 -3.836 1.00 0.00 H new ATOM 486 N ARG A 33 9.589 12.307 2.534 1.00 0.00 N ATOM 487 CA ARG A 33 8.609 13.222 3.185 1.00 0.00 C ATOM 488 C ARG A 33 8.811 13.185 4.699 1.00 0.00 C ATOM 489 O ARG A 33 9.388 12.255 5.223 1.00 0.00 O ATOM 490 CB ARG A 33 7.188 12.757 2.829 1.00 0.00 C ATOM 491 CG ARG A 33 6.697 13.507 1.586 1.00 0.00 C ATOM 492 CD ARG A 33 5.308 12.999 1.195 1.00 0.00 C ATOM 493 NE ARG A 33 4.805 13.781 0.032 1.00 0.00 N ATOM 494 CZ ARG A 33 3.650 13.490 -0.501 1.00 0.00 C ATOM 495 NH1 ARG A 33 2.818 12.708 0.133 1.00 0.00 N ATOM 496 NH2 ARG A 33 3.326 13.980 -1.666 1.00 0.00 N ATOM 0 H ARG A 33 9.238 11.370 2.337 1.00 0.00 H new ATOM 0 HA ARG A 33 8.755 14.244 2.835 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.182 11.683 2.644 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.514 12.940 3.666 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.661 14.578 1.786 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.394 13.360 0.761 1.00 0.00 H new ATOM 0 HD2 ARG A 33 5.354 11.940 0.943 1.00 0.00 H new ATOM 0 HD3 ARG A 33 4.623 13.097 2.037 1.00 0.00 H new ATOM 0 HE ARG A 33 5.364 14.545 -0.348 1.00 0.00 H new ATOM 0 HH11 ARG A 33 3.071 12.325 1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 33 1.915 12.480 -0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 33 3.976 14.591 -2.161 1.00 0.00 H new ATOM 0 HH22 ARG A 33 2.423 13.752 -2.082 1.00 0.00 H new ATOM 510 N PRO A 34 8.336 14.186 5.405 1.00 0.00 N ATOM 511 CA PRO A 34 8.485 14.221 6.882 1.00 0.00 C ATOM 512 C PRO A 34 8.111 12.878 7.512 1.00 0.00 C ATOM 513 O PRO A 34 7.011 12.681 7.986 1.00 0.00 O ATOM 514 CB PRO A 34 7.518 15.344 7.286 1.00 0.00 C ATOM 515 CG PRO A 34 6.875 15.916 6.011 1.00 0.00 C ATOM 516 CD PRO A 34 7.616 15.336 4.800 1.00 0.00 C ATOM 0 HA PRO A 34 9.507 14.400 7.217 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.750 14.960 7.958 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.051 16.127 7.826 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.817 15.657 5.969 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.937 17.004 6.009 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.930 15.021 4.014 1.00 0.00 H new ATOM 0 HD3 PRO A 34 8.300 16.058 4.355 1.00 0.00 H new ATOM 524 N SER A 35 9.024 11.950 7.493 1.00 0.00 N ATOM 525 CA SER A 35 8.737 10.609 8.062 1.00 0.00 C ATOM 526 C SER A 35 7.608 9.963 7.264 1.00 0.00 C ATOM 527 O SER A 35 6.954 9.049 7.725 1.00 0.00 O ATOM 528 CB SER A 35 8.329 10.746 9.529 1.00 0.00 C ATOM 529 OG SER A 35 8.556 9.511 10.197 1.00 0.00 O ATOM 0 H SER A 35 9.961 12.065 7.106 1.00 0.00 H new ATOM 0 HA SER A 35 9.629 9.985 8.003 1.00 0.00 H new ATOM 0 HB2 SER A 35 8.903 11.541 10.005 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.278 11.024 9.602 1.00 0.00 H new ATOM 0 HG SER A 35 8.146 8.782 9.686 1.00 0.00 H new ATOM 535 N GLY A 36 7.367 10.431 6.068 1.00 0.00 N ATOM 536 CA GLY A 36 6.273 9.836 5.251 1.00 0.00 C ATOM 537 C GLY A 36 6.739 8.511 4.639 1.00 0.00 C ATOM 538 O GLY A 36 7.849 8.071 4.858 1.00 0.00 O ATOM 0 H GLY A 36 7.878 11.195 5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.393 9.670 5.872 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.980 10.528 4.461 1.00 0.00 H new ATOM 542 N ASN A 37 5.891 7.877 3.873 1.00 0.00 N ATOM 543 CA ASN A 37 6.259 6.574 3.235 1.00 0.00 C ATOM 544 C ASN A 37 4.975 5.892 2.749 1.00 0.00 C ATOM 545 O ASN A 37 3.939 6.019 3.370 1.00 0.00 O ATOM 546 CB ASN A 37 6.963 5.665 4.258 1.00 0.00 C ATOM 547 CG ASN A 37 8.468 5.621 3.977 1.00 0.00 C ATOM 548 OD1 ASN A 37 9.249 6.230 4.679 1.00 0.00 O ATOM 549 ND2 ASN A 37 8.906 4.911 2.972 1.00 0.00 N ATOM 0 H ASN A 37 4.950 8.207 3.659 1.00 0.00 H new ATOM 0 HA ASN A 37 6.935 6.752 2.399 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.785 6.035 5.268 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.547 4.659 4.209 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.906 4.867 2.776 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.248 4.400 2.383 1.00 0.00 H new ATOM 556 N LEU A 38 5.029 5.175 1.646 1.00 0.00 N ATOM 557 CA LEU A 38 3.801 4.482 1.129 1.00 0.00 C ATOM 558 C LEU A 38 2.786 4.270 2.264 1.00 0.00 C ATOM 559 O LEU A 38 3.130 3.861 3.354 1.00 0.00 O ATOM 560 CB LEU A 38 4.200 3.131 0.533 1.00 0.00 C ATOM 561 CG LEU A 38 4.910 3.355 -0.805 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.620 2.070 -1.237 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.886 3.758 -1.871 1.00 0.00 C ATOM 0 H LEU A 38 5.869 5.041 1.083 1.00 0.00 H new ATOM 0 HA LEU A 38 3.338 5.102 0.362 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.856 2.597 1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.316 2.509 0.389 1.00 0.00 H new ATOM 0 HG LEU A 38 5.646 4.151 -0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.123 2.235 -2.190 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.354 1.789 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.888 1.270 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.394 3.917 -2.822 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.146 2.965 -1.983 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.388 4.679 -1.568 1.00 0.00 H new ATOM 575 N VAL A 39 1.539 4.573 2.012 1.00 0.00 N ATOM 576 CA VAL A 39 0.480 4.430 3.061 1.00 0.00 C ATOM 577 C VAL A 39 0.714 3.194 3.936 1.00 0.00 C ATOM 578 O VAL A 39 1.397 2.262 3.559 1.00 0.00 O ATOM 579 CB VAL A 39 -0.887 4.319 2.383 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.839 3.241 1.300 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.949 3.945 3.421 1.00 0.00 C ATOM 0 H VAL A 39 1.203 4.918 1.113 1.00 0.00 H new ATOM 0 HA VAL A 39 0.518 5.310 3.704 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.140 5.278 1.932 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.814 3.165 0.819 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.087 3.506 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.581 2.283 1.751 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.921 3.867 2.935 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.693 2.988 3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.990 4.714 4.193 1.00 0.00 H new ATOM 591 N SER A 40 0.131 3.195 5.110 1.00 0.00 N ATOM 592 CA SER A 40 0.279 2.042 6.053 1.00 0.00 C ATOM 593 C SER A 40 -1.099 1.408 6.297 1.00 0.00 C ATOM 594 O SER A 40 -2.103 1.886 5.807 1.00 0.00 O ATOM 595 CB SER A 40 0.841 2.556 7.381 1.00 0.00 C ATOM 596 OG SER A 40 0.253 1.833 8.453 1.00 0.00 O ATOM 0 H SER A 40 -0.450 3.957 5.460 1.00 0.00 H new ATOM 0 HA SER A 40 0.953 1.298 5.628 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.925 2.439 7.400 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.634 3.621 7.489 1.00 0.00 H new ATOM 0 HG SER A 40 0.613 2.159 9.304 1.00 0.00 H new ATOM 602 N VAL A 41 -1.161 0.340 7.057 1.00 0.00 N ATOM 603 CA VAL A 41 -2.482 -0.309 7.331 1.00 0.00 C ATOM 604 C VAL A 41 -2.329 -1.312 8.487 1.00 0.00 C ATOM 605 O VAL A 41 -2.078 -2.480 8.275 1.00 0.00 O ATOM 606 CB VAL A 41 -2.995 -1.047 6.069 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.252 -0.357 5.539 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.932 -1.040 4.964 1.00 0.00 C ATOM 0 H VAL A 41 -0.358 -0.108 7.497 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.203 0.461 7.604 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.218 -2.077 6.348 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.608 -0.881 4.652 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.027 -0.374 6.305 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.019 0.676 5.282 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.314 -1.564 4.088 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.693 -0.011 4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.032 -1.540 5.322 1.00 0.00 H new ATOM 618 N LEU A 42 -2.478 -0.867 9.710 1.00 0.00 N ATOM 619 CA LEU A 42 -2.339 -1.799 10.877 1.00 0.00 C ATOM 620 C LEU A 42 -3.678 -1.944 11.606 1.00 0.00 C ATOM 621 O LEU A 42 -3.733 -2.452 12.708 1.00 0.00 O ATOM 622 CB LEU A 42 -1.301 -1.249 11.856 1.00 0.00 C ATOM 623 CG LEU A 42 0.095 -1.379 11.250 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.078 -0.530 12.059 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.539 -2.842 11.287 1.00 0.00 C ATOM 0 H LEU A 42 -2.690 0.101 9.953 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.022 -2.773 10.505 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.515 -0.204 12.080 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.351 -1.794 12.799 1.00 0.00 H new ATOM 0 HG LEU A 42 0.075 -1.034 10.216 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.076 -0.620 11.630 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.765 0.514 12.033 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.095 -0.878 13.092 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.535 -2.931 10.854 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.560 -3.190 12.320 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.161 -3.449 10.714 1.00 0.00 H new ATOM 637 N SER A 43 -4.754 -1.506 11.012 1.00 0.00 N ATOM 638 CA SER A 43 -6.075 -1.629 11.696 1.00 0.00 C ATOM 639 C SER A 43 -7.158 -1.985 10.677 1.00 0.00 C ATOM 640 O SER A 43 -7.101 -1.586 9.531 1.00 0.00 O ATOM 641 CB SER A 43 -6.425 -0.300 12.366 1.00 0.00 C ATOM 642 OG SER A 43 -7.594 -0.468 13.159 1.00 0.00 O ATOM 0 H SER A 43 -4.778 -1.071 10.090 1.00 0.00 H new ATOM 0 HA SER A 43 -6.018 -2.416 12.448 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.595 0.037 12.987 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.591 0.469 11.611 1.00 0.00 H new ATOM 0 HG SER A 43 -7.821 0.382 13.592 1.00 0.00 H new ATOM 648 N GLY A 44 -8.150 -2.726 11.090 1.00 0.00 N ATOM 649 CA GLY A 44 -9.242 -3.102 10.149 1.00 0.00 C ATOM 650 C GLY A 44 -9.957 -1.835 9.685 1.00 0.00 C ATOM 651 O GLY A 44 -10.641 -1.825 8.681 1.00 0.00 O ATOM 0 H GLY A 44 -8.251 -3.087 12.039 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.833 -3.638 9.293 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.947 -3.774 10.639 1.00 0.00 H new ATOM 655 N ALA A 45 -9.798 -0.762 10.410 1.00 0.00 N ATOM 656 CA ALA A 45 -10.460 0.511 10.015 1.00 0.00 C ATOM 657 C ALA A 45 -9.587 1.232 8.990 1.00 0.00 C ATOM 658 O ALA A 45 -10.076 1.890 8.096 1.00 0.00 O ATOM 659 CB ALA A 45 -10.632 1.398 11.248 1.00 0.00 C ATOM 0 H ALA A 45 -9.237 -0.713 11.260 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.437 0.298 9.582 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.117 2.331 10.960 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.247 0.882 11.985 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.655 1.615 11.679 1.00 0.00 H new ATOM 665 N GLU A 46 -8.293 1.110 9.112 1.00 0.00 N ATOM 666 CA GLU A 46 -7.386 1.787 8.143 1.00 0.00 C ATOM 667 C GLU A 46 -7.487 1.087 6.787 1.00 0.00 C ATOM 668 O GLU A 46 -7.528 1.719 5.754 1.00 0.00 O ATOM 669 CB GLU A 46 -5.946 1.709 8.653 1.00 0.00 C ATOM 670 CG GLU A 46 -5.759 2.694 9.807 1.00 0.00 C ATOM 671 CD GLU A 46 -4.404 2.448 10.476 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.555 1.842 9.842 1.00 0.00 O ATOM 673 OE2 GLU A 46 -4.239 2.870 11.609 1.00 0.00 O ATOM 0 H GLU A 46 -7.825 0.571 9.841 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.675 2.833 8.038 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.721 0.696 8.986 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.250 1.941 7.847 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.813 3.718 9.437 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.562 2.575 10.534 1.00 0.00 H new ATOM 680 N GLY A 47 -7.534 -0.217 6.785 1.00 0.00 N ATOM 681 CA GLY A 47 -7.639 -0.952 5.491 1.00 0.00 C ATOM 682 C GLY A 47 -8.921 -0.527 4.777 1.00 0.00 C ATOM 683 O GLY A 47 -8.978 -0.472 3.565 1.00 0.00 O ATOM 0 H GLY A 47 -7.504 -0.804 7.619 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.772 -0.738 4.866 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.647 -2.027 5.669 1.00 0.00 H new ATOM 687 N SER A 48 -9.945 -0.215 5.520 1.00 0.00 N ATOM 688 CA SER A 48 -11.220 0.218 4.889 1.00 0.00 C ATOM 689 C SER A 48 -11.144 1.717 4.598 1.00 0.00 C ATOM 690 O SER A 48 -11.746 2.212 3.666 1.00 0.00 O ATOM 691 CB SER A 48 -12.385 -0.060 5.840 1.00 0.00 C ATOM 692 OG SER A 48 -13.613 0.168 5.160 1.00 0.00 O ATOM 0 H SER A 48 -9.953 -0.242 6.540 1.00 0.00 H new ATOM 0 HA SER A 48 -11.378 -0.332 3.961 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.340 -1.089 6.197 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.316 0.585 6.716 1.00 0.00 H new ATOM 0 HG SER A 48 -14.361 -0.011 5.767 1.00 0.00 H new ATOM 698 N PHE A 49 -10.401 2.444 5.388 1.00 0.00 N ATOM 699 CA PHE A 49 -10.276 3.909 5.161 1.00 0.00 C ATOM 700 C PHE A 49 -9.459 4.152 3.891 1.00 0.00 C ATOM 701 O PHE A 49 -9.860 4.896 3.017 1.00 0.00 O ATOM 702 CB PHE A 49 -9.571 4.554 6.359 1.00 0.00 C ATOM 703 CG PHE A 49 -9.932 6.019 6.435 1.00 0.00 C ATOM 704 CD1 PHE A 49 -11.150 6.409 7.005 1.00 0.00 C ATOM 705 CD2 PHE A 49 -9.049 6.987 5.940 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.485 7.768 7.079 1.00 0.00 C ATOM 707 CE2 PHE A 49 -9.384 8.343 6.015 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.602 8.734 6.583 1.00 0.00 C ATOM 0 H PHE A 49 -9.874 2.083 6.183 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.267 4.350 5.048 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.863 4.049 7.280 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.491 4.440 6.262 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.831 5.663 7.387 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.109 6.686 5.500 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.424 8.070 7.519 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -8.702 9.089 5.634 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.860 9.781 6.639 1.00 0.00 H new ATOM 718 N VAL A 50 -8.319 3.525 3.775 1.00 0.00 N ATOM 719 CA VAL A 50 -7.488 3.720 2.556 1.00 0.00 C ATOM 720 C VAL A 50 -8.295 3.288 1.334 1.00 0.00 C ATOM 721 O VAL A 50 -8.299 3.950 0.316 1.00 0.00 O ATOM 722 CB VAL A 50 -6.215 2.875 2.653 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.363 3.092 1.400 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.416 3.297 3.888 1.00 0.00 C ATOM 0 H VAL A 50 -7.930 2.888 4.470 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.210 4.770 2.467 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.484 1.822 2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.456 2.491 1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.930 2.794 0.518 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.095 4.145 1.320 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.509 2.696 3.958 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.147 4.350 3.805 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.021 3.146 4.782 1.00 0.00 H new ATOM 734 N SER A 51 -8.986 2.184 1.432 1.00 0.00 N ATOM 735 CA SER A 51 -9.799 1.709 0.279 1.00 0.00 C ATOM 736 C SER A 51 -10.774 2.810 -0.138 1.00 0.00 C ATOM 737 O SER A 51 -11.004 3.038 -1.307 1.00 0.00 O ATOM 738 CB SER A 51 -10.587 0.465 0.691 1.00 0.00 C ATOM 739 OG SER A 51 -11.710 0.314 -0.166 1.00 0.00 O ATOM 0 H SER A 51 -9.022 1.592 2.262 1.00 0.00 H new ATOM 0 HA SER A 51 -9.142 1.465 -0.556 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.950 -0.418 0.634 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.915 0.555 1.727 1.00 0.00 H new ATOM 0 HG SER A 51 -11.719 -0.593 -0.537 1.00 0.00 H new ATOM 745 N SER A 52 -11.350 3.496 0.811 1.00 0.00 N ATOM 746 CA SER A 52 -12.312 4.582 0.471 1.00 0.00 C ATOM 747 C SER A 52 -11.552 5.786 -0.092 1.00 0.00 C ATOM 748 O SER A 52 -12.099 6.592 -0.818 1.00 0.00 O ATOM 749 CB SER A 52 -13.071 5.002 1.729 1.00 0.00 C ATOM 750 OG SER A 52 -13.879 6.134 1.436 1.00 0.00 O ATOM 0 H SER A 52 -11.196 3.351 1.809 1.00 0.00 H new ATOM 0 HA SER A 52 -13.017 4.219 -0.276 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.692 4.180 2.084 1.00 0.00 H new ATOM 0 HB3 SER A 52 -12.369 5.239 2.529 1.00 0.00 H new ATOM 0 HG SER A 52 -14.368 6.404 2.241 1.00 0.00 H new ATOM 756 N LEU A 53 -10.298 5.915 0.240 1.00 0.00 N ATOM 757 CA LEU A 53 -9.502 7.064 -0.272 1.00 0.00 C ATOM 758 C LEU A 53 -9.068 6.774 -1.711 1.00 0.00 C ATOM 759 O LEU A 53 -8.777 7.674 -2.473 1.00 0.00 O ATOM 760 CB LEU A 53 -8.271 7.254 0.630 1.00 0.00 C ATOM 761 CG LEU A 53 -7.150 7.996 -0.113 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.583 9.436 -0.407 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.900 8.026 0.768 1.00 0.00 C ATOM 0 H LEU A 53 -9.789 5.272 0.846 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.100 7.976 -0.262 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.553 7.814 1.522 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.908 6.282 0.965 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.939 7.481 -1.050 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.783 9.956 -0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.480 9.427 -1.027 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.795 9.951 0.530 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.100 8.551 0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.125 8.542 1.701 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.583 7.006 0.985 1.00 0.00 H new ATOM 775 N VAL A 54 -9.008 5.524 -2.079 1.00 0.00 N ATOM 776 CA VAL A 54 -8.574 5.166 -3.461 1.00 0.00 C ATOM 777 C VAL A 54 -9.684 4.392 -4.178 1.00 0.00 C ATOM 778 O VAL A 54 -9.449 3.742 -5.174 1.00 0.00 O ATOM 779 CB VAL A 54 -7.306 4.313 -3.383 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.239 5.070 -2.590 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.609 2.988 -2.679 1.00 0.00 C ATOM 0 H VAL A 54 -9.241 4.732 -1.481 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.367 6.076 -4.024 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.948 4.110 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.333 4.467 -2.531 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.015 6.013 -3.089 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.607 5.270 -1.584 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.701 2.387 -2.628 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.970 3.186 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.372 2.446 -3.237 1.00 0.00 H new ATOM 791 N LYS A 55 -10.890 4.455 -3.681 1.00 0.00 N ATOM 792 CA LYS A 55 -12.008 3.721 -4.345 1.00 0.00 C ATOM 793 C LYS A 55 -12.346 4.409 -5.672 1.00 0.00 C ATOM 794 O LYS A 55 -12.808 3.786 -6.606 1.00 0.00 O ATOM 795 CB LYS A 55 -13.240 3.727 -3.428 1.00 0.00 C ATOM 796 CG LYS A 55 -13.565 2.299 -2.979 1.00 0.00 C ATOM 797 CD LYS A 55 -14.841 2.306 -2.136 1.00 0.00 C ATOM 798 CE LYS A 55 -15.116 0.893 -1.616 1.00 0.00 C ATOM 799 NZ LYS A 55 -15.380 -0.017 -2.767 1.00 0.00 N ATOM 0 H LYS A 55 -11.150 4.981 -2.847 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.709 2.691 -4.537 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -13.053 4.357 -2.558 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.093 4.155 -3.954 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -13.694 1.654 -3.848 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -12.736 1.891 -2.400 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -14.734 2.998 -1.301 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -15.683 2.655 -2.734 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.262 0.533 -1.042 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.972 0.902 -0.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -15.841 -0.884 -2.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.002 0.460 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -14.481 -0.262 -3.229 1.00 0.00 H new ATOM 896 N SER A 62 -6.798 0.037 -11.612 1.00 0.00 N ATOM 897 CA SER A 62 -7.589 -0.832 -10.692 1.00 0.00 C ATOM 898 C SER A 62 -6.774 -1.152 -9.441 1.00 0.00 C ATOM 899 O SER A 62 -7.315 -1.304 -8.366 1.00 0.00 O ATOM 900 CB SER A 62 -7.945 -2.132 -11.418 1.00 0.00 C ATOM 901 OG SER A 62 -6.949 -2.410 -12.394 1.00 0.00 O ATOM 0 HA SER A 62 -8.499 -0.310 -10.395 1.00 0.00 H new ATOM 0 HB2 SER A 62 -8.012 -2.954 -10.705 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.922 -2.041 -11.893 1.00 0.00 H new ATOM 0 HG SER A 62 -6.481 -1.582 -12.629 1.00 0.00 H new ATOM 907 N TYR A 63 -5.482 -1.275 -9.562 1.00 0.00 N ATOM 908 CA TYR A 63 -4.663 -1.609 -8.360 1.00 0.00 C ATOM 909 C TYR A 63 -3.952 -0.362 -7.832 1.00 0.00 C ATOM 910 O TYR A 63 -3.878 0.656 -8.491 1.00 0.00 O ATOM 911 CB TYR A 63 -3.635 -2.678 -8.731 1.00 0.00 C ATOM 912 CG TYR A 63 -4.321 -4.020 -8.831 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.266 -4.249 -9.837 1.00 0.00 C ATOM 914 CD2 TYR A 63 -4.013 -5.035 -7.918 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.902 -5.493 -9.932 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.647 -6.279 -8.013 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.590 -6.508 -9.020 1.00 0.00 C ATOM 918 OH TYR A 63 -6.218 -7.733 -9.113 1.00 0.00 O ATOM 0 H TYR A 63 -4.960 -1.160 -10.431 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.319 -1.988 -7.576 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.160 -2.428 -9.680 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.846 -2.716 -7.980 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.505 -3.466 -10.541 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.286 -4.858 -7.140 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.632 -5.669 -10.708 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.408 -7.062 -7.309 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.887 -8.325 -8.406 1.00 0.00 H new ATOM 928 N VAL A 64 -3.442 -0.437 -6.630 1.00 0.00 N ATOM 929 CA VAL A 64 -2.748 0.737 -6.023 1.00 0.00 C ATOM 930 C VAL A 64 -1.568 0.238 -5.173 1.00 0.00 C ATOM 931 O VAL A 64 -1.666 -0.760 -4.493 1.00 0.00 O ATOM 932 CB VAL A 64 -3.769 1.486 -5.155 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.121 2.682 -4.457 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.913 1.978 -6.043 1.00 0.00 C ATOM 0 H VAL A 64 -3.477 -1.268 -6.039 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.358 1.408 -6.789 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.146 0.805 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.866 3.195 -3.849 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.308 2.335 -3.819 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.727 3.370 -5.205 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.643 2.511 -5.434 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.518 2.648 -6.807 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.394 1.125 -6.522 1.00 0.00 H new ATOM 944 N TRP A 65 -0.449 0.913 -5.214 1.00 0.00 N ATOM 945 CA TRP A 65 0.733 0.448 -4.416 1.00 0.00 C ATOM 946 C TRP A 65 0.586 0.875 -2.949 1.00 0.00 C ATOM 947 O TRP A 65 0.031 1.915 -2.651 1.00 0.00 O ATOM 948 CB TRP A 65 2.016 1.095 -4.965 1.00 0.00 C ATOM 949 CG TRP A 65 2.794 0.171 -5.859 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.456 0.585 -6.962 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.038 -1.269 -5.757 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.083 -0.493 -7.548 1.00 0.00 N ATOM 953 CE2 TRP A 65 3.851 -1.659 -6.851 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.642 -2.271 -4.847 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.251 -2.979 -7.034 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.047 -3.604 -5.033 1.00 0.00 C ATOM 957 CH2 TRP A 65 3.847 -3.956 -6.125 1.00 0.00 C ATOM 0 H TRP A 65 -0.299 1.761 -5.761 1.00 0.00 H new ATOM 0 HA TRP A 65 0.786 -0.638 -4.488 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.755 1.996 -5.520 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.647 1.405 -4.132 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.489 1.601 -7.327 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.650 -0.435 -8.394 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.023 -2.012 -4.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 4.872 -3.246 -7.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.738 -4.362 -4.328 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.151 -4.983 -6.264 1.00 0.00 H new ATOM 968 N ILE A 66 1.128 0.106 -2.035 1.00 0.00 N ATOM 969 CA ILE A 66 1.073 0.498 -0.597 1.00 0.00 C ATOM 970 C ILE A 66 2.438 0.205 0.030 1.00 0.00 C ATOM 971 O ILE A 66 3.322 -0.323 -0.615 1.00 0.00 O ATOM 972 CB ILE A 66 -0.018 -0.280 0.145 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.119 -1.776 -0.126 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.393 0.189 -0.329 1.00 0.00 C ATOM 975 CD1 ILE A 66 -1.021 -2.517 0.579 1.00 0.00 C ATOM 0 H ILE A 66 1.605 -0.775 -2.226 1.00 0.00 H new ATOM 0 HA ILE A 66 0.834 1.559 -0.520 1.00 0.00 H new ATOM 0 HB ILE A 66 0.090 -0.098 1.214 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.087 -1.969 -1.198 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.082 -2.137 0.234 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.169 -0.365 0.200 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.505 1.254 -0.125 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.488 0.013 -1.401 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.931 -3.587 0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.967 -2.332 1.652 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.978 -2.161 0.197 1.00 0.00 H new ATOM 987 N GLY A 67 2.633 0.564 1.267 1.00 0.00 N ATOM 988 CA GLY A 67 3.948 0.335 1.914 1.00 0.00 C ATOM 989 C GLY A 67 4.018 -1.060 2.519 1.00 0.00 C ATOM 990 O GLY A 67 4.236 -1.214 3.696 1.00 0.00 O ATOM 0 H GLY A 67 1.932 1.009 1.859 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.745 0.459 1.181 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.111 1.082 2.691 1.00 0.00 H new ATOM 994 N LEU A 68 3.858 -2.078 1.723 1.00 0.00 N ATOM 995 CA LEU A 68 3.957 -3.465 2.265 1.00 0.00 C ATOM 996 C LEU A 68 4.894 -4.279 1.370 1.00 0.00 C ATOM 997 O LEU A 68 4.765 -4.276 0.161 1.00 0.00 O ATOM 998 CB LEU A 68 2.575 -4.125 2.291 1.00 0.00 C ATOM 999 CG LEU A 68 2.501 -5.154 3.433 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.741 -6.051 3.429 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.415 -4.439 4.785 1.00 0.00 C ATOM 0 H LEU A 68 3.664 -2.013 0.724 1.00 0.00 H new ATOM 0 HA LEU A 68 4.346 -3.428 3.282 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.804 -3.366 2.424 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.379 -4.614 1.337 1.00 0.00 H new ATOM 0 HG LEU A 68 1.611 -5.764 3.280 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.671 -6.772 4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.803 -6.581 2.479 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.633 -5.439 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.363 -5.178 5.585 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.298 -3.816 4.924 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.522 -3.814 4.810 1.00 0.00 H new ATOM 1013 N HIS A 69 5.832 -4.986 1.948 1.00 0.00 N ATOM 1014 CA HIS A 69 6.762 -5.802 1.120 1.00 0.00 C ATOM 1015 C HIS A 69 7.018 -7.140 1.800 1.00 0.00 C ATOM 1016 O HIS A 69 6.487 -7.434 2.849 1.00 0.00 O ATOM 1017 CB HIS A 69 8.086 -5.058 0.927 1.00 0.00 C ATOM 1018 CG HIS A 69 8.852 -5.051 2.218 1.00 0.00 C ATOM 1019 ND1 HIS A 69 10.020 -5.778 2.394 1.00 0.00 N ATOM 1020 CD2 HIS A 69 8.624 -4.415 3.407 1.00 0.00 C ATOM 1021 CE1 HIS A 69 10.445 -5.558 3.652 1.00 0.00 C ATOM 1022 NE2 HIS A 69 9.628 -4.735 4.314 1.00 0.00 N ATOM 0 H HIS A 69 5.991 -5.032 2.954 1.00 0.00 H new ATOM 0 HA HIS A 69 6.308 -5.975 0.144 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.675 -5.539 0.146 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.896 -4.036 0.599 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.789 -3.762 3.611 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.338 -5.994 4.075 1.00 0.00 H new ATOM 0 HE2 HIS A 69 9.720 -4.411 5.277 1.00 0.00 H new ATOM 1180 N TRP A 82 5.887 -10.354 5.547 1.00 0.00 N ATOM 1181 CA TRP A 82 5.018 -9.195 5.181 1.00 0.00 C ATOM 1182 C TRP A 82 5.196 -8.063 6.203 1.00 0.00 C ATOM 1183 O TRP A 82 4.565 -8.056 7.242 1.00 0.00 O ATOM 1184 CB TRP A 82 3.541 -9.629 5.156 1.00 0.00 C ATOM 1185 CG TRP A 82 3.424 -11.103 4.918 1.00 0.00 C ATOM 1186 CD1 TRP A 82 4.258 -11.847 4.151 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.417 -12.023 5.433 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.827 -13.162 4.168 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.696 -13.320 4.945 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.301 -11.856 6.271 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.895 -14.414 5.275 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.491 -12.955 6.606 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.789 -14.230 6.108 1.00 0.00 C ATOM 0 HA TRP A 82 5.308 -8.841 4.192 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.065 -9.370 6.102 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.011 -9.086 4.373 1.00 0.00 H new ATOM 0 HD1 TRP A 82 5.118 -11.475 3.614 1.00 0.00 H new ATOM 0 HE1 TRP A 82 4.288 -13.922 3.668 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.064 -10.877 6.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 2.128 -15.395 4.889 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.365 -12.816 7.250 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.163 -15.071 6.368 1.00 0.00 H new ATOM 1204 N GLU A 83 6.038 -7.096 5.921 1.00 0.00 N ATOM 1205 CA GLU A 83 6.226 -5.969 6.889 1.00 0.00 C ATOM 1206 C GLU A 83 5.877 -4.647 6.209 1.00 0.00 C ATOM 1207 O GLU A 83 6.165 -4.444 5.047 1.00 0.00 O ATOM 1208 CB GLU A 83 7.682 -5.923 7.359 1.00 0.00 C ATOM 1209 CG GLU A 83 7.890 -4.700 8.251 1.00 0.00 C ATOM 1210 CD GLU A 83 9.238 -4.812 8.967 1.00 0.00 C ATOM 1211 OE1 GLU A 83 9.321 -5.576 9.914 1.00 0.00 O ATOM 1212 OE2 GLU A 83 10.163 -4.133 8.554 1.00 0.00 O ATOM 0 H GLU A 83 6.598 -7.039 5.070 1.00 0.00 H new ATOM 0 HA GLU A 83 5.573 -6.126 7.747 1.00 0.00 H new ATOM 0 HB2 GLU A 83 7.927 -6.832 7.907 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.352 -5.878 6.500 1.00 0.00 H new ATOM 0 HG2 GLU A 83 7.859 -3.790 7.651 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.084 -4.628 8.981 1.00 0.00 H new ATOM 1219 N TRP A 84 5.260 -3.742 6.920 1.00 0.00 N ATOM 1220 CA TRP A 84 4.901 -2.440 6.308 1.00 0.00 C ATOM 1221 C TRP A 84 6.122 -1.531 6.316 1.00 0.00 C ATOM 1222 O TRP A 84 6.785 -1.373 7.321 1.00 0.00 O ATOM 1223 CB TRP A 84 3.771 -1.775 7.104 1.00 0.00 C ATOM 1224 CG TRP A 84 3.007 -2.810 7.862 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.462 -3.470 8.951 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.665 -3.311 7.610 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.489 -4.355 9.373 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.362 -4.295 8.578 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.693 -3.013 6.641 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.137 -4.963 8.584 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.542 -3.682 6.643 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.817 -4.656 7.612 1.00 0.00 C ATOM 0 H TRP A 84 4.991 -3.852 7.898 1.00 0.00 H new ATOM 0 HA TRP A 84 4.565 -2.607 5.285 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.184 -1.038 7.793 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.104 -1.240 6.428 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.427 -3.328 9.414 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.591 -4.977 10.175 1.00 0.00 H new ATOM 0 HE3 TRP A 84 0.897 -2.265 5.889 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -0.071 -5.711 9.334 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.283 -3.445 5.894 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.767 -5.169 7.607 1.00 0.00 H new ATOM 1243 N SER A 85 6.416 -0.920 5.209 1.00 0.00 N ATOM 1244 CA SER A 85 7.586 -0.011 5.165 1.00 0.00 C ATOM 1245 C SER A 85 7.165 1.352 5.699 1.00 0.00 C ATOM 1246 O SER A 85 7.943 2.283 5.737 1.00 0.00 O ATOM 1247 CB SER A 85 8.086 0.124 3.727 1.00 0.00 C ATOM 1248 OG SER A 85 7.064 0.705 2.926 1.00 0.00 O ATOM 0 H SER A 85 5.898 -1.010 4.335 1.00 0.00 H new ATOM 0 HA SER A 85 8.392 -0.415 5.777 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.983 0.743 3.698 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.361 -0.854 3.332 1.00 0.00 H new ATOM 0 HG SER A 85 7.382 0.794 2.003 1.00 0.00 H new ATOM 1288 N VAL A 89 5.238 -3.370 12.153 1.00 0.00 N ATOM 1289 CA VAL A 89 5.291 -4.855 12.012 1.00 0.00 C ATOM 1290 C VAL A 89 3.913 -5.382 11.608 1.00 0.00 C ATOM 1291 O VAL A 89 2.916 -4.696 11.717 1.00 0.00 O ATOM 1292 CB VAL A 89 5.699 -5.476 13.350 1.00 0.00 C ATOM 1293 CG1 VAL A 89 4.736 -5.013 14.443 1.00 0.00 C ATOM 1294 CG2 VAL A 89 5.650 -7.003 13.241 1.00 0.00 C ATOM 0 HA VAL A 89 6.019 -5.121 11.246 1.00 0.00 H new ATOM 0 HB VAL A 89 6.712 -5.162 13.601 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.027 -5.456 15.396 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.771 -3.926 14.522 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.723 -5.326 14.192 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.941 -7.445 14.194 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.637 -7.317 12.989 1.00 0.00 H new ATOM 0 HG23 VAL A 89 6.337 -7.334 12.463 1.00 0.00 H new ATOM 1304 N MET A 90 3.853 -6.595 11.133 1.00 0.00 N ATOM 1305 CA MET A 90 2.546 -7.174 10.712 1.00 0.00 C ATOM 1306 C MET A 90 1.598 -7.266 11.912 1.00 0.00 C ATOM 1307 O MET A 90 1.525 -8.283 12.573 1.00 0.00 O ATOM 1308 CB MET A 90 2.781 -8.577 10.137 1.00 0.00 C ATOM 1309 CG MET A 90 1.629 -8.953 9.194 1.00 0.00 C ATOM 1310 SD MET A 90 1.284 -10.726 9.335 1.00 0.00 S ATOM 1311 CE MET A 90 2.919 -11.318 8.833 1.00 0.00 C ATOM 0 H MET A 90 4.656 -7.213 11.018 1.00 0.00 H new ATOM 0 HA MET A 90 2.095 -6.532 9.955 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.728 -8.605 9.598 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.853 -9.304 10.946 1.00 0.00 H new ATOM 0 HG2 MET A 90 0.738 -8.378 9.444 1.00 0.00 H new ATOM 0 HG3 MET A 90 1.891 -8.704 8.166 1.00 0.00 H new ATOM 0 HE1 MET A 90 2.843 -12.350 8.490 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.299 -10.694 8.024 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.601 -11.267 9.682 1.00 0.00 H new ATOM 1321 N ASN A 91 0.853 -6.224 12.188 1.00 0.00 N ATOM 1322 CA ASN A 91 -0.104 -6.281 13.332 1.00 0.00 C ATOM 1323 C ASN A 91 -1.512 -6.429 12.761 1.00 0.00 C ATOM 1324 O ASN A 91 -2.469 -6.646 13.478 1.00 0.00 O ATOM 1325 CB ASN A 91 -0.008 -4.996 14.167 1.00 0.00 C ATOM 1326 CG ASN A 91 -0.232 -5.325 15.645 1.00 0.00 C ATOM 1327 OD1 ASN A 91 0.681 -5.244 16.443 1.00 0.00 O ATOM 1328 ND2 ASN A 91 -1.417 -5.693 16.047 1.00 0.00 N ATOM 0 H ASN A 91 0.867 -5.343 11.674 1.00 0.00 H new ATOM 0 HA ASN A 91 0.133 -7.125 13.979 1.00 0.00 H new ATOM 0 HB2 ASN A 91 0.970 -4.534 14.031 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.751 -4.274 13.828 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -1.577 -5.912 17.030 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.184 -5.761 15.378 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.637 -6.322 11.462 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.971 -6.467 10.817 1.00 0.00 C ATOM 1337 C TYR A 92 -2.849 -7.407 9.615 1.00 0.00 C ATOM 1338 O TYR A 92 -1.785 -7.559 9.045 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.470 -5.099 10.351 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.825 -5.246 9.693 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.892 -5.824 10.395 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -5.014 -4.806 8.376 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -7.142 -5.963 9.781 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.265 -4.944 7.764 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.328 -5.524 8.466 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.561 -5.661 7.861 1.00 0.00 O ATOM 0 H TYR A 92 -0.866 -6.139 10.820 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.680 -6.880 11.534 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.539 -4.418 11.199 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.760 -4.662 9.649 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.749 -6.162 11.411 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.194 -4.360 7.833 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.963 -6.409 10.323 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.410 -4.603 6.750 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.519 -5.305 6.949 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.923 -8.046 9.227 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.859 -8.983 8.063 1.00 0.00 C ATOM 1358 C PHE A 93 -5.056 -8.744 7.138 1.00 0.00 C ATOM 1359 O PHE A 93 -6.148 -8.451 7.582 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.892 -10.426 8.572 1.00 0.00 C ATOM 1361 CG PHE A 93 -5.164 -10.657 9.353 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -6.342 -11.008 8.682 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -5.165 -10.518 10.746 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -7.521 -11.223 9.406 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -6.344 -10.732 11.469 1.00 0.00 C ATOM 1366 CZ PHE A 93 -7.523 -11.085 10.799 1.00 0.00 C ATOM 0 H PHE A 93 -4.840 -7.960 9.664 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.936 -8.808 7.510 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.837 -11.120 7.733 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -3.025 -10.620 9.203 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -6.341 -11.113 7.607 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -4.256 -10.246 11.262 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -8.429 -11.495 8.889 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -6.345 -10.625 12.544 1.00 0.00 H new ATOM 0 HZ PHE A 93 -8.433 -11.251 11.357 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.857 -8.872 5.851 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.983 -8.659 4.896 1.00 0.00 C ATOM 1378 C ALA A 94 -5.517 -8.995 3.474 1.00 0.00 C ATOM 1379 O ALA A 94 -6.035 -8.482 2.502 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.442 -7.196 4.962 1.00 0.00 C ATOM 0 H ALA A 94 -3.964 -9.115 5.422 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.817 -9.308 5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.265 -7.041 4.264 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.776 -6.965 5.974 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.612 -6.542 4.695 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.542 -9.853 3.343 1.00 0.00 N ATOM 1387 CA TRP A 95 -4.049 -10.219 1.986 1.00 0.00 C ATOM 1388 C TRP A 95 -5.061 -11.149 1.312 1.00 0.00 C ATOM 1389 O TRP A 95 -5.757 -11.902 1.964 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.697 -10.928 2.106 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.668 -11.740 3.362 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -2.114 -11.343 4.531 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -3.202 -13.075 3.596 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -2.275 -12.349 5.466 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -2.940 -13.437 4.938 1.00 0.00 C ATOM 1396 CE3 TRP A 95 -3.883 -13.998 2.780 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -3.338 -14.671 5.454 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 -4.285 -15.241 3.296 1.00 0.00 C ATOM 1399 CH2 TRP A 95 -4.012 -15.576 4.630 1.00 0.00 C ATOM 0 H TRP A 95 -4.066 -10.316 4.117 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.930 -9.317 1.386 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.534 -11.571 1.241 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.890 -10.195 2.115 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.626 -10.395 4.705 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.943 -12.294 6.429 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -4.098 -13.749 1.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -3.127 -14.925 6.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -4.807 -15.942 2.662 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -4.323 -16.534 5.021 1.00 0.00 H new ATOM 1410 N GLU A 96 -5.150 -11.103 0.011 1.00 0.00 N ATOM 1411 CA GLU A 96 -6.118 -11.982 -0.704 1.00 0.00 C ATOM 1412 C GLU A 96 -5.702 -13.444 -0.532 1.00 0.00 C ATOM 1413 O GLU A 96 -6.515 -14.300 -0.241 1.00 0.00 O ATOM 1414 CB GLU A 96 -6.129 -11.626 -2.191 1.00 0.00 C ATOM 1415 CG GLU A 96 -7.262 -12.382 -2.890 1.00 0.00 C ATOM 1416 CD GLU A 96 -7.310 -11.982 -4.366 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -7.340 -10.792 -4.636 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -7.316 -12.871 -5.200 1.00 0.00 O ATOM 0 H GLU A 96 -4.593 -10.494 -0.588 1.00 0.00 H new ATOM 0 HA GLU A 96 -7.115 -11.837 -0.289 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.263 -10.552 -2.317 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.172 -11.884 -2.644 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -7.106 -13.457 -2.799 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -8.214 -12.156 -2.410 1.00 0.00 H new ATOM 1564 N HIS A 107 7.422 -9.216 -4.355 1.00 0.00 N ATOM 1565 CA HIS A 107 7.876 -8.892 -2.971 1.00 0.00 C ATOM 1566 C HIS A 107 7.210 -7.592 -2.514 1.00 0.00 C ATOM 1567 O HIS A 107 7.663 -6.940 -1.595 1.00 0.00 O ATOM 1568 CB HIS A 107 9.401 -8.732 -2.950 1.00 0.00 C ATOM 1569 CG HIS A 107 10.018 -9.662 -3.958 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.596 -10.866 -3.595 1.00 0.00 N ATOM 1571 CD2 HIS A 107 10.154 -9.582 -5.320 1.00 0.00 C ATOM 1572 CE1 HIS A 107 11.047 -11.450 -4.721 1.00 0.00 C ATOM 1573 NE2 HIS A 107 10.802 -10.710 -5.798 1.00 0.00 N ATOM 0 HA HIS A 107 7.596 -9.701 -2.296 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.672 -7.701 -3.177 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.786 -8.951 -1.954 1.00 0.00 H new ATOM 0 HD2 HIS A 107 9.807 -8.761 -5.930 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.548 -12.406 -4.746 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.039 -10.926 -6.766 1.00 0.00 H new ATOM 1581 N CYS A 108 6.131 -7.214 -3.150 1.00 0.00 N ATOM 1582 CA CYS A 108 5.424 -5.960 -2.758 1.00 0.00 C ATOM 1583 C CYS A 108 3.914 -6.187 -2.839 1.00 0.00 C ATOM 1584 O CYS A 108 3.436 -6.940 -3.664 1.00 0.00 O ATOM 1585 CB CYS A 108 5.828 -4.827 -3.700 1.00 0.00 C ATOM 1586 SG CYS A 108 7.493 -4.265 -3.276 1.00 0.00 S ATOM 0 H CYS A 108 5.708 -7.723 -3.927 1.00 0.00 H new ATOM 0 HA CYS A 108 5.697 -5.689 -1.738 1.00 0.00 H new ATOM 0 HB2 CYS A 108 5.800 -5.170 -4.734 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.121 -4.001 -3.619 1.00 0.00 H new ATOM 1591 N ALA A 109 3.159 -5.551 -1.979 1.00 0.00 N ATOM 1592 CA ALA A 109 1.679 -5.741 -1.998 1.00 0.00 C ATOM 1593 C ALA A 109 0.983 -4.478 -2.519 1.00 0.00 C ATOM 1594 O ALA A 109 1.431 -3.362 -2.312 1.00 0.00 O ATOM 1595 CB ALA A 109 1.184 -6.053 -0.580 1.00 0.00 C ATOM 0 H ALA A 109 3.504 -4.909 -1.266 1.00 0.00 H new ATOM 0 HA ALA A 109 1.440 -6.572 -2.662 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.103 -6.192 -0.594 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.662 -6.964 -0.220 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.435 -5.225 0.083 1.00 0.00 H new ATOM 1601 N SER A 110 -0.117 -4.665 -3.193 1.00 0.00 N ATOM 1602 CA SER A 110 -0.885 -3.518 -3.749 1.00 0.00 C ATOM 1603 C SER A 110 -2.378 -3.802 -3.542 1.00 0.00 C ATOM 1604 O SER A 110 -2.770 -4.922 -3.292 1.00 0.00 O ATOM 1605 CB SER A 110 -0.580 -3.387 -5.247 1.00 0.00 C ATOM 1606 OG SER A 110 0.523 -4.220 -5.573 1.00 0.00 O ATOM 0 H SER A 110 -0.523 -5.581 -3.385 1.00 0.00 H new ATOM 0 HA SER A 110 -0.609 -2.589 -3.250 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.453 -3.672 -5.834 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.354 -2.350 -5.495 1.00 0.00 H new ATOM 0 HG SER A 110 1.310 -3.665 -5.755 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.215 -2.810 -3.649 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.673 -3.053 -3.461 1.00 0.00 C ATOM 1614 C LEU A 111 -5.273 -3.485 -4.799 1.00 0.00 C ATOM 1615 O LEU A 111 -4.780 -3.134 -5.848 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.356 -1.763 -2.988 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.802 -1.339 -1.614 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.436 0.146 -1.631 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.865 -1.569 -0.538 1.00 0.00 C ATOM 0 H LEU A 111 -2.956 -1.846 -3.857 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.825 -3.831 -2.713 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.191 -0.968 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.433 -1.917 -2.922 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.914 -1.933 -1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.046 0.436 -0.655 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.678 0.325 -2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.324 0.737 -1.857 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.471 -1.268 0.433 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.751 -0.977 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.132 -2.625 -0.510 1.00 0.00 H new ATOM 1631 N SER A 112 -6.327 -4.255 -4.766 1.00 0.00 N ATOM 1632 CA SER A 112 -6.966 -4.725 -6.036 1.00 0.00 C ATOM 1633 C SER A 112 -8.393 -4.177 -6.127 1.00 0.00 C ATOM 1634 O SER A 112 -9.241 -4.496 -5.317 1.00 0.00 O ATOM 1635 CB SER A 112 -7.015 -6.254 -6.037 1.00 0.00 C ATOM 1636 OG SER A 112 -8.031 -6.691 -5.147 1.00 0.00 O ATOM 0 H SER A 112 -6.777 -4.582 -3.911 1.00 0.00 H new ATOM 0 HA SER A 112 -6.385 -4.371 -6.888 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.214 -6.622 -7.043 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.050 -6.661 -5.734 1.00 0.00 H new ATOM 0 HG SER A 112 -8.597 -5.931 -4.897 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.667 -3.351 -7.103 1.00 0.00 N ATOM 1643 CA ARG A 113 -10.048 -2.791 -7.231 1.00 0.00 C ATOM 1644 C ARG A 113 -11.065 -3.935 -7.275 1.00 0.00 C ATOM 1645 O ARG A 113 -12.169 -3.815 -6.784 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.154 -1.965 -8.519 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.612 -1.559 -8.756 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.682 -0.540 -9.896 1.00 0.00 C ATOM 1649 NE ARG A 113 -11.414 -1.225 -11.192 1.00 0.00 N ATOM 1650 CZ ARG A 113 -12.336 -1.966 -11.742 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -13.556 -1.515 -11.854 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -12.039 -3.159 -12.180 1.00 0.00 N ATOM 0 H ARG A 113 -8.002 -3.041 -7.812 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.256 -2.152 -6.373 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.527 -1.077 -8.445 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.786 -2.545 -9.365 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.209 -2.437 -9.002 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.034 -1.132 -7.846 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.665 -0.070 -9.918 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.952 0.253 -9.734 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.509 -1.114 -11.649 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.789 -0.583 -11.511 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.277 -2.095 -12.284 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.086 -3.512 -12.092 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -12.760 -3.738 -12.610 1.00 0.00 H new ATOM 1666 N SER A 114 -10.707 -5.042 -7.866 1.00 0.00 N ATOM 1667 CA SER A 114 -11.657 -6.189 -7.946 1.00 0.00 C ATOM 1668 C SER A 114 -12.114 -6.586 -6.541 1.00 0.00 C ATOM 1669 O SER A 114 -13.215 -7.061 -6.349 1.00 0.00 O ATOM 1670 CB SER A 114 -10.965 -7.378 -8.612 1.00 0.00 C ATOM 1671 OG SER A 114 -9.989 -7.908 -7.726 1.00 0.00 O ATOM 0 H SER A 114 -9.797 -5.202 -8.298 1.00 0.00 H new ATOM 0 HA SER A 114 -12.526 -5.894 -8.535 1.00 0.00 H new ATOM 0 HB2 SER A 114 -11.697 -8.145 -8.866 1.00 0.00 H new ATOM 0 HB3 SER A 114 -10.495 -7.065 -9.544 1.00 0.00 H new ATOM 0 HG SER A 114 -9.544 -8.672 -8.149 1.00 0.00 H new ATOM 1677 N THR A 115 -11.276 -6.397 -5.557 1.00 0.00 N ATOM 1678 CA THR A 115 -11.661 -6.766 -4.161 1.00 0.00 C ATOM 1679 C THR A 115 -12.096 -5.509 -3.407 1.00 0.00 C ATOM 1680 O THR A 115 -11.976 -5.424 -2.202 1.00 0.00 O ATOM 1681 CB THR A 115 -10.458 -7.391 -3.451 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.446 -6.407 -3.286 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.914 -8.554 -4.281 1.00 0.00 C ATOM 0 H THR A 115 -10.341 -6.003 -5.658 1.00 0.00 H new ATOM 0 HA THR A 115 -12.483 -7.481 -4.186 1.00 0.00 H new ATOM 0 HB THR A 115 -10.767 -7.764 -2.474 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.580 -6.780 -3.554 1.00 0.00 H new ATOM 0 HG21 THR A 115 -9.058 -8.996 -3.771 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.691 -9.308 -4.404 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.605 -8.189 -5.260 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.595 -4.531 -4.112 1.00 0.00 N ATOM 1692 CA ALA A 116 -13.032 -3.274 -3.441 1.00 0.00 C ATOM 1693 C ALA A 116 -11.849 -2.667 -2.686 1.00 0.00 C ATOM 1694 O ALA A 116 -12.015 -1.955 -1.716 1.00 0.00 O ATOM 1695 CB ALA A 116 -14.161 -3.587 -2.457 1.00 0.00 C ATOM 0 H ALA A 116 -12.719 -4.548 -5.124 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.390 -2.566 -4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.481 -2.668 -1.966 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -15.003 -4.023 -2.995 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.805 -4.294 -1.707 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.652 -2.943 -3.129 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.448 -2.388 -2.450 1.00 0.00 C ATOM 1703 C PHE A 117 -9.423 -2.851 -0.994 1.00 0.00 C ATOM 1704 O PHE A 117 -8.764 -2.263 -0.159 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.483 -0.858 -2.498 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.809 -0.401 -3.899 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.789 -0.270 -4.849 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -11.132 -0.103 -4.250 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -9.089 0.157 -6.146 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.434 0.323 -5.549 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.412 0.454 -6.497 1.00 0.00 C ATOM 0 H PHE A 117 -10.456 -3.533 -3.938 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.553 -2.743 -2.961 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -10.229 -0.479 -1.799 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.520 -0.453 -2.188 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.769 -0.499 -4.579 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.920 -0.202 -3.518 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.301 0.258 -6.877 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.455 0.550 -5.820 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.644 0.784 -7.499 1.00 0.00 H new ATOM 1721 N LEU A 118 -10.133 -3.900 -0.683 1.00 0.00 N ATOM 1722 CA LEU A 118 -10.153 -4.404 0.721 1.00 0.00 C ATOM 1723 C LEU A 118 -9.231 -5.618 0.838 1.00 0.00 C ATOM 1724 O LEU A 118 -9.275 -6.353 1.805 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.581 -4.805 1.095 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.455 -3.552 1.243 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.896 -3.972 1.544 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.928 -2.674 2.391 1.00 0.00 C ATOM 0 H LEU A 118 -10.702 -4.432 -1.342 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.808 -3.621 1.397 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.996 -5.460 0.329 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.577 -5.368 2.028 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.423 -2.982 0.315 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.519 -3.084 1.650 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -14.274 -4.586 0.727 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.922 -4.546 2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.555 -1.787 2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.953 -3.240 3.322 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.903 -2.372 2.177 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.390 -5.830 -0.138 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.454 -6.991 -0.087 1.00 0.00 C ATOM 1742 C ARG A 119 -6.116 -6.580 -0.702 1.00 0.00 C ATOM 1743 O ARG A 119 -6.030 -5.602 -1.419 1.00 0.00 O ATOM 1744 CB ARG A 119 -8.041 -8.163 -0.875 1.00 0.00 C ATOM 1745 CG ARG A 119 -9.315 -8.658 -0.184 1.00 0.00 C ATOM 1746 CD ARG A 119 -9.796 -9.950 -0.854 1.00 0.00 C ATOM 1747 NE ARG A 119 -11.280 -10.051 -0.728 1.00 0.00 N ATOM 1748 CZ ARG A 119 -11.810 -10.686 0.283 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -12.034 -10.056 1.404 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -12.115 -11.950 0.173 1.00 0.00 N ATOM 0 H ARG A 119 -8.310 -5.247 -0.971 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.306 -7.296 0.949 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -8.266 -7.852 -1.895 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.313 -8.972 -0.941 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -9.121 -8.836 0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -10.092 -7.896 -0.242 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -9.508 -9.957 -1.905 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -9.321 -10.813 -0.388 1.00 0.00 H new ATOM 0 HE ARG A 119 -11.881 -9.623 -1.432 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -11.795 -9.068 1.490 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -12.448 -10.552 2.194 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -11.940 -12.443 -0.703 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -12.529 -12.445 0.963 1.00 0.00 H new ATOM 1764 N TRP A 120 -5.069 -7.313 -0.425 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.733 -6.954 -0.991 1.00 0.00 C ATOM 1766 C TRP A 120 -3.246 -8.058 -1.931 1.00 0.00 C ATOM 1767 O TRP A 120 -3.311 -9.231 -1.619 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.722 -6.789 0.146 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.338 -6.000 1.256 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -4.090 -4.888 1.099 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.261 -6.246 2.689 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.481 -4.434 2.347 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.994 -5.238 3.358 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.632 -7.236 3.465 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -4.100 -5.215 4.749 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.736 -7.214 4.865 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.469 -6.206 5.505 1.00 0.00 C ATOM 0 H TRP A 120 -5.080 -8.143 0.167 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.826 -6.020 -1.545 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.409 -7.767 0.512 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.828 -6.284 -0.220 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.344 -4.429 0.155 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -5.058 -3.607 2.501 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -2.066 -8.018 2.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.666 -4.436 5.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -2.248 -7.978 5.452 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.546 -6.195 6.582 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.744 -7.685 -3.081 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.229 -8.696 -4.052 1.00 0.00 C ATOM 1790 C LYS A 121 -0.739 -8.464 -4.273 1.00 0.00 C ATOM 1791 O LYS A 121 -0.265 -7.344 -4.260 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.977 -8.557 -5.384 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.757 -9.813 -6.238 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.827 -10.859 -5.906 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.493 -12.172 -6.616 1.00 0.00 C ATOM 1796 NZ LYS A 121 -2.248 -12.747 -6.037 1.00 0.00 N ATOM 0 H LYS A 121 -2.669 -6.716 -3.390 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.387 -9.699 -3.656 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.042 -8.413 -5.200 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.624 -7.676 -5.919 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.802 -9.557 -7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.764 -10.222 -6.051 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.874 -11.017 -4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.809 -10.503 -6.219 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.317 -12.877 -6.506 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.363 -11.997 -7.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -2.224 -13.772 -6.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.420 -12.300 -6.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.228 -12.571 -5.012 1.00 0.00 H new ATOM 1810 N ASP A 122 0.009 -9.512 -4.464 1.00 0.00 N ATOM 1811 CA ASP A 122 1.470 -9.348 -4.670 1.00 0.00 C ATOM 1812 C ASP A 122 1.738 -8.791 -6.070 1.00 0.00 C ATOM 1813 O ASP A 122 1.007 -9.058 -7.003 1.00 0.00 O ATOM 1814 CB ASP A 122 2.167 -10.702 -4.512 1.00 0.00 C ATOM 1815 CG ASP A 122 1.559 -11.455 -3.326 1.00 0.00 C ATOM 1816 OD1 ASP A 122 1.986 -11.206 -2.211 1.00 0.00 O ATOM 1817 OD2 ASP A 122 0.675 -12.264 -3.555 1.00 0.00 O ATOM 0 H ASP A 122 -0.329 -10.474 -4.486 1.00 0.00 H new ATOM 0 HA ASP A 122 1.860 -8.652 -3.928 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.056 -11.288 -5.424 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.236 -10.556 -4.355 1.00 0.00 H new ATOM 1822 N TYR A 123 2.781 -8.018 -6.226 1.00 0.00 N ATOM 1823 CA TYR A 123 3.090 -7.447 -7.569 1.00 0.00 C ATOM 1824 C TYR A 123 4.591 -7.142 -7.668 1.00 0.00 C ATOM 1825 O TYR A 123 5.271 -6.986 -6.673 1.00 0.00 O ATOM 1826 CB TYR A 123 2.277 -6.156 -7.767 1.00 0.00 C ATOM 1827 CG TYR A 123 1.154 -6.402 -8.748 1.00 0.00 C ATOM 1828 CD1 TYR A 123 -0.094 -6.841 -8.288 1.00 0.00 C ATOM 1829 CD2 TYR A 123 1.360 -6.192 -10.116 1.00 0.00 C ATOM 1830 CE1 TYR A 123 -1.134 -7.070 -9.197 1.00 0.00 C ATOM 1831 CE2 TYR A 123 0.321 -6.420 -11.025 1.00 0.00 C ATOM 1832 CZ TYR A 123 -0.926 -6.858 -10.565 1.00 0.00 C ATOM 1833 OH TYR A 123 -1.952 -7.084 -11.461 1.00 0.00 O ATOM 0 H TYR A 123 3.430 -7.758 -5.483 1.00 0.00 H new ATOM 0 HA TYR A 123 2.824 -8.165 -8.344 1.00 0.00 H new ATOM 0 HB2 TYR A 123 1.871 -5.821 -6.812 1.00 0.00 H new ATOM 0 HB3 TYR A 123 2.925 -5.360 -8.134 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -0.254 -7.003 -7.232 1.00 0.00 H new ATOM 0 HD2 TYR A 123 2.322 -5.853 -10.471 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -2.096 -7.410 -8.843 1.00 0.00 H new ATOM 0 HE2 TYR A 123 0.481 -6.258 -12.081 1.00 0.00 H new ATOM 0 HH TYR A 123 -1.642 -6.888 -12.370 1.00 0.00 H new ATOM 1843 N ASN A 124 5.114 -7.062 -8.866 1.00 0.00 N ATOM 1844 CA ASN A 124 6.568 -6.771 -9.035 1.00 0.00 C ATOM 1845 C ASN A 124 6.899 -5.420 -8.395 1.00 0.00 C ATOM 1846 O ASN A 124 6.425 -4.390 -8.823 1.00 0.00 O ATOM 1847 CB ASN A 124 6.909 -6.726 -10.525 1.00 0.00 C ATOM 1848 CG ASN A 124 6.249 -7.909 -11.237 1.00 0.00 C ATOM 1849 OD1 ASN A 124 5.397 -7.724 -12.085 1.00 0.00 O ATOM 1850 ND2 ASN A 124 6.609 -9.124 -10.929 1.00 0.00 N ATOM 0 H ASN A 124 4.594 -7.186 -9.735 1.00 0.00 H new ATOM 0 HA ASN A 124 7.152 -7.554 -8.551 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.564 -5.788 -10.960 1.00 0.00 H new ATOM 0 HB3 ASN A 124 7.990 -6.762 -10.663 1.00 0.00 H new ATOM 0 HD21 ASN A 124 6.176 -9.919 -11.399 1.00 0.00 H new ATOM 0 HD22 ASN A 124 7.324 -9.279 -10.218 1.00 0.00 H new ATOM 1857 N CYS A 125 7.704 -5.426 -7.370 1.00 0.00 N ATOM 1858 CA CYS A 125 8.065 -4.150 -6.680 1.00 0.00 C ATOM 1859 C CYS A 125 8.483 -3.077 -7.690 1.00 0.00 C ATOM 1860 O CYS A 125 8.721 -1.943 -7.323 1.00 0.00 O ATOM 1861 CB CYS A 125 9.238 -4.406 -5.731 1.00 0.00 C ATOM 1862 SG CYS A 125 8.698 -5.462 -4.366 1.00 0.00 S ATOM 0 H CYS A 125 8.132 -6.264 -6.976 1.00 0.00 H new ATOM 0 HA CYS A 125 7.191 -3.799 -6.131 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.057 -4.882 -6.270 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.618 -3.461 -5.344 1.00 0.00 H new ATOM 1867 N ASN A 126 8.598 -3.410 -8.949 1.00 0.00 N ATOM 1868 CA ASN A 126 9.031 -2.382 -9.944 1.00 0.00 C ATOM 1869 C ASN A 126 7.829 -1.829 -10.718 1.00 0.00 C ATOM 1870 O ASN A 126 7.815 -0.675 -11.100 1.00 0.00 O ATOM 1871 CB ASN A 126 10.022 -3.010 -10.927 1.00 0.00 C ATOM 1872 CG ASN A 126 9.417 -4.288 -11.512 1.00 0.00 C ATOM 1873 OD1 ASN A 126 8.413 -4.243 -12.193 1.00 0.00 O ATOM 1874 ND2 ASN A 126 9.993 -5.435 -11.273 1.00 0.00 N ATOM 0 H ASN A 126 8.413 -4.338 -9.329 1.00 0.00 H new ATOM 0 HA ASN A 126 9.506 -1.561 -9.408 1.00 0.00 H new ATOM 0 HB2 ASN A 126 10.254 -2.306 -11.726 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.960 -3.237 -10.420 1.00 0.00 H new ATOM 0 HD21 ASN A 126 9.599 -6.293 -11.658 1.00 0.00 H new ATOM 0 HD22 ASN A 126 10.837 -5.473 -10.701 1.00 0.00 H new ATOM 1881 N VAL A 127 6.814 -2.619 -10.948 1.00 0.00 N ATOM 1882 CA VAL A 127 5.633 -2.086 -11.690 1.00 0.00 C ATOM 1883 C VAL A 127 5.156 -0.843 -10.945 1.00 0.00 C ATOM 1884 O VAL A 127 5.057 -0.848 -9.735 1.00 0.00 O ATOM 1885 CB VAL A 127 4.521 -3.142 -11.723 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.181 -2.480 -12.058 1.00 0.00 C ATOM 1887 CG2 VAL A 127 4.848 -4.192 -12.790 1.00 0.00 C ATOM 0 H VAL A 127 6.750 -3.595 -10.660 1.00 0.00 H new ATOM 0 HA VAL A 127 5.896 -1.840 -12.719 1.00 0.00 H new ATOM 0 HB VAL A 127 4.451 -3.618 -10.745 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.397 -3.237 -12.080 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.944 -1.733 -11.300 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.247 -1.998 -13.033 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.059 -4.943 -12.815 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.921 -3.710 -13.765 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.797 -4.671 -12.550 1.00 0.00 H new ATOM 1897 N ARG A 128 4.898 0.240 -11.632 1.00 0.00 N ATOM 1898 CA ARG A 128 4.485 1.455 -10.901 1.00 0.00 C ATOM 1899 C ARG A 128 2.987 1.496 -10.748 1.00 0.00 C ATOM 1900 O ARG A 128 2.276 1.013 -11.606 1.00 0.00 O ATOM 1901 CB ARG A 128 4.946 2.664 -11.715 1.00 0.00 C ATOM 1902 CG ARG A 128 6.358 2.410 -12.249 1.00 0.00 C ATOM 1903 CD ARG A 128 6.963 3.725 -12.746 1.00 0.00 C ATOM 1904 NE ARG A 128 8.101 3.434 -13.663 1.00 0.00 N ATOM 1905 CZ ARG A 128 7.877 3.199 -14.928 1.00 0.00 C ATOM 1906 NH1 ARG A 128 6.720 2.729 -15.311 1.00 0.00 N ATOM 1907 NH2 ARG A 128 8.809 3.435 -15.809 1.00 0.00 N ATOM 0 H ARG A 128 4.956 0.328 -12.647 1.00 0.00 H new ATOM 0 HA ARG A 128 4.929 1.460 -9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.259 2.842 -12.542 1.00 0.00 H new ATOM 0 HB3 ARG A 128 4.936 3.560 -11.094 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.983 1.984 -11.464 1.00 0.00 H new ATOM 0 HG3 ARG A 128 6.326 1.683 -13.061 1.00 0.00 H new ATOM 0 HD2 ARG A 128 6.206 4.313 -13.264 1.00 0.00 H new ATOM 0 HD3 ARG A 128 7.307 4.322 -11.901 1.00 0.00 H new ATOM 0 HE ARG A 128 9.055 3.418 -13.303 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.991 2.545 -14.622 1.00 0.00 H new ATOM 0 HH12 ARG A 128 6.546 2.546 -16.299 1.00 0.00 H new ATOM 0 HH21 ARG A 128 9.712 3.803 -15.510 1.00 0.00 H new ATOM 0 HH22 ARG A 128 8.635 3.252 -16.797 1.00 0.00 H new ATOM 1921 N LEU A 129 2.461 2.056 -9.677 1.00 0.00 N ATOM 1922 CA LEU A 129 0.956 2.041 -9.601 1.00 0.00 C ATOM 1923 C LEU A 129 0.461 3.294 -8.933 1.00 0.00 C ATOM 1924 O LEU A 129 1.175 3.866 -8.131 1.00 0.00 O ATOM 1925 CB LEU A 129 0.507 0.840 -8.756 1.00 0.00 C ATOM 1926 CG LEU A 129 0.448 -0.439 -9.607 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.349 -1.514 -8.995 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.989 -0.951 -9.640 1.00 0.00 C ATOM 0 H LEU A 129 2.963 2.493 -8.904 1.00 0.00 H new ATOM 0 HA LEU A 129 0.552 1.976 -10.611 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.197 0.697 -7.925 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.474 1.040 -8.325 1.00 0.00 H new ATOM 0 HG LEU A 129 0.789 -0.215 -10.618 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.302 -2.417 -9.603 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.377 -1.152 -8.962 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.011 -1.740 -7.984 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.038 -1.858 -10.242 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.320 -1.171 -8.625 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.636 -0.190 -10.076 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.746 3.716 -9.161 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.235 4.898 -8.423 1.00 0.00 C ATOM 1942 C PRO A 130 -1.094 4.574 -6.935 1.00 0.00 C ATOM 1943 O PRO A 130 -1.366 3.462 -6.537 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.700 4.991 -8.867 1.00 0.00 C ATOM 1945 CG PRO A 130 -2.986 3.848 -9.861 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.680 3.082 -10.121 1.00 0.00 C ATOM 0 HA PRO A 130 -0.711 5.836 -8.604 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.362 4.917 -8.004 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.893 5.956 -9.335 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.744 3.177 -9.457 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.381 4.249 -10.794 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.791 2.014 -9.935 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.342 3.193 -11.151 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.613 5.464 -6.107 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.427 5.056 -4.678 1.00 0.00 C ATOM 1956 C TYR A 131 -0.831 6.131 -3.682 1.00 0.00 C ATOM 1957 O TYR A 131 -1.257 7.212 -4.038 1.00 0.00 O ATOM 1958 CB TYR A 131 1.054 4.758 -4.469 1.00 0.00 C ATOM 1959 CG TYR A 131 1.845 6.023 -4.707 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.211 6.383 -6.008 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.203 6.837 -3.628 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.936 7.559 -6.231 1.00 0.00 C ATOM 1963 CE2 TYR A 131 2.931 8.013 -3.851 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.298 8.373 -5.152 1.00 0.00 C ATOM 1965 OH TYR A 131 4.013 9.532 -5.372 1.00 0.00 O ATOM 0 H TYR A 131 -0.349 6.421 -6.342 1.00 0.00 H new ATOM 0 HA TYR A 131 -1.067 4.192 -4.500 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.226 4.391 -3.457 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.381 3.974 -5.152 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.934 5.753 -6.841 1.00 0.00 H new ATOM 0 HD2 TYR A 131 1.919 6.559 -2.624 1.00 0.00 H new ATOM 0 HE1 TYR A 131 3.216 7.838 -7.236 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.209 8.642 -3.018 1.00 0.00 H new ATOM 0 HH TYR A 131 4.181 9.980 -4.517 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.664 5.828 -2.413 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.002 6.822 -1.351 1.00 0.00 C ATOM 1977 C VAL A 132 0.199 6.941 -0.415 1.00 0.00 C ATOM 1978 O VAL A 132 1.041 6.065 -0.373 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.222 6.337 -0.562 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.534 7.318 0.573 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.431 6.256 -1.496 1.00 0.00 C ATOM 0 H VAL A 132 -0.308 4.935 -2.072 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.233 7.789 -1.797 1.00 0.00 H new ATOM 0 HB VAL A 132 -2.007 5.354 -0.143 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.403 6.966 1.129 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.677 7.384 1.243 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.745 8.302 0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.301 5.911 -0.937 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.636 7.242 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.219 5.557 -2.305 1.00 0.00 H new ATOM 1991 N CYS A 133 0.300 7.996 0.340 1.00 0.00 N ATOM 1992 CA CYS A 133 1.468 8.117 1.259 1.00 0.00 C ATOM 1993 C CYS A 133 1.109 8.983 2.465 1.00 0.00 C ATOM 1994 O CYS A 133 0.347 9.921 2.364 1.00 0.00 O ATOM 1995 CB CYS A 133 2.644 8.737 0.507 1.00 0.00 C ATOM 1996 SG CYS A 133 3.330 7.503 -0.621 1.00 0.00 S ATOM 0 H CYS A 133 -0.363 8.771 0.363 1.00 0.00 H new ATOM 0 HA CYS A 133 1.745 7.124 1.614 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.316 9.615 -0.049 1.00 0.00 H new ATOM 0 HB3 CYS A 133 3.407 9.072 1.210 1.00 0.00 H new ATOM 2001 N LYS A 134 1.664 8.669 3.606 1.00 0.00 N ATOM 2002 CA LYS A 134 1.371 9.462 4.836 1.00 0.00 C ATOM 2003 C LYS A 134 2.540 10.414 5.098 1.00 0.00 C ATOM 2004 O LYS A 134 3.646 10.174 4.659 1.00 0.00 O ATOM 2005 CB LYS A 134 1.195 8.501 6.020 1.00 0.00 C ATOM 2006 CG LYS A 134 2.552 8.210 6.672 1.00 0.00 C ATOM 2007 CD LYS A 134 2.441 6.964 7.556 1.00 0.00 C ATOM 2008 CE LYS A 134 3.640 6.900 8.504 1.00 0.00 C ATOM 2009 NZ LYS A 134 3.545 5.675 9.347 1.00 0.00 N ATOM 0 H LYS A 134 2.312 7.892 3.739 1.00 0.00 H new ATOM 0 HA LYS A 134 0.456 10.041 4.708 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.517 8.937 6.754 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.740 7.571 5.679 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.310 8.057 5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.871 9.065 7.269 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.513 6.993 8.128 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.406 6.068 6.936 1.00 0.00 H new ATOM 0 HE2 LYS A 134 4.568 6.890 7.933 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.665 7.788 9.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 4.361 5.633 9.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 2.666 5.703 9.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 3.542 4.833 8.737 1.00 0.00 H new ATOM 2023 N PHE A 135 2.308 11.496 5.799 1.00 0.00 N ATOM 2024 CA PHE A 135 3.425 12.456 6.067 1.00 0.00 C ATOM 2025 C PHE A 135 2.921 13.624 6.920 1.00 0.00 C ATOM 2026 O PHE A 135 1.932 14.251 6.605 1.00 0.00 O ATOM 2027 CB PHE A 135 3.955 13.011 4.742 1.00 0.00 C ATOM 2028 CG PHE A 135 2.807 13.582 3.942 1.00 0.00 C ATOM 2029 CD1 PHE A 135 2.419 14.915 4.128 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.128 12.780 3.018 1.00 0.00 C ATOM 2031 CE1 PHE A 135 1.354 15.444 3.388 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.063 13.309 2.280 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.676 14.641 2.466 1.00 0.00 C ATOM 0 H PHE A 135 1.404 11.755 6.194 1.00 0.00 H new ATOM 0 HA PHE A 135 4.218 11.930 6.597 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.701 13.783 4.931 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.450 12.222 4.176 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.941 15.535 4.842 1.00 0.00 H new ATOM 0 HD2 PHE A 135 2.426 11.752 2.874 1.00 0.00 H new ATOM 0 HE1 PHE A 135 1.056 16.472 3.530 1.00 0.00 H new ATOM 0 HE2 PHE A 135 0.540 12.689 1.567 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.147 15.049 1.897 1.00 0.00 H new