USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 960 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 56 SER OG : rot 76:sc= 0.925 USER MOD Set 1.2: A 85 MET CE :methyl 152:sc= -0.0177 (180deg=-0.455) USER MOD Set 2.1: A 63 MET CE :methyl -160:sc= 0 (180deg=-0.252) USER MOD Set 2.2: A 71 THR OG1 : rot 83:sc= 1.27 USER MOD Set 3.1: A 7 LYS NZ :NH3+ -109:sc= 0.593 (180deg=0) USER MOD Set 3.2: A 31 ASN : amide:sc= 0.735 K(o=2.7,f=-2.2) USER MOD Set 3.3: A 32 ASN : amide:sc= 1.36 K(o=2.7,f=-2.1) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 112:sc= 0.0172 USER MOD Single : A 17 MET CE :methyl 134:sc= -0.469 (180deg=-0.74) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 174:sc= 0.8 (180deg=0.786) USER MOD Single : A 44 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 45 LYS NZ :NH3+ -172:sc= 1.13 (180deg=0.767) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 51 TYR OH : rot 90:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.379 X(o=-0.38,f=0) USER MOD Single : A 60 MET CE :methyl 164:sc= -0.441 (180deg=-1.1) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0.038 USER MOD Single : A 87 THR OG1 : rot 65:sc= 1.69 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -0.973 K(o=-0.97,f=-1.6) USER MOD Single : A 100 GLN : amide:sc= -0.0842 X(o=-0.084,f=-0.084) USER MOD Single : A 104 SER OG : rot -74:sc= 1.21 USER MOD Single : A 106 TYR OH : rot -9:sc= 1.28 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 149:sc= -0.626 (180deg=-1.53) USER MOD Single : A 121 ASN : amide:sc=-0.00849 X(o=-0.0085,f=-0.37) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl 160:sc= 0 (180deg=-0.432) USER MOD ----------------------------------------------------------------- ATOM 79 N LEU A 6 10.715 -10.217 0.383 1.00 0.00 N ATOM 80 CA LEU A 6 9.309 -9.919 0.204 1.00 0.00 C ATOM 81 C LEU A 6 9.172 -8.430 -0.082 1.00 0.00 C ATOM 82 O LEU A 6 9.351 -7.598 0.810 1.00 0.00 O ATOM 83 CB LEU A 6 8.522 -10.340 1.445 1.00 0.00 C ATOM 84 CG LEU A 6 7.027 -10.052 1.226 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.228 -11.353 1.247 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.513 -9.065 2.267 1.00 0.00 C ATOM 0 HA LEU A 6 8.898 -10.478 -0.637 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.674 -11.401 1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.883 -9.798 2.319 1.00 0.00 H new ATOM 0 HG LEU A 6 6.897 -9.594 0.245 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.172 -11.134 1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.583 -12.011 0.454 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.358 -11.844 2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.454 -8.874 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.649 -9.484 3.264 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.068 -8.130 2.187 1.00 0.00 H new ATOM 98 N LYS A 7 8.931 -8.101 -1.344 1.00 0.00 N ATOM 99 CA LYS A 7 9.143 -6.739 -1.801 1.00 0.00 C ATOM 100 C LYS A 7 7.944 -5.897 -1.367 1.00 0.00 C ATOM 101 O LYS A 7 6.793 -6.312 -1.565 1.00 0.00 O ATOM 102 CB LYS A 7 9.390 -6.708 -3.319 1.00 0.00 C ATOM 103 CG LYS A 7 10.224 -5.478 -3.708 1.00 0.00 C ATOM 104 CD LYS A 7 11.733 -5.717 -3.524 1.00 0.00 C ATOM 105 CE LYS A 7 12.378 -6.302 -4.786 1.00 0.00 C ATOM 106 NZ LYS A 7 13.850 -6.374 -4.667 1.00 0.00 N ATOM 0 H LYS A 7 8.594 -8.748 -2.057 1.00 0.00 H new ATOM 0 HA LYS A 7 10.039 -6.312 -1.350 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.907 -7.617 -3.627 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.437 -6.689 -3.847 1.00 0.00 H new ATOM 0 HG2 LYS A 7 10.023 -5.219 -4.747 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.916 -4.626 -3.102 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.221 -4.776 -3.270 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.893 -6.396 -2.686 1.00 0.00 H new ATOM 0 HE2 LYS A 7 11.979 -7.300 -4.969 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.112 -5.689 -5.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.284 -5.664 -5.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.128 -6.186 -3.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 14.175 -7.323 -4.944 1.00 0.00 H new ATOM 120 N PHE A 8 8.195 -4.728 -0.783 1.00 0.00 N ATOM 121 CA PHE A 8 7.160 -3.801 -0.352 1.00 0.00 C ATOM 122 C PHE A 8 7.001 -2.753 -1.446 1.00 0.00 C ATOM 123 O PHE A 8 7.748 -1.774 -1.447 1.00 0.00 O ATOM 124 CB PHE A 8 7.558 -3.142 0.982 1.00 0.00 C ATOM 125 CG PHE A 8 6.997 -3.753 2.241 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.565 -4.916 2.789 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.952 -3.095 2.916 1.00 0.00 C ATOM 128 CE1 PHE A 8 7.095 -5.401 4.019 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.476 -3.587 4.140 1.00 0.00 C ATOM 130 CZ PHE A 8 6.071 -4.727 4.707 1.00 0.00 C ATOM 0 H PHE A 8 9.141 -4.396 -0.594 1.00 0.00 H new ATOM 0 HA PHE A 8 6.217 -4.323 -0.190 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.645 -3.154 1.055 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.253 -2.096 0.948 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.357 -5.432 2.267 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.514 -2.205 2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.523 -6.299 4.440 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.658 -3.093 4.643 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.742 -5.085 5.671 1.00 0.00 H new ATOM 140 N LEU A 9 6.076 -2.917 -2.394 1.00 0.00 N ATOM 141 CA LEU A 9 5.783 -1.792 -3.273 1.00 0.00 C ATOM 142 C LEU A 9 5.072 -0.737 -2.437 1.00 0.00 C ATOM 143 O LEU A 9 4.127 -1.060 -1.710 1.00 0.00 O ATOM 144 CB LEU A 9 4.923 -2.166 -4.488 1.00 0.00 C ATOM 145 CG LEU A 9 5.062 -1.099 -5.587 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.422 -1.139 -6.301 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.968 -1.288 -6.627 1.00 0.00 C ATOM 0 H LEU A 9 5.544 -3.770 -2.566 1.00 0.00 H new ATOM 0 HA LEU A 9 6.724 -1.425 -3.684 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.230 -3.138 -4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.879 -2.257 -4.189 1.00 0.00 H new ATOM 0 HG LEU A 9 4.975 -0.133 -5.090 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.455 -0.362 -7.064 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.219 -0.970 -5.576 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.558 -2.114 -6.770 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.070 -0.530 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.057 -2.279 -7.073 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.992 -1.191 -6.151 1.00 0.00 H new ATOM 159 N VAL A 10 5.528 0.505 -2.544 1.00 0.00 N ATOM 160 CA VAL A 10 4.907 1.647 -1.896 1.00 0.00 C ATOM 161 C VAL A 10 4.797 2.728 -2.981 1.00 0.00 C ATOM 162 O VAL A 10 5.827 3.106 -3.551 1.00 0.00 O ATOM 163 CB VAL A 10 5.760 2.042 -0.671 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.184 3.246 0.078 1.00 0.00 C ATOM 165 CG2 VAL A 10 5.956 0.916 0.359 1.00 0.00 C ATOM 0 H VAL A 10 6.353 0.748 -3.093 1.00 0.00 H new ATOM 0 HA VAL A 10 3.909 1.456 -1.501 1.00 0.00 H new ATOM 0 HB VAL A 10 6.727 2.284 -1.112 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.821 3.483 0.930 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.140 4.105 -0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.180 3.009 0.430 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.566 1.281 1.185 1.00 0.00 H new ATOM 0 HG22 VAL A 10 4.985 0.597 0.738 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.455 0.071 -0.116 1.00 0.00 H new ATOM 175 N VAL A 11 3.578 3.174 -3.306 1.00 0.00 N ATOM 176 CA VAL A 11 3.271 4.116 -4.390 1.00 0.00 C ATOM 177 C VAL A 11 2.362 5.226 -3.833 1.00 0.00 C ATOM 178 O VAL A 11 1.197 5.330 -4.217 1.00 0.00 O ATOM 179 CB VAL A 11 2.644 3.398 -5.622 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.813 4.257 -6.881 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.265 2.019 -5.884 1.00 0.00 C ATOM 0 H VAL A 11 2.744 2.876 -2.800 1.00 0.00 H new ATOM 0 HA VAL A 11 4.195 4.565 -4.754 1.00 0.00 H new ATOM 0 HB VAL A 11 1.588 3.257 -5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.370 3.743 -7.734 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.315 5.216 -6.737 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.874 4.423 -7.068 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.790 1.565 -6.754 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.333 2.131 -6.071 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.114 1.381 -5.014 1.00 0.00 H new ATOM 191 N ASP A 12 2.841 6.027 -2.879 1.00 0.00 N ATOM 192 CA ASP A 12 2.116 7.226 -2.441 1.00 0.00 C ATOM 193 C ASP A 12 2.149 8.258 -3.578 1.00 0.00 C ATOM 194 O ASP A 12 3.031 8.202 -4.442 1.00 0.00 O ATOM 195 CB ASP A 12 2.708 7.868 -1.177 1.00 0.00 C ATOM 196 CG ASP A 12 2.914 6.919 0.004 1.00 0.00 C ATOM 197 OD1 ASP A 12 3.728 5.983 -0.154 1.00 0.00 O ATOM 198 OD2 ASP A 12 2.351 7.171 1.088 1.00 0.00 O ATOM 0 H ASP A 12 3.725 5.870 -2.395 1.00 0.00 H new ATOM 0 HA ASP A 12 1.099 6.918 -2.197 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.668 8.316 -1.433 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.052 8.679 -0.860 1.00 0.00 H new ATOM 203 N ASP A 13 1.225 9.222 -3.580 1.00 0.00 N ATOM 204 CA ASP A 13 1.155 10.273 -4.597 1.00 0.00 C ATOM 205 C ASP A 13 2.240 11.303 -4.319 1.00 0.00 C ATOM 206 O ASP A 13 3.172 11.480 -5.104 1.00 0.00 O ATOM 207 CB ASP A 13 -0.227 10.945 -4.595 1.00 0.00 C ATOM 208 CG ASP A 13 -0.207 12.250 -5.386 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.265 12.265 -6.548 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.593 13.305 -4.834 1.00 0.00 O ATOM 0 H ASP A 13 0.498 9.295 -2.869 1.00 0.00 H new ATOM 0 HA ASP A 13 1.310 9.829 -5.580 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.964 10.267 -5.025 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.536 11.143 -3.569 1.00 0.00 H new ATOM 215 N PHE A 14 2.119 11.986 -3.184 1.00 0.00 N ATOM 216 CA PHE A 14 3.081 12.960 -2.710 1.00 0.00 C ATOM 217 C PHE A 14 4.385 12.219 -2.424 1.00 0.00 C ATOM 218 O PHE A 14 4.426 11.424 -1.490 1.00 0.00 O ATOM 219 CB PHE A 14 2.505 13.614 -1.444 1.00 0.00 C ATOM 220 CG PHE A 14 3.371 14.641 -0.731 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.347 15.395 -1.417 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.140 14.890 0.635 1.00 0.00 C ATOM 223 CE1 PHE A 14 5.087 16.375 -0.736 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.876 15.876 1.315 1.00 0.00 C ATOM 225 CZ PHE A 14 4.845 16.626 0.626 1.00 0.00 C ATOM 0 H PHE A 14 1.324 11.869 -2.555 1.00 0.00 H new ATOM 0 HA PHE A 14 3.279 13.743 -3.442 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.564 14.094 -1.711 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.268 12.822 -0.734 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.525 15.218 -2.467 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.392 14.319 1.165 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.845 16.938 -1.260 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.697 16.057 2.365 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.403 17.394 1.142 1.00 0.00 H new ATOM 235 N SER A 15 5.462 12.455 -3.176 1.00 0.00 N ATOM 236 CA SER A 15 6.695 11.687 -2.994 1.00 0.00 C ATOM 237 C SER A 15 7.174 11.703 -1.536 1.00 0.00 C ATOM 238 O SER A 15 7.513 10.651 -0.994 1.00 0.00 O ATOM 239 CB SER A 15 7.768 12.184 -3.963 1.00 0.00 C ATOM 240 OG SER A 15 7.327 11.933 -5.283 1.00 0.00 O ATOM 0 H SER A 15 5.506 13.163 -3.909 1.00 0.00 H new ATOM 0 HA SER A 15 6.487 10.643 -3.227 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.945 13.250 -3.818 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.714 11.675 -3.776 1.00 0.00 H new ATOM 0 HG SER A 15 8.003 12.247 -5.919 1.00 0.00 H new ATOM 246 N THR A 16 7.114 12.840 -0.841 1.00 0.00 N ATOM 247 CA THR A 16 7.526 12.912 0.558 1.00 0.00 C ATOM 248 C THR A 16 6.700 11.964 1.446 1.00 0.00 C ATOM 249 O THR A 16 7.250 11.386 2.380 1.00 0.00 O ATOM 250 CB THR A 16 7.488 14.377 1.007 1.00 0.00 C ATOM 251 OG1 THR A 16 8.265 15.151 0.104 1.00 0.00 O ATOM 252 CG2 THR A 16 8.035 14.573 2.420 1.00 0.00 C ATOM 0 H THR A 16 6.783 13.724 -1.227 1.00 0.00 H new ATOM 0 HA THR A 16 8.552 12.559 0.665 1.00 0.00 H new ATOM 0 HB THR A 16 6.445 14.694 1.011 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.677 15.744 -0.409 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.984 15.629 2.687 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.440 13.992 3.124 1.00 0.00 H new ATOM 0 HG23 THR A 16 9.072 14.238 2.459 1.00 0.00 H new ATOM 260 N MET A 17 5.427 11.709 1.132 1.00 0.00 N ATOM 261 CA MET A 17 4.610 10.689 1.787 1.00 0.00 C ATOM 262 C MET A 17 5.257 9.304 1.620 1.00 0.00 C ATOM 263 O MET A 17 5.420 8.587 2.605 1.00 0.00 O ATOM 264 CB MET A 17 3.201 10.747 1.182 1.00 0.00 C ATOM 265 CG MET A 17 2.087 10.041 1.940 1.00 0.00 C ATOM 266 SD MET A 17 1.039 11.105 2.959 1.00 0.00 S ATOM 267 CE MET A 17 -0.503 10.183 2.716 1.00 0.00 C ATOM 0 H MET A 17 4.928 12.216 0.401 1.00 0.00 H new ATOM 0 HA MET A 17 4.541 10.875 2.859 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.923 11.795 1.073 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.247 10.324 0.179 1.00 0.00 H new ATOM 0 HG2 MET A 17 1.455 9.521 1.220 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.533 9.280 2.580 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.002 10.050 3.676 1.00 0.00 H new ATOM 0 HE2 MET A 17 -1.156 10.737 2.041 1.00 0.00 H new ATOM 0 HE3 MET A 17 -0.279 9.207 2.285 1.00 0.00 H new ATOM 277 N ARG A 18 5.744 8.966 0.417 1.00 0.00 N ATOM 278 CA ARG A 18 6.421 7.698 0.126 1.00 0.00 C ATOM 279 C ARG A 18 7.740 7.620 0.894 1.00 0.00 C ATOM 280 O ARG A 18 8.112 6.538 1.361 1.00 0.00 O ATOM 281 CB ARG A 18 6.569 7.585 -1.410 1.00 0.00 C ATOM 282 CG ARG A 18 7.590 6.573 -1.924 1.00 0.00 C ATOM 283 CD ARG A 18 7.204 5.172 -1.482 1.00 0.00 C ATOM 284 NE ARG A 18 8.086 4.115 -1.992 1.00 0.00 N ATOM 285 CZ ARG A 18 9.360 3.877 -1.686 1.00 0.00 C ATOM 286 NH1 ARG A 18 10.028 4.713 -0.900 1.00 0.00 N ATOM 287 NH2 ARG A 18 9.956 2.793 -2.161 1.00 0.00 N ATOM 0 H ARG A 18 5.676 9.580 -0.395 1.00 0.00 H new ATOM 0 HA ARG A 18 5.844 6.838 0.465 1.00 0.00 H new ATOM 0 HB2 ARG A 18 5.595 7.330 -1.829 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.836 8.567 -1.800 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.642 6.618 -3.012 1.00 0.00 H new ATOM 0 HG3 ARG A 18 8.582 6.822 -1.546 1.00 0.00 H new ATOM 0 HD2 ARG A 18 7.203 5.134 -0.393 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.184 4.968 -1.809 1.00 0.00 H new ATOM 0 HE ARG A 18 7.668 3.479 -2.671 1.00 0.00 H new ATOM 0 HH11 ARG A 18 9.565 5.542 -0.527 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.004 4.526 -0.669 1.00 0.00 H new ATOM 0 HH21 ARG A 18 9.439 2.147 -2.757 1.00 0.00 H new ATOM 0 HH22 ARG A 18 10.932 2.605 -1.930 1.00 0.00 H new ATOM 301 N ARG A 19 8.464 8.736 1.051 1.00 0.00 N ATOM 302 CA ARG A 19 9.636 8.761 1.928 1.00 0.00 C ATOM 303 C ARG A 19 9.211 8.436 3.356 1.00 0.00 C ATOM 304 O ARG A 19 9.851 7.593 3.981 1.00 0.00 O ATOM 305 CB ARG A 19 10.394 10.098 1.903 1.00 0.00 C ATOM 306 CG ARG A 19 11.342 10.280 0.714 1.00 0.00 C ATOM 307 CD ARG A 19 10.615 10.533 -0.610 1.00 0.00 C ATOM 308 NE ARG A 19 11.472 11.196 -1.607 1.00 0.00 N ATOM 309 CZ ARG A 19 12.658 10.771 -2.060 1.00 0.00 C ATOM 310 NH1 ARG A 19 13.058 9.527 -1.813 1.00 0.00 N ATOM 311 NH2 ARG A 19 13.444 11.591 -2.745 1.00 0.00 N ATOM 0 H ARG A 19 8.260 9.622 0.588 1.00 0.00 H new ATOM 0 HA ARG A 19 10.327 8.007 1.550 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.668 10.911 1.897 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.969 10.190 2.825 1.00 0.00 H new ATOM 0 HG2 ARG A 19 12.012 11.115 0.918 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.963 9.390 0.615 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.261 9.584 -1.013 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.735 11.149 -0.425 1.00 0.00 H new ATOM 0 HE ARG A 19 11.125 12.073 -1.994 1.00 0.00 H new ATOM 0 HH11 ARG A 19 12.461 8.896 -1.278 1.00 0.00 H new ATOM 0 HH12 ARG A 19 13.962 9.204 -2.158 1.00 0.00 H new ATOM 0 HH21 ARG A 19 13.146 12.549 -2.928 1.00 0.00 H new ATOM 0 HH22 ARG A 19 14.347 11.264 -3.088 1.00 0.00 H new ATOM 325 N ILE A 20 8.155 9.076 3.868 1.00 0.00 N ATOM 326 CA ILE A 20 7.630 8.836 5.207 1.00 0.00 C ATOM 327 C ILE A 20 7.317 7.345 5.369 1.00 0.00 C ATOM 328 O ILE A 20 7.896 6.725 6.254 1.00 0.00 O ATOM 329 CB ILE A 20 6.468 9.811 5.538 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.995 11.074 6.264 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.413 9.177 6.457 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.799 12.041 5.389 1.00 0.00 C ATOM 0 H ILE A 20 7.636 9.786 3.352 1.00 0.00 H new ATOM 0 HA ILE A 20 8.379 9.064 5.965 1.00 0.00 H new ATOM 0 HB ILE A 20 6.017 10.064 4.579 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.146 11.612 6.686 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.621 10.759 7.099 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.623 9.901 6.657 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.987 8.300 5.971 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.880 8.880 7.396 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.123 12.891 5.989 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.672 11.527 4.987 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.175 12.393 4.568 1.00 0.00 H new ATOM 344 N VAL A 21 6.454 6.747 4.542 1.00 0.00 N ATOM 345 CA VAL A 21 6.101 5.329 4.664 1.00 0.00 C ATOM 346 C VAL A 21 7.371 4.468 4.703 1.00 0.00 C ATOM 347 O VAL A 21 7.493 3.600 5.570 1.00 0.00 O ATOM 348 CB VAL A 21 5.166 4.880 3.518 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.812 3.386 3.640 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.839 5.638 3.508 1.00 0.00 C ATOM 0 H VAL A 21 5.984 7.227 3.775 1.00 0.00 H new ATOM 0 HA VAL A 21 5.559 5.194 5.600 1.00 0.00 H new ATOM 0 HB VAL A 21 5.721 5.086 2.603 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.153 3.100 2.820 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.724 2.791 3.597 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.307 3.208 4.590 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.223 5.282 2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.317 5.470 4.450 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.030 6.704 3.384 1.00 0.00 H new ATOM 360 N ARG A 22 8.327 4.709 3.799 1.00 0.00 N ATOM 361 CA ARG A 22 9.578 3.956 3.758 1.00 0.00 C ATOM 362 C ARG A 22 10.363 4.118 5.061 1.00 0.00 C ATOM 363 O ARG A 22 10.868 3.129 5.589 1.00 0.00 O ATOM 364 CB ARG A 22 10.365 4.399 2.517 1.00 0.00 C ATOM 365 CG ARG A 22 11.487 3.447 2.085 1.00 0.00 C ATOM 366 CD ARG A 22 12.817 3.549 2.826 1.00 0.00 C ATOM 367 NE ARG A 22 13.423 4.883 2.702 1.00 0.00 N ATOM 368 CZ ARG A 22 14.570 5.224 3.296 1.00 0.00 C ATOM 369 NH1 ARG A 22 15.314 4.303 3.895 1.00 0.00 N ATOM 370 NH2 ARG A 22 14.971 6.484 3.305 1.00 0.00 N ATOM 0 H ARG A 22 8.253 5.429 3.080 1.00 0.00 H new ATOM 0 HA ARG A 22 9.379 2.888 3.674 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.669 4.516 1.687 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.797 5.381 2.711 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.121 2.426 2.189 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.679 3.611 1.025 1.00 0.00 H new ATOM 0 HD2 ARG A 22 12.662 3.319 3.880 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.507 2.801 2.435 1.00 0.00 H new ATOM 0 HE ARG A 22 12.944 5.582 2.135 1.00 0.00 H new ATOM 0 HH11 ARG A 22 15.011 3.329 3.903 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.189 4.569 4.347 1.00 0.00 H new ATOM 0 HH21 ARG A 22 14.403 7.203 2.856 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.848 6.737 3.761 1.00 0.00 H new ATOM 384 N ASN A 23 10.459 5.335 5.593 1.00 0.00 N ATOM 385 CA ASN A 23 11.126 5.603 6.862 1.00 0.00 C ATOM 386 C ASN A 23 10.445 4.858 8.011 1.00 0.00 C ATOM 387 O ASN A 23 11.118 4.242 8.830 1.00 0.00 O ATOM 388 CB ASN A 23 11.155 7.110 7.152 1.00 0.00 C ATOM 389 CG ASN A 23 11.923 7.356 8.440 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.130 7.142 8.483 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.270 7.800 9.494 1.00 0.00 N ATOM 0 H ASN A 23 10.072 6.169 5.150 1.00 0.00 H new ATOM 0 HA ASN A 23 12.151 5.242 6.781 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.626 7.642 6.326 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.139 7.495 7.241 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.768 7.972 10.367 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.266 7.972 9.437 1.00 0.00 H new ATOM 398 N LEU A 24 9.112 4.885 8.076 1.00 0.00 N ATOM 399 CA LEU A 24 8.343 4.221 9.128 1.00 0.00 C ATOM 400 C LEU A 24 8.502 2.698 9.049 1.00 0.00 C ATOM 401 O LEU A 24 8.559 2.029 10.079 1.00 0.00 O ATOM 402 CB LEU A 24 6.858 4.594 9.012 1.00 0.00 C ATOM 403 CG LEU A 24 6.545 6.093 9.195 1.00 0.00 C ATOM 404 CD1 LEU A 24 5.086 6.315 8.790 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.848 6.609 10.607 1.00 0.00 C ATOM 0 H LEU A 24 8.532 5.373 7.393 1.00 0.00 H new ATOM 0 HA LEU A 24 8.727 4.558 10.091 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.496 4.280 8.033 1.00 0.00 H new ATOM 0 HB3 LEU A 24 6.298 4.028 9.756 1.00 0.00 H new ATOM 0 HG LEU A 24 7.204 6.678 8.554 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.832 7.368 8.908 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.949 6.023 7.749 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.437 5.712 9.424 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.605 7.670 10.667 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.249 6.058 11.332 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.906 6.466 10.827 1.00 0.00 H new ATOM 417 N LEU A 25 8.587 2.139 7.840 1.00 0.00 N ATOM 418 CA LEU A 25 8.908 0.730 7.626 1.00 0.00 C ATOM 419 C LEU A 25 10.300 0.421 8.170 1.00 0.00 C ATOM 420 O LEU A 25 10.481 -0.582 8.864 1.00 0.00 O ATOM 421 CB LEU A 25 8.805 0.385 6.129 1.00 0.00 C ATOM 422 CG LEU A 25 7.346 0.100 5.721 1.00 0.00 C ATOM 423 CD1 LEU A 25 7.137 0.280 4.216 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.916 -1.322 6.106 1.00 0.00 C ATOM 0 H LEU A 25 8.433 2.658 6.975 1.00 0.00 H new ATOM 0 HA LEU A 25 8.190 0.112 8.165 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.197 1.211 5.535 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.423 -0.486 5.911 1.00 0.00 H new ATOM 0 HG LEU A 25 6.734 0.821 6.262 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.097 0.071 3.965 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.379 1.305 3.935 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.786 -0.407 3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.882 -1.484 5.802 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.559 -2.045 5.605 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.001 -1.448 7.185 1.00 0.00 H new ATOM 436 N LYS A 26 11.283 1.282 7.894 1.00 0.00 N ATOM 437 CA LYS A 26 12.624 1.118 8.437 1.00 0.00 C ATOM 438 C LYS A 26 12.621 1.184 9.957 1.00 0.00 C ATOM 439 O LYS A 26 13.313 0.360 10.553 1.00 0.00 O ATOM 440 CB LYS A 26 13.592 2.156 7.850 1.00 0.00 C ATOM 441 CG LYS A 26 14.379 1.600 6.660 1.00 0.00 C ATOM 442 CD LYS A 26 15.660 0.847 7.074 1.00 0.00 C ATOM 443 CE LYS A 26 15.422 -0.611 7.498 1.00 0.00 C ATOM 444 NZ LYS A 26 15.385 -0.835 8.963 1.00 0.00 N ATOM 0 H LYS A 26 11.170 2.100 7.296 1.00 0.00 H new ATOM 0 HA LYS A 26 12.973 0.127 8.146 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.032 3.036 7.534 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.287 2.481 8.624 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.737 0.926 6.092 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.647 2.421 5.995 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.362 0.862 6.241 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.132 1.381 7.898 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.479 -0.950 7.069 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.209 -1.232 7.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.120 -1.822 9.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.324 -0.643 9.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.685 -0.198 9.394 1.00 0.00 H new ATOM 458 N GLU A 27 11.867 2.096 10.572 1.00 0.00 N ATOM 459 CA GLU A 27 11.745 2.182 12.024 1.00 0.00 C ATOM 460 C GLU A 27 11.248 0.861 12.597 1.00 0.00 C ATOM 461 O GLU A 27 11.771 0.399 13.611 1.00 0.00 O ATOM 462 CB GLU A 27 10.789 3.314 12.444 1.00 0.00 C ATOM 463 CG GLU A 27 11.394 4.717 12.345 1.00 0.00 C ATOM 464 CD GLU A 27 12.508 4.945 13.368 1.00 0.00 C ATOM 465 OE1 GLU A 27 12.242 4.917 14.592 1.00 0.00 O ATOM 466 OE2 GLU A 27 13.662 5.225 12.969 1.00 0.00 O ATOM 0 H GLU A 27 11.322 2.798 10.072 1.00 0.00 H new ATOM 0 HA GLU A 27 12.736 2.401 12.421 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.897 3.271 11.820 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.468 3.141 13.471 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.790 4.869 11.341 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.610 5.459 12.494 1.00 0.00 H new ATOM 473 N LEU A 28 10.234 0.251 11.980 1.00 0.00 N ATOM 474 CA LEU A 28 9.659 -0.980 12.511 1.00 0.00 C ATOM 475 C LEU A 28 10.561 -2.181 12.284 1.00 0.00 C ATOM 476 O LEU A 28 10.609 -3.049 13.156 1.00 0.00 O ATOM 477 CB LEU A 28 8.265 -1.234 11.940 1.00 0.00 C ATOM 478 CG LEU A 28 7.242 -0.267 12.549 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.958 -0.345 11.734 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.926 -0.566 14.021 1.00 0.00 C ATOM 0 H LEU A 28 9.800 0.588 11.121 1.00 0.00 H new ATOM 0 HA LEU A 28 9.567 -0.843 13.588 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.284 -1.116 10.857 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.966 -2.262 12.143 1.00 0.00 H new ATOM 0 HG LEU A 28 7.677 0.732 12.519 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.219 0.337 12.154 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.165 -0.065 10.701 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.570 -1.363 11.763 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.196 0.154 14.390 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.518 -1.573 14.108 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.839 -0.492 14.611 1.00 0.00 H new ATOM 492 N GLY A 29 11.288 -2.224 11.169 1.00 0.00 N ATOM 493 CA GLY A 29 12.204 -3.305 10.844 1.00 0.00 C ATOM 494 C GLY A 29 11.728 -4.062 9.620 1.00 0.00 C ATOM 495 O GLY A 29 11.527 -5.277 9.681 1.00 0.00 O ATOM 0 H GLY A 29 11.253 -1.494 10.457 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.200 -2.902 10.663 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.285 -3.987 11.691 1.00 0.00 H new ATOM 499 N PHE A 30 11.556 -3.348 8.509 1.00 0.00 N ATOM 500 CA PHE A 30 11.284 -3.907 7.195 1.00 0.00 C ATOM 501 C PHE A 30 12.296 -3.317 6.218 1.00 0.00 C ATOM 502 O PHE A 30 12.797 -2.208 6.434 1.00 0.00 O ATOM 503 CB PHE A 30 9.840 -3.602 6.785 1.00 0.00 C ATOM 504 CG PHE A 30 8.809 -4.274 7.670 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.388 -3.659 8.865 1.00 0.00 C ATOM 506 CD2 PHE A 30 8.305 -5.540 7.322 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.479 -4.315 9.712 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.363 -6.175 8.147 1.00 0.00 C ATOM 509 CZ PHE A 30 6.960 -5.570 9.349 1.00 0.00 C ATOM 0 H PHE A 30 11.605 -2.329 8.504 1.00 0.00 H new ATOM 0 HA PHE A 30 11.387 -4.992 7.200 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.683 -2.524 6.811 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.687 -3.922 5.754 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.764 -2.682 9.131 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.643 -6.025 6.418 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.179 -3.855 10.642 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.948 -7.129 7.857 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.252 -6.069 9.994 1.00 0.00 H new ATOM 519 N ASN A 31 12.598 -4.052 5.149 1.00 0.00 N ATOM 520 CA ASN A 31 13.549 -3.686 4.101 1.00 0.00 C ATOM 521 C ASN A 31 12.978 -4.126 2.749 1.00 0.00 C ATOM 522 O ASN A 31 11.897 -4.712 2.703 1.00 0.00 O ATOM 523 CB ASN A 31 14.936 -4.304 4.380 1.00 0.00 C ATOM 524 CG ASN A 31 15.048 -5.779 4.004 1.00 0.00 C ATOM 525 OD1 ASN A 31 15.325 -6.126 2.859 1.00 0.00 O ATOM 526 ND2 ASN A 31 14.847 -6.684 4.943 1.00 0.00 N ATOM 0 H ASN A 31 12.166 -4.961 4.982 1.00 0.00 H new ATOM 0 HA ASN A 31 13.693 -2.606 4.083 1.00 0.00 H new ATOM 0 HB2 ASN A 31 15.690 -3.741 3.829 1.00 0.00 H new ATOM 0 HB3 ASN A 31 15.165 -4.192 5.440 1.00 0.00 H new ATOM 0 HD21 ASN A 31 14.922 -7.676 4.719 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.617 -6.391 5.893 1.00 0.00 H new ATOM 533 N ASN A 32 13.704 -3.853 1.660 1.00 0.00 N ATOM 534 CA ASN A 32 13.334 -4.188 0.283 1.00 0.00 C ATOM 535 C ASN A 32 11.955 -3.657 -0.073 1.00 0.00 C ATOM 536 O ASN A 32 11.070 -4.361 -0.560 1.00 0.00 O ATOM 537 CB ASN A 32 13.562 -5.672 -0.054 1.00 0.00 C ATOM 538 CG ASN A 32 14.913 -5.822 -0.727 1.00 0.00 C ATOM 539 OD1 ASN A 32 15.006 -5.828 -1.951 1.00 0.00 O ATOM 540 ND2 ASN A 32 15.983 -5.897 0.045 1.00 0.00 N ATOM 0 H ASN A 32 14.602 -3.373 1.717 1.00 0.00 H new ATOM 0 HA ASN A 32 14.023 -3.663 -0.379 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.524 -6.275 0.854 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.771 -6.035 -0.711 1.00 0.00 H new ATOM 0 HD21 ASN A 32 16.911 -5.962 -0.374 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.881 -5.890 1.060 1.00 0.00 H new ATOM 547 N VAL A 33 11.789 -2.356 0.133 1.00 0.00 N ATOM 548 CA VAL A 33 10.735 -1.640 -0.551 1.00 0.00 C ATOM 549 C VAL A 33 11.065 -1.568 -2.045 1.00 0.00 C ATOM 550 O VAL A 33 12.219 -1.718 -2.450 1.00 0.00 O ATOM 551 CB VAL A 33 10.550 -0.243 0.060 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.000 -0.336 1.492 1.00 0.00 C ATOM 553 CG2 VAL A 33 11.863 0.553 0.051 1.00 0.00 C ATOM 0 H VAL A 33 12.362 -1.789 0.758 1.00 0.00 H new ATOM 0 HA VAL A 33 9.790 -2.169 -0.431 1.00 0.00 H new ATOM 0 HB VAL A 33 9.826 0.286 -0.559 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.879 0.667 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.035 -0.842 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.696 -0.899 2.113 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.695 1.536 0.490 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.616 0.020 0.631 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.211 0.669 -0.975 1.00 0.00 H new ATOM 563 N GLU A 34 10.070 -1.236 -2.849 1.00 0.00 N ATOM 564 CA GLU A 34 10.223 -0.699 -4.182 1.00 0.00 C ATOM 565 C GLU A 34 9.229 0.445 -4.321 1.00 0.00 C ATOM 566 O GLU A 34 8.425 0.741 -3.423 1.00 0.00 O ATOM 567 CB GLU A 34 9.992 -1.779 -5.253 1.00 0.00 C ATOM 568 CG GLU A 34 11.236 -2.586 -5.628 1.00 0.00 C ATOM 569 CD GLU A 34 12.324 -1.785 -6.353 1.00 0.00 C ATOM 570 OE1 GLU A 34 12.260 -0.534 -6.405 1.00 0.00 O ATOM 571 OE2 GLU A 34 13.253 -2.440 -6.884 1.00 0.00 O ATOM 0 H GLU A 34 9.093 -1.339 -2.575 1.00 0.00 H new ATOM 0 HA GLU A 34 11.241 -0.339 -4.333 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.224 -2.466 -4.897 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.601 -1.302 -6.152 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.662 -3.014 -4.721 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.934 -3.420 -6.262 1.00 0.00 H new ATOM 578 N GLU A 35 9.308 1.123 -5.450 1.00 0.00 N ATOM 579 CA GLU A 35 8.527 2.294 -5.756 1.00 0.00 C ATOM 580 C GLU A 35 8.050 2.146 -7.187 1.00 0.00 C ATOM 581 O GLU A 35 8.756 1.578 -8.029 1.00 0.00 O ATOM 582 CB GLU A 35 9.423 3.523 -5.563 1.00 0.00 C ATOM 583 CG GLU A 35 8.628 4.783 -5.234 1.00 0.00 C ATOM 584 CD GLU A 35 9.534 5.941 -4.806 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.556 5.733 -4.098 1.00 0.00 O ATOM 586 OE2 GLU A 35 9.234 7.098 -5.181 1.00 0.00 O ATOM 0 H GLU A 35 9.943 0.859 -6.203 1.00 0.00 H new ATOM 0 HA GLU A 35 7.658 2.411 -5.108 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.134 3.327 -4.761 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.004 3.691 -6.470 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.046 5.082 -6.106 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.918 4.565 -4.436 1.00 0.00 H new ATOM 593 N ALA A 36 6.871 2.684 -7.450 1.00 0.00 N ATOM 594 CA ALA A 36 6.372 2.944 -8.777 1.00 0.00 C ATOM 595 C ALA A 36 6.127 4.443 -8.848 1.00 0.00 C ATOM 596 O ALA A 36 6.102 5.125 -7.819 1.00 0.00 O ATOM 597 CB ALA A 36 5.084 2.154 -9.000 1.00 0.00 C ATOM 0 H ALA A 36 6.218 2.959 -6.716 1.00 0.00 H new ATOM 0 HA ALA A 36 7.073 2.637 -9.553 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.706 2.350 -10.003 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.287 1.089 -8.890 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.339 2.459 -8.265 1.00 0.00 H new ATOM 603 N GLU A 37 5.910 4.951 -10.050 1.00 0.00 N ATOM 604 CA GLU A 37 5.490 6.325 -10.222 1.00 0.00 C ATOM 605 C GLU A 37 4.067 6.511 -9.690 1.00 0.00 C ATOM 606 O GLU A 37 3.777 7.481 -8.985 1.00 0.00 O ATOM 607 CB GLU A 37 5.518 6.686 -11.706 1.00 0.00 C ATOM 608 CG GLU A 37 6.855 6.431 -12.405 1.00 0.00 C ATOM 609 CD GLU A 37 6.958 7.313 -13.645 1.00 0.00 C ATOM 610 OE1 GLU A 37 6.088 7.212 -14.541 1.00 0.00 O ATOM 611 OE2 GLU A 37 7.870 8.174 -13.681 1.00 0.00 O ATOM 0 H GLU A 37 6.019 4.429 -10.920 1.00 0.00 H new ATOM 0 HA GLU A 37 6.170 6.973 -9.669 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.742 6.117 -12.218 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.263 7.740 -11.814 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.679 6.644 -11.725 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.936 5.381 -12.685 1.00 0.00 H new ATOM 618 N ASP A 38 3.171 5.601 -10.072 1.00 0.00 N ATOM 619 CA ASP A 38 1.724 5.773 -10.062 1.00 0.00 C ATOM 620 C ASP A 38 1.055 4.400 -10.117 1.00 0.00 C ATOM 621 O ASP A 38 1.733 3.404 -10.342 1.00 0.00 O ATOM 622 CB ASP A 38 1.273 6.627 -11.263 1.00 0.00 C ATOM 623 CG ASP A 38 1.451 5.937 -12.619 1.00 0.00 C ATOM 624 OD1 ASP A 38 0.575 5.137 -13.010 1.00 0.00 O ATOM 625 OD2 ASP A 38 2.435 6.234 -13.340 1.00 0.00 O ATOM 0 H ASP A 38 3.451 4.681 -10.412 1.00 0.00 H new ATOM 0 HA ASP A 38 1.432 6.288 -9.147 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.223 6.889 -11.135 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.837 7.560 -11.265 1.00 0.00 H new ATOM 630 N GLY A 39 -0.258 4.329 -9.893 1.00 0.00 N ATOM 631 CA GLY A 39 -1.041 3.095 -9.888 1.00 0.00 C ATOM 632 C GLY A 39 -0.874 2.200 -11.124 1.00 0.00 C ATOM 633 O GLY A 39 -0.787 0.981 -10.972 1.00 0.00 O ATOM 0 H GLY A 39 -0.823 5.157 -9.704 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.771 2.518 -9.004 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.095 3.355 -9.789 1.00 0.00 H new ATOM 637 N VAL A 40 -0.812 2.748 -12.342 1.00 0.00 N ATOM 638 CA VAL A 40 -0.627 1.913 -13.532 1.00 0.00 C ATOM 639 C VAL A 40 0.782 1.321 -13.475 1.00 0.00 C ATOM 640 O VAL A 40 0.965 0.117 -13.682 1.00 0.00 O ATOM 641 CB VAL A 40 -0.858 2.703 -14.839 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.909 1.742 -16.038 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.169 3.504 -14.835 1.00 0.00 C ATOM 0 H VAL A 40 -0.886 3.748 -12.528 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.369 1.115 -13.536 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.023 3.400 -14.917 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.072 2.311 -16.953 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.034 1.200 -16.111 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.725 1.033 -15.901 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.273 4.037 -15.780 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.011 2.823 -14.708 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.155 4.221 -14.014 1.00 0.00 H new ATOM 653 N ASP A 41 1.774 2.151 -13.138 1.00 0.00 N ATOM 654 CA ASP A 41 3.141 1.687 -12.946 1.00 0.00 C ATOM 655 C ASP A 41 3.234 0.711 -11.768 1.00 0.00 C ATOM 656 O ASP A 41 4.096 -0.160 -11.782 1.00 0.00 O ATOM 657 CB ASP A 41 4.110 2.864 -12.782 1.00 0.00 C ATOM 658 CG ASP A 41 5.570 2.400 -12.777 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.995 1.623 -13.665 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.353 2.841 -11.910 1.00 0.00 O ATOM 0 H ASP A 41 1.649 3.153 -12.993 1.00 0.00 H new ATOM 0 HA ASP A 41 3.438 1.145 -13.844 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.957 3.577 -13.593 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.892 3.388 -11.852 1.00 0.00 H new ATOM 665 N ALA A 42 2.339 0.775 -10.773 1.00 0.00 N ATOM 666 CA ALA A 42 2.279 -0.159 -9.668 1.00 0.00 C ATOM 667 C ALA A 42 1.877 -1.538 -10.169 1.00 0.00 C ATOM 668 O ALA A 42 2.539 -2.520 -9.844 1.00 0.00 O ATOM 669 CB ALA A 42 1.301 0.337 -8.595 1.00 0.00 C ATOM 0 H ALA A 42 1.624 1.500 -10.724 1.00 0.00 H new ATOM 0 HA ALA A 42 3.268 -0.230 -9.216 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.270 -0.378 -7.773 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.632 1.306 -8.221 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.306 0.436 -9.028 1.00 0.00 H new ATOM 675 N LEU A 43 0.813 -1.620 -10.970 1.00 0.00 N ATOM 676 CA LEU A 43 0.367 -2.877 -11.569 1.00 0.00 C ATOM 677 C LEU A 43 1.479 -3.468 -12.455 1.00 0.00 C ATOM 678 O LEU A 43 1.776 -4.671 -12.411 1.00 0.00 O ATOM 679 CB LEU A 43 -0.920 -2.597 -12.365 1.00 0.00 C ATOM 680 CG LEU A 43 -1.690 -3.873 -12.743 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.476 -4.448 -11.558 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.678 -3.552 -13.866 1.00 0.00 C ATOM 0 H LEU A 43 0.237 -0.816 -11.221 1.00 0.00 H new ATOM 0 HA LEU A 43 0.152 -3.618 -10.799 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.570 -1.950 -11.776 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.666 -2.052 -13.274 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.957 -4.615 -13.060 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.003 -5.348 -11.874 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.787 -4.695 -10.750 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.197 -3.710 -11.207 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.226 -4.454 -14.137 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.379 -2.789 -13.527 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.134 -3.183 -14.735 1.00 0.00 H new ATOM 694 N ASN A 44 2.128 -2.598 -13.234 1.00 0.00 N ATOM 695 CA ASN A 44 3.272 -2.935 -14.073 1.00 0.00 C ATOM 696 C ASN A 44 4.431 -3.477 -13.226 1.00 0.00 C ATOM 697 O ASN A 44 4.975 -4.535 -13.543 1.00 0.00 O ATOM 698 CB ASN A 44 3.683 -1.697 -14.882 1.00 0.00 C ATOM 699 CG ASN A 44 4.737 -1.974 -15.945 1.00 0.00 C ATOM 700 OD1 ASN A 44 5.000 -3.108 -16.329 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.358 -0.923 -16.459 1.00 0.00 N ATOM 0 H ASN A 44 1.862 -1.615 -13.297 1.00 0.00 H new ATOM 0 HA ASN A 44 2.996 -3.728 -14.768 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.798 -1.279 -15.362 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.062 -0.938 -14.198 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.064 -1.052 -17.183 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.130 0.015 -16.131 1.00 0.00 H new ATOM 708 N LYS A 45 4.783 -2.810 -12.118 1.00 0.00 N ATOM 709 CA LYS A 45 5.756 -3.307 -11.142 1.00 0.00 C ATOM 710 C LYS A 45 5.329 -4.674 -10.641 1.00 0.00 C ATOM 711 O LYS A 45 6.161 -5.570 -10.603 1.00 0.00 O ATOM 712 CB LYS A 45 5.952 -2.343 -9.948 1.00 0.00 C ATOM 713 CG LYS A 45 7.260 -1.540 -10.021 1.00 0.00 C ATOM 714 CD LYS A 45 7.230 -0.485 -11.124 1.00 0.00 C ATOM 715 CE LYS A 45 8.581 0.223 -11.247 1.00 0.00 C ATOM 716 NZ LYS A 45 8.543 1.205 -12.345 1.00 0.00 N ATOM 0 H LYS A 45 4.394 -1.899 -11.874 1.00 0.00 H new ATOM 0 HA LYS A 45 6.716 -3.379 -11.653 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.111 -1.651 -9.908 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.938 -2.917 -9.021 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.440 -1.055 -9.062 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.093 -2.221 -10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.974 -0.955 -12.074 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.451 0.247 -10.910 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.824 0.724 -10.310 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.368 -0.509 -11.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.499 1.581 -12.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 8.200 0.744 -13.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.903 1.985 -12.091 1.00 0.00 H new ATOM 730 N LEU A 46 4.060 -4.862 -10.278 1.00 0.00 N ATOM 731 CA LEU A 46 3.569 -6.129 -9.749 1.00 0.00 C ATOM 732 C LEU A 46 3.820 -7.272 -10.725 1.00 0.00 C ATOM 733 O LEU A 46 4.217 -8.356 -10.283 1.00 0.00 O ATOM 734 CB LEU A 46 2.082 -6.029 -9.356 1.00 0.00 C ATOM 735 CG LEU A 46 1.829 -5.880 -7.850 1.00 0.00 C ATOM 736 CD1 LEU A 46 2.189 -7.184 -7.134 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.571 -4.675 -7.256 1.00 0.00 C ATOM 0 H LEU A 46 3.345 -4.138 -10.344 1.00 0.00 H new ATOM 0 HA LEU A 46 4.131 -6.352 -8.842 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.640 -5.177 -9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.565 -6.920 -9.712 1.00 0.00 H new ATOM 0 HG LEU A 46 0.768 -5.683 -7.698 1.00 0.00 H new ATOM 0 HD11 LEU A 46 2.008 -7.074 -6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.574 -7.995 -7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.241 -7.413 -7.302 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.362 -4.609 -6.188 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.643 -4.796 -7.409 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.235 -3.762 -7.748 1.00 0.00 H new ATOM 749 N GLN A 47 3.676 -7.027 -12.032 1.00 0.00 N ATOM 750 CA GLN A 47 4.047 -7.997 -13.070 1.00 0.00 C ATOM 751 C GLN A 47 5.562 -8.297 -13.168 1.00 0.00 C ATOM 752 O GLN A 47 5.971 -9.046 -14.059 1.00 0.00 O ATOM 753 CB GLN A 47 3.459 -7.584 -14.433 1.00 0.00 C ATOM 754 CG GLN A 47 1.924 -7.594 -14.403 1.00 0.00 C ATOM 755 CD GLN A 47 1.284 -7.482 -15.786 1.00 0.00 C ATOM 756 OE1 GLN A 47 1.896 -7.042 -16.760 1.00 0.00 O ATOM 757 NE2 GLN A 47 0.016 -7.833 -15.901 1.00 0.00 N ATOM 0 H GLN A 47 3.300 -6.153 -12.400 1.00 0.00 H new ATOM 0 HA GLN A 47 3.603 -8.943 -12.760 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.813 -6.588 -14.698 1.00 0.00 H new ATOM 0 HB3 GLN A 47 3.814 -8.265 -15.206 1.00 0.00 H new ATOM 0 HG2 GLN A 47 1.584 -8.514 -13.928 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.576 -6.768 -13.783 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -0.488 -8.197 -15.092 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -0.460 -7.740 -16.799 1.00 0.00 H new ATOM 766 N ALA A 48 6.427 -7.771 -12.296 1.00 0.00 N ATOM 767 CA ALA A 48 7.790 -8.281 -12.111 1.00 0.00 C ATOM 768 C ALA A 48 7.757 -9.675 -11.477 1.00 0.00 C ATOM 769 O ALA A 48 8.529 -10.552 -11.882 1.00 0.00 O ATOM 770 CB ALA A 48 8.626 -7.331 -11.251 1.00 0.00 C ATOM 0 H ALA A 48 6.202 -6.977 -11.696 1.00 0.00 H new ATOM 0 HA ALA A 48 8.257 -8.349 -13.093 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.631 -7.737 -11.132 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.683 -6.356 -11.736 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.161 -7.222 -10.271 1.00 0.00 H new ATOM 776 N GLY A 49 6.836 -9.901 -10.539 1.00 0.00 N ATOM 777 CA GLY A 49 6.609 -11.181 -9.893 1.00 0.00 C ATOM 778 C GLY A 49 7.452 -11.332 -8.631 1.00 0.00 C ATOM 779 O GLY A 49 8.651 -11.605 -8.734 1.00 0.00 O ATOM 0 H GLY A 49 6.210 -9.170 -10.202 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.553 -11.279 -9.640 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.846 -11.987 -10.588 1.00 0.00 H new ATOM 783 N GLY A 50 6.840 -11.199 -7.450 1.00 0.00 N ATOM 784 CA GLY A 50 7.463 -11.488 -6.158 1.00 0.00 C ATOM 785 C GLY A 50 7.209 -10.448 -5.068 1.00 0.00 C ATOM 786 O GLY A 50 7.914 -10.456 -4.052 1.00 0.00 O ATOM 0 H GLY A 50 5.875 -10.880 -7.366 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.103 -12.455 -5.807 1.00 0.00 H new ATOM 0 HA3 GLY A 50 8.539 -11.583 -6.304 1.00 0.00 H new ATOM 790 N TYR A 51 6.255 -9.534 -5.250 1.00 0.00 N ATOM 791 CA TYR A 51 5.881 -8.582 -4.209 1.00 0.00 C ATOM 792 C TYR A 51 5.173 -9.284 -3.056 1.00 0.00 C ATOM 793 O TYR A 51 4.739 -10.432 -3.182 1.00 0.00 O ATOM 794 CB TYR A 51 4.993 -7.493 -4.815 1.00 0.00 C ATOM 795 CG TYR A 51 5.814 -6.493 -5.592 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.140 -6.707 -6.940 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.372 -5.406 -4.905 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.044 -5.849 -7.589 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.265 -4.541 -5.554 1.00 0.00 C ATOM 800 CZ TYR A 51 7.616 -4.760 -6.906 1.00 0.00 C ATOM 801 OH TYR A 51 8.501 -3.948 -7.551 1.00 0.00 O ATOM 0 H TYR A 51 5.725 -9.435 -6.116 1.00 0.00 H new ATOM 0 HA TYR A 51 6.783 -8.123 -3.805 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.251 -7.948 -5.472 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.446 -6.982 -4.022 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.696 -7.531 -7.479 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.113 -5.234 -3.871 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.302 -6.027 -8.622 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.687 -3.703 -5.018 1.00 0.00 H new ATOM 0 HH TYR A 51 8.016 -3.214 -7.983 1.00 0.00 H new ATOM 811 N GLY A 52 5.012 -8.584 -1.932 1.00 0.00 N ATOM 812 CA GLY A 52 4.140 -9.005 -0.846 1.00 0.00 C ATOM 813 C GLY A 52 3.258 -7.886 -0.304 1.00 0.00 C ATOM 814 O GLY A 52 2.253 -8.200 0.331 1.00 0.00 O ATOM 0 H GLY A 52 5.490 -7.701 -1.753 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.506 -9.820 -1.195 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.750 -9.401 -0.034 1.00 0.00 H new ATOM 818 N PHE A 53 3.589 -6.614 -0.540 1.00 0.00 N ATOM 819 CA PHE A 53 2.753 -5.476 -0.177 1.00 0.00 C ATOM 820 C PHE A 53 2.661 -4.570 -1.382 1.00 0.00 C ATOM 821 O PHE A 53 3.647 -4.421 -2.108 1.00 0.00 O ATOM 822 CB PHE A 53 3.349 -4.669 0.979 1.00 0.00 C ATOM 823 CG PHE A 53 3.235 -5.306 2.340 1.00 0.00 C ATOM 824 CD1 PHE A 53 4.068 -6.384 2.686 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.349 -4.767 3.289 1.00 0.00 C ATOM 826 CE1 PHE A 53 4.006 -6.940 3.974 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.323 -5.290 4.589 1.00 0.00 C ATOM 828 CZ PHE A 53 3.140 -6.385 4.928 1.00 0.00 C ATOM 0 H PHE A 53 4.461 -6.346 -0.996 1.00 0.00 H new ATOM 0 HA PHE A 53 1.779 -5.850 0.138 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.403 -4.489 0.768 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.859 -3.696 1.010 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.758 -6.786 1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.692 -3.954 3.018 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.622 -7.790 4.229 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.674 -4.852 5.333 1.00 0.00 H new ATOM 0 HZ PHE A 53 3.100 -6.799 5.925 1.00 0.00 H new ATOM 838 N VAL A 54 1.490 -3.966 -1.559 1.00 0.00 N ATOM 839 CA VAL A 54 1.172 -3.107 -2.690 1.00 0.00 C ATOM 840 C VAL A 54 0.485 -1.871 -2.102 1.00 0.00 C ATOM 841 O VAL A 54 -0.704 -1.627 -2.289 1.00 0.00 O ATOM 842 CB VAL A 54 0.372 -3.938 -3.720 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.179 -3.250 -5.075 1.00 0.00 C ATOM 844 CG2 VAL A 54 1.097 -5.262 -4.002 1.00 0.00 C ATOM 0 H VAL A 54 0.717 -4.064 -0.901 1.00 0.00 H new ATOM 0 HA VAL A 54 2.028 -2.740 -3.257 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.608 -4.079 -3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.392 -3.902 -5.736 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.361 -2.314 -4.934 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.152 -3.044 -5.520 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.527 -5.841 -4.728 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.090 -5.055 -4.401 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.189 -5.831 -3.077 1.00 0.00 H new ATOM 854 N ILE A 55 1.234 -1.144 -1.272 1.00 0.00 N ATOM 855 CA ILE A 55 0.745 0.030 -0.563 1.00 0.00 C ATOM 856 C ILE A 55 0.674 1.121 -1.643 1.00 0.00 C ATOM 857 O ILE A 55 1.630 1.270 -2.409 1.00 0.00 O ATOM 858 CB ILE A 55 1.753 0.358 0.571 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.556 -0.594 1.778 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.551 1.792 1.096 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.851 -0.861 2.565 1.00 0.00 C ATOM 0 H ILE A 55 2.211 -1.361 -1.073 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.228 -0.089 -0.087 1.00 0.00 H new ATOM 0 HB ILE A 55 2.749 0.242 0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.813 -0.166 2.451 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.155 -1.543 1.421 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.271 1.994 1.889 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.700 2.502 0.282 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.540 1.897 1.488 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.640 -1.535 3.395 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.590 -1.318 1.906 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.242 0.080 2.952 1.00 0.00 H new ATOM 873 N SER A 56 -0.404 1.902 -1.703 1.00 0.00 N ATOM 874 CA SER A 56 -0.475 3.029 -2.621 1.00 0.00 C ATOM 875 C SER A 56 -1.250 4.176 -1.994 1.00 0.00 C ATOM 876 O SER A 56 -1.953 4.000 -0.996 1.00 0.00 O ATOM 877 CB SER A 56 -1.094 2.592 -3.961 1.00 0.00 C ATOM 878 OG SER A 56 -2.478 2.300 -3.854 1.00 0.00 O ATOM 0 H SER A 56 -1.236 1.772 -1.127 1.00 0.00 H new ATOM 0 HA SER A 56 0.535 3.384 -2.823 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.949 3.382 -4.698 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.568 1.711 -4.330 1.00 0.00 H new ATOM 0 HG SER A 56 -2.986 3.137 -3.799 1.00 0.00 H new ATOM 884 N ASP A 57 -1.187 5.334 -2.638 1.00 0.00 N ATOM 885 CA ASP A 57 -2.184 6.373 -2.445 1.00 0.00 C ATOM 886 C ASP A 57 -3.519 5.902 -3.006 1.00 0.00 C ATOM 887 O ASP A 57 -3.601 4.901 -3.725 1.00 0.00 O ATOM 888 CB ASP A 57 -1.754 7.671 -3.132 1.00 0.00 C ATOM 889 CG ASP A 57 -2.246 8.905 -2.375 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.479 9.123 -2.308 1.00 0.00 O ATOM 891 OD2 ASP A 57 -1.403 9.648 -1.831 1.00 0.00 O ATOM 0 H ASP A 57 -0.451 5.576 -3.301 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.286 6.571 -1.378 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.667 7.700 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.144 7.690 -4.150 1.00 0.00 H new ATOM 896 N TRP A 58 -4.563 6.660 -2.703 1.00 0.00 N ATOM 897 CA TRP A 58 -5.792 6.664 -3.459 1.00 0.00 C ATOM 898 C TRP A 58 -5.561 7.408 -4.775 1.00 0.00 C ATOM 899 O TRP A 58 -5.910 6.926 -5.852 1.00 0.00 O ATOM 900 CB TRP A 58 -6.867 7.415 -2.659 1.00 0.00 C ATOM 901 CG TRP A 58 -8.167 7.462 -3.385 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.514 8.308 -4.384 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.253 6.520 -3.257 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.721 7.908 -4.917 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.216 6.802 -4.265 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.491 5.436 -2.397 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.362 6.017 -4.429 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.671 4.692 -2.506 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.593 4.979 -3.526 1.00 0.00 C ATOM 0 H TRP A 58 -4.572 7.299 -1.908 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.111 5.640 -3.653 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -7.007 6.929 -1.694 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.527 8.431 -2.458 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -7.937 9.160 -4.711 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.188 8.373 -5.696 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.759 5.175 -1.647 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.053 6.210 -5.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.873 3.896 -1.805 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.493 4.388 -3.612 1.00 0.00 H new ATOM 920 N ASN A 59 -5.055 8.635 -4.659 1.00 0.00 N ATOM 921 CA ASN A 59 -5.162 9.665 -5.671 1.00 0.00 C ATOM 922 C ASN A 59 -4.102 9.502 -6.747 1.00 0.00 C ATOM 923 O ASN A 59 -3.037 10.113 -6.659 1.00 0.00 O ATOM 924 CB ASN A 59 -5.087 11.027 -4.968 1.00 0.00 C ATOM 925 CG ASN A 59 -5.262 12.212 -5.903 1.00 0.00 C ATOM 926 OD1 ASN A 59 -4.680 13.265 -5.668 1.00 0.00 O ATOM 927 ND2 ASN A 59 -6.122 12.128 -6.902 1.00 0.00 N ATOM 0 H ASN A 59 -4.545 8.941 -3.830 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.116 9.585 -6.193 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.855 11.069 -4.196 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.124 11.113 -4.465 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -6.307 12.944 -7.486 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -6.601 11.247 -7.090 1.00 0.00 H new ATOM 934 N MET A 60 -4.392 8.700 -7.769 1.00 0.00 N ATOM 935 CA MET A 60 -3.458 8.413 -8.851 1.00 0.00 C ATOM 936 C MET A 60 -4.093 8.683 -10.216 1.00 0.00 C ATOM 937 O MET A 60 -5.311 8.528 -10.355 1.00 0.00 O ATOM 938 CB MET A 60 -2.983 6.958 -8.742 1.00 0.00 C ATOM 939 CG MET A 60 -1.947 6.798 -7.635 1.00 0.00 C ATOM 940 SD MET A 60 -0.430 7.730 -7.953 1.00 0.00 S ATOM 941 CE MET A 60 0.458 7.294 -6.450 1.00 0.00 C ATOM 0 H MET A 60 -5.291 8.228 -7.869 1.00 0.00 H new ATOM 0 HA MET A 60 -2.598 9.076 -8.760 1.00 0.00 H new ATOM 0 HB2 MET A 60 -3.835 6.308 -8.543 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.555 6.640 -9.693 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.379 7.127 -6.690 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.702 5.742 -7.523 1.00 0.00 H new ATOM 0 HE1 MET A 60 1.515 7.529 -6.571 1.00 0.00 H new ATOM 0 HE2 MET A 60 0.054 7.861 -5.611 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.343 6.228 -6.256 1.00 0.00 H new ATOM 951 N PRO A 61 -3.295 9.074 -11.228 1.00 0.00 N ATOM 952 CA PRO A 61 -3.784 9.248 -12.585 1.00 0.00 C ATOM 953 C PRO A 61 -4.121 7.883 -13.195 1.00 0.00 C ATOM 954 O PRO A 61 -3.424 6.893 -12.944 1.00 0.00 O ATOM 955 CB PRO A 61 -2.651 9.956 -13.334 1.00 0.00 C ATOM 956 CG PRO A 61 -1.387 9.522 -12.592 1.00 0.00 C ATOM 957 CD PRO A 61 -1.869 9.369 -11.153 1.00 0.00 C ATOM 0 HA PRO A 61 -4.701 9.835 -12.635 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -2.620 9.660 -14.382 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -2.774 11.039 -13.312 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -0.989 8.587 -12.986 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -0.595 10.266 -12.675 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.332 8.567 -10.646 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -1.690 10.281 -10.584 1.00 0.00 H new ATOM 965 N ASN A 62 -5.140 7.851 -14.061 1.00 0.00 N ATOM 966 CA ASN A 62 -5.765 6.664 -14.647 1.00 0.00 C ATOM 967 C ASN A 62 -6.238 5.694 -13.564 1.00 0.00 C ATOM 968 O ASN A 62 -7.410 5.688 -13.190 1.00 0.00 O ATOM 969 CB ASN A 62 -4.858 5.953 -15.675 1.00 0.00 C ATOM 970 CG ASN A 62 -4.603 6.763 -16.931 1.00 0.00 C ATOM 971 OD1 ASN A 62 -5.424 6.757 -17.844 1.00 0.00 O ATOM 972 ND2 ASN A 62 -3.473 7.439 -17.012 1.00 0.00 N ATOM 0 H ASN A 62 -5.577 8.711 -14.392 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.638 7.016 -15.196 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.903 5.721 -15.204 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.315 5.003 -15.953 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.260 7.978 -17.851 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.812 7.423 -16.235 1.00 0.00 H new ATOM 979 N MET A 63 -5.339 4.841 -13.079 1.00 0.00 N ATOM 980 CA MET A 63 -5.622 3.795 -12.119 1.00 0.00 C ATOM 981 C MET A 63 -5.470 4.393 -10.726 1.00 0.00 C ATOM 982 O MET A 63 -4.355 4.495 -10.214 1.00 0.00 O ATOM 983 CB MET A 63 -4.696 2.605 -12.396 1.00 0.00 C ATOM 984 CG MET A 63 -4.980 1.412 -11.482 1.00 0.00 C ATOM 985 SD MET A 63 -4.265 -0.156 -12.054 1.00 0.00 S ATOM 986 CE MET A 63 -5.416 -0.531 -13.400 1.00 0.00 C ATOM 0 H MET A 63 -4.359 4.866 -13.359 1.00 0.00 H new ATOM 0 HA MET A 63 -6.639 3.412 -12.199 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.809 2.296 -13.435 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.660 2.918 -12.267 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.594 1.632 -10.487 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.059 1.292 -11.386 1.00 0.00 H new ATOM 0 HE1 MET A 63 -5.366 -1.594 -13.636 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.430 -0.274 -13.094 1.00 0.00 H new ATOM 0 HE3 MET A 63 -5.146 0.049 -14.282 1.00 0.00 H new ATOM 996 N ASP A 64 -6.598 4.790 -10.126 1.00 0.00 N ATOM 997 CA ASP A 64 -6.663 5.148 -8.710 1.00 0.00 C ATOM 998 C ASP A 64 -6.156 3.962 -7.888 1.00 0.00 C ATOM 999 O ASP A 64 -6.228 2.817 -8.345 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.105 5.430 -8.253 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.835 6.534 -9.011 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -8.656 7.730 -8.690 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.699 6.206 -9.856 1.00 0.00 O ATOM 0 H ASP A 64 -7.491 4.871 -10.612 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.061 6.045 -8.566 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.682 4.510 -8.344 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.087 5.692 -7.195 1.00 0.00 H new ATOM 1008 N GLY A 65 -5.786 4.188 -6.628 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.506 3.112 -5.682 1.00 0.00 C ATOM 1010 C GLY A 65 -6.674 2.131 -5.574 1.00 0.00 C ATOM 1011 O GLY A 65 -6.453 0.930 -5.426 1.00 0.00 O ATOM 0 H GLY A 65 -5.672 5.123 -6.236 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.610 2.577 -5.996 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.296 3.537 -4.700 1.00 0.00 H new ATOM 1015 N LEU A 66 -7.915 2.622 -5.705 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.111 1.787 -5.713 1.00 0.00 C ATOM 1017 C LEU A 66 -9.074 0.837 -6.905 1.00 0.00 C ATOM 1018 O LEU A 66 -9.405 -0.337 -6.777 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.374 2.677 -5.754 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.705 2.043 -5.322 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.206 0.885 -6.166 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.650 1.520 -3.897 1.00 0.00 C ATOM 0 H LEU A 66 -8.111 3.618 -5.809 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.142 1.191 -4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.194 3.545 -5.120 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.492 3.045 -6.773 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.394 2.879 -5.443 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.152 0.523 -5.762 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.354 1.220 -7.192 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.472 0.079 -6.150 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.612 1.080 -3.633 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.871 0.762 -3.817 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.428 2.342 -3.216 1.00 0.00 H new ATOM 1034 N GLU A 67 -8.665 1.325 -8.070 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.695 0.553 -9.299 1.00 0.00 C ATOM 1036 C GLU A 67 -7.487 -0.379 -9.398 1.00 0.00 C ATOM 1037 O GLU A 67 -7.623 -1.482 -9.931 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.808 1.502 -10.496 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.085 2.364 -10.451 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.387 1.556 -10.401 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.418 0.377 -10.819 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.435 2.097 -9.971 1.00 0.00 O ATOM 0 H GLU A 67 -8.302 2.271 -8.186 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.573 -0.093 -9.299 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.935 2.154 -10.522 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.799 0.921 -11.418 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.040 3.014 -9.577 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.105 3.010 -11.329 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.341 -0.002 -8.819 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.199 -0.890 -8.603 1.00 0.00 C ATOM 1051 C LEU A 68 -5.655 -2.068 -7.748 1.00 0.00 C ATOM 1052 O LEU A 68 -5.493 -3.225 -8.143 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.051 -0.111 -7.933 1.00 0.00 C ATOM 1054 CG LEU A 68 -2.815 -0.967 -7.587 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.113 -1.506 -8.839 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -1.828 -0.117 -6.780 1.00 0.00 C ATOM 0 H LEU A 68 -6.181 0.947 -8.482 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.824 -1.271 -9.553 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.743 0.699 -8.595 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.426 0.350 -7.019 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.155 -1.824 -7.006 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.249 -2.102 -8.544 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.806 -2.127 -9.406 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.783 -0.672 -9.459 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.951 -0.715 -6.531 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.523 0.746 -7.372 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.307 0.224 -5.862 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.287 -1.760 -6.609 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.926 -2.719 -5.725 1.00 0.00 C ATOM 1070 C LEU A 69 -7.861 -3.601 -6.528 1.00 0.00 C ATOM 1071 O LEU A 69 -7.649 -4.801 -6.553 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.613 -1.988 -4.556 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.825 -2.646 -3.865 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.698 -4.090 -3.363 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.154 -1.783 -2.645 1.00 0.00 C ATOM 0 H LEU A 69 -6.365 -0.800 -6.273 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.184 -3.377 -5.273 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.857 -1.809 -3.792 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.934 -1.013 -4.922 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.581 -2.703 -4.648 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.637 -4.399 -2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.470 -4.748 -4.202 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.897 -4.150 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.009 -2.208 -2.119 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.294 -1.755 -1.976 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.394 -0.771 -2.970 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.871 -3.049 -7.196 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.895 -3.842 -7.879 1.00 0.00 C ATOM 1089 C LYS A 70 -9.307 -4.747 -8.950 1.00 0.00 C ATOM 1090 O LYS A 70 -9.757 -5.889 -9.069 1.00 0.00 O ATOM 1091 CB LYS A 70 -10.918 -2.915 -8.524 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.833 -2.247 -7.492 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.211 -2.911 -7.484 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.229 -2.079 -6.708 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.593 -2.633 -6.785 1.00 0.00 N ATOM 0 H LYS A 70 -9.004 -2.041 -7.280 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.367 -4.473 -7.126 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.398 -2.147 -9.096 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.524 -3.482 -9.230 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.384 -2.317 -6.501 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.936 -1.186 -7.722 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.556 -3.047 -8.509 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.135 -3.903 -7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.923 -2.020 -5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.232 -1.061 -7.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.244 -2.030 -6.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.899 -2.665 -7.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.600 -3.595 -6.389 1.00 0.00 H new ATOM 1109 N THR A 71 -8.331 -4.253 -9.709 1.00 0.00 N ATOM 1110 CA THR A 71 -7.644 -5.018 -10.734 1.00 0.00 C ATOM 1111 C THR A 71 -6.977 -6.235 -10.096 1.00 0.00 C ATOM 1112 O THR A 71 -7.171 -7.358 -10.568 1.00 0.00 O ATOM 1113 CB THR A 71 -6.659 -4.083 -11.455 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.392 -3.047 -12.079 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.848 -4.778 -12.546 1.00 0.00 C ATOM 0 H THR A 71 -7.994 -3.294 -9.624 1.00 0.00 H new ATOM 0 HA THR A 71 -8.335 -5.405 -11.483 1.00 0.00 H new ATOM 0 HB THR A 71 -5.966 -3.718 -10.697 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.586 -2.344 -11.425 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.174 -4.059 -13.012 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.266 -5.588 -12.107 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.524 -5.183 -13.299 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.236 -6.033 -9.005 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.542 -7.107 -8.313 1.00 0.00 C ATOM 1125 C ILE A 72 -6.595 -8.016 -7.641 1.00 0.00 C ATOM 1126 O ILE A 72 -6.481 -9.236 -7.687 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.524 -6.449 -7.347 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.289 -5.991 -8.167 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.062 -7.432 -6.262 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.298 -5.119 -7.387 1.00 0.00 C ATOM 0 H ILE A 72 -6.103 -5.115 -8.580 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.972 -7.760 -8.974 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.008 -5.603 -6.858 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.766 -6.873 -8.536 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.633 -5.436 -9.040 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.349 -6.937 -5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.923 -7.764 -5.682 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.586 -8.293 -6.730 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.466 -4.844 -8.036 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.802 -4.216 -7.041 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.921 -5.675 -6.529 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.665 -7.456 -7.068 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.754 -8.159 -6.382 1.00 0.00 C ATOM 1144 C ARG A 73 -9.541 -9.062 -7.324 1.00 0.00 C ATOM 1145 O ARG A 73 -10.149 -10.029 -6.874 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.697 -7.133 -5.730 1.00 0.00 C ATOM 1147 CG ARG A 73 -10.609 -7.737 -4.653 1.00 0.00 C ATOM 1148 CD ARG A 73 -9.864 -8.129 -3.366 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.706 -8.983 -2.511 1.00 0.00 N ATOM 1150 CZ ARG A 73 -10.291 -9.964 -1.698 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -9.003 -10.179 -1.474 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -11.181 -10.743 -1.102 1.00 0.00 N ATOM 0 H ARG A 73 -7.802 -6.445 -7.070 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.308 -8.797 -5.619 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.102 -6.336 -5.285 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.315 -6.676 -6.503 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -11.391 -7.019 -4.406 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -11.103 -8.619 -5.060 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -8.944 -8.656 -3.620 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.577 -7.231 -2.819 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.711 -8.809 -2.541 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -8.302 -9.591 -1.925 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -8.713 -10.932 -0.851 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.177 -10.595 -1.263 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.870 -11.491 -0.482 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.553 -8.747 -8.616 1.00 0.00 N ATOM 1167 CA ALA A 74 -10.180 -9.584 -9.614 1.00 0.00 C ATOM 1168 C ALA A 74 -9.358 -10.845 -9.887 1.00 0.00 C ATOM 1169 O ALA A 74 -9.911 -11.805 -10.427 1.00 0.00 O ATOM 1170 CB ALA A 74 -10.335 -8.780 -10.901 1.00 0.00 C ATOM 0 H ALA A 74 -9.125 -7.901 -8.993 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.155 -9.900 -9.242 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.807 -9.400 -11.663 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.955 -7.904 -10.710 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -9.353 -8.460 -11.251 1.00 0.00 H new ATOM 1205 N MET A 78 -3.627 -13.093 -6.868 1.00 0.00 N ATOM 1206 CA MET A 78 -3.100 -11.822 -6.376 1.00 0.00 C ATOM 1207 C MET A 78 -4.122 -11.035 -5.576 1.00 0.00 C ATOM 1208 O MET A 78 -3.734 -10.138 -4.837 1.00 0.00 O ATOM 1209 CB MET A 78 -2.533 -10.950 -7.504 1.00 0.00 C ATOM 1210 CG MET A 78 -1.365 -11.645 -8.201 1.00 0.00 C ATOM 1211 SD MET A 78 -0.100 -10.533 -8.874 1.00 0.00 S ATOM 1212 CE MET A 78 -1.032 -9.769 -10.225 1.00 0.00 C ATOM 0 HA MET A 78 -2.283 -12.089 -5.706 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.317 -10.733 -8.230 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.202 -9.994 -7.098 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.890 -12.323 -7.492 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.758 -12.257 -9.013 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.396 -9.053 -10.746 1.00 0.00 H new ATOM 0 HE2 MET A 78 -1.359 -10.540 -10.923 1.00 0.00 H new ATOM 0 HE3 MET A 78 -1.903 -9.253 -9.820 1.00 0.00 H new ATOM 1222 N SER A 79 -5.395 -11.412 -5.643 1.00 0.00 N ATOM 1223 CA SER A 79 -6.471 -10.836 -4.856 1.00 0.00 C ATOM 1224 C SER A 79 -6.145 -10.796 -3.365 1.00 0.00 C ATOM 1225 O SER A 79 -6.565 -9.864 -2.680 1.00 0.00 O ATOM 1226 CB SER A 79 -7.760 -11.619 -5.134 1.00 0.00 C ATOM 1227 OG SER A 79 -7.517 -13.010 -5.293 1.00 0.00 O ATOM 0 H SER A 79 -5.713 -12.152 -6.269 1.00 0.00 H new ATOM 0 HA SER A 79 -6.605 -9.796 -5.155 1.00 0.00 H new ATOM 0 HB2 SER A 79 -8.461 -11.465 -4.314 1.00 0.00 H new ATOM 0 HB3 SER A 79 -8.233 -11.229 -6.035 1.00 0.00 H new ATOM 0 HG SER A 79 -8.364 -13.472 -5.467 1.00 0.00 H new ATOM 1233 N ALA A 80 -5.367 -11.769 -2.885 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.918 -11.873 -1.508 1.00 0.00 C ATOM 1235 C ALA A 80 -4.036 -10.710 -1.051 1.00 0.00 C ATOM 1236 O ALA A 80 -3.895 -10.515 0.159 1.00 0.00 O ATOM 1237 CB ALA A 80 -4.118 -13.165 -1.373 1.00 0.00 C ATOM 0 H ALA A 80 -5.024 -12.530 -3.471 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.807 -11.856 -0.878 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.767 -13.270 -0.346 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.752 -14.014 -1.628 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.262 -13.135 -2.048 1.00 0.00 H new ATOM 1243 N LEU A 81 -3.405 -9.987 -1.981 1.00 0.00 N ATOM 1244 CA LEU A 81 -2.401 -8.980 -1.675 1.00 0.00 C ATOM 1245 C LEU A 81 -2.974 -7.932 -0.728 1.00 0.00 C ATOM 1246 O LEU A 81 -4.090 -7.460 -0.960 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.930 -8.264 -2.949 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.806 -8.985 -3.708 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.633 -8.297 -5.065 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.508 -8.955 -2.906 1.00 0.00 C ATOM 0 H LEU A 81 -3.584 -10.091 -2.980 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.558 -9.492 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.782 -8.142 -3.618 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.588 -7.264 -2.683 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.068 -10.033 -3.852 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.161 -8.791 -5.625 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.565 -8.359 -5.626 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.371 -7.250 -4.911 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.288 -9.472 -3.465 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.808 -7.921 -2.737 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.360 -9.451 -1.947 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.210 -7.493 0.284 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.522 -6.297 1.034 1.00 0.00 C ATOM 1264 C PRO A 82 -2.226 -5.071 0.162 1.00 0.00 C ATOM 1265 O PRO A 82 -1.140 -4.483 0.215 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.701 -6.398 2.317 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.474 -7.208 1.906 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.951 -8.064 0.733 1.00 0.00 C ATOM 0 HA PRO A 82 -3.572 -6.193 1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.422 -5.413 2.691 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.260 -6.894 3.111 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.350 -6.558 1.613 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.114 -7.827 2.728 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.216 -8.062 -0.072 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.084 -9.101 1.040 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.200 -4.715 -0.674 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.324 -3.394 -1.265 1.00 0.00 C ATOM 1278 C VAL A 83 -3.879 -2.496 -0.159 1.00 0.00 C ATOM 1279 O VAL A 83 -4.847 -2.857 0.522 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.195 -3.411 -2.536 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.396 -3.923 -3.742 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.461 -4.260 -2.394 1.00 0.00 C ATOM 0 H VAL A 83 -3.939 -5.356 -0.963 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.363 -3.014 -1.613 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.500 -2.376 -2.691 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.033 -3.925 -4.626 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.539 -3.272 -3.914 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.047 -4.936 -3.544 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.027 -4.228 -3.325 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.185 -5.291 -2.173 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.074 -3.867 -1.583 1.00 0.00 H new ATOM 1292 N LEU A 84 -3.203 -1.383 0.108 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.318 -0.665 1.370 1.00 0.00 C ATOM 1294 C LEU A 84 -3.264 0.822 1.077 1.00 0.00 C ATOM 1295 O LEU A 84 -2.224 1.312 0.640 1.00 0.00 O ATOM 1296 CB LEU A 84 -2.175 -1.145 2.276 1.00 0.00 C ATOM 1297 CG LEU A 84 -2.037 -0.462 3.649 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.366 -0.177 4.358 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -1.186 -1.388 4.530 1.00 0.00 C ATOM 0 H LEU A 84 -2.555 -0.952 -0.551 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.259 -0.857 1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.300 -2.215 2.441 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.237 -1.013 1.736 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.581 0.514 3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.171 0.304 5.316 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.975 0.481 3.738 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.898 -1.114 4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.063 -0.940 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.683 -2.353 4.629 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.207 -1.529 4.071 1.00 0.00 H new ATOM 1311 N MET A 85 -4.397 1.501 1.261 1.00 0.00 N ATOM 1312 CA MET A 85 -4.564 2.894 0.865 1.00 0.00 C ATOM 1313 C MET A 85 -3.906 3.781 1.926 1.00 0.00 C ATOM 1314 O MET A 85 -4.214 3.635 3.112 1.00 0.00 O ATOM 1315 CB MET A 85 -6.061 3.219 0.704 1.00 0.00 C ATOM 1316 CG MET A 85 -6.857 2.253 -0.194 1.00 0.00 C ATOM 1317 SD MET A 85 -6.534 2.348 -1.978 1.00 0.00 S ATOM 1318 CE MET A 85 -5.124 1.219 -2.170 1.00 0.00 C ATOM 0 H MET A 85 -5.228 1.095 1.692 1.00 0.00 H new ATOM 0 HA MET A 85 -4.086 3.079 -0.097 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.521 3.231 1.692 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.155 4.226 0.297 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.652 1.234 0.135 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.919 2.433 -0.030 1.00 0.00 H new ATOM 0 HE1 MET A 85 -5.131 0.795 -3.174 1.00 0.00 H new ATOM 0 HE2 MET A 85 -4.195 1.767 -2.014 1.00 0.00 H new ATOM 0 HE3 MET A 85 -5.198 0.416 -1.437 1.00 0.00 H new ATOM 1328 N VAL A 86 -3.002 4.676 1.531 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.248 5.582 2.395 1.00 0.00 C ATOM 1330 C VAL A 86 -2.265 6.951 1.715 1.00 0.00 C ATOM 1331 O VAL A 86 -1.579 7.144 0.720 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.823 5.022 2.637 1.00 0.00 C ATOM 1333 CG1 VAL A 86 -0.022 5.924 3.588 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.831 3.603 3.247 1.00 0.00 C ATOM 0 H VAL A 86 -2.763 4.795 0.546 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.690 5.679 3.387 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.360 4.988 1.651 1.00 0.00 H new ATOM 0 HG11 VAL A 86 0.972 5.503 3.737 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.067 6.921 3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.536 5.989 4.547 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.195 3.264 3.394 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.347 3.622 4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.346 2.920 2.572 1.00 0.00 H new ATOM 1344 N THR A 87 -3.116 7.871 2.173 1.00 0.00 N ATOM 1345 CA THR A 87 -3.536 9.017 1.375 1.00 0.00 C ATOM 1346 C THR A 87 -3.840 10.233 2.259 1.00 0.00 C ATOM 1347 O THR A 87 -4.027 10.114 3.471 1.00 0.00 O ATOM 1348 CB THR A 87 -4.757 8.561 0.550 1.00 0.00 C ATOM 1349 OG1 THR A 87 -5.148 9.552 -0.369 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.976 8.181 1.407 1.00 0.00 C ATOM 0 H THR A 87 -3.530 7.840 3.105 1.00 0.00 H new ATOM 0 HA THR A 87 -2.740 9.345 0.707 1.00 0.00 H new ATOM 0 HB THR A 87 -4.425 7.664 0.027 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.436 9.685 -1.029 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.795 7.871 0.758 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.711 7.360 2.073 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.288 9.042 1.998 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.925 11.416 1.654 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.572 12.590 2.222 1.00 0.00 C ATOM 1360 C ALA A 88 -6.099 12.487 2.147 1.00 0.00 C ATOM 1361 O ALA A 88 -6.794 13.218 2.852 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.138 13.818 1.415 1.00 0.00 C ATOM 0 H ALA A 88 -3.533 11.586 0.728 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.280 12.668 3.269 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.613 14.709 1.825 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.055 13.926 1.470 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.437 13.694 0.374 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.636 11.649 1.259 1.00 0.00 N ATOM 1369 CA GLU A 89 -8.032 11.654 0.845 1.00 0.00 C ATOM 1370 C GLU A 89 -8.927 11.026 1.920 1.00 0.00 C ATOM 1371 O GLU A 89 -9.235 9.836 1.868 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.164 10.923 -0.507 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.373 11.588 -1.650 1.00 0.00 C ATOM 1374 CD GLU A 89 -7.931 12.944 -2.076 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.163 13.146 -2.001 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.153 13.820 -2.518 1.00 0.00 O ATOM 0 H GLU A 89 -6.088 10.925 0.795 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.368 12.683 0.719 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.821 9.895 -0.389 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.217 10.878 -0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.336 11.714 -1.337 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.367 10.921 -2.512 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.397 11.823 2.881 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.378 11.407 3.886 1.00 0.00 C ATOM 1385 C ALA A 90 -11.801 11.273 3.326 1.00 0.00 C ATOM 1386 O ALA A 90 -12.745 11.093 4.099 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.404 12.415 5.036 1.00 0.00 C ATOM 0 H ALA A 90 -9.101 12.794 2.985 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.062 10.422 4.230 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.136 12.100 5.780 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.417 12.467 5.497 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.677 13.398 4.652 1.00 0.00 H new ATOM 1393 N LYS A 91 -11.976 11.433 2.009 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.251 11.417 1.303 1.00 0.00 C ATOM 1395 C LYS A 91 -14.036 10.193 1.760 1.00 0.00 C ATOM 1396 O LYS A 91 -13.621 9.058 1.507 1.00 0.00 O ATOM 1397 CB LYS A 91 -12.958 11.380 -0.201 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.172 11.593 -1.120 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.366 13.071 -1.479 1.00 0.00 C ATOM 1400 CE LYS A 91 -15.194 13.203 -2.765 1.00 0.00 C ATOM 1401 NZ LYS A 91 -14.943 14.492 -3.439 1.00 0.00 N ATOM 0 H LYS A 91 -11.188 11.585 1.380 1.00 0.00 H new ATOM 0 HA LYS A 91 -13.849 12.303 1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.215 12.145 -0.427 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.507 10.417 -0.442 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.042 11.012 -2.033 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.070 11.218 -0.628 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.867 13.588 -0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -13.396 13.550 -1.612 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -14.951 12.384 -3.442 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.254 13.116 -2.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.518 14.549 -4.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.199 15.273 -2.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.936 14.564 -3.687 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.147 10.410 2.465 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.849 9.310 3.111 1.00 0.00 C ATOM 1417 C LYS A 92 -16.224 8.253 2.079 1.00 0.00 C ATOM 1418 O LYS A 92 -15.988 7.074 2.304 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.055 9.844 3.892 1.00 0.00 C ATOM 1420 CG LYS A 92 -17.448 8.867 5.002 1.00 0.00 C ATOM 1421 CD LYS A 92 -18.540 9.475 5.884 1.00 0.00 C ATOM 1422 CE LYS A 92 -18.869 8.476 6.991 1.00 0.00 C ATOM 1423 NZ LYS A 92 -19.882 9.004 7.921 1.00 0.00 N ATOM 0 H LYS A 92 -15.573 11.327 2.600 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.196 8.824 3.836 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -16.816 10.816 4.323 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.897 9.994 3.216 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -17.802 7.933 4.565 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -16.575 8.624 5.608 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -18.202 10.419 6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -19.429 9.694 5.292 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.231 7.548 6.548 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -17.961 8.233 7.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -20.079 8.297 8.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -19.527 9.876 8.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -20.757 9.213 7.399 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.717 8.665 0.916 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.047 7.785 -0.194 1.00 0.00 C ATOM 1439 C GLU A 93 -15.855 6.933 -0.633 1.00 0.00 C ATOM 1440 O GLU A 93 -16.042 5.769 -0.976 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.513 8.629 -1.391 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.979 9.052 -1.311 1.00 0.00 C ATOM 1443 CD GLU A 93 -19.350 10.040 -0.197 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -18.469 10.727 0.368 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -20.567 10.161 0.084 1.00 0.00 O ATOM 0 H GLU A 93 -16.902 9.648 0.716 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.836 7.115 0.146 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -16.890 9.521 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.358 8.060 -2.308 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.258 9.496 -2.267 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.586 8.155 -1.187 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.642 7.487 -0.624 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.429 6.738 -0.951 1.00 0.00 C ATOM 1454 C ASN A 94 -13.173 5.684 0.126 1.00 0.00 C ATOM 1455 O ASN A 94 -12.815 4.554 -0.208 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.185 7.628 -1.081 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.192 8.606 -2.247 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -13.179 8.776 -2.959 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -11.107 9.340 -2.403 1.00 0.00 N ATOM 0 H ASN A 94 -14.473 8.465 -0.390 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.600 6.275 -1.923 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.068 8.194 -0.157 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.309 6.986 -1.175 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.079 10.062 -3.123 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.296 9.186 -1.803 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.382 6.012 1.410 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.312 5.000 2.471 1.00 0.00 C ATOM 1468 C ILE A 95 -14.330 3.881 2.171 1.00 0.00 C ATOM 1469 O ILE A 95 -13.952 2.706 2.232 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.485 5.606 3.891 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.188 6.275 4.402 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.870 4.506 4.906 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -11.952 7.700 3.883 1.00 0.00 C ATOM 0 H ILE A 95 -13.597 6.955 1.734 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.311 4.568 2.475 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.271 6.356 3.809 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.213 6.300 5.491 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.339 5.654 4.117 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -13.987 4.949 5.895 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.809 4.043 4.602 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.086 3.749 4.937 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.020 8.087 4.294 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.890 7.685 2.795 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.778 8.341 4.191 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.596 4.226 1.871 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.634 3.251 1.515 1.00 0.00 C ATOM 1487 C ILE A 96 -16.075 2.381 0.396 1.00 0.00 C ATOM 1488 O ILE A 96 -15.988 1.170 0.569 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.998 3.905 1.134 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.858 4.274 2.363 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.881 2.979 0.266 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.432 5.558 3.066 1.00 0.00 C ATOM 0 H ILE A 96 -15.925 5.192 1.870 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.871 2.643 2.388 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.707 4.800 0.584 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.897 4.374 2.048 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.820 3.452 3.078 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.817 3.485 0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.356 2.738 -0.659 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.093 2.060 0.813 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.088 5.742 3.917 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.404 5.458 3.416 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.498 6.394 2.369 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.688 2.983 -0.727 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.207 2.293 -1.906 1.00 0.00 C ATOM 1506 C ALA A 97 -14.083 1.323 -1.552 1.00 0.00 C ATOM 1507 O ALA A 97 -14.139 0.168 -1.958 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.740 3.329 -2.921 1.00 0.00 C ATOM 0 H ALA A 97 -15.704 3.997 -0.837 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.014 1.701 -2.337 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.375 2.824 -3.815 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.573 3.979 -3.187 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -13.937 3.926 -2.488 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.065 1.752 -0.803 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.960 0.872 -0.445 1.00 0.00 C ATOM 1516 C ALA A 98 -12.459 -0.333 0.348 1.00 0.00 C ATOM 1517 O ALA A 98 -12.016 -1.456 0.098 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.925 1.639 0.370 1.00 0.00 C ATOM 0 H ALA A 98 -12.986 2.700 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.498 0.511 -1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.103 0.973 0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.543 2.472 -0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.388 2.020 1.280 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.369 -0.120 1.302 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.955 -1.205 2.073 1.00 0.00 C ATOM 1526 C ALA A 99 -14.806 -2.126 1.179 1.00 0.00 C ATOM 1527 O ALA A 99 -14.749 -3.346 1.336 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.760 -0.607 3.235 1.00 0.00 C ATOM 0 H ALA A 99 -13.715 0.805 1.556 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.167 -1.834 2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.205 -1.411 3.821 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.099 -0.018 3.870 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.549 0.033 2.840 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.553 -1.561 0.225 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.340 -2.286 -0.766 1.00 0.00 C ATOM 1536 C GLN A 100 -15.427 -3.168 -1.617 1.00 0.00 C ATOM 1537 O GLN A 100 -15.633 -4.381 -1.672 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.148 -1.321 -1.657 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.312 -0.603 -0.961 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.357 -1.575 -0.448 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -19.423 -1.862 0.747 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -20.182 -2.118 -1.320 1.00 0.00 N ATOM 0 H GLN A 100 -15.626 -0.549 0.122 1.00 0.00 H new ATOM 0 HA GLN A 100 -17.052 -2.920 -0.237 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.468 -0.570 -2.060 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.543 -1.881 -2.505 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.928 -0.012 -0.129 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.777 0.094 -1.659 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -20.116 -1.871 -2.307 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.887 -2.786 -1.008 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.405 -2.590 -2.256 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.423 -3.315 -3.040 1.00 0.00 C ATOM 1553 C ALA A 101 -12.680 -4.356 -2.189 1.00 0.00 C ATOM 1554 O ALA A 101 -12.284 -5.395 -2.714 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.448 -2.310 -3.661 1.00 0.00 C ATOM 0 H ALA A 101 -14.242 -1.583 -2.237 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.932 -3.864 -3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.704 -2.843 -4.253 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.996 -1.620 -4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.949 -1.751 -2.870 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.534 -4.119 -0.883 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.967 -5.069 0.065 1.00 0.00 C ATOM 1563 C GLY A 102 -10.485 -4.822 0.299 1.00 0.00 C ATOM 1564 O GLY A 102 -9.723 -5.782 0.410 1.00 0.00 O ATOM 0 H GLY A 102 -12.815 -3.239 -0.450 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.501 -4.998 1.013 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -12.111 -6.083 -0.307 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.066 -3.553 0.363 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.678 -3.189 0.626 1.00 0.00 C ATOM 1570 C ALA A 103 -8.270 -3.714 2.002 1.00 0.00 C ATOM 1571 O ALA A 103 -9.111 -3.816 2.904 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.496 -1.662 0.555 1.00 0.00 C ATOM 0 H ALA A 103 -10.684 -2.752 0.233 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.039 -3.639 -0.134 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.454 -1.410 0.754 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.771 -1.309 -0.439 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.133 -1.185 1.299 1.00 0.00 H new ATOM 1578 N SER A 104 -6.982 -3.975 2.207 1.00 0.00 N ATOM 1579 CA SER A 104 -6.484 -4.429 3.501 1.00 0.00 C ATOM 1580 C SER A 104 -6.534 -3.334 4.571 1.00 0.00 C ATOM 1581 O SER A 104 -6.414 -3.624 5.765 1.00 0.00 O ATOM 1582 CB SER A 104 -5.066 -4.971 3.351 1.00 0.00 C ATOM 1583 OG SER A 104 -4.163 -4.018 2.822 1.00 0.00 O ATOM 0 H SER A 104 -6.262 -3.879 1.491 1.00 0.00 H new ATOM 0 HA SER A 104 -7.144 -5.226 3.842 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.705 -5.304 4.324 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.084 -5.846 2.701 1.00 0.00 H new ATOM 0 HG SER A 104 -4.336 -3.900 1.865 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.712 -2.073 4.173 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.853 -0.968 5.091 1.00 0.00 C ATOM 1591 C GLY A 105 -6.847 0.365 4.368 1.00 0.00 C ATOM 1592 O GLY A 105 -6.538 0.444 3.171 1.00 0.00 O ATOM 0 H GLY A 105 -6.761 -1.799 3.192 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.783 -1.075 5.649 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.040 -0.992 5.817 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.152 1.404 5.140 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.210 2.783 4.704 1.00 0.00 C ATOM 1598 C TYR A 106 -6.542 3.625 5.776 1.00 0.00 C ATOM 1599 O TYR A 106 -6.796 3.429 6.967 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.668 3.214 4.502 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.834 4.360 3.525 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.561 5.692 3.893 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.289 4.078 2.228 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.756 6.729 2.961 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.523 5.110 1.307 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.254 6.445 1.670 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.485 7.441 0.775 1.00 0.00 O ATOM 0 H TYR A 106 -7.374 1.296 6.130 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.698 2.910 3.750 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.245 2.360 4.148 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -9.088 3.505 5.465 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.203 5.917 4.887 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.461 3.053 1.935 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.523 7.748 3.235 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.908 4.882 0.324 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.395 8.309 1.221 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.699 4.555 5.357 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.914 5.428 6.204 1.00 0.00 C ATOM 1619 C VAL A 107 -5.084 6.814 5.624 1.00 0.00 C ATOM 1620 O VAL A 107 -4.489 7.118 4.591 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.452 4.973 6.209 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.513 5.916 6.975 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -3.316 3.589 6.822 1.00 0.00 C ATOM 0 H VAL A 107 -5.538 4.727 4.365 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.238 5.410 7.245 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.156 4.972 5.160 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.495 5.528 6.934 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.542 6.906 6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.834 5.984 8.014 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.268 3.289 6.814 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.680 3.609 7.849 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.902 2.875 6.243 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.906 7.636 6.266 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.781 9.065 6.061 1.00 0.00 C ATOM 1635 C VAL A 108 -4.524 9.509 6.820 1.00 0.00 C ATOM 1636 O VAL A 108 -4.211 8.995 7.900 1.00 0.00 O ATOM 1637 CB VAL A 108 -7.032 9.831 6.525 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -7.046 11.227 5.886 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -8.343 9.134 6.122 1.00 0.00 C ATOM 0 H VAL A 108 -6.641 7.347 6.911 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.690 9.290 4.998 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.979 9.877 7.613 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.933 11.769 6.215 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.153 11.774 6.188 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.062 11.130 4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.191 9.720 6.476 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.390 9.047 5.036 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.378 8.140 6.567 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.806 10.474 6.257 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.799 11.268 6.943 1.00 0.00 C ATOM 1651 C LYS A 109 -3.451 12.036 8.107 1.00 0.00 C ATOM 1652 O LYS A 109 -4.633 12.372 8.017 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.193 12.190 5.871 1.00 0.00 C ATOM 1654 CG LYS A 109 -1.063 13.135 6.301 1.00 0.00 C ATOM 1655 CD LYS A 109 -0.648 14.002 5.108 1.00 0.00 C ATOM 1656 CE LYS A 109 0.235 15.189 5.505 1.00 0.00 C ATOM 1657 NZ LYS A 109 1.598 14.795 5.915 1.00 0.00 N ATOM 0 H LYS A 109 -3.914 10.732 5.276 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.011 10.665 7.393 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.817 11.563 5.063 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.998 12.796 5.456 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.395 13.766 7.126 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.210 12.560 6.662 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -0.113 13.384 4.387 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.543 14.374 4.608 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.302 15.880 4.664 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -0.241 15.729 6.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.143 15.643 6.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 1.543 14.159 6.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.069 14.305 5.128 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.699 12.397 9.163 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.368 11.901 9.493 1.00 0.00 C ATOM 1673 C PRO A 110 -1.421 10.457 9.995 1.00 0.00 C ATOM 1674 O PRO A 110 -2.491 9.907 10.266 1.00 0.00 O ATOM 1675 CB PRO A 110 -0.845 12.859 10.560 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.106 13.319 11.286 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.179 13.296 10.200 1.00 0.00 C ATOM 0 HA PRO A 110 -0.711 11.875 8.623 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.152 12.362 11.238 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.310 13.699 10.116 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.358 12.653 12.112 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.984 14.317 11.707 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.131 12.950 10.603 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.347 14.296 9.799 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.252 9.865 10.219 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.048 8.445 10.448 1.00 0.00 C ATOM 1687 C PHE A 111 1.449 8.261 10.693 1.00 0.00 C ATOM 1688 O PHE A 111 2.264 9.062 10.229 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.483 7.615 9.213 1.00 0.00 C ATOM 1690 CG PHE A 111 0.444 7.653 8.016 1.00 0.00 C ATOM 1691 CD1 PHE A 111 0.310 8.663 7.049 1.00 0.00 C ATOM 1692 CD2 PHE A 111 1.431 6.660 7.855 1.00 0.00 C ATOM 1693 CE1 PHE A 111 1.154 8.692 5.933 1.00 0.00 C ATOM 1694 CE2 PHE A 111 2.273 6.686 6.730 1.00 0.00 C ATOM 1695 CZ PHE A 111 2.135 7.704 5.771 1.00 0.00 C ATOM 0 H PHE A 111 0.621 10.392 10.246 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.643 8.102 11.294 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.599 6.576 9.523 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.466 7.964 8.895 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.449 9.422 7.167 1.00 0.00 H new ATOM 0 HD2 PHE A 111 1.540 5.881 8.595 1.00 0.00 H new ATOM 0 HE1 PHE A 111 1.049 9.475 5.197 1.00 0.00 H new ATOM 0 HE2 PHE A 111 3.027 5.923 6.602 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.785 7.725 4.909 1.00 0.00 H new ATOM 1705 N THR A 112 1.809 7.241 11.471 1.00 0.00 N ATOM 1706 CA THR A 112 3.173 6.987 11.919 1.00 0.00 C ATOM 1707 C THR A 112 3.424 5.477 11.990 1.00 0.00 C ATOM 1708 O THR A 112 2.587 4.681 11.550 1.00 0.00 O ATOM 1709 CB THR A 112 3.422 7.675 13.270 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.516 7.214 14.258 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.373 9.197 13.199 1.00 0.00 C ATOM 0 H THR A 112 1.141 6.552 11.815 1.00 0.00 H new ATOM 0 HA THR A 112 3.879 7.408 11.203 1.00 0.00 H new ATOM 0 HB THR A 112 4.439 7.400 13.549 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.699 7.668 15.107 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.557 9.614 14.189 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.136 9.554 12.507 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.390 9.513 12.850 1.00 0.00 H new ATOM 1719 N ALA A 113 4.566 5.054 12.543 1.00 0.00 N ATOM 1720 CA ALA A 113 4.878 3.649 12.747 1.00 0.00 C ATOM 1721 C ALA A 113 3.869 3.036 13.716 1.00 0.00 C ATOM 1722 O ALA A 113 3.480 1.891 13.511 1.00 0.00 O ATOM 1723 CB ALA A 113 6.320 3.458 13.230 1.00 0.00 C ATOM 0 H ALA A 113 5.300 5.687 12.861 1.00 0.00 H new ATOM 0 HA ALA A 113 4.801 3.129 11.792 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.518 2.396 13.372 1.00 0.00 H new ATOM 0 HB2 ALA A 113 7.009 3.860 12.487 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.460 3.983 14.175 1.00 0.00 H new ATOM 1729 N ALA A 114 3.341 3.824 14.664 1.00 0.00 N ATOM 1730 CA ALA A 114 2.288 3.382 15.574 1.00 0.00 C ATOM 1731 C ALA A 114 1.011 2.925 14.859 1.00 0.00 C ATOM 1732 O ALA A 114 0.225 2.201 15.470 1.00 0.00 O ATOM 1733 CB ALA A 114 1.937 4.498 16.558 1.00 0.00 C ATOM 0 H ALA A 114 3.637 4.788 14.817 1.00 0.00 H new ATOM 0 HA ALA A 114 2.690 2.516 16.100 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.151 4.156 17.231 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.821 4.763 17.138 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.589 5.372 16.008 1.00 0.00 H new ATOM 1739 N THR A 115 0.786 3.315 13.596 1.00 0.00 N ATOM 1740 CA THR A 115 -0.315 2.783 12.801 1.00 0.00 C ATOM 1741 C THR A 115 0.205 1.889 11.673 1.00 0.00 C ATOM 1742 O THR A 115 -0.500 0.968 11.279 1.00 0.00 O ATOM 1743 CB THR A 115 -1.257 3.913 12.339 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.582 3.457 12.232 1.00 0.00 O ATOM 1745 CG2 THR A 115 -0.911 4.502 10.978 1.00 0.00 C ATOM 0 H THR A 115 1.360 4.002 13.106 1.00 0.00 H new ATOM 0 HA THR A 115 -0.928 2.132 13.424 1.00 0.00 H new ATOM 0 HB THR A 115 -1.137 4.679 13.105 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.159 4.193 11.939 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.623 5.289 10.731 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.096 4.919 11.007 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.958 3.720 10.220 1.00 0.00 H new ATOM 1753 N LEU A 116 1.432 2.090 11.161 1.00 0.00 N ATOM 1754 CA LEU A 116 2.085 1.174 10.220 1.00 0.00 C ATOM 1755 C LEU A 116 2.049 -0.234 10.829 1.00 0.00 C ATOM 1756 O LEU A 116 1.540 -1.161 10.199 1.00 0.00 O ATOM 1757 CB LEU A 116 3.494 1.686 9.857 1.00 0.00 C ATOM 1758 CG LEU A 116 4.145 1.174 8.555 1.00 0.00 C ATOM 1759 CD1 LEU A 116 4.140 -0.344 8.444 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.511 1.740 7.276 1.00 0.00 C ATOM 0 H LEU A 116 2.001 2.904 11.394 1.00 0.00 H new ATOM 0 HA LEU A 116 1.557 1.128 9.267 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.448 2.774 9.801 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.161 1.437 10.682 1.00 0.00 H new ATOM 0 HG LEU A 116 5.170 1.537 8.631 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.611 -0.642 7.507 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.693 -0.772 9.280 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.112 -0.707 8.465 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.024 1.333 6.405 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.457 1.463 7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.601 2.826 7.275 1.00 0.00 H new ATOM 1772 N GLU A 117 2.484 -0.361 12.083 1.00 0.00 N ATOM 1773 CA GLU A 117 2.469 -1.603 12.842 1.00 0.00 C ATOM 1774 C GLU A 117 1.049 -2.128 13.061 1.00 0.00 C ATOM 1775 O GLU A 117 0.855 -3.341 13.067 1.00 0.00 O ATOM 1776 CB GLU A 117 3.252 -1.421 14.151 1.00 0.00 C ATOM 1777 CG GLU A 117 2.521 -0.672 15.277 1.00 0.00 C ATOM 1778 CD GLU A 117 2.023 -1.651 16.340 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.827 -1.957 17.255 1.00 0.00 O ATOM 1780 OE2 GLU A 117 0.879 -2.147 16.256 1.00 0.00 O ATOM 0 H GLU A 117 2.867 0.423 12.611 1.00 0.00 H new ATOM 0 HA GLU A 117 2.971 -2.376 12.259 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.535 -2.406 14.522 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.176 -0.887 13.927 1.00 0.00 H new ATOM 0 HG2 GLU A 117 3.192 0.057 15.732 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.679 -0.116 14.864 1.00 0.00 H new ATOM 1787 N GLU A 118 0.050 -1.249 13.171 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.331 -1.641 13.402 1.00 0.00 C ATOM 1789 C GLU A 118 -1.969 -2.159 12.106 1.00 0.00 C ATOM 1790 O GLU A 118 -2.751 -3.107 12.137 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.116 -0.465 14.004 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.535 -0.890 14.389 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.225 0.125 15.299 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.475 1.270 14.857 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.607 -0.243 16.431 1.00 0.00 O ATOM 0 H GLU A 118 0.184 -0.240 13.101 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.358 -2.460 14.121 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.595 -0.088 14.884 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.160 0.353 13.285 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.128 -1.024 13.485 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.497 -1.857 14.892 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.629 -1.581 10.949 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.065 -2.081 9.643 1.00 0.00 C ATOM 1804 C LYS A 119 -1.455 -3.463 9.404 1.00 0.00 C ATOM 1805 O LYS A 119 -2.154 -4.358 8.923 1.00 0.00 O ATOM 1806 CB LYS A 119 -1.643 -1.131 8.510 1.00 0.00 C ATOM 1807 CG LYS A 119 -2.254 0.284 8.570 1.00 0.00 C ATOM 1808 CD LYS A 119 -1.223 1.368 8.235 1.00 0.00 C ATOM 1809 CE LYS A 119 -0.705 1.334 6.786 1.00 0.00 C ATOM 1810 NZ LYS A 119 0.120 2.517 6.432 1.00 0.00 N ATOM 0 H LYS A 119 -1.041 -0.749 10.893 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.153 -2.143 9.645 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -0.557 -1.040 8.521 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.915 -1.586 7.557 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.088 0.349 7.872 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.658 0.463 9.567 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -1.668 2.345 8.425 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -0.375 1.266 8.912 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -0.114 0.430 6.639 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -1.554 1.274 6.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.835 2.243 5.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -0.490 3.259 6.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.593 2.878 7.285 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.167 -3.616 9.729 1.00 0.00 N ATOM 1825 CA LEU A 120 0.560 -4.880 9.672 1.00 0.00 C ATOM 1826 C LEU A 120 -0.133 -5.899 10.576 1.00 0.00 C ATOM 1827 O LEU A 120 -0.575 -6.933 10.093 1.00 0.00 O ATOM 1828 CB LEU A 120 2.023 -4.670 10.093 1.00 0.00 C ATOM 1829 CG LEU A 120 2.924 -3.981 9.057 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.216 -3.522 9.733 1.00 0.00 C ATOM 1831 CD2 LEU A 120 3.293 -4.909 7.904 1.00 0.00 C ATOM 0 H LEU A 120 0.412 -2.839 10.048 1.00 0.00 H new ATOM 0 HA LEU A 120 0.560 -5.260 8.650 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.037 -4.079 11.009 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.455 -5.641 10.334 1.00 0.00 H new ATOM 0 HG LEU A 120 2.365 -3.136 8.654 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.857 -3.033 8.999 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.979 -2.820 10.533 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.735 -4.385 10.150 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.930 -4.377 7.198 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.827 -5.777 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.386 -5.238 7.397 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.300 -5.589 11.864 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.002 -6.422 12.843 1.00 0.00 C ATOM 1845 C ASN A 121 -2.395 -6.815 12.343 1.00 0.00 C ATOM 1846 O ASN A 121 -2.799 -7.970 12.495 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.085 -5.677 14.185 1.00 0.00 C ATOM 1848 CG ASN A 121 -2.104 -6.301 15.126 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -3.287 -5.981 15.061 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -1.702 -7.196 16.001 1.00 0.00 N ATOM 0 H ASN A 121 0.061 -4.724 12.267 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.441 -7.346 12.984 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.104 -5.679 14.661 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.350 -4.635 14.005 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -2.375 -7.630 16.632 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -0.717 -7.456 16.048 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.134 -5.879 11.736 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.400 -6.171 11.075 1.00 0.00 C ATOM 1859 C LYS A 122 -4.200 -7.305 10.080 1.00 0.00 C ATOM 1860 O LYS A 122 -4.803 -8.351 10.277 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.037 -4.912 10.457 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.086 -4.321 11.410 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.691 -3.001 10.910 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.843 -1.783 11.314 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.618 -0.827 12.138 1.00 0.00 N ATOM 0 H LYS A 122 -2.865 -4.896 11.692 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.124 -6.507 11.817 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.265 -4.170 10.250 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.502 -5.163 9.504 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.886 -5.047 11.553 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.628 -4.155 12.385 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.783 -3.034 9.824 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.698 -2.890 11.312 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -4.967 -2.117 11.871 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.478 -1.280 10.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.015 -0.019 12.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.440 -0.489 11.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -6.945 -1.301 13.004 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.386 -7.153 9.037 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.296 -8.208 8.022 1.00 0.00 C ATOM 1881 C ILE A 123 -2.639 -9.502 8.511 1.00 0.00 C ATOM 1882 O ILE A 123 -2.996 -10.576 8.016 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.615 -7.714 6.743 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.190 -7.198 6.985 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -3.499 -6.656 6.082 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -0.535 -6.717 5.702 1.00 0.00 C ATOM 0 H ILE A 123 -2.795 -6.338 8.872 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.333 -8.459 7.798 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.501 -8.563 6.068 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.217 -6.381 7.707 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.586 -7.992 7.425 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.020 -6.300 5.170 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.467 -7.092 5.836 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -3.641 -5.821 6.768 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.472 -6.360 5.919 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.483 -7.540 4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.123 -5.905 5.275 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.711 -9.423 9.465 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.100 -10.594 10.065 1.00 0.00 C ATOM 1900 C PHE A 124 -2.204 -11.450 10.666 1.00 0.00 C ATOM 1901 O PHE A 124 -2.327 -12.618 10.318 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.074 -10.199 11.139 1.00 0.00 C ATOM 1903 CG PHE A 124 1.193 -9.474 10.701 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.677 -9.542 9.377 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.934 -8.756 11.662 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.870 -8.892 9.018 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.133 -8.115 11.306 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.605 -8.185 9.985 1.00 0.00 C ATOM 0 H PHE A 124 -1.366 -8.539 9.840 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.562 -11.156 9.302 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.583 -9.567 11.867 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.227 -11.108 11.660 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.126 -10.098 8.633 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.577 -8.698 12.680 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.222 -8.936 7.998 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.693 -7.567 12.050 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.529 -7.697 9.713 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.037 -10.864 11.523 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.999 -11.639 12.291 1.00 0.00 C ATOM 1920 C GLU A 125 -5.263 -11.913 11.456 1.00 0.00 C ATOM 1921 O GLU A 125 -5.890 -12.966 11.600 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.344 -10.884 13.582 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.133 -10.434 14.428 1.00 0.00 C ATOM 1924 CD GLU A 125 -2.605 -11.453 15.433 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -2.742 -12.681 15.241 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -2.003 -11.018 16.442 1.00 0.00 O ATOM 0 H GLU A 125 -3.063 -9.860 11.700 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.561 -12.603 12.552 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.932 -10.004 13.322 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -4.979 -11.521 14.197 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.321 -10.166 13.751 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.409 -9.529 14.969 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.666 -10.969 10.594 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.865 -11.058 9.755 1.00 0.00 C ATOM 1935 C LYS A 126 -6.602 -12.043 8.623 1.00 0.00 C ATOM 1936 O LYS A 126 -7.164 -13.138 8.633 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.294 -9.668 9.224 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.587 -9.723 8.388 1.00 0.00 C ATOM 1939 CD LYS A 126 -8.847 -8.442 7.577 1.00 0.00 C ATOM 1940 CE LYS A 126 -9.830 -8.667 6.411 1.00 0.00 C ATOM 1941 NZ LYS A 126 -11.227 -8.891 6.845 1.00 0.00 N ATOM 0 H LYS A 126 -5.151 -10.099 10.459 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.699 -11.422 10.355 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.439 -8.991 10.066 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.491 -9.252 8.616 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.533 -10.571 7.706 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.433 -9.901 9.052 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -9.244 -7.672 8.239 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -7.902 -8.068 7.183 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.799 -7.801 5.749 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -9.498 -9.526 5.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -11.831 -9.035 6.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -11.271 -9.733 7.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.562 -8.062 7.377 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.803 -11.637 7.630 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.547 -12.419 6.427 1.00 0.00 C ATOM 1957 C LEU A 127 -4.677 -13.641 6.742 1.00 0.00 C ATOM 1958 O LEU A 127 -4.656 -14.587 5.949 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.836 -11.585 5.339 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.220 -10.101 5.146 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.442 -9.465 3.984 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.722 -9.940 4.927 1.00 0.00 C ATOM 0 H LEU A 127 -5.312 -10.743 7.645 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.520 -12.738 6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.767 -11.621 5.546 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.993 -12.090 4.386 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.949 -9.579 6.064 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.737 -8.421 3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.373 -9.521 4.188 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.663 -10.001 3.061 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.959 -8.884 4.795 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.021 -10.494 4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.259 -10.327 5.793 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.939 -13.624 7.856 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.964 -14.647 8.192 1.00 0.00 C ATOM 1976 C GLY A 128 -1.601 -14.302 7.598 1.00 0.00 C ATOM 1977 O GLY A 128 -0.862 -15.225 7.245 1.00 0.00 O ATOM 0 H GLY A 128 -4.009 -12.885 8.555 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.883 -14.738 9.275 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.298 -15.614 7.815 1.00 0.00 H new ATOM 1981 N MET A 129 -1.281 -13.019 7.373 1.00 0.00 N ATOM 1982 CA MET A 129 -0.026 -12.656 6.708 1.00 0.00 C ATOM 1983 C MET A 129 1.178 -12.918 7.599 1.00 0.00 C ATOM 1984 O MET A 129 1.031 -13.038 8.834 1.00 0.00 O ATOM 1985 CB MET A 129 -0.029 -11.209 6.195 1.00 0.00 C ATOM 1986 CG MET A 129 -0.930 -10.981 4.976 1.00 0.00 C ATOM 1987 SD MET A 129 -0.804 -12.198 3.627 1.00 0.00 S ATOM 1988 CE MET A 129 -2.150 -11.674 2.534 1.00 0.00 C ATOM 1989 OXT MET A 129 2.282 -13.082 7.033 1.00 0.00 O ATOM 0 H MET A 129 -1.866 -12.227 7.638 1.00 0.00 H new ATOM 0 HA MET A 129 0.056 -13.303 5.835 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.352 -10.550 7.001 1.00 0.00 H new ATOM 0 HB3 MET A 129 0.991 -10.923 5.938 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.965 -10.957 5.317 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.707 -9.996 4.567 1.00 0.00 H new ATOM 0 HE1 MET A 129 -1.982 -12.073 1.533 1.00 0.00 H new ATOM 0 HE2 MET A 129 -3.098 -12.048 2.920 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.180 -10.585 2.490 1.00 0.00 H new