Browse entries in the PDBbind-CN Database
HEADER 5V5Y_COMPLEX COMPND 5V5Y_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 145 SER ARG TYR THR THR GLU PHE HIS GLU LEU GLU LYS ILE SEQRES 2 A 145 GLY SER GLY GLU PHE GLY SER VAL PHE LYS CYS VAL LYS SEQRES 3 A 145 ARG LEU ASP GLY CYS ILE TYR ALA ILE LYS ARG SER LYS SEQRES 4 A 145 LYS PRO LEU ALA GLY SER VAL ASP GLU GLN ASN ALA LEU SEQRES 5 A 145 ARG GLU VAL TYR ALA HIS ALA VAL LEU GLY GLN HIS SER SEQRES 6 A 145 HIS VAL VAL ARG TYR PHE SER ALA TRP ALA GLU ASP ASP SEQRES 7 A 145 HIS MET LEU ILE GLN ASN GLU TYR CYS ASN GLY GLY SER SEQRES 8 A 145 LEU ALA ASP ALA ILE SER GLU ASN TYR ARG ILE MET SER SEQRES 9 A 145 TYR PHE LYS GLU ALA GLU LEU LYS ASP LEU LEU LEU GLN SEQRES 10 A 145 VAL GLY ARG GLY LEU ARG TYR ILE HIS SER MET SER LEU SEQRES 11 A 145 VAL HIS MET ASP ILE LYS PRO SER ASN ILE PHE ILE SER SEQRES 12 A 145 ARG THR SEQRES 1 A 114 LYS VAL MET PHE LYS ILE GLY ASP LEU GLY HIS VAL THR SEQRES 2 A 114 ARG ILE SER SER PRO GLN VAL GLU GLU GLY ASP SER ARG SEQRES 3 A 114 PHE LEU ALA ASN GLU VAL LEU GLN GLU ASN TYR THR HIS SEQRES 4 A 114 LEU PRO LYS ALA ASP ILE PHE ALA LEU ALA LEU THR VAL SEQRES 5 A 114 VAL CYS ALA ALA GLY ALA GLU PRO LEU PRO ARG ASN GLY SEQRES 6 A 114 ASP GLN TRP HIS GLU ILE ARG GLN GLY ARG LEU PRO ARG SEQRES 7 A 114 ILE PRO GLN VAL LEU SER GLN GLU PHE THR GLU LEU LEU SEQRES 8 A 114 LYS VAL MET ILE HIS PRO ASP PRO GLU ARG ARG PRO SER SEQRES 9 A 114 ALA MET ALA LEU VAL LYS HIS SER VAL LEU HET UNN A 370 70 ATOM 1 N SER A 293 32.898 13.871 12.280 1.00 48.80 N ATOM 2 CA SER A 293 31.956 13.280 11.331 1.00 43.90 C ATOM 3 C SER A 293 32.227 11.794 11.124 1.00 36.69 C ATOM 4 O SER A 293 33.315 11.405 10.693 1.00 33.69 O ATOM 5 CB SER A 293 32.027 14.015 9.996 1.00 56.73 C ATOM 6 OG SER A 293 31.314 13.320 8.989 1.00 37.39 O ATOM 7 HG SER A 293 31.378 13.819 8.137 1.00 0.00 H ATOM 8 HN3 SER A 293 33.867 13.760 11.919 1.00 0.00 H ATOM 9 HN2 SER A 293 32.811 13.390 13.198 1.00 0.00 H ATOM 10 HN1 SER A 293 32.683 14.882 12.396 1.00 0.00 H ATOM 11 N ARG A 294 31.238 10.965 11.445 1.00 33.03 N ATOM 12 CA ARG A 294 31.356 9.527 11.242 1.00 27.91 C ATOM 13 C ARG A 294 31.469 9.202 9.759 1.00 29.30 C ATOM 14 O ARG A 294 32.279 8.372 9.360 1.00 31.96 O ATOM 15 CB ARG A 294 30.159 8.789 11.841 1.00 34.03 C ATOM 16 CG ARG A 294 30.076 7.322 11.431 1.00 35.29 C ATOM 17 CD ARG A 294 28.968 6.589 12.174 1.00 36.87 C ATOM 18 NE ARG A 294 28.429 5.470 11.400 1.00 39.07 N ATOM 19 CZ ARG A 294 28.923 4.235 11.403 1.00 33.06 C ATOM 20 NH1 ARG A 294 29.986 3.931 12.131 1.00 36.31 N ATOM 21 NH2 ARG A 294 28.348 3.295 10.675 1.00 28.57 N ATOM 22 HE ARG A 294 27.598 5.654 10.803 1.00 0.00 H ATOM 23 HH12 ARG A 294 30.361 2.961 12.124 1.00 0.00 H ATOM 24 HH11 ARG A 294 30.446 4.662 12.710 1.00 0.00 H ATOM 25 HH22 ARG A 294 28.732 2.329 10.676 1.00 0.00 H ATOM 26 HH21 ARG A 294 27.511 3.521 10.101 1.00 0.00 H ATOM 27 H ARG A 294 30.361 11.351 11.850 1.00 0.00 H ATOM 28 N TYR A 295 30.628 9.843 8.954 1.00 31.81 N ATOM 29 CA TYR A 295 30.608 9.617 7.513 1.00 31.62 C ATOM 30 C TYR A 295 31.983 9.870 6.921 1.00 38.40 C ATOM 31 O TYR A 295 32.500 9.061 6.160 1.00 29.37 O ATOM 32 CB TYR A 295 29.576 10.522 6.843 1.00 23.15 C ATOM 33 CG TYR A 295 29.404 10.301 5.346 1.00 26.03 C ATOM 34 CD1 TYR A 295 29.185 9.032 4.821 1.00 31.38 C ATOM 35 CD2 TYR A 295 29.428 11.373 4.465 1.00 31.15 C ATOM 36 CE1 TYR A 295 29.013 8.839 3.453 1.00 31.16 C ATOM 37 CE2 TYR A 295 29.259 11.188 3.108 1.00 27.98 C ATOM 38 CZ TYR A 295 29.055 9.922 2.606 1.00 31.91 C ATOM 39 OH TYR A 295 28.886 9.752 1.248 1.00 33.09 O ATOM 40 HH TYR A 295 29.691 10.078 0.773 1.00 0.00 H ATOM 41 H TYR A 295 29.962 10.528 9.365 1.00 0.00 H ATOM 42 N THR A 296 32.570 11.001 7.289 1.00 28.87 N ATOM 43 CA THR A 296 33.868 11.401 6.758 1.00 44.03 C ATOM 44 C THR A 296 34.992 10.524 7.296 1.00 31.08 C ATOM 45 O THR A 296 35.910 10.163 6.564 1.00 46.01 O ATOM 46 CB THR A 296 34.168 12.875 7.099 1.00 51.33 C ATOM 47 OG1 THR A 296 33.172 13.716 6.503 1.00 52.34 O ATOM 48 CG2 THR A 296 35.545 13.292 6.593 1.00 55.92 C ATOM 49 HG1 THR A 296 32.280 13.470 6.856 1.00 0.00 H ATOM 50 H THR A 296 32.092 11.619 7.975 1.00 0.00 H ATOM 51 N THR A 297 34.924 10.190 8.580 1.00 31.83 N ATOM 52 CA THR A 297 36.007 9.459 9.233 1.00 34.78 C ATOM 53 C THR A 297 36.007 7.994 8.826 1.00 33.15 C ATOM 54 O THR A 297 37.064 7.404 8.610 1.00 34.95 O ATOM 55 CB THR A 297 35.900 9.547 10.776 1.00 36.95 C ATOM 56 OG1 THR A 297 35.814 10.920 11.173 1.00 42.95 O ATOM 57 CG2 THR A 297 37.111 8.902 11.437 1.00 45.62 C ATOM 58 HG1 THR A 297 35.012 11.331 10.763 1.00 0.00 H ATOM 59 H THR A 297 34.083 10.454 9.131 1.00 0.00 H ATOM 60 N GLU A 298 34.816 7.417 8.713 1.00 31.42 N ATOM 61 CA GLU A 298 34.673 5.976 8.540 1.00 29.80 C ATOM 62 C GLU A 298 34.586 5.525 7.090 1.00 28.30 C ATOM 63 O GLU A 298 34.865 4.363 6.794 1.00 28.54 O ATOM 64 CB GLU A 298 33.431 5.490 9.280 1.00 35.05 C ATOM 65 CG GLU A 298 33.532 5.628 10.792 1.00 36.50 C ATOM 66 CD GLU A 298 34.515 4.646 11.397 1.00 67.98 C ATOM 67 OE1 GLU A 298 34.248 3.425 11.351 1.00 67.06 O ATOM 68 OE2 GLU A 298 35.558 5.095 11.915 1.00 65.83 O ATOM 69 H GLU A 298 33.962 8.009 8.749 1.00 0.00 H ATOM 70 N PHE A 299 34.199 6.438 6.201 1.00 27.07 N ATOM 71 CA PHE A 299 33.918 6.088 4.814 1.00 25.66 C ATOM 72 C PHE A 299 34.647 6.986 3.832 1.00 27.28 C ATOM 73 O PHE A 299 34.859 8.173 4.085 1.00 33.14 O ATOM 74 CB PHE A 299 32.410 6.145 4.552 1.00 23.32 C ATOM 75 CG PHE A 299 31.627 5.213 5.413 1.00 31.65 C ATOM 76 CD1 PHE A 299 31.452 3.897 5.035 1.00 23.34 C ATOM 77 CD2 PHE A 299 31.090 5.640 6.615 1.00 23.16 C ATOM 78 CE1 PHE A 299 30.738 3.023 5.827 1.00 28.53 C ATOM 79 CE2 PHE A 299 30.371 4.768 7.412 1.00 27.95 C ATOM 80 CZ PHE A 299 30.197 3.460 7.018 1.00 24.22 C ATOM 81 H PHE A 299 34.094 7.427 6.504 1.00 0.00 H ATOM 82 N HIS A 300 35.046 6.386 2.717 1.00 30.22 N ATOM 83 CA HIS A 300 35.648 7.100 1.602 1.00 27.38 C ATOM 84 C HIS A 300 34.697 7.014 0.418 1.00 25.59 C ATOM 85 O HIS A 300 34.372 5.919 -0.032 1.00 24.81 O ATOM 86 CB HIS A 300 37.011 6.493 1.264 1.00 29.47 C ATOM 87 CG HIS A 300 37.643 7.056 0.028 1.00 30.51 C ATOM 88 ND1 HIS A 300 38.177 8.323 -0.026 1.00 44.84 N ATOM 89 CD2 HIS A 300 37.842 6.509 -1.195 1.00 33.01 C ATOM 90 CE1 HIS A 300 38.674 8.539 -1.234 1.00 41.39 C ATOM 91 NE2 HIS A 300 38.484 7.454 -1.959 1.00 34.50 N ATOM 92 H HIS A 300 34.922 5.356 2.637 1.00 0.00 H ATOM 93 N GLU A 301 34.225 8.163 -0.059 1.00 32.86 N ATOM 94 CA GLU A 301 33.333 8.206 -1.219 1.00 34.33 C ATOM 95 C GLU A 301 34.069 7.804 -2.492 1.00 25.16 C ATOM 96 O GLU A 301 35.194 8.240 -2.720 1.00 26.98 O ATOM 97 CB GLU A 301 32.735 9.604 -1.391 1.00 35.32 C ATOM 98 CG GLU A 301 31.782 10.026 -0.289 1.00 39.39 C ATOM 99 CD GLU A 301 31.169 11.395 -0.540 1.00 32.44 C ATOM 100 OE1 GLU A 301 31.741 12.170 -1.334 1.00 40.55 O ATOM 101 OE2 GLU A 301 30.114 11.699 0.058 1.00 32.66 O ATOM 102 H GLU A 301 34.497 9.054 0.404 1.00 0.00 H ATOM 103 N LEU A 302 33.421 6.983 -3.318 1.00 25.67 N ATOM 104 CA LEU A 302 34.006 6.498 -4.574 1.00 28.20 C ATOM 105 C LEU A 302 33.263 7.008 -5.802 1.00 49.99 C ATOM 106 O LEU A 302 33.865 7.258 -6.847 1.00 34.50 O ATOM 107 CB LEU A 302 34.008 4.967 -4.617 1.00 28.98 C ATOM 108 CG LEU A 302 34.944 4.163 -3.724 1.00 25.53 C ATOM 109 CD1 LEU A 302 34.786 2.696 -4.081 1.00 34.34 C ATOM 110 CD2 LEU A 302 36.404 4.606 -3.880 1.00 28.62 C ATOM 111 H LEU A 302 32.462 6.673 -3.062 1.00 0.00 H ATOM 112 N GLU A 303 31.946 7.127 -5.686 1.00 26.23 N ATOM 113 CA GLU A 303 31.112 7.491 -6.822 1.00 29.07 C ATOM 114 C GLU A 303 29.711 7.884 -6.358 1.00 28.18 C ATOM 115 O GLU A 303 29.124 7.231 -5.489 1.00 25.76 O ATOM 116 CB GLU A 303 31.047 6.321 -7.820 1.00 29.53 C ATOM 117 CG GLU A 303 30.130 6.541 -9.023 1.00 31.10 C ATOM 118 CD GLU A 303 29.912 5.270 -9.844 1.00 60.90 C ATOM 119 OE1 GLU A 303 29.141 5.317 -10.826 1.00 40.39 O ATOM 120 OE2 GLU A 303 30.504 4.220 -9.511 1.00 42.59 O ATOM 121 H GLU A 303 31.500 6.956 -4.762 1.00 0.00 H ATOM 122 N LYS A 304 29.188 8.968 -6.925 1.00 23.89 N ATOM 123 CA LYS A 304 27.805 9.361 -6.699 1.00 28.27 C ATOM 124 C LYS A 304 26.920 8.482 -7.578 1.00 31.67 C ATOM 125 O LYS A 304 27.077 8.482 -8.794 1.00 28.50 O ATOM 126 CB LYS A 304 27.603 10.843 -7.027 1.00 25.64 C ATOM 127 CG LYS A 304 26.232 11.391 -6.672 1.00 33.99 C ATOM 128 CD LYS A 304 26.040 12.799 -7.225 1.00 33.94 C ATOM 129 CE LYS A 304 25.061 13.590 -6.385 1.00 38.71 C ATOM 130 NZ LYS A 304 25.724 14.228 -5.212 1.00 73.76 N ATOM 131 HZ1 LYS A 304 26.148 13.492 -4.612 1.00 0.00 H ATOM 132 HZ2 LYS A 304 26.466 14.876 -5.545 1.00 0.00 H ATOM 133 HZ3 LYS A 304 25.018 14.760 -4.663 1.00 0.00 H ATOM 134 H LYS A 304 29.784 9.551 -7.547 1.00 0.00 H ATOM 135 N ILE A 305 26.006 7.730 -6.970 1.00 27.82 N ATOM 136 CA ILE A 305 25.211 6.754 -7.711 1.00 22.82 C ATOM 137 C ILE A 305 23.717 7.074 -7.672 1.00 23.18 C ATOM 138 O ILE A 305 22.906 6.351 -8.244 1.00 24.05 O ATOM 139 CB ILE A 305 25.442 5.313 -7.181 1.00 21.87 C ATOM 140 CG1 ILE A 305 25.068 5.194 -5.697 1.00 28.06 C ATOM 141 CG2 ILE A 305 26.888 4.901 -7.418 1.00 24.05 C ATOM 142 CD1 ILE A 305 25.172 3.768 -5.148 1.00 19.96 C ATOM 143 H ILE A 305 25.855 7.839 -5.947 1.00 0.00 H ATOM 144 N GLY A 306 23.354 8.166 -7.015 1.00 27.91 N ATOM 145 CA GLY A 306 21.958 8.545 -6.927 1.00 31.39 C ATOM 146 C GLY A 306 21.760 9.935 -6.370 1.00 28.60 C ATOM 147 O GLY A 306 22.543 10.403 -5.540 1.00 24.76 O ATOM 148 H GLY A 306 24.078 8.757 -6.558 1.00 0.00 H ATOM 149 N SER A 307 20.697 10.585 -6.835 1.00 35.37 N ATOM 150 CA SER A 307 20.374 11.953 -6.445 1.00 45.00 C ATOM 151 C SER A 307 18.869 12.166 -6.510 1.00 47.54 C ATOM 152 O SER A 307 18.182 11.537 -7.314 1.00 42.84 O ATOM 153 CB SER A 307 21.084 12.958 -7.355 1.00 54.71 C ATOM 154 OG SER A 307 22.343 13.331 -6.825 1.00 65.74 O ATOM 155 HG SER A 307 22.914 12.527 -6.737 1.00 0.00 H ATOM 156 H SER A 307 20.069 10.097 -7.505 1.00 0.00 H ATOM 157 N GLY A 308 18.365 13.063 -5.671 1.00 37.90 N ATOM 158 CA GLY A 308 16.940 13.324 -5.592 1.00 40.75 C ATOM 159 C GLY A 308 16.631 14.390 -4.560 1.00 35.21 C ATOM 160 O GLY A 308 17.544 15.006 -4.008 1.00 40.54 O ATOM 161 H GLY A 308 19.011 13.594 -5.052 1.00 0.00 H ATOM 162 N GLU A 309 15.346 14.602 -4.291 1.00 50.11 N ATOM 163 CA GLU A 309 14.924 15.656 -3.376 1.00 74.79 C ATOM 164 C GLU A 309 15.380 15.339 -1.955 1.00 66.54 C ATOM 165 O GLU A 309 15.696 16.241 -1.178 1.00 61.99 O ATOM 166 CB GLU A 309 13.404 15.835 -3.420 1.00 86.22 C ATOM 167 CG GLU A 309 12.951 17.291 -3.385 1.00 82.13 C ATOM 168 CD GLU A 309 13.346 18.060 -4.635 1.00 92.82 C ATOM 169 OE1 GLU A 309 13.388 17.451 -5.725 1.00 96.06 O ATOM 170 OE2 GLU A 309 13.621 19.274 -4.526 1.00 83.17 O ATOM 171 H GLU A 309 14.626 14.003 -4.743 1.00 0.00 H ATOM 172 N PHE A 310 15.413 14.051 -1.628 1.00 54.87 N ATOM 173 CA PHE A 310 15.897 13.593 -0.328 1.00 62.87 C ATOM 174 C PHE A 310 17.336 14.039 -0.076 1.00 78.97 C ATOM 175 O PHE A 310 17.663 14.542 1.003 1.00 45.54 O ATOM 176 CB PHE A 310 15.808 12.067 -0.235 1.00 64.73 C ATOM 177 CG PHE A 310 16.613 11.350 -1.281 1.00 67.11 C ATOM 178 CD1 PHE A 310 16.065 11.061 -2.518 1.00 58.52 C ATOM 179 CD2 PHE A 310 17.921 10.967 -1.027 1.00 54.41 C ATOM 180 CE1 PHE A 310 16.804 10.407 -3.484 1.00 61.04 C ATOM 181 CE2 PHE A 310 18.666 10.314 -1.992 1.00 55.84 C ATOM 182 CZ PHE A 310 18.106 10.033 -3.220 1.00 59.49 C ATOM 183 H PHE A 310 15.084 13.347 -2.319 1.00 0.00 H ATOM 184 N GLY A 311 18.186 13.859 -1.083 1.00 50.72 N ATOM 185 CA GLY A 311 19.612 14.091 -0.949 1.00 54.84 C ATOM 186 C GLY A 311 20.387 13.328 -2.008 1.00 69.58 C ATOM 187 O GLY A 311 20.079 13.431 -3.197 1.00 32.02 O ATOM 188 H GLY A 311 17.815 13.540 -2.001 1.00 0.00 H ATOM 189 N SER A 312 21.381 12.550 -1.580 1.00 23.81 N ATOM 190 CA SER A 312 22.249 11.843 -2.518 1.00 29.34 C ATOM 191 C SER A 312 22.696 10.483 -1.978 1.00 27.20 C ATOM 192 O SER A 312 22.667 10.244 -0.772 1.00 28.23 O ATOM 193 CB SER A 312 23.473 12.702 -2.848 1.00 31.33 C ATOM 194 OG SER A 312 24.324 12.834 -1.724 1.00 60.04 O ATOM 195 HG SER A 312 25.105 13.393 -1.966 1.00 0.00 H ATOM 196 H SER A 312 21.542 12.444 -0.558 1.00 0.00 H ATOM 197 N VAL A 313 23.104 9.596 -2.884 1.00 26.42 N ATOM 198 CA VAL A 313 23.623 8.286 -2.503 1.00 23.58 C ATOM 199 C VAL A 313 25.017 8.116 -3.079 1.00 23.26 C ATOM 200 O VAL A 313 25.240 8.387 -4.255 1.00 23.85 O ATOM 201 CB VAL A 313 22.737 7.126 -3.004 1.00 22.87 C ATOM 202 CG1 VAL A 313 23.286 5.783 -2.481 1.00 19.61 C ATOM 203 CG2 VAL A 313 21.264 7.355 -2.625 1.00 24.21 C ATOM 204 H VAL A 313 23.051 9.844 -3.893 1.00 0.00 H ATOM 205 N PHE A 314 25.952 7.666 -2.249 1.00 18.73 N ATOM 206 CA PHE A 314 27.314 7.422 -2.701 1.00 23.05 C ATOM 207 C PHE A 314 27.734 5.968 -2.500 1.00 20.56 C ATOM 208 O PHE A 314 27.420 5.330 -1.489 1.00 21.98 O ATOM 209 CB PHE A 314 28.301 8.350 -1.975 1.00 29.17 C ATOM 210 CG PHE A 314 28.463 9.707 -2.623 1.00 24.32 C ATOM 211 CD1 PHE A 314 27.605 10.746 -2.306 1.00 40.29 C ATOM 212 CD2 PHE A 314 29.480 9.937 -3.542 1.00 26.20 C ATOM 213 CE1 PHE A 314 27.748 11.988 -2.892 1.00 23.82 C ATOM 214 CE2 PHE A 314 29.634 11.185 -4.135 1.00 30.54 C ATOM 215 CZ PHE A 314 28.766 12.211 -3.811 1.00 33.91 C ATOM 216 H PHE A 314 25.705 7.484 -1.255 1.00 0.00 H ATOM 217 N LYS A 315 28.433 5.457 -3.500 1.00 19.70 N ATOM 218 CA LYS A 315 29.205 4.236 -3.385 1.00 19.96 C ATOM 219 C LYS A 315 30.437 4.576 -2.544 1.00 20.57 C ATOM 220 O LYS A 315 31.205 5.461 -2.919 1.00 23.00 O ATOM 221 CB LYS A 315 29.590 3.726 -4.782 1.00 20.89 C ATOM 222 CG LYS A 315 30.500 2.520 -4.826 1.00 21.58 C ATOM 223 CD LYS A 315 30.974 2.274 -6.277 1.00 22.77 C ATOM 224 CE LYS A 315 31.763 0.986 -6.414 1.00 23.71 C ATOM 225 NZ LYS A 315 32.408 0.847 -7.768 1.00 28.32 N ATOM 226 HZ1 LYS A 315 31.672 0.853 -8.503 1.00 0.00 H ATOM 227 HZ2 LYS A 315 33.061 1.642 -7.923 1.00 0.00 H ATOM 228 HZ3 LYS A 315 32.934 -0.049 -7.810 1.00 0.00 H ATOM 229 H LYS A 315 28.428 5.956 -4.413 1.00 0.00 H ATOM 230 N CYS A 316 30.614 3.893 -1.415 1.00 20.34 N ATOM 231 CA CYS A 316 31.685 4.208 -0.461 1.00 21.23 C ATOM 232 C CYS A 316 32.466 2.972 -0.040 1.00 26.00 C ATOM 233 O CYS A 316 31.916 1.886 0.009 1.00 24.96 O ATOM 234 CB CYS A 316 31.112 4.862 0.808 1.00 20.66 C ATOM 235 SG CYS A 316 30.252 6.414 0.553 1.00 22.98 S ATOM 236 H CYS A 316 29.969 3.106 -1.200 1.00 0.00 H ATOM 237 N VAL A 317 33.746 3.150 0.277 1.00 23.76 N ATOM 238 CA VAL A 317 34.505 2.119 0.969 1.00 25.14 C ATOM 239 C VAL A 317 34.475 2.435 2.456 1.00 25.51 C ATOM 240 O VAL A 317 34.725 3.569 2.845 1.00 28.43 O ATOM 241 CB VAL A 317 35.975 2.044 0.501 1.00 27.28 C ATOM 242 CG1 VAL A 317 36.709 0.919 1.208 1.00 38.15 C ATOM 243 CG2 VAL A 317 36.024 1.838 -0.982 1.00 28.21 C ATOM 244 H VAL A 317 34.214 4.044 0.025 1.00 0.00 H ATOM 245 N LYS A 318 34.172 1.441 3.280 1.00 25.73 N ATOM 246 CA LYS A 318 34.328 1.591 4.726 1.00 26.73 C ATOM 247 C LYS A 318 35.774 1.278 5.086 1.00 29.52 C ATOM 248 O LYS A 318 36.235 0.153 4.896 1.00 30.85 O ATOM 249 CB LYS A 318 33.374 0.672 5.484 1.00 26.19 C ATOM 250 CG LYS A 318 33.489 0.803 6.995 1.00 27.98 C ATOM 251 CD LYS A 318 32.395 0.027 7.717 1.00 27.94 C ATOM 252 CE LYS A 318 32.593 0.097 9.220 1.00 35.23 C ATOM 253 NZ LYS A 318 31.637 -0.780 9.946 1.00 30.23 N ATOM 254 HZ1 LYS A 318 30.664 -0.483 9.731 1.00 0.00 H ATOM 255 HZ2 LYS A 318 31.775 -1.766 9.644 1.00 0.00 H ATOM 256 HZ3 LYS A 318 31.806 -0.703 10.969 1.00 0.00 H ATOM 257 H LYS A 318 33.819 0.543 2.892 1.00 0.00 H ATOM 258 N ARG A 319 36.490 2.277 5.592 1.00 36.88 N ATOM 259 CA ARG A 319 37.923 2.148 5.853 1.00 34.02 C ATOM 260 C ARG A 319 38.259 0.969 6.769 1.00 36.87 C ATOM 261 O ARG A 319 39.250 0.283 6.556 1.00 38.35 O ATOM 262 CB ARG A 319 38.460 3.454 6.447 1.00 35.47 C ATOM 263 CG ARG A 319 38.348 4.629 5.488 1.00 34.30 C ATOM 264 CD ARG A 319 39.311 5.764 5.815 1.00 50.10 C ATOM 265 NE ARG A 319 39.231 6.829 4.814 1.00 38.30 N ATOM 266 CZ ARG A 319 38.281 7.759 4.791 1.00 41.27 C ATOM 267 NH1 ARG A 319 37.324 7.761 5.710 1.00 42.69 N ATOM 268 NH2 ARG A 319 38.280 8.687 3.844 1.00 41.82 N ATOM 269 HE ARG A 319 39.962 6.860 4.075 1.00 0.00 H ATOM 270 HH12 ARG A 319 36.583 8.491 5.688 1.00 0.00 H ATOM 271 HH11 ARG A 319 37.315 7.033 6.453 1.00 0.00 H ATOM 272 HH22 ARG A 319 37.536 9.413 3.828 1.00 0.00 H ATOM 273 HH21 ARG A 319 39.023 8.689 3.117 1.00 0.00 H ATOM 274 H ARG A 319 36.017 3.177 5.809 1.00 0.00 H ATOM 275 N LEU A 320 37.410 0.713 7.765 1.00 37.76 N ATOM 276 CA LEU A 320 37.668 -0.352 8.732 1.00 37.69 C ATOM 277 C LEU A 320 37.727 -1.755 8.113 1.00 38.08 C ATOM 278 O LEU A 320 38.630 -2.523 8.435 1.00 41.10 O ATOM 279 CB LEU A 320 36.602 -0.332 9.832 1.00 43.51 C ATOM 280 CG LEU A 320 36.756 -1.369 10.952 1.00 56.82 C ATOM 281 CD1 LEU A 320 37.890 -0.995 11.899 1.00 51.78 C ATOM 282 CD2 LEU A 320 35.444 -1.530 11.709 1.00 46.43 C ATOM 283 H LEU A 320 36.545 1.284 7.856 1.00 0.00 H ATOM 284 N ASP A 321 36.769 -2.093 7.246 1.00 35.42 N ATOM 285 CA ASP A 321 36.706 -3.445 6.675 1.00 35.94 C ATOM 286 C ASP A 321 37.049 -3.485 5.179 1.00 35.93 C ATOM 287 O ASP A 321 37.188 -4.562 4.597 1.00 42.55 O ATOM 288 CB ASP A 321 35.317 -4.073 6.918 1.00 34.32 C ATOM 289 CG ASP A 321 34.178 -3.324 6.227 1.00 36.03 C ATOM 290 OD1 ASP A 321 34.418 -2.573 5.258 1.00 33.73 O ATOM 291 OD2 ASP A 321 33.016 -3.506 6.656 1.00 41.56 O ATOM 292 H ASP A 321 36.056 -1.388 6.971 1.00 0.00 H ATOM 293 N GLY A 322 37.192 -2.316 4.560 1.00 41.11 N ATOM 294 CA GLY A 322 37.569 -2.239 3.156 1.00 35.26 C ATOM 295 C GLY A 322 36.461 -2.613 2.177 1.00 31.22 C ATOM 296 O GLY A 322 36.696 -2.699 0.968 1.00 40.32 O ATOM 297 H GLY A 322 37.031 -1.437 5.092 1.00 0.00 H ATOM 298 N CYS A 323 35.251 -2.822 2.685 1.00 29.71 N ATOM 299 CA CYS A 323 34.132 -3.239 1.841 1.00 28.05 C ATOM 300 C CYS A 323 33.387 -2.038 1.279 1.00 33.03 C ATOM 301 O CYS A 323 33.470 -0.939 1.826 1.00 25.35 O ATOM 302 CB CYS A 323 33.159 -4.122 2.627 1.00 36.91 C ATOM 303 SG CYS A 323 33.910 -5.601 3.325 1.00 47.89 S ATOM 304 H CYS A 323 35.097 -2.686 3.704 1.00 0.00 H ATOM 305 N ILE A 324 32.642 -2.272 0.200 1.00 27.79 N ATOM 306 CA ILE A 324 31.896 -1.221 -0.475 1.00 23.27 C ATOM 307 C ILE A 324 30.422 -1.249 -0.053 1.00 21.97 C ATOM 308 O ILE A 324 29.802 -2.310 0.040 1.00 22.31 O ATOM 309 CB ILE A 324 32.017 -1.343 -2.010 1.00 25.16 C ATOM 310 CG1 ILE A 324 33.446 -0.976 -2.449 1.00 25.62 C ATOM 311 CG2 ILE A 324 31.019 -0.427 -2.710 1.00 22.42 C ATOM 312 CD1 ILE A 324 33.745 -1.256 -3.896 1.00 39.04 C ATOM 313 H ILE A 324 32.592 -3.241 -0.174 1.00 0.00 H ATOM 314 N TYR A 325 29.884 -0.061 0.202 1.00 20.81 N ATOM 315 CA TYR A 325 28.507 0.102 0.647 1.00 19.77 C ATOM 316 C TYR A 325 27.834 1.237 -0.109 1.00 18.88 C ATOM 317 O TYR A 325 28.511 2.117 -0.646 1.00 19.01 O ATOM 318 CB TYR A 325 28.465 0.386 2.152 1.00 19.69 C ATOM 319 CG TYR A 325 29.049 -0.717 3.007 1.00 20.98 C ATOM 320 CD1 TYR A 325 28.256 -1.759 3.458 1.00 21.34 C ATOM 321 CD2 TYR A 325 30.394 -0.713 3.371 1.00 22.27 C ATOM 322 CE1 TYR A 325 28.773 -2.771 4.240 1.00 22.91 C ATOM 323 CE2 TYR A 325 30.921 -1.727 4.159 1.00 25.83 C ATOM 324 CZ TYR A 325 30.106 -2.756 4.588 1.00 25.29 C ATOM 325 OH TYR A 325 30.609 -3.779 5.373 1.00 26.58 O ATOM 326 HH TYR A 325 30.969 -3.401 6.214 1.00 0.00 H ATOM 327 H TYR A 325 30.471 0.788 0.079 1.00 0.00 H ATOM 328 N ALA A 326 26.504 1.209 -0.149 1.00 18.35 N ATOM 329 CA ALA A 326 25.724 2.325 -0.668 1.00 19.68 C ATOM 330 C ALA A 326 25.248 3.157 0.515 1.00 17.75 C ATOM 331 O ALA A 326 24.523 2.650 1.368 1.00 22.68 O ATOM 332 CB ALA A 326 24.545 1.826 -1.492 1.00 19.30 C ATOM 333 H ALA A 326 26.006 0.365 0.201 1.00 0.00 H ATOM 334 N ILE A 327 25.654 4.424 0.574 1.00 17.13 N ATOM 335 CA ILE A 327 25.293 5.275 1.709 1.00 17.51 C ATOM 336 C ILE A 327 24.438 6.445 1.259 1.00 16.79 C ATOM 337 O ILE A 327 24.871 7.271 0.442 1.00 21.27 O ATOM 338 CB ILE A 327 26.540 5.797 2.459 1.00 22.09 C ATOM 339 CG1 ILE A 327 27.294 4.616 3.073 1.00 19.70 C ATOM 340 CG2 ILE A 327 26.137 6.780 3.567 1.00 21.92 C ATOM 341 CD1 ILE A 327 28.523 4.991 3.868 1.00 32.58 C ATOM 342 H ILE A 327 26.235 4.814 -0.196 1.00 0.00 H ATOM 343 N LYS A 328 23.212 6.482 1.775 1.00 16.55 N ATOM 344 CA LYS A 328 22.266 7.562 1.497 1.00 20.28 C ATOM 345 C LYS A 328 22.339 8.638 2.576 1.00 22.24 C ATOM 346 O LYS A 328 22.269 8.331 3.763 1.00 18.71 O ATOM 347 CB LYS A 328 20.845 7.018 1.407 1.00 17.02 C ATOM 348 CG LYS A 328 19.791 8.090 1.135 1.00 23.18 C ATOM 349 CD LYS A 328 18.448 7.485 0.790 1.00 24.84 C ATOM 350 CE LYS A 328 17.758 6.922 2.022 1.00 30.11 C ATOM 351 NZ LYS A 328 16.323 6.630 1.768 1.00 52.77 N ATOM 352 HZ1 LYS A 328 15.836 7.506 1.493 1.00 0.00 H ATOM 353 HZ2 LYS A 328 16.243 5.932 1.001 1.00 0.00 H ATOM 354 HZ3 LYS A 328 15.890 6.248 2.633 1.00 0.00 H ATOM 355 H LYS A 328 22.914 5.709 2.403 1.00 0.00 H ATOM 356 N ARG A 329 22.482 9.889 2.146 1.00 19.32 N ATOM 357 CA ARG A 329 22.498 11.044 3.040 1.00 29.61 C ATOM 358 C ARG A 329 21.319 11.949 2.694 1.00 31.19 C ATOM 359 O ARG A 329 21.240 12.479 1.581 1.00 31.13 O ATOM 360 CB ARG A 329 23.823 11.806 2.921 1.00 23.96 C ATOM 361 CG ARG A 329 24.037 12.895 3.977 1.00 33.24 C ATOM 362 CD ARG A 329 25.452 13.474 3.895 1.00 44.54 C ATOM 363 NE ARG A 329 25.455 14.871 3.458 1.00 66.85 N ATOM 364 CZ ARG A 329 25.644 15.925 4.251 1.00 38.34 C ATOM 365 NH1 ARG A 329 25.859 15.779 5.552 1.00 59.98 N ATOM 366 NH2 ARG A 329 25.621 17.145 3.736 1.00 60.37 N ATOM 367 HE ARG A 329 25.297 15.056 2.447 1.00 0.00 H ATOM 368 HH12 ARG A 329 26.004 16.616 6.152 1.00 0.00 H ATOM 369 HH11 ARG A 329 25.883 14.828 5.972 1.00 0.00 H ATOM 370 HH22 ARG A 329 25.768 17.971 4.350 1.00 0.00 H ATOM 371 HH21 ARG A 329 25.456 17.277 2.718 1.00 0.00 H ATOM 372 H ARG A 329 22.587 10.052 1.124 1.00 0.00 H ATOM 373 N SER A 330 20.403 12.096 3.647 1.00 22.87 N ATOM 374 CA SER A 330 19.181 12.885 3.479 1.00 30.37 C ATOM 375 C SER A 330 19.082 14.038 4.484 1.00 31.01 C ATOM 376 O SER A 330 19.535 13.917 5.623 1.00 32.46 O ATOM 377 CB SER A 330 17.951 11.991 3.644 1.00 31.01 C ATOM 378 OG SER A 330 18.055 10.804 2.886 1.00 38.56 O ATOM 379 HG SER A 330 18.851 10.294 3.181 1.00 0.00 H ATOM 380 H SER A 330 20.563 11.625 4.560 1.00 0.00 H ATOM 381 N LYS A 331 18.456 15.138 4.066 1.00 35.41 N ATOM 382 CA LYS A 331 18.147 16.254 4.968 1.00 41.61 C ATOM 383 C LYS A 331 17.100 15.852 6.009 1.00 37.46 C ATOM 384 O LYS A 331 16.364 14.889 5.808 1.00 35.07 O ATOM 385 CB LYS A 331 17.630 17.463 4.178 1.00 56.83 C ATOM 386 CG LYS A 331 18.562 17.962 3.086 1.00 42.55 C ATOM 387 CD LYS A 331 18.017 19.230 2.432 1.00 46.54 C ATOM 388 CE LYS A 331 18.887 19.683 1.272 1.00 60.47 C ATOM 389 NZ LYS A 331 18.413 20.971 0.689 1.00 84.37 N ATOM 390 HZ1 LYS A 331 17.440 20.855 0.340 1.00 0.00 H ATOM 391 HZ2 LYS A 331 18.435 21.710 1.420 1.00 0.00 H ATOM 392 HZ3 LYS A 331 19.035 21.243 -0.099 1.00 0.00 H ATOM 393 H LYS A 331 18.177 15.208 3.067 1.00 0.00 H ATOM 394 N LYS A 332 17.027 16.591 7.116 1.00 29.99 N ATOM 395 CA LYS A 332 16.003 16.346 8.124 1.00 27.97 C ATOM 396 C LYS A 332 14.611 16.567 7.539 1.00 34.37 C ATOM 397 O LYS A 332 14.359 17.598 6.917 1.00 31.85 O ATOM 398 CB LYS A 332 16.194 17.262 9.338 1.00 35.30 C ATOM 399 CG LYS A 332 15.271 16.920 10.515 1.00 37.22 C ATOM 400 CD LYS A 332 15.325 17.966 11.618 1.00 56.12 C ATOM 401 CE LYS A 332 14.397 17.598 12.778 1.00 58.53 C ATOM 402 NZ LYS A 332 14.136 18.750 13.690 1.00 65.87 N ATOM 403 HZ1 LYS A 332 15.035 19.083 14.092 1.00 0.00 H ATOM 404 HZ2 LYS A 332 13.689 19.521 13.154 1.00 0.00 H ATOM 405 HZ3 LYS A 332 13.503 18.447 14.457 1.00 0.00 H ATOM 406 H LYS A 332 17.714 17.358 7.263 1.00 0.00 H ATOM 407 N PRO A 333 13.701 15.598 7.722 1.00 32.12 N ATOM 408 CA PRO A 333 12.323 15.844 7.275 1.00 44.60 C ATOM 409 C PRO A 333 11.632 16.952 8.062 1.00 28.01 C ATOM 410 O PRO A 333 11.905 17.117 9.248 1.00 39.29 O ATOM 411 CB PRO A 333 11.624 14.500 7.515 1.00 49.40 C ATOM 412 CG PRO A 333 12.504 13.756 8.465 1.00 38.23 C ATOM 413 CD PRO A 333 13.895 14.205 8.155 1.00 35.64 C ATOM 414 N LEU A 334 10.745 17.696 7.406 1.00 52.49 N ATOM 415 CA LEU A 334 9.982 18.735 8.087 1.00 41.72 C ATOM 416 C LEU A 334 9.012 18.115 9.083 1.00 51.29 C ATOM 417 O LEU A 334 8.630 16.951 8.954 1.00 54.43 O ATOM 418 CB LEU A 334 9.215 19.603 7.086 1.00 48.34 C ATOM 419 CG LEU A 334 9.884 20.875 6.552 1.00 62.36 C ATOM 420 CD1 LEU A 334 10.331 21.802 7.686 1.00 49.48 C ATOM 421 CD2 LEU A 334 11.047 20.538 5.630 1.00 64.34 C ATOM 422 H LEU A 334 10.593 17.534 6.390 1.00 0.00 H ATOM 423 N ALA A 335 8.609 18.908 10.070 1.00 43.80 N ATOM 424 CA ALA A 335 7.715 18.436 11.119 1.00 59.61 C ATOM 425 C ALA A 335 6.356 18.022 10.560 1.00 58.00 C ATOM 426 O ALA A 335 5.728 18.768 9.807 1.00 65.83 O ATOM 427 CB ALA A 335 7.539 19.514 12.176 1.00 39.34 C ATOM 428 H ALA A 335 8.941 19.893 10.094 1.00 0.00 H ATOM 429 N GLY A 336 5.910 16.828 10.939 1.00 64.19 N ATOM 430 CA GLY A 336 4.603 16.334 10.545 1.00 76.49 C ATOM 431 C GLY A 336 4.452 16.209 9.043 1.00 69.99 C ATOM 432 O GLY A 336 3.445 16.637 8.478 1.00 76.46 O ATOM 433 H GLY A 336 6.516 16.230 11.536 1.00 0.00 H ATOM 434 N SER A 337 5.455 15.618 8.402 1.00 58.94 N ATOM 435 CA SER A 337 5.478 15.486 6.950 1.00 63.23 C ATOM 436 C SER A 337 5.617 14.028 6.519 1.00 82.84 C ATOM 437 O SER A 337 6.114 13.189 7.266 1.00 54.29 O ATOM 438 CB SER A 337 6.625 16.309 6.367 1.00 64.50 C ATOM 439 OG SER A 337 7.876 15.785 6.777 1.00 51.40 O ATOM 440 HG SER A 337 7.934 15.808 7.765 1.00 0.00 H ATOM 441 H SER A 337 6.250 15.237 8.954 1.00 0.00 H ATOM 442 N VAL A 338 5.179 13.735 5.301 1.00 82.51 N ATOM 443 CA VAL A 338 5.251 12.380 4.766 1.00 84.77 C ATOM 444 C VAL A 338 6.692 11.890 4.643 1.00 84.99 C ATOM 445 O VAL A 338 6.967 10.700 4.805 1.00 67.25 O ATOM 446 CB VAL A 338 4.574 12.287 3.386 1.00 62.97 C ATOM 447 CG1 VAL A 338 3.067 12.403 3.536 1.00 63.62 C ATOM 448 CG2 VAL A 338 5.116 13.355 2.435 1.00 67.60 C ATOM 449 H VAL A 338 4.774 14.491 4.713 1.00 0.00 H ATOM 450 N ASP A 339 7.609 12.810 4.361 1.00 58.89 N ATOM 451 CA ASP A 339 9.016 12.461 4.217 1.00 55.49 C ATOM 452 C ASP A 339 9.578 12.027 5.566 1.00 79.45 C ATOM 453 O ASP A 339 10.555 11.277 5.631 1.00 43.61 O ATOM 454 CB ASP A 339 9.807 13.643 3.653 1.00 47.00 C ATOM 455 CG ASP A 339 9.110 14.298 2.472 1.00 88.47 C ATOM 456 OD1 ASP A 339 8.253 15.181 2.700 1.00 72.15 O ATOM 457 OD2 ASP A 339 9.409 13.924 1.318 1.00 75.09 O ATOM 458 H ASP A 339 7.316 13.800 4.241 1.00 0.00 H ATOM 459 N GLU A 340 8.942 12.494 6.638 1.00 50.18 N ATOM 460 CA GLU A 340 9.340 12.137 7.990 1.00 40.95 C ATOM 461 C GLU A 340 9.092 10.658 8.239 1.00 48.67 C ATOM 462 O GLU A 340 10.023 9.905 8.545 1.00 63.89 O ATOM 463 CB GLU A 340 8.578 12.991 9.014 1.00 37.94 C ATOM 464 CG GLU A 340 9.037 12.842 10.444 1.00 49.28 C ATOM 465 CD GLU A 340 8.392 13.874 11.348 1.00 51.70 C ATOM 466 OE1 GLU A 340 7.265 14.311 11.033 1.00 84.47 O ATOM 467 OE2 GLU A 340 9.008 14.259 12.363 1.00 63.92 O ATOM 468 H GLU A 340 8.134 13.135 6.504 1.00 0.00 H ATOM 469 N GLN A 341 7.835 10.245 8.113 1.00 62.93 N ATOM 470 CA GLN A 341 7.470 8.851 8.335 1.00 67.24 C ATOM 471 C GLN A 341 8.256 7.939 7.406 1.00 56.95 C ATOM 472 O GLN A 341 8.780 6.913 7.833 1.00 50.24 O ATOM 473 CB GLN A 341 5.963 8.656 8.152 1.00 73.94 C ATOM 474 CG GLN A 341 5.112 9.359 9.219 1.00 81.16 C ATOM 475 CD GLN A 341 3.604 9.227 8.998 1.00 90.03 C ATOM 476 OE1 GLN A 341 3.137 9.029 7.876 1.00 75.00 O ATOM 477 NE2 GLN A 341 2.840 9.354 10.075 1.00 77.08 N ATOM 478 HE22 GLN A 341 3.275 9.521 11.005 1.00 0.00 H ATOM 479 HE21 GLN A 341 1.806 9.287 9.990 1.00 0.00 H ATOM 480 H GLN A 341 7.097 10.930 7.851 1.00 0.00 H ATOM 481 N ASN A 342 8.366 8.347 6.146 1.00 66.70 N ATOM 482 CA ASN A 342 9.123 7.603 5.143 1.00 39.87 C ATOM 483 C ASN A 342 10.533 7.225 5.604 1.00 56.45 C ATOM 484 O ASN A 342 10.896 6.049 5.622 1.00 43.01 O ATOM 485 CB ASN A 342 9.198 8.425 3.857 1.00 61.32 C ATOM 486 CG ASN A 342 9.716 7.627 2.687 1.00 72.73 C ATOM 487 OD1 ASN A 342 10.911 7.348 2.590 1.00 62.20 O ATOM 488 ND2 ASN A 342 8.815 7.258 1.782 1.00 50.17 N ATOM 489 HD22 ASN A 342 7.816 7.517 1.907 1.00 0.00 H ATOM 490 HD21 ASN A 342 9.109 6.710 0.949 1.00 0.00 H ATOM 491 H ASN A 342 7.895 9.230 5.863 1.00 0.00 H ATOM 492 N ALA A 343 11.324 8.220 5.990 1.00 47.62 N ATOM 493 CA ALA A 343 12.702 7.971 6.400 1.00 57.70 C ATOM 494 C ALA A 343 12.759 7.164 7.699 1.00 65.84 C ATOM 495 O ALA A 343 13.633 6.312 7.873 1.00 62.58 O ATOM 496 CB ALA A 343 13.449 9.285 6.557 1.00 38.98 C ATOM 497 H ALA A 343 10.955 9.192 6.000 1.00 0.00 H ATOM 498 N LEU A 344 11.824 7.435 8.604 1.00 40.27 N ATOM 499 CA LEU A 344 11.733 6.696 9.860 1.00 47.28 C ATOM 500 C LEU A 344 11.425 5.207 9.613 1.00 51.59 C ATOM 501 O LEU A 344 12.033 4.324 10.225 1.00 39.36 O ATOM 502 CB LEU A 344 10.669 7.341 10.769 1.00 69.50 C ATOM 503 CG LEU A 344 9.205 6.885 10.697 1.00 80.50 C ATOM 504 CD1 LEU A 344 9.098 5.567 11.424 1.00100.26 C ATOM 505 CD2 LEU A 344 8.222 7.897 11.297 1.00 67.21 C ATOM 506 H LEU A 344 11.139 8.194 8.412 1.00 0.00 H ATOM 507 N ARG A 345 10.485 4.929 8.717 1.00 41.79 N ATOM 508 CA ARG A 345 10.062 3.555 8.465 1.00 36.86 C ATOM 509 C ARG A 345 11.109 2.732 7.729 1.00 35.28 C ATOM 510 O ARG A 345 11.166 1.513 7.890 1.00 29.56 O ATOM 511 CB ARG A 345 8.762 3.542 7.671 1.00 31.43 C ATOM 512 CG ARG A 345 7.555 3.953 8.491 1.00 44.99 C ATOM 513 CD ARG A 345 6.272 3.620 7.771 1.00 52.99 C ATOM 514 NE ARG A 345 6.242 4.211 6.436 1.00 57.07 N ATOM 515 CZ ARG A 345 5.278 5.004 5.973 1.00 78.15 C ATOM 516 NH1 ARG A 345 4.223 5.316 6.721 1.00 43.42 N ATOM 517 NH2 ARG A 345 5.370 5.487 4.741 1.00 59.96 N ATOM 518 HE ARG A 345 7.035 3.996 5.798 1.00 0.00 H ATOM 519 HH12 ARG A 345 3.481 5.937 6.340 1.00 0.00 H ATOM 520 HH11 ARG A 345 4.140 4.939 7.687 1.00 0.00 H ATOM 521 HH22 ARG A 345 4.623 6.107 4.369 1.00 0.00 H ATOM 522 HH21 ARG A 345 6.189 5.245 4.147 1.00 0.00 H ATOM 523 H ARG A 345 10.042 5.705 8.185 1.00 0.00 H ATOM 524 N GLU A 346 11.933 3.396 6.922 1.00 24.62 N ATOM 525 CA GLU A 346 13.014 2.714 6.220 1.00 24.53 C ATOM 526 C GLU A 346 13.871 1.947 7.220 1.00 32.56 C ATOM 527 O GLU A 346 14.100 0.751 7.066 1.00 29.15 O ATOM 528 CB GLU A 346 13.863 3.713 5.434 1.00 27.52 C ATOM 529 CG GLU A 346 14.984 3.074 4.629 1.00 22.32 C ATOM 530 CD GLU A 346 15.603 4.035 3.638 1.00 37.02 C ATOM 531 OE1 GLU A 346 15.650 5.248 3.939 1.00 38.11 O ATOM 532 OE2 GLU A 346 16.037 3.584 2.555 1.00 35.42 O ATOM 533 H GLU A 346 11.804 4.419 6.790 1.00 0.00 H ATOM 534 N VAL A 347 14.307 2.634 8.272 1.00 41.55 N ATOM 535 CA VAL A 347 15.183 2.037 9.275 1.00 26.64 C ATOM 536 C VAL A 347 14.486 0.937 10.081 1.00 29.22 C ATOM 537 O VAL A 347 15.077 -0.116 10.321 1.00 28.93 O ATOM 538 CB VAL A 347 15.729 3.118 10.242 1.00 49.40 C ATOM 539 CG1 VAL A 347 16.680 2.513 11.262 1.00 54.13 C ATOM 540 CG2 VAL A 347 16.437 4.222 9.461 1.00 44.46 C ATOM 541 H VAL A 347 14.015 3.626 8.383 1.00 0.00 H ATOM 542 N TYR A 348 13.244 1.174 10.510 1.00 25.34 N ATOM 543 CA TYR A 348 12.448 0.133 11.176 1.00 29.05 C ATOM 544 C TYR A 348 12.250 -1.113 10.313 1.00 31.85 C ATOM 545 O TYR A 348 12.320 -2.240 10.808 1.00 32.81 O ATOM 546 CB TYR A 348 11.059 0.660 11.556 1.00 29.89 C ATOM 547 CG TYR A 348 10.945 1.332 12.907 1.00 38.61 C ATOM 548 CD1 TYR A 348 11.439 0.735 14.060 1.00 51.56 C ATOM 549 CD2 TYR A 348 10.322 2.563 13.029 1.00 47.90 C ATOM 550 CE1 TYR A 348 11.321 1.359 15.293 1.00 53.85 C ATOM 551 CE2 TYR A 348 10.201 3.191 14.255 1.00 36.45 C ATOM 552 CZ TYR A 348 10.701 2.591 15.379 1.00 29.94 C ATOM 553 OH TYR A 348 10.562 3.232 16.596 1.00 37.09 O ATOM 554 HH TYR A 348 10.970 2.678 17.308 1.00 0.00 H ATOM 555 H TYR A 348 12.830 2.118 10.370 1.00 0.00 H ATOM 556 N ALA A 349 11.944 -0.910 9.035 1.00 29.67 N ATOM 557 CA ALA A 349 11.751 -2.038 8.131 1.00 35.21 C ATOM 558 C ALA A 349 13.030 -2.862 8.075 1.00 30.07 C ATOM 559 O ALA A 349 13.013 -4.079 8.275 1.00 31.33 O ATOM 560 CB ALA A 349 11.366 -1.563 6.758 1.00 23.50 C ATOM 561 H ALA A 349 11.841 0.061 8.677 1.00 0.00 H ATOM 562 N HIS A 350 14.140 -2.177 7.830 1.00 25.75 N ATOM 563 CA HIS A 350 15.440 -2.827 7.809 1.00 34.23 C ATOM 564 C HIS A 350 15.718 -3.554 9.122 1.00 31.71 C ATOM 565 O HIS A 350 16.290 -4.642 9.132 1.00 33.96 O ATOM 566 CB HIS A 350 16.529 -1.800 7.546 1.00 30.48 C ATOM 567 CG HIS A 350 16.688 -1.446 6.103 1.00 21.20 C ATOM 568 ND1 HIS A 350 17.097 -2.359 5.154 1.00 31.95 N ATOM 569 CD2 HIS A 350 16.525 -0.271 5.449 1.00 29.41 C ATOM 570 CE1 HIS A 350 17.170 -1.766 3.977 1.00 26.65 C ATOM 571 NE2 HIS A 350 16.828 -0.498 4.127 1.00 25.48 N ATOM 572 H HIS A 350 14.078 -1.155 7.649 1.00 0.00 H ATOM 573 N ALA A 351 15.302 -2.943 10.225 1.00 45.83 N ATOM 574 CA ALA A 351 15.518 -3.514 11.548 1.00 39.86 C ATOM 575 C ALA A 351 14.786 -4.843 11.714 1.00 41.92 C ATOM 576 O ALA A 351 15.364 -5.814 12.205 1.00 48.12 O ATOM 577 CB ALA A 351 15.077 -2.529 12.621 1.00 56.71 C ATOM 578 H ALA A 351 14.808 -2.031 10.142 1.00 0.00 H ATOM 579 N VAL A 352 13.518 -4.882 11.307 1.00 46.78 N ATOM 580 CA VAL A 352 12.700 -6.094 11.398 1.00 35.33 C ATOM 581 C VAL A 352 13.188 -7.136 10.403 1.00 28.38 C ATOM 582 O VAL A 352 13.330 -8.309 10.737 1.00 44.02 O ATOM 583 CB VAL A 352 11.184 -5.780 11.133 1.00 40.24 C ATOM 584 CG1 VAL A 352 10.332 -7.048 10.884 1.00 40.14 C ATOM 585 CG2 VAL A 352 10.602 -4.990 12.284 1.00 47.90 C ATOM 586 H VAL A 352 13.093 -4.020 10.910 1.00 0.00 H ATOM 587 N LEU A 353 13.444 -6.707 9.175 1.00 29.90 N ATOM 588 CA LEU A 353 13.732 -7.651 8.107 1.00 26.40 C ATOM 589 C LEU A 353 15.158 -8.191 8.181 1.00 38.66 C ATOM 590 O LEU A 353 15.386 -9.379 7.941 1.00 31.36 O ATOM 591 CB LEU A 353 13.474 -6.994 6.757 1.00 26.30 C ATOM 592 CG LEU A 353 11.987 -6.718 6.531 1.00 24.38 C ATOM 593 CD1 LEU A 353 11.812 -5.820 5.325 1.00 26.81 C ATOM 594 CD2 LEU A 353 11.183 -8.016 6.364 1.00 28.79 C ATOM 595 H LEU A 353 13.439 -5.687 8.974 1.00 0.00 H ATOM 596 N GLY A 354 16.109 -7.326 8.519 1.00 38.91 N ATOM 597 CA GLY A 354 17.482 -7.752 8.717 1.00 35.94 C ATOM 598 C GLY A 354 18.060 -8.367 7.461 1.00 35.58 C ATOM 599 O GLY A 354 17.950 -7.786 6.382 1.00 32.46 O ATOM 600 H GLY A 354 15.864 -6.323 8.644 1.00 0.00 H ATOM 601 N GLN A 355 18.655 -9.548 7.596 1.00 26.99 N ATOM 602 CA GLN A 355 19.409 -10.146 6.498 1.00 25.14 C ATOM 603 C GLN A 355 18.582 -11.190 5.724 1.00 22.02 C ATOM 604 O GLN A 355 18.072 -12.149 6.292 1.00 27.93 O ATOM 605 CB GLN A 355 20.700 -10.759 7.053 1.00 35.48 C ATOM 606 CG GLN A 355 21.725 -11.157 5.998 1.00 28.33 C ATOM 607 CD GLN A 355 21.448 -12.516 5.399 1.00 38.31 C ATOM 608 OE1 GLN A 355 21.193 -13.483 6.114 1.00 36.46 O ATOM 609 NE2 GLN A 355 21.496 -12.597 4.078 1.00 30.18 N ATOM 610 HE22 GLN A 355 21.716 -11.752 3.513 1.00 0.00 H ATOM 611 HE21 GLN A 355 21.314 -13.506 3.606 1.00 0.00 H ATOM 612 H GLN A 355 18.582 -10.056 8.501 1.00 0.00 H ATOM 613 N HIS A 356 18.453 -10.982 4.418 1.00 23.00 N ATOM 614 CA HIS A 356 17.756 -11.925 3.535 1.00 22.68 C ATOM 615 C HIS A 356 18.288 -11.726 2.125 1.00 19.50 C ATOM 616 O HIS A 356 18.539 -10.598 1.710 1.00 24.42 O ATOM 617 CB HIS A 356 16.237 -11.717 3.580 1.00 25.59 C ATOM 618 CG HIS A 356 15.458 -12.766 2.849 1.00 25.52 C ATOM 619 ND1 HIS A 356 15.260 -12.732 1.484 1.00 27.51 N ATOM 620 CD2 HIS A 356 14.822 -13.875 3.295 1.00 22.31 C ATOM 621 CE1 HIS A 356 14.542 -13.780 1.121 1.00 43.04 C ATOM 622 NE2 HIS A 356 14.263 -14.490 2.201 1.00 31.50 N ATOM 623 H HIS A 356 18.861 -10.119 4.006 1.00 0.00 H ATOM 624 N SER A 357 18.461 -12.823 1.394 1.00 24.78 N ATOM 625 CA SER A 357 19.109 -12.788 0.080 1.00 31.51 C ATOM 626 C SER A 357 18.412 -11.918 -0.958 1.00 38.59 C ATOM 627 O SER A 357 19.043 -11.465 -1.917 1.00 34.48 O ATOM 628 CB SER A 357 19.225 -14.206 -0.480 1.00 30.59 C ATOM 629 OG SER A 357 17.959 -14.843 -0.527 1.00 62.00 O ATOM 630 HG SER A 357 18.064 -15.757 -0.893 1.00 0.00 H ATOM 631 H SER A 357 18.126 -13.734 1.766 1.00 0.00 H ATOM 632 N HIS A 358 17.114 -11.705 -0.782 1.00 21.00 N ATOM 633 CA HIS A 358 16.328 -10.929 -1.740 1.00 17.48 C ATOM 634 C HIS A 358 15.753 -9.651 -1.129 1.00 17.15 C ATOM 635 O HIS A 358 14.788 -9.080 -1.641 1.00 17.59 O ATOM 636 CB HIS A 358 15.217 -11.799 -2.311 1.00 19.03 C ATOM 637 CG HIS A 358 15.724 -13.015 -3.022 1.00 21.49 C ATOM 638 ND1 HIS A 358 16.504 -12.940 -4.154 1.00 24.49 N ATOM 639 CD2 HIS A 358 15.576 -14.335 -2.752 1.00 26.04 C ATOM 640 CE1 HIS A 358 16.809 -14.161 -4.559 1.00 22.84 C ATOM 641 NE2 HIS A 358 16.260 -15.025 -3.724 1.00 30.66 N ATOM 642 H HIS A 358 16.644 -12.100 0.058 1.00 0.00 H ATOM 643 N VAL A 359 16.363 -9.213 -0.032 1.00 16.86 N ATOM 644 CA VAL A 359 16.139 -7.882 0.506 1.00 19.17 C ATOM 645 C VAL A 359 17.491 -7.193 0.661 1.00 19.13 C ATOM 646 O VAL A 359 18.445 -7.802 1.156 1.00 22.05 O ATOM 647 CB VAL A 359 15.438 -7.911 1.879 1.00 21.66 C ATOM 648 CG1 VAL A 359 15.146 -6.491 2.348 1.00 19.74 C ATOM 649 CG2 VAL A 359 14.155 -8.738 1.832 1.00 22.44 C ATOM 650 H VAL A 359 17.025 -9.847 0.459 1.00 0.00 H ATOM 651 N VAL A 360 17.563 -5.928 0.260 1.00 15.72 N ATOM 652 CA VAL A 360 18.796 -5.166 0.387 1.00 16.67 C ATOM 653 C VAL A 360 19.181 -5.091 1.855 1.00 16.23 C ATOM 654 O VAL A 360 18.382 -4.681 2.699 1.00 22.16 O ATOM 655 CB VAL A 360 18.654 -3.750 -0.187 1.00 19.99 C ATOM 656 CG1 VAL A 360 19.862 -2.888 0.177 1.00 19.39 C ATOM 657 CG2 VAL A 360 18.478 -3.808 -1.707 1.00 19.01 C ATOM 658 H VAL A 360 16.723 -5.474 -0.152 1.00 0.00 H ATOM 659 N ARG A 361 20.409 -5.493 2.154 1.00 19.38 N ATOM 660 CA ARG A 361 20.857 -5.564 3.534 1.00 20.36 C ATOM 661 C ARG A 361 21.214 -4.214 4.134 1.00 21.80 C ATOM 662 O ARG A 361 21.925 -3.409 3.543 1.00 17.73 O ATOM 663 CB ARG A 361 22.061 -6.479 3.647 1.00 18.99 C ATOM 664 CG ARG A 361 22.505 -6.652 5.065 1.00 28.18 C ATOM 665 CD ARG A 361 23.483 -7.762 5.138 1.00 26.41 C ATOM 666 NE ARG A 361 23.934 -8.004 6.496 1.00 30.00 N ATOM 667 CZ ARG A 361 24.890 -8.869 6.798 1.00 43.88 C ATOM 668 NH1 ARG A 361 25.475 -9.566 5.835 1.00 29.83 N ATOM 669 NH2 ARG A 361 25.260 -9.038 8.052 1.00 44.00 N ATOM 670 HE ARG A 361 23.485 -7.473 7.269 1.00 0.00 H ATOM 671 HH12 ARG A 361 26.226 -10.246 6.068 1.00 0.00 H ATOM 672 HH11 ARG A 361 25.183 -9.433 4.846 1.00 0.00 H ATOM 673 HH22 ARG A 361 26.011 -9.718 8.285 1.00 0.00 H ATOM 674 HH21 ARG A 361 24.801 -8.491 8.808 1.00 0.00 H ATOM 675 H ARG A 361 21.061 -5.761 1.389 1.00 0.00 H ATOM 676 N TYR A 362 20.725 -4.005 5.346 1.00 18.93 N ATOM 677 CA TYR A 362 21.021 -2.823 6.129 1.00 17.89 C ATOM 678 C TYR A 362 22.219 -3.070 7.023 1.00 18.67 C ATOM 679 O TYR A 362 22.334 -4.146 7.606 1.00 20.30 O ATOM 680 CB TYR A 362 19.784 -2.472 6.946 1.00 27.36 C ATOM 681 CG TYR A 362 19.991 -1.637 8.180 1.00 21.58 C ATOM 682 CD1 TYR A 362 19.962 -0.259 8.104 1.00 28.09 C ATOM 683 CD2 TYR A 362 20.143 -2.225 9.431 1.00 31.01 C ATOM 684 CE1 TYR A 362 20.116 0.516 9.224 1.00 26.32 C ATOM 685 CE2 TYR A 362 20.300 -1.454 10.560 1.00 31.19 C ATOM 686 CZ TYR A 362 20.284 -0.081 10.448 1.00 33.41 C ATOM 687 OH TYR A 362 20.435 0.711 11.557 1.00 33.43 O ATOM 688 HH TYR A 362 20.398 1.663 11.289 1.00 0.00 H ATOM 689 H TYR A 362 20.097 -4.725 5.757 1.00 0.00 H ATOM 690 N PHE A 363 23.107 -2.084 7.138 1.00 18.94 N ATOM 691 CA PHE A 363 24.245 -2.217 8.037 1.00 20.38 C ATOM 692 C PHE A 363 24.201 -1.237 9.202 1.00 22.74 C ATOM 693 O PHE A 363 24.490 -1.620 10.330 1.00 21.14 O ATOM 694 CB PHE A 363 25.552 -2.079 7.252 1.00 20.09 C ATOM 695 CG PHE A 363 25.872 -3.304 6.460 1.00 20.10 C ATOM 696 CD1 PHE A 363 26.552 -4.359 7.043 1.00 24.76 C ATOM 697 CD2 PHE A 363 25.432 -3.435 5.155 1.00 19.39 C ATOM 698 CE1 PHE A 363 26.817 -5.504 6.331 1.00 23.35 C ATOM 699 CE2 PHE A 363 25.687 -4.576 4.443 1.00 19.57 C ATOM 700 CZ PHE A 363 26.385 -5.612 5.027 1.00 20.53 C ATOM 701 H PHE A 363 22.987 -1.213 6.582 1.00 0.00 H ATOM 702 N SER A 364 23.848 0.015 8.948 1.00 20.16 N ATOM 703 CA SER A 364 23.695 0.975 10.034 1.00 25.19 C ATOM 704 C SER A 364 22.970 2.227 9.571 1.00 20.65 C ATOM 705 O SER A 364 22.856 2.495 8.374 1.00 20.07 O ATOM 706 CB SER A 364 25.059 1.362 10.632 1.00 26.59 C ATOM 707 OG SER A 364 25.824 2.138 9.730 1.00 22.95 O ATOM 708 HG SER A 364 25.982 1.619 8.902 1.00 0.00 H ATOM 709 H SER A 364 23.679 0.315 7.967 1.00 0.00 H ATOM 710 N ALA A 365 22.490 2.985 10.547 1.00 21.35 N ATOM 711 CA ALA A 365 21.835 4.256 10.315 1.00 21.61 C ATOM 712 C ALA A 365 22.178 5.200 11.450 1.00 22.85 C ATOM 713 O ALA A 365 22.220 4.796 12.613 1.00 23.79 O ATOM 714 CB ALA A 365 20.332 4.075 10.206 1.00 23.37 C ATOM 715 H ALA A 365 22.589 2.651 11.527 1.00 0.00 H ATOM 716 N TRP A 366 22.437 6.453 11.113 1.00 23.41 N ATOM 717 CA TRP A 366 22.777 7.447 12.110 1.00 24.77 C ATOM 718 C TRP A 366 22.449 8.821 11.575 1.00 25.45 C ATOM 719 O TRP A 366 22.035 8.968 10.419 1.00 26.16 O ATOM 720 CB TRP A 366 24.255 7.345 12.502 1.00 30.23 C ATOM 721 CG TRP A 366 25.245 7.791 11.449 1.00 25.33 C ATOM 722 CD1 TRP A 366 25.901 8.985 11.396 1.00 26.37 C ATOM 723 CD2 TRP A 366 25.706 7.030 10.325 1.00 24.28 C ATOM 724 NE1 TRP A 366 26.735 9.021 10.301 1.00 26.19 N ATOM 725 CE2 TRP A 366 26.638 7.831 9.631 1.00 24.91 C ATOM 726 CE3 TRP A 366 25.424 5.750 9.840 1.00 23.13 C ATOM 727 CZ2 TRP A 366 27.281 7.397 8.469 1.00 24.43 C ATOM 728 CZ3 TRP A 366 26.063 5.319 8.682 1.00 24.93 C ATOM 729 CH2 TRP A 366 26.982 6.143 8.011 1.00 24.53 C ATOM 730 HE1 TRP A 366 27.340 9.822 10.028 1.00 0.00 H ATOM 731 H TRP A 366 22.396 6.730 10.111 1.00 0.00 H ATOM 732 N ALA A 367 22.613 9.819 12.427 1.00 26.88 N ATOM 733 CA ALA A 367 22.330 11.192 12.065 1.00 27.95 C ATOM 734 C ALA A 367 23.419 12.076 12.617 1.00 40.97 C ATOM 735 O ALA A 367 23.953 11.825 13.696 1.00 36.81 O ATOM 736 CB ALA A 367 20.970 11.624 12.589 1.00 35.49 C ATOM 737 H ALA A 367 22.956 9.611 13.387 1.00 0.00 H ATOM 738 N GLU A 368 23.751 13.111 11.862 1.00 33.44 N ATOM 739 CA GLU A 368 24.754 14.068 12.282 1.00 45.91 C ATOM 740 C GLU A 368 24.690 15.259 11.350 1.00 37.74 C ATOM 741 O GLU A 368 24.365 15.110 10.172 1.00 34.57 O ATOM 742 CB GLU A 368 26.148 13.443 12.263 1.00 48.16 C ATOM 743 CG GLU A 368 26.573 12.957 10.890 1.00 31.54 C ATOM 744 CD GLU A 368 27.825 12.111 10.929 1.00 49.60 C ATOM 745 OE1 GLU A 368 28.133 11.459 9.909 1.00 28.95 O ATOM 746 OE2 GLU A 368 28.503 12.099 11.980 1.00 35.00 O ATOM 747 H GLU A 368 23.280 13.241 10.944 1.00 0.00 H ATOM 748 N ASP A 369 24.982 16.437 11.884 1.00 37.45 N ATOM 749 CA ASP A 369 25.023 17.649 11.086 1.00 55.53 C ATOM 750 C ASP A 369 23.704 17.854 10.354 1.00 40.09 C ATOM 751 O ASP A 369 23.680 18.228 9.182 1.00 40.15 O ATOM 752 CB ASP A 369 26.181 17.586 10.090 1.00 67.78 C ATOM 753 CG ASP A 369 26.559 18.950 9.548 1.00 87.85 C ATOM 754 OD1 ASP A 369 26.775 19.876 10.362 1.00 69.61 O ATOM 755 OD2 ASP A 369 26.630 19.093 8.309 1.00 74.41 O ATOM 756 H ASP A 369 25.187 16.494 12.902 1.00 0.00 H ATOM 757 N ASP A 370 22.608 17.580 11.057 1.00 37.97 N ATOM 758 CA ASP A 370 21.259 17.815 10.547 1.00 35.75 C ATOM 759 C ASP A 370 20.898 16.961 9.323 1.00 33.79 C ATOM 760 O ASP A 370 19.968 17.288 8.588 1.00 37.69 O ATOM 761 CB ASP A 370 21.077 19.303 10.223 1.00 38.08 C ATOM 762 CG ASP A 370 20.011 19.964 11.085 1.00 72.54 C ATOM 763 OD1 ASP A 370 19.988 19.706 12.307 1.00 62.04 O ATOM 764 OD2 ASP A 370 19.195 20.744 10.545 1.00 63.01 O ATOM 765 H ASP A 370 22.716 17.181 12.011 1.00 0.00 H ATOM 766 N HIS A 371 21.615 15.859 9.120 1.00 32.06 N ATOM 767 CA HIS A 371 21.266 14.907 8.072 1.00 30.22 C ATOM 768 C HIS A 371 21.112 13.502 8.625 1.00 28.61 C ATOM 769 O HIS A 371 21.722 13.149 9.636 1.00 28.71 O ATOM 770 CB HIS A 371 22.319 14.902 6.962 1.00 29.89 C ATOM 771 CG HIS A 371 22.379 16.178 6.184 1.00 32.70 C ATOM 772 ND1 HIS A 371 22.828 17.360 6.727 1.00 35.21 N ATOM 773 CD2 HIS A 371 22.044 16.452 4.900 1.00 36.94 C ATOM 774 CE1 HIS A 371 22.767 18.312 5.811 1.00 40.41 C ATOM 775 NE2 HIS A 371 22.298 17.787 4.696 1.00 36.04 N ATOM 776 H HIS A 371 22.442 15.672 9.722 1.00 0.00 H ATOM 777 N MET A 372 20.276 12.719 7.951 1.00 27.30 N ATOM 778 CA MET A 372 20.131 11.299 8.222 1.00 25.80 C ATOM 779 C MET A 372 20.984 10.501 7.255 1.00 24.57 C ATOM 780 O MET A 372 21.028 10.807 6.058 1.00 24.47 O ATOM 781 CB MET A 372 18.668 10.876 8.100 1.00 25.34 C ATOM 782 CG MET A 372 17.758 11.491 9.156 1.00 26.70 C ATOM 783 SD MET A 372 16.033 11.023 8.898 1.00 28.52 S ATOM 784 CE MET A 372 16.074 9.291 9.355 1.00 31.18 C ATOM 785 H MET A 372 19.700 13.142 7.196 1.00 0.00 H ATOM 786 N LEU A 373 21.635 9.466 7.769 1.00 23.86 N ATOM 787 CA LEU A 373 22.457 8.592 6.949 1.00 22.90 C ATOM 788 C LEU A 373 22.110 7.129 7.157 1.00 21.76 C ATOM 789 O LEU A 373 21.857 6.695 8.275 1.00 21.91 O ATOM 790 CB LEU A 373 23.934 8.824 7.245 1.00 23.61 C ATOM 791 CG LEU A 373 24.423 10.183 6.753 1.00 26.63 C ATOM 792 CD1 LEU A 373 24.510 11.164 7.899 1.00 26.25 C ATOM 793 CD2 LEU A 373 25.750 10.048 6.024 1.00 45.82 C ATOM 794 H LEU A 373 21.555 9.274 8.788 1.00 0.00 H ATOM 795 N ILE A 374 22.075 6.376 6.063 1.00 20.78 N ATOM 796 CA ILE A 374 21.851 4.946 6.139 1.00 19.89 C ATOM 797 C ILE A 374 22.846 4.242 5.229 1.00 23.44 C ATOM 798 O ILE A 374 23.094 4.661 4.094 1.00 19.42 O ATOM 799 CB ILE A 374 20.384 4.565 5.786 1.00 19.27 C ATOM 800 CG1 ILE A 374 20.198 3.049 5.860 1.00 18.56 C ATOM 801 CG2 ILE A 374 19.975 5.099 4.425 1.00 23.35 C ATOM 802 CD1 ILE A 374 18.744 2.619 6.012 1.00 29.76 C ATOM 803 H ILE A 374 22.211 6.822 5.133 1.00 0.00 H ATOM 804 N GLN A 375 23.446 3.192 5.778 1.00 19.39 N ATOM 805 CA GLN A 375 24.489 2.423 5.119 1.00 19.33 C ATOM 806 C GLN A 375 23.938 1.052 4.780 1.00 24.35 C ATOM 807 O GLN A 375 23.685 0.246 5.673 1.00 20.72 O ATOM 808 CB GLN A 375 25.719 2.310 6.028 1.00 20.19 C ATOM 809 CG GLN A 375 26.810 1.332 5.573 1.00 20.42 C ATOM 810 CD GLN A 375 27.626 0.770 6.735 1.00 21.30 C ATOM 811 OE1 GLN A 375 27.396 1.113 7.896 1.00 21.57 O ATOM 812 NE2 GLN A 375 28.590 -0.094 6.421 1.00 21.71 N ATOM 813 HE22 GLN A 375 28.750 -0.356 5.427 1.00 0.00 H ATOM 814 HE21 GLN A 375 29.183 -0.507 7.169 1.00 0.00 H ATOM 815 H GLN A 375 23.153 2.904 6.733 1.00 0.00 H ATOM 816 N ASN A 376 23.746 0.806 3.485 1.00 18.10 N ATOM 817 CA ASN A 376 23.237 -0.467 2.994 1.00 17.55 C ATOM 818 C ASN A 376 24.284 -1.160 2.133 1.00 17.81 C ATOM 819 O ASN A 376 25.297 -0.561 1.778 1.00 18.36 O ATOM 820 CB ASN A 376 21.953 -0.264 2.177 1.00 20.47 C ATOM 821 CG ASN A 376 20.751 0.069 3.040 1.00 16.93 C ATOM 822 OD1 ASN A 376 20.793 -0.061 4.265 1.00 19.94 O ATOM 823 ND2 ASN A 376 19.668 0.493 2.403 1.00 16.45 N ATOM 824 HD22 ASN A 376 19.678 0.588 1.367 1.00 0.00 H ATOM 825 HD21 ASN A 376 18.809 0.731 2.939 1.00 0.00 H ATOM 826 H ASN A 376 23.969 1.553 2.797 1.00 0.00 H ATOM 827 N GLU A 377 24.034 -2.418 1.798 1.00 17.79 N ATOM 828 CA GLU A 377 24.927 -3.128 0.901 1.00 19.83 C ATOM 829 C GLU A 377 24.913 -2.437 -0.450 1.00 17.84 C ATOM 830 O GLU A 377 23.939 -1.793 -0.823 1.00 17.23 O ATOM 831 CB GLU A 377 24.534 -4.599 0.755 1.00 25.18 C ATOM 832 CG GLU A 377 23.251 -4.836 0.023 1.00 25.18 C ATOM 833 CD GLU A 377 22.992 -6.307 -0.225 1.00 31.64 C ATOM 834 OE1 GLU A 377 21.948 -6.802 0.226 1.00 20.18 O ATOM 835 OE2 GLU A 377 23.821 -6.970 -0.879 1.00 28.13 O ATOM 836 H GLU A 377 23.194 -2.898 2.180 1.00 0.00 H ATOM 837 N TYR A 378 26.011 -2.577 -1.172 1.00 19.88 N ATOM 838 CA TYR A 378 26.112 -2.032 -2.510 1.00 20.79 C ATOM 839 C TYR A 378 25.825 -3.146 -3.504 1.00 21.74 C ATOM 840 O TYR A 378 26.497 -4.176 -3.508 1.00 19.25 O ATOM 841 CB TYR A 378 27.497 -1.423 -2.737 1.00 22.98 C ATOM 842 CG TYR A 378 27.743 -0.973 -4.153 1.00 20.21 C ATOM 843 CD1 TYR A 378 27.187 0.205 -4.632 1.00 19.97 C ATOM 844 CD2 TYR A 378 28.539 -1.720 -5.009 1.00 22.02 C ATOM 845 CE1 TYR A 378 27.411 0.621 -5.934 1.00 22.33 C ATOM 846 CE2 TYR A 378 28.774 -1.308 -6.305 1.00 22.10 C ATOM 847 CZ TYR A 378 28.204 -0.137 -6.758 1.00 22.31 C ATOM 848 OH TYR A 378 28.422 0.282 -8.044 1.00 26.05 O ATOM 849 HH TYR A 378 27.942 1.134 -8.198 1.00 0.00 H ATOM 850 H TYR A 378 26.821 -3.090 -0.770 1.00 0.00 H ATOM 851 N CYS A 379 24.789 -2.936 -4.310 1.00 17.90 N ATOM 852 CA CYS A 379 24.408 -3.838 -5.389 1.00 17.87 C ATOM 853 C CYS A 379 25.014 -3.317 -6.689 1.00 21.33 C ATOM 854 O CYS A 379 24.595 -2.279 -7.204 1.00 18.38 O ATOM 855 CB CYS A 379 22.890 -3.935 -5.491 1.00 23.39 C ATOM 856 SG CYS A 379 22.112 -4.519 -3.971 1.00 20.15 S ATOM 857 H CYS A 379 24.218 -2.079 -4.162 1.00 0.00 H ATOM 858 N ASN A 380 26.012 -4.023 -7.209 1.00 24.02 N ATOM 859 CA ASN A 380 26.839 -3.457 -8.268 1.00 20.52 C ATOM 860 C ASN A 380 26.129 -3.344 -9.617 1.00 23.24 C ATOM 861 O ASN A 380 26.646 -2.708 -10.527 1.00 24.87 O ATOM 862 CB ASN A 380 28.136 -4.261 -8.429 1.00 25.62 C ATOM 863 CG ASN A 380 27.907 -5.722 -8.773 1.00 28.11 C ATOM 864 OD1 ASN A 380 26.779 -6.189 -8.878 1.00 25.70 O ATOM 865 ND2 ASN A 380 29.000 -6.449 -8.966 1.00 36.56 N ATOM 866 HD22 ASN A 380 29.939 -6.013 -8.867 1.00 0.00 H ATOM 867 HD21 ASN A 380 28.918 -7.455 -9.217 1.00 0.00 H ATOM 868 H ASN A 380 26.204 -4.983 -6.859 1.00 0.00 H ATOM 869 N GLY A 381 24.946 -3.937 -9.739 1.00 19.48 N ATOM 870 CA GLY A 381 24.194 -3.880 -10.988 1.00 22.83 C ATOM 871 C GLY A 381 23.177 -2.753 -11.044 1.00 28.97 C ATOM 872 O GLY A 381 22.398 -2.651 -11.997 1.00 22.03 O ATOM 873 H GLY A 381 24.548 -4.452 -8.928 1.00 0.00 H ATOM 874 N GLY A 382 23.161 -1.908 -10.020 1.00 18.22 N ATOM 875 CA GLY A 382 22.188 -0.840 -9.957 1.00 17.71 C ATOM 876 C GLY A 382 20.799 -1.403 -9.737 1.00 18.33 C ATOM 877 O GLY A 382 20.636 -2.467 -9.129 1.00 20.68 O ATOM 878 H GLY A 382 23.856 -2.015 -9.254 1.00 0.00 H ATOM 879 N SER A 383 19.795 -0.681 -10.218 1.00 16.68 N ATOM 880 CA SER A 383 18.416 -1.134 -10.103 1.00 17.58 C ATOM 881 C SER A 383 17.932 -1.752 -11.399 1.00 20.00 C ATOM 882 O SER A 383 18.581 -1.633 -12.445 1.00 18.11 O ATOM 883 CB SER A 383 17.494 0.017 -9.735 1.00 20.19 C ATOM 884 OG SER A 383 17.327 0.882 -10.845 1.00 20.21 O ATOM 885 HG SER A 383 18.208 1.244 -11.115 1.00 0.00 H ATOM 886 H SER A 383 19.997 0.226 -10.686 1.00 0.00 H ATOM 887 N LEU A 384 16.766 -2.381 -11.336 1.00 15.70 N ATOM 888 CA LEU A 384 16.166 -2.956 -12.525 1.00 15.92 C ATOM 889 C LEU A 384 15.826 -1.845 -13.518 1.00 16.37 C ATOM 890 O LEU A 384 15.852 -2.064 -14.726 1.00 20.77 O ATOM 891 CB LEU A 384 14.927 -3.768 -12.152 1.00 17.87 C ATOM 892 CG LEU A 384 14.181 -4.433 -13.306 1.00 21.66 C ATOM 893 CD1 LEU A 384 15.058 -5.459 -14.004 1.00 20.28 C ATOM 894 CD2 LEU A 384 12.912 -5.069 -12.777 1.00 15.59 C ATOM 895 H LEU A 384 16.276 -2.463 -10.423 1.00 0.00 H ATOM 896 N ALA A 385 15.513 -0.653 -13.013 1.00 18.93 N ATOM 897 CA ALA A 385 15.296 0.499 -13.881 1.00 18.79 C ATOM 898 C ALA A 385 16.571 0.818 -14.664 1.00 22.73 C ATOM 899 O ALA A 385 16.503 1.138 -15.854 1.00 22.64 O ATOM 900 CB ALA A 385 14.850 1.707 -13.081 1.00 23.51 C ATOM 901 H ALA A 385 15.422 -0.542 -11.983 1.00 0.00 H ATOM 902 N ASP A 386 17.727 0.709 -14.008 1.00 20.40 N ATOM 903 CA ASP A 386 19.008 0.953 -14.682 1.00 18.76 C ATOM 904 C ASP A 386 19.275 -0.129 -15.724 1.00 19.11 C ATOM 905 O ASP A 386 19.739 0.158 -16.832 1.00 24.09 O ATOM 906 CB ASP A 386 20.163 1.010 -13.669 1.00 25.13 C ATOM 907 CG ASP A 386 20.006 2.139 -12.660 1.00 25.22 C ATOM 908 OD1 ASP A 386 19.776 3.292 -13.082 1.00 28.58 O ATOM 909 OD2 ASP A 386 20.109 1.877 -11.441 1.00 28.29 O ATOM 910 H ASP A 386 17.721 0.447 -13.002 1.00 0.00 H ATOM 911 N ALA A 387 18.958 -1.370 -15.374 1.00 19.48 N ATOM 912 CA ALA A 387 19.149 -2.495 -16.282 1.00 23.61 C ATOM 913 C ALA A 387 18.240 -2.388 -17.507 1.00 28.20 C ATOM 914 O ALA A 387 18.654 -2.692 -18.630 1.00 23.46 O ATOM 915 CB ALA A 387 18.903 -3.803 -15.554 1.00 21.30 C ATOM 916 H ALA A 387 18.563 -1.544 -14.428 1.00 0.00 H ATOM 917 N ILE A 388 16.999 -1.962 -17.293 1.00 20.83 N ATOM 918 CA ILE A 388 16.059 -1.763 -18.402 1.00 22.47 C ATOM 919 C ILE A 388 16.553 -0.646 -19.308 1.00 20.20 C ATOM 920 O ILE A 388 16.440 -0.736 -20.528 1.00 22.91 O ATOM 921 CB ILE A 388 14.639 -1.458 -17.879 1.00 23.47 C ATOM 922 CG1 ILE A 388 14.054 -2.738 -17.278 1.00 22.42 C ATOM 923 CG2 ILE A 388 13.723 -0.916 -18.984 1.00 20.66 C ATOM 924 CD1 ILE A 388 12.770 -2.547 -16.537 1.00 23.71 C ATOM 925 H ILE A 388 16.688 -1.766 -16.320 1.00 0.00 H ATOM 926 N SER A 389 17.116 0.402 -18.721 1.00 25.10 N ATOM 927 CA SER A 389 17.699 1.478 -19.519 1.00 27.25 C ATOM 928 C SER A 389 18.872 1.001 -20.366 1.00 31.42 C ATOM 929 O SER A 389 19.025 1.418 -21.515 1.00 32.22 O ATOM 930 CB SER A 389 18.158 2.626 -18.622 1.00 31.99 C ATOM 931 OG SER A 389 17.041 3.338 -18.126 1.00 41.12 O ATOM 932 HG SER A 389 16.468 2.726 -17.600 1.00 0.00 H ATOM 933 H SER A 389 17.143 0.458 -17.683 1.00 0.00 H ATOM 934 N GLU A 390 19.710 0.143 -19.797 1.00 31.77 N ATOM 935 CA GLU A 390 20.855 -0.381 -20.531 1.00 40.14 C ATOM 936 C GLU A 390 20.378 -1.223 -21.712 1.00 42.66 C ATOM 937 O GLU A 390 20.950 -1.150 -22.796 1.00 40.91 O ATOM 938 CB GLU A 390 21.760 -1.199 -19.604 1.00 32.46 C ATOM 939 CG GLU A 390 22.947 -1.862 -20.291 1.00 59.43 C ATOM 940 CD GLU A 390 23.859 -0.876 -21.004 1.00 75.74 C ATOM 941 OE1 GLU A 390 23.875 0.321 -20.636 1.00 45.75 O ATOM 942 OE2 GLU A 390 24.569 -1.307 -21.938 1.00 61.74 O ATOM 943 H GLU A 390 19.547 -0.159 -18.815 1.00 0.00 H ATOM 944 N ASN A 391 19.326 -2.012 -21.503 1.00 26.12 N ATOM 945 CA ASN A 391 18.714 -2.780 -22.592 1.00 30.38 C ATOM 946 C ASN A 391 18.179 -1.899 -23.709 1.00 42.25 C ATOM 947 O ASN A 391 18.291 -2.237 -24.895 1.00 37.75 O ATOM 948 CB ASN A 391 17.572 -3.645 -22.060 1.00 30.35 C ATOM 949 CG ASN A 391 18.062 -4.862 -21.307 1.00 49.80 C ATOM 950 OD1 ASN A 391 19.231 -5.230 -21.395 1.00 42.41 O ATOM 951 ND2 ASN A 391 17.161 -5.506 -20.575 1.00 34.00 N ATOM 952 HD22 ASN A 391 16.182 -5.158 -20.530 1.00 0.00 H ATOM 953 HD21 ASN A 391 17.434 -6.359 -20.046 1.00 0.00 H ATOM 954 H ASN A 391 18.929 -2.085 -20.545 1.00 0.00 H ATOM 955 N TYR A 392 17.569 -0.784 -23.328 1.00 31.36 N ATOM 956 CA TYR A 392 17.101 0.187 -24.310 1.00 35.59 C ATOM 957 C TYR A 392 18.276 0.702 -25.126 1.00 33.68 C ATOM 958 O TYR A 392 18.205 0.769 -26.353 1.00 36.18 O ATOM 959 CB TYR A 392 16.381 1.351 -23.626 1.00 53.74 C ATOM 960 CG TYR A 392 14.875 1.211 -23.567 1.00 71.31 C ATOM 961 CD1 TYR A 392 14.267 0.375 -22.633 1.00 39.19 C ATOM 962 CD2 TYR A 392 14.058 1.928 -24.437 1.00 39.90 C ATOM 963 CE1 TYR A 392 12.886 0.251 -22.572 1.00 42.81 C ATOM 964 CE2 TYR A 392 12.679 1.812 -24.384 1.00 60.76 C ATOM 965 CZ TYR A 392 12.098 0.973 -23.450 1.00 85.60 C ATOM 966 OH TYR A 392 10.727 0.855 -23.395 1.00 73.65 O ATOM 967 HH TYR A 392 10.480 0.220 -22.677 1.00 0.00 H ATOM 968 H TYR A 392 17.423 -0.600 -22.315 1.00 0.00 H ATOM 969 N ARG A 393 19.365 1.048 -24.443 1.00 34.29 N ATOM 970 CA ARG A 393 20.550 1.586 -25.110 1.00 35.88 C ATOM 971 C ARG A 393 21.101 0.626 -26.157 1.00 47.16 C ATOM 972 O ARG A 393 21.415 1.034 -27.272 1.00 58.11 O ATOM 973 CB ARG A 393 21.649 1.912 -24.094 1.00 36.55 C ATOM 974 CG ARG A 393 22.868 2.581 -24.723 1.00 63.12 C ATOM 975 CD ARG A 393 23.907 2.992 -23.688 1.00 64.71 C ATOM 976 NE ARG A 393 24.709 1.861 -23.228 1.00 48.58 N ATOM 977 CZ ARG A 393 25.706 1.315 -23.918 1.00 60.98 C ATOM 978 NH1 ARG A 393 26.035 1.786 -25.114 1.00 56.15 N ATOM 979 NH2 ARG A 393 26.376 0.289 -23.411 1.00 60.41 N ATOM 980 HE ARG A 393 24.485 1.455 -22.297 1.00 0.00 H ATOM 981 HH12 ARG A 393 26.816 1.353 -25.647 1.00 0.00 H ATOM 982 HH11 ARG A 393 25.512 2.588 -25.519 1.00 0.00 H ATOM 983 HH22 ARG A 393 27.156 -0.140 -23.949 1.00 0.00 H ATOM 984 HH21 ARG A 393 26.121 -0.087 -22.475 1.00 0.00 H ATOM 985 H ARG A 393 19.373 0.933 -23.409 1.00 0.00 H ATOM 986 N ILE A 394 21.213 -0.650 -25.805 1.00 33.68 N ATOM 987 CA ILE A 394 21.795 -1.627 -26.719 1.00 43.71 C ATOM 988 C ILE A 394 20.713 -2.429 -27.440 1.00 49.46 C ATOM 989 O ILE A 394 21.007 -3.422 -28.103 1.00 45.29 O ATOM 990 CB ILE A 394 22.757 -2.569 -25.967 1.00 50.56 C ATOM 991 CG1 ILE A 394 21.987 -3.483 -25.003 1.00 61.10 C ATOM 992 CG2 ILE A 394 23.815 -1.725 -25.253 1.00 52.59 C ATOM 993 CD1 ILE A 394 22.862 -4.247 -24.012 1.00 52.40 C ATOM 994 H ILE A 394 20.882 -0.956 -24.868 1.00 0.00 H ATOM 995 N MET A 395 19.469 -1.964 -27.328 1.00 30.22 N ATOM 996 CA MET A 395 18.312 -2.621 -27.926 1.00 38.04 C ATOM 997 C MET A 395 18.341 -4.117 -27.675 1.00 41.32 C ATOM 998 O MET A 395 18.178 -4.911 -28.590 1.00 33.01 O ATOM 999 CB MET A 395 18.244 -2.316 -29.430 1.00 35.35 C ATOM 1000 CG MET A 395 18.279 -0.825 -29.703 1.00 37.23 C ATOM 1001 SD MET A 395 17.880 -0.370 -31.392 1.00 41.70 S ATOM 1002 CE MET A 395 18.173 1.392 -31.289 1.00 42.38 C ATOM 1003 H MET A 395 19.315 -1.089 -26.787 1.00 0.00 H ATOM 1004 N SER A 396 18.576 -4.486 -26.422 1.00 37.09 N ATOM 1005 CA SER A 396 18.437 -5.866 -25.998 1.00 42.41 C ATOM 1006 C SER A 396 17.185 -5.974 -25.157 1.00 43.35 C ATOM 1007 O SER A 396 16.502 -4.979 -24.915 1.00 34.41 O ATOM 1008 CB SER A 396 19.657 -6.335 -25.204 1.00 53.55 C ATOM 1009 OG SER A 396 19.499 -7.686 -24.808 1.00 64.71 O ATOM 1010 HG SER A 396 20.296 -7.974 -24.296 1.00 0.00 H ATOM 1011 H SER A 396 18.867 -3.768 -25.728 1.00 0.00 H ATOM 1012 N TYR A 397 16.879 -7.183 -24.713 1.00 33.04 N ATOM 1013 CA TYR A 397 15.755 -7.383 -23.813 1.00 63.86 C ATOM 1014 C TYR A 397 15.932 -8.644 -22.990 1.00 28.64 C ATOM 1015 O TYR A 397 16.655 -9.561 -23.377 1.00 40.26 O ATOM 1016 CB TYR A 397 14.447 -7.454 -24.595 1.00 47.70 C ATOM 1017 CG TYR A 397 14.379 -8.608 -25.566 1.00 43.38 C ATOM 1018 CD1 TYR A 397 14.887 -8.483 -26.849 1.00 48.81 C ATOM 1019 CD2 TYR A 397 13.799 -9.819 -25.204 1.00 65.09 C ATOM 1020 CE1 TYR A 397 14.828 -9.529 -27.749 1.00 44.47 C ATOM 1021 CE2 TYR A 397 13.734 -10.878 -26.098 1.00 43.04 C ATOM 1022 CZ TYR A 397 14.252 -10.724 -27.372 1.00 52.55 C ATOM 1023 OH TYR A 397 14.202 -11.752 -28.282 1.00 53.34 O ATOM 1024 HH TYR A 397 13.258 -12.002 -28.444 1.00 0.00 H ATOM 1025 H TYR A 397 17.450 -8.000 -25.012 1.00 0.00 H ATOM 1026 N PHE A 398 15.273 -8.670 -21.838 1.00 22.62 N ATOM 1027 CA PHE A 398 15.235 -9.857 -21.004 1.00 30.48 C ATOM 1028 C PHE A 398 14.404 -10.963 -21.648 1.00 33.65 C ATOM 1029 O PHE A 398 13.220 -10.773 -21.936 1.00 31.49 O ATOM 1030 CB PHE A 398 14.655 -9.522 -19.638 1.00 20.59 C ATOM 1031 CG PHE A 398 15.509 -8.603 -18.827 1.00 36.02 C ATOM 1032 CD1 PHE A 398 16.710 -9.040 -18.296 1.00 55.91 C ATOM 1033 CD2 PHE A 398 15.100 -7.308 -18.576 1.00 21.77 C ATOM 1034 CE1 PHE A 398 17.493 -8.194 -17.536 1.00 45.94 C ATOM 1035 CE2 PHE A 398 15.873 -6.458 -17.811 1.00 32.87 C ATOM 1036 CZ PHE A 398 17.073 -6.901 -17.292 1.00 34.91 C ATOM 1037 H PHE A 398 14.770 -7.816 -21.524 1.00 0.00 H ATOM 1038 N LYS A 399 15.031 -12.115 -21.858 1.00 23.33 N ATOM 1039 CA LYS A 399 14.356 -13.288 -22.392 1.00 28.25 C ATOM 1040 C LYS A 399 13.443 -13.888 -21.327 1.00 23.62 C ATOM 1041 O LYS A 399 13.524 -13.519 -20.156 1.00 22.60 O ATOM 1042 CB LYS A 399 15.378 -14.328 -22.855 1.00 39.66 C ATOM 1043 CG LYS A 399 16.093 -13.997 -24.159 1.00 55.44 C ATOM 1044 CD LYS A 399 16.855 -15.208 -24.718 1.00 66.36 C ATOM 1045 CE LYS A 399 18.103 -15.583 -23.902 1.00 75.88 C ATOM 1046 NZ LYS A 399 17.838 -16.206 -22.567 1.00 71.14 N ATOM 1047 HZ1 LYS A 399 17.291 -15.545 -21.980 1.00 0.00 H ATOM 1048 HZ2 LYS A 399 17.297 -17.085 -22.697 1.00 0.00 H ATOM 1049 HZ3 LYS A 399 18.742 -16.420 -22.100 1.00 0.00 H ATOM 1050 H LYS A 399 16.044 -12.181 -21.632 1.00 0.00 H ATOM 1051 N GLU A 400 12.586 -14.821 -21.729 1.00 24.39 N ATOM 1052 CA GLU A 400 11.607 -15.372 -20.805 1.00 27.27 C ATOM 1053 C GLU A 400 12.278 -16.016 -19.589 1.00 24.05 C ATOM 1054 O GLU A 400 11.805 -15.849 -18.471 1.00 23.21 O ATOM 1055 CB GLU A 400 10.702 -16.394 -21.506 1.00 27.81 C ATOM 1056 CG GLU A 400 9.628 -16.947 -20.575 1.00 30.45 C ATOM 1057 CD GLU A 400 8.530 -17.715 -21.291 1.00 26.32 C ATOM 1058 OE1 GLU A 400 7.751 -18.406 -20.602 1.00 34.47 O ATOM 1059 OE2 GLU A 400 8.441 -17.640 -22.532 1.00 33.34 O ATOM 1060 H GLU A 400 12.616 -15.160 -22.712 1.00 0.00 H ATOM 1061 N ALA A 401 13.373 -16.746 -19.799 1.00 26.03 N ATOM 1062 CA ALA A 401 14.068 -17.392 -18.681 1.00 29.98 C ATOM 1063 C ALA A 401 14.503 -16.375 -17.626 1.00 31.66 C ATOM 1064 O ALA A 401 14.435 -16.639 -16.424 1.00 26.36 O ATOM 1065 CB ALA A 401 15.274 -18.168 -19.182 1.00 31.13 C ATOM 1066 H ALA A 401 13.739 -16.859 -20.766 1.00 0.00 H ATOM 1067 N GLU A 402 14.959 -15.217 -18.086 1.00 26.12 N ATOM 1068 CA GLU A 402 15.399 -14.156 -17.197 1.00 22.51 C ATOM 1069 C GLU A 402 14.223 -13.491 -16.484 1.00 23.82 C ATOM 1070 O GLU A 402 14.325 -13.143 -15.311 1.00 20.02 O ATOM 1071 CB GLU A 402 16.197 -13.119 -17.982 1.00 29.48 C ATOM 1072 CG GLU A 402 17.483 -13.669 -18.584 1.00 33.88 C ATOM 1073 CD GLU A 402 18.183 -12.666 -19.487 1.00 49.25 C ATOM 1074 OE1 GLU A 402 17.586 -12.260 -20.509 1.00 36.35 O ATOM 1075 OE2 GLU A 402 19.328 -12.281 -19.172 1.00 67.54 O ATOM 1076 H GLU A 402 15.003 -15.064 -19.114 1.00 0.00 H ATOM 1077 N LEU A 403 13.110 -13.314 -17.190 1.00 20.70 N ATOM 1078 CA LEU A 403 11.905 -12.735 -16.599 1.00 19.85 C ATOM 1079 C LEU A 403 11.328 -13.642 -15.514 1.00 20.03 C ATOM 1080 O LEU A 403 10.826 -13.165 -14.492 1.00 19.33 O ATOM 1081 CB LEU A 403 10.848 -12.476 -17.685 1.00 20.09 C ATOM 1082 CG LEU A 403 11.282 -11.448 -18.737 1.00 22.38 C ATOM 1083 CD1 LEU A 403 10.387 -11.472 -19.966 1.00 23.98 C ATOM 1084 CD2 LEU A 403 11.316 -10.062 -18.141 1.00 23.77 C ATOM 1085 H LEU A 403 13.097 -13.596 -18.191 1.00 0.00 H ATOM 1086 N LYS A 404 11.391 -14.949 -15.738 1.00 21.18 N ATOM 1087 CA LYS A 404 10.899 -15.904 -14.746 1.00 23.35 C ATOM 1088 C LYS A 404 11.756 -15.838 -13.483 1.00 24.07 C ATOM 1089 O LYS A 404 11.249 -15.870 -12.354 1.00 21.78 O ATOM 1090 CB LYS A 404 10.909 -17.324 -15.317 1.00 25.57 C ATOM 1091 CG LYS A 404 9.850 -17.588 -16.380 1.00 24.70 C ATOM 1092 CD LYS A 404 10.073 -18.960 -17.023 1.00 25.70 C ATOM 1093 CE LYS A 404 8.836 -19.482 -17.729 1.00 48.05 C ATOM 1094 NZ LYS A 404 9.111 -20.762 -18.451 1.00 53.37 N ATOM 1095 HZ1 LYS A 404 9.853 -20.605 -19.162 1.00 0.00 H ATOM 1096 HZ2 LYS A 404 9.428 -21.481 -17.770 1.00 0.00 H ATOM 1097 HZ3 LYS A 404 8.242 -21.087 -18.921 1.00 0.00 H ATOM 1098 H LYS A 404 11.795 -15.298 -16.630 1.00 0.00 H ATOM 1099 N ASP A 405 13.062 -15.739 -13.690 1.00 21.42 N ATOM 1100 CA ASP A 405 14.023 -15.640 -12.598 1.00 23.39 C ATOM 1101 C ASP A 405 13.803 -14.352 -11.786 1.00 19.78 C ATOM 1102 O ASP A 405 13.827 -14.365 -10.550 1.00 20.72 O ATOM 1103 CB ASP A 405 15.442 -15.704 -13.173 1.00 21.79 C ATOM 1104 CG ASP A 405 16.518 -15.703 -12.103 1.00 36.24 C ATOM 1105 OD1 ASP A 405 16.390 -16.454 -11.113 1.00 32.78 O ATOM 1106 OD2 ASP A 405 17.506 -14.957 -12.263 1.00 38.63 O ATOM 1107 H ASP A 405 13.414 -15.732 -14.669 1.00 0.00 H ATOM 1108 N LEU A 406 13.569 -13.245 -12.482 1.00 20.87 N ATOM 1109 CA LEU A 406 13.228 -11.988 -11.823 1.00 21.76 C ATOM 1110 C LEU A 406 11.976 -12.157 -10.979 1.00 19.42 C ATOM 1111 O LEU A 406 11.938 -11.755 -9.820 1.00 17.48 O ATOM 1112 CB LEU A 406 13.017 -10.867 -12.846 1.00 17.46 C ATOM 1113 CG LEU A 406 12.364 -9.574 -12.349 1.00 16.64 C ATOM 1114 CD1 LEU A 406 13.218 -8.867 -11.296 1.00 18.29 C ATOM 1115 CD2 LEU A 406 12.088 -8.658 -13.539 1.00 20.13 C ATOM 1116 H LEU A 406 13.630 -13.275 -13.520 1.00 0.00 H ATOM 1117 N LEU A 407 10.946 -12.751 -11.563 1.00 20.85 N ATOM 1118 CA LEU A 407 9.679 -12.902 -10.857 1.00 18.49 C ATOM 1119 C LEU A 407 9.817 -13.816 -9.642 1.00 20.22 C ATOM 1120 O LEU A 407 9.265 -13.534 -8.574 1.00 21.66 O ATOM 1121 CB LEU A 407 8.601 -13.441 -11.808 1.00 21.95 C ATOM 1122 CG LEU A 407 7.202 -13.604 -11.206 1.00 19.62 C ATOM 1123 CD1 LEU A 407 6.766 -12.338 -10.507 1.00 22.06 C ATOM 1124 CD2 LEU A 407 6.185 -13.986 -12.281 1.00 22.87 C ATOM 1125 H LEU A 407 11.042 -13.113 -12.533 1.00 0.00 H ATOM 1126 N LEU A 408 10.557 -14.907 -9.797 1.00 19.90 N ATOM 1127 CA LEU A 408 10.727 -15.864 -8.710 1.00 21.19 C ATOM 1128 C LEU A 408 11.532 -15.266 -7.562 1.00 22.26 C ATOM 1129 O LEU A 408 11.185 -15.445 -6.393 1.00 20.41 O ATOM 1130 CB LEU A 408 11.407 -17.136 -9.214 1.00 25.68 C ATOM 1131 CG LEU A 408 11.699 -18.224 -8.176 1.00 32.77 C ATOM 1132 CD1 LEU A 408 10.410 -18.777 -7.582 1.00 33.14 C ATOM 1133 CD2 LEU A 408 12.517 -19.341 -8.799 1.00 34.28 C ATOM 1134 H LEU A 408 11.024 -15.082 -10.710 1.00 0.00 H ATOM 1135 N GLN A 409 12.604 -14.556 -7.892 1.00 20.89 N ATOM 1136 CA GLN A 409 13.492 -14.009 -6.869 1.00 18.99 C ATOM 1137 C GLN A 409 12.828 -12.899 -6.052 1.00 19.48 C ATOM 1138 O GLN A 409 12.905 -12.893 -4.821 1.00 19.83 O ATOM 1139 CB GLN A 409 14.769 -13.477 -7.503 1.00 22.01 C ATOM 1140 CG GLN A 409 15.739 -14.550 -7.943 1.00 27.32 C ATOM 1141 CD GLN A 409 17.129 -13.995 -8.158 1.00 27.07 C ATOM 1142 OE1 GLN A 409 17.591 -13.156 -7.394 1.00 24.12 O ATOM 1143 NE2 GLN A 409 17.793 -14.444 -9.210 1.00 22.81 N ATOM 1144 HE22 GLN A 409 17.361 -15.157 -9.832 1.00 0.00 H ATOM 1145 HE21 GLN A 409 18.747 -14.084 -9.415 1.00 0.00 H ATOM 1146 H GLN A 409 12.815 -14.386 -8.896 1.00 0.00 H ATOM 1147 N VAL A 410 12.186 -11.954 -6.729 1.00 17.41 N ATOM 1148 CA VAL A 410 11.492 -10.889 -6.018 1.00 18.26 C ATOM 1149 C VAL A 410 10.283 -11.478 -5.300 1.00 20.84 C ATOM 1150 O VAL A 410 9.912 -11.015 -4.219 1.00 18.85 O ATOM 1151 CB VAL A 410 11.058 -9.750 -6.955 1.00 19.61 C ATOM 1152 CG1 VAL A 410 10.304 -8.663 -6.176 1.00 17.30 C ATOM 1153 CG2 VAL A 410 12.267 -9.146 -7.648 1.00 19.40 C ATOM 1154 H VAL A 410 12.179 -11.974 -7.769 1.00 0.00 H ATOM 1155 N GLY A 411 9.685 -12.506 -5.897 1.00 23.11 N ATOM 1156 CA GLY A 411 8.618 -13.253 -5.250 1.00 22.56 C ATOM 1157 C GLY A 411 9.046 -13.832 -3.914 1.00 22.79 C ATOM 1158 O GLY A 411 8.311 -13.755 -2.927 1.00 25.12 O ATOM 1159 H GLY A 411 9.989 -12.783 -6.852 1.00 0.00 H ATOM 1160 N ARG A 412 10.243 -14.409 -3.868 1.00 21.97 N ATOM 1161 CA ARG A 412 10.768 -14.950 -2.618 1.00 27.08 C ATOM 1162 C ARG A 412 11.029 -13.845 -1.606 1.00 23.31 C ATOM 1163 O ARG A 412 10.844 -14.042 -0.410 1.00 26.11 O ATOM 1164 CB ARG A 412 12.045 -15.745 -2.870 1.00 24.05 C ATOM 1165 CG ARG A 412 11.773 -17.113 -3.456 1.00 29.34 C ATOM 1166 CD ARG A 412 13.011 -17.736 -4.054 1.00 33.34 C ATOM 1167 NE ARG A 412 12.794 -19.146 -4.356 1.00 31.67 N ATOM 1168 CZ ARG A 412 13.452 -19.833 -5.284 1.00 38.22 C ATOM 1169 NH1 ARG A 412 13.173 -21.114 -5.475 1.00 41.21 N ATOM 1170 NH2 ARG A 412 14.380 -19.248 -6.029 1.00 53.18 N ATOM 1171 HE ARG A 412 12.071 -19.651 -3.805 1.00 0.00 H ATOM 1172 HH12 ARG A 412 13.686 -21.655 -6.200 1.00 0.00 H ATOM 1173 HH11 ARG A 412 12.441 -21.578 -4.900 1.00 0.00 H ATOM 1174 HH22 ARG A 412 14.888 -19.796 -6.752 1.00 0.00 H ATOM 1175 HH21 ARG A 412 14.600 -18.241 -5.890 1.00 0.00 H ATOM 1176 H ARG A 412 10.813 -14.476 -4.735 1.00 0.00 H ATOM 1177 N GLY A 413 11.443 -12.680 -2.089 1.00 23.38 N ATOM 1178 CA GLY A 413 11.644 -11.531 -1.226 1.00 18.20 C ATOM 1179 C GLY A 413 10.336 -11.080 -0.599 1.00 21.73 C ATOM 1180 O GLY A 413 10.272 -10.825 0.612 1.00 19.67 O ATOM 1181 H GLY A 413 11.627 -12.589 -3.108 1.00 0.00 H ATOM 1182 N LEU A 414 9.289 -10.983 -1.417 1.00 18.46 N ATOM 1183 CA LEU A 414 7.954 -10.629 -0.922 1.00 27.04 C ATOM 1184 C LEU A 414 7.400 -11.661 0.049 1.00 25.31 C ATOM 1185 O LEU A 414 6.748 -11.310 1.036 1.00 21.59 O ATOM 1186 CB LEU A 414 6.968 -10.466 -2.081 1.00 23.19 C ATOM 1187 CG LEU A 414 7.081 -9.198 -2.925 1.00 24.40 C ATOM 1188 CD1 LEU A 414 5.964 -9.200 -3.947 1.00 19.60 C ATOM 1189 CD2 LEU A 414 7.014 -7.942 -2.074 1.00 20.64 C ATOM 1190 H LEU A 414 9.421 -11.163 -2.433 1.00 0.00 H ATOM 1191 N ARG A 415 7.633 -12.935 -0.236 1.00 22.73 N ATOM 1192 CA ARG A 415 7.136 -13.980 0.634 1.00 27.10 C ATOM 1193 C ARG A 415 7.729 -13.771 2.018 1.00 32.47 C ATOM 1194 O ARG A 415 7.024 -13.868 3.020 1.00 31.00 O ATOM 1195 CB ARG A 415 7.478 -15.368 0.102 1.00 23.35 C ATOM 1196 CG ARG A 415 6.875 -16.478 0.946 1.00 25.22 C ATOM 1197 CD ARG A 415 7.201 -17.863 0.425 1.00 35.90 C ATOM 1198 NE ARG A 415 8.636 -18.088 0.276 1.00 36.20 N ATOM 1199 CZ ARG A 415 9.172 -19.222 -0.167 1.00 59.95 C ATOM 1200 NH1 ARG A 415 8.393 -20.244 -0.500 1.00 62.67 N ATOM 1201 NH2 ARG A 415 10.489 -19.338 -0.275 1.00 39.77 N ATOM 1202 HE ARG A 415 9.280 -17.313 0.532 1.00 0.00 H ATOM 1203 HH12 ARG A 415 8.816 -21.129 -0.846 1.00 0.00 H ATOM 1204 HH11 ARG A 415 7.360 -20.160 -0.415 1.00 0.00 H ATOM 1205 HH22 ARG A 415 10.906 -20.225 -0.622 1.00 0.00 H ATOM 1206 HH21 ARG A 415 11.104 -18.542 -0.013 1.00 0.00 H ATOM 1207 H ARG A 415 8.175 -13.184 -1.088 1.00 0.00 H ATOM 1208 N TYR A 416 9.018 -13.449 2.068 1.00 24.19 N ATOM 1209 CA TYR A 416 9.676 -13.198 3.346 1.00 27.90 C ATOM 1210 C TYR A 416 9.107 -11.958 4.047 1.00 25.70 C ATOM 1211 O TYR A 416 8.747 -12.013 5.225 1.00 27.05 O ATOM 1212 CB TYR A 416 11.189 -13.036 3.158 1.00 28.45 C ATOM 1213 CG TYR A 416 11.896 -12.649 4.440 1.00 23.24 C ATOM 1214 CD1 TYR A 416 11.861 -13.483 5.546 1.00 30.48 C ATOM 1215 CD2 TYR A 416 12.586 -11.449 4.550 1.00 24.88 C ATOM 1216 CE1 TYR A 416 12.492 -13.137 6.727 1.00 30.80 C ATOM 1217 CE2 TYR A 416 13.227 -11.093 5.739 1.00 26.53 C ATOM 1218 CZ TYR A 416 13.174 -11.943 6.820 1.00 34.43 C ATOM 1219 OH TYR A 416 13.809 -11.607 8.006 1.00 37.28 O ATOM 1220 HH TYR A 416 14.778 -11.495 7.840 1.00 0.00 H ATOM 1221 H TYR A 416 9.564 -13.375 1.186 1.00 0.00 H ATOM 1222 N ILE A 417 9.041 -10.840 3.332 1.00 20.70 N ATOM 1223 CA ILE A 417 8.508 -9.604 3.899 1.00 21.09 C ATOM 1224 C ILE A 417 7.087 -9.817 4.407 1.00 28.49 C ATOM 1225 O ILE A 417 6.744 -9.378 5.505 1.00 24.34 O ATOM 1226 CB ILE A 417 8.534 -8.461 2.868 1.00 19.44 C ATOM 1227 CG1 ILE A 417 9.983 -8.073 2.558 1.00 24.12 C ATOM 1228 CG2 ILE A 417 7.790 -7.235 3.384 1.00 20.70 C ATOM 1229 CD1 ILE A 417 10.130 -7.138 1.374 1.00 22.64 C ATOM 1230 H ILE A 417 9.376 -10.845 2.347 1.00 0.00 H ATOM 1231 N HIS A 418 6.263 -10.496 3.616 1.00 22.41 N ATOM 1232 CA HIS A 418 4.883 -10.748 4.015 1.00 26.28 C ATOM 1233 C HIS A 418 4.801 -11.693 5.215 1.00 31.15 C ATOM 1234 O HIS A 418 3.902 -11.559 6.041 1.00 28.76 O ATOM 1235 CB HIS A 418 4.075 -11.312 2.840 1.00 23.89 C ATOM 1236 CG HIS A 418 3.895 -10.341 1.718 1.00 22.77 C ATOM 1237 ND1 HIS A 418 3.302 -10.683 0.524 1.00 22.76 N ATOM 1238 CD2 HIS A 418 4.243 -9.037 1.605 1.00 25.90 C ATOM 1239 CE1 HIS A 418 3.287 -9.632 -0.276 1.00 21.83 C ATOM 1240 NE2 HIS A 418 3.857 -8.621 0.355 1.00 21.40 N ATOM 1241 H HIS A 418 6.606 -10.852 2.701 1.00 0.00 H ATOM 1242 N SER A 419 5.732 -12.637 5.323 1.00 28.23 N ATOM 1243 CA SER A 419 5.714 -13.575 6.452 1.00 33.84 C ATOM 1244 C SER A 419 6.063 -12.882 7.770 1.00 30.14 C ATOM 1245 O SER A 419 5.779 -13.404 8.848 1.00 30.43 O ATOM 1246 CB SER A 419 6.682 -14.736 6.214 1.00 31.15 C ATOM 1247 OG SER A 419 8.026 -14.323 6.370 1.00 32.39 O ATOM 1248 HG SER A 419 8.227 -13.605 5.719 1.00 0.00 H ATOM 1249 H SER A 419 6.478 -12.711 4.602 1.00 0.00 H ATOM 1250 N MET A 420 6.681 -11.710 7.684 1.00 28.99 N ATOM 1251 CA MET A 420 7.023 -10.937 8.872 1.00 39.53 C ATOM 1252 C MET A 420 5.938 -9.904 9.158 1.00 36.24 C ATOM 1253 O MET A 420 6.145 -8.975 9.937 1.00 31.24 O ATOM 1254 CB MET A 420 8.381 -10.259 8.694 1.00 27.44 C ATOM 1255 CG MET A 420 9.509 -11.239 8.397 1.00 31.77 C ATOM 1256 SD MET A 420 10.042 -12.150 9.861 1.00 47.19 S ATOM 1257 CE MET A 420 11.033 -10.888 10.659 1.00 51.97 C ATOM 1258 H MET A 420 6.927 -11.334 6.746 1.00 0.00 H ATOM 1259 N SER A 421 4.785 -10.087 8.515 1.00 31.76 N ATOM 1260 CA SER A 421 3.608 -9.244 8.707 1.00 28.79 C ATOM 1261 C SER A 421 3.814 -7.819 8.185 1.00 33.82 C ATOM 1262 O SER A 421 3.171 -6.881 8.659 1.00 34.73 O ATOM 1263 CB SER A 421 3.224 -9.209 10.192 1.00 43.37 C ATOM 1264 OG SER A 421 1.817 -9.184 10.346 1.00 56.83 O ATOM 1265 HG SER A 421 1.452 -8.378 9.902 1.00 0.00 H ATOM 1266 H SER A 421 4.720 -10.874 7.839 1.00 0.00 H ATOM 1267 N LEU A 422 4.701 -7.669 7.202 1.00 25.99 N ATOM 1268 CA LEU A 422 4.938 -6.380 6.559 1.00 23.73 C ATOM 1269 C LEU A 422 4.566 -6.421 5.082 1.00 26.10 C ATOM 1270 O LEU A 422 4.488 -7.493 4.486 1.00 24.60 O ATOM 1271 CB LEU A 422 6.403 -5.965 6.688 1.00 22.54 C ATOM 1272 CG LEU A 422 6.974 -5.774 8.094 1.00 23.18 C ATOM 1273 CD1 LEU A 422 8.439 -5.377 8.010 1.00 25.78 C ATOM 1274 CD2 LEU A 422 6.173 -4.737 8.871 1.00 35.95 C ATOM 1275 H LEU A 422 5.242 -8.498 6.882 1.00 0.00 H ATOM 1276 N VAL A 423 4.339 -5.243 4.509 1.00 22.52 N ATOM 1277 CA VAL A 423 4.155 -5.096 3.064 1.00 21.72 C ATOM 1278 C VAL A 423 5.060 -3.982 2.584 1.00 20.61 C ATOM 1279 O VAL A 423 5.365 -3.055 3.332 1.00 21.39 O ATOM 1280 CB VAL A 423 2.692 -4.782 2.668 1.00 22.79 C ATOM 1281 CG1 VAL A 423 1.821 -6.017 2.800 1.00 23.87 C ATOM 1282 CG2 VAL A 423 2.135 -3.624 3.494 1.00 27.80 C ATOM 1283 H VAL A 423 4.290 -4.395 5.109 1.00 0.00 H ATOM 1284 N HIS A 424 5.491 -4.065 1.332 1.00 19.60 N ATOM 1285 CA HIS A 424 6.492 -3.133 0.815 1.00 21.90 C ATOM 1286 C HIS A 424 5.871 -1.818 0.327 1.00 19.17 C ATOM 1287 O HIS A 424 6.360 -0.729 0.649 1.00 21.02 O ATOM 1288 CB HIS A 424 7.285 -3.788 -0.321 1.00 19.17 C ATOM 1289 CG HIS A 424 8.415 -2.944 -0.814 1.00 17.64 C ATOM 1290 ND1 HIS A 424 8.261 -2.008 -1.814 1.00 17.86 N ATOM 1291 CD2 HIS A 424 9.711 -2.877 -0.431 1.00 18.79 C ATOM 1292 CE1 HIS A 424 9.417 -1.406 -2.032 1.00 19.33 C ATOM 1293 NE2 HIS A 424 10.313 -1.918 -1.207 1.00 16.24 N ATOM 1294 H HIS A 424 5.111 -4.805 0.708 1.00 0.00 H ATOM 1295 N MET A 425 4.810 -1.942 -0.469 1.00 19.47 N ATOM 1296 CA MET A 425 3.974 -0.825 -0.927 1.00 20.23 C ATOM 1297 C MET A 425 4.647 0.161 -1.898 1.00 19.64 C ATOM 1298 O MET A 425 4.109 1.234 -2.168 1.00 20.43 O ATOM 1299 CB MET A 425 3.425 -0.056 0.279 1.00 21.47 C ATOM 1300 CG MET A 425 2.568 -0.920 1.191 1.00 22.47 C ATOM 1301 SD MET A 425 1.167 -1.653 0.319 1.00 29.72 S ATOM 1302 CE MET A 425 0.240 -0.183 -0.123 1.00 42.35 C ATOM 1303 H MET A 425 4.556 -2.898 -0.789 1.00 0.00 H ATOM 1304 N ASP A 426 5.799 -0.203 -2.449 1.00 20.51 N ATOM 1305 CA ASP A 426 6.391 0.611 -3.507 1.00 19.37 C ATOM 1306 C ASP A 426 7.270 -0.249 -4.419 1.00 17.52 C ATOM 1307 O ASP A 426 8.349 0.164 -4.835 1.00 17.29 O ATOM 1308 CB ASP A 426 7.188 1.769 -2.892 1.00 22.65 C ATOM 1309 CG ASP A 426 7.513 2.880 -3.892 1.00 25.98 C ATOM 1310 OD1 ASP A 426 6.770 3.061 -4.884 1.00 25.46 O ATOM 1311 OD2 ASP A 426 8.522 3.582 -3.665 1.00 25.42 O ATOM 1312 H ASP A 426 6.279 -1.067 -2.127 1.00 0.00 H ATOM 1313 N ILE A 427 6.795 -1.448 -4.737 1.00 18.05 N ATOM 1314 CA ILE A 427 7.492 -2.294 -5.698 1.00 20.09 C ATOM 1315 C ILE A 427 7.418 -1.671 -7.099 1.00 24.12 C ATOM 1316 O ILE A 427 6.345 -1.305 -7.588 1.00 19.09 O ATOM 1317 CB ILE A 427 6.911 -3.724 -5.727 1.00 16.44 C ATOM 1318 CG1 ILE A 427 7.067 -4.404 -4.358 1.00 16.58 C ATOM 1319 CG2 ILE A 427 7.575 -4.563 -6.804 1.00 15.99 C ATOM 1320 CD1 ILE A 427 8.515 -4.636 -3.923 1.00 23.40 C ATOM 1321 H ILE A 427 5.916 -1.787 -4.296 1.00 0.00 H ATOM 1322 N LYS A 428 8.584 -1.550 -7.720 1.00 15.84 N ATOM 1323 CA LYS A 428 8.729 -1.045 -9.078 1.00 15.97 C ATOM 1324 C LYS A 428 10.187 -1.253 -9.455 1.00 15.50 C ATOM 1325 O LYS A 428 11.013 -1.508 -8.582 1.00 16.81 O ATOM 1326 CB LYS A 428 8.329 0.425 -9.197 1.00 16.64 C ATOM 1327 CG LYS A 428 9.038 1.376 -8.252 1.00 16.88 C ATOM 1328 CD LYS A 428 8.590 2.795 -8.554 1.00 25.09 C ATOM 1329 CE LYS A 428 9.051 3.770 -7.495 1.00 22.49 C ATOM 1330 NZ LYS A 428 8.729 5.169 -7.883 1.00 22.63 N ATOM 1331 HZ1 LYS A 428 9.206 5.398 -8.778 1.00 0.00 H ATOM 1332 HZ2 LYS A 428 7.700 5.266 -8.002 1.00 0.00 H ATOM 1333 HZ3 LYS A 428 9.056 5.818 -7.139 1.00 0.00 H ATOM 1334 H LYS A 428 9.444 -1.832 -7.207 1.00 0.00 H ATOM 1335 N PRO A 429 10.506 -1.157 -10.750 1.00 15.66 N ATOM 1336 CA PRO A 429 11.868 -1.442 -11.209 1.00 15.47 C ATOM 1337 C PRO A 429 12.956 -0.659 -10.470 1.00 15.41 C ATOM 1338 O PRO A 429 13.996 -1.225 -10.163 1.00 15.19 O ATOM 1339 CB PRO A 429 11.815 -1.046 -12.680 1.00 15.98 C ATOM 1340 CG PRO A 429 10.428 -1.332 -13.078 1.00 16.71 C ATOM 1341 CD PRO A 429 9.579 -0.978 -11.884 1.00 20.58 C ATOM 1342 N SER A 430 12.723 0.613 -10.188 1.00 15.78 N ATOM 1343 CA SER A 430 13.750 1.435 -9.555 1.00 19.17 C ATOM 1344 C SER A 430 14.015 1.048 -8.096 1.00 21.39 C ATOM 1345 O SER A 430 14.983 1.523 -7.497 1.00 17.27 O ATOM 1346 CB SER A 430 13.359 2.910 -9.633 1.00 25.54 C ATOM 1347 OG SER A 430 12.210 3.170 -8.839 1.00 23.03 O ATOM 1348 HG SER A 430 12.403 2.940 -7.896 1.00 0.00 H ATOM 1349 H SER A 430 11.799 1.031 -10.420 1.00 0.00 H ATOM 1350 N ASN A 431 13.169 0.191 -7.524 1.00 15.18 N ATOM 1351 CA ASN A 431 13.357 -0.248 -6.133 1.00 14.94 C ATOM 1352 C ASN A 431 13.795 -1.705 -6.045 1.00 17.00 C ATOM 1353 O ASN A 431 13.915 -2.260 -4.951 1.00 16.43 O ATOM 1354 CB ASN A 431 12.071 -0.030 -5.327 1.00 15.96 C ATOM 1355 CG ASN A 431 11.798 1.434 -5.061 1.00 18.18 C ATOM 1356 OD1 ASN A 431 12.708 2.263 -5.106 1.00 19.11 O ATOM 1357 ND2 ASN A 431 10.546 1.764 -4.783 1.00 20.67 N ATOM 1358 HD22 ASN A 431 9.809 1.031 -4.756 1.00 0.00 H ATOM 1359 HD21 ASN A 431 10.300 2.756 -4.592 1.00 0.00 H ATOM 1360 H ASN A 431 12.363 -0.173 -8.071 1.00 0.00 H ATOM 1361 N ILE A 432 14.044 -2.318 -7.199 1.00 15.44 N ATOM 1362 CA ILE A 432 14.617 -3.658 -7.254 1.00 14.72 C ATOM 1363 C ILE A 432 16.085 -3.505 -7.622 1.00 16.08 C ATOM 1364 O ILE A 432 16.403 -2.975 -8.685 1.00 18.30 O ATOM 1365 CB ILE A 432 13.909 -4.573 -8.285 1.00 15.77 C ATOM 1366 CG1 ILE A 432 12.404 -4.637 -8.019 1.00 16.32 C ATOM 1367 CG2 ILE A 432 14.495 -5.971 -8.251 1.00 17.33 C ATOM 1368 CD1 ILE A 432 12.036 -5.188 -6.639 1.00 16.45 C ATOM 1369 H ILE A 432 13.823 -1.827 -8.089 1.00 0.00 H ATOM 1370 N PHE A 433 16.972 -3.972 -6.750 1.00 14.74 N ATOM 1371 CA PHE A 433 18.412 -3.831 -6.981 1.00 16.59 C ATOM 1372 C PHE A 433 19.017 -5.158 -7.408 1.00 15.54 C ATOM 1373 O PHE A 433 18.454 -6.225 -7.173 1.00 20.18 O ATOM 1374 CB PHE A 433 19.093 -3.259 -5.733 1.00 20.63 C ATOM 1375 CG PHE A 433 18.720 -1.825 -5.471 1.00 16.20 C ATOM 1376 CD1 PHE A 433 17.604 -1.514 -4.722 1.00 17.62 C ATOM 1377 CD2 PHE A 433 19.454 -0.792 -6.025 1.00 18.07 C ATOM 1378 CE1 PHE A 433 17.241 -0.195 -4.498 1.00 16.67 C ATOM 1379 CE2 PHE A 433 19.098 0.522 -5.810 1.00 22.12 C ATOM 1380 CZ PHE A 433 17.982 0.820 -5.046 1.00 25.71 C ATOM 1381 H PHE A 433 16.638 -4.447 -5.887 1.00 0.00 H ATOM 1382 N ILE A 434 20.152 -5.063 -8.089 1.00 19.06 N ATOM 1383 CA ILE A 434 20.760 -6.186 -8.781 1.00 16.82 C ATOM 1384 C ILE A 434 22.202 -6.357 -8.331 1.00 17.57 C ATOM 1385 O ILE A 434 22.970 -5.409 -8.374 1.00 20.90 O ATOM 1386 CB ILE A 434 20.729 -5.970 -10.315 1.00 17.18 C ATOM 1387 CG1 ILE A 434 19.280 -5.835 -10.797 1.00 18.69 C ATOM 1388 CG2 ILE A 434 21.445 -7.095 -11.039 1.00 20.31 C ATOM 1389 CD1 ILE A 434 19.161 -5.307 -12.224 1.00 26.53 C ATOM 1390 H ILE A 434 20.629 -4.140 -8.129 1.00 0.00 H ATOM 1391 N SER A 435 22.548 -7.560 -7.880 1.00 23.11 N ATOM 1392 CA SER A 435 23.936 -7.915 -7.573 1.00 20.69 C ATOM 1393 C SER A 435 24.423 -8.963 -8.561 1.00 34.07 C ATOM 1394 O SER A 435 23.807 -10.024 -8.697 1.00 22.89 O ATOM 1395 CB SER A 435 24.059 -8.445 -6.141 1.00 22.54 C ATOM 1396 OG SER A 435 23.633 -7.477 -5.204 1.00 33.39 O ATOM 1397 HG SER A 435 23.722 -7.844 -4.289 1.00 0.00 H ATOM 1398 H SER A 435 21.806 -8.275 -7.740 1.00 0.00 H ATOM 1399 N ARG A 436 25.513 -8.648 -9.261 1.00 28.03 N ATOM 1400 CA ARG A 436 26.148 -9.576 -10.188 1.00 39.70 C ATOM 1401 C ARG A 436 27.479 -10.031 -9.603 1.00 47.03 C ATOM 1402 O ARG A 436 28.155 -9.263 -8.920 1.00 81.02 O ATOM 1403 CB ARG A 436 26.372 -8.927 -11.557 1.00 38.48 C ATOM 1404 CG ARG A 436 25.178 -8.157 -12.097 1.00 51.02 C ATOM 1405 CD ARG A 436 25.428 -7.663 -13.521 1.00 55.83 C ATOM 1406 NE ARG A 436 24.746 -6.395 -13.784 1.00 49.66 N ATOM 1407 CZ ARG A 436 23.539 -6.275 -14.330 1.00 52.70 C ATOM 1408 NH1 ARG A 436 23.020 -5.064 -14.511 1.00 58.54 N ATOM 1409 NH2 ARG A 436 22.847 -7.350 -14.698 1.00 45.50 N ATOM 1410 HE ARG A 436 25.244 -5.520 -13.524 1.00 0.00 H ATOM 1411 HH12 ARG A 436 22.077 -4.961 -14.937 1.00 0.00 H ATOM 1412 HH11 ARG A 436 23.557 -4.220 -14.226 1.00 0.00 H ATOM 1413 HH22 ARG A 436 21.904 -7.241 -15.124 1.00 0.00 H ATOM 1414 HH21 ARG A 436 23.249 -8.299 -14.560 1.00 0.00 H ATOM 1415 H ARG A 436 25.927 -7.702 -9.141 1.00 0.00 H ATOM 1416 N THR A 437 27.848 -11.279 -9.873 1.00 71.93 N ATOM 1417 CA THR A 437 29.094 -11.841 -9.360 1.00 80.67 C ATOM 1418 C THR A 437 29.800 -12.654 -10.441 1.00 75.46 C ATOM 1419 O THR A 437 29.175 -13.104 -11.403 1.00 72.37 O ATOM 1420 CB THR A 437 28.851 -12.743 -8.131 1.00 70.54 C ATOM 1421 OG1 THR A 437 28.545 -14.075 -8.561 1.00 79.78 O ATOM 1422 CG2 THR A 437 27.709 -12.208 -7.269 1.00 69.17 C ATOM 1423 HG1 THR A 437 28.390 -14.649 -7.769 1.00 0.00 H ATOM 1424 H THR A 437 27.232 -11.871 -10.466 1.00 0.00 H TER 1425 THR A 437 ATOM 1426 N LYS A 456 25.049 -16.053 -10.834 1.00 62.68 N ATOM 1427 CA LYS A 456 25.221 -14.845 -11.631 1.00 68.54 C ATOM 1428 C LYS A 456 24.531 -13.646 -10.987 1.00 61.65 C ATOM 1429 O LYS A 456 25.196 -12.782 -10.416 1.00 75.95 O ATOM 1430 CB LYS A 456 24.677 -15.048 -13.050 1.00 64.70 C ATOM 1431 CG LYS A 456 25.520 -15.948 -13.947 1.00 76.49 C ATOM 1432 CD LYS A 456 26.961 -15.465 -14.099 1.00 76.76 C ATOM 1433 CE LYS A 456 27.038 -14.033 -14.606 1.00 70.62 C ATOM 1434 NZ LYS A 456 28.445 -13.616 -14.850 1.00 79.84 N ATOM 1435 HZ1 LYS A 456 28.983 -13.681 -13.963 1.00 0.00 H ATOM 1436 HZ2 LYS A 456 28.872 -14.242 -15.563 1.00 0.00 H ATOM 1437 HZ3 LYS A 456 28.460 -12.635 -15.195 1.00 0.00 H ATOM 1438 HN3 LYS A 456 24.035 -16.266 -10.744 1.00 0.00 H ATOM 1439 HN2 LYS A 456 25.459 -15.905 -9.890 1.00 0.00 H ATOM 1440 HN1 LYS A 456 25.531 -16.847 -11.302 1.00 0.00 H ATOM 1441 N VAL A 457 23.201 -13.606 -11.068 1.00 33.93 N ATOM 1442 CA VAL A 457 22.447 -12.409 -10.709 1.00 25.45 C ATOM 1443 C VAL A 457 21.444 -12.631 -9.571 1.00 27.27 C ATOM 1444 O VAL A 457 20.677 -13.594 -9.564 1.00 26.94 O ATOM 1445 CB VAL A 457 21.702 -11.865 -11.948 1.00 35.81 C ATOM 1446 CG1 VAL A 457 20.870 -10.622 -11.604 1.00 32.08 C ATOM 1447 CG2 VAL A 457 22.706 -11.587 -13.074 1.00 53.14 C ATOM 1448 H VAL A 457 22.688 -14.449 -11.395 1.00 0.00 H ATOM 1449 N MET A 458 21.462 -11.702 -8.620 1.00 27.00 N ATOM 1450 CA MET A 458 20.559 -11.721 -7.477 1.00 25.09 C ATOM 1451 C MET A 458 19.740 -10.437 -7.449 1.00 24.15 C ATOM 1452 O MET A 458 20.301 -9.340 -7.483 1.00 26.44 O ATOM 1453 CB MET A 458 21.354 -11.874 -6.181 1.00 21.71 C ATOM 1454 CG MET A 458 21.998 -13.236 -6.012 1.00 50.06 C ATOM 1455 SD MET A 458 20.813 -14.542 -5.642 1.00 74.29 S ATOM 1456 CE MET A 458 20.077 -13.936 -4.124 1.00 42.23 C ATOM 1457 H MET A 458 22.152 -10.927 -8.695 1.00 0.00 H ATOM 1458 N PHE A 459 18.415 -10.578 -7.406 1.00 19.75 N ATOM 1459 CA PHE A 459 17.528 -9.427 -7.278 1.00 16.52 C ATOM 1460 C PHE A 459 17.159 -9.226 -5.823 1.00 21.85 C ATOM 1461 O PHE A 459 16.814 -10.174 -5.122 1.00 17.82 O ATOM 1462 CB PHE A 459 16.265 -9.605 -8.128 1.00 16.37 C ATOM 1463 CG PHE A 459 16.551 -9.756 -9.594 1.00 16.97 C ATOM 1464 CD1 PHE A 459 16.758 -8.646 -10.390 1.00 16.44 C ATOM 1465 CD2 PHE A 459 16.639 -11.012 -10.172 1.00 22.02 C ATOM 1466 CE1 PHE A 459 17.034 -8.782 -11.734 1.00 16.95 C ATOM 1467 CE2 PHE A 459 16.919 -11.154 -11.522 1.00 27.54 C ATOM 1468 CZ PHE A 459 17.123 -10.040 -12.300 1.00 17.77 C ATOM 1469 H PHE A 459 18.004 -11.531 -7.465 1.00 0.00 H ATOM 1470 N LYS A 460 17.227 -7.978 -5.383 1.00 18.98 N ATOM 1471 CA LYS A 460 17.014 -7.646 -3.985 1.00 18.20 C ATOM 1472 C LYS A 460 16.051 -6.478 -3.862 1.00 17.72 C ATOM 1473 O LYS A 460 16.214 -5.451 -4.516 1.00 19.64 O ATOM 1474 CB LYS A 460 18.348 -7.315 -3.321 1.00 15.76 C ATOM 1475 CG LYS A 460 19.396 -8.406 -3.489 1.00 25.99 C ATOM 1476 CD LYS A 460 20.721 -7.998 -2.870 1.00 31.74 C ATOM 1477 CE LYS A 460 21.714 -9.146 -2.882 1.00 31.84 C ATOM 1478 NZ LYS A 460 21.431 -10.079 -1.766 1.00 38.88 N ATOM 1479 HZ1 LYS A 460 21.509 -9.570 -0.862 1.00 0.00 H ATOM 1480 HZ2 LYS A 460 20.469 -10.459 -1.869 1.00 0.00 H ATOM 1481 HZ3 LYS A 460 22.118 -10.860 -1.786 1.00 0.00 H ATOM 1482 H LYS A 460 17.439 -7.215 -6.057 1.00 0.00 H ATOM 1483 N ILE A 461 15.037 -6.650 -3.025 1.00 19.34 N ATOM 1484 CA ILE A 461 14.048 -5.616 -2.805 1.00 14.89 C ATOM 1485 C ILE A 461 14.643 -4.520 -1.939 1.00 16.86 C ATOM 1486 O ILE A 461 15.154 -4.794 -0.855 1.00 18.67 O ATOM 1487 CB ILE A 461 12.786 -6.187 -2.130 1.00 15.37 C ATOM 1488 CG1 ILE A 461 12.106 -7.210 -3.055 1.00 17.19 C ATOM 1489 CG2 ILE A 461 11.840 -5.067 -1.759 1.00 17.20 C ATOM 1490 CD1 ILE A 461 11.000 -8.005 -2.387 1.00 16.77 C ATOM 1491 H ILE A 461 14.950 -7.551 -2.513 1.00 0.00 H ATOM 1492 N GLY A 462 14.551 -3.280 -2.408 1.00 16.44 N ATOM 1493 CA GLY A 462 15.115 -2.148 -1.697 1.00 19.08 C ATOM 1494 C GLY A 462 14.142 -1.002 -1.508 1.00 21.27 C ATOM 1495 O GLY A 462 12.952 -1.115 -1.820 1.00 21.28 O ATOM 1496 H GLY A 462 14.061 -3.116 -3.310 1.00 0.00 H ATOM 1497 N ASP A 463 14.672 0.112 -1.008 1.00 17.08 N ATOM 1498 CA ASP A 463 13.900 1.326 -0.735 1.00 20.55 C ATOM 1499 C ASP A 463 12.672 1.024 0.124 1.00 21.45 C ATOM 1500 O ASP A 463 11.534 1.030 -0.358 1.00 20.77 O ATOM 1501 CB ASP A 463 13.481 1.999 -2.038 1.00 19.49 C ATOM 1502 CG ASP A 463 13.011 3.429 -1.833 1.00 49.98 C ATOM 1503 OD1 ASP A 463 12.809 3.836 -0.667 1.00 66.68 O ATOM 1504 OD2 ASP A 463 12.844 4.145 -2.842 1.00 60.11 O ATOM 1505 H ASP A 463 15.691 0.121 -0.800 1.00 0.00 H ATOM 1506 N LEU A 464 12.914 0.781 1.406 1.00 20.79 N ATOM 1507 CA LEU A 464 11.868 0.303 2.305 1.00 23.30 C ATOM 1508 C LEU A 464 11.100 1.412 3.027 1.00 20.23 C ATOM 1509 O LEU A 464 10.505 1.170 4.071 1.00 25.70 O ATOM 1510 CB LEU A 464 12.485 -0.643 3.333 1.00 17.08 C ATOM 1511 CG LEU A 464 13.348 -1.772 2.775 1.00 26.53 C ATOM 1512 CD1 LEU A 464 13.839 -2.650 3.905 1.00 20.83 C ATOM 1513 CD2 LEU A 464 12.594 -2.601 1.757 1.00 30.93 C ATOM 1514 H LEU A 464 13.872 0.935 1.779 1.00 0.00 H ATOM 1515 N GLY A 465 11.085 2.611 2.454 1.00 20.50 N ATOM 1516 CA GLY A 465 10.452 3.759 3.079 1.00 26.22 C ATOM 1517 C GLY A 465 8.932 3.739 3.123 1.00 29.59 C ATOM 1518 O GLY A 465 8.332 4.494 3.897 1.00 30.02 O ATOM 1519 H GLY A 465 11.542 2.731 1.527 1.00 0.00 H ATOM 1520 N HIS A 466 8.303 2.902 2.298 1.00 22.18 N ATOM 1521 CA HIS A 466 6.839 2.785 2.288 1.00 24.27 C ATOM 1522 C HIS A 466 6.343 1.566 3.067 1.00 21.04 C ATOM 1523 O HIS A 466 5.142 1.328 3.146 1.00 21.96 O ATOM 1524 CB HIS A 466 6.301 2.689 0.857 1.00 24.97 C ATOM 1525 CG HIS A 466 6.357 3.973 0.089 1.00 46.30 C ATOM 1526 ND1 HIS A 466 5.231 4.572 -0.432 1.00 45.91 N ATOM 1527 CD2 HIS A 466 7.401 4.760 -0.263 1.00 46.68 C ATOM 1528 CE1 HIS A 466 5.577 5.679 -1.065 1.00 42.80 C ATOM 1529 NE2 HIS A 466 6.887 5.816 -0.977 1.00 42.64 N ATOM 1530 H HIS A 466 8.863 2.317 1.645 1.00 0.00 H ATOM 1531 N VAL A 467 7.267 0.770 3.593 1.00 21.58 N ATOM 1532 CA VAL A 467 6.904 -0.450 4.310 1.00 21.24 C ATOM 1533 C VAL A 467 5.950 -0.142 5.460 1.00 22.76 C ATOM 1534 O VAL A 467 6.146 0.824 6.194 1.00 26.36 O ATOM 1535 CB VAL A 467 8.172 -1.181 4.839 1.00 24.65 C ATOM 1536 CG1 VAL A 467 7.852 -2.247 5.905 1.00 26.84 C ATOM 1537 CG2 VAL A 467 8.909 -1.815 3.694 1.00 23.03 C ATOM 1538 H VAL A 467 8.271 1.021 3.492 1.00 0.00 H ATOM 1539 N THR A 468 4.909 -0.961 5.593 1.00 24.52 N ATOM 1540 CA THR A 468 3.958 -0.825 6.694 1.00 30.37 C ATOM 1541 C THR A 468 3.461 -2.196 7.168 1.00 25.35 C ATOM 1542 O THR A 468 3.685 -3.211 6.511 1.00 26.59 O ATOM 1543 CB THR A 468 2.757 0.061 6.289 1.00 35.68 C ATOM 1544 OG1 THR A 468 2.003 0.412 7.455 1.00 34.46 O ATOM 1545 CG2 THR A 468 1.848 -0.649 5.283 1.00 28.61 C ATOM 1546 HG1 THR A 468 2.583 0.911 8.084 1.00 0.00 H ATOM 1547 H THR A 468 4.769 -1.718 4.894 1.00 0.00 H ATOM 1548 N ARG A 469 2.806 -2.220 8.324 1.00 27.02 N ATOM 1549 CA ARG A 469 2.312 -3.467 8.903 1.00 31.02 C ATOM 1550 C ARG A 469 0.922 -3.760 8.369 1.00 33.61 C ATOM 1551 O ARG A 469 0.125 -2.846 8.170 1.00 48.33 O ATOM 1552 CB ARG A 469 2.296 -3.393 10.439 1.00 34.38 C ATOM 1553 CG ARG A 469 3.677 -3.213 11.042 1.00 35.21 C ATOM 1554 CD ARG A 469 3.752 -3.625 12.512 1.00 44.59 C ATOM 1555 NE ARG A 469 5.042 -3.237 13.084 1.00 58.22 N ATOM 1556 CZ ARG A 469 6.123 -4.014 13.120 1.00 49.00 C ATOM 1557 NH1 ARG A 469 6.086 -5.250 12.636 1.00 52.30 N ATOM 1558 NH2 ARG A 469 7.248 -3.558 13.656 1.00 64.90 N ATOM 1559 HE ARG A 469 5.120 -2.284 13.493 1.00 0.00 H ATOM 1560 HH12 ARG A 469 6.937 -5.847 12.670 1.00 0.00 H ATOM 1561 HH11 ARG A 469 5.206 -5.621 12.223 1.00 0.00 H ATOM 1562 HH22 ARG A 469 8.093 -4.164 13.685 1.00 0.00 H ATOM 1563 HH21 ARG A 469 7.285 -2.595 14.047 1.00 0.00 H ATOM 1564 H ARG A 469 2.641 -1.327 8.830 1.00 0.00 H ATOM 1565 N ILE A 470 0.632 -5.035 8.140 1.00 35.01 N ATOM 1566 CA ILE A 470 -0.681 -5.429 7.640 1.00 47.06 C ATOM 1567 C ILE A 470 -1.752 -5.233 8.714 1.00 49.50 C ATOM 1568 O ILE A 470 -2.910 -4.959 8.398 1.00 63.73 O ATOM 1569 CB ILE A 470 -0.684 -6.903 7.147 1.00 35.68 C ATOM 1570 CG1 ILE A 470 -0.686 -7.883 8.328 1.00 75.30 C ATOM 1571 CG2 ILE A 470 0.499 -7.136 6.188 1.00 29.58 C ATOM 1572 CD1 ILE A 470 -0.555 -9.352 7.934 1.00 72.60 C ATOM 1573 H ILE A 470 1.352 -5.764 8.320 1.00 0.00 H ATOM 1574 N SER A 471 -1.359 -5.352 9.980 1.00 57.20 N ATOM 1575 CA SER A 471 -2.305 -5.265 11.095 1.00 49.92 C ATOM 1576 C SER A 471 -2.525 -3.835 11.601 1.00 58.02 C ATOM 1577 O SER A 471 -3.455 -3.586 12.363 1.00 57.03 O ATOM 1578 CB SER A 471 -1.835 -6.150 12.255 1.00 54.82 C ATOM 1579 OG SER A 471 -0.534 -5.790 12.694 1.00 66.45 O ATOM 1580 HG SER A 471 -0.264 -6.380 13.441 1.00 0.00 H ATOM 1581 H SER A 471 -0.352 -5.511 10.183 1.00 0.00 H ATOM 1582 N SER A 472 -1.667 -2.905 11.194 1.00 48.72 N ATOM 1583 CA SER A 472 -1.874 -1.486 11.486 1.00 65.42 C ATOM 1584 C SER A 472 -1.356 -0.643 10.322 1.00 41.87 C ATOM 1585 O SER A 472 -0.380 0.094 10.468 1.00 49.10 O ATOM 1586 CB SER A 472 -1.173 -1.088 12.788 1.00 47.38 C ATOM 1587 OG SER A 472 0.235 -1.067 12.627 1.00 58.00 O ATOM 1588 HG SER A 472 0.476 -0.412 11.925 1.00 0.00 H ATOM 1589 H SER A 472 -0.826 -3.193 10.654 1.00 0.00 H ATOM 1590 N PRO A 473 -2.017 -0.753 9.156 1.00 40.22 N ATOM 1591 CA PRO A 473 -1.528 -0.182 7.893 1.00 38.99 C ATOM 1592 C PRO A 473 -1.514 1.343 7.868 1.00 36.61 C ATOM 1593 O PRO A 473 -2.514 1.992 8.182 1.00 40.54 O ATOM 1594 CB PRO A 473 -2.515 -0.731 6.858 1.00 52.24 C ATOM 1595 CG PRO A 473 -3.744 -1.015 7.615 1.00 47.54 C ATOM 1596 CD PRO A 473 -3.317 -1.424 8.989 1.00 62.81 C ATOM 1597 N GLN A 474 -0.367 1.896 7.493 1.00 45.20 N ATOM 1598 CA GLN A 474 -0.208 3.330 7.315 1.00 44.25 C ATOM 1599 C GLN A 474 0.267 3.578 5.893 1.00 56.01 C ATOM 1600 O GLN A 474 1.469 3.594 5.623 1.00 40.66 O ATOM 1601 CB GLN A 474 0.776 3.892 8.341 1.00 52.22 C ATOM 1602 CG GLN A 474 0.246 3.831 9.765 1.00 51.06 C ATOM 1603 CD GLN A 474 1.332 3.573 10.797 1.00 83.86 C ATOM 1604 OE1 GLN A 474 1.146 2.780 11.721 1.00 78.04 O ATOM 1605 NE2 GLN A 474 2.468 4.246 10.648 1.00 63.08 N ATOM 1606 HE22 GLN A 474 2.581 4.906 9.852 1.00 0.00 H ATOM 1607 HE21 GLN A 474 3.244 4.113 11.327 1.00 0.00 H ATOM 1608 H GLN A 474 0.451 1.278 7.319 1.00 0.00 H ATOM 1609 N VAL A 475 -0.688 3.755 4.984 1.00 30.87 N ATOM 1610 CA VAL A 475 -0.385 3.781 3.558 1.00 38.15 C ATOM 1611 C VAL A 475 -0.046 5.184 3.087 1.00 35.54 C ATOM 1612 O VAL A 475 -0.814 6.136 3.253 1.00 40.68 O ATOM 1613 CB VAL A 475 -1.561 3.204 2.730 1.00 42.81 C ATOM 1614 CG1 VAL A 475 -1.349 3.391 1.198 1.00 31.36 C ATOM 1615 CG2 VAL A 475 -1.764 1.735 3.106 1.00 38.47 C ATOM 1616 H VAL A 475 -1.672 3.877 5.297 1.00 0.00 H ATOM 1617 N GLU A 476 1.149 5.274 2.520 1.00 36.20 N ATOM 1618 CA GLU A 476 1.632 6.446 1.820 1.00 41.24 C ATOM 1619 C GLU A 476 1.471 6.132 0.345 1.00 75.89 C ATOM 1620 O GLU A 476 2.001 5.127 -0.132 1.00 83.63 O ATOM 1621 CB GLU A 476 3.094 6.728 2.181 1.00 45.48 C ATOM 1622 CG GLU A 476 3.738 7.877 1.424 1.00 62.73 C ATOM 1623 CD GLU A 476 5.255 7.880 1.551 1.00 85.27 C ATOM 1624 OE1 GLU A 476 5.784 7.228 2.481 1.00 62.48 O ATOM 1625 OE2 GLU A 476 5.920 8.529 0.714 1.00 65.56 O ATOM 1626 H GLU A 476 1.780 4.450 2.582 1.00 0.00 H ATOM 1627 N GLU A 477 0.727 6.965 -0.371 1.00 38.73 N ATOM 1628 CA GLU A 477 0.400 6.664 -1.758 1.00 77.32 C ATOM 1629 C GLU A 477 1.658 6.524 -2.598 1.00 72.28 C ATOM 1630 O GLU A 477 2.443 7.462 -2.729 1.00 68.30 O ATOM 1631 CB GLU A 477 -0.507 7.741 -2.355 1.00 89.24 C ATOM 1632 CG GLU A 477 -1.420 7.228 -3.464 1.00 80.04 C ATOM 1633 CD GLU A 477 -2.407 6.185 -2.969 1.00 84.07 C ATOM 1634 OE1 GLU A 477 -3.569 6.547 -2.689 1.00 93.56 O ATOM 1635 OE2 GLU A 477 -2.021 5.002 -2.856 1.00 74.67 O ATOM 1636 H GLU A 477 0.374 7.842 0.063 1.00 0.00 H ATOM 1637 N GLY A 478 1.841 5.331 -3.153 1.00 59.80 N ATOM 1638 CA GLY A 478 3.001 5.030 -3.964 1.00 63.89 C ATOM 1639 C GLY A 478 2.855 5.480 -5.405 1.00 31.54 C ATOM 1640 O GLY A 478 1.970 6.263 -5.756 1.00 51.58 O ATOM 1641 H GLY A 478 1.128 4.590 -3.000 1.00 0.00 H ATOM 1642 N ASP A 479 3.754 4.971 -6.234 1.00 42.16 N ATOM 1643 CA ASP A 479 3.806 5.303 -7.647 1.00 33.15 C ATOM 1644 C ASP A 479 2.517 4.866 -8.340 1.00 23.07 C ATOM 1645 O ASP A 479 2.186 3.686 -8.339 1.00 23.57 O ATOM 1646 CB ASP A 479 5.024 4.626 -8.269 1.00 26.56 C ATOM 1647 CG ASP A 479 5.390 5.199 -9.616 1.00 32.58 C ATOM 1648 OD1 ASP A 479 4.493 5.351 -10.462 1.00 22.38 O ATOM 1649 OD2 ASP A 479 6.583 5.502 -9.821 1.00 33.77 O ATOM 1650 H ASP A 479 4.455 4.303 -5.856 1.00 0.00 H ATOM 1651 N SER A 480 1.793 5.812 -8.923 1.00 24.76 N ATOM 1652 CA SER A 480 0.487 5.515 -9.512 1.00 29.02 C ATOM 1653 C SER A 480 0.580 4.491 -10.644 1.00 28.23 C ATOM 1654 O SER A 480 -0.391 3.789 -10.935 1.00 27.12 O ATOM 1655 CB SER A 480 -0.184 6.799 -10.021 1.00 36.30 C ATOM 1656 OG SER A 480 0.479 7.336 -11.151 1.00 49.90 O ATOM 1657 HG SER A 480 0.014 8.160 -11.444 1.00 0.00 H ATOM 1658 H SER A 480 2.161 6.784 -8.962 1.00 0.00 H ATOM 1659 N ARG A 481 1.744 4.392 -11.275 1.00 24.95 N ATOM 1660 CA ARG A 481 1.906 3.474 -12.397 1.00 22.77 C ATOM 1661 C ARG A 481 1.781 2.023 -11.958 1.00 21.82 C ATOM 1662 O ARG A 481 1.402 1.167 -12.755 1.00 21.75 O ATOM 1663 CB ARG A 481 3.261 3.692 -13.077 1.00 22.00 C ATOM 1664 CG ARG A 481 3.378 5.017 -13.821 1.00 23.16 C ATOM 1665 CD ARG A 481 4.815 5.303 -14.248 1.00 24.68 C ATOM 1666 NE ARG A 481 5.717 5.358 -13.105 1.00 27.51 N ATOM 1667 CZ ARG A 481 7.041 5.415 -13.191 1.00 35.61 C ATOM 1668 NH1 ARG A 481 7.638 5.431 -14.374 1.00 30.48 N ATOM 1669 NH2 ARG A 481 7.773 5.450 -12.089 1.00 28.53 N ATOM 1670 HE ARG A 481 5.294 5.352 -12.155 1.00 0.00 H ATOM 1671 HH12 ARG A 481 8.675 5.476 -14.432 1.00 0.00 H ATOM 1672 HH11 ARG A 481 7.069 5.399 -15.244 1.00 0.00 H ATOM 1673 HH22 ARG A 481 8.810 5.495 -12.155 1.00 0.00 H ATOM 1674 HH21 ARG A 481 7.311 5.433 -11.157 1.00 0.00 H ATOM 1675 H ARG A 481 2.548 4.975 -10.966 1.00 0.00 H ATOM 1676 N PHE A 482 2.114 1.750 -10.695 1.00 21.26 N ATOM 1677 CA PHE A 482 2.179 0.382 -10.186 1.00 20.47 C ATOM 1678 C PHE A 482 1.129 0.101 -9.128 1.00 21.26 C ATOM 1679 O PHE A 482 1.093 -0.986 -8.553 1.00 20.90 O ATOM 1680 CB PHE A 482 3.577 0.113 -9.630 1.00 22.95 C ATOM 1681 CG PHE A 482 4.641 0.242 -10.671 1.00 18.64 C ATOM 1682 CD1 PHE A 482 5.156 1.487 -10.997 1.00 18.95 C ATOM 1683 CD2 PHE A 482 5.088 -0.867 -11.359 1.00 18.94 C ATOM 1684 CE1 PHE A 482 6.123 1.614 -11.988 1.00 18.64 C ATOM 1685 CE2 PHE A 482 6.044 -0.744 -12.361 1.00 17.89 C ATOM 1686 CZ PHE A 482 6.552 0.501 -12.675 1.00 18.52 C ATOM 1687 H PHE A 482 2.335 2.537 -10.052 1.00 0.00 H ATOM 1688 N LEU A 483 0.254 1.071 -8.912 1.00 25.28 N ATOM 1689 CA LEU A 483 -0.695 1.013 -7.816 1.00 27.23 C ATOM 1690 C LEU A 483 -1.974 0.260 -8.175 1.00 24.62 C ATOM 1691 O LEU A 483 -2.600 0.533 -9.195 1.00 25.36 O ATOM 1692 CB LEU A 483 -1.036 2.427 -7.373 1.00 29.45 C ATOM 1693 CG LEU A 483 -1.804 2.520 -6.060 1.00 34.83 C ATOM 1694 CD1 LEU A 483 -0.929 2.035 -4.903 1.00 30.87 C ATOM 1695 CD2 LEU A 483 -2.264 3.940 -5.843 1.00 36.76 C ATOM 1696 H LEU A 483 0.247 1.896 -9.545 1.00 0.00 H ATOM 1697 N ALA A 484 -2.355 -0.684 -7.317 1.00 24.80 N ATOM 1698 CA ALA A 484 -3.591 -1.436 -7.496 1.00 33.16 C ATOM 1699 C ALA A 484 -4.791 -0.557 -7.144 1.00 27.99 C ATOM 1700 O ALA A 484 -4.703 0.317 -6.277 1.00 28.50 O ATOM 1701 CB ALA A 484 -3.567 -2.701 -6.645 1.00 31.17 C ATOM 1702 H ALA A 484 -1.753 -0.891 -6.495 1.00 0.00 H ATOM 1703 N ASN A 485 -5.914 -0.787 -7.821 1.00 27.74 N ATOM 1704 CA ASN A 485 -7.072 0.090 -7.698 1.00 28.03 C ATOM 1705 C ASN A 485 -7.617 0.144 -6.276 1.00 39.55 C ATOM 1706 O ASN A 485 -8.043 1.198 -5.811 1.00 29.99 O ATOM 1707 CB ASN A 485 -8.187 -0.359 -8.653 1.00 30.75 C ATOM 1708 CG ASN A 485 -9.248 0.708 -8.856 1.00 44.05 C ATOM 1709 OD1 ASN A 485 -8.934 1.876 -9.093 1.00 39.99 O ATOM 1710 ND2 ASN A 485 -10.513 0.310 -8.761 1.00 39.98 N ATOM 1711 HD22 ASN A 485 -10.731 -0.687 -8.559 1.00 0.00 H ATOM 1712 HD21 ASN A 485 -11.285 0.995 -8.888 1.00 0.00 H ATOM 1713 H ASN A 485 -5.966 -1.612 -8.452 1.00 0.00 H ATOM 1714 N GLU A 486 -7.602 -0.990 -5.586 1.00 29.39 N ATOM 1715 CA GLU A 486 -8.250 -1.068 -4.285 1.00 30.58 C ATOM 1716 C GLU A 486 -7.486 -0.248 -3.244 1.00 29.69 C ATOM 1717 O GLU A 486 -8.062 0.184 -2.255 1.00 33.50 O ATOM 1718 CB GLU A 486 -8.402 -2.529 -3.834 1.00 31.12 C ATOM 1719 CG GLU A 486 -7.107 -3.259 -3.477 1.00 35.52 C ATOM 1720 CD GLU A 486 -6.363 -3.825 -4.675 1.00 37.70 C ATOM 1721 OE1 GLU A 486 -5.282 -4.415 -4.446 1.00 29.85 O ATOM 1722 OE2 GLU A 486 -6.840 -3.690 -5.829 1.00 28.81 O ATOM 1723 H GLU A 486 -7.125 -1.827 -5.977 1.00 0.00 H ATOM 1724 N VAL A 487 -6.194 -0.018 -3.461 1.00 27.68 N ATOM 1725 CA VAL A 487 -5.449 0.849 -2.555 1.00 26.97 C ATOM 1726 C VAL A 487 -5.856 2.297 -2.782 1.00 30.91 C ATOM 1727 O VAL A 487 -6.054 3.048 -1.827 1.00 36.28 O ATOM 1728 CB VAL A 487 -3.927 0.705 -2.731 1.00 33.44 C ATOM 1729 CG1 VAL A 487 -3.184 1.631 -1.768 1.00 30.87 C ATOM 1730 CG2 VAL A 487 -3.521 -0.727 -2.497 1.00 27.70 C ATOM 1731 H VAL A 487 -5.716 -0.455 -4.275 1.00 0.00 H ATOM 1732 N LEU A 488 -5.993 2.682 -4.048 1.00 29.92 N ATOM 1733 CA LEU A 488 -6.458 4.018 -4.384 1.00 31.54 C ATOM 1734 C LEU A 488 -7.830 4.273 -3.772 1.00 32.64 C ATOM 1735 O LEU A 488 -8.127 5.383 -3.334 1.00 41.53 O ATOM 1736 CB LEU A 488 -6.516 4.202 -5.901 1.00 33.13 C ATOM 1737 CG LEU A 488 -7.003 5.561 -6.401 1.00 43.70 C ATOM 1738 CD1 LEU A 488 -6.003 6.638 -6.033 1.00 53.73 C ATOM 1739 CD2 LEU A 488 -7.231 5.520 -7.907 1.00 45.49 C ATOM 1740 H LEU A 488 -5.763 2.015 -4.812 1.00 0.00 H ATOM 1741 N GLN A 489 -8.659 3.234 -3.739 1.00 32.57 N ATOM 1742 CA GLN A 489 -9.991 3.332 -3.141 1.00 34.22 C ATOM 1743 C GLN A 489 -9.949 3.341 -1.610 1.00 34.63 C ATOM 1744 O GLN A 489 -10.998 3.370 -0.955 1.00 36.67 O ATOM 1745 CB GLN A 489 -10.865 2.178 -3.612 1.00 35.36 C ATOM 1746 CG GLN A 489 -11.104 2.161 -5.090 1.00 36.89 C ATOM 1747 CD GLN A 489 -12.030 1.043 -5.490 1.00 40.62 C ATOM 1748 OE1 GLN A 489 -11.980 -0.055 -4.928 1.00 50.09 O ATOM 1749 NE2 GLN A 489 -12.890 1.314 -6.454 1.00 39.72 N ATOM 1750 HE22 GLN A 489 -12.894 2.255 -6.898 1.00 0.00 H ATOM 1751 HE21 GLN A 489 -13.563 0.587 -6.770 1.00 0.00 H ATOM 1752 H GLN A 489 -8.353 2.328 -4.149 1.00 0.00 H ATOM 1753 N GLU A 490 -8.738 3.298 -1.061 1.00 32.83 N ATOM 1754 CA GLU A 490 -8.496 3.329 0.386 1.00 34.89 C ATOM 1755 C GLU A 490 -9.029 2.079 1.095 1.00 34.08 C ATOM 1756 O GLU A 490 -9.370 2.113 2.274 1.00 35.27 O ATOM 1757 CB GLU A 490 -9.081 4.607 1.000 1.00 35.00 C ATOM 1758 CG GLU A 490 -8.382 5.865 0.481 1.00 52.22 C ATOM 1759 CD GLU A 490 -8.945 7.157 1.043 1.00 46.85 C ATOM 1760 OE1 GLU A 490 -8.696 8.227 0.449 1.00 66.52 O ATOM 1761 OE2 GLU A 490 -9.628 7.112 2.082 1.00 47.31 O ATOM 1762 H GLU A 490 -7.915 3.239 -1.694 1.00 0.00 H ATOM 1763 N ASN A 491 -9.047 0.972 0.360 1.00 34.81 N ATOM 1764 CA ASN A 491 -9.219 -0.364 0.924 1.00 34.33 C ATOM 1765 C ASN A 491 -7.860 -0.993 1.240 1.00 32.38 C ATOM 1766 O ASN A 491 -7.188 -1.492 0.346 1.00 33.03 O ATOM 1767 CB ASN A 491 -9.983 -1.258 -0.055 1.00 35.22 C ATOM 1768 CG ASN A 491 -10.066 -2.704 0.406 1.00 36.99 C ATOM 1769 OD1 ASN A 491 -9.697 -3.040 1.532 1.00 39.16 O ATOM 1770 ND2 ASN A 491 -10.576 -3.565 -0.461 1.00 39.31 N ATOM 1771 HD22 ASN A 491 -10.875 -3.239 -1.402 1.00 0.00 H ATOM 1772 HD21 ASN A 491 -10.677 -4.567 -0.201 1.00 0.00 H ATOM 1773 H ASN A 491 -8.933 1.062 -0.670 1.00 0.00 H ATOM 1774 N TYR A 492 -7.477 -0.991 2.512 1.00 32.69 N ATOM 1775 CA TYR A 492 -6.160 -1.484 2.917 1.00 34.17 C ATOM 1776 C TYR A 492 -6.236 -2.872 3.550 1.00 36.59 C ATOM 1777 O TYR A 492 -5.377 -3.232 4.355 1.00 36.92 O ATOM 1778 CB TYR A 492 -5.513 -0.499 3.895 1.00 30.56 C ATOM 1779 CG TYR A 492 -5.387 0.912 3.355 1.00 30.71 C ATOM 1780 CD1 TYR A 492 -5.225 1.148 1.992 1.00 29.42 C ATOM 1781 CD2 TYR A 492 -5.454 2.011 4.205 1.00 37.08 C ATOM 1782 CE1 TYR A 492 -5.122 2.435 1.499 1.00 32.17 C ATOM 1783 CE2 TYR A 492 -5.350 3.299 3.721 1.00 38.83 C ATOM 1784 CZ TYR A 492 -5.181 3.505 2.368 1.00 35.74 C ATOM 1785 OH TYR A 492 -5.081 4.788 1.881 1.00 36.67 O ATOM 1786 HH TYR A 492 -4.964 4.759 0.898 1.00 0.00 H ATOM 1787 H TYR A 492 -8.129 -0.630 3.238 1.00 0.00 H ATOM 1788 N THR A 493 -7.249 -3.653 3.176 1.00 33.33 N ATOM 1789 CA THR A 493 -7.507 -4.940 3.823 1.00 35.06 C ATOM 1790 C THR A 493 -6.773 -6.119 3.167 1.00 38.29 C ATOM 1791 O THR A 493 -6.762 -7.226 3.710 1.00 39.69 O ATOM 1792 CB THR A 493 -9.037 -5.247 3.847 1.00 37.42 C ATOM 1793 OG1 THR A 493 -9.339 -6.124 4.938 1.00 60.95 O ATOM 1794 CG2 THR A 493 -9.517 -5.884 2.536 1.00 37.58 C ATOM 1795 HG1 THR A 493 -8.837 -6.970 4.829 1.00 0.00 H ATOM 1796 H THR A 493 -7.872 -3.340 2.405 1.00 0.00 H ATOM 1797 N HIS A 494 -6.162 -5.877 2.013 1.00 31.79 N ATOM 1798 CA HIS A 494 -5.493 -6.925 1.238 1.00 32.25 C ATOM 1799 C HIS A 494 -4.131 -6.465 0.734 1.00 28.72 C ATOM 1800 O HIS A 494 -3.739 -6.799 -0.382 1.00 27.20 O ATOM 1801 CB HIS A 494 -6.350 -7.345 0.036 1.00 54.39 C ATOM 1802 CG HIS A 494 -7.574 -8.125 0.398 1.00 45.23 C ATOM 1803 ND1 HIS A 494 -7.585 -9.072 1.398 1.00 47.57 N ATOM 1804 CD2 HIS A 494 -8.824 -8.111 -0.122 1.00 45.41 C ATOM 1805 CE1 HIS A 494 -8.794 -9.599 1.489 1.00 57.13 C ATOM 1806 NE2 HIS A 494 -9.564 -9.032 0.577 1.00 54.82 N ATOM 1807 H HIS A 494 -6.158 -4.904 1.645 1.00 0.00 H ATOM 1808 N LEU A 495 -3.398 -5.714 1.552 1.00 28.82 N ATOM 1809 CA LEU A 495 -2.207 -5.024 1.052 1.00 27.92 C ATOM 1810 C LEU A 495 -1.124 -5.930 0.447 1.00 24.01 C ATOM 1811 O LEU A 495 -0.428 -5.512 -0.482 1.00 23.09 O ATOM 1812 CB LEU A 495 -1.595 -4.178 2.169 1.00 29.15 C ATOM 1813 CG LEU A 495 -2.372 -2.910 2.533 1.00 33.08 C ATOM 1814 CD1 LEU A 495 -1.622 -2.145 3.617 1.00 34.76 C ATOM 1815 CD2 LEU A 495 -2.638 -2.012 1.312 1.00 38.05 C ATOM 1816 H LEU A 495 -3.672 -5.617 2.551 1.00 0.00 H ATOM 1817 N PRO A 496 -0.962 -7.164 0.952 1.00 24.74 N ATOM 1818 CA PRO A 496 0.096 -7.954 0.307 1.00 23.51 C ATOM 1819 C PRO A 496 -0.202 -8.215 -1.166 1.00 29.73 C ATOM 1820 O PRO A 496 0.714 -8.362 -1.974 1.00 26.82 O ATOM 1821 CB PRO A 496 0.105 -9.254 1.113 1.00 24.86 C ATOM 1822 CG PRO A 496 -0.496 -8.872 2.448 1.00 33.54 C ATOM 1823 CD PRO A 496 -1.545 -7.868 2.107 1.00 30.92 C ATOM 1824 N LYS A 497 -1.484 -8.243 -1.512 1.00 25.40 N ATOM 1825 CA LYS A 497 -1.883 -8.454 -2.900 1.00 24.22 C ATOM 1826 C LYS A 497 -1.584 -7.227 -3.755 1.00 22.82 C ATOM 1827 O LYS A 497 -1.530 -7.315 -4.979 1.00 23.38 O ATOM 1828 CB LYS A 497 -3.370 -8.814 -2.970 1.00 26.32 C ATOM 1829 CG LYS A 497 -3.720 -10.100 -2.238 1.00 28.03 C ATOM 1830 CD LYS A 497 -2.915 -11.272 -2.780 1.00 27.46 C ATOM 1831 CE LYS A 497 -3.387 -12.594 -2.212 1.00 29.93 C ATOM 1832 NZ LYS A 497 -4.782 -12.921 -2.623 1.00 31.57 N ATOM 1833 HZ1 LYS A 497 -5.425 -12.177 -2.285 1.00 0.00 H ATOM 1834 HZ2 LYS A 497 -4.832 -12.979 -3.660 1.00 0.00 H ATOM 1835 HZ3 LYS A 497 -5.059 -13.834 -2.209 1.00 0.00 H ATOM 1836 H LYS A 497 -2.214 -8.113 -0.783 1.00 0.00 H ATOM 1837 N ALA A 498 -1.387 -6.082 -3.112 1.00 22.67 N ATOM 1838 CA ALA A 498 -0.969 -4.884 -3.820 1.00 21.23 C ATOM 1839 C ALA A 498 0.487 -5.026 -4.263 1.00 23.64 C ATOM 1840 O ALA A 498 0.840 -4.614 -5.363 1.00 20.06 O ATOM 1841 CB ALA A 498 -1.154 -3.649 -2.955 1.00 25.67 C ATOM 1842 H ALA A 498 -1.535 -6.042 -2.083 1.00 0.00 H ATOM 1843 N ASP A 499 1.324 -5.615 -3.409 1.00 20.45 N ATOM 1844 CA ASP A 499 2.712 -5.891 -3.774 1.00 20.78 C ATOM 1845 C ASP A 499 2.756 -6.851 -4.972 1.00 18.68 C ATOM 1846 O ASP A 499 3.597 -6.716 -5.862 1.00 17.14 O ATOM 1847 CB ASP A 499 3.493 -6.499 -2.596 1.00 17.75 C ATOM 1848 CG ASP A 499 3.858 -5.478 -1.518 1.00 19.76 C ATOM 1849 OD1 ASP A 499 3.883 -4.267 -1.808 1.00 22.15 O ATOM 1850 OD2 ASP A 499 4.155 -5.900 -0.371 1.00 20.98 O ATOM 1851 H ASP A 499 0.983 -5.884 -2.464 1.00 0.00 H ATOM 1852 N ILE A 500 1.857 -7.830 -4.972 1.00 20.11 N ATOM 1853 CA ILE A 500 1.782 -8.823 -6.045 1.00 24.23 C ATOM 1854 C ILE A 500 1.404 -8.164 -7.380 1.00 18.44 C ATOM 1855 O ILE A 500 2.046 -8.416 -8.404 1.00 17.59 O ATOM 1856 CB ILE A 500 0.777 -9.932 -5.685 1.00 22.72 C ATOM 1857 CG1 ILE A 500 1.305 -10.775 -4.519 1.00 25.93 C ATOM 1858 CG2 ILE A 500 0.473 -10.839 -6.870 1.00 21.01 C ATOM 1859 CD1 ILE A 500 2.567 -11.596 -4.828 1.00 26.29 C ATOM 1860 H ILE A 500 1.183 -7.893 -4.182 1.00 0.00 H ATOM 1861 N PHE A 501 0.374 -7.323 -7.357 1.00 23.03 N ATOM 1862 CA PHE A 501 -0.015 -6.503 -8.515 1.00 21.87 C ATOM 1863 C PHE A 501 1.171 -5.708 -9.072 1.00 17.50 C ATOM 1864 O PHE A 501 1.488 -5.786 -10.265 1.00 17.70 O ATOM 1865 CB PHE A 501 -1.153 -5.562 -8.097 1.00 28.17 C ATOM 1866 CG PHE A 501 -1.684 -4.680 -9.203 1.00 20.52 C ATOM 1867 CD1 PHE A 501 -1.098 -3.455 -9.474 1.00 19.65 C ATOM 1868 CD2 PHE A 501 -2.800 -5.051 -9.929 1.00 21.88 C ATOM 1869 CE1 PHE A 501 -1.587 -2.631 -10.470 1.00 20.13 C ATOM 1870 CE2 PHE A 501 -3.306 -4.227 -10.934 1.00 27.67 C ATOM 1871 CZ PHE A 501 -2.705 -3.021 -11.201 1.00 22.25 C ATOM 1872 H PHE A 501 -0.181 -7.241 -6.481 1.00 0.00 H ATOM 1873 N ALA A 502 1.838 -4.970 -8.191 1.00 16.87 N ATOM 1874 CA ALA A 502 2.993 -4.142 -8.537 1.00 15.60 C ATOM 1875 C ALA A 502 4.140 -4.954 -9.138 1.00 18.27 C ATOM 1876 O ALA A 502 4.792 -4.514 -10.090 1.00 14.79 O ATOM 1877 CB ALA A 502 3.479 -3.388 -7.294 1.00 15.37 C ATOM 1878 H ALA A 502 1.521 -4.982 -7.200 1.00 0.00 H ATOM 1879 N LEU A 503 4.385 -6.134 -8.579 1.00 19.39 N ATOM 1880 CA LEU A 503 5.452 -6.999 -9.061 1.00 16.40 C ATOM 1881 C LEU A 503 5.179 -7.477 -10.486 1.00 19.67 C ATOM 1882 O LEU A 503 6.079 -7.495 -11.330 1.00 17.71 O ATOM 1883 CB LEU A 503 5.632 -8.203 -8.136 1.00 14.42 C ATOM 1884 CG LEU A 503 6.627 -9.267 -8.618 1.00 16.27 C ATOM 1885 CD1 LEU A 503 7.979 -8.646 -8.944 1.00 17.61 C ATOM 1886 CD2 LEU A 503 6.789 -10.364 -7.583 1.00 18.62 C ATOM 1887 H LEU A 503 3.801 -6.447 -7.778 1.00 0.00 H ATOM 1888 N ALA A 504 3.939 -7.865 -10.761 1.00 18.82 N ATOM 1889 CA ALA A 504 3.575 -8.285 -12.116 1.00 15.42 C ATOM 1890 C ALA A 504 3.882 -7.174 -13.117 1.00 14.80 C ATOM 1891 O ALA A 504 4.476 -7.419 -14.170 1.00 17.39 O ATOM 1892 CB ALA A 504 2.099 -8.677 -12.186 1.00 20.05 C ATOM 1893 H ALA A 504 3.221 -7.871 -10.009 1.00 0.00 H ATOM 1894 N LEU A 505 3.498 -5.946 -12.789 1.00 18.47 N ATOM 1895 CA LEU A 505 3.727 -4.830 -13.701 1.00 14.66 C ATOM 1896 C LEU A 505 5.218 -4.491 -13.796 1.00 19.86 C ATOM 1897 O LEU A 505 5.686 -4.005 -14.830 1.00 15.05 O ATOM 1898 CB LEU A 505 2.933 -3.600 -13.263 1.00 16.24 C ATOM 1899 CG LEU A 505 1.414 -3.665 -13.431 1.00 16.81 C ATOM 1900 CD1 LEU A 505 0.805 -2.349 -12.995 1.00 24.02 C ATOM 1901 CD2 LEU A 505 1.029 -3.964 -14.875 1.00 20.32 C ATOM 1902 H LEU A 505 3.031 -5.778 -11.875 1.00 0.00 H ATOM 1903 N THR A 506 5.961 -4.745 -12.723 1.00 14.72 N ATOM 1904 CA THR A 506 7.414 -4.587 -12.753 1.00 15.51 C ATOM 1905 C THR A 506 8.019 -5.530 -13.790 1.00 15.11 C ATOM 1906 O THR A 506 8.848 -5.116 -14.608 1.00 14.22 O ATOM 1907 CB THR A 506 8.033 -4.842 -11.366 1.00 11.55 C ATOM 1908 OG1 THR A 506 7.544 -3.851 -10.460 1.00 16.10 O ATOM 1909 CG2 THR A 506 9.546 -4.763 -11.408 1.00 14.27 C ATOM 1910 HG1 THR A 506 6.557 -3.913 -10.406 1.00 0.00 H ATOM 1911 H THR A 506 5.500 -5.062 -11.846 1.00 0.00 H ATOM 1912 N VAL A 507 7.575 -6.783 -13.789 1.00 15.85 N ATOM 1913 CA VAL A 507 8.075 -7.775 -14.736 1.00 22.75 C ATOM 1914 C VAL A 507 7.644 -7.408 -16.159 1.00 20.47 C ATOM 1915 O VAL A 507 8.414 -7.554 -17.112 1.00 16.78 O ATOM 1916 CB VAL A 507 7.586 -9.192 -14.346 1.00 17.86 C ATOM 1917 CG1 VAL A 507 7.894 -10.236 -15.432 1.00 19.79 C ATOM 1918 CG2 VAL A 507 8.204 -9.606 -13.017 1.00 19.19 C ATOM 1919 H VAL A 507 6.853 -7.064 -13.096 1.00 0.00 H ATOM 1920 N VAL A 508 6.423 -6.910 -16.298 1.00 14.72 N ATOM 1921 CA VAL A 508 5.926 -6.439 -17.586 1.00 15.39 C ATOM 1922 C VAL A 508 6.809 -5.303 -18.125 1.00 13.88 C ATOM 1923 O VAL A 508 7.078 -5.250 -19.323 1.00 17.53 O ATOM 1924 CB VAL A 508 4.437 -5.999 -17.456 1.00 19.05 C ATOM 1925 CG1 VAL A 508 3.963 -5.103 -18.621 1.00 24.59 C ATOM 1926 CG2 VAL A 508 3.554 -7.241 -17.283 1.00 17.84 C ATOM 1927 H VAL A 508 5.802 -6.854 -15.465 1.00 0.00 H ATOM 1928 N CYS A 509 7.276 -4.404 -17.259 1.00 15.61 N ATOM 1929 CA CYS A 509 8.223 -3.376 -17.697 1.00 15.20 C ATOM 1930 C CYS A 509 9.514 -4.016 -18.179 1.00 14.85 C ATOM 1931 O CYS A 509 10.056 -3.631 -19.223 1.00 16.11 O ATOM 1932 CB CYS A 509 8.541 -2.379 -16.584 1.00 19.22 C ATOM 1933 SG CYS A 509 7.166 -1.370 -16.102 1.00 24.13 S ATOM 1934 H CYS A 509 6.966 -4.433 -16.267 1.00 0.00 H ATOM 1935 N ALA A 510 9.992 -5.003 -17.427 1.00 17.29 N ATOM 1936 CA ALA A 510 11.237 -5.682 -17.771 1.00 16.20 C ATOM 1937 C ALA A 510 11.113 -6.445 -19.091 1.00 18.36 C ATOM 1938 O ALA A 510 12.101 -6.626 -19.800 1.00 14.69 O ATOM 1939 CB ALA A 510 11.649 -6.628 -16.656 1.00 19.38 C ATOM 1940 H ALA A 510 9.469 -5.297 -16.578 1.00 0.00 H ATOM 1941 N ALA A 511 9.903 -6.891 -19.412 1.00 17.72 N ATOM 1942 CA ALA A 511 9.664 -7.687 -20.615 1.00 18.33 C ATOM 1943 C ALA A 511 9.561 -6.856 -21.895 1.00 21.75 C ATOM 1944 O ALA A 511 9.404 -7.418 -22.971 1.00 23.73 O ATOM 1945 CB ALA A 511 8.395 -8.519 -20.444 1.00 18.53 C ATOM 1946 H ALA A 511 9.101 -6.667 -18.788 1.00 0.00 H ATOM 1947 N GLY A 512 9.608 -5.531 -21.776 1.00 19.30 N ATOM 1948 CA GLY A 512 9.621 -4.651 -22.932 1.00 26.63 C ATOM 1949 C GLY A 512 8.336 -3.885 -23.214 1.00 20.91 C ATOM 1950 O GLY A 512 8.183 -3.317 -24.295 1.00 20.14 O ATOM 1951 H GLY A 512 9.636 -5.112 -20.825 1.00 0.00 H ATOM 1952 N ALA A 513 7.417 -3.848 -22.255 1.00 19.42 N ATOM 1953 CA ALA A 513 6.173 -3.108 -22.440 1.00 22.85 C ATOM 1954 C ALA A 513 6.455 -1.623 -22.586 1.00 27.09 C ATOM 1955 O ALA A 513 7.472 -1.122 -22.110 1.00 24.30 O ATOM 1956 CB ALA A 513 5.222 -3.346 -21.272 1.00 23.58 C ATOM 1957 H ALA A 513 7.586 -4.353 -21.362 1.00 0.00 H ATOM 1958 N GLU A 514 5.538 -0.924 -23.238 1.00 17.82 N ATOM 1959 CA GLU A 514 5.608 0.527 -23.319 1.00 21.94 C ATOM 1960 C GLU A 514 5.507 1.109 -21.912 1.00 30.31 C ATOM 1961 O GLU A 514 4.990 0.450 -21.010 1.00 24.13 O ATOM 1962 CB GLU A 514 4.499 1.073 -24.220 1.00 34.67 C ATOM 1963 CG GLU A 514 4.726 0.786 -25.699 1.00 39.40 C ATOM 1964 CD GLU A 514 3.584 1.266 -26.577 1.00 51.75 C ATOM 1965 OE1 GLU A 514 2.896 2.234 -26.192 1.00 55.32 O ATOM 1966 OE2 GLU A 514 3.374 0.671 -27.654 1.00 57.54 O ATOM 1967 H GLU A 514 4.752 -1.423 -23.702 1.00 0.00 H ATOM 1968 N PRO A 515 6.016 2.337 -21.715 1.00 33.61 N ATOM 1969 CA PRO A 515 5.918 3.006 -20.412 1.00 31.80 C ATOM 1970 C PRO A 515 4.504 2.933 -19.849 1.00 28.46 C ATOM 1971 O PRO A 515 3.549 3.180 -20.572 1.00 20.81 O ATOM 1972 CB PRO A 515 6.312 4.449 -20.729 1.00 46.34 C ATOM 1973 CG PRO A 515 7.189 4.343 -21.930 1.00 37.82 C ATOM 1974 CD PRO A 515 6.681 3.183 -22.724 1.00 47.96 C ATOM 1975 N LEU A 516 4.381 2.573 -18.577 1.00 22.16 N ATOM 1976 CA LEU A 516 3.077 2.412 -17.955 1.00 22.32 C ATOM 1977 C LEU A 516 2.417 3.763 -17.736 1.00 21.94 C ATOM 1978 O LEU A 516 3.092 4.737 -17.414 1.00 23.60 O ATOM 1979 CB LEU A 516 3.206 1.671 -16.623 1.00 18.02 C ATOM 1980 CG LEU A 516 3.753 0.241 -16.678 1.00 23.48 C ATOM 1981 CD1 LEU A 516 3.877 -0.330 -15.274 1.00 23.92 C ATOM 1982 CD2 LEU A 516 2.872 -0.649 -17.531 1.00 28.03 C ATOM 1983 H LEU A 516 5.238 2.402 -18.012 1.00 0.00 H ATOM 1984 N PRO A 517 1.087 3.828 -17.901 1.00 28.15 N ATOM 1985 CA PRO A 517 0.361 5.085 -17.696 1.00 27.86 C ATOM 1986 C PRO A 517 0.257 5.475 -16.225 1.00 25.26 C ATOM 1987 O PRO A 517 0.132 4.591 -15.379 1.00 24.83 O ATOM 1988 CB PRO A 517 -1.018 4.772 -18.263 1.00 32.10 C ATOM 1989 CG PRO A 517 -1.180 3.331 -17.985 1.00 23.57 C ATOM 1990 CD PRO A 517 0.166 2.737 -18.263 1.00 21.16 C ATOM 1991 N ARG A 518 0.289 6.775 -15.937 1.00 23.77 N ATOM 1992 CA ARG A 518 0.093 7.277 -14.579 1.00 27.91 C ATOM 1993 C ARG A 518 -1.387 7.460 -14.293 1.00 28.20 C ATOM 1994 O ARG A 518 -1.805 7.513 -13.139 1.00 31.24 O ATOM 1995 CB ARG A 518 0.827 8.605 -14.379 1.00 34.00 C ATOM 1996 CG ARG A 518 2.278 8.589 -14.832 1.00 50.42 C ATOM 1997 CD ARG A 518 3.022 9.822 -14.352 1.00 60.96 C ATOM 1998 NE ARG A 518 4.084 9.471 -13.412 1.00 72.15 N ATOM 1999 CZ ARG A 518 5.318 9.120 -13.764 1.00 55.28 C ATOM 2000 NH1 ARG A 518 6.208 8.814 -12.828 1.00 59.83 N ATOM 2001 NH2 ARG A 518 5.668 9.069 -15.045 1.00 62.77 N ATOM 2002 HE ARG A 518 3.860 9.497 -12.397 1.00 0.00 H ATOM 2003 HH12 ARG A 518 7.174 8.539 -13.099 1.00 0.00 H ATOM 2004 HH11 ARG A 518 5.940 8.849 -11.824 1.00 0.00 H ATOM 2005 HH22 ARG A 518 6.635 8.793 -15.309 1.00 0.00 H ATOM 2006 HH21 ARG A 518 4.975 9.305 -15.783 1.00 0.00 H ATOM 2007 H ARG A 518 0.459 7.456 -16.705 1.00 0.00 H ATOM 2008 N ASN A 519 -2.179 7.577 -15.357 1.00 26.00 N ATOM 2009 CA ASN A 519 -3.608 7.817 -15.232 1.00 27.87 C ATOM 2010 C ASN A 519 -4.265 7.694 -16.597 1.00 29.94 C ATOM 2011 O ASN A 519 -3.601 7.367 -17.579 1.00 34.60 O ATOM 2012 CB ASN A 519 -3.871 9.198 -14.625 1.00 38.00 C ATOM 2013 CG ASN A 519 -3.102 10.303 -15.332 1.00 36.43 C ATOM 2014 OD1 ASN A 519 -3.067 10.367 -16.563 1.00 34.14 O ATOM 2015 ND2 ASN A 519 -2.464 11.170 -14.553 1.00 42.41 N ATOM 2016 HD22 ASN A 519 -2.520 11.079 -13.519 1.00 0.00 H ATOM 2017 HD21 ASN A 519 -1.908 11.940 -14.978 1.00 0.00 H ATOM 2018 H ASN A 519 -1.763 7.494 -16.307 1.00 0.00 H ATOM 2019 N GLY A 520 -5.566 7.947 -16.659 1.00 37.25 N ATOM 2020 CA GLY A 520 -6.273 7.925 -17.927 1.00 41.88 C ATOM 2021 C GLY A 520 -6.848 6.563 -18.254 1.00 51.76 C ATOM 2022 O GLY A 520 -6.855 5.659 -17.416 1.00 41.11 O ATOM 2023 H GLY A 520 -6.087 8.164 -15.786 1.00 0.00 H ATOM 2024 N ASP A 521 -7.322 6.420 -19.487 1.00 41.09 N ATOM 2025 CA ASP A 521 -8.054 5.233 -19.907 1.00 42.03 C ATOM 2026 C ASP A 521 -7.190 3.980 -19.887 1.00 33.53 C ATOM 2027 O ASP A 521 -7.662 2.905 -19.529 1.00 37.46 O ATOM 2028 CB ASP A 521 -8.636 5.446 -21.310 1.00 48.38 C ATOM 2029 CG ASP A 521 -9.681 6.548 -21.348 1.00 63.48 C ATOM 2030 OD1 ASP A 521 -10.446 6.681 -20.370 1.00 53.20 O ATOM 2031 OD2 ASP A 521 -9.740 7.281 -22.359 1.00 74.54 O ATOM 2032 H ASP A 521 -7.165 7.183 -20.176 1.00 0.00 H ATOM 2033 N GLN A 522 -5.924 4.117 -20.267 1.00 30.95 N ATOM 2034 CA GLN A 522 -5.011 2.984 -20.283 1.00 28.56 C ATOM 2035 C GLN A 522 -4.766 2.472 -18.858 1.00 28.65 C ATOM 2036 O GLN A 522 -4.623 1.270 -18.634 1.00 29.97 O ATOM 2037 CB GLN A 522 -3.683 3.373 -20.935 1.00 34.10 C ATOM 2038 CG GLN A 522 -3.813 4.030 -22.304 1.00 65.79 C ATOM 2039 CD GLN A 522 -2.565 4.803 -22.707 1.00 80.66 C ATOM 2040 OE1 GLN A 522 -2.013 4.590 -23.787 1.00 76.09 O ATOM 2041 NE2 GLN A 522 -2.123 5.715 -21.844 1.00 55.71 N ATOM 2042 HE22 GLN A 522 -2.620 5.862 -20.943 1.00 0.00 H ATOM 2043 HE21 GLN A 522 -1.280 6.281 -22.071 1.00 0.00 H ATOM 2044 H GLN A 522 -5.579 5.053 -20.559 1.00 0.00 H ATOM 2045 N TRP A 523 -4.705 3.398 -17.906 1.00 28.83 N ATOM 2046 CA TRP A 523 -4.514 3.048 -16.502 1.00 27.79 C ATOM 2047 C TRP A 523 -5.681 2.185 -16.033 1.00 29.87 C ATOM 2048 O TRP A 523 -5.495 1.171 -15.374 1.00 26.47 O ATOM 2049 CB TRP A 523 -4.396 4.315 -15.647 1.00 29.59 C ATOM 2050 CG TRP A 523 -4.024 4.087 -14.218 1.00 30.13 C ATOM 2051 CD1 TRP A 523 -2.767 4.143 -13.679 1.00 23.79 C ATOM 2052 CD2 TRP A 523 -4.911 3.788 -13.131 1.00 26.26 C ATOM 2053 NE1 TRP A 523 -2.817 3.893 -12.333 1.00 23.91 N ATOM 2054 CE2 TRP A 523 -4.120 3.674 -11.968 1.00 24.94 C ATOM 2055 CE3 TRP A 523 -6.291 3.608 -13.026 1.00 28.09 C ATOM 2056 CZ2 TRP A 523 -4.664 3.377 -10.723 1.00 26.83 C ATOM 2057 CZ3 TRP A 523 -6.828 3.316 -11.787 1.00 29.18 C ATOM 2058 CH2 TRP A 523 -6.018 3.204 -10.652 1.00 27.49 C ATOM 2059 HE1 TRP A 523 -1.999 3.873 -11.692 1.00 0.00 H ATOM 2060 H TRP A 523 -4.796 4.400 -18.169 1.00 0.00 H ATOM 2061 N HIS A 524 -6.892 2.579 -16.401 1.00 34.09 N ATOM 2062 CA HIS A 524 -8.070 1.833 -15.984 1.00 39.87 C ATOM 2063 C HIS A 524 -8.173 0.459 -16.652 1.00 30.68 C ATOM 2064 O HIS A 524 -8.534 -0.513 -15.994 1.00 30.83 O ATOM 2065 CB HIS A 524 -9.326 2.660 -16.251 1.00 46.54 C ATOM 2066 CG HIS A 524 -9.573 3.708 -15.211 1.00 48.95 C ATOM 2067 ND1 HIS A 524 -10.027 3.405 -13.945 1.00 50.00 N ATOM 2068 CD2 HIS A 524 -9.409 5.051 -15.240 1.00 39.43 C ATOM 2069 CE1 HIS A 524 -10.143 4.517 -13.244 1.00 51.74 C ATOM 2070 NE2 HIS A 524 -9.776 5.531 -14.005 1.00 60.90 N ATOM 2071 H HIS A 524 -7.001 3.428 -16.992 1.00 0.00 H ATOM 2072 N GLU A 525 -7.869 0.369 -17.946 1.00 32.13 N ATOM 2073 CA GLU A 525 -7.849 -0.932 -18.622 1.00 30.46 C ATOM 2074 C GLU A 525 -6.983 -1.952 -17.865 1.00 30.43 C ATOM 2075 O GLU A 525 -7.368 -3.113 -17.710 1.00 29.76 O ATOM 2076 CB GLU A 525 -7.334 -0.799 -20.058 1.00 35.51 C ATOM 2077 CG GLU A 525 -8.206 0.046 -20.969 1.00 64.59 C ATOM 2078 CD GLU A 525 -7.490 0.444 -22.248 1.00 77.31 C ATOM 2079 OE1 GLU A 525 -7.769 1.542 -22.778 1.00 62.79 O ATOM 2080 OE2 GLU A 525 -6.648 -0.345 -22.724 1.00 69.35 O ATOM 2081 H GLU A 525 -7.643 1.231 -18.482 1.00 0.00 H ATOM 2082 N ILE A 526 -5.813 -1.524 -17.400 1.00 26.77 N ATOM 2083 CA ILE A 526 -4.934 -2.426 -16.660 1.00 25.15 C ATOM 2084 C ILE A 526 -5.600 -2.885 -15.367 1.00 29.61 C ATOM 2085 O ILE A 526 -5.523 -4.060 -15.009 1.00 26.09 O ATOM 2086 CB ILE A 526 -3.581 -1.770 -16.329 1.00 23.30 C ATOM 2087 CG1 ILE A 526 -2.780 -1.531 -17.607 1.00 24.62 C ATOM 2088 CG2 ILE A 526 -2.752 -2.654 -15.388 1.00 26.19 C ATOM 2089 CD1 ILE A 526 -1.551 -0.670 -17.389 1.00 24.11 C ATOM 2090 H ILE A 526 -5.521 -0.539 -17.564 1.00 0.00 H ATOM 2091 N ARG A 527 -6.259 -1.961 -14.673 1.00 29.82 N ATOM 2092 CA ARG A 527 -6.881 -2.289 -13.395 1.00 31.59 C ATOM 2093 C ARG A 527 -8.141 -3.118 -13.601 1.00 29.49 C ATOM 2094 O ARG A 527 -8.654 -3.734 -12.660 1.00 31.48 O ATOM 2095 CB ARG A 527 -7.199 -1.017 -12.606 1.00 28.01 C ATOM 2096 CG ARG A 527 -6.035 -0.510 -11.772 1.00 32.52 C ATOM 2097 CD ARG A 527 -4.964 0.109 -12.625 1.00 30.02 C ATOM 2098 NE ARG A 527 -3.720 0.313 -11.887 1.00 24.09 N ATOM 2099 CZ ARG A 527 -2.588 0.707 -12.460 1.00 27.51 C ATOM 2100 NH1 ARG A 527 -2.556 0.937 -13.769 1.00 31.27 N ATOM 2101 NH2 ARG A 527 -1.488 0.866 -11.733 1.00 23.79 N ATOM 2102 HE ARG A 527 -3.720 0.141 -10.861 1.00 0.00 H ATOM 2103 HH12 ARG A 527 -1.672 1.246 -14.221 1.00 0.00 H ATOM 2104 HH11 ARG A 527 -3.415 0.808 -14.341 1.00 0.00 H ATOM 2105 HH22 ARG A 527 -0.605 1.175 -12.187 1.00 0.00 H ATOM 2106 HH21 ARG A 527 -1.510 0.682 -10.710 1.00 0.00 H ATOM 2107 H ARG A 527 -6.332 -0.993 -15.046 1.00 0.00 H ATOM 2108 N GLN A 528 -8.648 -3.134 -14.830 1.00 31.79 N ATOM 2109 CA GLN A 528 -9.748 -4.018 -15.171 1.00 32.45 C ATOM 2110 C GLN A 528 -9.215 -5.434 -15.420 1.00 35.53 C ATOM 2111 O GLN A 528 -9.980 -6.361 -15.673 1.00 37.55 O ATOM 2112 CB GLN A 528 -10.516 -3.473 -16.386 1.00 34.03 C ATOM 2113 CG GLN A 528 -11.318 -2.225 -16.029 1.00 39.26 C ATOM 2114 CD GLN A 528 -11.977 -1.554 -17.216 1.00 77.78 C ATOM 2115 OE1 GLN A 528 -11.936 -2.059 -18.340 1.00 63.70 O ATOM 2116 NE2 GLN A 528 -12.592 -0.401 -16.969 1.00 54.91 N ATOM 2117 HE22 GLN A 528 -12.601 -0.013 -16.004 1.00 0.00 H ATOM 2118 HE21 GLN A 528 -13.064 0.112 -17.741 1.00 0.00 H ATOM 2119 H GLN A 528 -8.251 -2.505 -15.557 1.00 0.00 H ATOM 2120 N GLY A 529 -7.899 -5.592 -15.316 1.00 29.52 N ATOM 2121 CA GLY A 529 -7.266 -6.895 -15.402 1.00 32.05 C ATOM 2122 C GLY A 529 -6.602 -7.181 -16.739 1.00 37.08 C ATOM 2123 O GLY A 529 -6.172 -8.308 -16.976 1.00 27.62 O ATOM 2124 H GLY A 529 -7.303 -4.753 -15.168 1.00 0.00 H ATOM 2125 N ARG A 530 -6.517 -6.172 -17.605 1.00 27.79 N ATOM 2126 CA ARG A 530 -5.928 -6.335 -18.937 1.00 27.25 C ATOM 2127 C ARG A 530 -4.427 -6.083 -18.913 1.00 25.93 C ATOM 2128 O ARG A 530 -3.967 -4.978 -18.633 1.00 24.20 O ATOM 2129 CB ARG A 530 -6.606 -5.397 -19.940 1.00 29.48 C ATOM 2130 CG ARG A 530 -8.134 -5.449 -19.866 1.00 64.26 C ATOM 2131 CD ARG A 530 -8.815 -4.508 -20.854 1.00 68.33 C ATOM 2132 NE ARG A 530 -10.116 -4.056 -20.357 1.00 79.93 N ATOM 2133 CZ ARG A 530 -11.253 -4.741 -20.469 1.00 79.23 C ATOM 2134 NH1 ARG A 530 -11.273 -5.926 -21.068 1.00 65.40 N ATOM 2135 NH2 ARG A 530 -12.378 -4.236 -19.980 1.00 75.87 N ATOM 2136 HE ARG A 530 -10.155 -3.132 -19.881 1.00 0.00 H ATOM 2137 HH12 ARG A 530 -12.166 -6.452 -21.150 1.00 0.00 H ATOM 2138 HH11 ARG A 530 -10.395 -6.328 -21.455 1.00 0.00 H ATOM 2139 HH22 ARG A 530 -13.267 -4.768 -20.066 1.00 0.00 H ATOM 2140 HH21 ARG A 530 -12.371 -3.308 -19.511 1.00 0.00 H ATOM 2141 H ARG A 530 -6.881 -5.238 -17.327 1.00 0.00 H ATOM 2142 N LEU A 531 -3.669 -7.128 -19.210 1.00 24.15 N ATOM 2143 CA LEU A 531 -2.219 -7.072 -19.165 1.00 26.54 C ATOM 2144 C LEU A 531 -1.700 -6.143 -20.262 1.00 21.78 C ATOM 2145 O LEU A 531 -2.174 -6.223 -21.395 1.00 22.81 O ATOM 2146 CB LEU A 531 -1.659 -8.480 -19.335 1.00 29.39 C ATOM 2147 CG LEU A 531 -0.250 -8.775 -18.842 1.00 33.04 C ATOM 2148 CD1 LEU A 531 -0.155 -8.597 -17.338 1.00 23.57 C ATOM 2149 CD2 LEU A 531 0.130 -10.188 -19.239 1.00 33.83 C ATOM 2150 H LEU A 531 -4.129 -8.020 -19.485 1.00 0.00 H ATOM 2151 N PRO A 532 -0.752 -5.244 -19.937 1.00 20.50 N ATOM 2152 CA PRO A 532 -0.184 -4.426 -21.016 1.00 28.83 C ATOM 2153 C PRO A 532 0.438 -5.273 -22.115 1.00 31.66 C ATOM 2154 O PRO A 532 0.900 -6.379 -21.849 1.00 22.58 O ATOM 2155 CB PRO A 532 0.888 -3.596 -20.310 1.00 23.15 C ATOM 2156 CG PRO A 532 0.406 -3.500 -18.882 1.00 26.78 C ATOM 2157 CD PRO A 532 -0.270 -4.817 -18.609 1.00 21.07 C ATOM 2158 N ARG A 533 0.441 -4.750 -23.334 1.00 25.81 N ATOM 2159 CA ARG A 533 1.032 -5.444 -24.470 1.00 20.54 C ATOM 2160 C ARG A 533 2.521 -5.685 -24.255 1.00 18.94 C ATOM 2161 O ARG A 533 3.241 -4.791 -23.798 1.00 22.76 O ATOM 2162 CB ARG A 533 0.822 -4.636 -25.746 1.00 21.64 C ATOM 2163 CG ARG A 533 -0.621 -4.601 -26.227 1.00 24.60 C ATOM 2164 CD ARG A 533 -0.830 -3.571 -27.327 1.00 24.84 C ATOM 2165 NE ARG A 533 -2.212 -3.089 -27.326 1.00 62.93 N ATOM 2166 CZ ARG A 533 -2.583 -1.820 -27.166 1.00 34.33 C ATOM 2167 NH1 ARG A 533 -1.683 -0.854 -27.013 1.00 45.45 N ATOM 2168 NH2 ARG A 533 -3.872 -1.509 -27.179 1.00 68.34 N ATOM 2169 HE ARG A 533 -2.965 -3.794 -27.461 1.00 0.00 H ATOM 2170 HH12 ARG A 533 -1.993 0.131 -26.889 1.00 0.00 H ATOM 2171 HH11 ARG A 533 -0.669 -1.083 -27.017 1.00 0.00 H ATOM 2172 HH22 ARG A 533 -4.170 -0.520 -27.055 1.00 0.00 H ATOM 2173 HH21 ARG A 533 -4.585 -2.254 -27.313 1.00 0.00 H ATOM 2174 H ARG A 533 0.008 -3.816 -23.483 1.00 0.00 H ATOM 2175 N ILE A 534 2.970 -6.892 -24.584 1.00 18.80 N ATOM 2176 CA ILE A 534 4.381 -7.257 -24.522 1.00 17.24 C ATOM 2177 C ILE A 534 4.824 -7.632 -25.945 1.00 17.64 C ATOM 2178 O ILE A 534 4.259 -8.539 -26.552 1.00 24.95 O ATOM 2179 CB ILE A 534 4.617 -8.413 -23.524 1.00 17.24 C ATOM 2180 CG1 ILE A 534 4.288 -7.941 -22.102 1.00 27.04 C ATOM 2181 CG2 ILE A 534 6.062 -8.901 -23.562 1.00 15.50 C ATOM 2182 CD1 ILE A 534 4.165 -9.059 -21.074 1.00 23.68 C ATOM 2183 H ILE A 534 2.285 -7.608 -24.900 1.00 0.00 H ATOM 2184 N PRO A 535 5.825 -6.918 -26.490 1.00 17.34 N ATOM 2185 CA PRO A 535 6.205 -7.130 -27.895 1.00 21.61 C ATOM 2186 C PRO A 535 6.854 -8.490 -28.172 1.00 21.60 C ATOM 2187 O PRO A 535 6.735 -8.979 -29.292 1.00 25.08 O ATOM 2188 CB PRO A 535 7.191 -5.991 -28.168 1.00 22.82 C ATOM 2189 CG PRO A 535 7.757 -5.640 -26.839 1.00 29.47 C ATOM 2190 CD PRO A 535 6.663 -5.897 -25.834 1.00 21.86 C ATOM 2191 N GLN A 536 7.510 -9.095 -27.184 1.00 22.55 N ATOM 2192 CA GLN A 536 8.170 -10.383 -27.408 1.00 20.80 C ATOM 2193 C GLN A 536 7.270 -11.558 -27.066 1.00 32.08 C ATOM 2194 O GLN A 536 6.376 -11.450 -26.230 1.00 18.36 O ATOM 2195 CB GLN A 536 9.453 -10.484 -26.591 1.00 17.29 C ATOM 2196 CG GLN A 536 9.244 -10.516 -25.089 1.00 16.09 C ATOM 2197 CD GLN A 536 10.540 -10.761 -24.348 1.00 24.46 C ATOM 2198 OE1 GLN A 536 11.208 -11.776 -24.562 1.00 25.62 O ATOM 2199 NE2 GLN A 536 10.912 -9.826 -23.486 1.00 21.93 N ATOM 2200 HE22 GLN A 536 10.315 -8.987 -23.339 1.00 0.00 H ATOM 2201 HE21 GLN A 536 11.801 -9.931 -22.956 1.00 0.00 H ATOM 2202 H GLN A 536 7.554 -8.649 -26.245 1.00 0.00 H ATOM 2203 N VAL A 537 7.536 -12.691 -27.703 1.00 22.24 N ATOM 2204 CA VAL A 537 6.785 -13.908 -27.457 1.00 19.82 C ATOM 2205 C VAL A 537 7.124 -14.495 -26.086 1.00 19.81 C ATOM 2206 O VAL A 537 8.297 -14.712 -25.760 1.00 21.44 O ATOM 2207 CB VAL A 537 7.067 -14.964 -28.541 1.00 27.09 C ATOM 2208 CG1 VAL A 537 6.357 -16.280 -28.230 1.00 29.99 C ATOM 2209 CG2 VAL A 537 6.640 -14.449 -29.908 1.00 29.00 C ATOM 2210 H VAL A 537 8.307 -12.707 -28.401 1.00 0.00 H ATOM 2211 N LEU A 538 6.082 -14.740 -25.296 1.00 28.52 N ATOM 2212 CA LEU A 538 6.202 -15.434 -24.019 1.00 20.10 C ATOM 2213 C LEU A 538 5.229 -16.612 -23.996 1.00 20.21 C ATOM 2214 O LEU A 538 4.179 -16.587 -24.650 1.00 23.91 O ATOM 2215 CB LEU A 538 5.920 -14.489 -22.843 1.00 19.06 C ATOM 2216 CG LEU A 538 6.752 -13.208 -22.748 1.00 18.42 C ATOM 2217 CD1 LEU A 538 6.209 -12.322 -21.646 1.00 26.22 C ATOM 2218 CD2 LEU A 538 8.236 -13.492 -22.514 1.00 26.12 C ATOM 2219 H LEU A 538 5.140 -14.423 -25.603 1.00 0.00 H ATOM 2220 N SER A 539 5.579 -17.649 -23.244 1.00 24.82 N ATOM 2221 CA SER A 539 4.724 -18.819 -23.119 1.00 25.70 C ATOM 2222 C SER A 539 3.363 -18.409 -22.557 1.00 22.22 C ATOM 2223 O SER A 539 3.281 -17.457 -21.780 1.00 25.08 O ATOM 2224 CB SER A 539 5.382 -19.864 -22.219 1.00 30.83 C ATOM 2225 OG SER A 539 5.370 -19.437 -20.863 1.00 26.31 O ATOM 2226 HG SER A 539 5.867 -18.585 -20.782 1.00 0.00 H ATOM 2227 H SER A 539 6.485 -17.624 -22.733 1.00 0.00 H ATOM 2228 N GLN A 540 2.301 -19.112 -22.956 1.00 24.06 N ATOM 2229 CA GLN A 540 0.957 -18.806 -22.463 1.00 26.17 C ATOM 2230 C GLN A 540 0.850 -18.942 -20.947 1.00 35.00 C ATOM 2231 O GLN A 540 0.152 -18.165 -20.305 1.00 27.87 O ATOM 2232 CB GLN A 540 -0.094 -19.709 -23.116 1.00 30.79 C ATOM 2233 CG GLN A 540 -1.499 -19.461 -22.568 1.00 40.36 C ATOM 2234 CD GLN A 540 -2.595 -20.080 -23.417 1.00 51.97 C ATOM 2235 OE1 GLN A 540 -3.381 -19.374 -24.048 1.00 67.79 O ATOM 2236 NE2 GLN A 540 -2.663 -21.403 -23.420 1.00 39.93 N ATOM 2237 HE22 GLN A 540 -1.977 -21.960 -22.872 1.00 0.00 H ATOM 2238 HE21 GLN A 540 -3.402 -21.884 -23.971 1.00 0.00 H ATOM 2239 H GLN A 540 2.431 -19.893 -23.631 1.00 0.00 H ATOM 2240 N GLU A 541 1.539 -19.921 -20.374 1.00 31.88 N ATOM 2241 CA GLU A 541 1.433 -20.164 -18.940 1.00 32.46 C ATOM 2242 C GLU A 541 2.062 -19.015 -18.154 1.00 33.04 C ATOM 2243 O GLU A 541 1.572 -18.641 -17.091 1.00 27.97 O ATOM 2244 CB GLU A 541 2.089 -21.496 -18.569 1.00 33.13 C ATOM 2245 CG GLU A 541 2.021 -21.831 -17.081 1.00 67.00 C ATOM 2246 CD GLU A 541 2.571 -23.211 -16.764 1.00 87.37 C ATOM 2247 OE1 GLU A 541 3.360 -23.745 -17.576 1.00 67.79 O ATOM 2248 OE2 GLU A 541 2.211 -23.762 -15.701 1.00 74.17 O ATOM 2249 H GLU A 541 2.161 -20.521 -20.953 1.00 0.00 H ATOM 2250 N PHE A 542 3.142 -18.454 -18.682 1.00 22.00 N ATOM 2251 CA PHE A 542 3.787 -17.317 -18.047 1.00 20.31 C ATOM 2252 C PHE A 542 2.924 -16.055 -18.173 1.00 26.89 C ATOM 2253 O PHE A 542 2.761 -15.307 -17.214 1.00 24.82 O ATOM 2254 CB PHE A 542 5.172 -17.093 -18.654 1.00 23.30 C ATOM 2255 CG PHE A 542 6.006 -16.087 -17.912 1.00 21.82 C ATOM 2256 CD1 PHE A 542 6.226 -16.219 -16.550 1.00 26.84 C ATOM 2257 CD2 PHE A 542 6.579 -15.019 -18.575 1.00 22.76 C ATOM 2258 CE1 PHE A 542 6.992 -15.301 -15.867 1.00 25.73 C ATOM 2259 CE2 PHE A 542 7.353 -14.092 -17.893 1.00 23.21 C ATOM 2260 CZ PHE A 542 7.555 -14.231 -16.540 1.00 24.81 C ATOM 2261 H PHE A 542 3.534 -18.835 -19.567 1.00 0.00 H ATOM 2262 N THR A 543 2.363 -15.840 -19.358 1.00 20.69 N ATOM 2263 CA THR A 543 1.446 -14.735 -19.609 1.00 21.31 C ATOM 2264 C THR A 543 0.243 -14.781 -18.665 1.00 25.90 C ATOM 2265 O THR A 543 -0.157 -13.760 -18.101 1.00 26.75 O ATOM 2266 CB THR A 543 0.959 -14.765 -21.103 1.00 21.80 C ATOM 2267 OG1 THR A 543 2.049 -14.389 -21.949 1.00 37.70 O ATOM 2268 CG2 THR A 543 -0.203 -13.821 -21.344 1.00 45.11 C ATOM 2269 HG1 THR A 543 1.753 -14.405 -22.894 1.00 0.00 H ATOM 2270 H THR A 543 2.588 -16.488 -20.140 1.00 0.00 H ATOM 2271 N GLU A 544 -0.324 -15.970 -18.495 1.00 28.29 N ATOM 2272 CA GLU A 544 -1.530 -16.140 -17.690 1.00 25.92 C ATOM 2273 C GLU A 544 -1.263 -15.920 -16.196 1.00 24.90 C ATOM 2274 O GLU A 544 -2.156 -15.498 -15.460 1.00 25.76 O ATOM 2275 CB GLU A 544 -2.122 -17.529 -17.927 1.00 31.71 C ATOM 2276 CG GLU A 544 -2.718 -17.710 -19.326 1.00 37.06 C ATOM 2277 CD GLU A 544 -4.005 -16.929 -19.539 1.00 56.07 C ATOM 2278 OE1 GLU A 544 -4.711 -16.637 -18.549 1.00 60.34 O ATOM 2279 OE2 GLU A 544 -4.314 -16.606 -20.706 1.00 65.18 O ATOM 2280 H GLU A 544 0.103 -16.803 -18.948 1.00 0.00 H ATOM 2281 N LEU A 545 -0.038 -16.202 -15.762 1.00 23.61 N ATOM 2282 CA LEU A 545 0.371 -15.922 -14.388 1.00 28.41 C ATOM 2283 C LEU A 545 0.463 -14.419 -14.138 1.00 23.59 C ATOM 2284 O LEU A 545 -0.027 -13.927 -13.127 1.00 23.84 O ATOM 2285 CB LEU A 545 1.713 -16.585 -14.076 1.00 22.69 C ATOM 2286 CG LEU A 545 2.302 -16.282 -12.696 1.00 33.18 C ATOM 2287 CD1 LEU A 545 1.300 -16.585 -11.587 1.00 30.79 C ATOM 2288 CD2 LEU A 545 3.581 -17.071 -12.486 1.00 28.12 C ATOM 2289 H LEU A 545 0.646 -16.632 -16.417 1.00 0.00 H ATOM 2290 N LEU A 546 1.093 -13.691 -15.053 1.00 20.50 N ATOM 2291 CA LEU A 546 1.196 -12.246 -14.911 1.00 19.41 C ATOM 2292 C LEU A 546 -0.205 -11.633 -14.870 1.00 24.71 C ATOM 2293 O LEU A 546 -0.463 -10.693 -14.112 1.00 23.10 O ATOM 2294 CB LEU A 546 2.021 -11.643 -16.052 1.00 20.36 C ATOM 2295 CG LEU A 546 3.521 -11.972 -16.035 1.00 20.28 C ATOM 2296 CD1 LEU A 546 4.182 -11.428 -17.281 1.00 18.61 C ATOM 2297 CD2 LEU A 546 4.235 -11.428 -14.788 1.00 22.02 C ATOM 2298 H LEU A 546 1.517 -14.158 -15.880 1.00 0.00 H ATOM 2299 N LYS A 547 -1.107 -12.203 -15.663 1.00 22.09 N ATOM 2300 CA LYS A 547 -2.465 -11.691 -15.807 1.00 29.72 C ATOM 2301 C LYS A 547 -3.288 -11.867 -14.531 1.00 30.10 C ATOM 2302 O LYS A 547 -3.978 -10.946 -14.096 1.00 25.27 O ATOM 2303 CB LYS A 547 -3.161 -12.387 -16.985 1.00 27.41 C ATOM 2304 CG LYS A 547 -4.601 -11.947 -17.227 1.00 27.32 C ATOM 2305 CD LYS A 547 -5.144 -12.493 -18.561 1.00 30.61 C ATOM 2306 CE LYS A 547 -6.647 -12.287 -18.679 1.00 49.30 C ATOM 2307 NZ LYS A 547 -7.017 -10.854 -18.546 1.00 48.46 N ATOM 2308 HZ1 LYS A 547 -6.710 -10.503 -17.617 1.00 0.00 H ATOM 2309 HZ2 LYS A 547 -6.551 -10.306 -19.297 1.00 0.00 H ATOM 2310 HZ3 LYS A 547 -8.049 -10.754 -18.632 1.00 0.00 H ATOM 2311 H LYS A 547 -0.833 -13.049 -16.203 1.00 0.00 H ATOM 2312 N VAL A 548 -3.219 -13.044 -13.923 1.00 25.48 N ATOM 2313 CA VAL A 548 -3.978 -13.274 -12.699 1.00 26.86 C ATOM 2314 C VAL A 548 -3.374 -12.458 -11.557 1.00 25.61 C ATOM 2315 O VAL A 548 -4.062 -12.118 -10.599 1.00 26.54 O ATOM 2316 CB VAL A 548 -4.031 -14.773 -12.326 1.00 29.57 C ATOM 2317 CG1 VAL A 548 -2.676 -15.286 -11.865 1.00 26.79 C ATOM 2318 CG2 VAL A 548 -5.104 -15.020 -11.249 1.00 31.98 C ATOM 2319 H VAL A 548 -2.625 -13.801 -14.318 1.00 0.00 H ATOM 2320 N MET A 549 -2.093 -12.121 -11.670 1.00 23.62 N ATOM 2321 CA MET A 549 -1.445 -11.301 -10.654 1.00 22.47 C ATOM 2322 C MET A 549 -1.996 -9.874 -10.653 1.00 25.71 C ATOM 2323 O MET A 549 -1.814 -9.161 -9.677 1.00 21.99 O ATOM 2324 CB MET A 549 0.076 -11.261 -10.855 1.00 22.68 C ATOM 2325 CG MET A 549 0.822 -12.501 -10.392 1.00 24.51 C ATOM 2326 SD MET A 549 2.557 -12.490 -10.898 1.00 22.77 S ATOM 2327 CE MET A 549 3.248 -11.275 -9.767 1.00 22.44 C ATOM 2328 H MET A 549 -1.547 -12.446 -12.493 1.00 0.00 H ATOM 2329 N ILE A 550 -2.664 -9.456 -11.730 1.00 22.89 N ATOM 2330 CA ILE A 550 -3.240 -8.112 -11.787 1.00 23.10 C ATOM 2331 C ILE A 550 -4.771 -8.178 -11.831 1.00 25.27 C ATOM 2332 O ILE A 550 -5.436 -7.231 -12.247 1.00 28.84 O ATOM 2333 CB ILE A 550 -2.714 -7.291 -12.997 1.00 22.07 C ATOM 2334 CG1 ILE A 550 -3.128 -7.891 -14.346 1.00 23.11 C ATOM 2335 CG2 ILE A 550 -1.189 -7.162 -12.934 1.00 20.11 C ATOM 2336 CD1 ILE A 550 -3.018 -6.884 -15.492 1.00 22.49 C ATOM 2337 H ILE A 550 -2.777 -10.096 -12.542 1.00 0.00 H ATOM 2338 N HIS A 551 -5.320 -9.300 -11.387 1.00 26.62 N ATOM 2339 CA HIS A 551 -6.768 -9.479 -11.351 1.00 28.95 C ATOM 2340 C HIS A 551 -7.444 -8.369 -10.532 1.00 30.55 C ATOM 2341 O HIS A 551 -6.931 -7.994 -9.481 1.00 28.91 O ATOM 2342 CB HIS A 551 -7.118 -10.841 -10.755 1.00 30.38 C ATOM 2343 CG HIS A 551 -8.499 -11.301 -11.091 1.00 32.93 C ATOM 2344 ND1 HIS A 551 -9.602 -10.951 -10.346 1.00 34.78 N ATOM 2345 CD2 HIS A 551 -8.959 -12.073 -12.105 1.00 42.00 C ATOM 2346 CE1 HIS A 551 -10.684 -11.494 -10.880 1.00 37.03 C ATOM 2347 NE2 HIS A 551 -10.320 -12.178 -11.949 1.00 53.28 N ATOM 2348 H HIS A 551 -4.705 -10.071 -11.057 1.00 0.00 H ATOM 2349 N PRO A 552 -8.592 -7.842 -11.008 1.00 31.26 N ATOM 2350 CA PRO A 552 -9.322 -6.796 -10.275 1.00 32.21 C ATOM 2351 C PRO A 552 -9.681 -7.190 -8.843 1.00 42.32 C ATOM 2352 O PRO A 552 -9.705 -6.341 -7.954 1.00 34.42 O ATOM 2353 CB PRO A 552 -10.599 -6.601 -11.109 1.00 34.33 C ATOM 2354 CG PRO A 552 -10.267 -7.055 -12.447 1.00 44.16 C ATOM 2355 CD PRO A 552 -9.183 -8.091 -12.333 1.00 32.27 C ATOM 2356 N ASP A 553 -9.959 -8.470 -8.632 1.00 34.36 N ATOM 2357 CA ASP A 553 -10.258 -8.989 -7.301 1.00 35.54 C ATOM 2358 C ASP A 553 -8.958 -9.383 -6.616 1.00 33.69 C ATOM 2359 O ASP A 553 -8.337 -10.363 -7.017 1.00 35.79 O ATOM 2360 CB ASP A 553 -11.195 -10.199 -7.390 1.00 38.00 C ATOM 2361 CG ASP A 553 -11.801 -10.586 -6.045 1.00 48.74 C ATOM 2362 OD1 ASP A 553 -11.179 -10.334 -4.993 1.00 40.39 O ATOM 2363 OD2 ASP A 553 -12.909 -11.159 -6.044 1.00 45.89 O ATOM 2364 H ASP A 553 -9.964 -9.124 -9.440 1.00 0.00 H ATOM 2365 N PRO A 554 -8.539 -8.631 -5.580 1.00 34.44 N ATOM 2366 CA PRO A 554 -7.278 -8.995 -4.919 1.00 31.30 C ATOM 2367 C PRO A 554 -7.241 -10.448 -4.447 1.00 32.40 C ATOM 2368 O PRO A 554 -6.185 -11.075 -4.487 1.00 31.43 O ATOM 2369 CB PRO A 554 -7.213 -8.052 -3.714 1.00 32.82 C ATOM 2370 CG PRO A 554 -8.175 -6.962 -3.991 1.00 44.82 C ATOM 2371 CD PRO A 554 -9.183 -7.460 -4.958 1.00 36.81 C ATOM 2372 N GLU A 555 -8.378 -10.984 -4.012 1.00 36.96 N ATOM 2373 CA GLU A 555 -8.385 -12.333 -3.452 1.00 40.54 C ATOM 2374 C GLU A 555 -8.075 -13.377 -4.521 1.00 41.22 C ATOM 2375 O GLU A 555 -7.664 -14.492 -4.199 1.00 39.07 O ATOM 2376 CB GLU A 555 -9.727 -12.649 -2.777 1.00 46.89 C ATOM 2377 CG GLU A 555 -9.556 -13.074 -1.321 1.00 59.02 C ATOM 2378 CD GLU A 555 -10.807 -13.676 -0.705 1.00 86.83 C ATOM 2379 OE1 GLU A 555 -11.895 -13.579 -1.316 1.00 45.27 O ATOM 2380 OE2 GLU A 555 -10.694 -14.251 0.401 1.00 62.04 O ATOM 2381 H GLU A 555 -9.263 -10.442 -4.071 1.00 0.00 H ATOM 2382 N ARG A 556 -8.253 -13.013 -5.789 1.00 35.50 N ATOM 2383 CA ARG A 556 -7.927 -13.920 -6.885 1.00 35.27 C ATOM 2384 C ARG A 556 -6.442 -13.886 -7.236 1.00 32.63 C ATOM 2385 O ARG A 556 -5.933 -14.814 -7.868 1.00 34.62 O ATOM 2386 CB ARG A 556 -8.761 -13.583 -8.121 1.00 35.93 C ATOM 2387 CG ARG A 556 -10.263 -13.718 -7.899 1.00 45.79 C ATOM 2388 CD ARG A 556 -10.671 -15.165 -7.640 1.00 49.38 C ATOM 2389 NE ARG A 556 -10.402 -16.025 -8.791 1.00 59.53 N ATOM 2390 CZ ARG A 556 -11.239 -16.206 -9.809 1.00 60.04 C ATOM 2391 NH1 ARG A 556 -12.412 -15.586 -9.838 1.00 66.94 N ATOM 2392 NH2 ARG A 556 -10.900 -17.012 -10.804 1.00 74.73 N ATOM 2393 HE ARG A 556 -9.493 -16.530 -8.816 1.00 0.00 H ATOM 2394 HH12 ARG A 556 -13.059 -15.734 -10.639 1.00 0.00 H ATOM 2395 HH11 ARG A 556 -12.684 -14.952 -9.060 1.00 0.00 H ATOM 2396 HH22 ARG A 556 -11.552 -17.156 -11.602 1.00 0.00 H ATOM 2397 HH21 ARG A 556 -9.982 -17.501 -10.788 1.00 0.00 H ATOM 2398 H ARG A 556 -8.630 -12.068 -6.002 1.00 0.00 H ATOM 2399 N ARG A 557 -5.752 -12.816 -6.849 1.00 31.64 N ATOM 2400 CA ARG A 557 -4.308 -12.745 -7.056 1.00 33.74 C ATOM 2401 C ARG A 557 -3.630 -13.742 -6.125 1.00 30.49 C ATOM 2402 O ARG A 557 -4.040 -13.892 -4.968 1.00 32.27 O ATOM 2403 CB ARG A 557 -3.770 -11.331 -6.805 1.00 26.74 C ATOM 2404 CG ARG A 557 -4.432 -10.255 -7.656 1.00 27.05 C ATOM 2405 CD ARG A 557 -3.973 -8.853 -7.266 1.00 29.54 C ATOM 2406 NE ARG A 557 -4.967 -7.855 -7.658 1.00 27.95 N ATOM 2407 CZ ARG A 557 -5.104 -6.655 -7.101 1.00 40.21 C ATOM 2408 NH1 ARG A 557 -4.300 -6.263 -6.120 1.00 25.07 N ATOM 2409 NH2 ARG A 557 -6.057 -5.838 -7.528 1.00 31.18 N ATOM 2410 HE ARG A 557 -5.617 -8.102 -8.432 1.00 0.00 H ATOM 2411 HH12 ARG A 557 -4.420 -5.322 -5.694 1.00 0.00 H ATOM 2412 HH11 ARG A 557 -3.551 -6.897 -5.777 1.00 0.00 H ATOM 2413 HH22 ARG A 557 -6.169 -4.899 -7.096 1.00 0.00 H ATOM 2414 HH21 ARG A 557 -6.693 -6.137 -8.295 1.00 0.00 H ATOM 2415 H ARG A 557 -6.246 -12.022 -6.394 1.00 0.00 H ATOM 2416 N PRO A 558 -2.604 -14.449 -6.621 1.00 27.72 N ATOM 2417 CA PRO A 558 -1.863 -15.341 -5.725 1.00 28.91 C ATOM 2418 C PRO A 558 -1.107 -14.576 -4.657 1.00 26.87 C ATOM 2419 O PRO A 558 -0.607 -13.489 -4.936 1.00 27.26 O ATOM 2420 CB PRO A 558 -0.886 -16.051 -6.668 1.00 31.88 C ATOM 2421 CG PRO A 558 -0.733 -15.118 -7.811 1.00 27.52 C ATOM 2422 CD PRO A 558 -2.092 -14.525 -7.997 1.00 28.50 C ATOM 2423 N SER A 559 -1.029 -15.128 -3.451 1.00 28.03 N ATOM 2424 CA SER A 559 -0.106 -14.611 -2.445 1.00 28.86 C ATOM 2425 C SER A 559 1.320 -14.821 -2.941 1.00 25.28 C ATOM 2426 O SER A 559 1.528 -15.512 -3.929 1.00 26.72 O ATOM 2427 CB SER A 559 -0.300 -15.316 -1.110 1.00 33.18 C ATOM 2428 OG SER A 559 -0.043 -16.701 -1.246 1.00 30.05 O ATOM 2429 HG SER A 559 -0.173 -17.147 -0.372 1.00 0.00 H ATOM 2430 H SER A 559 -1.635 -15.941 -3.220 1.00 0.00 H ATOM 2431 N ALA A 560 2.303 -14.248 -2.250 1.00 27.17 N ATOM 2432 CA ALA A 560 3.698 -14.477 -2.619 1.00 26.45 C ATOM 2433 C ALA A 560 4.045 -15.956 -2.452 1.00 24.01 C ATOM 2434 O ALA A 560 4.746 -16.533 -3.281 1.00 27.03 O ATOM 2435 CB ALA A 560 4.627 -13.607 -1.787 1.00 23.87 C ATOM 2436 H ALA A 560 2.076 -13.633 -1.442 1.00 0.00 H ATOM 2437 N MET A 561 3.534 -16.572 -1.389 1.00 25.93 N ATOM 2438 CA MET A 561 3.754 -17.997 -1.161 1.00 27.56 C ATOM 2439 C MET A 561 3.214 -18.811 -2.328 1.00 33.40 C ATOM 2440 O MET A 561 3.912 -19.659 -2.893 1.00 31.66 O ATOM 2441 CB MET A 561 3.092 -18.447 0.147 1.00 29.86 C ATOM 2442 CG MET A 561 3.228 -19.937 0.425 1.00 58.66 C ATOM 2443 SD MET A 561 4.936 -20.521 0.361 1.00 74.55 S ATOM 2444 CE MET A 561 5.290 -20.725 2.107 1.00 60.22 C ATOM 2445 H MET A 561 2.967 -16.028 -0.708 1.00 0.00 H ATOM 2446 N ALA A 562 1.971 -18.543 -2.703 1.00 33.88 N ATOM 2447 CA ALA A 562 1.371 -19.241 -3.831 1.00 29.63 C ATOM 2448 C ALA A 562 2.111 -18.910 -5.132 1.00 29.11 C ATOM 2449 O ALA A 562 2.240 -19.768 -6.006 1.00 33.53 O ATOM 2450 CB ALA A 562 -0.112 -18.892 -3.944 1.00 32.99 C ATOM 2451 H ALA A 562 1.420 -17.828 -2.187 1.00 0.00 H ATOM 2452 N LEU A 563 2.608 -17.679 -5.253 1.00 32.72 N ATOM 2453 CA LEU A 563 3.328 -17.264 -6.459 1.00 37.33 C ATOM 2454 C LEU A 563 4.593 -18.086 -6.693 1.00 29.06 C ATOM 2455 O LEU A 563 4.815 -18.593 -7.797 1.00 27.52 O ATOM 2456 CB LEU A 563 3.697 -15.776 -6.389 1.00 22.94 C ATOM 2457 CG LEU A 563 4.640 -15.242 -7.470 1.00 31.92 C ATOM 2458 CD1 LEU A 563 3.983 -15.314 -8.840 1.00 25.92 C ATOM 2459 CD2 LEU A 563 5.065 -13.822 -7.149 1.00 24.65 C ATOM 2460 H LEU A 563 2.482 -17.000 -4.476 1.00 0.00 H ATOM 2461 N VAL A 564 5.426 -18.218 -5.666 1.00 28.96 N ATOM 2462 CA VAL A 564 6.716 -18.872 -5.851 1.00 29.53 C ATOM 2463 C VAL A 564 6.564 -20.381 -6.015 1.00 36.87 C ATOM 2464 O VAL A 564 7.500 -21.049 -6.442 1.00 36.36 O ATOM 2465 CB VAL A 564 7.694 -18.576 -4.690 1.00 38.04 C ATOM 2466 CG1 VAL A 564 7.939 -17.074 -4.577 1.00 39.00 C ATOM 2467 CG2 VAL A 564 7.188 -19.141 -3.376 1.00 48.22 C ATOM 2468 H VAL A 564 5.158 -17.854 -4.729 1.00 0.00 H ATOM 2469 N LYS A 565 5.386 -20.917 -5.698 1.00 29.19 N ATOM 2470 CA LYS A 565 5.119 -22.330 -5.962 1.00 29.10 C ATOM 2471 C LYS A 565 4.368 -22.528 -7.281 1.00 39.37 C ATOM 2472 O LYS A 565 3.356 -23.221 -7.333 1.00 43.16 O ATOM 2473 CB LYS A 565 4.345 -22.955 -4.801 1.00 40.78 C ATOM 2474 CG LYS A 565 5.180 -23.034 -3.539 1.00 41.68 C ATOM 2475 CD LYS A 565 4.696 -24.111 -2.583 1.00 67.72 C ATOM 2476 CE LYS A 565 5.489 -24.086 -1.280 1.00 63.16 C ATOM 2477 NZ LYS A 565 6.839 -23.453 -1.432 1.00 66.22 N ATOM 2478 HZ1 LYS A 565 7.394 -23.986 -2.131 1.00 0.00 H ATOM 2479 HZ2 LYS A 565 6.726 -22.471 -1.754 1.00 0.00 H ATOM 2480 HZ3 LYS A 565 7.331 -23.464 -0.516 1.00 0.00 H ATOM 2481 H LYS A 565 4.651 -20.326 -5.260 1.00 0.00 H ATOM 2482 N HIS A 566 4.879 -21.915 -8.345 1.00 36.96 N ATOM 2483 CA HIS A 566 4.401 -22.193 -9.699 1.00 33.17 C ATOM 2484 C HIS A 566 5.489 -22.896 -10.480 1.00 32.53 C ATOM 2485 O HIS A 566 6.603 -22.381 -10.605 1.00 33.12 O ATOM 2486 CB HIS A 566 3.975 -20.913 -10.419 1.00 32.68 C ATOM 2487 CG HIS A 566 2.557 -20.524 -10.151 1.00 36.05 C ATOM 2488 ND1 HIS A 566 1.543 -20.730 -11.059 1.00 44.77 N ATOM 2489 CD2 HIS A 566 1.982 -19.952 -9.067 1.00 38.93 C ATOM 2490 CE1 HIS A 566 0.403 -20.300 -10.548 1.00 47.29 C ATOM 2491 NE2 HIS A 566 0.642 -19.824 -9.339 1.00 41.66 N ATOM 2492 H HIS A 566 5.640 -21.219 -8.210 1.00 0.00 H ATOM 2493 N SER A 567 5.155 -24.075 -10.998 1.00 36.60 N ATOM 2494 CA SER A 567 6.094 -24.894 -11.750 1.00 43.27 C ATOM 2495 C SER A 567 6.717 -24.119 -12.903 1.00 35.85 C ATOM 2496 O SER A 567 7.868 -24.363 -13.268 1.00 37.65 O ATOM 2497 CB SER A 567 5.393 -26.145 -12.282 1.00 44.40 C ATOM 2498 OG SER A 567 4.988 -26.984 -11.218 1.00 69.09 O ATOM 2499 HG SER A 567 4.538 -27.786 -11.585 1.00 0.00 H ATOM 2500 H SER A 567 4.185 -24.425 -10.860 1.00 0.00 H ATOM 2501 N VAL A 568 5.955 -23.182 -13.465 1.00 35.72 N ATOM 2502 CA VAL A 568 6.396 -22.440 -14.642 1.00 39.38 C ATOM 2503 C VAL A 568 7.655 -21.629 -14.362 1.00 44.80 C ATOM 2504 O VAL A 568 8.437 -21.356 -15.268 1.00 41.26 O ATOM 2505 CB VAL A 568 5.275 -21.498 -15.176 1.00 38.66 C ATOM 2506 CG1 VAL A 568 5.068 -20.245 -14.275 1.00 44.59 C ATOM 2507 CG2 VAL A 568 5.553 -21.119 -16.649 1.00 46.93 C ATOM 2508 H VAL A 568 5.022 -22.974 -13.055 1.00 0.00 H ATOM 2509 N LEU A 569 7.861 -21.266 -13.101 1.00 38.09 N ATOM 2510 CA LEU A 569 8.989 -20.421 -12.736 1.00 43.43 C ATOM 2511 C LEU A 569 10.247 -21.256 -12.520 1.00 49.73 C ATOM 2512 O LEU A 569 11.363 -20.757 -12.666 1.00 62.59 O ATOM 2513 CB LEU A 569 8.660 -19.615 -11.476 1.00 29.69 C ATOM 2514 CG LEU A 569 7.476 -18.644 -11.560 1.00 27.93 C ATOM 2515 CD1 LEU A 569 7.264 -17.916 -10.231 1.00 28.99 C ATOM 2516 CD2 LEU A 569 7.677 -17.640 -12.683 1.00 29.45 C ATOM 2517 H LEU A 569 7.205 -21.591 -12.362 1.00 0.00 H TER 2518 LEU A 569 HETATM 2519 O HOH 1 -12.640 -14.652 -3.084 1.00 40.61 O HETATM 2520 O HOH 2 18.033 -5.369 5.772 1.00 35.51 O HETATM 2521 O HOH 3 40.766 0.414 4.577 1.00 35.05 O HETATM 2522 O HOH 4 21.035 -9.064 0.757 1.00 25.03 O HETATM 2523 O HOH 5 -4.772 -16.013 -16.125 1.00 36.46 O HETATM 2524 O HOH 6 -0.812 -23.058 -23.090 1.00 33.92 O HETATM 2525 O HOH 7 32.768 -2.978 9.530 1.00 46.53 O HETATM 2526 O HOH 8 22.321 -10.591 2.300 1.00 32.61 O HETATM 2527 O HOH 9 -13.890 -15.026 -0.678 1.00 37.95 O HETATM 2528 O HOH 10 2.936 2.592 3.009 1.00 28.43 O HETATM 2529 O HOH 11 1.701 -15.423 -24.263 1.00 32.26 O HETATM 2530 O HOH 12 -10.326 1.355 -12.419 1.00 41.21 O HETATM 2531 O HOH 13 9.343 -17.214 -24.907 1.00 36.35 O HETATM 2532 O HOH 14 16.318 4.356 0.079 1.00 34.83 O HETATM 2533 O HOH 15 36.078 -3.366 -1.492 1.00 39.05 O HETATM 2534 O HOH 16 -4.658 5.206 -0.701 1.00 38.22 O HETATM 2535 O HOH 17 14.588 -18.926 -15.125 1.00 43.80 O HETATM 2536 O HOH 18 10.862 -13.892 -26.098 1.00 33.02 O HETATM 2537 O HOH 19 14.283 2.217 -16.835 1.00 31.95 O HETATM 2538 O HOH 20 35.563 2.808 8.835 1.00 27.80 O HETATM 2539 O HOH 21 -0.145 -19.922 -15.512 1.00 36.22 O HETATM 2540 O HOH 22 3.070 -2.133 -23.818 1.00 29.07 O HETATM 2541 O HOH 23 27.951 -4.254 0.209 1.00 33.51 O HETATM 2542 O HOH 24 11.418 20.525 -3.622 1.00 42.43 O HETATM 2543 O HOH 25 13.028 4.542 -6.499 1.00 32.75 O HETATM 2544 O HOH 26 4.078 -2.638 -3.942 1.00 17.14 O HETATM 2545 O HOH 27 3.972 -11.726 -25.042 1.00 26.76 O HETATM 2546 O HOH 28 39.442 6.810 -4.399 1.00 39.94 O HETATM 2547 O HOH 29 15.756 0.937 2.066 1.00 25.12 O HETATM 2548 O HOH 30 2.441 -0.447 -21.210 1.00 28.44 O HETATM 2549 O HOH 31 25.656 -6.688 -2.916 1.00 35.63 O HETATM 2550 O HOH 32 -6.036 -3.936 0.077 1.00 28.26 O HETATM 2551 O HOH 33 5.737 -7.679 -31.458 1.00 22.48 O HETATM 2552 O HOH 34 -4.432 -4.627 -1.874 1.00 27.73 O HETATM 2553 O HOH 35 -0.096 1.893 -14.904 1.00 20.25 O HETATM 2554 O HOH 36 9.867 -1.464 -20.860 1.00 28.68 O HETATM 2555 O HOH 37 29.672 -2.030 8.530 1.00 28.11 O HETATM 2556 O HOH 38 -6.430 -9.928 -14.795 1.00 28.87 O HETATM 2557 O HOH 39 20.966 3.142 14.385 1.00 22.02 O HETATM 2558 O HOH 40 2.579 1.755 -6.449 1.00 34.27 O HETATM 2559 O HOH 41 1.697 -12.855 0.081 1.00 22.23 O HETATM 2560 O HOH 42 6.017 21.369 8.992 1.00 32.59 O HETATM 2561 O HOH 43 17.283 -0.016 -0.183 1.00 21.90 O HETATM 2562 O HOH 44 -8.824 -3.739 -7.888 1.00 30.95 O HETATM 2563 O HOH 45 29.033 0.692 10.068 1.00 30.62 O HETATM 2564 O HOH 46 -6.651 -2.981 -9.320 1.00 26.52 O HETATM 2565 O HOH 47 12.304 -15.347 -24.423 1.00 31.87 O HETATM 2566 O HOH 48 5.428 1.192 -6.843 1.00 21.97 O HETATM 2567 O HOH 49 8.833 0.489 0.837 1.00 19.77 O HETATM 2568 O HOH 50 1.997 -1.724 -27.803 1.00 24.89 O HETATM 2569 O HOH 51 21.692 -14.896 2.528 1.00 29.91 O HETATM 2570 O HOH 52 -6.619 -4.936 -11.189 1.00 22.45 O HETATM 2571 O HOH 53 19.074 -8.248 3.835 1.00 23.52 O HETATM 2572 O HOH 54 20.395 6.031 -9.420 1.00 21.67 O HETATM 2573 O HOH 55 26.123 9.908 0.872 1.00 30.83 O HETATM 2574 O HOH 56 0.094 -1.977 -5.914 1.00 25.65 O HETATM 2575 O HOH 57 -3.583 -5.874 4.340 1.00 34.79 O HETATM 2576 O HOH 58 21.991 1.806 -17.065 1.00 43.94 O HETATM 2577 O HOH 59 -10.978 -2.059 -7.284 1.00 33.80 O HETATM 2578 O HOH 60 2.472 -22.274 -21.666 1.00 35.96 O HETATM 2579 O HOH 61 10.639 2.357 -11.691 1.00 20.88 O HETATM 2580 O HOH 62 19.160 8.834 4.638 1.00 27.77 O HETATM 2581 O HOH 63 4.393 -15.002 3.085 1.00 26.17 O HETATM 2582 O HOH 64 12.038 -13.561 -28.884 1.00 37.90 O HETATM 2583 O HOH 65 25.768 -0.679 -12.387 1.00 28.34 O HETATM 2584 O HOH 66 26.931 -6.209 -5.521 1.00 28.60 O HETATM 2585 O HOH 67 6.783 2.298 -16.967 1.00 34.61 O HETATM 2586 O HOH 68 35.235 10.575 1.237 1.00 41.81 O HETATM 2587 O HOH 69 16.772 3.741 -10.641 1.00 40.34 O HETATM 2588 O HOH 70 3.429 -13.860 -26.155 1.00 33.82 O HETATM 2589 O HOH 71 -11.834 -2.186 -2.922 1.00 29.78 O HETATM 2590 O HOH 72 0.527 -9.084 -22.931 1.00 34.06 O HETATM 2591 O HOH 73 3.912 2.011 9.014 1.00 40.40 O HETATM 2592 O HOH 74 14.197 -17.855 -22.416 1.00 32.59 O HETATM 2593 O HOH 75 19.467 3.528 -9.069 1.00 32.21 O HETATM 2594 O HOH 76 -0.792 -2.071 -23.700 1.00 25.78 O HETATM 2595 O HOH 77 20.396 -8.819 -15.548 1.00 41.90 O HETATM 2596 O HOH 78 -6.475 -1.166 -28.600 1.00 41.06 O HETATM 2597 O HOH 79 9.767 -12.769 -29.692 1.00 24.03 O HETATM 2598 O HOH 80 17.104 3.463 -8.349 1.00 35.03 O HETATM 2599 O HOH 81 14.167 -19.714 -12.468 1.00 38.68 O HETATM 2600 O HOH 82 14.195 -4.697 -20.755 1.00 32.99 O HETATM 2601 O HOH 83 24.830 7.744 -11.244 1.00 38.87 O HETATM 2602 O HOH 84 -3.530 -2.840 -20.783 1.00 40.42 O HETATM 2603 O HOH 85 6.840 -22.211 -20.013 1.00 41.31 O HETATM 2604 O HOH 86 1.205 -9.190 -25.731 1.00 25.28 O HETATM 2605 O HOH 87 32.837 -5.089 -1.140 1.00 42.35 O HETATM 2606 O HOH 88 22.567 2.986 -19.651 1.00 44.26 O HETATM 2607 O HOH 89 0.865 -0.649 -25.173 1.00 37.56 O HETATM 2608 O HOH 90 -4.057 7.212 -10.911 1.00 48.21 O HETATM 2609 O HOH 91 -1.348 10.323 -11.643 1.00 47.98 O HETATM 2610 O HOH 92 25.464 20.353 3.970 1.00 48.54 O HETATM 2611 O HOH 93 2.478 -14.817 1.114 1.00 23.37 O HETATM 2612 O HOH 94 23.932 0.718 -12.682 1.00 30.73 O HETATM 2613 O HOH 95 25.983 -6.914 10.467 1.00 39.47 O HETATM 2614 O HOH 96 18.892 8.383 -8.501 1.00 31.99 O HETATM 2615 O HOH 97 25.180 -9.081 2.583 1.00 34.90 O HETATM 2616 O HOH 98 -4.088 -5.465 -25.742 1.00 40.18 O HETATM 2617 O HOH 99 -0.430 13.926 -15.274 1.00 46.65 O HETATM 2618 O HOH 100 18.893 -11.161 -15.854 1.00 43.87 O HETATM 2619 O HOH 101 10.700 -22.226 -2.366 1.00 49.62 O HETATM 2620 O HOH 102 18.483 7.314 7.111 1.00 26.05 O HETATM 2621 O HOH 103 -3.302 -10.934 1.535 1.00 35.66 O HETATM 2622 O HOH 104 18.913 24.231 11.764 1.00 39.42 O HETATM 2623 O HOH 105 2.088 -0.530 -4.760 1.00 26.08 O HETATM 2624 O HOH 106 7.422 -19.640 -25.863 1.00 58.87 O HETATM 2625 O HOH 107 26.610 8.892 14.900 1.00 44.23 O HETATM 2626 O HOH 108 13.436 5.907 14.883 1.00 40.86 O HETATM 2627 O HOH 109 23.823 1.679 -15.313 1.00 35.76 O HETATM 2628 O HOH 110 11.817 0.878 -16.047 1.00 44.07 O HETATM 2629 C01 UNN A 111 24.600 5.730 -14.342 1.00 -0.04 C HETATM 2630 N02 UNN A 111 24.474 5.278 -12.929 1.00 0.24 N HETATM 2631 C03 UNN A 111 23.116 4.752 -12.635 1.00 -0.01 C HETATM 2632 C04 UNN A 111 22.969 4.090 -11.242 1.00 0.06 C HETATM 2633 N05 UNN A 111 24.127 3.351 -10.756 1.00 -0.30 N HETATM 2634 C06 UNN A 111 25.426 3.931 -11.061 1.00 0.06 C HETATM 2635 C07 UNN A 111 25.561 4.336 -12.539 1.00 -0.01 C HETATM 2636 H11 UNN A 111 26.535 4.825 -12.692 1.00 0.08 H HETATM 2637 H12 UNN A 111 25.500 3.435 -13.167 1.00 0.08 H HETATM 2638 H9 UNN A 111 26.206 3.192 -10.826 1.00 0.06 H HETATM 2639 H10 UNN A 111 25.568 4.825 -10.436 1.00 0.06 H HETATM 2640 C08 UNN A 111 23.968 2.579 -9.607 1.00 0.03 C HETATM 2641 C09 UNN A 111 22.876 2.779 -8.725 1.00 -0.05 C HETATM 2642 C10 UNN A 111 22.717 2.009 -7.569 1.00 -0.05 C HETATM 2643 C11 UNN A 111 23.644 0.996 -7.234 1.00 0.05 C HETATM 2644 N12 UNN A 111 23.581 0.176 -6.137 1.00 -0.25 N HETATM 2645 C13 UNN A 111 22.823 0.327 -5.027 1.00 0.20 C HETATM 2646 N14 UNN A 111 22.782 -0.688 -4.122 1.00 -0.26 N HETATM 2647 C15 UNN A 111 22.043 -0.621 -2.986 1.00 0.02 C HETATM 2648 C16 UNN A 111 21.307 0.542 -2.754 1.00 0.11 C HETATM 2649 C17 UNN A 111 20.443 0.960 -1.714 1.00 0.23 C HETATM 2650 O18 UNN A 111 20.053 0.399 -0.638 1.00 -0.39 O HETATM 2651 N19 UNN A 111 20.027 2.191 -2.081 1.00 -0.13 N HETATM 2652 C20 UNN A 111 19.186 2.959 -1.217 1.00 0.09 C HETATM 2653 C21 UNN A 111 20.183 3.777 -0.539 1.00 -0.06 C HETATM 2654 C22 UNN A 111 20.974 3.353 0.466 1.00 -0.12 C HETATM 2655 H20 UNN A 111 21.694 4.034 0.916 1.00 0.03 H HETATM 2656 H21 UNN A 111 20.893 2.329 0.828 1.00 0.03 H HETATM 2657 H19 UNN A 111 20.297 4.808 -0.869 1.00 0.07 H HETATM 2658 H17 UNN A 111 18.636 2.319 -0.511 1.00 0.07 H HETATM 2659 H18 UNN A 111 18.473 3.575 -1.785 1.00 0.07 H HETATM 2660 N23 UNN A 111 20.616 2.592 -3.206 1.00 -0.10 N HETATM 2661 C24 UNN A 111 21.355 1.572 -3.661 1.00 0.19 C HETATM 2662 N25 UNN A 111 22.104 1.452 -4.778 1.00 -0.23 N HETATM 2663 C26 UNN A 111 20.372 3.693 -3.975 1.00 0.20 C HETATM 2664 N27 UNN A 111 19.110 4.178 -3.841 1.00 -0.26 N HETATM 2665 C28 UNN A 111 18.558 5.217 -4.519 1.00 0.04 C HETATM 2666 C29 UNN A 111 19.362 5.817 -5.513 1.00 -0.02 C HETATM 2667 C30 UNN A 111 20.664 5.327 -5.744 1.00 -0.02 C HETATM 2668 C31 UNN A 111 21.175 4.243 -5.003 1.00 0.02 C HETATM 2669 H24 UNN A 111 22.159 3.840 -5.215 1.00 0.09 H HETATM 2670 H23 UNN A 111 21.282 5.792 -6.504 1.00 0.08 H HETATM 2671 H22 UNN A 111 18.981 6.649 -6.095 1.00 0.09 H HETATM 2672 C32 UNN A 111 17.159 5.646 -4.186 1.00 0.06 C HETATM 2673 C33 UNN A 111 16.575 6.717 -5.144 1.00 -0.06 C HETATM 2674 H25 UNN A 111 15.553 6.972 -4.829 1.00 0.02 H HETATM 2675 H26 UNN A 111 16.554 6.319 -6.169 1.00 0.02 H HETATM 2676 H27 UNN A 111 17.204 7.619 -5.113 1.00 0.02 H HETATM 2677 C34 UNN A 111 17.080 6.140 -2.717 1.00 -0.06 C HETATM 2678 H28 UNN A 111 17.497 5.372 -2.049 1.00 0.02 H HETATM 2679 H29 UNN A 111 16.030 6.328 -2.449 1.00 0.02 H HETATM 2680 H30 UNN A 111 17.657 7.070 -2.611 1.00 0.02 H HETATM 2681 O35 UNN A 111 16.281 4.523 -4.288 1.00 -0.42 O HETATM 2682 H31 UNN A 111 16.590 3.828 -3.719 1.00 0.20 H HETATM 2683 H16 UNN A 111 22.025 -1.444 -2.281 1.00 0.09 H HETATM 2684 H15 UNN A 111 24.185 -0.658 -6.161 1.00 0.22 H HETATM 2685 C36 UNN A 111 24.734 0.788 -8.097 1.00 -0.05 C HETATM 2686 C37 UNN A 111 24.890 1.563 -9.253 1.00 -0.05 C HETATM 2687 H33 UNN A 111 25.743 1.380 -9.897 1.00 0.05 H HETATM 2688 H32 UNN A 111 25.462 0.019 -7.865 1.00 0.05 H HETATM 2689 H14 UNN A 111 21.869 2.192 -6.919 1.00 0.05 H HETATM 2690 H13 UNN A 111 22.146 3.548 -8.953 1.00 0.05 H HETATM 2691 H7 UNN A 111 22.121 3.391 -11.290 1.00 0.06 H HETATM 2692 H8 UNN A 111 22.748 4.885 -10.514 1.00 0.06 H HETATM 2693 H5 UNN A 111 22.866 4.002 -13.400 1.00 0.08 H HETATM 2694 H6 UNN A 111 22.404 5.588 -12.694 1.00 0.08 H HETATM 2695 H4 UNN A 111 24.591 6.098 -12.354 1.00 0.20 H HETATM 2696 H1 UNN A 111 23.778 6.421 -14.581 1.00 0.08 H HETATM 2697 H2 UNN A 111 24.553 4.858 -15.011 1.00 0.08 H HETATM 2698 H3 UNN A 111 25.562 6.245 -14.478 1.00 0.08 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1426 1427 1438 1439 1440 CONECT 1438 1426 CONECT 1439 1426 CONECT 1440 1426 CONECT 2629 2630 2696 2697 2698 CONECT 2630 2629 2631 2635 2695 CONECT 2631 2630 2632 2693 2694 CONECT 2632 2631 2633 2691 2692 CONECT 2633 2632 2634 2640 CONECT 2634 2633 2635 2638 2639 CONECT 2635 2630 2634 2636 2637 CONECT 2636 2635 CONECT 2637 2635 CONECT 2638 2634 CONECT 2639 2634 CONECT 2640 2633 2641 2686 CONECT 2641 2640 2642 2690 CONECT 2642 2641 2643 2689 CONECT 2643 2642 2644 2685 CONECT 2644 2643 2645 2684 CONECT 2645 2644 2646 2662 CONECT 2646 2645 2647 CONECT 2647 2646 2648 2683 CONECT 2648 2647 2649 2661 CONECT 2649 2648 2650 2651 CONECT 2650 2649 CONECT 2651 2649 2652 2660 CONECT 2652 2651 2653 2658 2659 CONECT 2653 2652 2654 2657 CONECT 2654 2653 2655 2656 CONECT 2655 2654 CONECT 2656 2654 CONECT 2657 2653 CONECT 2658 2652 CONECT 2659 2652 CONECT 2660 2651 2661 2663 CONECT 2661 2648 2660 2662 CONECT 2662 2645 2661 CONECT 2663 2660 2664 2668 CONECT 2664 2663 2665 CONECT 2665 2664 2666 2672 CONECT 2666 2665 2667 2671 CONECT 2667 2666 2668 2670 CONECT 2668 2663 2667 2669 CONECT 2669 2668 CONECT 2670 2667 CONECT 2671 2666 CONECT 2672 2665 2673 2677 2681 CONECT 2673 2672 2674 2675 2676 CONECT 2674 2673 CONECT 2675 2673 CONECT 2676 2673 CONECT 2677 2672 2678 2679 2680 CONECT 2678 2677 CONECT 2679 2677 CONECT 2680 2677 CONECT 2681 2672 2682 CONECT 2682 2681 CONECT 2683 2647 CONECT 2684 2644 CONECT 2685 2643 2686 2688 CONECT 2686 2640 2685 2687 CONECT 2687 2686 CONECT 2688 2685 CONECT 2689 2642 CONECT 2690 2641 CONECT 2691 2632 CONECT 2692 2632 CONECT 2693 2631 CONECT 2694 2631 CONECT 2695 2630 CONECT 2696 2629 CONECT 2697 2629 CONECT 2698 2629 MASTER 0 0 0 0 0 0 0 0 2696 2 78 21 END
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Related entries of code: 5v5y
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1x8b
RCSB PDB
PDBbind
289aa, >1X8B_1|Chain... *
2in6
RCSB PDB
PDBbind
287aa, >2IN6_1|Chain... at 99%
2io6
RCSB PDB
PDBbind
287aa, >2IO6_1|Chain... at 99%
3bi6
RCSB PDB
PDBbind
287aa, >3BI6_1|Chain... at 99%
3biz
RCSB PDB
PDBbind
287aa, >3BIZ_1|Chain... at 99%
5vc3
RCSB PDB
PDBbind
289aa, >5VC3_1|Chain... at 99%
5vc4
RCSB PDB
PDBbind
289aa, >5VC4_1|Chain... at 99%
5vc5
RCSB PDB
PDBbind
289aa, >5VC5_1|Chain... at 99%
5vc6
RCSB PDB
PDBbind
289aa, >5VC6_1|Chain... at 99%
5vd2
RCSB PDB
PDBbind
289aa, >5VD2_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5vd0
RCSB PDB
PDBbind
8X7
5vdk
RCSB PDB
PDBbind
8X7
Entry Information
PDB ID
5v5y
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Wee1-like protein kinase
Ligand Name
8X7
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=13.4nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 7863-7875
Ligand Properties
Formula
C
2
7
H
3
3
N
8
O
2
Molecular Weight
501.603
Exact Mass
501.273
No. of atoms
70
No. of bonds
74
Polar Surface Area
105.54
LOGP Value
3.10 (
Computed with XLOGP3
)
3.18 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
C=CCn1c(=O)c2c(n1c1cccc(n1)C(O)(C)C)nc(nc2)Nc1ccc(cc1)N1CC[NH+](CC1)C
InChI String
InChI=1S/C27H32N8O2/c1-5-13-34-25(36)21-18-28-26(29-19-9-11-20(12-10-19)33-16-14-32(4)15-17-33)31-24(21)35(34)23-8-6-7-22(30-23)27(2,3)37/h5-12,18,37H,1,13-17H2,2-4H3,(H,28,29,31)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P30291
Entrez Gene ID
NCBI Entrez Gene ID:
7465
ASD
Information of known allosteric effects of PDB entries
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