Browse entries in the PDBbind-CN Database
HEADER 6MYN_COMPLEX COMPND 6MYN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 30 PRO VAL GLU GLU TYR LEU VAL HIS ALA LEU GLN GLY SER SEQRES 2 A 30 VAL SER SER GLY GLN ALA HIS SER LEU ALA SER LEU ALA SEQRES 3 A 30 LYS THR TRP SER SEQRES 1 A 167 ASP ASN GLU GLY VAL LEU LEU THR GLU LYS LEU LYS PRO SEQRES 2 A 167 VAL ASP TYR GLU TYR ARG GLU GLU VAL HIS TRP MET THR SEQRES 3 A 167 HIS GLN PRO ARG VAL GLY ARG GLY SER PHE GLY GLU VAL SEQRES 4 A 167 HIS ARG MET LYS ASP LYS GLN THR GLY PHE GLN CYS ALA SEQRES 5 A 167 VAL LYS LYS VAL ARG LEU GLU VAL PHE ARG VAL GLU GLU SEQRES 6 A 167 LEU VAL ALA CYS ALA GLY LEU SER SER PRO ARG ILE VAL SEQRES 7 A 167 PRO LEU TYR GLY ALA VAL ARG GLU GLY PRO TRP VAL ASN SEQRES 8 A 167 ILE PHE MET GLU LEU LEU GLU GLY GLY SER LEU GLY GLN SEQRES 9 A 167 LEU ILE LYS GLN MET GLY CYS LEU PRO GLU ASP ARG ALA SEQRES 10 A 167 LEU TYR TYR LEU GLY GLN ALA LEU GLU GLY LEU GLU TYR SEQRES 11 A 167 LEU HIS THR ARG ARG ILE LEU HIS GLY ASP VAL LYS ALA SEQRES 12 A 167 ASP ASN VAL LEU LEU SER SER ASP GLY SER ARG ALA ALA SEQRES 13 A 167 LEU CYS ASP PHE GLY HIS ALA LEU CYS LEU GLN SEQRES 1 A 125 SER LEU LEU THR GLY ASP TYR ILE PRO GLY THR GLU THR SEQRES 2 A 125 HIS MET ALA PRO GLU VAL VAL MET GLY LYS PRO CYS ASP SEQRES 3 A 125 ALA LYS VAL ASP ILE TRP SER SER CYS CYS MET MET LEU SEQRES 4 A 125 HIS MET LEU ASN GLY CYS HIS PRO TRP THR GLN TYR PHE SEQRES 5 A 125 ARG GLY PRO LEU CYS LEU LYS ILE ALA SER GLU PRO PRO SEQRES 6 A 125 PRO ILE ARG GLU ILE PRO PRO SER CYS ALA PRO LEU THR SEQRES 7 A 125 ALA GLN ALA ILE GLN GLU GLY LEU ARG LYS GLU PRO VAL SEQRES 8 A 125 HIS ARG ALA SER ALA MET GLU LEU ARG ARG LYS VAL GLY SEQRES 9 A 125 LYS ALA LEU GLN GLU VAL GLY GLY LEU LYS SER PRO TRP SEQRES 10 A 125 LYS GLY GLU TYR LYS GLU PRO ARG HET K A 6Y 56 ATOM 1 N PRO A 334 30.690 45.057 17.784 1.00 74.72 N ATOM 2 CA PRO A 334 29.340 45.624 17.997 1.00 75.18 C ATOM 3 C PRO A 334 28.309 45.082 16.993 1.00 74.35 C ATOM 4 O PRO A 334 27.510 44.197 17.329 1.00 72.87 O ATOM 5 CB PRO A 334 29.549 47.135 17.812 1.00 65.24 C ATOM 6 CG PRO A 334 31.077 47.348 17.819 1.00 70.95 C ATOM 7 CD PRO A 334 31.675 46.063 17.342 1.00 70.93 C ATOM 8 HN2 PRO A 334 30.627 44.314 17.059 1.00 0.00 H ATOM 9 HN1 PRO A 334 31.020 44.641 18.678 1.00 0.00 H ATOM 10 N VAL A 335 28.340 45.605 15.763 1.00 68.96 N ATOM 11 CA VAL A 335 27.578 45.017 14.665 1.00 68.32 C ATOM 12 C VAL A 335 28.065 43.619 14.289 1.00 66.23 C ATOM 13 O VAL A 335 27.363 42.901 13.576 1.00 65.89 O ATOM 14 CB VAL A 335 27.619 45.966 13.444 1.00 59.01 C ATOM 15 CG1 VAL A 335 28.942 45.855 12.721 1.00 59.86 C ATOM 16 CG2 VAL A 335 26.453 45.711 12.494 1.00 55.59 C ATOM 17 H VAL A 335 28.920 46.450 15.584 1.00 0.00 H ATOM 18 N GLU A 336 29.245 43.208 14.759 1.00 64.42 N ATOM 19 CA GLU A 336 29.792 41.887 14.461 1.00 68.12 C ATOM 20 C GLU A 336 28.742 40.792 14.599 1.00 66.21 C ATOM 21 O GLU A 336 28.393 40.107 13.632 1.00 56.75 O ATOM 22 CB GLU A 336 30.965 41.618 15.408 1.00 73.61 C ATOM 23 CG GLU A 336 32.123 40.803 14.845 1.00 82.30 C ATOM 24 CD GLU A 336 33.447 41.164 15.539 1.00 99.19 C ATOM 25 OE1 GLU A 336 33.518 42.265 16.141 1.00 90.05 O ATOM 26 OE2 GLU A 336 34.412 40.360 15.488 1.00102.09 O ATOM 27 H GLU A 336 29.796 43.853 15.360 1.00 0.00 H ATOM 28 N GLU A 337 28.221 40.643 15.819 1.00 70.51 N ATOM 29 CA GLU A 337 27.232 39.619 16.137 1.00 59.17 C ATOM 30 C GLU A 337 26.028 39.700 15.220 1.00 56.73 C ATOM 31 O GLU A 337 25.375 38.689 14.957 1.00 60.38 O ATOM 32 CB GLU A 337 26.835 39.796 17.602 1.00 72.54 C ATOM 33 CG GLU A 337 25.736 38.931 18.164 1.00 82.10 C ATOM 34 CD GLU A 337 25.151 39.561 19.432 1.00 98.49 C ATOM 35 OE1 GLU A 337 24.184 40.360 19.320 1.00101.96 O ATOM 36 OE2 GLU A 337 25.685 39.290 20.533 1.00 96.31 O ATOM 37 H GLU A 337 28.534 41.285 16.575 1.00 0.00 H ATOM 38 N TYR A 338 25.733 40.893 14.716 1.00 61.24 N ATOM 39 CA TYR A 338 24.588 41.089 13.836 1.00 64.99 C ATOM 40 C TYR A 338 24.850 40.540 12.442 1.00 58.04 C ATOM 41 O TYR A 338 23.928 40.040 11.793 1.00 56.97 O ATOM 42 CB TYR A 338 24.243 42.581 13.768 1.00 67.51 C ATOM 43 CG TYR A 338 23.176 43.000 14.725 1.00 71.40 C ATOM 44 CD1 TYR A 338 21.867 43.157 14.290 1.00 74.59 C ATOM 45 CD2 TYR A 338 23.464 43.226 16.066 1.00 72.60 C ATOM 46 CE1 TYR A 338 20.868 43.535 15.158 1.00 78.91 C ATOM 47 CE2 TYR A 338 22.467 43.608 16.947 1.00 77.13 C ATOM 48 CZ TYR A 338 21.170 43.763 16.483 1.00 84.04 C ATOM 49 OH TYR A 338 20.161 44.143 17.340 1.00 94.63 O ATOM 50 HH TYR A 338 19.309 44.203 16.839 1.00 0.00 H ATOM 51 H TYR A 338 26.334 41.707 14.955 1.00 0.00 H ATOM 52 N LEU A 339 26.091 40.673 11.956 1.00 59.25 N ATOM 53 CA LEU A 339 26.472 40.194 10.626 1.00 54.35 C ATOM 54 C LEU A 339 26.494 38.675 10.568 1.00 51.10 C ATOM 55 O LEU A 339 26.103 38.069 9.562 1.00 48.16 O ATOM 56 CB LEU A 339 27.850 40.728 10.254 1.00 44.79 C ATOM 57 CG LEU A 339 27.969 42.216 10.033 1.00 43.23 C ATOM 58 CD1 LEU A 339 29.392 42.680 10.285 1.00 41.32 C ATOM 59 CD2 LEU A 339 27.524 42.470 8.617 1.00 43.47 C ATOM 60 H LEU A 339 26.812 41.135 12.546 1.00 0.00 H ATOM 61 N VAL A 340 26.978 38.051 11.635 1.00 46.98 N ATOM 62 CA VAL A 340 26.938 36.605 11.725 1.00 47.29 C ATOM 63 C VAL A 340 25.507 36.115 11.578 1.00 49.68 C ATOM 64 O VAL A 340 25.239 35.139 10.870 1.00 51.62 O ATOM 65 CB VAL A 340 27.577 36.153 13.052 1.00 46.81 C ATOM 66 CG1 VAL A 340 27.340 34.669 13.289 1.00 44.31 C ATOM 67 CG2 VAL A 340 29.064 36.513 13.065 1.00 42.67 C ATOM 68 H VAL A 340 27.390 38.605 12.413 1.00 0.00 H ATOM 69 N HIS A 341 24.561 36.792 12.237 1.00 50.41 N ATOM 70 CA HIS A 341 23.171 36.345 12.211 1.00 49.02 C ATOM 71 C HIS A 341 22.575 36.457 10.816 1.00 46.14 C ATOM 72 O HIS A 341 21.751 35.624 10.427 1.00 46.60 O ATOM 73 CB HIS A 341 22.338 37.146 13.222 1.00 52.18 C ATOM 74 CG HIS A 341 21.096 36.443 13.688 1.00 51.25 C ATOM 75 ND1 HIS A 341 19.850 36.686 13.148 1.00 45.58 N ATOM 76 CD2 HIS A 341 20.912 35.503 14.646 1.00 50.90 C ATOM 77 CE1 HIS A 341 18.955 35.927 13.753 1.00 43.78 C ATOM 78 NE2 HIS A 341 19.573 35.199 14.663 1.00 46.21 N ATOM 79 H HIS A 341 24.818 37.645 12.773 1.00 0.00 H ATOM 80 N ALA A 342 22.978 37.468 10.047 1.00 43.98 N ATOM 81 CA ALA A 342 22.478 37.586 8.687 1.00 40.80 C ATOM 82 C ALA A 342 22.973 36.440 7.830 1.00 42.08 C ATOM 83 O ALA A 342 22.262 35.996 6.931 1.00 44.83 O ATOM 84 CB ALA A 342 22.896 38.919 8.077 1.00 47.69 C ATOM 85 H ALA A 342 23.648 38.171 10.419 1.00 0.00 H ATOM 86 N LEU A 343 24.166 35.924 8.125 1.00 43.02 N ATOM 87 CA LEU A 343 24.760 34.856 7.330 1.00 40.95 C ATOM 88 C LEU A 343 24.170 33.492 7.655 1.00 41.86 C ATOM 89 O LEU A 343 24.016 32.661 6.755 1.00 45.84 O ATOM 90 CB LEU A 343 26.275 34.827 7.526 1.00 37.92 C ATOM 91 CG LEU A 343 27.046 35.990 6.926 1.00 38.23 C ATOM 92 CD1 LEU A 343 28.493 35.857 7.287 1.00 39.78 C ATOM 93 CD2 LEU A 343 26.860 36.055 5.420 1.00 38.24 C ATOM 94 H LEU A 343 24.688 36.294 8.945 1.00 0.00 H ATOM 95 N GLN A 344 23.846 33.233 8.916 1.00 37.48 N ATOM 96 CA GLN A 344 23.310 31.934 9.286 1.00 34.11 C ATOM 97 C GLN A 344 21.997 31.646 8.578 1.00 38.73 C ATOM 98 O GLN A 344 21.170 32.536 8.373 1.00 47.84 O ATOM 99 CB GLN A 344 23.111 31.857 10.785 1.00 33.75 C ATOM 100 CG GLN A 344 24.366 32.198 11.507 1.00 47.42 C ATOM 101 CD GLN A 344 24.272 31.959 12.986 1.00 54.08 C ATOM 102 OE1 GLN A 344 23.753 32.797 13.734 1.00 60.98 O ATOM 103 NE2 GLN A 344 24.791 30.818 13.429 1.00 45.86 N ATOM 104 HE22 GLN A 344 25.216 30.146 12.759 1.00 0.00 H ATOM 105 HE21 GLN A 344 24.772 30.598 14.445 1.00 0.00 H ATOM 106 H GLN A 344 23.977 33.964 9.644 1.00 0.00 H ATOM 107 N GLY A 345 21.826 30.390 8.186 1.00 40.28 N ATOM 108 CA GLY A 345 20.571 29.873 7.724 1.00 26.67 C ATOM 109 C GLY A 345 20.343 30.025 6.250 1.00 41.36 C ATOM 110 O GLY A 345 19.313 29.565 5.743 1.00 50.66 O ATOM 111 H GLY A 345 22.644 29.748 8.215 1.00 0.00 H ATOM 112 N SER A 346 21.246 30.670 5.533 1.00 37.57 N ATOM 113 CA SER A 346 21.139 30.649 4.085 1.00 46.03 C ATOM 114 C SER A 346 22.526 30.491 3.480 1.00 41.40 C ATOM 115 O SER A 346 23.540 30.496 4.171 1.00 39.70 O ATOM 116 CB SER A 346 20.404 31.891 3.535 1.00 42.78 C ATOM 117 OG SER A 346 20.776 33.075 4.199 1.00 47.70 O ATOM 118 HG SER A 346 20.280 33.839 3.812 1.00 0.00 H ATOM 119 H SER A 346 22.021 31.184 5.998 1.00 0.00 H ATOM 120 N VAL A 347 22.547 30.287 2.174 1.00 42.16 N ATOM 121 CA VAL A 347 23.774 30.188 1.402 1.00 42.00 C ATOM 122 C VAL A 347 23.809 31.389 0.479 1.00 33.86 C ATOM 123 O VAL A 347 22.843 31.632 -0.242 1.00 34.69 O ATOM 124 CB VAL A 347 23.831 28.869 0.614 1.00 40.48 C ATOM 125 CG1 VAL A 347 25.020 28.863 -0.316 1.00 34.99 C ATOM 126 CG2 VAL A 347 23.863 27.683 1.584 1.00 38.54 C ATOM 127 H VAL A 347 21.640 30.193 1.674 1.00 0.00 H ATOM 128 N SER A 348 24.899 32.154 0.515 1.00 29.14 N ATOM 129 CA SER A 348 24.978 33.380 -0.262 1.00 39.71 C ATOM 130 C SER A 348 26.299 33.494 -1.025 1.00 41.90 C ATOM 131 O SER A 348 27.307 32.859 -0.695 1.00 37.95 O ATOM 132 CB SER A 348 24.799 34.625 0.632 1.00 36.71 C ATOM 133 OG SER A 348 25.858 34.722 1.578 1.00 38.86 O ATOM 134 HG SER A 348 25.862 33.914 2.151 1.00 0.00 H ATOM 135 H SER A 348 25.705 31.870 1.108 1.00 0.00 H ATOM 136 N SER A 349 26.271 34.342 -2.050 1.00 37.58 N ATOM 137 CA SER A 349 27.485 34.821 -2.681 1.00 32.82 C ATOM 138 C SER A 349 28.109 35.891 -1.802 1.00 33.61 C ATOM 139 O SER A 349 27.423 36.794 -1.326 1.00 47.44 O ATOM 140 CB SER A 349 27.179 35.404 -4.055 1.00 29.06 C ATOM 141 OG SER A 349 26.557 34.469 -4.895 1.00 36.78 O ATOM 142 HG SER A 349 26.376 34.886 -5.774 1.00 0.00 H ATOM 143 H SER A 349 25.352 34.671 -2.409 1.00 0.00 H ATOM 144 N GLY A 350 29.409 35.805 -1.603 1.00 37.22 N ATOM 145 CA GLY A 350 30.077 36.711 -0.703 1.00 38.20 C ATOM 146 C GLY A 350 31.579 36.663 -0.795 1.00 42.08 C ATOM 147 O GLY A 350 32.148 36.399 -1.861 1.00 42.69 O ATOM 148 H GLY A 350 29.959 35.076 -2.101 1.00 0.00 H ATOM 149 N GLN A 351 32.232 36.928 0.334 1.00 44.81 N ATOM 150 CA GLN A 351 33.669 37.144 0.365 1.00 38.95 C ATOM 151 C GLN A 351 34.277 36.512 1.607 1.00 37.57 C ATOM 152 O GLN A 351 33.612 36.258 2.613 1.00 32.67 O ATOM 153 CB GLN A 351 34.000 38.634 0.304 1.00 50.79 C ATOM 154 CG GLN A 351 33.554 39.328 -0.995 1.00 47.83 C ATOM 155 CD GLN A 351 33.806 40.814 -0.969 1.00 52.50 C ATOM 156 OE1 GLN A 351 34.864 41.300 -1.393 1.00 61.37 O ATOM 157 NE2 GLN A 351 32.836 41.551 -0.452 1.00 59.49 N ATOM 158 HE22 GLN A 351 31.965 41.098 -0.109 1.00 0.00 H ATOM 159 HE21 GLN A 351 32.945 42.583 -0.389 1.00 0.00 H ATOM 160 H GLN A 351 31.696 36.982 1.224 1.00 0.00 H ATOM 161 N ALA A 352 35.578 36.275 1.507 1.00 38.65 N ATOM 162 CA ALA A 352 36.261 35.399 2.443 1.00 34.40 C ATOM 163 C ALA A 352 36.020 35.805 3.881 1.00 37.72 C ATOM 164 O ALA A 352 35.886 34.943 4.756 1.00 39.24 O ATOM 165 CB ALA A 352 37.750 35.398 2.145 1.00 38.80 C ATOM 166 H ALA A 352 36.120 36.726 0.743 1.00 0.00 H ATOM 167 N HIS A 353 35.970 37.115 4.153 1.00 39.05 N ATOM 168 CA HIS A 353 35.772 37.566 5.527 1.00 36.17 C ATOM 169 C HIS A 353 34.418 37.122 6.053 1.00 40.69 C ATOM 170 O HIS A 353 34.309 36.727 7.215 1.00 42.17 O ATOM 171 CB HIS A 353 35.934 39.084 5.635 1.00 44.61 C ATOM 172 CG HIS A 353 35.272 39.846 4.530 1.00 58.20 C ATOM 173 ND1 HIS A 353 33.982 40.339 4.626 1.00 60.85 N ATOM 174 CD2 HIS A 353 35.716 40.190 3.296 1.00 54.52 C ATOM 175 CE1 HIS A 353 33.663 40.955 3.501 1.00 55.41 C ATOM 176 NE2 HIS A 353 34.698 40.880 2.678 1.00 58.29 N ATOM 177 H HIS A 353 36.072 37.810 3.386 1.00 0.00 H ATOM 178 N SER A 354 33.384 37.141 5.195 1.00 41.61 N ATOM 179 CA SER A 354 32.069 36.610 5.553 1.00 39.59 C ATOM 180 C SER A 354 32.126 35.107 5.794 1.00 43.38 C ATOM 181 O SER A 354 31.564 34.598 6.775 1.00 41.68 O ATOM 182 CB SER A 354 31.044 36.921 4.453 1.00 43.71 C ATOM 183 OG SER A 354 30.654 38.287 4.415 1.00 40.65 O ATOM 184 HG SER A 354 30.246 38.537 5.282 1.00 0.00 H ATOM 185 H SER A 354 33.523 37.546 4.247 1.00 0.00 H ATOM 186 N LEU A 355 32.798 34.377 4.895 1.00 43.63 N ATOM 187 CA LEU A 355 32.906 32.933 5.055 1.00 38.55 C ATOM 188 C LEU A 355 33.540 32.572 6.381 1.00 35.15 C ATOM 189 O LEU A 355 33.125 31.609 7.027 1.00 40.34 O ATOM 190 CB LEU A 355 33.705 32.313 3.917 1.00 36.37 C ATOM 191 CG LEU A 355 33.845 30.792 4.021 1.00 38.28 C ATOM 192 CD1 LEU A 355 32.471 30.135 4.084 1.00 39.65 C ATOM 193 CD2 LEU A 355 34.621 30.245 2.847 1.00 37.56 C ATOM 194 H LEU A 355 33.245 34.843 4.079 1.00 0.00 H ATOM 195 N ALA A 356 34.546 33.328 6.804 1.00 40.61 N ATOM 196 CA ALA A 356 35.231 33.008 8.057 1.00 50.20 C ATOM 197 C ALA A 356 34.374 33.348 9.273 1.00 47.38 C ATOM 198 O ALA A 356 34.371 32.601 10.253 1.00 46.00 O ATOM 199 CB ALA A 356 36.570 33.740 8.132 1.00 44.96 C ATOM 200 H ALA A 356 34.848 34.150 6.243 1.00 0.00 H ATOM 201 N SER A 357 33.678 34.492 9.233 1.00 45.27 N ATOM 202 CA SER A 357 32.648 34.832 10.211 1.00 46.44 C ATOM 203 C SER A 357 31.691 33.671 10.426 1.00 51.39 C ATOM 204 O SER A 357 31.450 33.223 11.563 1.00 44.89 O ATOM 205 CB SER A 357 31.849 36.044 9.724 1.00 42.67 C ATOM 206 OG SER A 357 32.561 37.255 9.841 1.00 54.66 O ATOM 207 HG SER A 357 33.389 37.203 9.301 1.00 0.00 H ATOM 208 H SER A 357 33.881 35.169 8.470 1.00 0.00 H ATOM 209 N LEU A 358 31.099 33.210 9.322 1.00 41.66 N ATOM 210 CA LEU A 358 30.155 32.111 9.393 1.00 42.62 C ATOM 211 C LEU A 358 30.830 30.828 9.853 1.00 38.70 C ATOM 212 O LEU A 358 30.244 30.058 10.614 1.00 43.20 O ATOM 213 CB LEU A 358 29.496 31.922 8.033 1.00 38.28 C ATOM 214 CG LEU A 358 28.484 30.797 8.056 1.00 37.29 C ATOM 215 CD1 LEU A 358 27.415 31.100 9.107 1.00 33.38 C ATOM 216 CD2 LEU A 358 27.909 30.605 6.668 1.00 36.54 C ATOM 217 H LEU A 358 31.317 33.643 8.402 1.00 0.00 H ATOM 218 N ALA A 359 32.067 30.586 9.405 1.00 42.77 N ATOM 219 CA ALA A 359 32.718 29.301 9.653 1.00 46.71 C ATOM 220 C ALA A 359 33.000 29.110 11.131 1.00 43.55 C ATOM 221 O ALA A 359 32.890 27.993 11.648 1.00 40.67 O ATOM 222 CB ALA A 359 34.013 29.187 8.846 1.00 37.47 C ATOM 223 H ALA A 359 32.573 31.323 8.873 1.00 0.00 H ATOM 224 N LYS A 360 33.340 30.205 11.824 1.00 43.81 N ATOM 225 CA LYS A 360 33.564 30.172 13.267 1.00 45.76 C ATOM 226 C LYS A 360 32.351 29.650 14.023 1.00 49.34 C ATOM 227 O LYS A 360 32.502 29.137 15.139 1.00 52.07 O ATOM 228 CB LYS A 360 33.939 31.565 13.792 1.00 46.18 C ATOM 229 CG LYS A 360 35.353 32.064 13.422 1.00 49.47 C ATOM 230 CD LYS A 360 35.510 33.578 13.675 1.00 54.81 C ATOM 231 CE LYS A 360 36.486 34.234 12.688 1.00 58.51 C ATOM 232 NZ LYS A 360 36.328 35.721 12.586 1.00 61.18 N ATOM 233 HZ1 LYS A 360 35.364 35.945 12.266 1.00 0.00 H ATOM 234 HZ2 LYS A 360 36.493 36.151 13.519 1.00 0.00 H ATOM 235 HZ3 LYS A 360 37.017 36.096 11.903 1.00 0.00 H ATOM 236 H LYS A 360 33.448 31.107 11.318 1.00 0.00 H ATOM 237 N THR A 361 31.144 29.760 13.453 1.00 46.70 N ATOM 238 CA THR A 361 29.986 29.255 14.184 1.00 48.49 C ATOM 239 C THR A 361 29.841 27.746 14.063 1.00 50.26 C ATOM 240 O THR A 361 29.114 27.147 14.861 1.00 52.34 O ATOM 241 CB THR A 361 28.678 29.945 13.737 1.00 45.04 C ATOM 242 OG1 THR A 361 28.033 29.187 12.718 1.00 45.54 O ATOM 243 CG2 THR A 361 28.922 31.341 13.224 1.00 42.99 C ATOM 244 HG1 THR A 361 28.636 29.106 11.937 1.00 0.00 H ATOM 245 H THR A 361 31.035 30.194 12.514 1.00 0.00 H ATOM 246 N TRP A 362 30.555 27.116 13.121 1.00 55.25 N ATOM 247 CA TRP A 362 30.453 25.679 12.881 1.00 53.46 C ATOM 248 C TRP A 362 31.187 24.839 13.920 1.00 58.57 C ATOM 249 O TRP A 362 31.496 23.681 13.626 1.00 63.78 O ATOM 250 CB TRP A 362 30.943 25.350 11.466 1.00 44.61 C ATOM 251 CG TRP A 362 30.052 25.976 10.454 1.00 43.02 C ATOM 252 CD1 TRP A 362 28.808 26.489 10.686 1.00 40.96 C ATOM 253 CD2 TRP A 362 30.317 26.185 9.065 1.00 38.29 C ATOM 254 NE1 TRP A 362 28.281 27.006 9.534 1.00 39.58 N ATOM 255 CE2 TRP A 362 29.184 26.829 8.518 1.00 44.66 C ATOM 256 CE3 TRP A 362 31.390 25.895 8.230 1.00 34.17 C ATOM 257 CZ2 TRP A 362 29.103 27.187 7.169 1.00 39.12 C ATOM 258 CZ3 TRP A 362 31.306 26.248 6.898 1.00 36.98 C ATOM 259 CH2 TRP A 362 30.174 26.887 6.377 1.00 33.42 C ATOM 260 HE1 TRP A 362 27.349 27.459 9.444 1.00 0.00 H ATOM 261 H TRP A 362 31.210 27.674 12.536 1.00 0.00 H ATOM 262 N SER A 363 31.435 25.392 15.112 1.00 71.33 N ATOM 263 CA SER A 363 32.048 24.700 16.262 1.00 71.56 C ATOM 264 C SER A 363 33.508 24.373 15.994 1.00 69.34 C ATOM 265 O SER A 363 34.268 24.099 16.918 1.00 78.29 O ATOM 266 CB SER A 363 31.272 23.415 16.628 1.00 79.86 C ATOM 267 OG SER A 363 29.976 23.700 17.146 1.00 78.77 O ATOM 268 HG SER A 363 29.516 22.851 17.366 1.00 0.00 H ATOM 269 H SER A 363 31.175 26.391 15.239 1.00 0.00 H TER 270 SER A 363 ATOM 271 N ASP A 378 20.334 24.598 8.882 1.00 56.55 N ATOM 272 CA ASP A 378 20.578 23.334 8.181 1.00 61.15 C ATOM 273 C ASP A 378 21.575 23.505 7.035 1.00 60.15 C ATOM 274 O ASP A 378 22.662 22.930 7.062 1.00 62.04 O ATOM 275 CB ASP A 378 19.261 22.750 7.637 1.00 67.16 C ATOM 276 CG ASP A 378 19.447 21.402 6.894 1.00 73.15 C ATOM 277 OD1 ASP A 378 20.542 21.118 6.328 1.00 62.34 O ATOM 278 OD2 ASP A 378 18.467 20.616 6.881 1.00 78.50 O ATOM 279 HN3 ASP A 378 19.948 25.295 8.213 1.00 0.00 H ATOM 280 HN2 ASP A 378 21.229 24.953 9.276 1.00 0.00 H ATOM 281 HN1 ASP A 378 19.653 24.440 9.652 1.00 0.00 H ATOM 282 N ASN A 379 21.168 24.252 6.006 1.00 50.92 N ATOM 283 CA ASN A 379 21.950 24.459 4.794 1.00 42.16 C ATOM 284 C ASN A 379 22.357 25.938 4.757 1.00 45.77 C ATOM 285 O ASN A 379 21.582 26.792 4.332 1.00 50.27 O ATOM 286 CB ASN A 379 21.135 24.030 3.578 1.00 40.15 C ATOM 287 CG ASN A 379 21.833 24.298 2.254 1.00 39.87 C ATOM 288 OD1 ASN A 379 21.270 24.954 1.377 1.00 37.56 O ATOM 289 ND2 ASN A 379 23.058 23.793 2.102 1.00 34.99 N ATOM 290 HD22 ASN A 379 23.494 23.245 2.871 1.00 0.00 H ATOM 291 HD21 ASN A 379 23.578 23.947 1.214 1.00 0.00 H ATOM 292 H ASN A 379 20.238 24.713 6.073 1.00 0.00 H ATOM 293 N GLU A 380 23.572 26.235 5.229 1.00 40.73 N ATOM 294 CA GLU A 380 24.130 27.578 5.300 1.00 39.17 C ATOM 295 C GLU A 380 25.546 27.523 4.724 1.00 41.07 C ATOM 296 O GLU A 380 26.125 26.444 4.600 1.00 33.77 O ATOM 297 CB GLU A 380 24.121 28.138 6.764 1.00 33.74 C ATOM 298 CG GLU A 380 24.892 27.308 7.812 1.00 39.53 C ATOM 299 CD GLU A 380 24.751 27.843 9.269 1.00 49.44 C ATOM 300 OE1 GLU A 380 25.537 27.454 10.170 1.00 41.49 O ATOM 301 OE2 GLU A 380 23.844 28.652 9.527 1.00 49.86 O ATOM 302 H GLU A 380 24.162 25.449 5.570 1.00 0.00 H ATOM 303 N GLY A 381 26.096 28.682 4.370 1.00 34.51 N ATOM 304 CA GLY A 381 27.403 28.747 3.751 1.00 30.20 C ATOM 305 C GLY A 381 27.545 29.982 2.893 1.00 39.45 C ATOM 306 O GLY A 381 26.578 30.670 2.590 1.00 45.39 O ATOM 307 H GLY A 381 25.573 29.564 4.543 1.00 0.00 H ATOM 308 N VAL A 382 28.796 30.263 2.508 1.00 38.83 N ATOM 309 CA VAL A 382 29.151 31.363 1.608 1.00 38.27 C ATOM 310 C VAL A 382 29.976 30.825 0.442 1.00 37.04 C ATOM 311 O VAL A 382 30.956 30.105 0.647 1.00 35.25 O ATOM 312 CB VAL A 382 29.967 32.456 2.323 1.00 44.22 C ATOM 313 CG1 VAL A 382 30.386 33.551 1.325 1.00 35.53 C ATOM 314 CG2 VAL A 382 29.218 33.002 3.515 1.00 40.92 C ATOM 315 H VAL A 382 29.564 29.663 2.871 1.00 0.00 H ATOM 316 N LEU A 383 29.618 31.224 -0.768 1.00 36.69 N ATOM 317 CA LEU A 383 30.366 30.882 -1.968 1.00 34.07 C ATOM 318 C LEU A 383 31.203 32.076 -2.429 1.00 36.23 C ATOM 319 O LEU A 383 30.705 33.199 -2.517 1.00 36.44 O ATOM 320 CB LEU A 383 29.397 30.418 -3.061 1.00 38.31 C ATOM 321 CG LEU A 383 28.548 29.215 -2.631 1.00 38.53 C ATOM 322 CD1 LEU A 383 27.374 28.962 -3.565 1.00 37.01 C ATOM 323 CD2 LEU A 383 29.429 27.983 -2.502 1.00 32.25 C ATOM 324 H LEU A 383 28.763 31.808 -0.865 1.00 0.00 H ATOM 325 N LEU A 384 32.469 31.837 -2.749 1.00 34.61 N ATOM 326 CA LEU A 384 33.347 32.956 -3.068 1.00 37.71 C ATOM 327 C LEU A 384 33.510 33.234 -4.567 1.00 36.75 C ATOM 328 O LEU A 384 34.163 34.214 -4.918 1.00 37.87 O ATOM 329 CB LEU A 384 34.713 32.745 -2.408 1.00 26.57 C ATOM 330 CG LEU A 384 34.550 32.546 -0.900 1.00 34.09 C ATOM 331 CD1 LEU A 384 35.849 32.293 -0.199 1.00 33.82 C ATOM 332 CD2 LEU A 384 33.872 33.730 -0.285 1.00 34.74 C ATOM 333 H LEU A 384 32.830 30.862 -2.772 1.00 0.00 H ATOM 334 N THR A 385 32.927 32.438 -5.461 1.00 32.10 N ATOM 335 CA THR A 385 33.140 32.651 -6.888 1.00 41.04 C ATOM 336 C THR A 385 31.833 32.639 -7.671 1.00 47.69 C ATOM 337 O THR A 385 30.883 31.934 -7.330 1.00 50.30 O ATOM 338 CB THR A 385 34.091 31.608 -7.510 1.00 46.46 C ATOM 339 OG1 THR A 385 33.928 31.606 -8.936 1.00 47.34 O ATOM 340 CG2 THR A 385 33.847 30.190 -6.941 1.00 45.22 C ATOM 341 HG1 THR A 385 34.142 32.504 -9.293 1.00 0.00 H ATOM 342 H THR A 385 32.316 31.660 -5.140 1.00 0.00 H ATOM 343 N GLU A 386 31.813 33.409 -8.756 1.00 50.68 N ATOM 344 CA GLU A 386 30.582 33.622 -9.501 1.00 56.60 C ATOM 345 C GLU A 386 30.066 32.340 -10.140 1.00 61.25 C ATOM 346 O GLU A 386 28.877 32.266 -10.475 1.00 59.49 O ATOM 347 CB GLU A 386 30.793 34.701 -10.573 1.00 62.52 C ATOM 348 CG GLU A 386 31.772 35.814 -10.178 1.00 65.76 C ATOM 349 CD GLU A 386 33.240 35.458 -10.440 1.00 72.34 C ATOM 350 OE1 GLU A 386 33.542 35.007 -11.569 1.00 77.29 O ATOM 351 OE2 GLU A 386 34.090 35.618 -9.521 1.00 68.99 O ATOM 352 H GLU A 386 32.691 33.865 -9.076 1.00 0.00 H ATOM 353 N LYS A 387 30.915 31.324 -10.297 1.00 52.09 N ATOM 354 CA LYS A 387 30.488 30.089 -10.939 1.00 53.84 C ATOM 355 C LYS A 387 29.938 29.035 -9.965 1.00 54.90 C ATOM 356 O LYS A 387 29.560 27.942 -10.404 1.00 53.26 O ATOM 357 CB LYS A 387 31.634 29.506 -11.760 1.00 54.07 C ATOM 358 CG LYS A 387 32.988 30.097 -11.494 1.00 62.77 C ATOM 359 CD LYS A 387 33.345 31.246 -12.465 1.00 73.53 C ATOM 360 CE LYS A 387 34.847 31.641 -12.325 1.00 81.35 C ATOM 361 NZ LYS A 387 35.155 33.111 -12.412 1.00 73.00 N ATOM 362 HZ1 LYS A 387 34.846 33.475 -13.336 1.00 0.00 H ATOM 363 HZ2 LYS A 387 34.652 33.615 -11.654 1.00 0.00 H ATOM 364 HZ3 LYS A 387 36.179 33.256 -12.306 1.00 0.00 H ATOM 365 H LYS A 387 31.894 31.415 -9.957 1.00 0.00 H ATOM 366 N LEU A 388 29.862 29.335 -8.670 1.00 47.63 N ATOM 367 CA LEU A 388 29.139 28.511 -7.698 1.00 42.37 C ATOM 368 C LEU A 388 28.041 29.405 -7.122 1.00 44.58 C ATOM 369 O LEU A 388 28.322 30.260 -6.277 1.00 58.84 O ATOM 370 CB LEU A 388 30.079 27.973 -6.613 1.00 32.02 C ATOM 371 CG LEU A 388 31.129 26.902 -6.971 1.00 41.04 C ATOM 372 CD1 LEU A 388 31.775 26.255 -5.726 1.00 31.43 C ATOM 373 CD2 LEU A 388 30.581 25.799 -7.887 1.00 38.87 C ATOM 374 H LEU A 388 30.339 30.195 -8.332 1.00 0.00 H ATOM 375 N LYS A 389 26.797 29.237 -7.580 1.00 40.43 N ATOM 376 CA LYS A 389 25.702 30.160 -7.269 1.00 39.38 C ATOM 377 C LYS A 389 24.594 29.462 -6.490 1.00 43.38 C ATOM 378 O LYS A 389 24.123 28.395 -6.911 1.00 42.88 O ATOM 379 CB LYS A 389 25.110 30.772 -8.559 1.00 43.13 C ATOM 380 CG LYS A 389 25.927 31.919 -9.174 1.00 56.37 C ATOM 381 CD LYS A 389 25.591 32.161 -10.671 1.00 50.90 C ATOM 382 CE LYS A 389 26.090 33.525 -11.183 1.00 60.19 C ATOM 383 NZ LYS A 389 25.185 34.703 -10.842 1.00 66.36 N ATOM 384 HZ1 LYS A 389 24.245 34.549 -11.261 1.00 0.00 H ATOM 385 HZ2 LYS A 389 25.097 34.783 -9.809 1.00 0.00 H ATOM 386 HZ3 LYS A 389 25.598 35.578 -11.225 1.00 0.00 H ATOM 387 H LYS A 389 26.597 28.414 -8.184 1.00 0.00 H ATOM 388 N PRO A 390 24.137 30.027 -5.377 1.00 44.81 N ATOM 389 CA PRO A 390 22.996 29.443 -4.668 1.00 39.72 C ATOM 390 C PRO A 390 21.710 29.765 -5.397 1.00 41.02 C ATOM 391 O PRO A 390 21.654 30.634 -6.261 1.00 41.37 O ATOM 392 CB PRO A 390 23.030 30.121 -3.294 1.00 37.90 C ATOM 393 CG PRO A 390 23.728 31.415 -3.516 1.00 37.55 C ATOM 394 CD PRO A 390 24.664 31.224 -4.698 1.00 43.63 C ATOM 395 N VAL A 391 20.666 29.021 -5.061 1.00 43.10 N ATOM 396 CA VAL A 391 19.358 29.249 -5.661 1.00 42.81 C ATOM 397 C VAL A 391 18.365 29.357 -4.527 1.00 41.01 C ATOM 398 O VAL A 391 18.166 28.389 -3.785 1.00 44.22 O ATOM 399 CB VAL A 391 18.937 28.138 -6.636 1.00 39.22 C ATOM 400 CG1 VAL A 391 17.867 28.655 -7.573 1.00 38.42 C ATOM 401 CG2 VAL A 391 20.126 27.635 -7.407 1.00 42.58 C ATOM 402 H VAL A 391 20.782 28.263 -4.358 1.00 0.00 H ATOM 403 N ASP A 392 17.764 30.530 -4.387 1.00 35.98 N ATOM 404 CA ASP A 392 16.794 30.805 -3.341 1.00 38.22 C ATOM 405 C ASP A 392 17.312 30.335 -1.989 1.00 38.64 C ATOM 406 O ASP A 392 16.725 29.482 -1.327 1.00 39.99 O ATOM 407 CB ASP A 392 15.447 30.186 -3.690 1.00 33.83 C ATOM 408 CG ASP A 392 14.962 30.645 -5.040 1.00 44.80 C ATOM 409 OD1 ASP A 392 15.198 31.815 -5.408 1.00 44.06 O ATOM 410 OD2 ASP A 392 14.370 29.834 -5.761 1.00 54.96 O ATOM 411 H ASP A 392 17.998 31.290 -5.058 1.00 0.00 H ATOM 412 N TYR A 393 18.449 30.917 -1.604 1.00 37.45 N ATOM 413 CA TYR A 393 19.066 30.821 -0.286 1.00 36.43 C ATOM 414 C TYR A 393 19.667 29.457 -0.018 1.00 38.93 C ATOM 415 O TYR A 393 20.074 29.196 1.131 1.00 37.88 O ATOM 416 CB TYR A 393 18.075 31.171 0.831 1.00 32.32 C ATOM 417 CG TYR A 393 17.412 32.498 0.603 1.00 36.69 C ATOM 418 CD1 TYR A 393 17.960 33.653 1.113 1.00 41.52 C ATOM 419 CD2 TYR A 393 16.256 32.607 -0.156 1.00 38.52 C ATOM 420 CE1 TYR A 393 17.385 34.883 0.894 1.00 40.83 C ATOM 421 CE2 TYR A 393 15.670 33.830 -0.380 1.00 41.76 C ATOM 422 CZ TYR A 393 16.238 34.975 0.152 1.00 40.63 C ATOM 423 OH TYR A 393 15.676 36.223 -0.055 1.00 40.77 O ATOM 424 HH TYR A 393 16.223 36.910 0.402 1.00 0.00 H ATOM 425 H TYR A 393 18.944 31.496 -2.313 1.00 0.00 H ATOM 426 N GLU A 394 19.749 28.581 -1.032 1.00 34.98 N ATOM 427 CA GLU A 394 20.178 27.199 -0.832 1.00 39.42 C ATOM 428 C GLU A 394 21.295 26.778 -1.783 1.00 44.04 C ATOM 429 O GLU A 394 21.422 27.287 -2.908 1.00 44.37 O ATOM 430 CB GLU A 394 19.009 26.246 -0.999 1.00 34.34 C ATOM 431 CG GLU A 394 17.958 26.525 -0.019 1.00 33.56 C ATOM 432 CD GLU A 394 17.140 25.340 0.280 1.00 38.55 C ATOM 433 OE1 GLU A 394 16.721 24.672 -0.680 1.00 41.35 O ATOM 434 OE2 GLU A 394 16.915 25.082 1.485 1.00 50.91 O ATOM 435 H GLU A 394 19.499 28.896 -1.991 1.00 0.00 H ATOM 436 N TYR A 395 22.092 25.816 -1.315 1.00 39.33 N ATOM 437 CA TYR A 395 23.073 25.113 -2.148 1.00 43.67 C ATOM 438 C TYR A 395 23.115 23.682 -1.634 1.00 42.90 C ATOM 439 O TYR A 395 23.821 23.410 -0.666 1.00 45.97 O ATOM 440 CB TYR A 395 24.454 25.752 -2.064 1.00 36.48 C ATOM 441 CG TYR A 395 25.273 25.542 -3.315 1.00 42.36 C ATOM 442 CD1 TYR A 395 26.549 24.963 -3.268 1.00 41.58 C ATOM 443 CD2 TYR A 395 24.769 25.920 -4.555 1.00 39.70 C ATOM 444 CE1 TYR A 395 27.306 24.774 -4.451 1.00 37.25 C ATOM 445 CE2 TYR A 395 25.491 25.737 -5.721 1.00 39.88 C ATOM 446 CZ TYR A 395 26.754 25.168 -5.676 1.00 39.57 C ATOM 447 OH TYR A 395 27.433 25.001 -6.861 1.00 33.32 O ATOM 448 HH TYR A 395 27.564 25.883 -7.292 1.00 0.00 H ATOM 449 H TYR A 395 22.014 25.552 -0.312 1.00 0.00 H ATOM 450 N ARG A 396 22.365 22.775 -2.257 1.00 41.55 N ATOM 451 CA ARG A 396 22.228 21.422 -1.726 1.00 43.36 C ATOM 452 C ARG A 396 22.813 20.405 -2.699 1.00 44.14 C ATOM 453 O ARG A 396 22.552 20.470 -3.906 1.00 46.21 O ATOM 454 CB ARG A 396 20.768 21.085 -1.414 1.00 38.59 C ATOM 455 CG ARG A 396 20.041 22.150 -0.598 1.00 45.37 C ATOM 456 CD ARG A 396 18.733 21.650 0.043 1.00 42.25 C ATOM 457 NE ARG A 396 18.993 21.117 1.381 1.00 52.34 N ATOM 458 CZ ARG A 396 18.623 21.714 2.513 1.00 55.97 C ATOM 459 NH1 ARG A 396 17.944 22.851 2.452 1.00 53.74 N ATOM 460 NH2 ARG A 396 18.902 21.173 3.701 1.00 46.77 N ATOM 461 HE ARG A 396 19.500 20.212 1.453 1.00 0.00 H ATOM 462 HH12 ARG A 396 17.649 23.328 3.328 1.00 0.00 H ATOM 463 HH11 ARG A 396 17.707 23.266 1.528 1.00 0.00 H ATOM 464 HH22 ARG A 396 18.605 21.654 4.574 1.00 0.00 H ATOM 465 HH21 ARG A 396 19.416 20.271 3.754 1.00 0.00 H ATOM 466 H ARG A 396 21.870 23.034 -3.134 1.00 0.00 H ATOM 467 N GLU A 397 23.583 19.456 -2.161 1.00 39.88 N ATOM 468 CA GLU A 397 24.201 18.414 -2.973 1.00 41.74 C ATOM 469 C GLU A 397 23.157 17.612 -3.740 1.00 48.62 C ATOM 470 O GLU A 397 22.151 17.171 -3.173 1.00 45.81 O ATOM 471 CB GLU A 397 25.023 17.481 -2.087 1.00 40.98 C ATOM 472 CG GLU A 397 25.725 16.372 -2.843 1.00 43.52 C ATOM 473 CD GLU A 397 26.736 15.589 -2.001 1.00 43.45 C ATOM 474 OE1 GLU A 397 26.860 15.855 -0.784 1.00 43.54 O ATOM 475 OE2 GLU A 397 27.407 14.698 -2.573 1.00 49.20 O ATOM 476 H GLU A 397 23.747 19.460 -1.134 1.00 0.00 H ATOM 477 N GLU A 398 23.399 17.431 -5.035 1.00 41.44 N ATOM 478 CA GLU A 398 22.565 16.667 -5.965 1.00 53.86 C ATOM 479 C GLU A 398 21.357 17.481 -6.425 1.00 57.34 C ATOM 480 O GLU A 398 20.599 17.014 -7.307 1.00 53.77 O ATOM 481 CB GLU A 398 22.092 15.304 -5.404 1.00 55.57 C ATOM 482 CG GLU A 398 23.227 14.239 -5.153 1.00 54.00 C ATOM 483 CD GLU A 398 24.323 14.199 -6.248 1.00 64.90 C ATOM 484 OE1 GLU A 398 23.978 14.195 -7.465 1.00 68.25 O ATOM 485 OE2 GLU A 398 25.532 14.181 -5.879 1.00 56.81 O ATOM 486 H GLU A 398 24.258 17.872 -5.422 1.00 0.00 H ATOM 487 N VAL A 399 21.159 18.684 -5.896 1.00 49.95 N ATOM 488 CA VAL A 399 20.113 19.584 -6.354 1.00 40.02 C ATOM 489 C VAL A 399 20.697 20.736 -7.139 1.00 41.37 C ATOM 490 O VAL A 399 20.325 20.968 -8.289 1.00 46.71 O ATOM 491 CB VAL A 399 19.275 20.098 -5.168 1.00 45.02 C ATOM 492 CG1 VAL A 399 18.079 20.943 -5.681 1.00 28.67 C ATOM 493 CG2 VAL A 399 18.888 18.950 -4.293 1.00 35.97 C ATOM 494 H VAL A 399 21.779 18.995 -5.121 1.00 0.00 H ATOM 495 N HIS A 400 21.611 21.484 -6.528 1.00 39.36 N ATOM 496 CA HIS A 400 22.259 22.611 -7.182 1.00 43.73 C ATOM 497 C HIS A 400 23.681 22.287 -7.613 1.00 46.38 C ATOM 498 O HIS A 400 24.174 22.898 -8.567 1.00 47.94 O ATOM 499 CB HIS A 400 22.237 23.845 -6.258 1.00 44.74 C ATOM 500 CG HIS A 400 20.922 24.037 -5.561 1.00 44.52 C ATOM 501 ND1 HIS A 400 20.738 23.758 -4.223 1.00 37.82 N ATOM 502 CD2 HIS A 400 19.712 24.419 -6.035 1.00 39.28 C ATOM 503 CE1 HIS A 400 19.474 23.970 -3.904 1.00 37.92 C ATOM 504 NE2 HIS A 400 18.827 24.357 -4.988 1.00 32.20 N ATOM 505 H HIS A 400 21.872 21.255 -5.548 1.00 0.00 H ATOM 506 N TRP A 401 24.334 21.321 -6.946 1.00 41.98 N ATOM 507 CA TRP A 401 25.577 20.730 -7.415 1.00 45.01 C ATOM 508 C TRP A 401 25.524 19.205 -7.327 1.00 50.01 C ATOM 509 O TRP A 401 25.024 18.641 -6.346 1.00 50.22 O ATOM 510 CB TRP A 401 26.776 21.277 -6.640 1.00 40.03 C ATOM 511 CG TRP A 401 26.790 20.969 -5.200 1.00 45.42 C ATOM 512 CD1 TRP A 401 26.071 21.587 -4.213 1.00 41.66 C ATOM 513 CD2 TRP A 401 27.593 19.977 -4.549 1.00 45.84 C ATOM 514 NE1 TRP A 401 26.376 21.031 -2.988 1.00 40.76 N ATOM 515 CE2 TRP A 401 27.309 20.042 -3.172 1.00 37.50 C ATOM 516 CE3 TRP A 401 28.523 19.039 -4.998 1.00 44.75 C ATOM 517 CZ2 TRP A 401 27.922 19.209 -2.249 1.00 35.40 C ATOM 518 CZ3 TRP A 401 29.123 18.215 -4.076 1.00 44.69 C ATOM 519 CH2 TRP A 401 28.820 18.308 -2.715 1.00 37.38 C ATOM 520 HE1 TRP A 401 25.966 21.315 -2.075 1.00 0.00 H ATOM 521 H TRP A 401 23.931 20.979 -6.050 1.00 0.00 H ATOM 522 N MET A 402 26.034 18.548 -8.377 1.00 54.07 N ATOM 523 CA MET A 402 26.164 17.096 -8.476 1.00 54.12 C ATOM 524 C MET A 402 27.625 16.675 -8.410 1.00 48.62 C ATOM 525 O MET A 402 28.492 17.301 -9.022 1.00 48.23 O ATOM 526 CB MET A 402 25.582 16.566 -9.797 1.00 64.44 C ATOM 527 CG MET A 402 24.888 17.605 -10.699 1.00 69.57 C ATOM 528 SD MET A 402 23.142 17.968 -10.268 1.00 94.60 S ATOM 529 CE MET A 402 22.471 16.311 -9.995 1.00 72.83 C ATOM 530 H MET A 402 26.363 19.115 -9.184 1.00 0.00 H ATOM 531 N THR A 403 27.899 15.600 -7.687 1.00 56.25 N ATOM 532 CA THR A 403 29.181 14.929 -7.844 1.00 58.28 C ATOM 533 C THR A 403 29.277 14.303 -9.235 1.00 68.08 C ATOM 534 O THR A 403 28.274 13.904 -9.834 1.00 65.74 O ATOM 535 CB THR A 403 29.373 13.848 -6.782 1.00 55.95 C ATOM 536 OG1 THR A 403 28.485 14.075 -5.683 1.00 65.91 O ATOM 537 CG2 THR A 403 30.765 13.899 -6.271 1.00 62.06 C ATOM 538 HG1 THR A 403 27.549 14.051 -6.006 1.00 0.00 H ATOM 539 H THR A 403 27.200 15.236 -7.009 1.00 0.00 H ATOM 540 N HIS A 404 30.503 14.229 -9.751 1.00 78.10 N ATOM 541 CA HIS A 404 30.742 13.657 -11.071 1.00 88.91 C ATOM 542 C HIS A 404 30.515 12.144 -11.052 1.00 95.70 C ATOM 543 O HIS A 404 31.062 11.434 -10.199 1.00 87.66 O ATOM 544 CB HIS A 404 32.168 14.005 -11.531 1.00 84.70 C ATOM 545 CG HIS A 404 32.751 13.064 -12.552 1.00104.67 C ATOM 546 ND1 HIS A 404 32.737 13.329 -13.907 1.00107.40 N ATOM 547 CD2 HIS A 404 33.395 11.877 -12.410 1.00106.12 C ATOM 548 CE1 HIS A 404 33.328 12.338 -14.555 1.00109.22 C ATOM 549 NE2 HIS A 404 33.735 11.444 -13.670 1.00107.18 N ATOM 550 H HIS A 404 31.309 14.588 -9.200 1.00 0.00 H ATOM 551 N GLN A 405 29.641 11.669 -11.968 1.00 99.61 N ATOM 552 CA GLN A 405 29.547 10.302 -12.492 1.00107.15 C ATOM 553 C GLN A 405 29.428 9.273 -11.363 1.00110.37 C ATOM 554 O GLN A 405 28.914 9.630 -10.291 1.00105.63 O ATOM 555 CB GLN A 405 30.750 10.059 -13.421 1.00107.42 C ATOM 556 CG GLN A 405 30.469 10.387 -14.901 1.00113.85 C ATOM 557 CD GLN A 405 29.483 11.553 -15.092 1.00123.03 C ATOM 558 OE1 GLN A 405 28.304 11.340 -15.394 1.00121.42 O ATOM 559 NE2 GLN A 405 29.970 12.785 -14.931 1.00119.44 N ATOM 560 HE22 GLN A 405 30.969 12.920 -14.676 1.00 0.00 H ATOM 561 HE21 GLN A 405 29.350 13.610 -15.060 1.00 0.00 H ATOM 562 H GLN A 405 28.955 12.353 -12.345 1.00 0.00 H ATOM 563 N PRO A 406 29.802 7.991 -11.546 1.00111.36 N ATOM 564 CA PRO A 406 30.057 7.161 -10.364 1.00107.71 C ATOM 565 C PRO A 406 31.134 7.810 -9.509 1.00 98.61 C ATOM 566 O PRO A 406 32.148 8.294 -10.020 1.00 91.85 O ATOM 567 CB PRO A 406 30.512 5.814 -10.947 1.00 97.37 C ATOM 568 CG PRO A 406 30.724 6.051 -12.407 1.00 94.78 C ATOM 569 CD PRO A 406 29.751 7.134 -12.748 1.00105.56 C ATOM 570 N ARG A 407 30.893 7.834 -8.200 1.00 89.04 N ATOM 571 CA ARG A 407 31.724 8.637 -7.318 1.00 91.84 C ATOM 572 C ARG A 407 33.183 8.196 -7.392 1.00 98.76 C ATOM 573 O ARG A 407 33.502 7.007 -7.302 1.00100.76 O ATOM 574 CB ARG A 407 31.209 8.563 -5.881 1.00 91.37 C ATOM 575 CG ARG A 407 30.716 9.915 -5.325 1.00 78.47 C ATOM 576 CD ARG A 407 30.563 9.869 -3.795 1.00 74.43 C ATOM 577 NE ARG A 407 29.492 10.741 -3.304 1.00 86.92 N ATOM 578 CZ ARG A 407 29.668 11.866 -2.599 1.00 75.62 C ATOM 579 NH1 ARG A 407 30.891 12.276 -2.272 1.00 62.08 N ATOM 580 NH2 ARG A 407 28.605 12.578 -2.208 1.00 66.89 N ATOM 581 HE ARG A 407 28.514 10.463 -3.521 1.00 0.00 H ATOM 582 HH12 ARG A 407 31.017 13.151 -1.724 1.00 0.00 H ATOM 583 HH11 ARG A 407 31.721 11.721 -2.564 1.00 0.00 H ATOM 584 HH22 ARG A 407 28.737 13.452 -1.660 1.00 0.00 H ATOM 585 HH21 ARG A 407 27.646 12.257 -2.452 1.00 0.00 H ATOM 586 H ARG A 407 30.108 7.277 -7.807 1.00 0.00 H ATOM 587 N VAL A 408 34.062 9.171 -7.598 1.00100.18 N ATOM 588 CA VAL A 408 35.504 8.990 -7.531 1.00 88.97 C ATOM 589 C VAL A 408 36.006 9.914 -6.425 1.00 88.29 C ATOM 590 O VAL A 408 35.956 11.150 -6.562 1.00 79.81 O ATOM 591 CB VAL A 408 36.186 9.289 -8.875 1.00 97.38 C ATOM 592 CG1 VAL A 408 36.153 8.058 -9.757 1.00 88.63 C ATOM 593 CG2 VAL A 408 35.514 10.498 -9.590 1.00 95.07 C ATOM 594 H VAL A 408 33.698 10.119 -7.820 1.00 0.00 H ATOM 595 N GLY A 409 36.450 9.305 -5.288 1.00 81.35 N ATOM 596 CA GLY A 409 37.086 10.042 -4.210 1.00 70.53 C ATOM 597 C GLY A 409 38.595 10.146 -4.412 1.00 71.15 C ATOM 598 O GLY A 409 39.180 9.448 -5.246 1.00 78.15 O ATOM 599 H GLY A 409 36.329 8.277 -5.190 1.00 0.00 H ATOM 600 N ARG A 410 39.242 11.048 -3.651 1.00 58.12 N ATOM 601 CA ARG A 410 40.659 11.202 -3.946 1.00 57.63 C ATOM 602 C ARG A 410 41.553 11.617 -2.788 1.00 51.11 C ATOM 603 O ARG A 410 42.769 11.662 -2.992 1.00 51.38 O ATOM 604 CB ARG A 410 40.842 12.173 -5.127 1.00 66.39 C ATOM 605 CG ARG A 410 42.006 11.766 -6.042 1.00 68.42 C ATOM 606 CD ARG A 410 41.826 12.225 -7.488 1.00 81.71 C ATOM 607 NE ARG A 410 40.943 11.359 -8.274 1.00 98.10 N ATOM 608 CZ ARG A 410 40.489 11.658 -9.494 1.00101.79 C ATOM 609 NH1 ARG A 410 40.827 12.810 -10.072 1.00 89.25 N ATOM 610 NH2 ARG A 410 39.686 10.811 -10.133 1.00100.74 N ATOM 611 HE ARG A 410 40.651 10.453 -7.855 1.00 0.00 H ATOM 612 HH12 ARG A 410 40.471 13.039 -11.022 1.00 0.00 H ATOM 613 HH11 ARG A 410 41.446 13.480 -9.573 1.00 0.00 H ATOM 614 HH22 ARG A 410 39.333 11.045 -11.083 1.00 0.00 H ATOM 615 HH21 ARG A 410 39.411 9.915 -9.683 1.00 0.00 H ATOM 616 H ARG A 410 38.764 11.595 -2.907 1.00 0.00 H ATOM 617 N GLY A 411 41.044 11.860 -1.580 1.00 44.28 N ATOM 618 CA GLY A 411 41.899 12.142 -0.441 1.00 37.61 C ATOM 619 C GLY A 411 42.310 10.890 0.319 1.00 39.25 C ATOM 620 O GLY A 411 42.020 9.760 -0.071 1.00 40.89 O ATOM 621 H GLY A 411 40.012 11.847 -1.451 1.00 0.00 H ATOM 622 N SER A 412 42.982 11.106 1.452 1.00 40.38 N ATOM 623 CA SER A 412 43.261 10.012 2.381 1.00 31.40 C ATOM 624 C SER A 412 42.010 9.221 2.759 1.00 42.43 C ATOM 625 O SER A 412 42.092 8.007 2.999 1.00 45.26 O ATOM 626 CB SER A 412 43.916 10.555 3.651 1.00 36.15 C ATOM 627 OG SER A 412 45.307 10.828 3.470 1.00 57.75 O ATOM 628 HG SER A 412 45.687 11.176 4.315 1.00 0.00 H ATOM 629 H SER A 412 43.312 12.066 1.677 1.00 0.00 H ATOM 630 N PHE A 413 40.855 9.890 2.853 1.00 42.53 N ATOM 631 CA PHE A 413 39.591 9.286 3.265 1.00 39.10 C ATOM 632 C PHE A 413 38.602 9.171 2.129 1.00 38.46 C ATOM 633 O PHE A 413 37.415 8.953 2.384 1.00 36.25 O ATOM 634 CB PHE A 413 38.925 10.098 4.367 1.00 36.60 C ATOM 635 CG PHE A 413 39.809 10.404 5.505 1.00 39.47 C ATOM 636 CD1 PHE A 413 39.793 9.615 6.634 1.00 44.02 C ATOM 637 CD2 PHE A 413 40.649 11.480 5.467 1.00 34.65 C ATOM 638 CE1 PHE A 413 40.602 9.897 7.688 1.00 39.69 C ATOM 639 CE2 PHE A 413 41.462 11.749 6.519 1.00 34.37 C ATOM 640 CZ PHE A 413 41.434 10.965 7.627 1.00 33.99 C ATOM 641 H PHE A 413 40.858 10.903 2.618 1.00 0.00 H ATOM 642 N GLY A 414 39.051 9.358 0.897 1.00 35.49 N ATOM 643 CA GLY A 414 38.144 9.300 -0.231 1.00 37.25 C ATOM 644 C GLY A 414 37.045 10.323 -0.138 1.00 40.16 C ATOM 645 O GLY A 414 35.900 10.042 -0.505 1.00 44.29 O ATOM 646 H GLY A 414 40.061 9.548 0.738 1.00 0.00 H ATOM 647 N GLU A 415 37.379 11.522 0.336 1.00 45.48 N ATOM 648 CA GLU A 415 36.413 12.557 0.680 1.00 40.59 C ATOM 649 C GLU A 415 36.493 13.756 -0.238 1.00 34.24 C ATOM 650 O GLU A 415 35.785 14.736 -0.013 1.00 37.04 O ATOM 651 CB GLU A 415 36.630 13.029 2.123 1.00 38.86 C ATOM 652 CG GLU A 415 37.750 14.073 2.247 1.00 39.38 C ATOM 653 CD GLU A 415 39.182 13.484 2.198 1.00 43.43 C ATOM 654 OE1 GLU A 415 39.342 12.262 2.020 1.00 33.97 O ATOM 655 OE2 GLU A 415 40.156 14.269 2.348 1.00 51.74 O ATOM 656 H GLU A 415 38.389 11.732 0.468 1.00 0.00 H ATOM 657 N VAL A 416 37.348 13.712 -1.245 1.00 36.85 N ATOM 658 CA VAL A 416 37.517 14.796 -2.203 1.00 42.00 C ATOM 659 C VAL A 416 36.938 14.322 -3.524 1.00 39.51 C ATOM 660 O VAL A 416 37.267 13.228 -3.989 1.00 44.11 O ATOM 661 CB VAL A 416 39.000 15.202 -2.365 1.00 42.76 C ATOM 662 CG1 VAL A 416 39.119 16.341 -3.319 1.00 39.68 C ATOM 663 CG2 VAL A 416 39.615 15.607 -1.051 1.00 32.42 C ATOM 664 H VAL A 416 37.931 12.858 -1.359 1.00 0.00 H ATOM 665 N HIS A 417 36.082 15.135 -4.131 1.00 40.51 N ATOM 666 CA HIS A 417 35.416 14.715 -5.353 1.00 42.09 C ATOM 667 C HIS A 417 35.414 15.839 -6.362 1.00 39.82 C ATOM 668 O HIS A 417 35.557 17.006 -6.026 1.00 48.52 O ATOM 669 CB HIS A 417 33.975 14.262 -5.099 1.00 43.99 C ATOM 670 CG HIS A 417 33.857 13.264 -3.998 1.00 43.52 C ATOM 671 ND1 HIS A 417 33.919 11.908 -4.218 1.00 55.71 N ATOM 672 CD2 HIS A 417 33.727 13.425 -2.663 1.00 40.43 C ATOM 673 CE1 HIS A 417 33.831 11.277 -3.063 1.00 53.19 C ATOM 674 NE2 HIS A 417 33.710 12.175 -2.103 1.00 46.28 N ATOM 675 H HIS A 417 35.887 16.075 -3.731 1.00 0.00 H ATOM 676 N ARG A 418 35.282 15.449 -7.613 1.00 48.70 N ATOM 677 CA ARG A 418 34.940 16.350 -8.694 1.00 47.46 C ATOM 678 C ARG A 418 33.436 16.589 -8.673 1.00 57.03 C ATOM 679 O ARG A 418 32.656 15.716 -8.274 1.00 57.49 O ATOM 680 CB ARG A 418 35.383 15.734 -10.016 1.00 48.87 C ATOM 681 CG ARG A 418 35.208 16.580 -11.241 1.00 72.74 C ATOM 682 CD ARG A 418 35.595 15.760 -12.475 1.00 87.58 C ATOM 683 NE ARG A 418 36.991 15.315 -12.440 1.00 92.18 N ATOM 684 CZ ARG A 418 37.957 15.879 -13.161 1.00 86.58 C ATOM 685 NH1 ARG A 418 37.653 16.894 -13.963 1.00 87.03 N ATOM 686 NH2 ARG A 418 39.213 15.438 -13.086 1.00 81.58 N ATOM 687 HE ARG A 418 37.239 14.518 -11.820 1.00 0.00 H ATOM 688 HH12 ARG A 418 38.396 17.346 -14.534 1.00 0.00 H ATOM 689 HH11 ARG A 418 36.672 17.236 -14.020 1.00 0.00 H ATOM 690 HH22 ARG A 418 39.957 15.889 -13.656 1.00 0.00 H ATOM 691 HH21 ARG A 418 39.448 14.643 -12.458 1.00 0.00 H ATOM 692 H ARG A 418 35.431 14.444 -7.836 1.00 0.00 H ATOM 693 N MET A 419 33.032 17.788 -9.087 1.00 51.88 N ATOM 694 CA MET A 419 31.637 18.202 -8.997 1.00 51.41 C ATOM 695 C MET A 419 31.340 19.252 -10.060 1.00 48.26 C ATOM 696 O MET A 419 32.229 19.942 -10.559 1.00 49.22 O ATOM 697 CB MET A 419 31.304 18.756 -7.602 1.00 46.92 C ATOM 698 CG MET A 419 32.039 20.061 -7.275 1.00 45.65 C ATOM 699 SD MET A 419 30.914 21.410 -7.000 1.00 49.34 S ATOM 700 CE MET A 419 30.867 22.211 -8.579 1.00 52.16 C ATOM 701 H MET A 419 33.731 18.447 -9.486 1.00 0.00 H ATOM 702 N LYS A 420 30.068 19.380 -10.384 1.00 49.85 N ATOM 703 CA LYS A 420 29.605 20.392 -11.314 1.00 52.25 C ATOM 704 C LYS A 420 28.539 21.237 -10.627 1.00 54.41 C ATOM 705 O LYS A 420 27.730 20.732 -9.846 1.00 50.55 O ATOM 706 CB LYS A 420 29.052 19.749 -12.586 1.00 44.62 C ATOM 707 CG LYS A 420 29.117 20.611 -13.796 1.00 51.68 C ATOM 708 CD LYS A 420 28.752 19.821 -15.071 1.00 59.44 C ATOM 709 CE LYS A 420 27.232 19.728 -15.282 1.00 70.03 C ATOM 710 NZ LYS A 420 26.774 20.019 -16.696 1.00 63.83 N ATOM 711 HZ1 LYS A 420 27.058 20.984 -16.959 1.00 0.00 H ATOM 712 HZ2 LYS A 420 27.212 19.338 -17.348 1.00 0.00 H ATOM 713 HZ3 LYS A 420 25.739 19.934 -16.748 1.00 0.00 H ATOM 714 H LYS A 420 29.374 18.733 -9.958 1.00 0.00 H ATOM 715 N ASP A 421 28.563 22.532 -10.883 1.00 54.63 N ATOM 716 CA ASP A 421 27.440 23.374 -10.517 1.00 49.89 C ATOM 717 C ASP A 421 26.361 23.199 -11.571 1.00 47.63 C ATOM 718 O ASP A 421 26.599 23.484 -12.749 1.00 44.99 O ATOM 719 CB ASP A 421 27.875 24.827 -10.426 1.00 52.74 C ATOM 720 CG ASP A 421 26.751 25.719 -10.056 1.00 51.59 C ATOM 721 OD1 ASP A 421 26.655 26.072 -8.864 1.00 46.36 O ATOM 722 OD2 ASP A 421 25.947 26.025 -10.962 1.00 53.81 O ATOM 723 H ASP A 421 29.392 22.951 -11.350 1.00 0.00 H ATOM 724 N LYS A 422 25.184 22.727 -11.147 1.00 50.14 N ATOM 725 CA LYS A 422 24.147 22.327 -12.098 1.00 49.69 C ATOM 726 C LYS A 422 23.750 23.468 -13.016 1.00 52.38 C ATOM 727 O LYS A 422 23.567 23.258 -14.218 1.00 58.64 O ATOM 728 CB LYS A 422 22.915 21.794 -11.372 1.00 51.82 C ATOM 729 CG LYS A 422 21.932 21.141 -12.320 1.00 62.96 C ATOM 730 CD LYS A 422 20.566 20.840 -11.684 1.00 82.33 C ATOM 731 CE LYS A 422 19.547 20.346 -12.743 1.00 79.29 C ATOM 732 NZ LYS A 422 18.200 19.996 -12.176 1.00 65.46 N ATOM 733 HZ1 LYS A 422 18.308 19.236 -11.474 1.00 0.00 H ATOM 734 HZ2 LYS A 422 17.788 20.835 -11.720 1.00 0.00 H ATOM 735 HZ3 LYS A 422 17.575 19.675 -12.943 1.00 0.00 H ATOM 736 H LYS A 422 25.003 22.643 -10.126 1.00 0.00 H ATOM 737 N GLN A 423 23.644 24.690 -12.483 1.00 53.47 N ATOM 738 CA GLN A 423 23.185 25.814 -13.295 1.00 48.35 C ATOM 739 C GLN A 423 24.299 26.392 -14.152 1.00 50.51 C ATOM 740 O GLN A 423 24.092 26.634 -15.344 1.00 54.42 O ATOM 741 CB GLN A 423 22.580 26.914 -12.428 1.00 53.47 C ATOM 742 CG GLN A 423 21.709 26.388 -11.292 1.00 71.05 C ATOM 743 CD GLN A 423 22.524 26.073 -10.025 1.00 66.64 C ATOM 744 OE1 GLN A 423 22.371 24.991 -9.424 1.00 59.85 O ATOM 745 NE2 GLN A 423 23.387 27.019 -9.613 1.00 52.17 N ATOM 746 HE22 GLN A 423 23.480 27.906 -10.147 1.00 0.00 H ATOM 747 HE21 GLN A 423 23.961 26.863 -8.760 1.00 0.00 H ATOM 748 H GLN A 423 23.890 24.841 -11.484 1.00 0.00 H ATOM 749 N THR A 424 25.484 26.637 -13.576 1.00 49.03 N ATOM 750 CA THR A 424 26.536 27.290 -14.359 1.00 47.48 C ATOM 751 C THR A 424 27.368 26.331 -15.198 1.00 50.50 C ATOM 752 O THR A 424 28.112 26.801 -16.060 1.00 51.99 O ATOM 753 CB THR A 424 27.501 28.085 -13.475 1.00 44.40 C ATOM 754 OG1 THR A 424 28.377 27.188 -12.782 1.00 45.88 O ATOM 755 CG2 THR A 424 26.744 28.918 -12.489 1.00 45.44 C ATOM 756 HG1 THR A 424 28.998 27.709 -12.213 1.00 0.00 H ATOM 757 H THR A 424 25.655 26.367 -12.586 1.00 0.00 H ATOM 758 N GLY A 425 27.285 25.017 -14.958 1.00 52.64 N ATOM 759 CA GLY A 425 28.124 24.049 -15.637 1.00 45.94 C ATOM 760 C GLY A 425 29.567 24.028 -15.188 1.00 52.79 C ATOM 761 O GLY A 425 30.330 23.173 -15.643 1.00 58.78 O ATOM 762 H GLY A 425 26.594 24.678 -14.259 1.00 0.00 H ATOM 763 N PHE A 426 29.962 24.941 -14.315 1.00 61.07 N ATOM 764 CA PHE A 426 31.318 24.994 -13.799 1.00 54.95 C ATOM 765 C PHE A 426 31.651 23.718 -13.037 1.00 51.15 C ATOM 766 O PHE A 426 30.785 23.108 -12.414 1.00 54.17 O ATOM 767 CB PHE A 426 31.435 26.206 -12.888 1.00 53.36 C ATOM 768 CG PHE A 426 32.821 26.591 -12.576 1.00 56.47 C ATOM 769 CD1 PHE A 426 33.293 26.489 -11.273 1.00 55.51 C ATOM 770 CD2 PHE A 426 33.663 27.070 -13.573 1.00 64.92 C ATOM 771 CE1 PHE A 426 34.594 26.845 -10.951 1.00 59.54 C ATOM 772 CE2 PHE A 426 34.974 27.432 -13.263 1.00 72.92 C ATOM 773 CZ PHE A 426 35.441 27.322 -11.942 1.00 65.32 C ATOM 774 H PHE A 426 29.274 25.648 -13.986 1.00 0.00 H ATOM 775 N GLN A 427 32.917 23.300 -13.113 1.00 56.30 N ATOM 776 CA GLN A 427 33.429 22.140 -12.388 1.00 51.16 C ATOM 777 C GLN A 427 34.521 22.542 -11.408 1.00 49.34 C ATOM 778 O GLN A 427 35.318 23.451 -11.670 1.00 51.18 O ATOM 779 CB GLN A 427 34.006 21.084 -13.320 1.00 49.75 C ATOM 780 CG GLN A 427 33.080 20.656 -14.414 1.00 65.99 C ATOM 781 CD GLN A 427 33.432 19.296 -14.993 1.00 77.53 C ATOM 782 OE1 GLN A 427 34.458 18.688 -14.632 1.00 78.03 O ATOM 783 NE2 GLN A 427 32.573 18.805 -15.902 1.00 67.42 N ATOM 784 HE22 GLN A 427 31.730 19.352 -16.170 1.00 0.00 H ATOM 785 HE21 GLN A 427 32.751 17.878 -16.338 1.00 0.00 H ATOM 786 H GLN A 427 33.574 23.829 -13.721 1.00 0.00 H ATOM 787 N CYS A 428 34.587 21.819 -10.303 1.00 41.24 N ATOM 788 CA CYS A 428 35.617 22.067 -9.303 1.00 47.72 C ATOM 789 C CYS A 428 35.681 20.906 -8.299 1.00 44.64 C ATOM 790 O CYS A 428 35.170 19.817 -8.558 1.00 48.70 O ATOM 791 CB CYS A 428 35.363 23.419 -8.620 1.00 47.74 C ATOM 792 SG CYS A 428 33.914 23.494 -7.568 1.00 58.42 S ATOM 793 H CYS A 428 33.893 21.061 -10.145 1.00 0.00 H ATOM 794 N ALA A 429 36.303 21.114 -7.149 1.00 38.15 N ATOM 795 CA ALA A 429 36.497 20.033 -6.200 1.00 35.50 C ATOM 796 C ALA A 429 35.779 20.316 -4.886 1.00 35.83 C ATOM 797 O ALA A 429 35.766 21.453 -4.405 1.00 35.50 O ATOM 798 CB ALA A 429 37.981 19.807 -5.943 1.00 35.87 C ATOM 799 H ALA A 429 36.658 22.065 -6.922 1.00 0.00 H ATOM 800 N VAL A 430 35.169 19.277 -4.324 1.00 35.27 N ATOM 801 CA VAL A 430 34.629 19.304 -2.975 1.00 41.02 C ATOM 802 C VAL A 430 35.479 18.417 -2.112 1.00 40.58 C ATOM 803 O VAL A 430 35.747 17.274 -2.491 1.00 43.74 O ATOM 804 CB VAL A 430 33.189 18.793 -2.872 1.00 43.17 C ATOM 805 CG1 VAL A 430 32.506 19.560 -1.744 1.00 32.90 C ATOM 806 CG2 VAL A 430 32.486 18.896 -4.180 1.00 40.57 C ATOM 807 H VAL A 430 35.074 18.401 -4.877 1.00 0.00 H ATOM 808 N LYS A 431 35.843 18.922 -0.939 1.00 35.84 N ATOM 809 CA LYS A 431 36.284 18.105 0.176 1.00 34.98 C ATOM 810 C LYS A 431 35.139 18.069 1.185 1.00 39.54 C ATOM 811 O LYS A 431 34.649 19.127 1.598 1.00 39.82 O ATOM 812 CB LYS A 431 37.569 18.665 0.796 1.00 27.00 C ATOM 813 CG LYS A 431 38.156 17.800 1.913 1.00 35.50 C ATOM 814 CD LYS A 431 38.884 18.602 3.022 1.00 40.11 C ATOM 815 CE LYS A 431 39.645 17.676 4.000 1.00 42.28 C ATOM 816 NZ LYS A 431 40.159 18.342 5.245 1.00 41.30 N ATOM 817 HZ1 LYS A 431 40.819 19.102 4.983 1.00 0.00 H ATOM 818 HZ2 LYS A 431 39.360 18.743 5.777 1.00 0.00 H ATOM 819 HZ3 LYS A 431 40.652 17.641 5.833 1.00 0.00 H ATOM 820 H LYS A 431 35.810 19.954 -0.813 1.00 0.00 H ATOM 821 N LYS A 432 34.688 16.862 1.550 1.00 36.00 N ATOM 822 CA LYS A 432 33.697 16.681 2.612 1.00 37.77 C ATOM 823 C LYS A 432 34.371 16.560 3.975 1.00 39.61 C ATOM 824 O LYS A 432 35.335 15.806 4.132 1.00 37.24 O ATOM 825 CB LYS A 432 32.848 15.435 2.371 1.00 35.51 C ATOM 826 CG LYS A 432 31.695 15.636 1.450 1.00 43.09 C ATOM 827 CD LYS A 432 30.487 14.843 1.912 1.00 45.00 C ATOM 828 CE LYS A 432 29.311 15.111 1.003 1.00 41.63 C ATOM 829 NZ LYS A 432 29.853 15.092 -0.382 1.00 42.10 N ATOM 830 HZ1 LYS A 432 30.580 15.830 -0.479 1.00 0.00 H ATOM 831 HZ2 LYS A 432 30.274 14.161 -0.575 1.00 0.00 H ATOM 832 HZ3 LYS A 432 29.083 15.272 -1.057 1.00 0.00 H ATOM 833 H LYS A 432 35.056 16.021 1.060 1.00 0.00 H ATOM 834 N VAL A 433 33.837 17.276 4.966 1.00 41.39 N ATOM 835 CA VAL A 433 34.337 17.231 6.344 1.00 45.63 C ATOM 836 C VAL A 433 33.155 16.992 7.270 1.00 40.19 C ATOM 837 O VAL A 433 32.140 17.684 7.169 1.00 41.71 O ATOM 838 CB VAL A 433 35.054 18.532 6.766 1.00 41.65 C ATOM 839 CG1 VAL A 433 35.446 18.452 8.216 1.00 41.86 C ATOM 840 CG2 VAL A 433 36.257 18.840 5.885 1.00 40.77 C ATOM 841 H VAL A 433 33.029 17.895 4.751 1.00 0.00 H ATOM 842 N ARG A 434 33.283 16.025 8.164 1.00 41.61 N ATOM 843 CA ARG A 434 32.247 15.798 9.162 1.00 47.33 C ATOM 844 C ARG A 434 32.113 17.002 10.089 1.00 50.17 C ATOM 845 O ARG A 434 33.081 17.392 10.760 1.00 42.16 O ATOM 846 CB ARG A 434 32.555 14.548 9.974 1.00 50.28 C ATOM 847 CG ARG A 434 32.297 13.314 9.197 1.00 48.62 C ATOM 848 CD ARG A 434 32.781 12.080 9.921 1.00 56.04 C ATOM 849 NE ARG A 434 32.286 10.908 9.211 1.00 56.95 N ATOM 850 CZ ARG A 434 32.723 9.667 9.368 1.00 51.47 C ATOM 851 NH1 ARG A 434 33.702 9.390 10.220 1.00 47.94 N ATOM 852 NH2 ARG A 434 32.162 8.704 8.651 1.00 52.08 N ATOM 853 HE ARG A 434 31.523 11.059 8.521 1.00 0.00 H ATOM 854 HH12 ARG A 434 34.033 8.410 10.331 1.00 0.00 H ATOM 855 HH11 ARG A 434 34.138 10.153 10.777 1.00 0.00 H ATOM 856 HH22 ARG A 434 32.487 7.722 8.755 1.00 0.00 H ATOM 857 HH21 ARG A 434 31.397 8.931 7.984 1.00 0.00 H ATOM 858 H ARG A 434 34.130 15.422 8.154 1.00 0.00 H ATOM 859 N LEU A 435 30.894 17.572 10.130 1.00 49.06 N ATOM 860 CA LEU A 435 30.654 18.790 10.898 1.00 45.72 C ATOM 861 C LEU A 435 31.045 18.609 12.357 1.00 50.88 C ATOM 862 O LEU A 435 31.495 19.561 13.006 1.00 53.14 O ATOM 863 CB LEU A 435 29.190 19.210 10.764 1.00 44.39 C ATOM 864 CG LEU A 435 28.612 20.169 11.809 1.00 38.14 C ATOM 865 CD1 LEU A 435 29.275 21.540 11.872 1.00 32.39 C ATOM 866 CD2 LEU A 435 27.157 20.309 11.580 1.00 41.09 C ATOM 867 H LEU A 435 30.109 17.137 9.605 1.00 0.00 H ATOM 868 N GLU A 436 30.941 17.387 12.870 1.00 48.58 N ATOM 869 CA GLU A 436 31.248 17.144 14.266 1.00 51.79 C ATOM 870 C GLU A 436 32.737 17.195 14.564 1.00 49.29 C ATOM 871 O GLU A 436 33.110 17.340 15.734 1.00 60.97 O ATOM 872 CB GLU A 436 30.676 15.794 14.683 1.00 61.93 C ATOM 873 CG GLU A 436 30.893 14.719 13.657 1.00 65.68 C ATOM 874 CD GLU A 436 30.471 13.359 14.161 1.00 87.46 C ATOM 875 OE1 GLU A 436 30.128 13.264 15.366 1.00 93.40 O ATOM 876 OE2 GLU A 436 30.483 12.396 13.355 1.00 86.12 O ATOM 877 H GLU A 436 30.637 16.598 12.264 1.00 0.00 H ATOM 878 N VAL A 437 33.595 17.072 13.554 1.00 43.84 N ATOM 879 CA VAL A 437 35.036 17.107 13.765 1.00 42.09 C ATOM 880 C VAL A 437 35.673 18.293 13.068 1.00 46.29 C ATOM 881 O VAL A 437 36.898 18.391 13.024 1.00 49.49 O ATOM 882 CB VAL A 437 35.727 15.789 13.337 1.00 48.18 C ATOM 883 CG1 VAL A 437 35.319 14.613 14.230 1.00 47.65 C ATOM 884 CG2 VAL A 437 35.484 15.455 11.861 1.00 46.78 C ATOM 885 H VAL A 437 33.227 16.948 12.589 1.00 0.00 H ATOM 886 N PHE A 438 34.857 19.205 12.538 1.00 54.53 N ATOM 887 CA PHE A 438 35.342 20.324 11.737 1.00 49.32 C ATOM 888 C PHE A 438 36.189 21.276 12.572 1.00 52.61 C ATOM 889 O PHE A 438 35.753 21.757 13.624 1.00 59.00 O ATOM 890 CB PHE A 438 34.169 21.073 11.118 1.00 41.36 C ATOM 891 CG PHE A 438 34.568 22.312 10.386 1.00 46.01 C ATOM 892 CD1 PHE A 438 35.085 22.236 9.092 1.00 48.42 C ATOM 893 CD2 PHE A 438 34.423 23.557 10.976 1.00 43.91 C ATOM 894 CE1 PHE A 438 35.449 23.377 8.392 1.00 43.63 C ATOM 895 CE2 PHE A 438 34.779 24.704 10.292 1.00 45.85 C ATOM 896 CZ PHE A 438 35.294 24.617 8.988 1.00 45.66 C ATOM 897 H PHE A 438 33.834 19.115 12.702 1.00 0.00 H ATOM 898 N ARG A 439 37.404 21.547 12.098 1.00 53.77 N ATOM 899 CA ARG A 439 38.287 22.517 12.723 1.00 52.79 C ATOM 900 C ARG A 439 38.050 23.858 12.049 1.00 54.04 C ATOM 901 O ARG A 439 38.183 23.974 10.825 1.00 53.54 O ATOM 902 CB ARG A 439 39.755 22.113 12.597 1.00 52.95 C ATOM 903 CG ARG A 439 40.192 20.935 13.412 1.00 57.00 C ATOM 904 CD ARG A 439 41.687 20.716 13.238 1.00 62.53 C ATOM 905 NE ARG A 439 42.492 21.608 14.071 1.00 64.05 N ATOM 906 CZ ARG A 439 43.231 22.605 13.604 1.00 57.68 C ATOM 907 NH1 ARG A 439 43.263 22.841 12.305 1.00 53.77 N ATOM 908 NH2 ARG A 439 43.932 23.366 14.435 1.00 57.55 N ATOM 909 HE ARG A 439 42.485 21.450 15.099 1.00 0.00 H ATOM 910 HH12 ARG A 439 43.841 23.621 11.932 1.00 0.00 H ATOM 911 HH11 ARG A 439 42.711 22.246 11.655 1.00 0.00 H ATOM 912 HH22 ARG A 439 44.510 24.147 14.063 1.00 0.00 H ATOM 913 HH21 ARG A 439 43.903 23.182 15.458 1.00 0.00 H ATOM 914 H ARG A 439 37.733 21.045 11.248 1.00 0.00 H ATOM 915 N VAL A 440 37.691 24.862 12.844 1.00 55.18 N ATOM 916 CA VAL A 440 37.388 26.173 12.287 1.00 48.37 C ATOM 917 C VAL A 440 38.555 26.699 11.461 1.00 52.60 C ATOM 918 O VAL A 440 38.355 27.342 10.417 1.00 49.66 O ATOM 919 CB VAL A 440 37.002 27.126 13.423 1.00 45.34 C ATOM 920 CG1 VAL A 440 37.142 28.511 12.978 1.00 46.79 C ATOM 921 CG2 VAL A 440 35.579 26.845 13.840 1.00 53.35 C ATOM 922 H VAL A 440 37.626 24.710 13.871 1.00 0.00 H ATOM 923 N GLU A 441 39.791 26.395 11.888 1.00 56.65 N ATOM 924 CA GLU A 441 40.969 26.894 11.184 1.00 49.95 C ATOM 925 C GLU A 441 41.043 26.388 9.752 1.00 51.49 C ATOM 926 O GLU A 441 41.656 27.048 8.911 1.00 47.98 O ATOM 927 CB GLU A 441 42.256 26.512 11.915 1.00 52.36 C ATOM 928 CG GLU A 441 42.461 27.215 13.243 1.00 59.16 C ATOM 929 CD GLU A 441 42.004 26.366 14.412 1.00 62.98 C ATOM 930 OE1 GLU A 441 40.914 25.772 14.315 1.00 55.77 O ATOM 931 OE2 GLU A 441 42.746 26.267 15.418 1.00 76.41 O ATOM 932 H GLU A 441 39.911 25.797 12.730 1.00 0.00 H ATOM 933 N GLU A 442 40.415 25.250 9.438 1.00 48.26 N ATOM 934 CA GLU A 442 40.446 24.778 8.062 1.00 38.44 C ATOM 935 C GLU A 442 39.907 25.820 7.092 1.00 41.18 C ATOM 936 O GLU A 442 40.229 25.768 5.906 1.00 46.18 O ATOM 937 CB GLU A 442 39.687 23.454 7.920 1.00 38.79 C ATOM 938 CG GLU A 442 39.652 22.942 6.464 1.00 44.35 C ATOM 939 CD GLU A 442 39.599 21.424 6.288 1.00 46.72 C ATOM 940 OE1 GLU A 442 39.373 20.678 7.273 1.00 49.12 O ATOM 941 OE2 GLU A 442 39.791 20.984 5.127 1.00 53.80 O ATOM 942 H GLU A 442 39.910 24.709 10.169 1.00 0.00 H ATOM 943 N LEU A 443 39.130 26.789 7.569 1.00 46.47 N ATOM 944 CA LEU A 443 38.662 27.888 6.734 1.00 45.41 C ATOM 945 C LEU A 443 39.074 29.261 7.238 1.00 50.74 C ATOM 946 O LEU A 443 39.254 30.167 6.422 1.00 53.06 O ATOM 947 CB LEU A 443 37.133 27.856 6.593 1.00 38.19 C ATOM 948 CG LEU A 443 36.605 26.577 5.981 1.00 32.09 C ATOM 949 CD1 LEU A 443 35.089 26.541 6.057 1.00 31.49 C ATOM 950 CD2 LEU A 443 37.120 26.503 4.557 1.00 39.08 C ATOM 951 H LEU A 443 38.848 26.761 8.570 1.00 0.00 H ATOM 952 N VAL A 444 39.216 29.455 8.551 1.00 48.82 N ATOM 953 CA VAL A 444 39.716 30.745 9.024 1.00 56.78 C ATOM 954 C VAL A 444 41.148 30.958 8.556 1.00 54.29 C ATOM 955 O VAL A 444 41.526 32.059 8.129 1.00 61.30 O ATOM 956 CB VAL A 444 39.595 30.848 10.555 1.00 54.98 C ATOM 957 CG1 VAL A 444 40.525 31.908 11.087 1.00 48.48 C ATOM 958 CG2 VAL A 444 38.177 31.180 10.935 1.00 50.03 C ATOM 959 H VAL A 444 38.975 28.701 9.226 1.00 0.00 H ATOM 960 N ALA A 445 41.957 29.898 8.598 1.00 52.42 N ATOM 961 CA ALA A 445 43.365 29.990 8.247 1.00 52.25 C ATOM 962 C ALA A 445 43.615 30.126 6.756 1.00 54.36 C ATOM 963 O ALA A 445 44.762 30.367 6.374 1.00 64.07 O ATOM 964 CB ALA A 445 44.116 28.772 8.756 1.00 45.66 C ATOM 965 H ALA A 445 41.569 28.978 8.891 1.00 0.00 H ATOM 966 N CYS A 446 42.602 29.985 5.904 1.00 48.58 N ATOM 967 CA CYS A 446 42.824 30.037 4.465 1.00 47.17 C ATOM 968 C CYS A 446 41.876 30.953 3.710 1.00 53.17 C ATOM 969 O CYS A 446 42.187 31.322 2.569 1.00 51.44 O ATOM 970 CB CYS A 446 42.737 28.629 3.855 1.00 56.34 C ATOM 971 SG CYS A 446 41.079 27.882 3.838 1.00 62.03 S ATOM 972 H CYS A 446 41.640 29.836 6.270 1.00 0.00 H ATOM 973 N ALA A 447 40.725 31.303 4.276 1.00 58.28 N ATOM 974 CA ALA A 447 39.884 32.312 3.658 1.00 54.87 C ATOM 975 C ALA A 447 40.608 33.645 3.713 1.00 54.37 C ATOM 976 O ALA A 447 41.198 33.999 4.735 1.00 60.56 O ATOM 977 CB ALA A 447 38.534 32.399 4.367 1.00 49.25 C ATOM 978 H ALA A 447 40.426 30.852 5.164 1.00 0.00 H ATOM 979 N GLY A 448 40.584 34.370 2.605 1.00 54.15 N ATOM 980 CA GLY A 448 41.296 35.612 2.482 1.00 57.48 C ATOM 981 C GLY A 448 42.651 35.475 1.824 1.00 59.42 C ATOM 982 O GLY A 448 43.181 36.469 1.324 1.00 65.58 O ATOM 983 H GLY A 448 40.030 34.028 1.794 1.00 0.00 H ATOM 984 N LEU A 449 43.214 34.267 1.797 1.00 54.80 N ATOM 985 CA LEU A 449 44.496 34.048 1.150 1.00 48.20 C ATOM 986 C LEU A 449 44.389 34.241 -0.357 1.00 49.94 C ATOM 987 O LEU A 449 43.317 34.130 -0.951 1.00 54.84 O ATOM 988 CB LEU A 449 45.018 32.648 1.446 1.00 47.19 C ATOM 989 CG LEU A 449 45.286 32.369 2.920 1.00 51.44 C ATOM 990 CD1 LEU A 449 45.937 31.006 3.136 1.00 39.18 C ATOM 991 CD2 LEU A 449 46.101 33.503 3.530 1.00 52.81 C ATOM 992 H LEU A 449 42.726 33.466 2.248 1.00 0.00 H ATOM 993 N SER A 450 45.526 34.558 -0.971 1.00 49.05 N ATOM 994 CA SER A 450 45.642 34.615 -2.428 1.00 52.55 C ATOM 995 C SER A 450 47.112 34.425 -2.772 1.00 49.21 C ATOM 996 O SER A 450 47.931 35.296 -2.474 1.00 48.51 O ATOM 997 CB SER A 450 45.121 35.929 -2.974 1.00 54.58 C ATOM 998 OG SER A 450 45.513 36.080 -4.319 1.00 55.49 O ATOM 999 HG SER A 450 46.501 36.071 -4.376 1.00 0.00 H ATOM 1000 H SER A 450 46.364 34.773 -0.393 1.00 0.00 H ATOM 1001 N SER A 451 47.439 33.302 -3.381 1.00 49.28 N ATOM 1002 CA SER A 451 48.830 32.972 -3.654 1.00 51.53 C ATOM 1003 C SER A 451 48.911 31.867 -4.689 1.00 50.31 C ATOM 1004 O SER A 451 48.209 30.851 -4.581 1.00 52.61 O ATOM 1005 CB SER A 451 49.565 32.522 -2.391 1.00 44.05 C ATOM 1006 OG SER A 451 50.744 31.814 -2.738 1.00 39.96 O ATOM 1007 HG SER A 451 51.211 31.528 -1.913 1.00 0.00 H ATOM 1008 H SER A 451 46.690 32.641 -3.671 1.00 0.00 H ATOM 1009 N PRO A 452 49.775 32.014 -5.686 1.00 46.00 N ATOM 1010 CA PRO A 452 49.854 30.988 -6.735 1.00 46.80 C ATOM 1011 C PRO A 452 50.267 29.643 -6.208 1.00 39.65 C ATOM 1012 O PRO A 452 49.959 28.631 -6.841 1.00 40.37 O ATOM 1013 CB PRO A 452 50.894 31.559 -7.709 1.00 52.56 C ATOM 1014 CG PRO A 452 50.922 33.044 -7.396 1.00 53.40 C ATOM 1015 CD PRO A 452 50.687 33.137 -5.925 1.00 42.36 C ATOM 1016 N ARG A 453 50.946 29.599 -5.068 1.00 43.00 N ATOM 1017 CA ARG A 453 51.415 28.354 -4.483 1.00 45.14 C ATOM 1018 C ARG A 453 50.392 27.701 -3.577 1.00 39.69 C ATOM 1019 O ARG A 453 50.704 26.670 -2.968 1.00 37.38 O ATOM 1020 CB ARG A 453 52.697 28.593 -3.698 1.00 45.41 C ATOM 1021 CG ARG A 453 53.782 29.189 -4.512 1.00 42.29 C ATOM 1022 CD ARG A 453 54.257 28.222 -5.543 1.00 43.42 C ATOM 1023 NE ARG A 453 54.648 28.952 -6.753 1.00 56.96 N ATOM 1024 CZ ARG A 453 53.962 28.937 -7.889 1.00 54.62 C ATOM 1025 NH1 ARG A 453 52.853 28.206 -7.988 1.00 46.24 N ATOM 1026 NH2 ARG A 453 54.403 29.637 -8.929 1.00 64.52 N ATOM 1027 HE ARG A 453 55.520 29.518 -6.719 1.00 0.00 H ATOM 1028 HH12 ARG A 453 52.316 28.194 -8.878 1.00 0.00 H ATOM 1029 HH11 ARG A 453 52.524 27.647 -7.175 1.00 0.00 H ATOM 1030 HH22 ARG A 453 53.872 29.631 -9.823 1.00 0.00 H ATOM 1031 HH21 ARG A 453 55.280 30.191 -8.849 1.00 0.00 H ATOM 1032 H ARG A 453 51.150 30.491 -4.574 1.00 0.00 H ATOM 1033 N ILE A 454 49.187 28.273 -3.479 1.00 38.79 N ATOM 1034 CA ILE A 454 48.140 27.793 -2.582 1.00 41.97 C ATOM 1035 C ILE A 454 46.844 27.642 -3.361 1.00 37.79 C ATOM 1036 O ILE A 454 46.424 28.576 -4.048 1.00 41.65 O ATOM 1037 CB ILE A 454 47.944 28.730 -1.376 1.00 37.34 C ATOM 1038 CG1 ILE A 454 49.141 28.596 -0.437 1.00 36.16 C ATOM 1039 CG2 ILE A 454 46.680 28.376 -0.645 1.00 32.95 C ATOM 1040 CD1 ILE A 454 49.109 29.497 0.735 1.00 42.32 C ATOM 1041 H ILE A 454 48.985 29.103 -4.073 1.00 0.00 H ATOM 1042 N VAL A 455 46.206 26.478 -3.235 1.00 37.45 N ATOM 1043 CA VAL A 455 44.996 26.164 -4.015 1.00 37.69 C ATOM 1044 C VAL A 455 43.884 27.152 -3.682 1.00 38.44 C ATOM 1045 O VAL A 455 43.601 27.401 -2.488 1.00 43.57 O ATOM 1046 CB VAL A 455 44.544 24.723 -3.748 1.00 37.18 C ATOM 1047 CG1 VAL A 455 43.364 24.360 -4.612 1.00 38.44 C ATOM 1048 CG2 VAL A 455 45.684 23.779 -3.997 1.00 35.46 C ATOM 1049 H VAL A 455 46.573 25.771 -2.567 1.00 0.00 H ATOM 1050 N PRO A 456 43.219 27.731 -4.678 1.00 39.46 N ATOM 1051 CA PRO A 456 42.177 28.724 -4.389 1.00 31.21 C ATOM 1052 C PRO A 456 40.962 28.079 -3.745 1.00 36.70 C ATOM 1053 O PRO A 456 40.588 26.951 -4.077 1.00 37.41 O ATOM 1054 CB PRO A 456 41.833 29.299 -5.764 1.00 35.75 C ATOM 1055 CG PRO A 456 42.927 28.841 -6.690 1.00 41.01 C ATOM 1056 CD PRO A 456 43.432 27.545 -6.119 1.00 42.10 C ATOM 1057 N LEU A 457 40.350 28.812 -2.809 1.00 38.62 N ATOM 1058 CA LEU A 457 39.139 28.391 -2.114 1.00 32.26 C ATOM 1059 C LEU A 457 37.915 29.009 -2.784 1.00 28.86 C ATOM 1060 O LEU A 457 37.873 30.216 -3.017 1.00 28.24 O ATOM 1061 CB LEU A 457 39.214 28.798 -0.647 1.00 27.99 C ATOM 1062 CG LEU A 457 37.951 28.600 0.165 1.00 29.29 C ATOM 1063 CD1 LEU A 457 37.710 27.115 0.298 1.00 29.84 C ATOM 1064 CD2 LEU A 457 37.979 29.307 1.541 1.00 35.50 C ATOM 1065 H LEU A 457 40.761 29.735 -2.563 1.00 0.00 H ATOM 1066 N TYR A 458 36.918 28.189 -3.081 1.00 29.69 N ATOM 1067 CA TYR A 458 35.747 28.661 -3.807 1.00 30.80 C ATOM 1068 C TYR A 458 34.525 28.867 -2.923 1.00 32.92 C ATOM 1069 O TYR A 458 33.573 29.533 -3.344 1.00 32.11 O ATOM 1070 CB TYR A 458 35.404 27.673 -4.930 1.00 39.73 C ATOM 1071 CG TYR A 458 36.310 27.781 -6.129 1.00 36.55 C ATOM 1072 CD1 TYR A 458 37.286 28.770 -6.199 1.00 31.78 C ATOM 1073 CD2 TYR A 458 36.178 26.906 -7.208 1.00 45.98 C ATOM 1074 CE1 TYR A 458 38.105 28.872 -7.300 1.00 42.87 C ATOM 1075 CE2 TYR A 458 37.005 27.006 -8.335 1.00 41.43 C ATOM 1076 CZ TYR A 458 37.959 27.983 -8.364 1.00 42.34 C ATOM 1077 OH TYR A 458 38.782 28.086 -9.444 1.00 52.76 O ATOM 1078 HH TYR A 458 39.411 28.839 -9.308 1.00 0.00 H ATOM 1079 H TYR A 458 36.972 27.192 -2.791 1.00 0.00 H ATOM 1080 N GLY A 459 34.538 28.316 -1.728 1.00 32.22 N ATOM 1081 CA GLY A 459 33.489 28.524 -0.756 1.00 30.74 C ATOM 1082 C GLY A 459 33.416 27.330 0.177 1.00 39.02 C ATOM 1083 O GLY A 459 34.240 26.413 0.124 1.00 36.18 O ATOM 1084 H GLY A 459 35.339 27.704 -1.472 1.00 0.00 H ATOM 1085 N ALA A 460 32.414 27.375 1.057 1.00 37.36 N ATOM 1086 CA ALA A 460 32.068 26.250 1.917 1.00 33.67 C ATOM 1087 C ALA A 460 30.585 26.350 2.241 1.00 37.31 C ATOM 1088 O ALA A 460 30.067 27.431 2.533 1.00 39.24 O ATOM 1089 CB ALA A 460 32.909 26.218 3.202 1.00 28.71 C ATOM 1090 H ALA A 460 31.856 28.250 1.133 1.00 0.00 H ATOM 1091 N VAL A 461 29.898 25.229 2.166 1.00 34.76 N ATOM 1092 CA VAL A 461 28.486 25.165 2.480 1.00 34.53 C ATOM 1093 C VAL A 461 28.285 24.024 3.460 1.00 31.86 C ATOM 1094 O VAL A 461 28.737 22.905 3.209 1.00 36.79 O ATOM 1095 CB VAL A 461 27.634 24.961 1.214 1.00 31.93 C ATOM 1096 CG1 VAL A 461 26.201 24.664 1.591 1.00 40.03 C ATOM 1097 CG2 VAL A 461 27.696 26.162 0.335 1.00 32.43 C ATOM 1098 H VAL A 461 30.387 24.360 1.871 1.00 0.00 H ATOM 1099 N ARG A 462 27.632 24.310 4.577 1.00 36.44 N ATOM 1100 CA ARG A 462 27.177 23.271 5.490 1.00 38.18 C ATOM 1101 C ARG A 462 25.834 22.724 5.032 1.00 37.24 C ATOM 1102 O ARG A 462 24.974 23.466 4.561 1.00 41.90 O ATOM 1103 CB ARG A 462 27.061 23.826 6.908 1.00 38.35 C ATOM 1104 CG ARG A 462 26.372 22.895 7.877 1.00 48.62 C ATOM 1105 CD ARG A 462 26.842 23.175 9.283 1.00 47.91 C ATOM 1106 NE ARG A 462 26.030 24.172 9.978 1.00 50.96 N ATOM 1107 CZ ARG A 462 24.929 23.874 10.653 1.00 54.37 C ATOM 1108 NH1 ARG A 462 24.512 22.614 10.695 1.00 55.49 N ATOM 1109 NH2 ARG A 462 24.248 24.826 11.270 1.00 52.99 N ATOM 1110 HE ARG A 462 26.332 25.167 9.941 1.00 0.00 H ATOM 1111 HH12 ARG A 462 23.649 22.369 11.222 1.00 0.00 H ATOM 1112 HH11 ARG A 462 25.048 21.872 10.201 1.00 0.00 H ATOM 1113 HH22 ARG A 462 23.385 24.588 11.799 1.00 0.00 H ATOM 1114 HH21 ARG A 462 24.576 25.812 11.226 1.00 0.00 H ATOM 1115 H ARG A 462 27.439 25.305 4.808 1.00 0.00 H ATOM 1116 N GLU A 463 25.672 21.414 5.129 1.00 38.55 N ATOM 1117 CA GLU A 463 24.407 20.776 4.769 1.00 44.92 C ATOM 1118 C GLU A 463 24.257 19.585 5.710 1.00 51.64 C ATOM 1119 O GLU A 463 24.779 18.499 5.447 1.00 50.71 O ATOM 1120 CB GLU A 463 24.339 20.351 3.310 1.00 41.14 C ATOM 1121 CG GLU A 463 23.025 19.662 2.954 1.00 42.64 C ATOM 1122 CD GLU A 463 22.772 19.524 1.447 1.00 50.61 C ATOM 1123 OE1 GLU A 463 21.647 19.120 1.078 1.00 53.27 O ATOM 1124 OE2 GLU A 463 23.678 19.812 0.632 1.00 50.22 O ATOM 1125 H GLU A 463 26.461 20.827 5.468 1.00 0.00 H ATOM 1126 N GLY A 464 23.549 19.813 6.811 1.00 57.61 N ATOM 1127 CA GLY A 464 23.359 18.795 7.806 1.00 51.27 C ATOM 1128 C GLY A 464 24.666 18.488 8.479 1.00 49.86 C ATOM 1129 O GLY A 464 25.334 19.381 9.001 1.00 57.29 O ATOM 1130 H GLY A 464 23.123 20.750 6.956 1.00 0.00 H ATOM 1131 N PRO A 465 25.073 17.216 8.453 1.00 53.26 N ATOM 1132 CA PRO A 465 26.294 16.799 9.155 1.00 56.31 C ATOM 1133 C PRO A 465 27.577 17.000 8.346 1.00 55.23 C ATOM 1134 O PRO A 465 28.667 16.684 8.849 1.00 46.93 O ATOM 1135 CB PRO A 465 26.018 15.306 9.407 1.00 45.35 C ATOM 1136 CG PRO A 465 25.288 14.882 8.141 1.00 41.17 C ATOM 1137 CD PRO A 465 24.465 16.093 7.708 1.00 52.17 C ATOM 1138 N TRP A 466 27.466 17.538 7.128 1.00 53.40 N ATOM 1139 CA TRP A 466 28.587 17.756 6.220 1.00 46.68 C ATOM 1140 C TRP A 466 28.971 19.228 6.125 1.00 42.78 C ATOM 1141 O TRP A 466 28.132 20.073 5.815 1.00 40.58 O ATOM 1142 CB TRP A 466 28.248 17.260 4.814 1.00 45.99 C ATOM 1143 CG TRP A 466 28.212 15.809 4.705 1.00 46.78 C ATOM 1144 CD1 TRP A 466 27.167 15.046 4.299 1.00 53.01 C ATOM 1145 CD2 TRP A 466 29.273 14.912 5.014 1.00 49.71 C ATOM 1146 NE1 TRP A 466 27.510 13.720 4.326 1.00 50.78 N ATOM 1147 CE2 TRP A 466 28.801 13.610 4.766 1.00 49.92 C ATOM 1148 CE3 TRP A 466 30.584 15.080 5.474 1.00 45.39 C ATOM 1149 CZ2 TRP A 466 29.588 12.485 4.971 1.00 42.03 C ATOM 1150 CZ3 TRP A 466 31.357 13.962 5.682 1.00 45.22 C ATOM 1151 CH2 TRP A 466 30.861 12.682 5.425 1.00 42.19 C ATOM 1152 HE1 TRP A 466 26.892 12.928 4.057 1.00 0.00 H ATOM 1153 H TRP A 466 26.518 17.820 6.806 1.00 0.00 H ATOM 1154 N VAL A 467 30.246 19.526 6.350 1.00 42.87 N ATOM 1155 CA VAL A 467 30.845 20.759 5.852 1.00 36.14 C ATOM 1156 C VAL A 467 31.478 20.426 4.504 1.00 39.95 C ATOM 1157 O VAL A 467 32.431 19.647 4.444 1.00 39.23 O ATOM 1158 CB VAL A 467 31.882 21.327 6.827 1.00 40.59 C ATOM 1159 CG1 VAL A 467 32.597 22.485 6.190 1.00 43.10 C ATOM 1160 CG2 VAL A 467 31.235 21.764 8.111 1.00 37.45 C ATOM 1161 H VAL A 467 30.832 18.863 6.896 1.00 0.00 H ATOM 1162 N ASN A 468 30.915 20.976 3.423 1.00 35.76 N ATOM 1163 CA ASN A 468 31.434 20.801 2.075 1.00 34.88 C ATOM 1164 C ASN A 468 32.324 21.980 1.743 1.00 38.42 C ATOM 1165 O ASN A 468 31.847 23.114 1.727 1.00 41.06 O ATOM 1166 CB ASN A 468 30.312 20.746 1.046 1.00 39.73 C ATOM 1167 CG ASN A 468 29.436 19.548 1.204 1.00 40.62 C ATOM 1168 OD1 ASN A 468 29.679 18.504 0.619 1.00 41.92 O ATOM 1169 ND2 ASN A 468 28.388 19.696 1.983 1.00 46.15 N ATOM 1170 HD22 ASN A 468 28.220 20.604 2.462 1.00 0.00 H ATOM 1171 HD21 ASN A 468 27.727 18.905 2.121 1.00 0.00 H ATOM 1172 H ASN A 468 30.063 21.558 3.552 1.00 0.00 H ATOM 1173 N ILE A 469 33.589 21.720 1.422 1.00 37.46 N ATOM 1174 CA ILE A 469 34.551 22.772 1.102 1.00 32.91 C ATOM 1175 C ILE A 469 34.922 22.679 -0.379 1.00 34.16 C ATOM 1176 O ILE A 469 35.391 21.641 -0.845 1.00 35.13 O ATOM 1177 CB ILE A 469 35.786 22.674 2.004 1.00 31.39 C ATOM 1178 CG1 ILE A 469 35.378 22.695 3.475 1.00 41.00 C ATOM 1179 CG2 ILE A 469 36.661 23.812 1.768 1.00 35.94 C ATOM 1180 CD1 ILE A 469 36.565 22.664 4.446 1.00 37.80 C ATOM 1181 H ILE A 469 33.905 20.729 1.398 1.00 0.00 H ATOM 1182 N PHE A 470 34.718 23.763 -1.110 1.00 33.65 N ATOM 1183 CA PHE A 470 34.871 23.800 -2.555 1.00 31.68 C ATOM 1184 C PHE A 470 36.171 24.502 -2.924 1.00 38.36 C ATOM 1185 O PHE A 470 36.556 25.488 -2.290 1.00 35.26 O ATOM 1186 CB PHE A 470 33.698 24.538 -3.207 1.00 33.95 C ATOM 1187 CG PHE A 470 32.362 23.897 -2.968 1.00 33.56 C ATOM 1188 CD1 PHE A 470 31.991 22.758 -3.665 1.00 35.97 C ATOM 1189 CD2 PHE A 470 31.475 24.434 -2.053 1.00 32.28 C ATOM 1190 CE1 PHE A 470 30.767 22.161 -3.450 1.00 34.28 C ATOM 1191 CE2 PHE A 470 30.254 23.845 -1.828 1.00 35.49 C ATOM 1192 CZ PHE A 470 29.895 22.708 -2.531 1.00 39.91 C ATOM 1193 H PHE A 470 34.432 24.637 -0.624 1.00 0.00 H ATOM 1194 N MET A 471 36.840 24.011 -3.966 1.00 39.34 N ATOM 1195 CA MET A 471 38.064 24.667 -4.410 1.00 41.63 C ATOM 1196 C MET A 471 38.269 24.443 -5.898 1.00 42.62 C ATOM 1197 O MET A 471 37.545 23.677 -6.537 1.00 39.96 O ATOM 1198 CB MET A 471 39.290 24.174 -3.641 1.00 38.65 C ATOM 1199 CG MET A 471 39.748 22.808 -4.048 1.00 40.87 C ATOM 1200 SD MET A 471 40.131 21.820 -2.614 1.00 44.04 S ATOM 1201 CE MET A 471 38.504 21.568 -1.961 1.00 44.99 C ATOM 1202 H MET A 471 36.491 23.165 -4.460 1.00 0.00 H ATOM 1203 N GLU A 472 39.275 25.132 -6.440 1.00 40.54 N ATOM 1204 CA GLU A 472 39.695 24.874 -7.810 1.00 47.39 C ATOM 1205 C GLU A 472 40.101 23.418 -7.988 1.00 53.35 C ATOM 1206 O GLU A 472 40.712 22.808 -7.103 1.00 51.40 O ATOM 1207 CB GLU A 472 40.873 25.754 -8.214 1.00 49.15 C ATOM 1208 CG GLU A 472 41.191 25.567 -9.695 1.00 48.89 C ATOM 1209 CD GLU A 472 42.482 26.210 -10.172 1.00 56.47 C ATOM 1210 OE1 GLU A 472 43.165 25.577 -11.010 1.00 68.21 O ATOM 1211 OE2 GLU A 472 42.809 27.338 -9.742 1.00 64.34 O ATOM 1212 H GLU A 472 39.763 25.859 -5.879 1.00 0.00 H ATOM 1213 N LEU A 473 39.757 22.865 -9.148 1.00 56.16 N ATOM 1214 CA LEU A 473 40.160 21.522 -9.537 1.00 50.20 C ATOM 1215 C LEU A 473 41.429 21.650 -10.362 1.00 58.87 C ATOM 1216 O LEU A 473 41.411 22.259 -11.440 1.00 63.81 O ATOM 1217 CB LEU A 473 39.056 20.853 -10.342 1.00 51.16 C ATOM 1218 CG LEU A 473 39.369 19.474 -10.899 1.00 58.66 C ATOM 1219 CD1 LEU A 473 39.162 18.429 -9.818 1.00 49.92 C ATOM 1220 CD2 LEU A 473 38.488 19.216 -12.099 1.00 57.85 C ATOM 1221 H LEU A 473 39.173 23.418 -9.807 1.00 0.00 H ATOM 1222 N LEU A 474 42.533 21.112 -9.848 1.00 55.73 N ATOM 1223 CA LEU A 474 43.799 21.093 -10.567 1.00 54.29 C ATOM 1224 C LEU A 474 43.967 19.727 -11.206 1.00 52.49 C ATOM 1225 O LEU A 474 43.982 18.710 -10.501 1.00 47.44 O ATOM 1226 CB LEU A 474 44.955 21.408 -9.633 1.00 48.19 C ATOM 1227 CG LEU A 474 44.948 22.888 -9.334 1.00 46.64 C ATOM 1228 CD1 LEU A 474 45.356 23.093 -7.919 1.00 51.44 C ATOM 1229 CD2 LEU A 474 45.913 23.572 -10.258 1.00 53.23 C ATOM 1230 H LEU A 474 42.490 20.690 -8.898 1.00 0.00 H ATOM 1231 N GLU A 475 44.116 19.716 -12.535 1.00 53.79 N ATOM 1232 CA GLU A 475 43.940 18.497 -13.332 1.00 59.44 C ATOM 1233 C GLU A 475 45.129 17.524 -13.284 1.00 51.48 C ATOM 1234 O GLU A 475 44.942 16.326 -13.518 1.00 48.03 O ATOM 1235 CB GLU A 475 43.643 18.887 -14.778 1.00 72.49 C ATOM 1236 CG GLU A 475 42.391 19.737 -14.943 1.00 71.54 C ATOM 1237 CD GLU A 475 41.121 18.896 -14.905 1.00 77.81 C ATOM 1238 OE1 GLU A 475 41.202 17.691 -14.569 1.00 70.60 O ATOM 1239 OE2 GLU A 475 40.040 19.440 -15.221 1.00 83.61 O ATOM 1240 H GLU A 475 44.365 20.602 -13.020 1.00 0.00 H ATOM 1241 N GLY A 476 46.335 17.997 -12.973 1.00 44.87 N ATOM 1242 CA GLY A 476 47.474 17.118 -12.772 1.00 44.84 C ATOM 1243 C GLY A 476 47.433 16.218 -11.542 1.00 45.31 C ATOM 1244 O GLY A 476 48.349 15.412 -11.365 1.00 44.70 O ATOM 1245 H GLY A 476 46.465 19.024 -12.871 1.00 0.00 H ATOM 1246 N GLY A 477 46.429 16.308 -10.691 1.00 43.83 N ATOM 1247 CA GLY A 477 46.454 15.438 -9.534 1.00 47.17 C ATOM 1248 C GLY A 477 47.475 15.865 -8.483 1.00 44.35 C ATOM 1249 O GLY A 477 48.137 16.904 -8.576 1.00 42.94 O ATOM 1250 H GLY A 477 45.649 16.978 -10.845 1.00 0.00 H ATOM 1251 N SER A 478 47.595 15.027 -7.461 1.00 42.80 N ATOM 1252 CA SER A 478 48.492 15.316 -6.351 1.00 43.80 C ATOM 1253 C SER A 478 49.891 14.792 -6.631 1.00 43.86 C ATOM 1254 O SER A 478 50.071 13.748 -7.265 1.00 44.81 O ATOM 1255 CB SER A 478 47.975 14.717 -5.034 1.00 38.30 C ATOM 1256 OG SER A 478 47.860 13.306 -5.086 1.00 37.95 O ATOM 1257 HG SER A 478 48.748 12.910 -5.273 1.00 0.00 H ATOM 1258 H SER A 478 47.039 14.148 -7.453 1.00 0.00 H ATOM 1259 N LEU A 479 50.882 15.548 -6.151 1.00 40.28 N ATOM 1260 CA LEU A 479 52.252 15.060 -6.087 1.00 41.06 C ATOM 1261 C LEU A 479 52.328 13.672 -5.456 1.00 39.68 C ATOM 1262 O LEU A 479 53.176 12.863 -5.834 1.00 47.59 O ATOM 1263 CB LEU A 479 53.114 16.065 -5.313 1.00 40.51 C ATOM 1264 CG LEU A 479 54.620 15.847 -5.125 1.00 37.10 C ATOM 1265 CD1 LEU A 479 55.342 15.754 -6.487 1.00 48.86 C ATOM 1266 CD2 LEU A 479 55.146 16.999 -4.363 1.00 30.45 C ATOM 1267 H LEU A 479 50.670 16.509 -5.815 1.00 0.00 H ATOM 1268 N GLY A 480 51.451 13.366 -4.508 1.00 41.47 N ATOM 1269 CA GLY A 480 51.433 12.021 -3.964 1.00 46.84 C ATOM 1270 C GLY A 480 51.149 10.974 -5.021 1.00 42.79 C ATOM 1271 O GLY A 480 51.746 9.894 -5.015 1.00 43.77 O ATOM 1272 H GLY A 480 50.784 14.083 -4.159 1.00 0.00 H ATOM 1273 N GLN A 481 50.229 11.280 -5.936 1.00 46.71 N ATOM 1274 CA GLN A 481 49.952 10.376 -7.045 1.00 50.14 C ATOM 1275 C GLN A 481 51.116 10.353 -8.020 1.00 48.52 C ATOM 1276 O GLN A 481 51.571 9.278 -8.416 1.00 52.95 O ATOM 1277 CB GLN A 481 48.653 10.776 -7.746 1.00 46.84 C ATOM 1278 CG GLN A 481 47.382 10.515 -6.911 1.00 58.86 C ATOM 1279 CD GLN A 481 46.090 11.215 -7.444 1.00 65.35 C ATOM 1280 OE1 GLN A 481 46.140 12.197 -8.206 1.00 55.76 O ATOM 1281 NE2 GLN A 481 44.928 10.694 -7.027 1.00 71.31 N ATOM 1282 HE22 GLN A 481 44.926 9.872 -6.390 1.00 0.00 H ATOM 1283 HE21 GLN A 481 44.029 11.111 -7.341 1.00 0.00 H ATOM 1284 H GLN A 481 49.703 12.174 -5.858 1.00 0.00 H ATOM 1285 N LEU A 482 51.626 11.531 -8.397 1.00 49.91 N ATOM 1286 CA LEU A 482 52.776 11.622 -9.297 1.00 46.76 C ATOM 1287 C LEU A 482 53.890 10.681 -8.878 1.00 52.59 C ATOM 1288 O LEU A 482 54.429 9.932 -9.703 1.00 53.80 O ATOM 1289 CB LEU A 482 53.314 13.048 -9.336 1.00 49.48 C ATOM 1290 CG LEU A 482 54.339 13.184 -10.466 1.00 52.93 C ATOM 1291 CD1 LEU A 482 53.630 12.883 -11.750 1.00 55.41 C ATOM 1292 CD2 LEU A 482 54.981 14.553 -10.543 1.00 38.95 C ATOM 1293 H LEU A 482 51.193 12.407 -8.040 1.00 0.00 H ATOM 1294 N ILE A 483 54.237 10.704 -7.589 1.00 44.26 N ATOM 1295 CA ILE A 483 55.282 9.831 -7.064 1.00 41.82 C ATOM 1296 C ILE A 483 54.913 8.364 -7.264 1.00 47.18 C ATOM 1297 O ILE A 483 55.736 7.563 -7.711 1.00 58.33 O ATOM 1298 CB ILE A 483 55.552 10.157 -5.584 1.00 45.83 C ATOM 1299 CG1 ILE A 483 56.090 11.575 -5.428 1.00 42.71 C ATOM 1300 CG2 ILE A 483 56.523 9.171 -4.954 1.00 44.76 C ATOM 1301 CD1 ILE A 483 56.185 11.967 -3.975 1.00 40.38 C ATOM 1302 H ILE A 483 53.751 11.359 -6.944 1.00 0.00 H ATOM 1303 N LYS A 484 53.674 7.985 -6.940 1.00 51.71 N ATOM 1304 CA LYS A 484 53.264 6.585 -7.104 1.00 56.90 C ATOM 1305 C LYS A 484 53.309 6.176 -8.565 1.00 59.97 C ATOM 1306 O LYS A 484 53.772 5.082 -8.907 1.00 63.59 O ATOM 1307 CB LYS A 484 51.847 6.369 -6.569 1.00 50.69 C ATOM 1308 CG LYS A 484 51.698 5.354 -5.464 1.00 51.29 C ATOM 1309 CD LYS A 484 50.482 5.759 -4.624 1.00 61.34 C ATOM 1310 CE LYS A 484 50.343 4.964 -3.336 1.00 73.96 C ATOM 1311 NZ LYS A 484 49.540 5.716 -2.324 1.00 79.01 N ATOM 1312 HZ1 LYS A 484 50.011 6.618 -2.110 1.00 0.00 H ATOM 1313 HZ2 LYS A 484 48.590 5.902 -2.705 1.00 0.00 H ATOM 1314 HZ3 LYS A 484 49.461 5.150 -1.455 1.00 0.00 H ATOM 1315 H LYS A 484 52.998 8.684 -6.571 1.00 0.00 H ATOM 1316 N GLN A 485 52.803 7.042 -9.434 1.00 57.51 N ATOM 1317 CA GLN A 485 52.840 6.785 -10.861 1.00 58.49 C ATOM 1318 C GLN A 485 54.270 6.554 -11.322 1.00 61.24 C ATOM 1319 O GLN A 485 54.587 5.513 -11.905 1.00 67.38 O ATOM 1320 CB GLN A 485 52.197 7.964 -11.596 1.00 61.57 C ATOM 1321 CG GLN A 485 51.872 7.749 -13.050 1.00 57.77 C ATOM 1322 CD GLN A 485 51.098 8.919 -13.626 1.00 71.64 C ATOM 1323 OE1 GLN A 485 50.550 9.739 -12.886 1.00 76.95 O ATOM 1324 NE2 GLN A 485 51.049 9.005 -14.953 1.00 77.46 N ATOM 1325 HE22 GLN A 485 51.526 8.290 -15.538 1.00 0.00 H ATOM 1326 HE21 GLN A 485 50.533 9.787 -15.405 1.00 0.00 H ATOM 1327 H GLN A 485 52.372 7.922 -9.085 1.00 0.00 H ATOM 1328 N MET A 486 55.162 7.491 -11.028 1.00 55.51 N ATOM 1329 CA MET A 486 56.481 7.464 -11.639 1.00 56.40 C ATOM 1330 C MET A 486 57.544 6.752 -10.793 1.00 59.50 C ATOM 1331 O MET A 486 58.690 6.612 -11.244 1.00 58.60 O ATOM 1332 CB MET A 486 56.901 8.893 -11.963 1.00 49.63 C ATOM 1333 CG MET A 486 55.828 9.660 -12.668 1.00 52.38 C ATOM 1334 SD MET A 486 56.005 9.554 -14.441 1.00 79.90 S ATOM 1335 CE MET A 486 57.628 10.291 -14.621 1.00 77.50 C ATOM 1336 H MET A 486 54.917 8.248 -10.358 1.00 0.00 H ATOM 1337 N GLY A 487 57.192 6.275 -9.599 1.00 56.37 N ATOM 1338 CA GLY A 487 58.130 5.555 -8.763 1.00 49.11 C ATOM 1339 C GLY A 487 58.853 6.479 -7.819 1.00 49.87 C ATOM 1340 O GLY A 487 58.719 6.359 -6.593 1.00 59.16 O ATOM 1341 H GLY A 487 56.220 6.424 -9.260 1.00 0.00 H ATOM 1342 N CYS A 488 59.643 7.388 -8.385 1.00 45.58 N ATOM 1343 CA CYS A 488 60.231 8.491 -7.636 1.00 44.49 C ATOM 1344 C CYS A 488 60.576 9.582 -8.632 1.00 42.60 C ATOM 1345 O CYS A 488 60.399 9.414 -9.839 1.00 51.83 O ATOM 1346 CB CYS A 488 61.443 8.047 -6.819 1.00 49.87 C ATOM 1347 SG CYS A 488 62.716 7.221 -7.761 1.00 65.20 S ATOM 1348 H CYS A 488 59.849 7.308 -9.401 1.00 0.00 H ATOM 1349 N LEU A 489 61.046 10.722 -8.123 1.00 39.43 N ATOM 1350 CA LEU A 489 61.216 11.757 -9.121 1.00 37.75 C ATOM 1351 C LEU A 489 62.688 12.053 -9.381 1.00 39.84 C ATOM 1352 O LEU A 489 63.515 11.998 -8.469 1.00 40.05 O ATOM 1353 CB LEU A 489 60.517 13.064 -8.722 1.00 38.88 C ATOM 1354 CG LEU A 489 59.045 13.089 -8.270 1.00 41.24 C ATOM 1355 CD1 LEU A 489 58.566 14.556 -8.160 1.00 32.51 C ATOM 1356 CD2 LEU A 489 58.109 12.223 -9.133 1.00 30.14 C ATOM 1357 H LEU A 489 61.267 10.853 -7.115 1.00 0.00 H ATOM 1358 N PRO A 490 63.033 12.324 -10.615 1.00 45.91 N ATOM 1359 CA PRO A 490 64.297 13.003 -10.909 1.00 38.78 C ATOM 1360 C PRO A 490 64.622 14.122 -9.928 1.00 42.90 C ATOM 1361 O PRO A 490 63.729 14.825 -9.449 1.00 44.27 O ATOM 1362 CB PRO A 490 64.061 13.556 -12.326 1.00 43.91 C ATOM 1363 CG PRO A 490 62.554 13.319 -12.611 1.00 47.81 C ATOM 1364 CD PRO A 490 62.242 12.091 -11.831 1.00 43.15 C ATOM 1365 N GLU A 491 65.913 14.309 -9.645 1.00 50.35 N ATOM 1366 CA GLU A 491 66.323 15.271 -8.629 1.00 39.44 C ATOM 1367 C GLU A 491 65.907 16.683 -9.002 1.00 46.24 C ATOM 1368 O GLU A 491 65.493 17.457 -8.132 1.00 50.86 O ATOM 1369 CB GLU A 491 67.830 15.193 -8.419 1.00 43.87 C ATOM 1370 CG GLU A 491 68.371 16.103 -7.338 1.00 52.40 C ATOM 1371 CD GLU A 491 69.898 16.088 -7.273 1.00 60.86 C ATOM 1372 OE1 GLU A 491 70.456 16.807 -6.397 1.00 51.88 O ATOM 1373 OE2 GLU A 491 70.522 15.369 -8.105 1.00 56.89 O ATOM 1374 H GLU A 491 66.635 13.762 -10.155 1.00 0.00 H ATOM 1375 N ASP A 492 66.002 17.041 -10.288 1.00 48.08 N ATOM 1376 CA ASP A 492 65.667 18.408 -10.686 1.00 44.39 C ATOM 1377 C ASP A 492 64.181 18.676 -10.486 1.00 49.05 C ATOM 1378 O ASP A 492 63.799 19.742 -9.987 1.00 42.77 O ATOM 1379 CB ASP A 492 66.073 18.664 -12.139 1.00 36.64 C ATOM 1380 CG ASP A 492 65.326 17.769 -13.132 1.00 47.96 C ATOM 1381 OD1 ASP A 492 65.061 16.595 -12.802 1.00 49.25 O ATOM 1382 OD2 ASP A 492 64.994 18.228 -14.247 1.00 48.27 O ATOM 1383 H ASP A 492 66.313 16.350 -11.001 1.00 0.00 H ATOM 1384 N ARG A 493 63.332 17.711 -10.853 1.00 44.14 N ATOM 1385 CA ARG A 493 61.901 17.859 -10.645 1.00 44.25 C ATOM 1386 C ARG A 493 61.579 17.951 -9.152 1.00 43.75 C ATOM 1387 O ARG A 493 60.829 18.835 -8.715 1.00 40.54 O ATOM 1388 CB ARG A 493 61.175 16.688 -11.306 1.00 47.83 C ATOM 1389 CG ARG A 493 59.707 16.936 -11.624 1.00 50.64 C ATOM 1390 CD ARG A 493 59.473 16.973 -13.127 1.00 51.50 C ATOM 1391 NE ARG A 493 58.619 18.104 -13.451 1.00 60.33 N ATOM 1392 CZ ARG A 493 58.498 18.647 -14.656 1.00 68.09 C ATOM 1393 NH1 ARG A 493 59.183 18.145 -15.680 1.00 66.06 N ATOM 1394 NH2 ARG A 493 57.684 19.690 -14.837 1.00 62.58 N ATOM 1395 HE ARG A 493 58.060 18.520 -12.679 1.00 0.00 H ATOM 1396 HH12 ARG A 493 59.090 18.568 -16.625 1.00 0.00 H ATOM 1397 HH11 ARG A 493 59.811 17.329 -15.535 1.00 0.00 H ATOM 1398 HH22 ARG A 493 57.588 20.117 -15.780 1.00 0.00 H ATOM 1399 HH21 ARG A 493 57.146 20.075 -14.035 1.00 0.00 H ATOM 1400 H ARG A 493 63.700 16.843 -11.293 1.00 0.00 H ATOM 1401 N ALA A 494 62.167 17.062 -8.349 1.00 35.85 N ATOM 1402 CA ALA A 494 61.914 17.090 -6.916 1.00 41.39 C ATOM 1403 C ALA A 494 62.289 18.435 -6.308 1.00 42.51 C ATOM 1404 O ALA A 494 61.547 18.977 -5.487 1.00 46.09 O ATOM 1405 CB ALA A 494 62.670 15.959 -6.220 1.00 43.41 C ATOM 1406 H ALA A 494 62.808 16.347 -8.748 1.00 0.00 H ATOM 1407 N LEU A 495 63.448 18.978 -6.671 1.00 40.98 N ATOM 1408 CA LEU A 495 63.812 20.297 -6.169 1.00 43.04 C ATOM 1409 C LEU A 495 62.818 21.343 -6.647 1.00 45.75 C ATOM 1410 O LEU A 495 62.377 22.211 -5.879 1.00 42.72 O ATOM 1411 CB LEU A 495 65.224 20.662 -6.634 1.00 46.19 C ATOM 1412 CG LEU A 495 66.435 20.123 -5.872 1.00 45.10 C ATOM 1413 CD1 LEU A 495 67.659 20.212 -6.737 1.00 45.70 C ATOM 1414 CD2 LEU A 495 66.636 20.947 -4.669 1.00 38.00 C ATOM 1415 H LEU A 495 64.090 18.465 -7.309 1.00 0.00 H ATOM 1416 N TYR A 496 62.456 21.264 -7.922 1.00 41.85 N ATOM 1417 CA TYR A 496 61.566 22.239 -8.518 1.00 37.15 C ATOM 1418 C TYR A 496 60.253 22.320 -7.761 1.00 36.61 C ATOM 1419 O TYR A 496 59.759 23.418 -7.481 1.00 34.87 O ATOM 1420 CB TYR A 496 61.328 21.871 -9.976 1.00 38.30 C ATOM 1421 CG TYR A 496 60.310 22.730 -10.667 1.00 37.70 C ATOM 1422 CD1 TYR A 496 60.616 24.022 -11.037 1.00 37.63 C ATOM 1423 CD2 TYR A 496 59.039 22.250 -10.951 1.00 33.69 C ATOM 1424 CE1 TYR A 496 59.692 24.817 -11.671 1.00 43.23 C ATOM 1425 CE2 TYR A 496 58.105 23.046 -11.582 1.00 37.52 C ATOM 1426 CZ TYR A 496 58.440 24.327 -11.953 1.00 42.43 C ATOM 1427 OH TYR A 496 57.537 25.143 -12.603 1.00 40.68 O ATOM 1428 HH TYR A 496 56.739 25.272 -12.031 1.00 0.00 H ATOM 1429 H TYR A 496 62.820 20.484 -8.506 1.00 0.00 H ATOM 1430 N TYR A 497 59.661 21.167 -7.432 1.00 35.41 N ATOM 1431 CA TYR A 497 58.414 21.198 -6.666 1.00 34.96 C ATOM 1432 C TYR A 497 58.667 21.624 -5.225 1.00 36.73 C ATOM 1433 O TYR A 497 57.942 22.467 -4.686 1.00 38.01 O ATOM 1434 CB TYR A 497 57.699 19.845 -6.715 1.00 35.45 C ATOM 1435 CG TYR A 497 57.122 19.490 -8.071 1.00 36.39 C ATOM 1436 CD1 TYR A 497 56.488 20.435 -8.851 1.00 30.59 C ATOM 1437 CD2 TYR A 497 57.230 18.196 -8.573 1.00 42.81 C ATOM 1438 CE1 TYR A 497 55.973 20.102 -10.091 1.00 35.15 C ATOM 1439 CE2 TYR A 497 56.737 17.857 -9.819 1.00 38.47 C ATOM 1440 CZ TYR A 497 56.106 18.806 -10.570 1.00 43.02 C ATOM 1441 OH TYR A 497 55.616 18.457 -11.805 1.00 45.78 O ATOM 1442 HH TYR A 497 55.189 19.246 -12.224 1.00 0.00 H ATOM 1443 H TYR A 497 60.081 20.259 -7.717 1.00 0.00 H ATOM 1444 N LEU A 498 59.709 21.084 -4.592 1.00 40.78 N ATOM 1445 CA LEU A 498 60.020 21.489 -3.227 1.00 39.95 C ATOM 1446 C LEU A 498 60.169 23.002 -3.098 1.00 43.72 C ATOM 1447 O LEU A 498 59.914 23.561 -2.027 1.00 37.53 O ATOM 1448 CB LEU A 498 61.288 20.792 -2.749 1.00 38.44 C ATOM 1449 CG LEU A 498 61.842 21.274 -1.406 1.00 39.26 C ATOM 1450 CD1 LEU A 498 60.802 21.154 -0.327 1.00 42.58 C ATOM 1451 CD2 LEU A 498 63.031 20.457 -1.043 1.00 36.64 C ATOM 1452 H LEU A 498 60.299 20.375 -5.072 1.00 0.00 H ATOM 1453 N GLY A 499 60.560 23.684 -4.173 1.00 37.55 N ATOM 1454 CA GLY A 499 60.824 25.103 -4.045 1.00 40.63 C ATOM 1455 C GLY A 499 59.540 25.873 -4.005 1.00 40.16 C ATOM 1456 O GLY A 499 59.374 26.826 -3.241 1.00 43.56 O ATOM 1457 H GLY A 499 60.674 23.206 -5.090 1.00 0.00 H ATOM 1458 N GLN A 500 58.603 25.427 -4.827 1.00 44.55 N ATOM 1459 CA GLN A 500 57.255 25.971 -4.814 1.00 46.35 C ATOM 1460 C GLN A 500 56.557 25.696 -3.484 1.00 40.88 C ATOM 1461 O GLN A 500 55.914 26.583 -2.911 1.00 42.27 O ATOM 1462 CB GLN A 500 56.479 25.373 -5.979 1.00 39.38 C ATOM 1463 CG GLN A 500 57.123 25.650 -7.309 1.00 36.66 C ATOM 1464 CD GLN A 500 56.148 25.522 -8.451 1.00 45.03 C ATOM 1465 OE1 GLN A 500 55.077 24.969 -8.292 1.00 57.88 O ATOM 1466 NE2 GLN A 500 56.499 26.054 -9.595 1.00 47.59 N ATOM 1467 HE22 GLN A 500 57.425 26.518 -9.690 1.00 0.00 H ATOM 1468 HE21 GLN A 500 55.852 26.012 -10.408 1.00 0.00 H ATOM 1469 H GLN A 500 58.837 24.668 -5.499 1.00 0.00 H ATOM 1470 N ALA A 501 56.650 24.463 -2.988 1.00 39.15 N ATOM 1471 CA ALA A 501 56.079 24.152 -1.686 1.00 37.45 C ATOM 1472 C ALA A 501 56.608 25.111 -0.628 1.00 40.60 C ATOM 1473 O ALA A 501 55.842 25.681 0.158 1.00 39.28 O ATOM 1474 CB ALA A 501 56.395 22.708 -1.313 1.00 32.46 C ATOM 1475 H ALA A 501 57.132 23.720 -3.533 1.00 0.00 H ATOM 1476 N LEU A 502 57.925 25.320 -0.611 1.00 37.26 N ATOM 1477 CA LEU A 502 58.502 26.314 0.283 1.00 34.26 C ATOM 1478 C LEU A 502 58.025 27.729 -0.048 1.00 38.32 C ATOM 1479 O LEU A 502 57.874 28.560 0.853 1.00 38.66 O ATOM 1480 CB LEU A 502 60.018 26.206 0.238 1.00 34.42 C ATOM 1481 CG LEU A 502 60.499 24.889 0.857 1.00 40.61 C ATOM 1482 CD1 LEU A 502 61.953 24.587 0.558 1.00 34.89 C ATOM 1483 CD2 LEU A 502 60.265 24.921 2.345 1.00 41.60 C ATOM 1484 H LEU A 502 58.544 24.770 -1.240 1.00 0.00 H ATOM 1485 N GLU A 503 57.744 28.013 -1.317 1.00 36.74 N ATOM 1486 CA GLU A 503 57.234 29.328 -1.689 1.00 41.82 C ATOM 1487 C GLU A 503 55.878 29.604 -1.051 1.00 42.21 C ATOM 1488 O GLU A 503 55.637 30.699 -0.523 1.00 42.49 O ATOM 1489 CB GLU A 503 57.130 29.421 -3.203 1.00 45.64 C ATOM 1490 CG GLU A 503 57.830 30.573 -3.832 1.00 50.80 C ATOM 1491 CD GLU A 503 58.051 30.306 -5.290 1.00 59.30 C ATOM 1492 OE1 GLU A 503 57.088 30.493 -6.076 1.00 60.82 O ATOM 1493 OE2 GLU A 503 59.172 29.860 -5.637 1.00 61.00 O ATOM 1494 H GLU A 503 57.889 27.291 -2.051 1.00 0.00 H ATOM 1495 N GLY A 504 54.963 28.629 -1.132 1.00 39.74 N ATOM 1496 CA GLY A 504 53.710 28.711 -0.395 1.00 45.87 C ATOM 1497 C GLY A 504 53.851 28.701 1.126 1.00 41.79 C ATOM 1498 O GLY A 504 53.071 29.352 1.821 1.00 34.53 O ATOM 1499 H GLY A 504 55.151 27.800 -1.731 1.00 0.00 H ATOM 1500 N LEU A 505 54.832 27.970 1.666 1.00 34.84 N ATOM 1501 CA LEU A 505 55.060 28.031 3.109 1.00 43.45 C ATOM 1502 C LEU A 505 55.574 29.400 3.543 1.00 49.63 C ATOM 1503 O LEU A 505 55.316 29.823 4.679 1.00 42.93 O ATOM 1504 CB LEU A 505 56.042 26.953 3.549 1.00 36.20 C ATOM 1505 CG LEU A 505 55.483 25.545 3.545 1.00 38.80 C ATOM 1506 CD1 LEU A 505 56.577 24.545 3.848 1.00 32.29 C ATOM 1507 CD2 LEU A 505 54.378 25.495 4.562 1.00 29.84 C ATOM 1508 H LEU A 505 55.427 27.364 1.066 1.00 0.00 H ATOM 1509 N GLU A 506 56.324 30.088 2.672 1.00 43.57 N ATOM 1510 CA GLU A 506 56.735 31.458 2.953 1.00 39.80 C ATOM 1511 C GLU A 506 55.517 32.349 3.120 1.00 44.34 C ATOM 1512 O GLU A 506 55.371 33.060 4.120 1.00 44.58 O ATOM 1513 CB GLU A 506 57.592 31.984 1.809 1.00 46.08 C ATOM 1514 CG GLU A 506 59.083 31.934 1.959 1.00 48.97 C ATOM 1515 CD GLU A 506 59.764 32.594 0.756 1.00 58.33 C ATOM 1516 OE1 GLU A 506 59.514 32.132 -0.393 1.00 48.19 O ATOM 1517 OE2 GLU A 506 60.507 33.594 0.960 1.00 61.96 O ATOM 1518 H GLU A 506 56.618 29.638 1.782 1.00 0.00 H ATOM 1519 N TYR A 507 54.649 32.342 2.109 1.00 47.23 N ATOM 1520 CA TYR A 507 53.385 33.065 2.164 1.00 47.50 C ATOM 1521 C TYR A 507 52.606 32.748 3.450 1.00 48.99 C ATOM 1522 O TYR A 507 52.170 33.657 4.162 1.00 49.81 O ATOM 1523 CB TYR A 507 52.567 32.724 0.913 1.00 41.25 C ATOM 1524 CG TYR A 507 51.350 33.581 0.716 1.00 41.73 C ATOM 1525 CD1 TYR A 507 51.415 34.720 -0.054 1.00 46.49 C ATOM 1526 CD2 TYR A 507 50.131 33.252 1.298 1.00 48.30 C ATOM 1527 CE1 TYR A 507 50.316 35.525 -0.242 1.00 47.25 C ATOM 1528 CE2 TYR A 507 49.017 34.055 1.123 1.00 47.62 C ATOM 1529 CZ TYR A 507 49.121 35.192 0.349 1.00 49.51 C ATOM 1530 OH TYR A 507 48.041 36.011 0.146 1.00 53.59 O ATOM 1531 HH TYR A 507 47.318 35.498 -0.294 1.00 0.00 H ATOM 1532 H TYR A 507 54.882 31.802 1.251 1.00 0.00 H ATOM 1533 N LEU A 508 52.425 31.462 3.769 1.00 41.49 N ATOM 1534 CA LEU A 508 51.654 31.112 4.958 1.00 49.29 C ATOM 1535 C LEU A 508 52.337 31.578 6.236 1.00 50.00 C ATOM 1536 O LEU A 508 51.669 32.001 7.184 1.00 48.57 O ATOM 1537 CB LEU A 508 51.421 29.609 5.026 1.00 45.78 C ATOM 1538 CG LEU A 508 50.370 29.083 4.071 1.00 45.22 C ATOM 1539 CD1 LEU A 508 50.164 27.594 4.308 1.00 42.54 C ATOM 1540 CD2 LEU A 508 49.123 29.852 4.294 1.00 45.18 C ATOM 1541 H LEU A 508 52.832 30.714 3.172 1.00 0.00 H ATOM 1542 N HIS A 509 53.664 31.499 6.286 1.00 51.67 N ATOM 1543 CA HIS A 509 54.359 31.681 7.550 1.00 45.82 C ATOM 1544 C HIS A 509 54.445 33.143 7.955 1.00 47.85 C ATOM 1545 O HIS A 509 54.204 33.474 9.117 1.00 50.19 O ATOM 1546 CB HIS A 509 55.745 31.075 7.462 1.00 42.39 C ATOM 1547 CG HIS A 509 55.753 29.590 7.555 1.00 40.38 C ATOM 1548 ND1 HIS A 509 56.900 28.846 7.397 1.00 45.33 N ATOM 1549 CD2 HIS A 509 54.759 28.708 7.805 1.00 37.77 C ATOM 1550 CE1 HIS A 509 56.612 27.565 7.538 1.00 40.31 C ATOM 1551 NE2 HIS A 509 55.321 27.456 7.792 1.00 38.77 N ATOM 1552 H HIS A 509 54.205 31.307 5.419 1.00 0.00 H ATOM 1553 N THR A 510 54.786 34.034 7.027 1.00 48.49 N ATOM 1554 CA THR A 510 54.859 35.431 7.429 1.00 56.74 C ATOM 1555 C THR A 510 53.485 36.012 7.737 1.00 58.14 C ATOM 1556 O THR A 510 53.407 37.137 8.237 1.00 67.77 O ATOM 1557 CB THR A 510 55.569 36.297 6.370 1.00 61.34 C ATOM 1558 OG1 THR A 510 54.798 36.339 5.162 1.00 56.72 O ATOM 1559 CG2 THR A 510 56.995 35.777 6.090 1.00 58.50 C ATOM 1560 HG1 THR A 510 54.690 35.420 4.809 1.00 0.00 H ATOM 1561 H THR A 510 54.993 33.743 6.050 1.00 0.00 H ATOM 1562 N ARG A 511 52.408 35.288 7.442 1.00 54.19 N ATOM 1563 CA ARG A 511 51.085 35.626 7.946 1.00 50.54 C ATOM 1564 C ARG A 511 50.760 34.821 9.184 1.00 47.45 C ATOM 1565 O ARG A 511 49.594 34.601 9.497 1.00 49.86 O ATOM 1566 CB ARG A 511 50.021 35.428 6.867 1.00 43.95 C ATOM 1567 CG ARG A 511 50.165 36.436 5.729 1.00 48.57 C ATOM 1568 CD ARG A 511 49.233 36.137 4.579 1.00 53.56 C ATOM 1569 NE ARG A 511 49.341 37.091 3.475 1.00 52.79 N ATOM 1570 CZ ARG A 511 50.383 37.183 2.655 1.00 53.35 C ATOM 1571 NH1 ARG A 511 51.437 36.395 2.823 1.00 52.16 N ATOM 1572 NH2 ARG A 511 50.374 38.070 1.664 1.00 52.53 N ATOM 1573 HE ARG A 511 48.546 37.744 3.321 1.00 0.00 H ATOM 1574 HH12 ARG A 511 52.250 36.470 2.179 1.00 0.00 H ATOM 1575 HH11 ARG A 511 51.450 35.702 3.598 1.00 0.00 H ATOM 1576 HH22 ARG A 511 51.190 38.142 1.023 1.00 0.00 H ATOM 1577 HH21 ARG A 511 49.551 38.692 1.530 1.00 0.00 H ATOM 1578 H ARG A 511 52.515 34.453 6.831 1.00 0.00 H ATOM 1579 N ARG A 512 51.789 34.372 9.879 1.00 48.51 N ATOM 1580 CA ARG A 512 51.655 33.586 11.101 1.00 61.42 C ATOM 1581 C ARG A 512 50.642 32.441 10.973 1.00 60.08 C ATOM 1582 O ARG A 512 49.929 32.115 11.923 1.00 58.18 O ATOM 1583 CB ARG A 512 51.338 34.495 12.291 1.00 63.18 C ATOM 1584 CG ARG A 512 52.621 34.920 13.026 1.00 75.04 C ATOM 1585 CD ARG A 512 52.394 35.607 14.380 1.00 87.24 C ATOM 1586 NE ARG A 512 51.883 36.973 14.238 1.00104.30 N ATOM 1587 CZ ARG A 512 52.099 37.962 15.107 1.00 98.13 C ATOM 1588 NH1 ARG A 512 52.837 37.757 16.198 1.00 92.65 N ATOM 1589 NH2 ARG A 512 51.582 39.164 14.872 1.00 91.38 N ATOM 1590 HE ARG A 512 51.309 37.187 13.397 1.00 0.00 H ATOM 1591 HH12 ARG A 512 53.000 38.534 16.869 1.00 0.00 H ATOM 1592 HH11 ARG A 512 53.250 36.820 16.378 1.00 0.00 H ATOM 1593 HH22 ARG A 512 51.745 39.941 15.544 1.00 0.00 H ATOM 1594 HH21 ARG A 512 51.014 39.328 14.016 1.00 0.00 H ATOM 1595 H ARG A 512 52.747 34.590 9.537 1.00 0.00 H ATOM 1596 N ILE A 513 50.619 31.780 9.808 1.00 56.64 N ATOM 1597 CA ILE A 513 49.840 30.557 9.590 1.00 52.07 C ATOM 1598 C ILE A 513 50.779 29.368 9.455 1.00 45.75 C ATOM 1599 O ILE A 513 51.767 29.431 8.719 1.00 51.68 O ATOM 1600 CB ILE A 513 48.952 30.646 8.341 1.00 53.30 C ATOM 1601 CG1 ILE A 513 47.871 31.711 8.509 1.00 48.81 C ATOM 1602 CG2 ILE A 513 48.348 29.277 8.046 1.00 44.22 C ATOM 1603 CD1 ILE A 513 47.378 32.264 7.168 1.00 57.05 C ATOM 1604 H ILE A 513 51.183 32.153 9.018 1.00 0.00 H ATOM 1605 N LEU A 514 50.447 28.279 10.139 1.00 49.79 N ATOM 1606 CA LEU A 514 51.175 27.015 10.096 1.00 44.86 C ATOM 1607 C LEU A 514 50.291 25.981 9.408 1.00 45.39 C ATOM 1608 O LEU A 514 49.164 25.756 9.850 1.00 53.27 O ATOM 1609 CB LEU A 514 51.524 26.570 11.513 1.00 45.88 C ATOM 1610 CG LEU A 514 51.487 25.066 11.746 1.00 50.29 C ATOM 1611 CD1 LEU A 514 52.745 24.466 11.191 1.00 49.87 C ATOM 1612 CD2 LEU A 514 51.360 24.727 13.203 1.00 52.18 C ATOM 1613 H LEU A 514 49.607 28.331 10.750 1.00 0.00 H ATOM 1614 N HIS A 515 50.792 25.356 8.328 1.00 49.43 N ATOM 1615 CA HIS A 515 49.939 24.490 7.501 1.00 39.31 C ATOM 1616 C HIS A 515 49.572 23.198 8.219 1.00 37.52 C ATOM 1617 O HIS A 515 48.467 22.693 8.048 1.00 36.45 O ATOM 1618 CB HIS A 515 50.627 24.172 6.174 1.00 36.01 C ATOM 1619 CG HIS A 515 49.907 23.156 5.341 1.00 35.24 C ATOM 1620 ND1 HIS A 515 49.895 21.810 5.642 1.00 36.06 N ATOM 1621 CD2 HIS A 515 49.188 23.288 4.202 1.00 37.94 C ATOM 1622 CE1 HIS A 515 49.192 21.160 4.732 1.00 34.51 C ATOM 1623 NE2 HIS A 515 48.756 22.033 3.843 1.00 33.21 N ATOM 1624 H HIS A 515 51.792 25.486 8.075 1.00 0.00 H ATOM 1625 N GLY A 516 50.503 22.618 8.976 1.00 44.06 N ATOM 1626 CA GLY A 516 50.229 21.500 9.849 1.00 37.77 C ATOM 1627 C GLY A 516 50.412 20.118 9.249 1.00 44.09 C ATOM 1628 O GLY A 516 50.562 19.150 10.006 1.00 49.21 O ATOM 1629 H GLY A 516 51.474 22.988 8.936 1.00 0.00 H ATOM 1630 N ASP A 517 50.382 19.980 7.924 1.00 42.65 N ATOM 1631 CA ASP A 517 50.491 18.653 7.313 1.00 42.74 C ATOM 1632 C ASP A 517 51.050 18.776 5.902 1.00 42.99 C ATOM 1633 O ASP A 517 50.436 18.371 4.920 1.00 45.05 O ATOM 1634 CB ASP A 517 49.139 17.942 7.313 1.00 44.07 C ATOM 1635 CG ASP A 517 49.244 16.465 6.988 1.00 43.91 C ATOM 1636 OD1 ASP A 517 50.346 15.899 7.074 1.00 50.22 O ATOM 1637 OD2 ASP A 517 48.204 15.870 6.645 1.00 45.49 O ATOM 1638 H ASP A 517 50.281 20.820 7.319 1.00 0.00 H ATOM 1639 N VAL A 518 52.239 19.358 5.784 1.00 39.27 N ATOM 1640 CA VAL A 518 52.922 19.369 4.506 1.00 36.57 C ATOM 1641 C VAL A 518 53.333 17.950 4.144 1.00 44.24 C ATOM 1642 O VAL A 518 53.898 17.211 4.971 1.00 42.28 O ATOM 1643 CB VAL A 518 54.121 20.313 4.564 1.00 39.25 C ATOM 1644 CG1 VAL A 518 54.766 20.449 3.171 1.00 35.37 C ATOM 1645 CG2 VAL A 518 53.642 21.631 5.071 1.00 38.06 C ATOM 1646 H VAL A 518 52.681 19.807 6.612 1.00 0.00 H ATOM 1647 N LYS A 519 53.032 17.559 2.907 1.00 36.65 N ATOM 1648 CA LYS A 519 53.278 16.198 2.447 1.00 37.50 C ATOM 1649 C LYS A 519 52.846 16.110 0.990 1.00 37.06 C ATOM 1650 O LYS A 519 52.093 16.958 0.503 1.00 34.82 O ATOM 1651 CB LYS A 519 52.552 15.157 3.314 1.00 34.82 C ATOM 1652 CG LYS A 519 51.017 15.089 3.218 1.00 36.54 C ATOM 1653 CD LYS A 519 50.590 13.729 3.774 1.00 42.97 C ATOM 1654 CE LYS A 519 49.093 13.510 3.916 1.00 43.78 C ATOM 1655 NZ LYS A 519 48.840 12.036 4.025 1.00 39.13 N ATOM 1656 HZ1 LYS A 519 49.190 11.561 3.169 1.00 0.00 H ATOM 1657 HZ2 LYS A 519 49.336 11.661 4.859 1.00 0.00 H ATOM 1658 HZ3 LYS A 519 47.818 11.867 4.123 1.00 0.00 H ATOM 1659 H LYS A 519 52.609 18.245 2.250 1.00 0.00 H ATOM 1660 N ALA A 520 53.358 15.093 0.291 1.00 34.11 N ATOM 1661 CA ALA A 520 53.118 15.007 -1.145 1.00 40.71 C ATOM 1662 C ALA A 520 51.629 15.000 -1.457 1.00 47.62 C ATOM 1663 O ALA A 520 51.176 15.670 -2.401 1.00 40.87 O ATOM 1664 CB ALA A 520 53.782 13.764 -1.729 1.00 35.28 C ATOM 1665 H ALA A 520 53.926 14.365 0.769 1.00 0.00 H ATOM 1666 N ASP A 521 50.842 14.280 -0.644 1.00 46.71 N ATOM 1667 CA ASP A 521 49.417 14.160 -0.929 1.00 43.39 C ATOM 1668 C ASP A 521 48.698 15.506 -0.913 1.00 45.02 C ATOM 1669 O ASP A 521 47.601 15.601 -1.470 1.00 51.89 O ATOM 1670 CB ASP A 521 48.764 13.195 0.059 1.00 44.82 C ATOM 1671 CG ASP A 521 49.017 11.723 -0.293 1.00 53.65 C ATOM 1672 OD1 ASP A 521 49.213 11.412 -1.498 1.00 47.60 O ATOM 1673 OD2 ASP A 521 49.006 10.874 0.640 1.00 48.72 O ATOM 1674 H ASP A 521 51.248 13.808 0.189 1.00 0.00 H ATOM 1675 N ASN A 522 49.300 16.551 -0.329 1.00 42.94 N ATOM 1676 CA ASN A 522 48.692 17.876 -0.230 1.00 38.47 C ATOM 1677 C ASN A 522 49.368 18.919 -1.114 1.00 40.58 C ATOM 1678 O ASN A 522 49.232 20.126 -0.866 1.00 36.16 O ATOM 1679 CB ASN A 522 48.694 18.373 1.208 1.00 34.17 C ATOM 1680 CG ASN A 522 47.862 17.524 2.100 1.00 41.84 C ATOM 1681 OD1 ASN A 522 46.909 16.907 1.647 1.00 53.60 O ATOM 1682 ND2 ASN A 522 48.208 17.474 3.386 1.00 41.96 N ATOM 1683 HD22 ASN A 522 49.028 18.017 3.725 1.00 0.00 H ATOM 1684 HD21 ASN A 522 47.658 16.892 4.050 1.00 0.00 H ATOM 1685 H ASN A 522 50.248 16.412 0.074 1.00 0.00 H ATOM 1686 N VAL A 523 50.096 18.496 -2.137 1.00 36.89 N ATOM 1687 CA VAL A 523 50.526 19.411 -3.181 1.00 39.33 C ATOM 1688 C VAL A 523 49.792 19.008 -4.448 1.00 37.81 C ATOM 1689 O VAL A 523 49.759 17.828 -4.805 1.00 41.35 O ATOM 1690 CB VAL A 523 52.057 19.411 -3.355 1.00 37.77 C ATOM 1691 CG1 VAL A 523 52.469 20.509 -4.310 1.00 34.49 C ATOM 1692 CG2 VAL A 523 52.748 19.586 -2.001 1.00 28.69 C ATOM 1693 H VAL A 523 50.364 17.493 -2.194 1.00 0.00 H ATOM 1694 N LEU A 524 49.143 19.963 -5.083 1.00 35.03 N ATOM 1695 CA LEU A 524 48.396 19.684 -6.298 1.00 41.67 C ATOM 1696 C LEU A 524 49.092 20.338 -7.483 1.00 40.30 C ATOM 1697 O LEU A 524 49.475 21.515 -7.426 1.00 39.43 O ATOM 1698 CB LEU A 524 46.949 20.171 -6.197 1.00 41.33 C ATOM 1699 CG LEU A 524 46.162 19.579 -5.044 1.00 36.53 C ATOM 1700 CD1 LEU A 524 44.809 20.222 -4.983 1.00 42.32 C ATOM 1701 CD2 LEU A 524 46.017 18.124 -5.246 1.00 40.96 C ATOM 1702 H LEU A 524 49.166 20.933 -4.708 1.00 0.00 H ATOM 1703 N LEU A 525 49.240 19.569 -8.553 1.00 43.61 N ATOM 1704 CA LEU A 525 49.947 19.991 -9.750 1.00 44.89 C ATOM 1705 C LEU A 525 48.915 20.411 -10.777 1.00 43.09 C ATOM 1706 O LEU A 525 47.845 19.805 -10.863 1.00 48.70 O ATOM 1707 CB LEU A 525 50.831 18.843 -10.282 1.00 42.25 C ATOM 1708 CG LEU A 525 51.638 18.111 -9.187 1.00 35.04 C ATOM 1709 CD1 LEU A 525 52.160 16.754 -9.580 1.00 41.60 C ATOM 1710 CD2 LEU A 525 52.775 18.974 -8.694 1.00 38.45 C ATOM 1711 H LEU A 525 48.829 18.614 -8.534 1.00 0.00 H ATOM 1712 N SER A 526 49.228 21.465 -11.533 1.00 47.36 N ATOM 1713 CA SER A 526 48.485 21.842 -12.738 1.00 47.69 C ATOM 1714 C SER A 526 48.494 20.768 -13.832 1.00 53.03 C ATOM 1715 O SER A 526 49.077 19.689 -13.663 1.00 50.49 O ATOM 1716 CB SER A 526 49.047 23.142 -13.299 1.00 53.69 C ATOM 1717 OG SER A 526 50.456 23.119 -13.244 1.00 52.53 O ATOM 1718 HG SER A 526 50.747 23.016 -12.303 1.00 0.00 H ATOM 1719 H SER A 526 50.041 22.049 -11.252 1.00 0.00 H ATOM 1720 N SER A 527 47.844 21.052 -14.967 1.00 62.01 N ATOM 1721 CA SER A 527 47.598 20.006 -15.964 1.00 59.19 C ATOM 1722 C SER A 527 48.891 19.536 -16.622 1.00 63.01 C ATOM 1723 O SER A 527 49.038 18.349 -16.938 1.00 66.92 O ATOM 1724 CB SER A 527 46.628 20.519 -17.017 1.00 58.78 C ATOM 1725 OG SER A 527 47.014 21.832 -17.400 1.00 77.46 O ATOM 1726 HG SER A 527 46.386 22.172 -18.086 1.00 0.00 H ATOM 1727 H SER A 527 47.511 22.021 -15.143 1.00 0.00 H ATOM 1728 N ASP A 528 49.839 20.454 -16.835 1.00 62.50 N ATOM 1729 CA ASP A 528 51.106 20.152 -17.489 1.00 55.07 C ATOM 1730 C ASP A 528 52.235 19.870 -16.505 1.00 56.06 C ATOM 1731 O ASP A 528 53.363 19.611 -16.925 1.00 61.10 O ATOM 1732 CB ASP A 528 51.497 21.296 -18.441 1.00 47.58 C ATOM 1733 CG ASP A 528 51.895 22.566 -17.719 1.00 55.99 C ATOM 1734 OD1 ASP A 528 52.019 22.548 -16.477 1.00 53.96 O ATOM 1735 OD2 ASP A 528 52.094 23.596 -18.406 1.00 56.25 O ATOM 1736 H ASP A 528 49.664 21.429 -16.519 1.00 0.00 H ATOM 1737 N GLY A 529 51.970 19.941 -15.213 1.00 61.01 N ATOM 1738 CA GLY A 529 52.956 19.593 -14.223 1.00 55.31 C ATOM 1739 C GLY A 529 53.875 20.709 -13.817 1.00 49.65 C ATOM 1740 O GLY A 529 54.790 20.472 -13.020 1.00 51.85 O ATOM 1741 H GLY A 529 51.028 20.255 -14.904 1.00 0.00 H ATOM 1742 N SER A 530 53.651 21.920 -14.315 1.00 47.74 N ATOM 1743 CA SER A 530 54.572 23.029 -14.107 1.00 45.43 C ATOM 1744 C SER A 530 54.269 23.880 -12.873 1.00 48.98 C ATOM 1745 O SER A 530 55.145 24.626 -12.427 1.00 44.80 O ATOM 1746 CB SER A 530 54.570 23.922 -15.345 1.00 38.86 C ATOM 1747 OG SER A 530 53.459 24.788 -15.333 1.00 46.76 O ATOM 1748 HG SER A 530 52.626 24.254 -15.322 1.00 0.00 H ATOM 1749 H SER A 530 52.788 22.082 -14.873 1.00 0.00 H ATOM 1750 N ARG A 531 53.055 23.815 -12.323 1.00 50.91 N ATOM 1751 CA ARG A 531 52.673 24.638 -11.180 1.00 54.51 C ATOM 1752 C ARG A 531 52.158 23.758 -10.051 1.00 46.84 C ATOM 1753 O ARG A 531 51.395 22.808 -10.276 1.00 46.54 O ATOM 1754 CB ARG A 531 51.623 25.684 -11.558 1.00 51.42 C ATOM 1755 CG ARG A 531 52.170 26.816 -12.412 1.00 54.83 C ATOM 1756 CD ARG A 531 51.069 27.422 -13.279 1.00 72.13 C ATOM 1757 NE ARG A 531 50.431 26.412 -14.138 1.00 86.02 N ATOM 1758 CZ ARG A 531 49.294 26.597 -14.818 1.00 92.61 C ATOM 1759 NH1 ARG A 531 48.647 27.765 -14.743 1.00 89.16 N ATOM 1760 NH2 ARG A 531 48.797 25.615 -15.571 1.00 70.63 N ATOM 1761 HE ARG A 531 50.898 25.487 -14.223 1.00 0.00 H ATOM 1762 HH12 ARG A 531 47.763 27.905 -15.273 1.00 0.00 H ATOM 1763 HH11 ARG A 531 49.028 28.533 -14.154 1.00 0.00 H ATOM 1764 HH22 ARG A 531 47.913 25.761 -16.099 1.00 0.00 H ATOM 1765 HH21 ARG A 531 49.294 24.703 -15.630 1.00 0.00 H ATOM 1766 H ARG A 531 52.357 23.155 -12.723 1.00 0.00 H ATOM 1767 N ALA A 532 52.607 24.067 -8.842 1.00 40.88 N ATOM 1768 CA ALA A 532 52.317 23.262 -7.671 1.00 42.02 C ATOM 1769 C ALA A 532 51.733 24.171 -6.619 1.00 43.19 C ATOM 1770 O ALA A 532 52.154 25.324 -6.471 1.00 45.89 O ATOM 1771 CB ALA A 532 53.558 22.557 -7.122 1.00 46.52 C ATOM 1772 H ALA A 532 53.190 24.921 -8.729 1.00 0.00 H ATOM 1773 N ALA A 533 50.740 23.656 -5.915 1.00 43.95 N ATOM 1774 CA ALA A 533 50.029 24.459 -4.947 1.00 40.21 C ATOM 1775 C ALA A 533 49.660 23.577 -3.782 1.00 36.75 C ATOM 1776 O ALA A 533 49.433 22.376 -3.941 1.00 37.93 O ATOM 1777 CB ALA A 533 48.790 25.108 -5.551 1.00 35.40 C ATOM 1778 H ALA A 533 50.468 22.663 -6.059 1.00 0.00 H ATOM 1779 N LEU A 534 49.644 24.192 -2.605 1.00 39.66 N ATOM 1780 CA LEU A 534 49.304 23.531 -1.360 1.00 32.82 C ATOM 1781 C LEU A 534 47.791 23.522 -1.176 1.00 38.24 C ATOM 1782 O LEU A 534 47.129 24.550 -1.366 1.00 37.11 O ATOM 1783 CB LEU A 534 49.954 24.278 -0.205 1.00 36.96 C ATOM 1784 CG LEU A 534 51.442 24.537 -0.277 1.00 38.68 C ATOM 1785 CD1 LEU A 534 51.875 25.499 0.822 1.00 41.42 C ATOM 1786 CD2 LEU A 534 52.073 23.205 -0.072 1.00 41.84 C ATOM 1787 H LEU A 534 49.889 25.202 -2.575 1.00 0.00 H ATOM 1788 N CYS A 535 47.245 22.370 -0.825 1.00 33.58 N ATOM 1789 CA CYS A 535 45.857 22.289 -0.429 1.00 39.86 C ATOM 1790 C CYS A 535 45.803 21.733 0.984 1.00 42.19 C ATOM 1791 O CYS A 535 46.842 21.511 1.608 1.00 37.37 O ATOM 1792 CB CYS A 535 45.018 21.454 -1.404 1.00 33.21 C ATOM 1793 SG CYS A 535 45.593 19.771 -1.605 1.00 56.06 S ATOM 1794 H CYS A 535 47.825 21.507 -0.834 1.00 0.00 H ATOM 1795 N ASP A 536 44.558 21.586 1.481 1.00 45.36 N ATOM 1796 CA ASP A 536 44.150 20.981 2.754 1.00 44.74 C ATOM 1797 C ASP A 536 44.642 21.724 3.975 1.00 41.06 C ATOM 1798 O ASP A 536 45.753 21.489 4.437 1.00 44.74 O ATOM 1799 CB ASP A 536 44.610 19.528 2.869 1.00 46.66 C ATOM 1800 CG ASP A 536 43.914 18.778 4.011 1.00 57.62 C ATOM 1801 OD1 ASP A 536 44.229 19.003 5.210 1.00 62.45 O ATOM 1802 OD2 ASP A 536 43.037 17.950 3.696 1.00 55.74 O ATOM 1803 H ASP A 536 43.787 21.948 0.885 1.00 0.00 H ATOM 1804 N PHE A 537 43.803 22.558 4.560 1.00 42.49 N ATOM 1805 CA PHE A 537 44.202 23.249 5.767 1.00 44.66 C ATOM 1806 C PHE A 537 43.598 22.637 7.023 1.00 45.37 C ATOM 1807 O PHE A 537 43.598 23.281 8.073 1.00 44.60 O ATOM 1808 CB PHE A 537 43.862 24.723 5.639 1.00 39.74 C ATOM 1809 CG PHE A 537 44.831 25.472 4.779 1.00 43.95 C ATOM 1810 CD1 PHE A 537 45.730 26.356 5.338 1.00 43.16 C ATOM 1811 CD2 PHE A 537 44.863 25.272 3.403 1.00 50.32 C ATOM 1812 CE1 PHE A 537 46.620 27.050 4.545 1.00 51.23 C ATOM 1813 CE2 PHE A 537 45.766 25.967 2.600 1.00 48.25 C ATOM 1814 CZ PHE A 537 46.639 26.851 3.168 1.00 48.83 C ATOM 1815 H PHE A 537 42.859 22.718 4.155 1.00 0.00 H ATOM 1816 N GLY A 538 43.145 21.386 6.951 1.00 37.25 N ATOM 1817 CA GLY A 538 42.498 20.747 8.070 1.00 39.04 C ATOM 1818 C GLY A 538 43.370 20.492 9.267 1.00 38.40 C ATOM 1819 O GLY A 538 42.887 19.950 10.260 1.00 49.04 O ATOM 1820 H GLY A 538 43.261 20.856 6.064 1.00 0.00 H ATOM 1821 N HIS A 539 44.645 20.825 9.180 1.00 42.78 N ATOM 1822 CA HIS A 539 45.590 20.695 10.271 1.00 41.99 C ATOM 1823 C HIS A 539 46.214 22.034 10.591 1.00 42.02 C ATOM 1824 O HIS A 539 47.116 22.103 11.433 1.00 41.57 O ATOM 1825 CB HIS A 539 46.703 19.702 9.919 1.00 39.49 C ATOM 1826 CG HIS A 539 46.260 18.277 9.883 1.00 50.33 C ATOM 1827 ND1 HIS A 539 45.518 17.753 8.847 1.00 51.71 N ATOM 1828 CD2 HIS A 539 46.476 17.255 10.744 1.00 50.66 C ATOM 1829 CE1 HIS A 539 45.286 16.474 9.078 1.00 53.57 C ATOM 1830 NE2 HIS A 539 45.860 16.147 10.222 1.00 50.58 N ATOM 1831 H HIS A 539 44.991 21.203 8.275 1.00 0.00 H ATOM 1832 N ALA A 540 45.754 23.094 9.940 1.00 42.98 N ATOM 1833 CA ALA A 540 46.375 24.403 10.042 1.00 46.28 C ATOM 1834 C ALA A 540 46.190 24.988 11.435 1.00 52.16 C ATOM 1835 O ALA A 540 45.365 24.546 12.245 1.00 55.59 O ATOM 1836 CB ALA A 540 45.810 25.361 8.988 1.00 40.59 C ATOM 1837 H ALA A 540 44.917 22.984 9.333 1.00 0.00 H ATOM 1838 N LEU A 541 46.969 26.017 11.704 1.00 51.66 N ATOM 1839 CA LEU A 541 46.967 26.600 13.034 1.00 59.40 C ATOM 1840 C LEU A 541 47.453 28.033 12.903 1.00 65.34 C ATOM 1841 O LEU A 541 48.503 28.262 12.297 1.00 64.09 O ATOM 1842 CB LEU A 541 47.855 25.785 13.962 1.00 49.01 C ATOM 1843 CG LEU A 541 47.835 26.233 15.413 1.00 64.60 C ATOM 1844 CD1 LEU A 541 46.455 25.983 16.026 1.00 75.72 C ATOM 1845 CD2 LEU A 541 48.922 25.518 16.189 1.00 65.35 C ATOM 1846 H LEU A 541 47.585 26.411 10.964 1.00 0.00 H ATOM 1847 N CYS A 542 46.667 28.991 13.405 1.00 75.37 N ATOM 1848 CA CYS A 542 47.099 30.383 13.480 1.00 71.63 C ATOM 1849 C CYS A 542 48.071 30.557 14.643 1.00 66.07 C ATOM 1850 O CYS A 542 47.979 29.861 15.657 1.00 59.47 O ATOM 1851 CB CYS A 542 45.898 31.325 13.629 1.00 70.59 C ATOM 1852 SG CYS A 542 44.967 31.666 12.078 1.00 82.90 S ATOM 1853 H CYS A 542 45.720 28.737 13.752 1.00 0.00 H ATOM 1854 N LEU A 543 49.015 31.485 14.483 1.00 69.84 N ATOM 1855 CA LEU A 543 50.157 31.616 15.382 1.00 76.84 C ATOM 1856 C LEU A 543 50.197 32.963 16.123 1.00 88.62 C ATOM 1857 O LEU A 543 49.456 33.917 15.832 1.00 74.66 O ATOM 1858 CB LEU A 543 51.461 31.390 14.612 1.00 65.72 C ATOM 1859 CG LEU A 543 51.729 29.909 14.365 1.00 69.80 C ATOM 1860 CD1 LEU A 543 52.658 29.712 13.167 1.00 58.94 C ATOM 1861 CD2 LEU A 543 52.297 29.257 15.619 1.00 59.77 C ATOM 1862 H LEU A 543 48.934 32.144 13.683 1.00 0.00 H ATOM 1863 N GLN A 544 51.116 33.017 17.088 1.00 94.23 N ATOM 1864 CA GLN A 544 51.197 34.058 18.108 1.00100.83 C ATOM 1865 C GLN A 544 52.510 34.845 17.931 1.00101.00 C ATOM 1866 O GLN A 544 52.953 35.605 18.802 1.00100.21 O ATOM 1867 CB GLN A 544 51.107 33.395 19.494 1.00104.06 C ATOM 1868 CG GLN A 544 50.899 34.303 20.696 1.00112.55 C ATOM 1869 CD GLN A 544 51.435 33.669 21.978 1.00119.52 C ATOM 1870 OE1 GLN A 544 52.625 33.345 22.071 1.00113.55 O ATOM 1871 NE2 GLN A 544 50.556 33.475 22.963 1.00114.65 N ATOM 1872 HE22 GLN A 544 49.565 33.764 22.840 1.00 0.00 H ATOM 1873 HE21 GLN A 544 50.862 33.035 23.854 1.00 0.00 H ATOM 1874 H GLN A 544 51.829 32.260 17.116 1.00 0.00 H TER 1875 GLN A 544 ATOM 1876 N SER A 551 53.375 23.981 22.739 1.00 87.84 N ATOM 1877 CA SER A 551 52.868 22.633 22.479 1.00 93.40 C ATOM 1878 C SER A 551 51.705 22.680 21.513 1.00 96.49 C ATOM 1879 O SER A 551 50.949 23.670 21.439 1.00 91.28 O ATOM 1880 CB SER A 551 52.437 21.928 23.777 1.00 77.59 C ATOM 1881 HN3 SER A 551 52.617 24.562 23.151 1.00 0.00 H ATOM 1882 HN2 SER A 551 53.694 24.408 21.846 1.00 0.00 H ATOM 1883 HN1 SER A 551 54.173 23.928 23.404 1.00 0.00 H ATOM 1884 N LEU A 552 51.569 21.585 20.772 1.00 87.30 N ATOM 1885 CA LEU A 552 50.500 21.440 19.805 1.00 92.17 C ATOM 1886 C LEU A 552 49.387 20.548 20.319 1.00 87.81 C ATOM 1887 O LEU A 552 48.306 20.524 19.722 1.00 84.22 O ATOM 1888 CB LEU A 552 51.061 20.881 18.488 1.00 84.19 C ATOM 1889 CG LEU A 552 50.931 21.768 17.244 1.00 75.94 C ATOM 1890 CD1 LEU A 552 51.253 23.198 17.604 1.00 71.28 C ATOM 1891 CD2 LEU A 552 51.833 21.274 16.115 1.00 62.17 C ATOM 1892 H LEU A 552 52.251 20.809 20.890 1.00 0.00 H ATOM 1893 N LEU A 553 49.619 19.860 21.435 1.00 82.85 N ATOM 1894 CA LEU A 553 48.760 18.769 21.889 1.00 91.47 C ATOM 1895 C LEU A 553 47.665 19.275 22.839 1.00 96.56 C ATOM 1896 O LEU A 553 47.529 18.843 23.985 1.00 89.65 O ATOM 1897 CB LEU A 553 49.619 17.679 22.527 1.00 78.62 C ATOM 1898 CG LEU A 553 50.689 17.130 21.579 1.00 73.93 C ATOM 1899 CD1 LEU A 553 51.326 15.870 22.115 1.00 75.60 C ATOM 1900 CD2 LEU A 553 50.109 16.863 20.199 1.00 78.34 C ATOM 1901 H LEU A 553 50.449 20.111 22.009 1.00 0.00 H ATOM 1902 N THR A 554 46.860 20.205 22.325 1.00 97.02 N ATOM 1903 CA THR A 554 45.708 20.719 23.055 1.00106.61 C ATOM 1904 C THR A 554 44.651 21.206 22.076 1.00113.55 C ATOM 1905 O THR A 554 44.964 21.709 20.991 1.00107.45 O ATOM 1906 CB THR A 554 46.058 21.885 23.991 1.00107.88 C ATOM 1907 OG1 THR A 554 47.027 22.736 23.362 1.00102.82 O ATOM 1908 CG2 THR A 554 46.565 21.389 25.345 1.00105.36 C ATOM 1909 HG1 THR A 554 47.249 23.486 23.969 1.00 0.00 H ATOM 1910 H THR A 554 47.060 20.575 21.374 1.00 0.00 H ATOM 1911 N GLY A 555 43.392 21.075 22.491 1.00114.28 N ATOM 1912 CA GLY A 555 42.277 21.635 21.756 1.00107.15 C ATOM 1913 C GLY A 555 41.753 20.753 20.641 1.00110.52 C ATOM 1914 O GLY A 555 41.800 19.517 20.713 1.00103.36 O ATOM 1915 H GLY A 555 43.204 20.554 23.371 1.00 0.00 H ATOM 1916 N ASP A 556 41.261 21.410 19.589 1.00111.19 N ATOM 1917 CA ASP A 556 40.679 20.745 18.427 1.00105.27 C ATOM 1918 C ASP A 556 41.746 20.070 17.575 1.00101.59 C ATOM 1919 O ASP A 556 41.562 19.901 16.365 1.00 96.11 O ATOM 1920 CB ASP A 556 39.884 21.750 17.569 1.00 97.32 C ATOM 1921 CG ASP A 556 40.718 22.985 17.123 1.00 93.57 C ATOM 1922 OD1 ASP A 556 41.977 22.996 17.251 1.00 88.27 O ATOM 1923 OD2 ASP A 556 40.084 23.958 16.637 1.00 80.88 O ATOM 1924 H ASP A 556 41.294 22.449 19.597 1.00 0.00 H ATOM 1925 N TYR A 557 42.859 19.676 18.187 1.00102.35 N ATOM 1926 CA TYR A 557 44.057 19.371 17.421 1.00 89.48 C ATOM 1927 C TYR A 557 43.990 17.969 16.829 1.00 89.64 C ATOM 1928 O TYR A 557 43.922 16.970 17.560 1.00 86.42 O ATOM 1929 CB TYR A 557 45.302 19.525 18.284 1.00 93.17 C ATOM 1930 CG TYR A 557 46.548 19.095 17.550 1.00 88.56 C ATOM 1931 CD1 TYR A 557 47.029 19.820 16.456 1.00 79.15 C ATOM 1932 CD2 TYR A 557 47.236 17.951 17.939 1.00 81.50 C ATOM 1933 CE1 TYR A 557 48.172 19.411 15.778 1.00 76.23 C ATOM 1934 CE2 TYR A 557 48.376 17.535 17.274 1.00 76.88 C ATOM 1935 CZ TYR A 557 48.841 18.260 16.199 1.00 76.38 C ATOM 1936 OH TYR A 557 49.983 17.813 15.558 1.00 75.26 O ATOM 1937 HH TYR A 557 50.201 18.424 14.810 1.00 0.00 H ATOM 1938 H TYR A 557 42.873 19.585 19.223 1.00 0.00 H ATOM 1939 N ILE A 558 44.012 17.913 15.506 1.00 81.95 N ATOM 1940 CA ILE A 558 44.242 16.684 14.753 1.00 76.48 C ATOM 1941 C ILE A 558 45.711 16.671 14.346 1.00 72.05 C ATOM 1942 O ILE A 558 46.174 17.649 13.739 1.00 72.15 O ATOM 1943 CB ILE A 558 43.338 16.617 13.507 1.00 78.37 C ATOM 1944 CG1 ILE A 558 41.854 16.654 13.910 1.00 79.72 C ATOM 1945 CG2 ILE A 558 43.680 15.391 12.663 1.00 72.25 C ATOM 1946 CD1 ILE A 558 40.893 17.034 12.770 1.00 79.05 C ATOM 1947 H ILE A 558 43.857 18.793 14.974 1.00 0.00 H ATOM 1948 N PRO A 559 46.468 15.616 14.656 1.00 65.62 N ATOM 1949 CA PRO A 559 47.874 15.563 14.238 1.00 57.36 C ATOM 1950 C PRO A 559 48.024 15.218 12.765 1.00 53.72 C ATOM 1951 O PRO A 559 47.155 14.606 12.143 1.00 61.30 O ATOM 1952 CB PRO A 559 48.470 14.462 15.124 1.00 51.55 C ATOM 1953 CG PRO A 559 47.340 13.570 15.402 1.00 59.90 C ATOM 1954 CD PRO A 559 46.094 14.439 15.454 1.00 66.52 C ATOM 1955 N GLY A 560 49.167 15.612 12.215 1.00 54.73 N ATOM 1956 CA GLY A 560 49.469 15.381 10.817 1.00 53.65 C ATOM 1957 C GLY A 560 50.091 14.019 10.567 1.00 46.24 C ATOM 1958 O GLY A 560 50.149 13.152 11.443 1.00 47.90 O ATOM 1959 H GLY A 560 49.868 16.102 12.807 1.00 0.00 H ATOM 1960 N THR A 561 50.577 13.841 9.346 1.00 39.71 N ATOM 1961 CA THR A 561 51.143 12.556 8.967 1.00 42.35 C ATOM 1962 C THR A 561 52.370 12.214 9.802 1.00 45.31 C ATOM 1963 O THR A 561 53.344 12.971 9.838 1.00 50.82 O ATOM 1964 CB THR A 561 51.500 12.557 7.498 1.00 43.43 C ATOM 1965 OG1 THR A 561 50.398 13.088 6.775 1.00 44.58 O ATOM 1966 CG2 THR A 561 51.741 11.148 7.061 1.00 46.04 C ATOM 1967 HG1 THR A 561 50.217 14.011 7.083 1.00 0.00 H ATOM 1968 H THR A 561 50.553 14.621 8.659 1.00 0.00 H ATOM 1969 N GLU A 562 52.324 11.042 10.433 1.00 46.78 N ATOM 1970 CA GLU A 562 53.343 10.648 11.401 1.00 51.01 C ATOM 1971 C GLU A 562 54.745 10.634 10.789 1.00 53.86 C ATOM 1972 O GLU A 562 55.702 11.102 11.413 1.00 49.45 O ATOM 1973 CB GLU A 562 52.985 9.279 11.978 1.00 49.86 C ATOM 1974 CG GLU A 562 53.797 8.864 13.178 1.00 50.67 C ATOM 1975 CD GLU A 562 53.382 7.494 13.715 1.00 64.90 C ATOM 1976 OE1 GLU A 562 52.640 6.776 13.000 1.00 67.40 O ATOM 1977 OE2 GLU A 562 53.795 7.136 14.847 1.00 65.28 O ATOM 1978 H GLU A 562 51.540 10.389 10.230 1.00 0.00 H ATOM 1979 N THR A 563 54.893 10.091 9.572 1.00 48.81 N ATOM 1980 CA THR A 563 56.228 10.002 8.987 1.00 46.96 C ATOM 1981 C THR A 563 56.863 11.380 8.785 1.00 44.79 C ATOM 1982 O THR A 563 58.079 11.530 8.944 1.00 46.36 O ATOM 1983 CB THR A 563 56.189 9.225 7.667 1.00 48.47 C ATOM 1984 OG1 THR A 563 55.309 9.871 6.733 1.00 51.71 O ATOM 1985 CG2 THR A 563 55.705 7.848 7.921 1.00 42.69 C ATOM 1986 HG1 THR A 563 55.294 9.358 5.886 1.00 0.00 H ATOM 1987 H THR A 563 54.066 9.737 9.050 1.00 0.00 H ATOM 1988 N HIS A 564 56.068 12.399 8.465 1.00 47.14 N ATOM 1989 CA HIS A 564 56.585 13.744 8.251 1.00 42.20 C ATOM 1990 C HIS A 564 56.550 14.606 9.516 1.00 41.10 C ATOM 1991 O HIS A 564 56.605 15.831 9.415 1.00 36.83 O ATOM 1992 CB HIS A 564 55.805 14.455 7.141 1.00 41.01 C ATOM 1993 CG HIS A 564 55.854 13.789 5.796 1.00 40.43 C ATOM 1994 ND1 HIS A 564 55.852 12.421 5.628 1.00 36.69 N ATOM 1995 CD2 HIS A 564 55.846 14.322 4.545 1.00 38.78 C ATOM 1996 CE1 HIS A 564 55.868 12.141 4.335 1.00 40.28 C ATOM 1997 NE2 HIS A 564 55.865 13.276 3.657 1.00 35.07 N ATOM 1998 H HIS A 564 55.047 12.230 8.365 1.00 0.00 H ATOM 1999 N MET A 565 56.488 13.994 10.691 1.00 50.09 N ATOM 2000 CA MET A 565 56.253 14.693 11.949 1.00 48.00 C ATOM 2001 C MET A 565 57.562 15.156 12.583 1.00 45.41 C ATOM 2002 O MET A 565 58.443 14.338 12.877 1.00 46.64 O ATOM 2003 CB MET A 565 55.505 13.772 12.911 1.00 48.19 C ATOM 2004 CG MET A 565 54.474 14.448 13.761 1.00 56.59 C ATOM 2005 SD MET A 565 53.685 13.321 14.916 1.00 67.18 S ATOM 2006 CE MET A 565 52.102 14.142 14.978 1.00 63.68 C ATOM 2007 H MET A 565 56.614 12.962 10.716 1.00 0.00 H ATOM 2008 N ALA A 566 57.656 16.463 12.846 1.00 52.27 N ATOM 2009 CA ALA A 566 58.848 17.073 13.436 1.00 47.42 C ATOM 2010 C ALA A 566 59.096 16.566 14.861 1.00 56.08 C ATOM 2011 O ALA A 566 58.147 16.283 15.600 1.00 54.81 O ATOM 2012 CB ALA A 566 58.694 18.587 13.458 1.00 42.33 C ATOM 2013 H ALA A 566 56.845 17.074 12.621 1.00 0.00 H ATOM 2014 N PRO A 567 60.369 16.471 15.280 1.00 60.27 N ATOM 2015 CA PRO A 567 60.674 15.916 16.615 1.00 55.29 C ATOM 2016 C PRO A 567 60.072 16.703 17.752 1.00 55.90 C ATOM 2017 O PRO A 567 59.700 16.103 18.770 1.00 63.89 O ATOM 2018 CB PRO A 567 62.209 15.950 16.677 1.00 53.88 C ATOM 2019 CG PRO A 567 62.646 15.978 15.303 1.00 56.82 C ATOM 2020 CD PRO A 567 61.595 16.738 14.521 1.00 52.37 C ATOM 2021 N GLU A 568 59.972 18.029 17.636 1.00 53.54 N ATOM 2022 CA GLU A 568 59.325 18.769 18.711 1.00 57.59 C ATOM 2023 C GLU A 568 57.832 18.456 18.771 1.00 60.36 C ATOM 2024 O GLU A 568 57.275 18.312 19.863 1.00 59.84 O ATOM 2025 CB GLU A 568 59.581 20.267 18.570 1.00 49.52 C ATOM 2026 CG GLU A 568 58.933 20.931 17.401 1.00 49.37 C ATOM 2027 CD GLU A 568 59.790 20.879 16.169 1.00 48.77 C ATOM 2028 OE1 GLU A 568 60.662 19.987 16.084 1.00 44.17 O ATOM 2029 OE2 GLU A 568 59.587 21.742 15.297 1.00 43.34 O ATOM 2030 H GLU A 568 60.346 18.521 16.800 1.00 0.00 H ATOM 2031 N VAL A 569 57.179 18.295 17.615 1.00 58.12 N ATOM 2032 CA VAL A 569 55.768 17.909 17.610 1.00 60.72 C ATOM 2033 C VAL A 569 55.553 16.619 18.396 1.00 57.47 C ATOM 2034 O VAL A 569 54.564 16.478 19.121 1.00 64.77 O ATOM 2035 CB VAL A 569 55.250 17.780 16.167 1.00 55.70 C ATOM 2036 CG1 VAL A 569 54.003 16.951 16.138 1.00 57.59 C ATOM 2037 CG2 VAL A 569 54.950 19.128 15.606 1.00 53.37 C ATOM 2038 H VAL A 569 57.677 18.445 16.715 1.00 0.00 H ATOM 2039 N VAL A 570 56.482 15.671 18.289 1.00 55.67 N ATOM 2040 CA VAL A 570 56.286 14.365 18.919 1.00 60.31 C ATOM 2041 C VAL A 570 56.491 14.452 20.428 1.00 76.56 C ATOM 2042 O VAL A 570 55.664 13.966 21.212 1.00 78.28 O ATOM 2043 CB VAL A 570 57.221 13.314 18.292 1.00 55.89 C ATOM 2044 CG1 VAL A 570 57.194 12.058 19.108 1.00 62.47 C ATOM 2045 CG2 VAL A 570 56.835 13.026 16.856 1.00 59.79 C ATOM 2046 H VAL A 570 57.353 15.860 17.754 1.00 0.00 H ATOM 2047 N MET A 571 57.607 15.058 20.856 1.00 79.84 N ATOM 2048 CA MET A 571 57.976 15.134 22.268 1.00 72.83 C ATOM 2049 C MET A 571 57.120 16.108 23.067 1.00 67.50 C ATOM 2050 O MET A 571 57.405 16.320 24.247 1.00 74.17 O ATOM 2051 CB MET A 571 59.442 15.542 22.405 1.00 78.29 C ATOM 2052 CG MET A 571 60.474 14.444 22.212 1.00 80.58 C ATOM 2053 SD MET A 571 62.124 15.199 22.103 1.00 97.57 S ATOM 2054 CE MET A 571 63.201 13.776 22.347 1.00 94.90 C ATOM 2055 H MET A 571 58.238 15.493 20.153 1.00 0.00 H ATOM 2056 N GLY A 572 56.112 16.727 22.464 1.00 66.34 N ATOM 2057 CA GLY A 572 55.230 17.624 23.162 1.00 64.84 C ATOM 2058 C GLY A 572 55.662 19.074 23.174 1.00 73.77 C ATOM 2059 O GLY A 572 54.808 19.949 23.360 1.00 80.24 O ATOM 2060 H GLY A 572 55.954 16.557 21.450 1.00 0.00 H ATOM 2061 N LYS A 573 56.964 19.352 22.951 1.00 77.14 N ATOM 2062 CA LYS A 573 57.650 20.649 23.009 1.00 68.57 C ATOM 2063 C LYS A 573 56.935 21.736 22.203 1.00 76.36 C ATOM 2064 O LYS A 573 56.046 21.428 21.397 1.00 77.43 O ATOM 2065 CB LYS A 573 59.099 20.475 22.530 1.00 68.36 C ATOM 2066 CG LYS A 573 59.851 19.357 23.243 1.00 65.07 C ATOM 2067 CD LYS A 573 61.321 19.338 22.898 1.00 73.27 C ATOM 2068 CE LYS A 573 62.060 18.314 23.765 1.00 87.24 C ATOM 2069 NZ LYS A 573 63.543 18.283 23.544 1.00 87.14 N ATOM 2070 HZ1 LYS A 573 63.739 18.044 22.551 1.00 0.00 H ATOM 2071 HZ2 LYS A 573 63.944 19.217 23.763 1.00 0.00 H ATOM 2072 HZ3 LYS A 573 63.970 17.567 24.166 1.00 0.00 H ATOM 2073 H LYS A 573 57.562 18.538 22.705 1.00 0.00 H ATOM 2074 N PRO A 574 57.257 23.017 22.405 1.00 85.41 N ATOM 2075 CA PRO A 574 56.485 24.071 21.732 1.00 83.49 C ATOM 2076 C PRO A 574 56.847 24.167 20.263 1.00 78.34 C ATOM 2077 O PRO A 574 57.984 23.914 19.857 1.00 73.96 O ATOM 2078 CB PRO A 574 56.875 25.349 22.484 1.00 82.87 C ATOM 2079 CG PRO A 574 57.503 24.870 23.761 1.00 90.79 C ATOM 2080 CD PRO A 574 58.177 23.582 23.405 1.00 83.87 C ATOM 2081 N CYS A 575 55.857 24.556 19.466 1.00 76.36 N ATOM 2082 CA CYS A 575 55.932 24.433 18.020 1.00 63.08 C ATOM 2083 C CYS A 575 55.679 25.768 17.342 1.00 61.91 C ATOM 2084 O CYS A 575 54.756 26.504 17.722 1.00 59.08 O ATOM 2085 CB CYS A 575 54.930 23.386 17.518 1.00 58.72 C ATOM 2086 SG CYS A 575 55.264 21.713 18.104 1.00 66.23 S ATOM 2087 H CYS A 575 54.999 24.962 19.892 1.00 0.00 H ATOM 2088 N ASP A 576 56.508 26.065 16.333 1.00 56.38 N ATOM 2089 CA ASP A 576 56.331 27.242 15.482 1.00 62.86 C ATOM 2090 C ASP A 576 56.381 26.818 14.008 1.00 49.75 C ATOM 2091 O ASP A 576 56.370 25.619 13.715 1.00 48.33 O ATOM 2092 CB ASP A 576 57.384 28.318 15.826 1.00 53.37 C ATOM 2093 CG ASP A 576 58.803 27.913 15.437 1.00 54.77 C ATOM 2094 OD1 ASP A 576 59.066 26.687 15.339 1.00 47.82 O ATOM 2095 OD2 ASP A 576 59.646 28.828 15.228 1.00 54.14 O ATOM 2096 H ASP A 576 57.312 25.432 16.146 1.00 0.00 H ATOM 2097 N ALA A 577 56.458 27.771 13.074 1.00 43.07 N ATOM 2098 CA ALA A 577 56.380 27.443 11.651 1.00 48.99 C ATOM 2099 C ALA A 577 57.464 26.456 11.220 1.00 48.46 C ATOM 2100 O ALA A 577 57.398 25.898 10.119 1.00 38.28 O ATOM 2101 CB ALA A 577 56.461 28.712 10.797 1.00 34.90 C ATOM 2102 H ALA A 577 56.575 28.763 13.364 1.00 0.00 H ATOM 2103 N LYS A 578 58.449 26.205 12.083 1.00 45.12 N ATOM 2104 CA LYS A 578 59.532 25.310 11.698 1.00 46.84 C ATOM 2105 C LYS A 578 59.073 23.874 11.495 1.00 44.84 C ATOM 2106 O LYS A 578 59.783 23.103 10.839 1.00 46.82 O ATOM 2107 CB LYS A 578 60.657 25.338 12.736 1.00 48.03 C ATOM 2108 CG LYS A 578 61.444 26.646 12.809 1.00 51.76 C ATOM 2109 CD LYS A 578 61.988 27.103 11.465 1.00 43.76 C ATOM 2110 CE LYS A 578 62.944 28.264 11.641 1.00 48.64 C ATOM 2111 NZ LYS A 578 63.990 27.964 12.668 1.00 55.09 N ATOM 2112 HZ1 LYS A 578 63.532 27.773 13.582 1.00 0.00 H ATOM 2113 HZ2 LYS A 578 64.536 27.130 12.372 1.00 0.00 H ATOM 2114 HZ3 LYS A 578 64.626 28.781 12.762 1.00 0.00 H ATOM 2115 H LYS A 578 58.444 26.645 13.025 1.00 0.00 H ATOM 2116 N VAL A 579 57.917 23.481 12.037 1.00 43.51 N ATOM 2117 CA VAL A 579 57.520 22.088 11.846 1.00 46.53 C ATOM 2118 C VAL A 579 57.155 21.833 10.388 1.00 40.97 C ATOM 2119 O VAL A 579 57.381 20.733 9.881 1.00 41.06 O ATOM 2120 CB VAL A 579 56.368 21.679 12.788 1.00 44.87 C ATOM 2121 CG1 VAL A 579 56.699 22.008 14.226 1.00 46.33 C ATOM 2122 CG2 VAL A 579 55.102 22.336 12.367 1.00 39.20 C ATOM 2123 H VAL A 579 57.322 24.142 12.575 1.00 0.00 H ATOM 2124 N ASP A 580 56.600 22.830 9.693 1.00 35.87 N ATOM 2125 CA ASP A 580 56.351 22.684 8.267 1.00 37.85 C ATOM 2126 C ASP A 580 57.641 22.359 7.514 1.00 40.99 C ATOM 2127 O ASP A 580 57.644 21.553 6.582 1.00 45.02 O ATOM 2128 CB ASP A 580 55.699 23.962 7.708 1.00 39.42 C ATOM 2129 CG ASP A 580 54.183 24.012 7.934 1.00 43.80 C ATOM 2130 OD1 ASP A 580 53.601 23.003 8.388 1.00 40.02 O ATOM 2131 OD2 ASP A 580 53.563 25.055 7.642 1.00 37.16 O ATOM 2132 H ASP A 580 56.344 23.716 10.174 1.00 0.00 H ATOM 2133 N ILE A 581 58.756 22.959 7.921 1.00 44.08 N ATOM 2134 CA ILE A 581 60.000 22.781 7.190 1.00 37.57 C ATOM 2135 C ILE A 581 60.511 21.360 7.344 1.00 41.11 C ATOM 2136 O ILE A 581 60.928 20.729 6.370 1.00 40.47 O ATOM 2137 CB ILE A 581 61.028 23.799 7.681 1.00 43.20 C ATOM 2138 CG1 ILE A 581 60.390 25.183 7.732 1.00 40.29 C ATOM 2139 CG2 ILE A 581 62.265 23.749 6.804 1.00 45.88 C ATOM 2140 CD1 ILE A 581 60.014 25.718 6.409 1.00 35.83 C ATOM 2141 H ILE A 581 58.738 23.560 8.769 1.00 0.00 H ATOM 2142 N TRP A 582 60.495 20.832 8.565 1.00 38.92 N ATOM 2143 CA TRP A 582 60.771 19.414 8.735 1.00 38.90 C ATOM 2144 C TRP A 582 59.925 18.556 7.796 1.00 42.22 C ATOM 2145 O TRP A 582 60.435 17.633 7.150 1.00 40.27 O ATOM 2146 CB TRP A 582 60.517 19.023 10.172 1.00 37.49 C ATOM 2147 CG TRP A 582 60.734 17.611 10.409 1.00 37.30 C ATOM 2148 CD1 TRP A 582 59.892 16.600 10.117 1.00 37.71 C ATOM 2149 CD2 TRP A 582 61.890 17.022 10.998 1.00 43.49 C ATOM 2150 NE1 TRP A 582 60.438 15.402 10.486 1.00 44.12 N ATOM 2151 CE2 TRP A 582 61.671 15.634 11.038 1.00 46.06 C ATOM 2152 CE3 TRP A 582 63.091 17.533 11.502 1.00 42.09 C ATOM 2153 CZ2 TRP A 582 62.613 14.741 11.564 1.00 46.51 C ATOM 2154 CZ3 TRP A 582 64.019 16.647 12.030 1.00 43.86 C ATOM 2155 CH2 TRP A 582 63.777 15.269 12.051 1.00 45.16 C ATOM 2156 HE1 TRP A 582 59.992 14.470 10.368 1.00 0.00 H ATOM 2157 H TRP A 582 60.287 21.428 9.391 1.00 0.00 H ATOM 2158 N SER A 583 58.621 18.847 7.711 1.00 47.29 N ATOM 2159 CA SER A 583 57.724 18.050 6.878 1.00 42.11 C ATOM 2160 C SER A 583 58.113 18.139 5.422 1.00 37.18 C ATOM 2161 O SER A 583 58.305 17.118 4.766 1.00 38.57 O ATOM 2162 CB SER A 583 56.287 18.503 7.061 1.00 40.54 C ATOM 2163 OG SER A 583 55.861 18.159 8.358 1.00 40.98 O ATOM 2164 HG SER A 583 55.920 17.178 8.474 1.00 0.00 H ATOM 2165 H SER A 583 58.241 19.653 8.247 1.00 0.00 H ATOM 2166 N SER A 584 58.259 19.355 4.911 1.00 33.63 N ATOM 2167 CA SER A 584 58.642 19.536 3.522 1.00 37.40 C ATOM 2168 C SER A 584 59.887 18.734 3.163 1.00 41.68 C ATOM 2169 O SER A 584 60.049 18.316 2.006 1.00 45.59 O ATOM 2170 CB SER A 584 58.865 21.014 3.228 1.00 36.59 C ATOM 2171 OG SER A 584 59.980 21.494 3.939 1.00 38.89 O ATOM 2172 HG SER A 584 59.826 21.378 4.910 1.00 0.00 H ATOM 2173 H SER A 584 58.097 20.188 5.512 1.00 0.00 H ATOM 2174 N CYS A 585 60.764 18.479 4.130 1.00 38.53 N ATOM 2175 CA CYS A 585 61.964 17.731 3.796 1.00 39.84 C ATOM 2176 C CYS A 585 61.732 16.235 3.887 1.00 39.34 C ATOM 2177 O CYS A 585 62.388 15.472 3.171 1.00 42.92 O ATOM 2178 CB CYS A 585 63.128 18.161 4.689 1.00 40.14 C ATOM 2179 SG CYS A 585 63.731 19.814 4.320 1.00 36.21 S ATOM 2180 H CYS A 585 60.595 18.807 5.102 1.00 0.00 H ATOM 2181 N CYS A 586 60.813 15.801 4.750 1.00 41.18 N ATOM 2182 CA CYS A 586 60.320 14.428 4.673 1.00 42.65 C ATOM 2183 C CYS A 586 59.620 14.196 3.350 1.00 34.11 C ATOM 2184 O CYS A 586 59.722 13.119 2.760 1.00 36.27 O ATOM 2185 CB CYS A 586 59.358 14.144 5.829 1.00 39.92 C ATOM 2186 SG CYS A 586 60.101 14.089 7.420 1.00 43.75 S ATOM 2187 H CYS A 586 60.446 16.443 5.481 1.00 0.00 H ATOM 2188 N MET A 587 58.873 15.196 2.897 1.00 35.65 N ATOM 2189 CA MET A 587 58.291 15.148 1.572 1.00 38.37 C ATOM 2190 C MET A 587 59.378 15.047 0.515 1.00 40.18 C ATOM 2191 O MET A 587 59.244 14.272 -0.438 1.00 42.59 O ATOM 2192 CB MET A 587 57.397 16.374 1.337 1.00 33.12 C ATOM 2193 CG MET A 587 56.645 16.303 0.005 1.00 35.39 C ATOM 2194 SD MET A 587 55.619 17.700 -0.477 1.00 33.82 S ATOM 2195 CE MET A 587 56.795 19.045 -0.488 1.00 30.99 C ATOM 2196 H MET A 587 58.704 16.025 3.502 1.00 0.00 H ATOM 2197 N MET A 588 60.472 15.803 0.673 1.00 36.45 N ATOM 2198 CA MET A 588 61.555 15.750 -0.311 1.00 40.31 C ATOM 2199 C MET A 588 62.103 14.336 -0.445 1.00 41.18 C ATOM 2200 O MET A 588 62.255 13.813 -1.556 1.00 45.24 O ATOM 2201 CB MET A 588 62.676 16.723 0.073 1.00 41.84 C ATOM 2202 CG MET A 588 63.808 16.869 -0.962 1.00 37.27 C ATOM 2203 SD MET A 588 63.231 17.242 -2.620 1.00 45.53 S ATOM 2204 CE MET A 588 64.731 17.612 -3.509 1.00 40.91 C ATOM 2205 H MET A 588 60.553 16.431 1.498 1.00 0.00 H ATOM 2206 N LEU A 589 62.394 13.702 0.689 1.00 42.14 N ATOM 2207 CA LEU A 589 62.916 12.340 0.692 1.00 41.66 C ATOM 2208 C LEU A 589 61.959 11.388 0.006 1.00 42.79 C ATOM 2209 O LEU A 589 62.382 10.519 -0.761 1.00 46.30 O ATOM 2210 CB LEU A 589 63.166 11.886 2.132 1.00 36.84 C ATOM 2211 CG LEU A 589 64.264 12.621 2.895 1.00 43.90 C ATOM 2212 CD1 LEU A 589 64.205 12.282 4.368 1.00 45.61 C ATOM 2213 CD2 LEU A 589 65.613 12.246 2.304 1.00 43.67 C ATOM 2214 H LEU A 589 62.245 14.190 1.595 1.00 0.00 H ATOM 2215 N HIS A 590 60.666 11.522 0.303 1.00 40.41 N ATOM 2216 CA HIS A 590 59.646 10.737 -0.367 1.00 38.35 C ATOM 2217 C HIS A 590 59.725 10.927 -1.883 1.00 43.22 C ATOM 2218 O HIS A 590 59.710 9.955 -2.645 1.00 44.77 O ATOM 2219 CB HIS A 590 58.284 11.146 0.189 1.00 40.71 C ATOM 2220 CG HIS A 590 57.126 10.404 -0.400 1.00 42.58 C ATOM 2221 ND1 HIS A 590 55.857 10.932 -0.444 1.00 43.54 N ATOM 2222 CD2 HIS A 590 57.036 9.167 -0.942 1.00 44.69 C ATOM 2223 CE1 HIS A 590 55.033 10.053 -0.985 1.00 41.44 C ATOM 2224 NE2 HIS A 590 55.726 8.975 -1.300 1.00 42.68 N ATOM 2225 H HIS A 590 60.382 12.206 1.033 1.00 0.00 H ATOM 2226 N MET A 591 59.834 12.177 -2.337 1.00 35.67 N ATOM 2227 CA MET A 591 59.928 12.431 -3.768 1.00 40.83 C ATOM 2228 C MET A 591 61.149 11.750 -4.368 1.00 49.08 C ATOM 2229 O MET A 591 61.100 11.250 -5.503 1.00 39.24 O ATOM 2230 CB MET A 591 59.995 13.931 -4.033 1.00 41.63 C ATOM 2231 CG MET A 591 58.676 14.593 -4.365 1.00 36.39 C ATOM 2232 SD MET A 591 58.930 16.343 -4.743 1.00 38.80 S ATOM 2233 CE MET A 591 59.587 16.906 -3.169 1.00 40.61 C ATOM 2234 H MET A 591 59.852 12.972 -1.667 1.00 0.00 H ATOM 2235 N LEU A 592 62.261 11.731 -3.620 1.00 45.10 N ATOM 2236 CA LEU A 592 63.503 11.196 -4.153 1.00 43.33 C ATOM 2237 C LEU A 592 63.545 9.684 -4.030 1.00 45.47 C ATOM 2238 O LEU A 592 63.918 8.985 -4.977 1.00 53.46 O ATOM 2239 CB LEU A 592 64.699 11.816 -3.444 1.00 39.21 C ATOM 2240 CG LEU A 592 64.958 13.295 -3.664 1.00 45.89 C ATOM 2241 CD1 LEU A 592 65.888 13.796 -2.590 1.00 45.47 C ATOM 2242 CD2 LEU A 592 65.565 13.510 -5.013 1.00 41.46 C ATOM 2243 H LEU A 592 62.235 12.103 -2.649 1.00 0.00 H ATOM 2244 N ASN A 593 63.171 9.156 -2.878 1.00 39.57 N ATOM 2245 CA ASN A 593 63.307 7.723 -2.694 1.00 45.27 C ATOM 2246 C ASN A 593 62.110 6.955 -3.221 1.00 50.50 C ATOM 2247 O ASN A 593 62.244 5.770 -3.534 1.00 58.82 O ATOM 2248 CB ASN A 593 63.513 7.387 -1.217 1.00 50.58 C ATOM 2249 CG ASN A 593 64.807 7.942 -0.664 1.00 55.21 C ATOM 2250 OD1 ASN A 593 65.830 8.006 -1.348 1.00 59.39 O ATOM 2251 ND2 ASN A 593 64.770 8.336 0.592 1.00 62.43 N ATOM 2252 HD22 ASN A 593 63.885 8.264 1.134 1.00 0.00 H ATOM 2253 HD21 ASN A 593 65.626 8.719 1.042 1.00 0.00 H ATOM 2254 H ASN A 593 62.787 9.755 -2.119 1.00 0.00 H ATOM 2255 N GLY A 594 60.955 7.599 -3.342 1.00 47.16 N ATOM 2256 CA GLY A 594 59.738 6.880 -3.611 1.00 45.34 C ATOM 2257 C GLY A 594 59.097 6.276 -2.384 1.00 46.09 C ATOM 2258 O GLY A 594 58.140 5.508 -2.518 1.00 47.27 O ATOM 2259 H GLY A 594 60.930 8.634 -3.241 1.00 0.00 H ATOM 2260 N CYS A 595 59.594 6.580 -1.190 1.00 45.09 N ATOM 2261 CA CYS A 595 58.884 6.161 0.007 1.00 45.34 C ATOM 2262 C CYS A 595 59.107 7.156 1.138 1.00 42.84 C ATOM 2263 O CYS A 595 60.025 7.979 1.112 1.00 47.22 O ATOM 2264 CB CYS A 595 59.293 4.761 0.449 1.00 41.70 C ATOM 2265 SG CYS A 595 60.912 4.700 1.111 1.00 64.05 S ATOM 2266 H CYS A 595 60.484 7.113 -1.113 1.00 0.00 H ATOM 2267 N HIS A 596 58.235 7.064 2.131 1.00 44.39 N ATOM 2268 CA HIS A 596 58.307 7.932 3.279 1.00 42.76 C ATOM 2269 C HIS A 596 59.576 7.654 4.070 1.00 46.69 C ATOM 2270 O HIS A 596 60.035 6.510 4.128 1.00 60.55 O ATOM 2271 CB HIS A 596 57.087 7.726 4.168 1.00 43.74 C ATOM 2272 CG HIS A 596 55.828 8.282 3.587 1.00 49.51 C ATOM 2273 ND1 HIS A 596 54.747 8.646 4.364 1.00 48.47 N ATOM 2274 CD2 HIS A 596 55.487 8.559 2.304 1.00 42.85 C ATOM 2275 CE1 HIS A 596 53.793 9.116 3.580 1.00 51.95 C ATOM 2276 NE2 HIS A 596 54.215 9.074 2.327 1.00 48.02 N ATOM 2277 H HIS A 596 57.481 6.349 2.081 1.00 0.00 H ATOM 2278 N PRO A 597 60.149 8.675 4.710 1.00 48.21 N ATOM 2279 CA PRO A 597 61.209 8.418 5.690 1.00 54.98 C ATOM 2280 C PRO A 597 60.727 7.473 6.782 1.00 54.48 C ATOM 2281 O PRO A 597 59.530 7.310 7.030 1.00 46.16 O ATOM 2282 CB PRO A 597 61.525 9.808 6.254 1.00 48.96 C ATOM 2283 CG PRO A 597 60.248 10.604 6.035 1.00 46.24 C ATOM 2284 CD PRO A 597 59.681 10.078 4.749 1.00 50.05 C ATOM 2285 N TRP A 598 61.697 6.815 7.397 1.00 56.33 N ATOM 2286 CA TRP A 598 61.483 5.969 8.561 1.00 61.72 C ATOM 2287 C TRP A 598 60.853 4.608 8.248 1.00 71.66 C ATOM 2288 O TRP A 598 61.146 3.646 8.959 1.00 76.87 O ATOM 2289 CB TRP A 598 60.620 6.689 9.602 1.00 60.45 C ATOM 2290 CG TRP A 598 61.078 8.049 10.069 1.00 55.44 C ATOM 2291 CD1 TRP A 598 60.467 9.236 9.818 1.00 53.13 C ATOM 2292 CD2 TRP A 598 62.192 8.346 10.926 1.00 52.75 C ATOM 2293 NE1 TRP A 598 61.137 10.258 10.439 1.00 54.89 N ATOM 2294 CE2 TRP A 598 62.196 9.736 11.134 1.00 57.02 C ATOM 2295 CE3 TRP A 598 63.183 7.574 11.535 1.00 57.26 C ATOM 2296 CZ2 TRP A 598 63.161 10.374 11.919 1.00 59.32 C ATOM 2297 CZ3 TRP A 598 64.135 8.208 12.316 1.00 62.19 C ATOM 2298 CH2 TRP A 598 64.119 9.594 12.499 1.00 57.90 C ATOM 2299 HE1 TRP A 598 60.883 11.265 10.390 1.00 0.00 H ATOM 2300 H TRP A 598 62.665 6.908 7.028 1.00 0.00 H ATOM 2301 N THR A 599 59.990 4.494 7.220 1.00 75.53 N ATOM 2302 CA THR A 599 59.202 3.259 7.052 1.00 73.54 C ATOM 2303 C THR A 599 60.077 2.037 6.785 1.00 80.75 C ATOM 2304 O THR A 599 59.678 0.908 7.101 1.00 83.15 O ATOM 2305 CB THR A 599 58.162 3.375 5.919 1.00 68.29 C ATOM 2306 OG1 THR A 599 58.798 3.672 4.660 1.00 68.93 O ATOM 2307 CG2 THR A 599 57.053 4.406 6.253 1.00 58.18 C ATOM 2308 HG1 THR A 599 59.286 4.531 4.732 1.00 0.00 H ATOM 2309 H THR A 599 59.879 5.277 6.545 1.00 0.00 H ATOM 2310 N GLN A 600 61.253 2.231 6.191 1.00 76.09 N ATOM 2311 CA GLN A 600 62.157 1.108 5.979 1.00 86.40 C ATOM 2312 C GLN A 600 62.725 0.619 7.307 1.00 90.33 C ATOM 2313 O GLN A 600 62.456 -0.506 7.745 1.00 95.79 O ATOM 2314 CB GLN A 600 63.288 1.517 5.027 1.00 87.45 C ATOM 2315 CG GLN A 600 62.872 2.448 3.884 1.00 90.88 C ATOM 2316 CD GLN A 600 62.288 1.717 2.676 1.00 91.54 C ATOM 2317 OE1 GLN A 600 62.932 1.619 1.618 1.00 85.97 O ATOM 2318 NE2 GLN A 600 61.058 1.215 2.822 1.00 86.86 N ATOM 2319 HE22 GLN A 600 60.557 1.321 3.727 1.00 0.00 H ATOM 2320 HE21 GLN A 600 60.602 0.718 2.030 1.00 0.00 H ATOM 2321 H GLN A 600 61.526 3.184 5.878 1.00 0.00 H ATOM 2322 N TYR A 601 63.465 1.488 7.989 1.00 90.30 N ATOM 2323 CA TYR A 601 64.349 1.082 9.072 1.00 94.17 C ATOM 2324 C TYR A 601 63.614 0.674 10.348 1.00 91.21 C ATOM 2325 O TYR A 601 64.190 -0.048 11.166 1.00 87.39 O ATOM 2326 CB TYR A 601 65.332 2.225 9.346 1.00 95.23 C ATOM 2327 CG TYR A 601 66.054 2.666 8.084 1.00100.26 C ATOM 2328 CD1 TYR A 601 67.266 2.086 7.713 1.00 96.62 C ATOM 2329 CD2 TYR A 601 65.507 3.638 7.243 1.00 92.76 C ATOM 2330 CE1 TYR A 601 67.924 2.477 6.548 1.00 98.27 C ATOM 2331 CE2 TYR A 601 66.156 4.032 6.073 1.00 89.20 C ATOM 2332 CZ TYR A 601 67.365 3.451 5.731 1.00 95.25 C ATOM 2333 OH TYR A 601 68.015 3.841 4.573 1.00 84.50 O ATOM 2334 HH TYR A 601 68.858 3.330 4.481 1.00 0.00 H ATOM 2335 H TYR A 601 63.410 2.496 7.739 1.00 0.00 H ATOM 2336 N PHE A 602 62.365 1.098 10.541 1.00 92.08 N ATOM 2337 CA PHE A 602 61.688 0.897 11.817 1.00 94.10 C ATOM 2338 C PHE A 602 60.257 0.422 11.592 1.00 95.63 C ATOM 2339 O PHE A 602 59.570 0.890 10.680 1.00 90.67 O ATOM 2340 CB PHE A 602 61.718 2.191 12.657 1.00 85.24 C ATOM 2341 CG PHE A 602 63.100 2.785 12.801 1.00 92.25 C ATOM 2342 CD1 PHE A 602 64.011 2.256 13.711 1.00 94.06 C ATOM 2343 CD2 PHE A 602 63.499 3.860 12.011 1.00 89.57 C ATOM 2344 CE1 PHE A 602 65.289 2.796 13.835 1.00 86.32 C ATOM 2345 CE2 PHE A 602 64.777 4.405 12.132 1.00 81.47 C ATOM 2346 CZ PHE A 602 65.667 3.873 13.043 1.00 86.29 C ATOM 2347 H PHE A 602 61.864 1.581 9.768 1.00 0.00 H ATOM 2348 N ARG A 603 59.813 -0.513 12.430 1.00 99.46 N ATOM 2349 CA ARG A 603 58.508 -1.142 12.274 1.00101.44 C ATOM 2350 C ARG A 603 57.487 -0.653 13.290 1.00103.60 C ATOM 2351 O ARG A 603 56.358 -0.327 12.911 1.00106.59 O ATOM 2352 CB ARG A 603 58.644 -2.674 12.361 1.00104.50 C ATOM 2353 CG ARG A 603 59.261 -3.327 11.114 1.00108.02 C ATOM 2354 CD ARG A 603 59.262 -4.867 11.198 1.00112.82 C ATOM 2355 NE ARG A 603 57.918 -5.447 11.323 1.00108.14 N ATOM 2356 CZ ARG A 603 57.679 -6.725 11.619 1.00 93.52 C ATOM 2357 NH1 ARG A 603 58.700 -7.554 11.821 1.00 76.00 N ATOM 2358 NH2 ARG A 603 56.425 -7.173 11.727 1.00 78.69 N ATOM 2359 HE ARG A 603 57.101 -4.821 11.171 1.00 0.00 H ATOM 2360 HH12 ARG A 603 58.522 -8.552 12.052 1.00 0.00 H ATOM 2361 HH11 ARG A 603 59.677 -7.204 11.748 1.00 0.00 H ATOM 2362 HH22 ARG A 603 56.248 -8.171 11.958 1.00 0.00 H ATOM 2363 HH21 ARG A 603 55.626 -6.523 11.580 1.00 0.00 H ATOM 2364 H ARG A 603 60.419 -0.804 13.223 1.00 0.00 H ATOM 2365 N GLY A 604 57.862 -0.574 14.572 1.00108.09 N ATOM 2366 CA GLY A 604 56.943 -0.240 15.646 1.00 94.59 C ATOM 2367 C GLY A 604 56.476 1.203 15.629 1.00 84.86 C ATOM 2368 O GLY A 604 56.621 1.903 14.625 1.00 87.38 O ATOM 2369 H GLY A 604 58.857 -0.760 14.810 1.00 0.00 H ATOM 2370 N PRO A 605 55.888 1.677 16.748 1.00 81.29 N ATOM 2371 CA PRO A 605 55.358 3.056 16.796 1.00 79.02 C ATOM 2372 C PRO A 605 56.381 4.117 16.414 1.00 77.82 C ATOM 2373 O PRO A 605 57.299 4.437 17.180 1.00 79.76 O ATOM 2374 CB PRO A 605 54.905 3.208 18.253 1.00 79.86 C ATOM 2375 CG PRO A 605 54.563 1.811 18.675 1.00 83.86 C ATOM 2376 CD PRO A 605 55.537 0.903 17.949 1.00 83.68 C ATOM 2377 N LEU A 606 56.201 4.674 15.214 1.00 73.58 N ATOM 2378 CA LEU A 606 57.267 5.426 14.556 1.00 70.00 C ATOM 2379 C LEU A 606 57.660 6.658 15.352 1.00 69.39 C ATOM 2380 O LEU A 606 58.837 7.038 15.385 1.00 68.12 O ATOM 2381 CB LEU A 606 56.827 5.820 13.147 1.00 60.78 C ATOM 2382 CG LEU A 606 57.555 5.190 11.962 1.00 64.14 C ATOM 2383 CD1 LEU A 606 57.785 3.708 12.161 1.00 77.84 C ATOM 2384 CD2 LEU A 606 56.768 5.405 10.694 1.00 60.36 C ATOM 2385 H LEU A 606 55.282 4.570 14.737 1.00 0.00 H ATOM 2386 N CYS A 607 56.689 7.292 16.003 1.00 68.47 N ATOM 2387 CA CYS A 607 56.964 8.546 16.687 1.00 68.69 C ATOM 2388 C CYS A 607 57.952 8.372 17.831 1.00 69.73 C ATOM 2389 O CYS A 607 58.522 9.364 18.289 1.00 71.08 O ATOM 2390 CB CYS A 607 55.658 9.155 17.193 1.00 71.20 C ATOM 2391 SG CYS A 607 54.689 8.009 18.165 1.00 72.64 S ATOM 2392 H CYS A 607 55.730 6.890 16.023 1.00 0.00 H ATOM 2393 N LEU A 608 58.172 7.139 18.297 1.00 74.14 N ATOM 2394 CA LEU A 608 59.195 6.900 19.310 1.00 71.49 C ATOM 2395 C LEU A 608 60.590 7.033 18.720 1.00 74.63 C ATOM 2396 O LEU A 608 61.474 7.639 19.338 1.00 73.06 O ATOM 2397 CB LEU A 608 59.024 5.517 19.934 1.00 68.15 C ATOM 2398 CG LEU A 608 57.771 5.231 20.753 1.00 78.69 C ATOM 2399 CD1 LEU A 608 57.954 3.894 21.441 1.00 85.24 C ATOM 2400 CD2 LEU A 608 57.487 6.344 21.771 1.00 88.15 C ATOM 2401 H LEU A 608 57.609 6.343 17.935 1.00 0.00 H ATOM 2402 N LYS A 609 60.807 6.465 17.529 1.00 74.51 N ATOM 2403 CA LYS A 609 62.086 6.638 16.851 1.00 72.51 C ATOM 2404 C LYS A 609 62.316 8.093 16.446 1.00 73.72 C ATOM 2405 O LYS A 609 63.460 8.559 16.462 1.00 72.00 O ATOM 2406 CB LYS A 609 62.165 5.733 15.620 1.00 67.56 C ATOM 2407 CG LYS A 609 61.801 4.269 15.853 1.00 73.32 C ATOM 2408 CD LYS A 609 62.722 3.564 16.852 1.00 84.16 C ATOM 2409 CE LYS A 609 62.469 2.048 16.851 1.00 81.83 C ATOM 2410 NZ LYS A 609 63.158 1.316 17.953 1.00 77.72 N ATOM 2411 HZ1 LYS A 609 64.185 1.456 17.871 1.00 0.00 H ATOM 2412 HZ2 LYS A 609 62.829 1.682 18.869 1.00 0.00 H ATOM 2413 HZ3 LYS A 609 62.939 0.302 17.884 1.00 0.00 H ATOM 2414 H LYS A 609 60.059 5.896 17.084 1.00 0.00 H ATOM 2415 N ILE A 610 61.253 8.830 16.097 1.00 63.57 N ATOM 2416 CA ILE A 610 61.437 10.204 15.637 1.00 61.34 C ATOM 2417 C ILE A 610 62.106 11.060 16.711 1.00 68.50 C ATOM 2418 O ILE A 610 62.897 11.960 16.401 1.00 68.97 O ATOM 2419 CB ILE A 610 60.089 10.795 15.166 1.00 58.04 C ATOM 2420 CG1 ILE A 610 59.777 10.297 13.760 1.00 53.85 C ATOM 2421 CG2 ILE A 610 60.089 12.334 15.197 1.00 54.11 C ATOM 2422 CD1 ILE A 610 59.049 11.321 12.899 1.00 55.85 C ATOM 2423 H ILE A 610 60.297 8.424 16.154 1.00 0.00 H ATOM 2424 N ALA A 611 61.848 10.770 17.983 1.00 71.13 N ATOM 2425 CA ALA A 611 62.364 11.594 19.066 1.00 64.39 C ATOM 2426 C ALA A 611 63.749 11.174 19.537 1.00 69.77 C ATOM 2427 O ALA A 611 64.538 12.032 19.957 1.00 71.66 O ATOM 2428 CB ALA A 611 61.395 11.560 20.246 1.00 68.80 C ATOM 2429 H ALA A 611 61.266 9.938 18.208 1.00 0.00 H ATOM 2430 N SER A 612 64.055 9.875 19.487 1.00 67.45 N ATOM 2431 CA SER A 612 65.319 9.330 19.975 1.00 74.34 C ATOM 2432 C SER A 612 66.401 9.325 18.900 1.00 73.03 C ATOM 2433 O SER A 612 67.540 9.728 19.155 1.00 70.68 O ATOM 2434 CB SER A 612 65.102 7.905 20.512 1.00 78.06 C ATOM 2435 OG SER A 612 64.607 7.038 19.502 1.00 77.57 O ATOM 2436 HG SER A 612 65.257 6.997 18.756 1.00 0.00 H ATOM 2437 H SER A 612 63.358 9.219 19.080 1.00 0.00 H ATOM 2438 N GLU A 613 66.048 8.880 17.698 1.00 69.32 N ATOM 2439 CA GLU A 613 66.998 8.682 16.631 1.00 62.49 C ATOM 2440 C GLU A 613 67.527 10.005 16.096 1.00 67.79 C ATOM 2441 O GLU A 613 66.957 11.068 16.352 1.00 65.44 O ATOM 2442 CB GLU A 613 66.344 7.902 15.500 1.00 72.80 C ATOM 2443 CG GLU A 613 65.877 6.547 15.932 1.00 77.84 C ATOM 2444 CD GLU A 613 66.925 5.847 16.766 1.00 88.34 C ATOM 2445 OE1 GLU A 613 68.047 5.606 16.250 1.00 92.33 O ATOM 2446 OE2 GLU A 613 66.630 5.564 17.948 1.00 93.36 O ATOM 2447 H GLU A 613 65.046 8.666 17.520 1.00 0.00 H ATOM 2448 N PRO A 614 68.634 9.957 15.357 1.00 70.14 N ATOM 2449 CA PRO A 614 69.092 11.131 14.597 1.00 69.37 C ATOM 2450 C PRO A 614 68.162 11.413 13.428 1.00 61.49 C ATOM 2451 O PRO A 614 67.452 10.506 12.961 1.00 57.35 O ATOM 2452 CB PRO A 614 70.481 10.704 14.099 1.00 64.52 C ATOM 2453 CG PRO A 614 70.855 9.536 14.925 1.00 62.02 C ATOM 2454 CD PRO A 614 69.617 8.864 15.336 1.00 61.25 C ATOM 2455 N PRO A 615 68.152 12.644 12.912 1.00 59.14 N ATOM 2456 CA PRO A 615 67.254 12.957 11.810 1.00 54.08 C ATOM 2457 C PRO A 615 67.542 12.059 10.628 1.00 53.77 C ATOM 2458 O PRO A 615 68.701 11.685 10.375 1.00 59.62 O ATOM 2459 CB PRO A 615 67.575 14.427 11.489 1.00 51.66 C ATOM 2460 CG PRO A 615 68.405 14.919 12.577 1.00 54.03 C ATOM 2461 CD PRO A 615 69.096 13.741 13.169 1.00 64.11 C ATOM 2462 N PRO A 616 66.537 11.698 9.883 1.00 56.19 N ATOM 2463 CA PRO A 616 66.702 10.653 8.867 1.00 61.06 C ATOM 2464 C PRO A 616 67.540 11.058 7.668 1.00 54.18 C ATOM 2465 O PRO A 616 67.193 10.670 6.553 1.00 53.83 O ATOM 2466 CB PRO A 616 65.259 10.370 8.435 1.00 57.97 C ATOM 2467 CG PRO A 616 64.589 11.693 8.615 1.00 56.03 C ATOM 2468 CD PRO A 616 65.189 12.288 9.858 1.00 56.80 C ATOM 2469 N ILE A 617 68.638 11.797 7.853 1.00 53.49 N ATOM 2470 CA ILE A 617 69.424 12.199 6.687 1.00 51.12 C ATOM 2471 C ILE A 617 70.175 11.027 6.053 1.00 54.92 C ATOM 2472 O ILE A 617 70.606 11.131 4.898 1.00 49.17 O ATOM 2473 CB ILE A 617 70.393 13.342 7.028 1.00 46.00 C ATOM 2474 CG1 ILE A 617 71.078 13.102 8.374 1.00 59.45 C ATOM 2475 CG2 ILE A 617 69.664 14.652 7.014 1.00 40.77 C ATOM 2476 CD1 ILE A 617 72.170 14.139 8.706 1.00 56.65 C ATOM 2477 H ILE A 617 68.929 12.081 8.810 1.00 0.00 H ATOM 2478 N ARG A 618 70.315 9.901 6.767 1.00 58.37 N ATOM 2479 CA ARG A 618 70.843 8.673 6.172 1.00 54.64 C ATOM 2480 C ARG A 618 70.130 8.310 4.870 1.00 52.59 C ATOM 2481 O ARG A 618 70.722 7.664 4.003 1.00 57.23 O ATOM 2482 CB ARG A 618 70.715 7.519 7.176 1.00 60.88 C ATOM 2483 CG ARG A 618 69.261 7.086 7.444 1.00 75.19 C ATOM 2484 CD ARG A 618 69.029 6.488 8.837 1.00 87.77 C ATOM 2485 NE ARG A 618 69.341 5.060 8.900 1.00 99.50 N ATOM 2486 CZ ARG A 618 68.995 4.264 9.909 1.00102.77 C ATOM 2487 NH1 ARG A 618 68.318 4.764 10.937 1.00101.30 N ATOM 2488 NH2 ARG A 618 69.321 2.974 9.893 1.00 97.97 N ATOM 2489 HE ARG A 618 69.866 4.641 8.106 1.00 0.00 H ATOM 2490 HH12 ARG A 618 68.044 4.148 11.729 1.00 0.00 H ATOM 2491 HH11 ARG A 618 68.062 5.772 10.950 1.00 0.00 H ATOM 2492 HH22 ARG A 618 69.047 2.359 10.685 1.00 0.00 H ATOM 2493 HH21 ARG A 618 69.850 2.581 9.088 1.00 0.00 H ATOM 2494 H ARG A 618 70.041 9.900 7.770 1.00 0.00 H ATOM 2495 N GLU A 619 68.870 8.721 4.714 1.00 52.19 N ATOM 2496 CA GLU A 619 68.039 8.362 3.574 1.00 56.64 C ATOM 2497 C GLU A 619 68.215 9.299 2.376 1.00 53.73 C ATOM 2498 O GLU A 619 67.562 9.084 1.343 1.00 52.10 O ATOM 2499 CB GLU A 619 66.559 8.355 3.977 1.00 51.90 C ATOM 2500 CG GLU A 619 66.265 7.717 5.280 1.00 52.97 C ATOM 2501 CD GLU A 619 64.811 7.292 5.389 1.00 67.50 C ATOM 2502 OE1 GLU A 619 64.080 7.326 4.373 1.00 64.29 O ATOM 2503 OE2 GLU A 619 64.392 6.916 6.501 1.00 75.92 O ATOM 2504 H GLU A 619 68.459 9.332 5.448 1.00 0.00 H ATOM 2505 N ILE A 620 69.046 10.337 2.495 1.00 51.29 N ATOM 2506 CA ILE A 620 69.312 11.249 1.381 1.00 47.77 C ATOM 2507 C ILE A 620 70.049 10.461 0.306 1.00 48.72 C ATOM 2508 O ILE A 620 71.104 9.875 0.598 1.00 51.33 O ATOM 2509 CB ILE A 620 70.155 12.458 1.806 1.00 39.81 C ATOM 2510 CG1 ILE A 620 69.378 13.387 2.738 1.00 41.51 C ATOM 2511 CG2 ILE A 620 70.604 13.218 0.592 1.00 40.57 C ATOM 2512 CD1 ILE A 620 70.158 14.633 3.131 1.00 42.94 C ATOM 2513 H ILE A 620 69.519 10.503 3.406 1.00 0.00 H ATOM 2514 N PRO A 621 69.554 10.428 -0.928 1.00 49.19 N ATOM 2515 CA PRO A 621 70.230 9.662 -1.983 1.00 55.39 C ATOM 2516 C PRO A 621 71.657 10.145 -2.180 1.00 54.36 C ATOM 2517 O PRO A 621 71.923 11.356 -2.205 1.00 53.30 O ATOM 2518 CB PRO A 621 69.369 9.930 -3.229 1.00 58.31 C ATOM 2519 CG PRO A 621 68.086 10.484 -2.710 1.00 55.85 C ATOM 2520 CD PRO A 621 68.420 11.203 -1.451 1.00 48.84 C ATOM 2521 N PRO A 622 72.608 9.224 -2.330 1.00 59.52 N ATOM 2522 CA PRO A 622 74.022 9.635 -2.417 1.00 54.61 C ATOM 2523 C PRO A 622 74.401 10.260 -3.752 1.00 52.63 C ATOM 2524 O PRO A 622 75.437 10.929 -3.820 1.00 65.94 O ATOM 2525 CB PRO A 622 74.783 8.326 -2.179 1.00 55.66 C ATOM 2526 CG PRO A 622 73.703 7.260 -1.912 1.00 59.91 C ATOM 2527 CD PRO A 622 72.441 7.774 -2.494 1.00 55.45 C ATOM 2528 N SER A 623 73.599 10.068 -4.804 1.00 51.54 N ATOM 2529 CA SER A 623 73.771 10.687 -6.114 1.00 50.67 C ATOM 2530 C SER A 623 73.184 12.094 -6.202 1.00 55.33 C ATOM 2531 O SER A 623 73.114 12.661 -7.306 1.00 53.81 O ATOM 2532 CB SER A 623 73.124 9.819 -7.187 1.00 53.34 C ATOM 2533 OG SER A 623 71.715 9.817 -7.027 1.00 56.85 O ATOM 2534 HG SER A 623 71.374 10.743 -7.107 1.00 0.00 H ATOM 2535 H SER A 623 72.789 9.427 -4.679 1.00 0.00 H ATOM 2536 N CYS A 624 72.747 12.659 -5.080 1.00 48.25 N ATOM 2537 CA CYS A 624 72.243 14.018 -5.071 1.00 50.25 C ATOM 2538 C CYS A 624 73.408 14.984 -4.995 1.00 55.44 C ATOM 2539 O CYS A 624 74.376 14.746 -4.265 1.00 58.61 O ATOM 2540 CB CYS A 624 71.305 14.242 -3.885 1.00 57.10 C ATOM 2541 SG CYS A 624 69.659 13.471 -4.047 1.00 76.10 S ATOM 2542 H CYS A 624 72.767 12.116 -4.193 1.00 0.00 H ATOM 2543 N ALA A 625 73.311 16.075 -5.753 1.00 48.14 N ATOM 2544 CA ALA A 625 74.360 17.080 -5.745 1.00 43.38 C ATOM 2545 C ALA A 625 74.530 17.643 -4.331 1.00 49.29 C ATOM 2546 O ALA A 625 73.572 17.691 -3.557 1.00 48.35 O ATOM 2547 CB ALA A 625 74.036 18.190 -6.738 1.00 40.51 C ATOM 2548 H ALA A 625 72.475 16.209 -6.357 1.00 0.00 H ATOM 2549 N PRO A 626 75.744 18.055 -3.957 1.00 48.34 N ATOM 2550 CA PRO A 626 75.995 18.423 -2.556 1.00 48.50 C ATOM 2551 C PRO A 626 75.039 19.447 -1.967 1.00 43.91 C ATOM 2552 O PRO A 626 74.782 19.386 -0.756 1.00 44.49 O ATOM 2553 CB PRO A 626 77.435 18.944 -2.600 1.00 41.94 C ATOM 2554 CG PRO A 626 77.755 19.057 -4.036 1.00 44.75 C ATOM 2555 CD PRO A 626 76.992 18.043 -4.724 1.00 41.49 C ATOM 2556 N LEU A 627 74.473 20.358 -2.773 1.00 47.10 N ATOM 2557 CA LEU A 627 73.571 21.383 -2.232 1.00 46.10 C ATOM 2558 C LEU A 627 72.151 20.868 -2.042 1.00 50.78 C ATOM 2559 O LEU A 627 71.452 21.338 -1.137 1.00 47.26 O ATOM 2560 CB LEU A 627 73.525 22.630 -3.118 1.00 35.89 C ATOM 2561 CG LEU A 627 72.991 23.878 -2.405 1.00 43.51 C ATOM 2562 CD1 LEU A 627 73.736 24.169 -1.092 1.00 42.05 C ATOM 2563 CD2 LEU A 627 73.054 25.073 -3.311 1.00 36.73 C ATOM 2564 H LEU A 627 74.675 20.338 -3.793 1.00 0.00 H ATOM 2565 N THR A 628 71.689 19.938 -2.885 1.00 42.63 N ATOM 2566 CA THR A 628 70.481 19.212 -2.527 1.00 40.65 C ATOM 2567 C THR A 628 70.640 18.639 -1.122 1.00 44.53 C ATOM 2568 O THR A 628 69.895 18.987 -0.205 1.00 47.22 O ATOM 2569 CB THR A 628 70.185 18.108 -3.553 1.00 51.18 C ATOM 2570 OG1 THR A 628 70.144 18.658 -4.884 1.00 52.85 O ATOM 2571 CG2 THR A 628 68.854 17.419 -3.254 1.00 37.23 C ATOM 2572 HG1 THR A 628 69.953 17.935 -5.533 1.00 0.00 H ATOM 2573 H THR A 628 72.183 19.738 -3.778 1.00 0.00 H ATOM 2574 N ALA A 629 71.689 17.842 -0.918 1.00 51.32 N ATOM 2575 CA ALA A 629 71.865 17.129 0.342 1.00 49.01 C ATOM 2576 C ALA A 629 72.028 18.085 1.517 1.00 46.64 C ATOM 2577 O ALA A 629 71.483 17.847 2.602 1.00 42.58 O ATOM 2578 CB ALA A 629 73.066 16.190 0.246 1.00 46.91 C ATOM 2579 H ALA A 629 72.396 17.726 -1.672 1.00 0.00 H ATOM 2580 N GLN A 630 72.773 19.167 1.329 1.00 45.05 N ATOM 2581 CA GLN A 630 72.961 20.088 2.446 1.00 53.46 C ATOM 2582 C GLN A 630 71.658 20.802 2.808 1.00 50.74 C ATOM 2583 O GLN A 630 71.397 21.057 3.994 1.00 47.50 O ATOM 2584 CB GLN A 630 74.076 21.075 2.108 1.00 45.94 C ATOM 2585 CG GLN A 630 74.269 22.197 3.088 1.00 51.89 C ATOM 2586 CD GLN A 630 75.132 23.300 2.490 1.00 65.25 C ATOM 2587 OE1 GLN A 630 76.053 23.016 1.712 1.00 71.86 O ATOM 2588 NE2 GLN A 630 74.824 24.560 2.820 1.00 43.07 N ATOM 2589 HE22 GLN A 630 74.041 24.749 3.478 1.00 0.00 H ATOM 2590 HE21 GLN A 630 75.368 25.350 2.418 1.00 0.00 H ATOM 2591 H GLN A 630 73.213 19.355 0.406 1.00 0.00 H ATOM 2592 N ALA A 631 70.802 21.068 1.812 1.00 47.25 N ATOM 2593 CA ALA A 631 69.539 21.755 2.071 1.00 42.35 C ATOM 2594 C ALA A 631 68.554 20.848 2.788 1.00 45.44 C ATOM 2595 O ALA A 631 67.877 21.271 3.733 1.00 41.59 O ATOM 2596 CB ALA A 631 68.928 22.261 0.773 1.00 35.97 C ATOM 2597 H ALA A 631 71.040 20.781 0.841 1.00 0.00 H ATOM 2598 N ILE A 632 68.442 19.598 2.337 1.00 44.41 N ATOM 2599 CA ILE A 632 67.629 18.624 3.058 1.00 38.16 C ATOM 2600 C ILE A 632 68.085 18.535 4.505 1.00 45.07 C ATOM 2601 O ILE A 632 67.270 18.399 5.424 1.00 45.73 O ATOM 2602 CB ILE A 632 67.695 17.259 2.354 1.00 36.28 C ATOM 2603 CG1 ILE A 632 67.143 17.358 0.931 1.00 35.84 C ATOM 2604 CG2 ILE A 632 67.007 16.208 3.169 1.00 36.44 C ATOM 2605 CD1 ILE A 632 67.286 16.092 0.162 1.00 29.78 C ATOM 2606 H ILE A 632 68.937 19.316 1.467 1.00 0.00 H ATOM 2607 N GLN A 633 69.400 18.643 4.737 1.00 47.51 N ATOM 2608 CA GLN A 633 69.918 18.529 6.093 1.00 42.92 C ATOM 2609 C GLN A 633 69.527 19.736 6.945 1.00 48.28 C ATOM 2610 O GLN A 633 69.241 19.588 8.139 1.00 46.13 O ATOM 2611 CB GLN A 633 71.431 18.365 6.053 1.00 46.24 C ATOM 2612 CG GLN A 633 71.957 17.036 5.556 1.00 47.42 C ATOM 2613 CD GLN A 633 73.478 17.005 5.602 1.00 53.68 C ATOM 2614 OE1 GLN A 633 74.075 17.402 6.604 1.00 61.64 O ATOM 2615 NE2 GLN A 633 74.112 16.568 4.513 1.00 51.88 N ATOM 2616 HE22 GLN A 633 73.567 16.242 3.690 1.00 0.00 H ATOM 2617 HE21 GLN A 633 75.152 16.553 4.487 1.00 0.00 H ATOM 2618 H GLN A 633 70.054 18.809 3.945 1.00 0.00 H ATOM 2619 N GLU A 634 69.496 20.935 6.349 1.00 44.69 N ATOM 2620 CA GLU A 634 69.222 22.145 7.125 1.00 48.95 C ATOM 2621 C GLU A 634 67.759 22.233 7.541 1.00 54.47 C ATOM 2622 O GLU A 634 67.444 22.674 8.656 1.00 58.68 O ATOM 2623 CB GLU A 634 69.642 23.373 6.329 1.00 42.29 C ATOM 2624 CG GLU A 634 71.131 23.370 6.095 1.00 52.00 C ATOM 2625 CD GLU A 634 71.652 24.604 5.400 1.00 55.59 C ATOM 2626 OE1 GLU A 634 70.927 25.162 4.552 1.00 59.15 O ATOM 2627 OE2 GLU A 634 72.797 25.012 5.703 1.00 63.42 O ATOM 2628 H GLU A 634 69.668 21.007 5.326 1.00 0.00 H ATOM 2629 N GLY A 635 66.859 21.810 6.673 1.00 49.87 N ATOM 2630 CA GLY A 635 65.484 21.657 7.070 1.00 48.90 C ATOM 2631 C GLY A 635 65.163 20.407 7.849 1.00 43.92 C ATOM 2632 O GLY A 635 63.982 20.165 8.076 1.00 48.83 O ATOM 2633 H GLY A 635 67.145 21.586 5.698 1.00 0.00 H ATOM 2634 N LEU A 636 66.151 19.599 8.250 1.00 43.95 N ATOM 2635 CA LEU A 636 65.931 18.441 9.114 1.00 42.32 C ATOM 2636 C LEU A 636 66.763 18.499 10.393 1.00 46.12 C ATOM 2637 O LEU A 636 67.297 17.500 10.859 1.00 49.96 O ATOM 2638 CB LEU A 636 66.203 17.145 8.370 1.00 44.45 C ATOM 2639 CG LEU A 636 65.109 16.739 7.381 1.00 50.35 C ATOM 2640 CD1 LEU A 636 65.556 15.514 6.580 1.00 34.98 C ATOM 2641 CD2 LEU A 636 63.773 16.514 8.103 1.00 35.76 C ATOM 2642 H LEU A 636 67.120 19.804 7.932 1.00 0.00 H ATOM 2643 N ARG A 637 66.861 19.668 10.997 1.00 49.77 N ATOM 2644 CA ARG A 637 67.568 19.811 12.256 1.00 56.08 C ATOM 2645 C ARG A 637 66.561 19.610 13.374 1.00 54.41 C ATOM 2646 O ARG A 637 65.512 20.259 13.387 1.00 56.71 O ATOM 2647 CB ARG A 637 68.235 21.190 12.348 1.00 64.50 C ATOM 2648 CG ARG A 637 69.308 21.486 11.259 1.00 62.69 C ATOM 2649 CD ARG A 637 70.653 20.728 11.491 1.00 65.52 C ATOM 2650 NE ARG A 637 71.170 20.914 12.850 1.00 72.38 N ATOM 2651 CZ ARG A 637 71.919 21.942 13.250 1.00 70.11 C ATOM 2652 NH1 ARG A 637 72.307 22.012 14.520 1.00 60.00 N ATOM 2653 NH2 ARG A 637 72.267 22.898 12.391 1.00 60.33 N ATOM 2654 HE ARG A 637 70.934 20.188 13.557 1.00 0.00 H ATOM 2655 HH12 ARG A 637 72.891 22.810 14.842 1.00 0.00 H ATOM 2656 HH11 ARG A 637 72.026 21.269 15.191 1.00 0.00 H ATOM 2657 HH22 ARG A 637 72.851 23.697 12.711 1.00 0.00 H ATOM 2658 HH21 ARG A 637 71.954 22.846 11.400 1.00 0.00 H ATOM 2659 H ARG A 637 66.422 20.504 10.562 1.00 0.00 H ATOM 2660 N LYS A 638 66.864 18.696 14.296 1.00 51.32 N ATOM 2661 CA LYS A 638 65.863 18.315 15.280 1.00 50.57 C ATOM 2662 C LYS A 638 65.414 19.499 16.123 1.00 58.57 C ATOM 2663 O LYS A 638 64.273 19.526 16.589 1.00 57.50 O ATOM 2664 CB LYS A 638 66.396 17.198 16.157 1.00 57.91 C ATOM 2665 CG LYS A 638 66.744 15.951 15.373 1.00 61.41 C ATOM 2666 CD LYS A 638 67.145 14.808 16.294 1.00 64.44 C ATOM 2667 CE LYS A 638 66.119 14.625 17.414 1.00 58.90 C ATOM 2668 NZ LYS A 638 66.079 13.212 17.862 1.00 62.74 N ATOM 2669 HZ1 LYS A 638 65.816 12.603 17.061 1.00 0.00 H ATOM 2670 HZ2 LYS A 638 67.017 12.935 18.216 1.00 0.00 H ATOM 2671 HZ3 LYS A 638 65.376 13.110 18.622 1.00 0.00 H ATOM 2672 H LYS A 638 67.808 18.259 14.312 1.00 0.00 H ATOM 2673 N GLU A 639 66.267 20.500 16.303 1.00 59.88 N ATOM 2674 CA GLU A 639 65.877 21.654 17.086 1.00 58.42 C ATOM 2675 C GLU A 639 65.383 22.754 16.169 1.00 58.91 C ATOM 2676 O GLU A 639 66.159 23.261 15.345 1.00 54.35 O ATOM 2677 CB GLU A 639 67.039 22.160 17.922 1.00 71.09 C ATOM 2678 CG GLU A 639 66.708 22.255 19.386 1.00 74.65 C ATOM 2679 CD GLU A 639 67.503 21.256 20.195 1.00 89.93 C ATOM 2680 OE1 GLU A 639 68.761 21.320 20.136 1.00 90.46 O ATOM 2681 OE2 GLU A 639 66.872 20.403 20.868 1.00 81.15 O ATOM 2682 H GLU A 639 67.217 20.455 15.881 1.00 0.00 H ATOM 2683 N PRO A 640 64.129 23.168 16.293 1.00 59.40 N ATOM 2684 CA PRO A 640 63.597 24.208 15.402 1.00 53.27 C ATOM 2685 C PRO A 640 64.424 25.471 15.366 1.00 56.73 C ATOM 2686 O PRO A 640 64.361 26.212 14.375 1.00 57.07 O ATOM 2687 CB PRO A 640 62.199 24.474 15.973 1.00 49.64 C ATOM 2688 CG PRO A 640 62.237 23.905 17.364 1.00 60.04 C ATOM 2689 CD PRO A 640 63.130 22.708 17.261 1.00 57.70 C ATOM 2690 N VAL A 641 65.200 25.759 16.404 1.00 61.08 N ATOM 2691 CA VAL A 641 66.020 26.962 16.328 1.00 65.89 C ATOM 2692 C VAL A 641 67.091 26.804 15.262 1.00 54.93 C ATOM 2693 O VAL A 641 67.312 27.707 14.456 1.00 54.08 O ATOM 2694 CB VAL A 641 66.615 27.293 17.700 1.00 67.56 C ATOM 2695 CG1 VAL A 641 65.809 28.431 18.328 1.00 66.99 C ATOM 2696 CG2 VAL A 641 66.588 26.033 18.570 1.00 71.48 C ATOM 2697 H VAL A 641 65.222 25.146 17.244 1.00 0.00 H ATOM 2698 N HIS A 642 67.734 25.645 15.211 1.00 51.32 N ATOM 2699 CA HIS A 642 68.776 25.386 14.231 1.00 54.47 C ATOM 2700 C HIS A 642 68.231 25.014 12.862 1.00 61.23 C ATOM 2701 O HIS A 642 68.996 25.004 11.889 1.00 55.53 O ATOM 2702 CB HIS A 642 69.679 24.264 14.726 1.00 59.70 C ATOM 2703 CG HIS A 642 70.288 24.539 16.058 1.00 63.81 C ATOM 2704 ND1 HIS A 642 70.584 23.543 16.960 1.00 70.28 N ATOM 2705 CD2 HIS A 642 70.645 25.705 16.647 1.00 64.23 C ATOM 2706 CE1 HIS A 642 71.099 24.083 18.050 1.00 78.94 C ATOM 2707 NE2 HIS A 642 71.145 25.394 17.886 1.00 70.13 N ATOM 2708 H HIS A 642 67.485 24.900 15.892 1.00 0.00 H ATOM 2709 N ARG A 643 66.945 24.687 12.770 1.00 62.36 N ATOM 2710 CA ARG A 643 66.347 24.330 11.501 1.00 47.41 C ATOM 2711 C ARG A 643 66.147 25.585 10.688 1.00 45.12 C ATOM 2712 O ARG A 643 65.925 26.661 11.244 1.00 49.80 O ATOM 2713 CB ARG A 643 65.015 23.636 11.718 1.00 52.06 C ATOM 2714 CG ARG A 643 64.510 22.864 10.534 1.00 53.24 C ATOM 2715 CD ARG A 643 63.202 22.264 10.903 1.00 47.60 C ATOM 2716 NE ARG A 643 63.312 21.458 12.111 1.00 50.78 N ATOM 2717 CZ ARG A 643 62.305 21.234 12.950 1.00 48.88 C ATOM 2718 NH1 ARG A 643 61.118 21.763 12.723 1.00 43.37 N ATOM 2719 NH2 ARG A 643 62.486 20.481 14.021 1.00 51.48 N ATOM 2720 HE ARG A 643 64.235 21.031 12.331 1.00 0.00 H ATOM 2721 HH12 ARG A 643 60.334 21.584 13.383 1.00 0.00 H ATOM 2722 HH11 ARG A 643 60.966 22.359 11.884 1.00 0.00 H ATOM 2723 HH22 ARG A 643 61.696 20.308 14.675 1.00 0.00 H ATOM 2724 HH21 ARG A 643 63.419 20.061 14.210 1.00 0.00 H ATOM 2725 H ARG A 643 66.357 24.688 13.628 1.00 0.00 H ATOM 2726 N ALA A 644 66.235 25.442 9.365 1.00 44.83 N ATOM 2727 CA ALA A 644 66.073 26.580 8.466 1.00 43.44 C ATOM 2728 C ALA A 644 64.634 27.071 8.470 1.00 42.52 C ATOM 2729 O ALA A 644 63.705 26.324 8.749 1.00 45.64 O ATOM 2730 CB ALA A 644 66.470 26.206 7.039 1.00 44.33 C ATOM 2731 H ALA A 644 66.423 24.500 8.966 1.00 0.00 H ATOM 2732 N SER A 645 64.456 28.343 8.158 1.00 41.84 N ATOM 2733 CA SER A 645 63.127 28.883 7.959 1.00 39.77 C ATOM 2734 C SER A 645 62.631 28.546 6.558 1.00 44.54 C ATOM 2735 O SER A 645 63.358 28.002 5.729 1.00 44.57 O ATOM 2736 CB SER A 645 63.139 30.390 8.154 1.00 43.25 C ATOM 2737 OG SER A 645 63.744 31.009 7.042 1.00 44.63 O ATOM 2738 HG SER A 645 64.674 30.682 6.949 1.00 0.00 H ATOM 2739 H SER A 645 65.283 28.965 8.054 1.00 0.00 H ATOM 2740 N ALA A 646 61.383 28.929 6.276 1.00 53.89 N ATOM 2741 CA ALA A 646 60.835 28.773 4.929 1.00 47.44 C ATOM 2742 C ALA A 646 61.621 29.581 3.911 1.00 43.91 C ATOM 2743 O ALA A 646 61.917 29.093 2.818 1.00 44.70 O ATOM 2744 CB ALA A 646 59.359 29.177 4.898 1.00 42.45 C ATOM 2745 H ALA A 646 60.793 29.344 7.025 1.00 0.00 H ATOM 2746 N MET A 647 61.956 30.828 4.246 1.00 50.65 N ATOM 2747 CA MET A 647 62.606 31.703 3.273 1.00 50.02 C ATOM 2748 C MET A 647 64.039 31.268 3.020 1.00 51.28 C ATOM 2749 O MET A 647 64.527 31.335 1.882 1.00 44.24 O ATOM 2750 CB MET A 647 62.552 33.152 3.747 1.00 48.60 C ATOM 2751 CG MET A 647 63.487 34.098 3.022 1.00 64.69 C ATOM 2752 SD MET A 647 63.495 35.749 3.759 1.00 75.79 S ATOM 2753 CE MET A 647 62.153 36.553 2.866 1.00 85.15 C ATOM 2754 H MET A 647 61.754 31.179 5.204 1.00 0.00 H ATOM 2755 N GLU A 648 64.720 30.791 4.060 1.00 48.18 N ATOM 2756 CA GLU A 648 66.096 30.355 3.872 1.00 47.45 C ATOM 2757 C GLU A 648 66.161 29.155 2.944 1.00 49.75 C ATOM 2758 O GLU A 648 66.988 29.108 2.023 1.00 54.06 O ATOM 2759 CB GLU A 648 66.727 30.019 5.213 1.00 41.54 C ATOM 2760 CG GLU A 648 67.119 31.228 6.028 1.00 43.71 C ATOM 2761 CD GLU A 648 66.947 30.998 7.529 1.00 47.82 C ATOM 2762 OE1 GLU A 648 66.877 29.815 7.951 1.00 41.04 O ATOM 2763 OE2 GLU A 648 66.861 32.006 8.278 1.00 54.85 O ATOM 2764 H GLU A 648 64.273 30.731 4.997 1.00 0.00 H ATOM 2765 N LEU A 649 65.272 28.189 3.155 1.00 48.20 N ATOM 2766 CA LEU A 649 65.366 26.928 2.440 1.00 38.67 C ATOM 2767 C LEU A 649 64.880 27.060 1.013 1.00 47.86 C ATOM 2768 O LEU A 649 65.345 26.323 0.138 1.00 46.97 O ATOM 2769 CB LEU A 649 64.573 25.855 3.172 1.00 39.69 C ATOM 2770 CG LEU A 649 64.970 24.422 2.862 1.00 45.13 C ATOM 2771 CD1 LEU A 649 66.389 24.261 3.310 1.00 38.19 C ATOM 2772 CD2 LEU A 649 64.035 23.425 3.566 1.00 39.54 C ATOM 2773 H LEU A 649 64.502 28.338 3.838 1.00 0.00 H ATOM 2774 N ARG A 650 63.948 27.982 0.756 1.00 52.06 N ATOM 2775 CA ARG A 650 63.516 28.224 -0.614 1.00 42.64 C ATOM 2776 C ARG A 650 64.663 28.797 -1.426 1.00 45.01 C ATOM 2777 O ARG A 650 64.993 28.275 -2.497 1.00 54.41 O ATOM 2778 CB ARG A 650 62.292 29.150 -0.627 1.00 44.69 C ATOM 2779 CG ARG A 650 61.565 29.268 -1.977 1.00 51.01 C ATOM 2780 CD ARG A 650 61.995 30.509 -2.748 1.00 54.21 C ATOM 2781 NE ARG A 650 61.781 31.727 -1.969 1.00 61.80 N ATOM 2782 CZ ARG A 650 62.572 32.799 -2.006 1.00 62.35 C ATOM 2783 NH1 ARG A 650 63.647 32.804 -2.785 1.00 60.22 N ATOM 2784 NH2 ARG A 650 62.295 33.860 -1.254 1.00 58.39 N ATOM 2785 HE ARG A 650 60.953 31.759 -1.341 1.00 0.00 H ATOM 2786 HH12 ARG A 650 64.264 33.640 -2.814 1.00 0.00 H ATOM 2787 HH11 ARG A 650 63.872 31.971 -3.366 1.00 0.00 H ATOM 2788 HH22 ARG A 650 62.914 34.695 -1.285 1.00 0.00 H ATOM 2789 HH21 ARG A 650 61.459 33.855 -0.635 1.00 0.00 H ATOM 2790 H ARG A 650 63.530 28.528 1.536 1.00 0.00 H ATOM 2791 N ARG A 651 65.302 29.857 -0.916 1.00 49.80 N ATOM 2792 CA ARG A 651 66.521 30.376 -1.534 1.00 48.39 C ATOM 2793 C ARG A 651 67.524 29.265 -1.753 1.00 47.20 C ATOM 2794 O ARG A 651 68.018 29.065 -2.869 1.00 45.21 O ATOM 2795 CB ARG A 651 67.148 31.463 -0.664 1.00 47.09 C ATOM 2796 CG ARG A 651 66.477 32.788 -0.777 1.00 59.10 C ATOM 2797 CD ARG A 651 66.968 33.722 0.297 1.00 68.72 C ATOM 2798 NE ARG A 651 66.357 35.038 0.175 1.00 72.44 N ATOM 2799 CZ ARG A 651 66.554 36.025 1.038 1.00 88.55 C ATOM 2800 NH1 ARG A 651 67.348 35.832 2.085 1.00 97.50 N ATOM 2801 NH2 ARG A 651 65.956 37.199 0.860 1.00 91.36 N ATOM 2802 HE ARG A 651 65.730 35.214 -0.636 1.00 0.00 H ATOM 2803 HH12 ARG A 651 67.507 36.602 2.766 1.00 0.00 H ATOM 2804 HH11 ARG A 651 67.811 34.911 2.224 1.00 0.00 H ATOM 2805 HH22 ARG A 651 66.113 37.971 1.539 1.00 0.00 H ATOM 2806 HH21 ARG A 651 65.331 37.346 0.042 1.00 0.00 H ATOM 2807 H ARG A 651 64.924 30.320 -0.065 1.00 0.00 H ATOM 2808 N LYS A 652 67.833 28.525 -0.683 1.00 43.42 N ATOM 2809 CA LYS A 652 68.832 27.469 -0.780 1.00 44.06 C ATOM 2810 C LYS A 652 68.458 26.428 -1.829 1.00 40.38 C ATOM 2811 O LYS A 652 69.337 25.842 -2.462 1.00 37.57 O ATOM 2812 CB LYS A 652 69.015 26.818 0.586 1.00 40.12 C ATOM 2813 CG LYS A 652 70.174 25.858 0.658 1.00 40.59 C ATOM 2814 CD LYS A 652 71.492 26.589 0.618 1.00 49.93 C ATOM 2815 CE LYS A 652 72.320 26.290 1.854 1.00 53.40 C ATOM 2816 NZ LYS A 652 71.580 26.647 3.082 1.00 52.56 N ATOM 2817 HZ1 LYS A 652 71.355 27.662 3.067 1.00 0.00 H ATOM 2818 HZ2 LYS A 652 70.699 26.096 3.127 1.00 0.00 H ATOM 2819 HZ3 LYS A 652 72.167 26.433 3.913 1.00 0.00 H ATOM 2820 H LYS A 652 67.357 28.704 0.224 1.00 0.00 H ATOM 2821 N VAL A 653 67.164 26.177 -2.012 1.00 39.85 N ATOM 2822 CA VAL A 653 66.738 25.128 -2.916 1.00 37.25 C ATOM 2823 C VAL A 653 66.703 25.658 -4.336 1.00 47.30 C ATOM 2824 O VAL A 653 67.086 24.965 -5.281 1.00 48.48 O ATOM 2825 CB VAL A 653 65.378 24.561 -2.463 1.00 40.35 C ATOM 2826 CG1 VAL A 653 64.718 23.763 -3.564 1.00 44.86 C ATOM 2827 CG2 VAL A 653 65.552 23.681 -1.247 1.00 39.89 C ATOM 2828 H VAL A 653 66.453 26.739 -1.502 1.00 0.00 H ATOM 2829 N GLY A 654 66.288 26.906 -4.506 1.00 43.89 N ATOM 2830 CA GLY A 654 66.379 27.514 -5.815 1.00 44.36 C ATOM 2831 C GLY A 654 67.776 27.445 -6.393 1.00 48.02 C ATOM 2832 O GLY A 654 67.948 27.218 -7.596 1.00 53.03 O ATOM 2833 H GLY A 654 65.900 27.443 -3.704 1.00 0.00 H ATOM 2834 N LYS A 655 68.799 27.622 -5.544 1.00 44.63 N ATOM 2835 CA LYS A 655 70.162 27.516 -6.047 1.00 46.77 C ATOM 2836 C LYS A 655 70.552 26.069 -6.296 1.00 47.45 C ATOM 2837 O LYS A 655 71.211 25.763 -7.301 1.00 46.62 O ATOM 2838 CB LYS A 655 71.175 28.162 -5.114 1.00 40.42 C ATOM 2839 CG LYS A 655 72.456 28.396 -5.912 1.00 45.08 C ATOM 2840 CD LYS A 655 73.538 29.145 -5.197 1.00 49.76 C ATOM 2841 CE LYS A 655 74.793 29.184 -6.065 1.00 49.91 C ATOM 2842 NZ LYS A 655 75.199 27.820 -6.484 1.00 45.58 N ATOM 2843 HZ1 LYS A 655 75.396 27.244 -5.641 1.00 0.00 H ATOM 2844 HZ2 LYS A 655 74.430 27.384 -7.031 1.00 0.00 H ATOM 2845 HZ3 LYS A 655 76.054 27.880 -7.072 1.00 0.00 H ATOM 2846 H LYS A 655 68.622 27.832 -4.541 1.00 0.00 H ATOM 2847 N ALA A 656 70.157 25.165 -5.402 1.00 37.29 N ATOM 2848 CA ALA A 656 70.396 23.757 -5.669 1.00 43.03 C ATOM 2849 C ALA A 656 69.817 23.355 -7.020 1.00 43.37 C ATOM 2850 O ALA A 656 70.423 22.577 -7.761 1.00 43.78 O ATOM 2851 CB ALA A 656 69.819 22.909 -4.543 1.00 42.56 C ATOM 2852 H ALA A 656 69.684 25.463 -4.525 1.00 0.00 H ATOM 2853 N LEU A 657 68.662 23.912 -7.376 1.00 46.11 N ATOM 2854 CA LEU A 657 68.081 23.597 -8.673 1.00 46.46 C ATOM 2855 C LEU A 657 68.952 24.123 -9.808 1.00 49.68 C ATOM 2856 O LEU A 657 69.139 23.429 -10.814 1.00 47.49 O ATOM 2857 CB LEU A 657 66.657 24.156 -8.775 1.00 42.48 C ATOM 2858 CG LEU A 657 65.939 24.000 -10.128 1.00 42.60 C ATOM 2859 CD1 LEU A 657 65.883 22.543 -10.590 1.00 33.61 C ATOM 2860 CD2 LEU A 657 64.565 24.609 -10.061 1.00 33.35 C ATOM 2861 H LEU A 657 68.177 24.569 -6.731 1.00 0.00 H ATOM 2862 N GLN A 658 69.500 25.334 -9.673 1.00 46.72 N ATOM 2863 CA GLN A 658 70.373 25.853 -10.721 1.00 46.23 C ATOM 2864 C GLN A 658 71.679 25.069 -10.810 1.00 47.72 C ATOM 2865 O GLN A 658 72.251 24.938 -11.901 1.00 46.85 O ATOM 2866 CB GLN A 658 70.653 27.334 -10.483 1.00 45.21 C ATOM 2867 CG GLN A 658 69.409 28.166 -10.482 1.00 47.13 C ATOM 2868 CD GLN A 658 68.594 27.960 -11.739 1.00 49.89 C ATOM 2869 OE1 GLN A 658 67.491 27.392 -11.705 1.00 48.73 O ATOM 2870 NE2 GLN A 658 69.132 28.423 -12.863 1.00 49.17 N ATOM 2871 HE22 GLN A 658 70.060 28.892 -12.841 1.00 0.00 H ATOM 2872 HE21 GLN A 658 68.625 28.316 -13.765 1.00 0.00 H ATOM 2873 H GLN A 658 69.305 25.904 -8.825 1.00 0.00 H ATOM 2874 N GLU A 659 72.157 24.529 -9.686 1.00 42.81 N ATOM 2875 CA GLU A 659 73.405 23.786 -9.709 1.00 39.84 C ATOM 2876 C GLU A 659 73.303 22.503 -10.515 1.00 44.02 C ATOM 2877 O GLU A 659 74.304 22.059 -11.089 1.00 55.00 O ATOM 2878 CB GLU A 659 73.853 23.495 -8.295 1.00 41.31 C ATOM 2879 CG GLU A 659 74.102 24.757 -7.535 1.00 44.63 C ATOM 2880 CD GLU A 659 75.085 24.568 -6.418 1.00 45.92 C ATOM 2881 OE1 GLU A 659 75.527 23.420 -6.194 1.00 43.18 O ATOM 2882 OE2 GLU A 659 75.417 25.577 -5.767 1.00 43.99 O ATOM 2883 H GLU A 659 71.635 24.641 -8.793 1.00 0.00 H ATOM 2884 N VAL A 660 72.130 21.897 -10.589 1.00 43.11 N ATOM 2885 CA VAL A 660 71.951 20.709 -11.401 1.00 41.40 C ATOM 2886 C VAL A 660 71.392 21.065 -12.778 1.00 48.40 C ATOM 2887 O VAL A 660 70.834 20.206 -13.459 1.00 49.98 O ATOM 2888 CB VAL A 660 71.083 19.662 -10.689 1.00 42.02 C ATOM 2889 CG1 VAL A 660 71.719 19.239 -9.348 1.00 35.15 C ATOM 2890 CG2 VAL A 660 69.689 20.209 -10.471 1.00 41.86 C ATOM 2891 H VAL A 660 71.323 22.279 -10.056 1.00 0.00 H ATOM 2892 N GLY A 661 71.530 22.326 -13.194 1.00 43.53 N ATOM 2893 CA GLY A 661 71.199 22.723 -14.551 1.00 49.80 C ATOM 2894 C GLY A 661 69.769 23.144 -14.820 1.00 60.07 C ATOM 2895 O GLY A 661 69.302 23.021 -15.960 1.00 64.35 O ATOM 2896 H GLY A 661 71.884 23.043 -12.529 1.00 0.00 H ATOM 2897 N GLY A 662 69.067 23.671 -13.822 1.00 50.13 N ATOM 2898 CA GLY A 662 67.670 23.977 -13.974 1.00 51.25 C ATOM 2899 C GLY A 662 66.822 22.719 -14.130 1.00 52.94 C ATOM 2900 O GLY A 662 67.290 21.584 -14.013 1.00 55.12 O ATOM 2901 H GLY A 662 69.536 23.866 -12.915 1.00 0.00 H ATOM 2902 N LEU A 663 65.539 22.953 -14.407 1.00 46.23 N ATOM 2903 CA LEU A 663 64.573 21.877 -14.601 1.00 53.45 C ATOM 2904 C LEU A 663 64.597 21.444 -16.058 1.00 54.22 C ATOM 2905 O LEU A 663 64.342 22.258 -16.948 1.00 53.10 O ATOM 2906 CB LEU A 663 63.178 22.343 -14.198 1.00 51.10 C ATOM 2907 CG LEU A 663 61.954 21.509 -14.536 1.00 49.74 C ATOM 2908 CD1 LEU A 663 61.966 20.165 -13.818 1.00 47.63 C ATOM 2909 CD2 LEU A 663 60.748 22.356 -14.154 1.00 41.75 C ATOM 2910 H LEU A 663 65.215 23.938 -14.488 1.00 0.00 H ATOM 2911 N LYS A 664 64.924 20.172 -16.292 1.00 52.55 N ATOM 2912 CA LYS A 664 65.048 19.616 -17.636 1.00 52.95 C ATOM 2913 C LYS A 664 64.255 18.340 -17.839 1.00 56.95 C ATOM 2914 O LYS A 664 63.957 18.007 -18.993 1.00 59.89 O ATOM 2915 CB LYS A 664 66.519 19.307 -17.980 1.00 56.10 C ATOM 2916 CG LYS A 664 67.495 20.496 -18.026 1.00 63.52 C ATOM 2917 CD LYS A 664 68.884 20.012 -18.529 1.00 78.83 C ATOM 2918 CE LYS A 664 70.069 20.926 -18.116 1.00 84.44 C ATOM 2919 NZ LYS A 664 70.363 22.102 -19.026 1.00 81.12 N ATOM 2920 HZ1 LYS A 664 70.590 21.753 -19.979 1.00 0.00 H ATOM 2921 HZ2 LYS A 664 69.528 22.720 -19.072 1.00 0.00 H ATOM 2922 HZ3 LYS A 664 71.172 22.637 -18.649 1.00 0.00 H ATOM 2923 H LYS A 664 65.099 19.547 -15.479 1.00 0.00 H ATOM 2924 N SER A 665 63.929 17.607 -16.777 1.00 51.94 N ATOM 2925 CA SER A 665 63.257 16.328 -16.927 1.00 51.31 C ATOM 2926 C SER A 665 61.868 16.532 -17.524 1.00 61.96 C ATOM 2927 O SER A 665 61.211 17.541 -17.250 1.00 63.07 O ATOM 2928 CB SER A 665 63.153 15.624 -15.576 1.00 57.71 C ATOM 2929 OG SER A 665 64.415 15.572 -14.910 1.00 54.99 O ATOM 2930 HG SER A 665 64.745 16.493 -14.758 1.00 0.00 H ATOM 2931 H SER A 665 64.159 17.956 -15.825 1.00 0.00 H ATOM 2932 N PRO A 666 61.392 15.611 -18.352 1.00 69.97 N ATOM 2933 CA PRO A 666 60.002 15.704 -18.785 1.00 70.10 C ATOM 2934 C PRO A 666 59.130 15.464 -17.571 1.00 70.81 C ATOM 2935 O PRO A 666 59.485 14.684 -16.683 1.00 64.70 O ATOM 2936 CB PRO A 666 59.856 14.581 -19.820 1.00 73.81 C ATOM 2937 CG PRO A 666 61.140 13.777 -19.740 1.00 78.27 C ATOM 2938 CD PRO A 666 61.932 14.260 -18.568 1.00 69.94 C ATOM 2939 N TRP A 667 57.994 16.163 -17.525 1.00 76.02 N ATOM 2940 CA TRP A 667 57.155 16.116 -16.332 1.00 75.89 C ATOM 2941 C TRP A 667 56.643 14.700 -16.086 1.00 77.13 C ATOM 2942 O TRP A 667 56.748 14.179 -14.963 1.00 68.56 O ATOM 2943 CB TRP A 667 56.048 17.180 -16.446 1.00 70.37 C ATOM 2944 CG TRP A 667 54.572 16.808 -16.469 1.00 72.77 C ATOM 2945 CD1 TRP A 667 53.742 16.796 -17.565 1.00 73.02 C ATOM 2946 CD2 TRP A 667 53.744 16.516 -15.344 1.00 64.29 C ATOM 2947 NE1 TRP A 667 52.460 16.482 -17.189 1.00 66.98 N ATOM 2948 CE2 TRP A 667 52.431 16.299 -15.834 1.00 68.87 C ATOM 2949 CE3 TRP A 667 53.987 16.384 -13.979 1.00 61.01 C ATOM 2950 CZ2 TRP A 667 51.369 15.959 -15.006 1.00 66.68 C ATOM 2951 CZ3 TRP A 667 52.931 16.049 -13.153 1.00 65.44 C ATOM 2952 CH2 TRP A 667 51.636 15.833 -13.672 1.00 66.65 C ATOM 2953 HE1 TRP A 667 51.645 16.397 -17.829 1.00 0.00 H ATOM 2954 H TRP A 667 57.707 16.742 -18.340 1.00 0.00 H ATOM 2955 N LYS A 668 56.173 14.027 -17.132 1.00 66.04 N ATOM 2956 CA LYS A 668 55.914 12.597 -17.045 1.00 73.40 C ATOM 2957 C LYS A 668 56.898 11.861 -17.950 1.00 85.00 C ATOM 2958 O LYS A 668 56.557 11.350 -19.021 1.00 87.97 O ATOM 2959 CB LYS A 668 54.463 12.292 -17.363 1.00 72.74 C ATOM 2960 CG LYS A 668 53.621 12.235 -16.084 1.00 71.71 C ATOM 2961 CD LYS A 668 52.135 12.342 -16.341 1.00 64.36 C ATOM 2962 CE LYS A 668 51.348 12.185 -15.057 1.00 59.32 C ATOM 2963 NZ LYS A 668 49.893 12.146 -15.351 1.00 79.70 N ATOM 2964 HZ1 LYS A 668 49.611 13.031 -15.818 1.00 0.00 H ATOM 2965 HZ2 LYS A 668 49.689 11.341 -15.978 1.00 0.00 H ATOM 2966 HZ3 LYS A 668 49.364 12.038 -14.462 1.00 0.00 H ATOM 2967 H LYS A 668 55.988 14.529 -18.024 1.00 0.00 H ATOM 2968 N GLY A 669 58.155 11.835 -17.494 1.00 84.51 N ATOM 2969 CA GLY A 669 59.224 11.087 -18.119 1.00 77.32 C ATOM 2970 C GLY A 669 59.085 9.607 -17.840 1.00 81.85 C ATOM 2971 O GLY A 669 57.967 9.102 -17.731 1.00 86.15 O ATOM 2972 H GLY A 669 58.377 12.385 -16.640 1.00 0.00 H ATOM 2973 N GLU A 670 60.194 8.894 -17.707 1.00 82.42 N ATOM 2974 CA GLU A 670 60.126 7.448 -17.590 1.00 83.05 C ATOM 2975 C GLU A 670 60.240 7.008 -16.136 1.00 87.28 C ATOM 2976 O GLU A 670 60.788 7.719 -15.281 1.00 82.56 O ATOM 2977 CB GLU A 670 61.206 6.781 -18.449 1.00 99.15 C ATOM 2978 CG GLU A 670 60.937 6.919 -19.964 1.00 99.40 C ATOM 2979 CD GLU A 670 61.262 5.657 -20.772 1.00 94.83 C ATOM 2980 OE1 GLU A 670 62.425 5.532 -21.223 1.00 82.24 O ATOM 2981 OE2 GLU A 670 60.353 4.801 -20.955 1.00 85.01 O ATOM 2982 H GLU A 670 61.117 9.372 -17.686 1.00 0.00 H ATOM 2983 N TYR A 671 59.688 5.819 -15.873 1.00 77.47 N ATOM 2984 CA TYR A 671 59.605 5.277 -14.522 1.00 66.67 C ATOM 2985 C TYR A 671 60.997 5.118 -13.918 1.00 69.27 C ATOM 2986 O TYR A 671 61.993 4.977 -14.630 1.00 80.54 O ATOM 2987 CB TYR A 671 58.877 3.938 -14.564 1.00 60.00 C ATOM 2988 CG TYR A 671 58.535 3.331 -13.225 1.00 62.71 C ATOM 2989 CD1 TYR A 671 59.410 2.460 -12.600 1.00 66.10 C ATOM 2990 CD2 TYR A 671 57.321 3.590 -12.607 1.00 60.72 C ATOM 2991 CE1 TYR A 671 59.101 1.878 -11.388 1.00 63.63 C ATOM 2992 CE2 TYR A 671 57.004 3.015 -11.391 1.00 58.89 C ATOM 2993 CZ TYR A 671 57.903 2.164 -10.788 1.00 65.05 C ATOM 2994 OH TYR A 671 57.623 1.589 -9.573 1.00 78.85 O ATOM 2995 HH TYR A 671 58.380 1.013 -9.300 1.00 0.00 H ATOM 2996 H TYR A 671 59.304 5.260 -16.661 1.00 0.00 H ATOM 2997 N LYS A 672 61.071 5.168 -12.591 1.00 66.37 N ATOM 2998 CA LYS A 672 62.344 5.026 -11.885 1.00 67.25 C ATOM 2999 C LYS A 672 62.136 4.179 -10.642 1.00 60.61 C ATOM 3000 O LYS A 672 61.308 4.512 -9.796 1.00 59.68 O ATOM 3001 CB LYS A 672 62.940 6.391 -11.520 1.00 71.81 C ATOM 3002 CG LYS A 672 63.505 7.139 -12.730 1.00 87.24 C ATOM 3003 CD LYS A 672 63.749 8.622 -12.443 1.00 79.85 C ATOM 3004 CE LYS A 672 64.475 9.303 -13.610 1.00 77.05 C ATOM 3005 NZ LYS A 672 65.762 8.632 -13.997 1.00 80.32 N ATOM 3006 HZ1 LYS A 672 66.411 8.635 -13.184 1.00 0.00 H ATOM 3007 HZ2 LYS A 672 65.568 7.651 -14.283 1.00 0.00 H ATOM 3008 HZ3 LYS A 672 66.195 9.147 -14.790 1.00 0.00 H ATOM 3009 H LYS A 672 60.200 5.312 -12.041 1.00 0.00 H ATOM 3010 N GLU A 673 62.898 3.104 -10.527 1.00 71.13 N ATOM 3011 CA GLU A 673 62.657 2.133 -9.473 1.00 71.03 C ATOM 3012 C GLU A 673 62.989 2.746 -8.120 1.00 72.80 C ATOM 3013 O GLU A 673 64.064 3.348 -7.960 1.00 62.56 O ATOM 3014 CB GLU A 673 63.473 0.864 -9.701 1.00 70.63 C ATOM 3015 CG GLU A 673 63.290 -0.194 -8.613 1.00 81.39 C ATOM 3016 CD GLU A 673 61.863 -0.746 -8.527 1.00 87.60 C ATOM 3017 OE1 GLU A 673 61.208 -0.896 -9.590 1.00 90.37 O ATOM 3018 OE2 GLU A 673 61.401 -1.031 -7.389 1.00 77.44 O ATOM 3019 H GLU A 673 63.678 2.952 -11.198 1.00 0.00 H ATOM 3020 N PRO A 674 62.081 2.634 -7.132 1.00 75.96 N ATOM 3021 CA PRO A 674 62.314 3.228 -5.805 1.00 74.01 C ATOM 3022 C PRO A 674 63.383 2.524 -4.975 1.00 76.02 C ATOM 3023 O PRO A 674 64.138 1.686 -5.478 1.00 79.01 O ATOM 3024 CB PRO A 674 60.938 3.121 -5.134 1.00 67.28 C ATOM 3025 CG PRO A 674 59.961 2.981 -6.265 1.00 67.44 C ATOM 3026 CD PRO A 674 60.681 2.217 -7.323 1.00 66.85 C ATOM 3027 N ARG A 675 63.461 2.864 -3.694 1.00 77.52 N ATOM 3028 CA ARG A 675 64.550 2.372 -2.866 1.00 85.51 C ATOM 3029 C ARG A 675 64.165 1.097 -2.105 1.00 87.90 C ATOM 3030 O ARG A 675 64.886 0.090 -2.148 1.00 82.27 O ATOM 3031 CB ARG A 675 65.003 3.464 -1.892 1.00 75.69 C ATOM 3032 CG ARG A 675 66.319 3.141 -1.197 1.00 93.98 C ATOM 3033 CD ARG A 675 66.622 4.106 -0.062 1.00 87.45 C ATOM 3034 NE ARG A 675 65.472 4.283 0.826 1.00 91.48 N ATOM 3035 CZ ARG A 675 65.527 4.893 2.009 1.00 87.65 C ATOM 3036 NH1 ARG A 675 66.685 5.375 2.455 1.00 80.80 N ATOM 3037 NH2 ARG A 675 64.425 5.016 2.751 1.00 85.59 N ATOM 3038 HE ARG A 675 64.553 3.909 0.513 1.00 0.00 H ATOM 3039 HH12 ARG A 675 66.729 5.851 3.378 1.00 0.00 H ATOM 3040 HH11 ARG A 675 67.546 5.275 1.880 1.00 0.00 H ATOM 3041 HH22 ARG A 675 64.470 5.493 3.674 1.00 0.00 H ATOM 3042 HH21 ARG A 675 63.521 4.635 2.406 1.00 0.00 H ATOM 3043 H ARG A 675 62.738 3.487 -3.280 1.00 0.00 H TER 3044 ARG A 675 HETATM 3045 O HOH 1 71.168 23.805 -19.839 1.00 66.35 O HETATM 3046 O HOH 2 68.987 27.563 -14.823 1.00 55.54 O HETATM 3047 O HOH 3 35.860 34.283 -9.776 1.00 55.27 O HETATM 3048 O HOH 4 59.013 33.301 -2.296 1.00 53.00 O HETATM 3049 O HOH 5 19.215 27.689 2.636 1.00 39.52 O HETATM 3050 O HOH 6 64.284 -2.014 -2.891 1.00 71.35 O HETATM 3051 O HOH 7 21.310 17.006 -0.976 1.00 37.31 O HETATM 3052 O HOH 8 64.985 9.839 -6.899 1.00 51.59 O HETATM 3053 O HOH 9 21.451 31.113 -8.569 1.00 50.77 O HETATM 3054 O HOH 10 71.358 16.928 13.674 1.00 68.78 O HETATM 3055 O HOH 11 38.638 20.169 9.535 1.00 47.41 O HETATM 3056 O HOH 12 51.043 37.544 17.900 1.00 77.62 O HETATM 3057 O HOH 13 50.006 13.945 -10.218 1.00 51.66 O HETATM 3058 O HOH 14 34.332 23.574 -15.197 1.00 47.46 O HETATM 3059 O HOH 15 59.897 13.222 -14.636 1.00 59.55 O HETATM 3060 O HOH 16 16.537 25.956 -2.875 1.00 37.13 O HETATM 3061 O HOH 17 58.686 24.110 15.754 1.00 44.77 O HETATM 3062 O HOH 18 55.557 32.579 -6.101 1.00 44.65 O HETATM 3063 O HOH 19 46.501 21.186 7.283 1.00 39.91 O HETATM 3064 O HOH 20 74.675 21.008 -5.760 1.00 47.74 O HETATM 3065 O HOH 21 54.530 31.136 -11.048 1.00 52.50 O HETATM 3066 O HOH 22 52.725 25.788 20.932 1.00 65.18 O HETATM 3067 O HOH 23 48.345 39.777 1.623 1.00 40.65 O HETATM 3068 O HOH 24 69.071 18.786 -14.852 1.00 48.44 O HETATM 3069 O HOH 25 37.606 24.441 15.788 1.00 63.20 O HETATM 3070 O HOH 26 37.722 24.295 -10.856 1.00 49.81 O HETATM 3071 O HOH 27 69.302 30.276 2.723 1.00 46.89 O HETATM 3072 O HOH 28 54.825 12.878 1.133 1.00 33.28 O HETATM 3073 O HOH 29 53.822 20.293 8.180 1.00 36.56 O HETATM 3074 O HOH 30 15.974 20.348 7.974 1.00 63.65 O HETATM 3075 O HOH 31 24.435 16.487 3.621 1.00 44.78 O HETATM 3076 O HOH 32 25.307 33.352 3.894 1.00 46.33 O HETATM 3077 O HOH 33 45.110 10.610 -3.971 1.00 45.89 O HETATM 3078 O HOH 34 55.380 34.275 18.753 1.00 65.34 O HETATM 3079 O HOH 35 64.861 12.710 14.569 1.00 61.39 O HETATM 3080 O HOH 36 53.395 31.686 18.005 1.00 79.72 O HETATM 3081 O HOH 37 59.666 30.220 8.065 1.00 39.70 O HETATM 3082 O HOH 38 71.627 26.359 -14.271 1.00 50.94 O HETATM 3083 O HOH 39 60.893 25.998 -7.930 1.00 40.98 O HETATM 3084 O HOH 40 29.201 40.017 6.169 1.00 45.62 O HETATM 3085 O HOH 41 71.875 20.633 -6.242 1.00 47.44 O HETATM 3086 O HOH 42 52.038 12.108 0.796 1.00 40.30 O HETATM 3087 O HOH 43 45.169 31.553 -3.530 1.00 39.70 O HETATM 3088 O HOH 44 20.673 23.041 11.338 1.00 62.82 O HETATM 3089 O HOH 45 29.970 40.942 -0.523 1.00 38.20 O HETATM 3090 O HOH 46 63.064 28.234 -4.793 1.00 45.49 O HETATM 3091 O HOH 47 36.943 12.312 -11.929 1.00 69.97 O HETATM 3092 O HOH 48 68.083 12.372 -10.713 1.00 31.21 O HETATM 3093 O HOH 49 70.335 17.173 9.752 1.00 52.91 O HETATM 3094 O HOH 50 49.913 9.075 10.138 1.00 43.84 O HETATM 3095 O HOH 51 27.522 37.579 1.744 1.00 48.45 O HETATM 3096 O HOH 52 55.763 35.837 17.055 1.00 62.70 O HETATM 3097 O HOH 53 20.041 17.770 4.351 1.00 55.26 O HETATM 3098 O HOH 54 36.270 24.969 -14.864 1.00 57.42 O HETATM 3099 O HOH 55 68.006 16.322 -15.318 1.00 48.27 O HETATM 3100 O HOH 56 16.705 38.572 2.736 1.00 43.54 O HETATM 3101 O HOH 57 20.516 20.553 10.104 1.00 59.30 O HETATM 3102 O HOH 58 22.400 15.853 3.896 1.00 51.42 O HETATM 3103 O HOH 59 56.333 32.022 18.188 1.00 68.53 O HETATM 3104 C4 K A 6 41.857 23.502 0.778 1.00 0.07 C HETATM 3105 C7 K A 6 41.180 22.295 1.423 1.00 0.12 C HETATM 3106 C8 K A 6 39.681 22.337 1.179 1.00 -0.05 C HETATM 3107 H1 K A 6 39.208 21.462 1.649 1.00 0.02 H HETATM 3108 H2 K A 6 39.485 22.322 0.097 1.00 0.02 H HETATM 3109 H3 K A 6 39.264 23.257 1.615 1.00 0.02 H HETATM 3110 C9 K A 6 41.608 21.015 0.821 1.00 -0.11 C HETATM 3111 C10 K A 6 41.891 19.929 0.413 1.00 -0.08 C HETATM 3112 C11 K A 6 42.262 18.662 -0.150 1.00 0.06 C HETATM 3113 C12 K A 6 42.335 18.584 -1.535 1.00 -0.04 C HETATM 3114 C13 K A 6 42.777 17.427 -2.169 1.00 0.03 C HETATM 3115 C14 K A 6 43.221 16.333 -1.422 1.00 -0.02 C HETATM 3116 C15 K A 6 43.141 16.386 -0.033 1.00 -0.02 C HETATM 3117 C16 K A 6 42.642 17.521 0.563 1.00 0.15 C HETATM 3118 F17 K A 6 42.441 17.517 1.896 1.00 -0.18 F HETATM 3119 H9 K A 6 43.467 15.546 0.570 1.00 0.06 H HETATM 3120 C18 K A 6 43.774 15.109 -2.131 1.00 0.00 C HETATM 3121 C19 K A 6 44.691 15.466 -3.343 1.00 -0.01 C HETATM 3122 C20 K A 6 43.509 15.269 -4.320 1.00 0.08 C HETATM 3123 C21 K A 6 42.755 14.609 -3.204 1.00 -0.01 C HETATM 3124 H14 K A 6 41.739 15.007 -3.064 1.00 0.03 H HETATM 3125 H15 K A 6 42.711 13.513 -3.291 1.00 0.03 H HETATM 3126 N22 K A 6 42.835 16.560 -4.583 1.00 -0.22 N HETATM 3127 C23 K A 6 42.591 17.514 -3.628 1.00 0.14 C HETATM 3128 N24 K A 6 42.092 18.625 -4.136 1.00 -0.30 N HETATM 3129 C25 K A 6 41.975 18.396 -5.497 1.00 0.11 C HETATM 3130 C26 K A 6 42.384 17.117 -5.812 1.00 0.17 C HETATM 3131 C27 K A 6 42.369 16.269 -6.991 1.00 0.23 C HETATM 3132 N29 K A 6 42.970 16.757 -8.067 1.00 -0.29 N HETATM 3133 C30 K A 6 42.948 16.047 -9.333 1.00 0.02 C HETATM 3134 H16 K A 6 43.503 16.625 -10.087 1.00 0.05 H HETATM 3135 H17 K A 6 41.907 15.918 -9.663 1.00 0.05 H HETATM 3136 H18 K A 6 43.418 15.060 -9.208 1.00 0.05 H HETATM 3137 H19 K A 6 43.449 17.633 -8.005 1.00 0.18 H HETATM 3138 O28 K A 6 41.787 15.188 -6.988 1.00 -0.38 O HETATM 3139 C31 K A 6 41.627 19.438 -6.448 1.00 0.20 C HETATM 3140 N33 K A 6 41.479 20.663 -5.961 1.00 -0.30 N HETATM 3141 H20 K A 6 41.240 21.418 -6.571 1.00 0.18 H HETATM 3142 H21 K A 6 41.607 20.831 -4.984 1.00 0.18 H HETATM 3143 O32 K A 6 41.489 19.162 -7.649 1.00 -0.39 O HETATM 3144 H13 K A 6 43.703 14.682 -5.230 1.00 0.07 H HETATM 3145 H11 K A 6 45.520 14.760 -3.498 1.00 0.03 H HETATM 3146 H12 K A 6 45.083 16.493 -3.318 1.00 0.03 H HETATM 3147 H10 K A 6 44.165 14.365 -1.421 1.00 0.05 H HETATM 3148 H4 K A 6 42.042 19.440 -2.132 1.00 0.06 H HETATM 3149 O34 K A 6 41.291 22.349 2.851 1.00 -0.41 O HETATM 3150 H22 K A 6 40.842 21.603 3.231 1.00 0.20 H HETATM 3151 C3 K A 6 42.109 24.715 1.452 1.00 -0.02 C HETATM 3152 C2 K A 6 42.664 25.518 0.532 1.00 0.16 C HETATM 3153 C1 K A 6 43.152 26.920 0.537 1.00 0.01 C HETATM 3154 H6 K A 6 43.539 27.177 -0.460 1.00 0.05 H HETATM 3155 H7 K A 6 43.955 27.026 1.281 1.00 0.05 H HETATM 3156 H8 K A 6 42.323 27.596 0.794 1.00 0.05 H HETATM 3157 O6 K A 6 42.763 24.862 -0.637 1.00 -0.12 O HETATM 3158 N5 K A 6 42.238 23.562 -0.467 1.00 -0.08 N HETATM 3159 H5 K A 6 41.898 24.949 2.494 1.00 0.04 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 271 272 279 280 281 CONECT 279 271 CONECT 280 271 CONECT 281 271 CONECT 1876 1877 1881 1882 1883 CONECT 1881 1876 CONECT 1882 1876 CONECT 1883 1876 CONECT 3104 3105 3151 3158 CONECT 3105 3104 3106 3110 3149 CONECT 3106 3105 3107 3108 3109 CONECT 3107 3106 CONECT 3108 3106 CONECT 3109 3106 CONECT 3110 3105 3111 CONECT 3111 3110 3112 CONECT 3112 3111 3113 3117 CONECT 3113 3112 3114 3148 CONECT 3114 3113 3115 3127 CONECT 3115 3114 3116 3120 CONECT 3116 3115 3117 3119 CONECT 3117 3112 3116 3118 CONECT 3118 3117 CONECT 3119 3116 CONECT 3120 3115 3121 3123 3147 CONECT 3121 3120 3122 3145 3146 CONECT 3122 3121 3123 3126 3144 CONECT 3123 3120 3122 3124 3125 CONECT 3124 3123 CONECT 3125 3123 CONECT 3126 3122 3127 3130 CONECT 3127 3114 3126 3128 CONECT 3128 3127 3129 CONECT 3129 3128 3130 3139 CONECT 3130 3126 3129 3131 CONECT 3131 3130 3132 3138 CONECT 3132 3131 3133 3137 CONECT 3133 3132 3134 3135 3136 CONECT 3134 3133 CONECT 3135 3133 CONECT 3136 3133 CONECT 3137 3132 CONECT 3138 3131 CONECT 3139 3129 3140 3143 CONECT 3140 3139 3141 3142 CONECT 3141 3140 CONECT 3142 3140 CONECT 3143 3139 CONECT 3144 3122 CONECT 3145 3121 CONECT 3146 3121 CONECT 3147 3120 CONECT 3148 3113 CONECT 3149 3105 3150 CONECT 3150 3149 CONECT 3151 3104 3152 3159 CONECT 3152 3151 3153 3157 CONECT 3153 3152 3154 3155 3156 CONECT 3154 3153 CONECT 3155 3153 CONECT 3156 3153 CONECT 3157 3152 3158 CONECT 3158 3104 3157 CONECT 3159 3151 MASTER 0 0 0 0 0 0 0 0 3156 3 67 26 END
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Related entries of code: 6myn
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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PDBbind
352aa, >4G3E_1|Chains... *
4g3f
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PDBbind
336aa, >4G3F_1|Chain... at 99%
4g3g
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PDBbind
350aa, >4G3G_1|Chain... at 95%
5t8o
RCSB PDB
PDBbind
349aa, >5T8O_1|Chains... at 100%
5t8p
RCSB PDB
PDBbind
349aa, >5T8P_1|Chains... at 100%
5t8q
RCSB PDB
PDBbind
349aa, >5T8Q_1|Chains... at 100%
6g4y
RCSB PDB
PDBbind
349aa, >6G4Y_1|Chains... at 100%
6g4z
RCSB PDB
PDBbind
349aa, >6G4Z_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6myn
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Mitogen-activated protein kinase kinase kinase 14
Ligand Name
2.7.11.25
EC.Number
E.C.-.-.-.-
Resolution
2.74(Å)
Affinity (Kd/Ki/IC50)
Ki=14nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Acs Med.Chem.Lett. Vol. 10: pp. 1260-1265
Ligand Properties
Formula
C
2
4
H
2
2
FN
5
O
4
Molecular Weight
463.461
Exact Mass
463.166
No. of atoms
56
No. of bonds
60
Polar Surface Area
136.27
LOGP Value
1.16 (
Computed with XLOGP3
)
3.23 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
Canonical SMILES
CNC(=O)c1c(nc2n1[C@@H]1C[C@@H](C1)c1c2cc(C#C[C@](c2noc(c2)C)(O)C)c(c1)F)C(=O)N
InChI String
InChI=1S/C24H22FN5O4/c1-11-6-18(29-34-11)24(2,33)5-4-12-9-16-15(10-17(12)25)13-7-14(8-13)30-20(23(32)27-3)19(21(26)31)28-22(16)30/h6,9-10,13-14,33H,7-8H2,1-3H3,(H2,26,31)(H,27,32)/t13-,14+,24-/m1/s1
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):
Q9WUL6
Entrez Gene ID
NCBI Entrez Gene ID:
53859
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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