Browse entries in the PDBbind-CN Database
HEADER 5H3Q_COMPLEX COMPND 5H3Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 48 SER GLY LEU GLN GLY HIS ILE ILE GLU ASN PRO GLN TYR SEQRES 2 A 48 PHE SER ASP ALA CYS VAL HIS HIS ILE LYS ARG ARG ASP SEQRES 3 A 48 ILE VAL LEU LYS TRP GLU LEU GLY GLU GLY ALA PHE GLY SEQRES 4 A 48 LYS VAL PHE LEU ALA GLU CYS HIS ASN SEQRES 1 A 11 LYS MET LEU VAL ALA VAL LYS ALA LEU LYS GLU SEQRES 1 A 244 ALA ARG GLN ASP PHE GLN ARG GLU ALA GLU LEU LEU THR SEQRES 2 A 244 MET LEU GLN HIS GLN HIS ILE VAL ARG PHE PHE GLY VAL SEQRES 3 A 244 CYS THR GLU GLY ARG PRO LEU LEU MET VAL PHE GLU TYR SEQRES 4 A 244 MET ARG HIS GLY ASP LEU ASN ARG PHE LEU ARG SER HIS SEQRES 5 A 244 GLY PRO ASP ALA LYS LEU LEU ALA GLY GLY GLU ASP VAL SEQRES 6 A 244 ALA PRO GLY PRO LEU GLY LEU GLY GLN LEU LEU ALA VAL SEQRES 7 A 244 ALA SER GLN VAL ALA ALA GLY MET VAL TYR LEU ALA GLY SEQRES 8 A 244 LEU HIS PHE VAL HIS ARG ASP LEU ALA THR ARG ASN CYS SEQRES 9 A 244 LEU VAL GLY GLN GLY LEU VAL VAL LYS ILE GLY ASP PHE SEQRES 10 A 244 GLY MET SER ARG ASP ILE TYR SER THR ASP TYR TYR ARG SEQRES 11 A 244 VAL GLY GLY ARG THR MET LEU PRO ILE ARG TRP MET PRO SEQRES 12 A 244 PRO GLU SER ILE LEU TYR ARG LYS PHE THR THR GLU SER SEQRES 13 A 244 ASP VAL TRP SER PHE GLY VAL VAL LEU TRP GLU ILE PHE SEQRES 14 A 244 THR TYR GLY LYS GLN PRO TRP TYR GLN LEU SER ASN THR SEQRES 15 A 244 GLU ALA ILE ASP CYS ILE THR GLN GLY ARG GLU LEU GLU SEQRES 16 A 244 ARG PRO ARG ALA CYS PRO PRO GLU VAL TYR ALA ILE MET SEQRES 17 A 244 ARG GLY CYS TRP GLN ARG GLU PRO GLN GLN ARG HIS SER SEQRES 18 A 244 ILE LYS ASP VAL HIS ALA ARG LEU GLN ALA LEU ALA GLN SEQRES 19 A 244 ALA PRO PRO VAL TYR LEU ASP VAL LEU GLY HET NA A 1 1 HET UNN A 399 68 ATOM 1 N SER A 484 51.692 36.118 -10.042 1.00111.82 N ATOM 2 CA SER A 484 50.589 35.171 -10.428 1.00103.97 C ATOM 3 C SER A 484 49.412 35.391 -9.476 1.00 94.23 C ATOM 4 O SER A 484 48.312 35.771 -9.888 1.00103.24 O ATOM 5 CB SER A 484 51.108 33.695 -10.520 1.00108.66 C ATOM 6 OG SER A 484 51.238 32.965 -9.284 1.00 97.92 O ATOM 7 HG SER A 484 51.877 33.434 -8.691 1.00 0.00 H ATOM 8 HN3 SER A 484 51.984 35.927 -9.062 1.00 0.00 H ATOM 9 HN2 SER A 484 51.349 37.097 -10.118 1.00 0.00 H ATOM 10 HN1 SER A 484 52.502 35.983 -10.680 1.00 0.00 H ATOM 11 N GLY A 485 49.703 35.274 -8.194 1.00 75.71 N ATOM 12 CA GLY A 485 48.732 35.440 -7.134 1.00 74.96 C ATOM 13 C GLY A 485 48.284 34.097 -6.569 1.00 59.46 C ATOM 14 O GLY A 485 47.445 34.064 -5.696 1.00 66.62 O ATOM 15 H GLY A 485 50.684 35.050 -7.931 1.00 0.00 H ATOM 16 N LEU A 486 48.865 32.991 -7.017 1.00 54.53 N ATOM 17 CA LEU A 486 48.379 31.663 -6.611 1.00 48.25 C ATOM 18 C LEU A 486 49.052 31.166 -5.302 1.00 40.58 C ATOM 19 O LEU A 486 50.262 30.864 -5.255 1.00 37.90 O ATOM 20 CB LEU A 486 48.586 30.682 -7.759 1.00 53.30 C ATOM 21 CG LEU A 486 47.756 29.438 -7.734 1.00 49.51 C ATOM 22 CD1 LEU A 486 46.301 29.731 -7.850 1.00 52.74 C ATOM 23 CD2 LEU A 486 48.157 28.560 -8.868 1.00 52.87 C ATOM 24 H LEU A 486 49.676 33.064 -7.664 1.00 0.00 H ATOM 25 N GLN A 487 48.264 31.123 -4.244 1.00 35.26 N ATOM 26 CA GLN A 487 48.769 30.721 -2.968 1.00 38.23 C ATOM 27 C GLN A 487 49.248 29.235 -3.025 1.00 32.48 C ATOM 28 O GLN A 487 48.475 28.299 -3.464 1.00 31.82 O ATOM 29 CB GLN A 487 47.704 30.864 -1.922 1.00 38.16 C ATOM 30 CG GLN A 487 47.362 32.289 -1.490 1.00 38.89 C ATOM 31 CD GLN A 487 46.133 32.252 -0.598 1.00 40.98 C ATOM 32 OE1 GLN A 487 45.095 32.709 -1.010 1.00 40.02 O ATOM 33 NE2 GLN A 487 46.213 31.598 0.597 1.00 42.26 N ATOM 34 HE22 GLN A 487 47.125 31.217 0.921 1.00 0.00 H ATOM 35 HE21 GLN A 487 45.362 31.481 1.184 1.00 0.00 H ATOM 36 H GLN A 487 47.262 31.385 -4.340 1.00 0.00 H ATOM 37 N GLY A 488 50.470 29.041 -2.552 1.00 30.74 N ATOM 38 CA GLY A 488 51.104 27.674 -2.556 1.00 33.48 C ATOM 39 C GLY A 488 52.071 27.449 -3.687 1.00 34.34 C ATOM 40 O GLY A 488 52.819 26.483 -3.662 1.00 37.02 O ATOM 41 H GLY A 488 51.003 29.849 -2.170 1.00 0.00 H ATOM 42 N HIS A 489 52.018 28.337 -4.695 1.00 35.88 N ATOM 43 CA HIS A 489 52.942 28.357 -5.807 1.00 36.84 C ATOM 44 C HIS A 489 54.267 28.933 -5.384 1.00 39.98 C ATOM 45 O HIS A 489 54.366 30.077 -4.916 1.00 35.81 O ATOM 46 CB HIS A 489 52.441 29.156 -7.028 1.00 36.65 C ATOM 47 CG HIS A 489 53.114 28.767 -8.305 1.00 39.81 C ATOM 48 ND1 HIS A 489 52.864 29.402 -9.496 1.00 40.16 N ATOM 49 CD2 HIS A 489 53.995 27.769 -8.591 1.00 38.46 C ATOM 50 CE1 HIS A 489 53.495 28.784 -10.464 1.00 41.33 C ATOM 51 NE2 HIS A 489 54.216 27.809 -9.940 1.00 42.62 N ATOM 52 H HIS A 489 51.265 29.054 -4.674 1.00 0.00 H ATOM 53 N ILE A 490 55.300 28.092 -5.512 1.00 35.43 N ATOM 54 CA ILE A 490 56.623 28.403 -5.027 1.00 37.05 C ATOM 55 C ILE A 490 57.154 29.706 -5.621 1.00 37.35 C ATOM 56 O ILE A 490 57.932 30.390 -4.965 1.00 39.25 O ATOM 57 CB ILE A 490 57.586 27.234 -5.314 1.00 35.59 C ATOM 58 CG1 ILE A 490 59.034 27.522 -4.912 1.00 41.01 C ATOM 59 CG2 ILE A 490 57.681 26.981 -6.806 1.00 35.37 C ATOM 60 CD1 ILE A 490 59.350 27.281 -3.513 1.00 47.67 C ATOM 61 H ILE A 490 55.143 27.177 -5.980 1.00 0.00 H ATOM 62 N ILE A 491 56.779 30.026 -6.862 1.00 36.39 N ATOM 63 CA ILE A 491 57.295 31.245 -7.475 1.00 41.86 C ATOM 64 C ILE A 491 56.693 32.514 -6.933 1.00 42.19 C ATOM 65 O ILE A 491 57.172 33.529 -7.276 1.00 38.70 O ATOM 66 CB ILE A 491 57.160 31.297 -8.987 1.00 41.49 C ATOM 67 CG1 ILE A 491 55.710 31.360 -9.430 1.00 46.38 C ATOM 68 CG2 ILE A 491 57.810 30.085 -9.548 1.00 47.47 C ATOM 69 CD1 ILE A 491 55.591 31.492 -10.942 1.00 52.28 C ATOM 70 H ILE A 491 56.125 29.411 -7.387 1.00 0.00 H ATOM 71 N GLU A 492 55.736 32.463 -6.023 1.00 40.54 N ATOM 72 CA GLU A 492 55.315 33.702 -5.325 1.00 36.68 C ATOM 73 C GLU A 492 56.388 34.169 -4.341 1.00 44.00 C ATOM 74 O GLU A 492 56.194 35.166 -3.752 1.00 47.01 O ATOM 75 CB GLU A 492 54.018 33.487 -4.553 1.00 36.52 C ATOM 76 CG GLU A 492 52.885 32.980 -5.401 1.00 47.90 C ATOM 77 CD GLU A 492 52.331 34.100 -6.265 1.00 60.31 C ATOM 78 OE1 GLU A 492 51.596 34.954 -5.697 1.00 77.71 O ATOM 79 OE2 GLU A 492 52.640 34.144 -7.479 1.00 70.07 O ATOM 80 H GLU A 492 55.279 31.556 -5.797 1.00 0.00 H ATOM 81 N ASN A 493 57.468 33.422 -4.088 1.00 37.10 N ATOM 82 CA ASN A 493 58.489 33.845 -3.192 1.00 37.79 C ATOM 83 C ASN A 493 59.583 34.570 -3.937 1.00 46.90 C ATOM 84 O ASN A 493 59.719 34.392 -5.116 1.00 42.04 O ATOM 85 CB ASN A 493 59.116 32.636 -2.504 1.00 39.48 C ATOM 86 CG ASN A 493 58.213 32.070 -1.470 1.00 39.42 C ATOM 87 OD1 ASN A 493 58.202 32.526 -0.354 1.00 37.87 O ATOM 88 ND2 ASN A 493 57.443 31.060 -1.842 1.00 35.41 N ATOM 89 HD22 ASN A 493 57.490 30.702 -2.817 1.00 0.00 H ATOM 90 HD21 ASN A 493 56.791 30.624 -1.159 1.00 0.00 H ATOM 91 H ASN A 493 57.565 32.501 -4.562 1.00 0.00 H ATOM 92 N PRO A 494 60.390 35.368 -3.220 1.00 49.10 N ATOM 93 CA PRO A 494 61.457 36.097 -3.900 1.00 48.35 C ATOM 94 C PRO A 494 62.641 35.204 -4.236 1.00 51.10 C ATOM 95 O PRO A 494 63.051 34.357 -3.416 1.00 48.51 O ATOM 96 CB PRO A 494 61.923 37.070 -2.800 1.00 53.11 C ATOM 97 CG PRO A 494 61.788 36.236 -1.510 1.00 59.53 C ATOM 98 CD PRO A 494 60.454 35.544 -1.747 1.00 53.65 C ATOM 99 N GLN A 495 63.275 35.461 -5.376 1.00 48.07 N ATOM 100 CA GLN A 495 64.505 34.799 -5.745 1.00 45.45 C ATOM 101 C GLN A 495 65.708 35.620 -5.370 1.00 48.61 C ATOM 102 O GLN A 495 65.964 36.621 -5.980 1.00 48.15 O ATOM 103 CB GLN A 495 64.516 34.537 -7.223 1.00 47.44 C ATOM 104 CG GLN A 495 65.787 33.868 -7.681 1.00 48.91 C ATOM 105 CD GLN A 495 65.702 33.577 -9.153 1.00 61.30 C ATOM 106 OE1 GLN A 495 65.349 34.459 -9.941 1.00 64.27 O ATOM 107 NE2 GLN A 495 65.973 32.333 -9.538 1.00 57.31 N ATOM 108 HE22 GLN A 495 66.267 31.624 -8.836 1.00 0.00 H ATOM 109 HE21 GLN A 495 65.891 32.069 -10.541 1.00 0.00 H ATOM 110 H GLN A 495 62.871 36.165 -6.026 1.00 0.00 H ATOM 111 N TYR A 496 66.451 35.158 -4.377 1.00 56.76 N ATOM 112 CA TYR A 496 67.696 35.779 -3.946 1.00 65.48 C ATOM 113 C TYR A 496 68.944 35.357 -4.743 1.00 67.65 C ATOM 114 O TYR A 496 69.839 36.156 -4.892 1.00 61.18 O ATOM 115 CB TYR A 496 67.929 35.523 -2.424 1.00 77.32 C ATOM 116 CG TYR A 496 67.016 36.369 -1.561 1.00 86.83 C ATOM 117 CD1 TYR A 496 67.012 37.770 -1.699 1.00 97.30 C ATOM 118 CD2 TYR A 496 66.129 35.796 -0.659 1.00 92.22 C ATOM 119 CE1 TYR A 496 66.177 38.570 -0.948 1.00100.14 C ATOM 120 CE2 TYR A 496 65.288 36.596 0.108 1.00100.21 C ATOM 121 CZ TYR A 496 65.324 37.984 -0.041 1.00102.74 C ATOM 122 OH TYR A 496 64.519 38.816 0.698 1.00 93.55 O ATOM 123 HH TYR A 496 64.696 39.756 0.444 1.00 0.00 H ATOM 124 H TYR A 496 66.128 34.305 -3.877 1.00 0.00 H ATOM 125 N PHE A 497 69.042 34.110 -5.201 1.00 57.73 N ATOM 126 CA PHE A 497 70.230 33.664 -5.881 1.00 53.86 C ATOM 127 C PHE A 497 69.782 33.376 -7.299 1.00 55.51 C ATOM 128 O PHE A 497 69.338 32.287 -7.628 1.00 54.05 O ATOM 129 CB PHE A 497 70.767 32.426 -5.229 1.00 55.31 C ATOM 130 CG PHE A 497 71.307 32.640 -3.871 1.00 55.44 C ATOM 131 CD1 PHE A 497 72.546 33.223 -3.695 1.00 61.40 C ATOM 132 CD2 PHE A 497 70.621 32.193 -2.767 1.00 68.16 C ATOM 133 CE1 PHE A 497 73.079 33.404 -2.435 1.00 59.32 C ATOM 134 CE2 PHE A 497 71.138 32.366 -1.512 1.00 70.05 C ATOM 135 CZ PHE A 497 72.383 32.964 -1.343 1.00 66.33 C ATOM 136 H PHE A 497 68.250 33.450 -5.066 1.00 0.00 H ATOM 137 N SER A 498 69.877 34.389 -8.132 1.00 57.63 N ATOM 138 CA SER A 498 69.515 34.292 -9.528 1.00 63.61 C ATOM 139 C SER A 498 70.509 33.448 -10.316 1.00 56.04 C ATOM 140 O SER A 498 70.180 33.038 -11.417 1.00 65.67 O ATOM 141 CB SER A 498 69.414 35.688 -10.166 1.00 65.47 C ATOM 142 OG SER A 498 70.701 36.256 -10.292 1.00 66.80 O ATOM 143 HG SER A 498 70.626 37.153 -10.703 1.00 0.00 H ATOM 144 H SER A 498 70.228 35.299 -7.771 1.00 0.00 H ATOM 145 N ASP A 499 71.705 33.180 -9.789 1.00 53.59 N ATOM 146 CA ASP A 499 72.593 32.237 -10.476 1.00 52.58 C ATOM 147 C ASP A 499 72.612 30.872 -9.874 1.00 43.92 C ATOM 148 O ASP A 499 73.407 30.119 -10.275 1.00 45.15 O ATOM 149 CB ASP A 499 74.047 32.748 -10.589 1.00 61.32 C ATOM 150 CG ASP A 499 74.130 34.228 -10.938 1.00 78.65 C ATOM 151 OD1 ASP A 499 73.473 34.631 -11.917 1.00 86.22 O ATOM 152 OD2 ASP A 499 74.828 34.985 -10.210 1.00 91.20 O ATOM 153 H ASP A 499 72.004 33.634 -8.902 1.00 0.00 H ATOM 154 N ALA A 500 71.770 30.506 -8.914 1.00 49.12 N ATOM 155 CA ALA A 500 71.816 29.095 -8.412 1.00 52.89 C ATOM 156 C ALA A 500 71.709 28.107 -9.623 1.00 52.46 C ATOM 157 O ALA A 500 70.895 28.319 -10.530 1.00 46.60 O ATOM 158 CB ALA A 500 70.726 28.806 -7.366 1.00 52.30 C ATOM 159 H ALA A 500 71.091 31.187 -8.518 1.00 0.00 H ATOM 160 N CYS A 501 72.559 27.077 -9.656 1.00 44.09 N ATOM 161 CA CYS A 501 72.591 26.227 -10.824 1.00 39.17 C ATOM 162 C CYS A 501 71.398 25.209 -10.628 1.00 41.23 C ATOM 163 O CYS A 501 70.984 24.891 -9.519 1.00 41.09 O ATOM 164 CB CYS A 501 73.992 25.599 -10.942 1.00 36.69 C ATOM 165 SG CYS A 501 74.405 24.430 -9.580 1.00 48.44 S ATOM 166 H CYS A 501 73.190 26.889 -8.851 1.00 0.00 H ATOM 167 N VAL A 502 70.895 24.665 -11.713 1.00 36.45 N ATOM 168 CA VAL A 502 69.823 23.693 -11.743 1.00 39.22 C ATOM 169 C VAL A 502 70.415 22.488 -12.400 1.00 38.11 C ATOM 170 O VAL A 502 71.063 22.640 -13.378 1.00 34.81 O ATOM 171 CB VAL A 502 68.656 24.242 -12.558 1.00 41.00 C ATOM 172 CG1 VAL A 502 67.610 23.169 -12.902 1.00 43.24 C ATOM 173 CG2 VAL A 502 68.000 25.394 -11.768 1.00 44.43 C ATOM 174 H VAL A 502 71.300 24.957 -12.625 1.00 0.00 H ATOM 175 N HIS A 503 70.265 21.307 -11.811 1.00 35.74 N ATOM 176 CA HIS A 503 70.770 20.104 -12.384 1.00 38.80 C ATOM 177 C HIS A 503 69.859 19.676 -13.583 1.00 38.52 C ATOM 178 O HIS A 503 68.650 19.750 -13.493 1.00 41.28 O ATOM 179 CB HIS A 503 70.860 19.042 -11.290 1.00 39.10 C ATOM 180 CG HIS A 503 71.410 17.730 -11.776 1.00 42.56 C ATOM 181 ND1 HIS A 503 72.731 17.565 -12.137 1.00 50.48 N ATOM 182 CD2 HIS A 503 70.807 16.543 -12.042 1.00 44.90 C ATOM 183 CE1 HIS A 503 72.936 16.330 -12.555 1.00 45.49 C ATOM 184 NE2 HIS A 503 71.776 15.702 -12.540 1.00 54.21 N ATOM 185 H HIS A 503 69.762 21.259 -10.902 1.00 0.00 H ATOM 186 N HIS A 504 70.470 19.349 -14.713 1.00 37.48 N ATOM 187 CA HIS A 504 69.829 18.927 -15.928 1.00 36.94 C ATOM 188 C HIS A 504 70.112 17.458 -16.063 1.00 43.66 C ATOM 189 O HIS A 504 71.210 17.010 -15.908 1.00 48.29 O ATOM 190 CB HIS A 504 70.351 19.675 -17.176 1.00 39.12 C ATOM 191 CG HIS A 504 69.734 21.020 -17.368 1.00 40.41 C ATOM 192 ND1 HIS A 504 70.015 22.092 -16.532 1.00 44.23 N ATOM 193 CD2 HIS A 504 68.742 21.445 -18.190 1.00 41.74 C ATOM 194 CE1 HIS A 504 69.297 23.147 -16.897 1.00 42.27 C ATOM 195 NE2 HIS A 504 68.495 22.771 -17.883 1.00 45.44 N ATOM 196 H HIS A 504 71.509 19.403 -14.721 1.00 0.00 H ATOM 197 N ILE A 505 69.077 16.702 -16.294 1.00 41.00 N ATOM 198 CA ILE A 505 69.168 15.271 -16.361 1.00 42.60 C ATOM 199 C ILE A 505 68.979 14.917 -17.842 1.00 38.39 C ATOM 200 O ILE A 505 68.091 15.474 -18.528 1.00 41.70 O ATOM 201 CB ILE A 505 68.047 14.655 -15.567 1.00 38.88 C ATOM 202 CG1 ILE A 505 68.282 14.974 -14.106 1.00 44.65 C ATOM 203 CG2 ILE A 505 67.935 13.180 -15.851 1.00 40.11 C ATOM 204 CD1 ILE A 505 67.020 14.828 -13.291 1.00 42.23 C ATOM 205 H ILE A 505 68.150 17.152 -16.435 1.00 0.00 H ATOM 206 N LYS A 506 69.786 13.989 -18.322 1.00 43.50 N ATOM 207 CA LYS A 506 69.686 13.536 -19.733 1.00 50.47 C ATOM 208 C LYS A 506 68.477 12.587 -19.927 1.00 46.67 C ATOM 209 O LYS A 506 68.128 11.711 -19.066 1.00 38.05 O ATOM 210 CB LYS A 506 70.925 12.733 -20.105 1.00 60.51 C ATOM 211 CG LYS A 506 72.220 13.493 -20.100 1.00 65.93 C ATOM 212 CD LYS A 506 73.368 12.488 -20.375 1.00 86.15 C ATOM 213 CE LYS A 506 74.443 12.991 -21.346 1.00 78.63 C ATOM 214 NZ LYS A 506 74.840 14.404 -21.038 1.00 81.78 N ATOM 215 HZ1 LYS A 506 74.007 15.022 -21.117 1.00 0.00 H ATOM 216 HZ2 LYS A 506 75.219 14.453 -20.071 1.00 0.00 H ATOM 217 HZ3 LYS A 506 75.568 14.713 -21.713 1.00 0.00 H ATOM 218 H LYS A 506 70.505 13.567 -17.700 1.00 0.00 H ATOM 219 N ARG A 507 67.881 12.717 -21.085 1.00 42.98 N ATOM 220 CA ARG A 507 66.808 11.816 -21.506 1.00 49.83 C ATOM 221 C ARG A 507 67.168 10.325 -21.345 1.00 46.88 C ATOM 222 O ARG A 507 66.379 9.523 -20.828 1.00 50.72 O ATOM 223 CB ARG A 507 66.451 12.125 -22.941 1.00 52.44 C ATOM 224 CG ARG A 507 65.635 11.057 -23.580 1.00 56.04 C ATOM 225 CD ARG A 507 65.254 11.440 -24.990 1.00 64.88 C ATOM 226 NE ARG A 507 64.173 10.537 -25.376 1.00 73.70 N ATOM 227 CZ ARG A 507 62.954 10.878 -25.801 1.00 75.20 C ATOM 228 NH1 ARG A 507 62.593 12.161 -25.972 1.00 70.68 N ATOM 229 NH2 ARG A 507 62.073 9.898 -26.071 1.00 74.79 N ATOM 230 HE ARG A 507 64.374 9.519 -25.313 1.00 0.00 H ATOM 231 HH12 ARG A 507 61.635 12.392 -26.305 1.00 0.00 H ATOM 232 HH11 ARG A 507 63.272 12.923 -25.772 1.00 0.00 H ATOM 233 HH22 ARG A 507 61.117 10.136 -26.404 1.00 0.00 H ATOM 234 HH21 ARG A 507 62.348 8.903 -25.947 1.00 0.00 H ATOM 235 H ARG A 507 68.178 13.482 -21.724 1.00 0.00 H ATOM 236 N ARG A 508 68.369 9.951 -21.741 1.00 43.15 N ATOM 237 CA ARG A 508 68.735 8.548 -21.622 1.00 51.04 C ATOM 238 C ARG A 508 68.789 8.082 -20.170 1.00 52.96 C ATOM 239 O ARG A 508 68.913 6.924 -19.970 1.00 56.91 O ATOM 240 CB ARG A 508 70.052 8.197 -22.344 1.00 51.70 C ATOM 241 CG ARG A 508 71.244 9.109 -22.077 1.00 59.67 C ATOM 242 CD ARG A 508 72.578 8.371 -21.896 1.00 73.29 C ATOM 243 NE ARG A 508 73.679 9.323 -22.121 1.00 86.79 N ATOM 244 CZ ARG A 508 74.292 9.557 -23.297 1.00101.50 C ATOM 245 NH1 ARG A 508 73.983 8.883 -24.422 1.00 90.71 N ATOM 246 NH2 ARG A 508 75.266 10.470 -23.354 1.00102.57 N ATOM 247 HE ARG A 508 74.013 9.863 -21.298 1.00 0.00 H ATOM 248 HH12 ARG A 508 74.482 9.096 -25.309 1.00 0.00 H ATOM 249 HH11 ARG A 508 73.246 8.150 -24.403 1.00 0.00 H ATOM 250 HH22 ARG A 508 75.748 10.661 -24.256 1.00 0.00 H ATOM 251 HH21 ARG A 508 75.542 10.990 -22.497 1.00 0.00 H ATOM 252 H ARG A 508 69.040 10.644 -22.130 1.00 0.00 H ATOM 253 N ASP A 509 68.744 8.965 -19.170 1.00 50.38 N ATOM 254 CA ASP A 509 68.805 8.546 -17.769 1.00 46.35 C ATOM 255 C ASP A 509 67.389 8.402 -17.179 1.00 49.31 C ATOM 256 O ASP A 509 67.281 8.103 -16.016 1.00 46.34 O ATOM 257 CB ASP A 509 69.608 9.558 -16.937 1.00 52.22 C ATOM 258 CG ASP A 509 71.105 9.649 -17.326 1.00 60.57 C ATOM 259 OD1 ASP A 509 71.719 8.617 -17.640 1.00 56.45 O ATOM 260 OD2 ASP A 509 71.654 10.786 -17.288 1.00 81.50 O ATOM 261 H ASP A 509 68.663 9.978 -19.392 1.00 0.00 H ATOM 262 N ILE A 510 66.314 8.641 -17.952 1.00 48.13 N ATOM 263 CA ILE A 510 64.966 8.601 -17.405 1.00 48.78 C ATOM 264 C ILE A 510 64.099 7.684 -18.168 1.00 42.98 C ATOM 265 O ILE A 510 63.997 7.800 -19.354 1.00 46.35 O ATOM 266 CB ILE A 510 64.239 9.987 -17.433 1.00 56.48 C ATOM 267 CG1 ILE A 510 65.079 10.978 -16.689 1.00 58.62 C ATOM 268 CG2 ILE A 510 62.871 9.873 -16.725 1.00 60.19 C ATOM 269 CD1 ILE A 510 64.329 12.125 -16.084 1.00 78.52 C ATOM 270 H ILE A 510 66.449 8.859 -18.960 1.00 0.00 H ATOM 271 N VAL A 511 63.340 6.877 -17.478 1.00 36.21 N ATOM 272 CA VAL A 511 62.452 5.967 -18.142 1.00 38.24 C ATOM 273 C VAL A 511 61.101 6.119 -17.484 1.00 37.07 C ATOM 274 O VAL A 511 60.933 5.718 -16.291 1.00 39.67 O ATOM 275 CB VAL A 511 62.961 4.458 -18.028 1.00 37.84 C ATOM 276 CG1 VAL A 511 62.052 3.519 -18.841 1.00 35.75 C ATOM 277 CG2 VAL A 511 64.349 4.360 -18.603 1.00 36.99 C ATOM 278 H VAL A 511 63.379 6.894 -16.439 1.00 0.00 H ATOM 279 N LEU A 512 60.134 6.637 -18.251 1.00 32.01 N ATOM 280 CA LEU A 512 58.809 6.792 -17.786 1.00 34.33 C ATOM 281 C LEU A 512 58.192 5.435 -17.663 1.00 32.98 C ATOM 282 O LEU A 512 58.318 4.635 -18.563 1.00 33.51 O ATOM 283 CB LEU A 512 57.946 7.625 -18.733 1.00 34.23 C ATOM 284 CG LEU A 512 58.338 9.077 -18.935 1.00 40.95 C ATOM 285 CD1 LEU A 512 57.193 9.730 -19.738 1.00 42.14 C ATOM 286 CD2 LEU A 512 58.683 9.899 -17.668 1.00 38.00 C ATOM 287 H LEU A 512 60.365 6.935 -19.220 1.00 0.00 H ATOM 288 N LYS A 513 57.453 5.189 -16.578 1.00 33.54 N ATOM 289 CA LYS A 513 56.798 3.876 -16.411 1.00 34.04 C ATOM 290 C LYS A 513 55.372 4.013 -16.633 1.00 33.03 C ATOM 291 O LYS A 513 54.865 3.304 -17.462 1.00 39.24 O ATOM 292 CB LYS A 513 57.061 3.276 -15.020 1.00 35.01 C ATOM 293 CG LYS A 513 58.513 2.931 -14.879 1.00 38.34 C ATOM 294 CD LYS A 513 58.891 2.864 -13.403 1.00 55.22 C ATOM 295 CE LYS A 513 58.271 1.662 -12.694 1.00 58.54 C ATOM 296 NZ LYS A 513 58.858 0.381 -13.229 1.00 61.14 N ATOM 297 HZ1 LYS A 513 58.665 0.312 -14.249 1.00 0.00 H ATOM 298 HZ2 LYS A 513 59.886 0.378 -13.069 1.00 0.00 H ATOM 299 HZ3 LYS A 513 58.427 -0.428 -12.738 1.00 0.00 H ATOM 300 H LYS A 513 57.339 5.923 -15.850 1.00 0.00 H ATOM 301 N TRP A 514 54.704 4.886 -15.871 1.00 32.93 N ATOM 302 CA TRP A 514 53.301 5.144 -16.069 1.00 30.38 C ATOM 303 C TRP A 514 52.849 6.381 -15.279 1.00 33.49 C ATOM 304 O TRP A 514 53.472 6.827 -14.322 1.00 36.76 O ATOM 305 CB TRP A 514 52.451 3.922 -15.591 1.00 37.11 C ATOM 306 CG TRP A 514 52.851 3.338 -14.198 1.00 33.17 C ATOM 307 CD1 TRP A 514 52.579 3.870 -13.006 1.00 37.62 C ATOM 308 CD2 TRP A 514 53.638 2.149 -13.946 1.00 37.08 C ATOM 309 NE1 TRP A 514 53.122 3.105 -11.995 1.00 37.06 N ATOM 310 CE2 TRP A 514 53.810 2.053 -12.553 1.00 40.00 C ATOM 311 CE3 TRP A 514 54.173 1.149 -14.766 1.00 41.17 C ATOM 312 CZ2 TRP A 514 54.479 0.965 -11.936 1.00 40.56 C ATOM 313 CZ3 TRP A 514 54.873 0.089 -14.165 1.00 44.37 C ATOM 314 CH2 TRP A 514 54.998 -0.008 -12.756 1.00 42.04 C ATOM 315 HE1 TRP A 514 53.027 3.293 -10.977 1.00 0.00 H ATOM 316 H TRP A 514 55.211 5.391 -15.116 1.00 0.00 H ATOM 317 N GLU A 515 51.696 6.868 -15.659 1.00 31.74 N ATOM 318 CA GLU A 515 51.039 7.923 -15.009 1.00 40.96 C ATOM 319 C GLU A 515 50.530 7.505 -13.628 1.00 47.46 C ATOM 320 O GLU A 515 50.168 6.368 -13.443 1.00 48.30 O ATOM 321 CB GLU A 515 49.860 8.331 -15.838 1.00 42.50 C ATOM 322 CG GLU A 515 49.276 9.648 -15.385 1.00 52.48 C ATOM 323 CD GLU A 515 48.080 10.048 -16.186 1.00 53.67 C ATOM 324 OE1 GLU A 515 47.596 9.217 -16.963 1.00 56.61 O ATOM 325 OE2 GLU A 515 47.616 11.165 -15.995 1.00 65.94 O ATOM 326 H GLU A 515 51.239 6.448 -16.493 1.00 0.00 H ATOM 327 N LEU A 516 50.640 8.425 -12.664 1.00 44.72 N ATOM 328 CA LEU A 516 50.091 8.303 -11.306 1.00 44.03 C ATOM 329 C LEU A 516 48.883 9.282 -11.138 1.00 48.66 C ATOM 330 O LEU A 516 47.974 8.987 -10.398 1.00 63.09 O ATOM 331 CB LEU A 516 51.205 8.663 -10.341 1.00 44.88 C ATOM 332 CG LEU A 516 52.470 7.783 -10.274 1.00 49.29 C ATOM 333 CD1 LEU A 516 53.635 8.387 -9.487 1.00 46.89 C ATOM 334 CD2 LEU A 516 52.095 6.414 -9.709 1.00 53.87 C ATOM 335 H LEU A 516 51.156 9.298 -12.894 1.00 0.00 H ATOM 336 N GLY A 517 48.898 10.431 -11.820 1.00 52.86 N ATOM 337 CA GLY A 517 47.867 11.500 -11.729 1.00 54.18 C ATOM 338 C GLY A 517 47.966 12.655 -12.785 1.00 62.62 C ATOM 339 O GLY A 517 48.872 12.693 -13.684 1.00 45.49 O ATOM 340 H GLY A 517 49.696 10.591 -12.468 1.00 0.00 H ATOM 341 N GLU A 518 47.020 13.604 -12.692 1.00 64.26 N ATOM 342 CA GLU A 518 46.867 14.695 -13.675 1.00 65.85 C ATOM 343 C GLU A 518 46.057 15.974 -13.238 1.00 66.85 C ATOM 344 O GLU A 518 44.887 15.848 -12.849 1.00 62.10 O ATOM 345 CB GLU A 518 46.178 14.124 -14.904 1.00 57.43 C ATOM 346 CG GLU A 518 46.490 14.942 -16.135 1.00 65.69 C ATOM 347 CD GLU A 518 45.582 14.589 -17.253 1.00 75.00 C ATOM 348 OE1 GLU A 518 44.898 13.543 -17.152 1.00 81.96 O ATOM 349 OE2 GLU A 518 45.563 15.363 -18.223 1.00 84.81 O ATOM 350 H GLU A 518 46.362 13.569 -11.887 1.00 0.00 H ATOM 351 N GLY A 519 46.653 17.178 -13.371 1.00 63.01 N ATOM 352 CA GLY A 519 45.887 18.468 -13.307 1.00 72.72 C ATOM 353 C GLY A 519 45.995 19.440 -14.505 1.00 75.18 C ATOM 354 O GLY A 519 46.629 19.130 -15.529 1.00 73.25 O ATOM 355 H GLY A 519 47.681 17.213 -13.523 1.00 0.00 H ATOM 356 N ALA A 520 45.366 20.614 -14.333 1.00 65.44 N ATOM 357 CA ALA A 520 45.390 21.738 -15.260 1.00 64.53 C ATOM 358 C ALA A 520 46.761 22.042 -15.831 1.00 69.83 C ATOM 359 O ALA A 520 46.858 22.418 -16.992 1.00 71.18 O ATOM 360 CB ALA A 520 44.854 23.010 -14.552 1.00 64.47 C ATOM 361 H ALA A 520 44.812 20.731 -13.460 1.00 0.00 H ATOM 362 N PHE A 521 47.815 21.910 -15.008 1.00 72.04 N ATOM 363 CA PHE A 521 49.157 22.416 -15.356 1.00 70.75 C ATOM 364 C PHE A 521 50.184 21.326 -15.613 1.00 70.74 C ATOM 365 O PHE A 521 51.385 21.661 -15.893 1.00 71.11 O ATOM 366 CB PHE A 521 49.656 23.404 -14.282 1.00 64.54 C ATOM 367 CG PHE A 521 48.694 24.543 -14.043 1.00 71.43 C ATOM 368 CD1 PHE A 521 48.582 25.579 -14.973 1.00 69.52 C ATOM 369 CD2 PHE A 521 47.860 24.561 -12.899 1.00 74.58 C ATOM 370 CE1 PHE A 521 47.702 26.640 -14.750 1.00 73.74 C ATOM 371 CE2 PHE A 521 46.967 25.600 -12.689 1.00 73.28 C ATOM 372 CZ PHE A 521 46.889 26.643 -13.621 1.00 73.90 C ATOM 373 H PHE A 521 47.680 21.434 -14.093 1.00 0.00 H ATOM 374 N GLY A 522 49.724 20.062 -15.595 1.00 63.59 N ATOM 375 CA GLY A 522 50.658 18.893 -15.763 1.00 71.94 C ATOM 376 C GLY A 522 50.180 17.470 -15.414 1.00 56.80 C ATOM 377 O GLY A 522 49.110 17.290 -14.880 1.00 59.11 O ATOM 378 H GLY A 522 48.707 19.889 -15.463 1.00 0.00 H ATOM 379 N LYS A 523 51.028 16.499 -15.713 1.00 54.68 N ATOM 380 CA LYS A 523 50.807 15.061 -15.545 1.00 45.11 C ATOM 381 C LYS A 523 51.928 14.640 -14.621 1.00 38.13 C ATOM 382 O LYS A 523 53.022 15.186 -14.709 1.00 37.62 O ATOM 383 CB LYS A 523 51.088 14.332 -16.840 1.00 52.59 C ATOM 384 CG LYS A 523 50.048 14.369 -17.906 1.00 50.29 C ATOM 385 CD LYS A 523 49.195 13.117 -17.816 1.00 59.63 C ATOM 386 CE LYS A 523 48.021 13.098 -18.779 1.00 61.95 C ATOM 387 NZ LYS A 523 48.346 13.869 -20.015 1.00 61.16 N ATOM 388 HZ1 LYS A 523 48.560 14.855 -19.761 1.00 0.00 H ATOM 389 HZ2 LYS A 523 49.173 13.443 -20.481 1.00 0.00 H ATOM 390 HZ3 LYS A 523 47.532 13.845 -20.661 1.00 0.00 H ATOM 391 H LYS A 523 51.946 16.787 -16.108 1.00 0.00 H ATOM 392 N VAL A 524 51.649 13.703 -13.707 1.00 35.36 N ATOM 393 CA VAL A 524 52.663 13.117 -12.873 1.00 36.51 C ATOM 394 C VAL A 524 52.871 11.673 -13.294 1.00 31.16 C ATOM 395 O VAL A 524 51.912 10.901 -13.489 1.00 27.83 O ATOM 396 CB VAL A 524 52.280 13.241 -11.386 1.00 34.11 C ATOM 397 CG1 VAL A 524 53.397 12.740 -10.487 1.00 35.55 C ATOM 398 CG2 VAL A 524 51.922 14.692 -11.114 1.00 38.61 C ATOM 399 H VAL A 524 50.664 13.388 -13.596 1.00 0.00 H ATOM 400 N PHE A 525 54.125 11.312 -13.433 1.00 30.56 N ATOM 401 CA PHE A 525 54.498 9.922 -13.841 1.00 32.46 C ATOM 402 C PHE A 525 55.455 9.318 -12.811 1.00 29.30 C ATOM 403 O PHE A 525 56.294 10.012 -12.247 1.00 29.66 O ATOM 404 CB PHE A 525 55.231 9.904 -15.191 1.00 32.25 C ATOM 405 CG PHE A 525 54.354 10.218 -16.345 1.00 34.49 C ATOM 406 CD1 PHE A 525 54.082 11.527 -16.668 1.00 36.70 C ATOM 407 CD2 PHE A 525 53.755 9.205 -17.067 1.00 36.05 C ATOM 408 CE1 PHE A 525 53.246 11.835 -17.710 1.00 40.27 C ATOM 409 CE2 PHE A 525 52.894 9.492 -18.100 1.00 40.08 C ATOM 410 CZ PHE A 525 52.639 10.818 -18.446 1.00 43.19 C ATOM 411 H PHE A 525 54.877 12.008 -13.255 1.00 0.00 H ATOM 412 N LEU A 526 55.347 8.025 -12.615 1.00 30.11 N ATOM 413 CA LEU A 526 56.451 7.247 -11.989 1.00 30.45 C ATOM 414 C LEU A 526 57.449 6.993 -13.047 1.00 32.96 C ATOM 415 O LEU A 526 57.076 6.709 -14.174 1.00 31.04 O ATOM 416 CB LEU A 526 55.943 5.891 -11.499 1.00 34.83 C ATOM 417 CG LEU A 526 56.955 5.020 -10.686 1.00 39.17 C ATOM 418 CD1 LEU A 526 57.356 5.672 -9.380 1.00 39.65 C ATOM 419 CD2 LEU A 526 56.356 3.648 -10.365 1.00 40.75 C ATOM 420 H LEU A 526 54.475 7.536 -12.902 1.00 0.00 H ATOM 421 N ALA A 527 58.711 7.189 -12.704 1.00 33.97 N ATOM 422 CA ALA A 527 59.830 6.911 -13.553 1.00 34.85 C ATOM 423 C ALA A 527 60.991 6.272 -12.810 1.00 36.50 C ATOM 424 O ALA A 527 61.053 6.342 -11.606 1.00 36.93 O ATOM 425 CB ALA A 527 60.330 8.191 -14.261 1.00 32.86 C ATOM 426 H ALA A 527 58.903 7.570 -11.756 1.00 0.00 H ATOM 427 N GLU A 528 61.911 5.677 -13.576 1.00 41.63 N ATOM 428 CA GLU A 528 63.204 5.243 -13.093 1.00 42.06 C ATOM 429 C GLU A 528 64.266 6.214 -13.539 1.00 43.70 C ATOM 430 O GLU A 528 64.291 6.599 -14.697 1.00 46.43 O ATOM 431 CB GLU A 528 63.544 3.929 -13.693 1.00 55.02 C ATOM 432 CG GLU A 528 62.745 2.777 -13.174 1.00 63.12 C ATOM 433 CD GLU A 528 62.940 1.528 -14.038 1.00 78.83 C ATOM 434 OE1 GLU A 528 63.778 1.548 -15.014 1.00 70.65 O ATOM 435 OE2 GLU A 528 62.215 0.545 -13.741 1.00 77.69 O ATOM 436 H GLU A 528 61.684 5.517 -14.578 1.00 0.00 H ATOM 437 N CYS A 529 65.164 6.591 -12.641 1.00 43.39 N ATOM 438 CA CYS A 529 66.170 7.640 -12.901 1.00 51.79 C ATOM 439 C CYS A 529 67.445 6.868 -12.657 1.00 61.43 C ATOM 440 O CYS A 529 67.511 6.065 -11.738 1.00 61.66 O ATOM 441 CB CYS A 529 65.999 8.931 -12.019 1.00 48.23 C ATOM 442 SG CYS A 529 66.983 10.371 -12.538 1.00 60.82 S ATOM 443 H CYS A 529 65.160 6.127 -11.710 1.00 0.00 H ATOM 444 N HIS A 530 68.384 6.998 -13.592 1.00 72.89 N ATOM 445 CA HIS A 530 69.702 6.347 -13.531 1.00 71.01 C ATOM 446 C HIS A 530 70.835 7.447 -13.466 1.00 73.45 C ATOM 447 O HIS A 530 70.791 8.415 -14.207 1.00 73.35 O ATOM 448 CB HIS A 530 69.890 5.395 -14.728 1.00 62.78 C ATOM 449 CG HIS A 530 68.708 4.508 -15.034 1.00 68.94 C ATOM 450 ND1 HIS A 530 68.446 4.038 -16.301 1.00 76.00 N ATOM 451 CD2 HIS A 530 67.734 3.984 -14.253 1.00 92.47 C ATOM 452 CE1 HIS A 530 67.371 3.265 -16.296 1.00 72.87 C ATOM 453 NE2 HIS A 530 66.915 3.218 -15.066 1.00 86.61 N ATOM 454 H HIS A 530 68.173 7.596 -14.416 1.00 0.00 H ATOM 455 N ASN A 531 71.724 7.381 -12.465 1.00 91.84 N ATOM 456 CA ASN A 531 73.100 7.992 -12.461 1.00 96.61 C ATOM 457 C ASN A 531 73.317 9.227 -13.352 1.00 99.33 C ATOM 458 O ASN A 531 74.304 9.947 -13.194 1.00107.54 O ATOM 459 CB ASN A 531 74.182 6.933 -12.789 1.00 99.60 C ATOM 460 CG ASN A 531 73.826 6.067 -14.002 1.00 98.49 C ATOM 461 OD1 ASN A 531 74.029 6.470 -15.152 1.00110.28 O ATOM 462 ND2 ASN A 531 73.306 4.868 -13.752 1.00 93.63 N ATOM 463 HD22 ASN A 531 73.150 4.564 -12.770 1.00 0.00 H ATOM 464 HD21 ASN A 531 73.056 4.235 -14.539 1.00 0.00 H ATOM 465 H ASN A 531 71.437 6.860 -11.612 1.00 0.00 H TER 466 ASN A 531 ATOM 467 N LYS A 538 68.471 2.771 -11.248 1.00 84.80 N ATOM 468 CA LYS A 538 68.923 2.763 -9.861 1.00 84.04 C ATOM 469 C LYS A 538 67.753 3.132 -8.898 1.00 85.63 C ATOM 470 O LYS A 538 67.542 2.411 -7.908 1.00 95.75 O ATOM 471 CB LYS A 538 70.158 3.684 -9.651 1.00 85.66 C ATOM 472 CG LYS A 538 71.129 3.809 -10.828 1.00 89.47 C ATOM 473 CD LYS A 538 72.263 4.818 -10.577 1.00 91.79 C ATOM 474 CE LYS A 538 73.611 4.203 -10.226 1.00 97.29 C ATOM 475 NZ LYS A 538 73.430 3.362 -9.015 1.00107.05 N ATOM 476 HZ1 LYS A 538 73.090 3.954 -8.231 1.00 0.00 H ATOM 477 HZ2 LYS A 538 72.734 2.615 -9.214 1.00 0.00 H ATOM 478 HZ3 LYS A 538 74.340 2.930 -8.755 1.00 0.00 H ATOM 479 HN3 LYS A 538 68.121 3.719 -11.492 1.00 0.00 H ATOM 480 HN2 LYS A 538 67.706 2.077 -11.366 1.00 0.00 H ATOM 481 HN1 LYS A 538 69.265 2.523 -11.872 1.00 0.00 H ATOM 482 N MET A 539 66.995 4.218 -9.184 1.00 75.95 N ATOM 483 CA MET A 539 65.857 4.657 -8.294 1.00 59.64 C ATOM 484 C MET A 539 64.569 5.175 -8.929 1.00 48.94 C ATOM 485 O MET A 539 64.571 5.803 -9.987 1.00 43.61 O ATOM 486 CB MET A 539 66.293 5.683 -7.260 1.00 52.84 C ATOM 487 CG MET A 539 66.617 7.080 -7.770 1.00 68.85 C ATOM 488 SD MET A 539 66.902 8.326 -6.461 1.00 72.48 S ATOM 489 CE MET A 539 67.880 9.450 -7.485 1.00 69.93 C ATOM 490 H MET A 539 67.203 4.766 -10.043 1.00 0.00 H ATOM 491 N LEU A 540 63.465 4.895 -8.238 1.00 43.65 N ATOM 492 CA LEU A 540 62.150 5.437 -8.556 1.00 46.40 C ATOM 493 C LEU A 540 62.036 6.920 -8.231 1.00 46.57 C ATOM 494 O LEU A 540 62.501 7.361 -7.184 1.00 47.18 O ATOM 495 CB LEU A 540 61.056 4.730 -7.801 1.00 45.53 C ATOM 496 CG LEU A 540 60.904 3.250 -8.174 1.00 44.76 C ATOM 497 CD1 LEU A 540 59.735 2.739 -7.365 1.00 45.76 C ATOM 498 CD2 LEU A 540 60.712 2.966 -9.673 1.00 49.35 C ATOM 499 H LEU A 540 63.546 4.252 -7.424 1.00 0.00 H ATOM 500 N VAL A 541 61.421 7.653 -9.168 1.00 35.34 N ATOM 501 CA VAL A 541 61.129 9.085 -9.025 1.00 33.06 C ATOM 502 C VAL A 541 59.726 9.410 -9.524 1.00 30.43 C ATOM 503 O VAL A 541 59.102 8.615 -10.243 1.00 32.81 O ATOM 504 CB VAL A 541 62.193 9.983 -9.699 1.00 34.63 C ATOM 505 CG1 VAL A 541 63.529 9.852 -9.030 1.00 35.95 C ATOM 506 CG2 VAL A 541 62.312 9.690 -11.182 1.00 39.17 C ATOM 507 H VAL A 541 61.133 7.180 -10.049 1.00 0.00 H ATOM 508 N ALA A 542 59.205 10.541 -9.082 1.00 31.26 N ATOM 509 CA ALA A 542 57.914 11.099 -9.525 1.00 29.99 C ATOM 510 C ALA A 542 58.345 12.290 -10.371 1.00 33.32 C ATOM 511 O ALA A 542 59.207 13.094 -9.951 1.00 36.20 O ATOM 512 CB ALA A 542 57.139 11.598 -8.304 1.00 32.99 C ATOM 513 H ALA A 542 59.744 11.076 -8.371 1.00 0.00 H ATOM 514 N VAL A 543 57.854 12.322 -11.611 1.00 32.41 N ATOM 515 CA VAL A 543 58.197 13.361 -12.530 1.00 33.49 C ATOM 516 C VAL A 543 56.974 14.117 -12.885 1.00 32.54 C ATOM 517 O VAL A 543 55.903 13.535 -13.113 1.00 30.64 O ATOM 518 CB VAL A 543 58.961 12.893 -13.792 1.00 35.00 C ATOM 519 CG1 VAL A 543 60.197 12.124 -13.398 1.00 39.11 C ATOM 520 CG2 VAL A 543 58.137 12.038 -14.662 1.00 38.05 C ATOM 521 H VAL A 543 57.204 11.570 -11.917 1.00 0.00 H ATOM 522 N LYS A 544 57.122 15.432 -12.937 1.00 33.59 N ATOM 523 CA LYS A 544 55.991 16.301 -13.256 1.00 34.86 C ATOM 524 C LYS A 544 56.256 16.824 -14.686 1.00 37.99 C ATOM 525 O LYS A 544 57.308 17.415 -14.959 1.00 36.79 O ATOM 526 CB LYS A 544 55.960 17.398 -12.246 1.00 34.07 C ATOM 527 CG LYS A 544 54.892 18.441 -12.473 1.00 33.54 C ATOM 528 CD LYS A 544 55.115 19.572 -11.451 1.00 42.38 C ATOM 529 CE LYS A 544 54.683 20.924 -11.980 1.00 43.22 C ATOM 530 NZ LYS A 544 53.221 20.952 -12.015 1.00 50.68 N ATOM 531 HZ1 LYS A 544 52.876 20.195 -12.639 1.00 0.00 H ATOM 532 HZ2 LYS A 544 52.850 20.807 -11.054 1.00 0.00 H ATOM 533 HZ3 LYS A 544 52.902 21.874 -12.376 1.00 0.00 H ATOM 534 H LYS A 544 58.055 15.852 -12.748 1.00 0.00 H ATOM 535 N ALA A 545 55.350 16.514 -15.602 1.00 34.06 N ATOM 536 CA ALA A 545 55.504 16.900 -17.035 1.00 42.06 C ATOM 537 C ALA A 545 54.830 18.262 -17.256 1.00 40.45 C ATOM 538 O ALA A 545 53.716 18.411 -16.838 1.00 37.22 O ATOM 539 CB ALA A 545 54.898 15.860 -17.948 1.00 41.80 C ATOM 540 H ALA A 545 54.503 15.984 -15.312 1.00 0.00 H ATOM 541 N LEU A 546 55.502 19.225 -17.914 1.00 40.61 N ATOM 542 CA LEU A 546 54.883 20.534 -18.219 1.00 44.63 C ATOM 543 C LEU A 546 53.800 20.439 -19.299 1.00 49.86 C ATOM 544 O LEU A 546 54.057 19.794 -20.303 1.00 47.15 O ATOM 545 CB LEU A 546 55.946 21.463 -18.703 1.00 44.35 C ATOM 546 CG LEU A 546 55.513 22.885 -19.109 1.00 53.77 C ATOM 547 CD1 LEU A 546 54.820 23.624 -17.993 1.00 47.46 C ATOM 548 CD2 LEU A 546 56.749 23.640 -19.554 1.00 55.73 C ATOM 549 H LEU A 546 56.481 19.045 -18.216 1.00 0.00 H ATOM 550 N LYS A 547 52.605 21.012 -19.089 1.00 54.42 N ATOM 551 CA LYS A 547 51.552 21.071 -20.164 1.00 61.30 C ATOM 552 C LYS A 547 51.694 22.454 -20.811 1.00 62.69 C ATOM 553 O LYS A 547 51.548 23.434 -20.097 1.00 61.24 O ATOM 554 CB LYS A 547 50.135 20.837 -19.623 1.00 52.87 C ATOM 555 H LYS A 547 52.400 21.427 -18.158 1.00 0.00 H ATOM 556 N GLU A 548 52.091 22.517 -22.096 1.00 68.91 N ATOM 557 CA GLU A 548 52.213 23.782 -22.933 1.00 88.95 C ATOM 558 C GLU A 548 53.594 23.958 -23.560 1.00 87.39 C ATOM 559 O GLU A 548 54.537 24.368 -22.887 1.00 96.39 O ATOM 560 CB GLU A 548 51.851 25.096 -22.205 1.00 87.07 C ATOM 561 CG GLU A 548 51.179 26.080 -23.130 1.00 96.24 C ATOM 562 CD GLU A 548 49.667 25.854 -23.223 1.00 93.21 C ATOM 563 OE1 GLU A 548 48.925 26.836 -23.384 1.00 97.68 O ATOM 564 OE2 GLU A 548 49.193 24.706 -23.139 1.00 87.03 O ATOM 565 H GLU A 548 52.337 21.619 -22.559 1.00 0.00 H TER 566 GLU A 548 ATOM 567 N ALA A 553 54.700 29.949 -19.422 1.00 56.46 N ATOM 568 CA ALA A 553 54.657 28.602 -18.845 1.00 62.03 C ATOM 569 C ALA A 553 56.052 28.156 -18.723 1.00 64.28 C ATOM 570 O ALA A 553 56.438 27.668 -17.657 1.00 60.63 O ATOM 571 CB ALA A 553 53.913 27.600 -19.678 1.00 52.49 C ATOM 572 HN3 ALA A 553 55.162 29.911 -20.353 1.00 0.00 H ATOM 573 HN2 ALA A 553 55.238 30.578 -18.792 1.00 0.00 H ATOM 574 HN1 ALA A 553 53.731 30.310 -19.529 1.00 0.00 H ATOM 575 N ARG A 554 56.809 28.343 -19.813 1.00 49.97 N ATOM 576 CA ARG A 554 58.196 27.944 -19.874 1.00 50.85 C ATOM 577 C ARG A 554 59.029 28.817 -18.949 1.00 47.95 C ATOM 578 O ARG A 554 60.008 28.367 -18.367 1.00 52.14 O ATOM 579 CB ARG A 554 58.757 27.878 -21.353 1.00 45.53 C ATOM 580 H ARG A 554 56.381 28.793 -20.647 1.00 0.00 H ATOM 581 N GLN A 555 58.661 30.071 -18.784 1.00 54.92 N ATOM 582 CA GLN A 555 59.420 30.922 -17.874 1.00 54.87 C ATOM 583 C GLN A 555 59.114 30.639 -16.403 1.00 50.81 C ATOM 584 O GLN A 555 60.036 30.688 -15.562 1.00 57.33 O ATOM 585 CB GLN A 555 59.174 32.392 -18.187 1.00 62.45 C ATOM 586 CG GLN A 555 59.893 32.854 -19.454 1.00 77.70 C ATOM 587 CD GLN A 555 59.350 34.176 -20.001 1.00 90.13 C ATOM 588 OE1 GLN A 555 58.596 34.901 -19.323 1.00 92.50 O ATOM 589 NE2 GLN A 555 59.733 34.497 -21.230 1.00 86.98 N ATOM 590 HE22 GLN A 555 60.363 33.863 -21.761 1.00 0.00 H ATOM 591 HE21 GLN A 555 59.403 35.383 -21.663 1.00 0.00 H ATOM 592 H GLN A 555 57.839 30.450 -19.296 1.00 0.00 H ATOM 593 N ASP A 556 57.830 30.354 -16.119 1.00 48.14 N ATOM 594 CA ASP A 556 57.379 29.829 -14.825 1.00 45.70 C ATOM 595 C ASP A 556 58.130 28.552 -14.459 1.00 43.30 C ATOM 596 O ASP A 556 58.747 28.497 -13.386 1.00 38.24 O ATOM 597 CB ASP A 556 55.917 29.564 -14.866 1.00 43.68 C ATOM 598 CG ASP A 556 55.104 30.849 -14.692 1.00 54.67 C ATOM 599 OD1 ASP A 556 55.701 31.923 -14.607 1.00 47.20 O ATOM 600 OD2 ASP A 556 53.879 30.768 -14.545 1.00 62.35 O ATOM 601 H ASP A 556 57.117 30.515 -16.859 1.00 0.00 H ATOM 602 N PHE A 557 58.183 27.638 -15.422 1.00 40.50 N ATOM 603 CA PHE A 557 58.946 26.390 -15.316 1.00 40.40 C ATOM 604 C PHE A 557 60.365 26.660 -14.852 1.00 39.57 C ATOM 605 O PHE A 557 60.814 26.111 -13.897 1.00 38.60 O ATOM 606 CB PHE A 557 58.931 25.621 -16.636 1.00 40.79 C ATOM 607 CG PHE A 557 59.640 24.265 -16.579 1.00 42.85 C ATOM 608 CD1 PHE A 557 61.007 24.171 -16.777 1.00 38.03 C ATOM 609 CD2 PHE A 557 58.911 23.093 -16.328 1.00 40.32 C ATOM 610 CE1 PHE A 557 61.666 22.955 -16.766 1.00 39.43 C ATOM 611 CE2 PHE A 557 59.572 21.865 -16.275 1.00 41.02 C ATOM 612 CZ PHE A 557 60.954 21.799 -16.488 1.00 39.65 C ATOM 613 H PHE A 557 57.654 27.818 -16.299 1.00 0.00 H ATOM 614 N GLN A 558 61.046 27.570 -15.513 1.00 41.06 N ATOM 615 CA GLN A 558 62.455 27.885 -15.172 1.00 42.05 C ATOM 616 C GLN A 558 62.611 28.531 -13.814 1.00 40.02 C ATOM 617 O GLN A 558 63.591 28.253 -13.070 1.00 36.42 O ATOM 618 CB GLN A 558 63.033 28.840 -16.229 1.00 49.34 C ATOM 619 CG GLN A 558 64.448 29.264 -15.928 1.00 57.83 C ATOM 620 CD GLN A 558 65.101 30.016 -17.081 1.00 79.70 C ATOM 621 OE1 GLN A 558 64.628 30.013 -18.232 1.00 81.50 O ATOM 622 NE2 GLN A 558 66.208 30.668 -16.770 1.00 85.34 N ATOM 623 HE22 GLN A 558 66.569 30.644 -15.795 1.00 0.00 H ATOM 624 HE21 GLN A 558 66.718 31.205 -17.500 1.00 0.00 H ATOM 625 H GLN A 558 60.586 28.081 -16.293 1.00 0.00 H ATOM 626 N ARG A 559 61.682 29.454 -13.517 1.00 38.46 N ATOM 627 CA ARG A 559 61.670 30.071 -12.209 1.00 36.00 C ATOM 628 C ARG A 559 61.397 29.037 -11.024 1.00 37.71 C ATOM 629 O ARG A 559 62.089 29.024 -9.978 1.00 38.87 O ATOM 630 CB ARG A 559 60.631 31.172 -12.247 1.00 44.66 C ATOM 631 CG ARG A 559 60.523 31.946 -10.953 1.00 53.12 C ATOM 632 CD ARG A 559 61.888 32.259 -10.367 1.00 62.03 C ATOM 633 NE ARG A 559 61.890 33.639 -9.969 1.00 85.72 N ATOM 634 CZ ARG A 559 62.193 34.656 -10.758 1.00 79.03 C ATOM 635 NH1 ARG A 559 62.590 34.480 -12.005 1.00 84.73 N ATOM 636 NH2 ARG A 559 62.120 35.866 -10.268 1.00 85.67 N ATOM 637 HE ARG A 559 61.633 33.855 -8.985 1.00 0.00 H ATOM 638 HH12 ARG A 559 62.821 35.302 -12.598 1.00 0.00 H ATOM 639 HH11 ARG A 559 62.672 33.519 -12.394 1.00 0.00 H ATOM 640 HH22 ARG A 559 62.353 36.684 -10.866 1.00 0.00 H ATOM 641 HH21 ARG A 559 61.829 36.010 -9.280 1.00 0.00 H ATOM 642 H ARG A 559 60.972 29.725 -14.227 1.00 0.00 H ATOM 643 N GLU A 560 60.419 28.160 -11.244 1.00 37.44 N ATOM 644 CA GLU A 560 60.147 27.063 -10.347 1.00 36.56 C ATOM 645 C GLU A 560 61.389 26.179 -10.125 1.00 36.02 C ATOM 646 O GLU A 560 61.784 25.925 -8.973 1.00 37.87 O ATOM 647 CB GLU A 560 59.008 26.238 -10.897 1.00 36.51 C ATOM 648 CG GLU A 560 57.623 26.882 -10.941 1.00 35.03 C ATOM 649 CD GLU A 560 56.719 26.083 -11.862 1.00 38.21 C ATOM 650 OE1 GLU A 560 57.250 25.157 -12.578 1.00 39.16 O ATOM 651 OE2 GLU A 560 55.507 26.341 -11.870 1.00 37.14 O ATOM 652 H GLU A 560 59.830 28.270 -12.094 1.00 0.00 H ATOM 653 N ALA A 561 62.073 25.779 -11.195 1.00 36.15 N ATOM 654 CA ALA A 561 63.302 24.952 -11.012 1.00 36.93 C ATOM 655 C ALA A 561 64.386 25.681 -10.240 1.00 34.74 C ATOM 656 O ALA A 561 65.048 25.095 -9.427 1.00 38.08 O ATOM 657 CB ALA A 561 63.866 24.499 -12.358 1.00 39.80 C ATOM 658 H ALA A 561 61.754 26.040 -12.150 1.00 0.00 H ATOM 659 N GLU A 562 64.581 26.974 -10.506 1.00 39.43 N ATOM 660 CA GLU A 562 65.632 27.767 -9.792 1.00 41.63 C ATOM 661 C GLU A 562 65.385 27.975 -8.297 1.00 37.79 C ATOM 662 O GLU A 562 66.319 27.934 -7.513 1.00 44.03 O ATOM 663 CB GLU A 562 65.774 29.126 -10.402 1.00 41.96 C ATOM 664 CG GLU A 562 66.479 29.099 -11.738 1.00 48.58 C ATOM 665 CD GLU A 562 66.334 30.377 -12.549 1.00 51.75 C ATOM 666 OE1 GLU A 562 65.684 31.374 -12.125 1.00 56.48 O ATOM 667 OE2 GLU A 562 66.877 30.364 -13.657 1.00 53.45 O ATOM 668 H GLU A 562 63.991 27.441 -11.224 1.00 0.00 H ATOM 669 N LEU A 563 64.114 28.109 -7.924 1.00 37.48 N ATOM 670 CA LEU A 563 63.724 28.083 -6.508 1.00 35.27 C ATOM 671 C LEU A 563 63.720 26.749 -5.903 1.00 39.49 C ATOM 672 O LEU A 563 64.174 26.586 -4.744 1.00 39.04 O ATOM 673 CB LEU A 563 62.386 28.736 -6.304 1.00 38.11 C ATOM 674 CG LEU A 563 62.349 30.232 -6.601 1.00 43.44 C ATOM 675 CD1 LEU A 563 60.926 30.749 -6.603 1.00 46.02 C ATOM 676 CD2 LEU A 563 63.139 31.003 -5.564 1.00 44.17 C ATOM 677 H LEU A 563 63.381 28.235 -8.651 1.00 0.00 H ATOM 678 N LEU A 564 63.197 25.758 -6.618 1.00 40.80 N ATOM 679 CA LEU A 564 63.204 24.404 -6.069 1.00 38.40 C ATOM 680 C LEU A 564 64.603 23.844 -5.834 1.00 41.80 C ATOM 681 O LEU A 564 64.788 23.025 -4.866 1.00 38.94 O ATOM 682 CB LEU A 564 62.452 23.444 -6.978 1.00 45.20 C ATOM 683 CG LEU A 564 60.957 23.604 -7.132 1.00 40.18 C ATOM 684 CD1 LEU A 564 60.501 22.967 -8.465 1.00 43.08 C ATOM 685 CD2 LEU A 564 60.235 22.971 -5.946 1.00 45.96 C ATOM 686 H LEU A 564 62.788 25.944 -7.556 1.00 0.00 H ATOM 687 N THR A 565 65.603 24.269 -6.637 1.00 40.50 N ATOM 688 CA THR A 565 67.040 23.877 -6.299 1.00 47.03 C ATOM 689 C THR A 565 67.529 24.441 -4.966 1.00 35.85 C ATOM 690 O THR A 565 68.470 23.872 -4.355 1.00 43.82 O ATOM 691 CB THR A 565 68.172 24.295 -7.320 1.00 48.91 C ATOM 692 OG1 THR A 565 68.112 25.726 -7.568 1.00 57.35 O ATOM 693 CG2 THR A 565 68.068 23.595 -8.478 1.00 54.23 C ATOM 694 HG1 THR A 565 67.228 25.957 -7.948 1.00 0.00 H ATOM 695 H THR A 565 65.398 24.854 -7.472 1.00 0.00 H ATOM 696 N MET A 566 66.930 25.512 -4.505 1.00 39.49 N ATOM 697 CA MET A 566 67.256 26.028 -3.168 1.00 42.86 C ATOM 698 C MET A 566 66.726 25.167 -2.040 1.00 50.31 C ATOM 699 O MET A 566 67.343 25.131 -1.008 1.00 53.43 O ATOM 700 CB MET A 566 66.660 27.400 -2.967 1.00 56.56 C ATOM 701 CG MET A 566 67.152 28.473 -3.919 1.00 68.17 C ATOM 702 SD MET A 566 68.947 28.570 -3.858 1.00 75.39 S ATOM 703 CE MET A 566 69.224 29.187 -2.172 1.00 86.11 C ATOM 704 H MET A 566 66.220 25.999 -5.088 1.00 0.00 H ATOM 705 N LEU A 567 65.577 24.501 -2.204 1.00 49.08 N ATOM 706 CA LEU A 567 64.966 23.675 -1.115 1.00 46.32 C ATOM 707 C LEU A 567 65.525 22.291 -0.947 1.00 44.86 C ATOM 708 O LEU A 567 65.058 21.350 -1.592 1.00 58.30 O ATOM 709 CB LEU A 567 63.456 23.554 -1.311 1.00 44.79 C ATOM 710 CG LEU A 567 62.714 24.892 -1.509 1.00 44.97 C ATOM 711 CD1 LEU A 567 61.251 24.600 -1.766 1.00 55.18 C ATOM 712 CD2 LEU A 567 62.844 25.856 -0.358 1.00 45.15 C ATOM 713 H LEU A 567 65.091 24.559 -3.121 1.00 0.00 H ATOM 714 N GLN A 568 66.468 22.142 -0.019 1.00 44.28 N ATOM 715 CA GLN A 568 67.066 20.833 0.244 1.00 46.28 C ATOM 716 C GLN A 568 66.923 20.562 1.734 1.00 45.37 C ATOM 717 O GLN A 568 67.617 21.137 2.537 1.00 50.75 O ATOM 718 CB GLN A 568 68.534 20.777 -0.261 1.00 45.81 C ATOM 719 CG GLN A 568 68.641 21.069 -1.802 1.00 63.59 C ATOM 720 CD GLN A 568 67.906 20.028 -2.720 1.00 67.48 C ATOM 721 OE1 GLN A 568 68.155 18.850 -2.560 1.00 74.01 O ATOM 722 NE2 GLN A 568 67.005 20.467 -3.683 1.00 60.96 N ATOM 723 HE22 GLN A 568 66.815 21.484 -3.793 1.00 0.00 H ATOM 724 HE21 GLN A 568 66.520 19.779 -4.294 1.00 0.00 H ATOM 725 H GLN A 568 66.784 22.969 0.527 1.00 0.00 H ATOM 726 N HIS A 569 66.010 19.692 2.116 1.00 40.00 N ATOM 727 CA HIS A 569 65.732 19.471 3.539 1.00 41.18 C ATOM 728 C HIS A 569 64.998 18.147 3.628 1.00 37.21 C ATOM 729 O HIS A 569 64.200 17.830 2.756 1.00 34.69 O ATOM 730 CB HIS A 569 64.913 20.632 4.171 1.00 40.83 C ATOM 731 CG HIS A 569 64.867 20.548 5.666 1.00 43.54 C ATOM 732 ND1 HIS A 569 63.876 19.877 6.337 1.00 47.63 N ATOM 733 CD2 HIS A 569 65.711 21.013 6.618 1.00 44.39 C ATOM 734 CE1 HIS A 569 64.142 19.865 7.629 1.00 50.08 C ATOM 735 NE2 HIS A 569 65.251 20.561 7.822 1.00 45.79 N ATOM 736 H HIS A 569 65.480 19.156 1.400 1.00 0.00 H ATOM 737 N GLN A 570 65.301 17.388 4.659 1.00 35.87 N ATOM 738 CA GLN A 570 64.658 16.124 4.962 1.00 38.23 C ATOM 739 C GLN A 570 63.149 16.197 4.896 1.00 35.93 C ATOM 740 O GLN A 570 62.543 15.250 4.554 1.00 34.90 O ATOM 741 CB GLN A 570 65.018 15.671 6.390 1.00 44.98 C ATOM 742 CG GLN A 570 65.740 14.385 6.502 1.00 62.64 C ATOM 743 CD GLN A 570 64.873 13.208 6.111 1.00 82.74 C ATOM 744 OE1 GLN A 570 63.889 12.898 6.791 1.00 98.66 O ATOM 745 NE2 GLN A 570 65.240 12.526 5.016 1.00 79.94 N ATOM 746 HE22 GLN A 570 66.076 12.824 4.474 1.00 0.00 H ATOM 747 HE21 GLN A 570 64.688 11.700 4.709 1.00 0.00 H ATOM 748 H GLN A 570 66.052 17.716 5.299 1.00 0.00 H ATOM 749 N HIS A 571 62.552 17.326 5.297 1.00 33.74 N ATOM 750 CA HIS A 571 61.094 17.496 5.326 1.00 34.65 C ATOM 751 C HIS A 571 60.504 18.401 4.272 1.00 35.90 C ATOM 752 O HIS A 571 59.349 18.849 4.415 1.00 36.26 O ATOM 753 CB HIS A 571 60.673 17.850 6.774 1.00 33.30 C ATOM 754 CG HIS A 571 61.030 16.755 7.704 1.00 29.34 C ATOM 755 ND1 HIS A 571 60.463 15.499 7.598 1.00 32.17 N ATOM 756 CD2 HIS A 571 62.031 16.646 8.587 1.00 27.81 C ATOM 757 CE1 HIS A 571 61.034 14.698 8.483 1.00 30.39 C ATOM 758 NE2 HIS A 571 61.988 15.378 9.088 1.00 28.52 N ATOM 759 H HIS A 571 63.149 18.121 5.603 1.00 0.00 H ATOM 760 N ILE A 572 61.258 18.604 3.183 1.00 36.61 N ATOM 761 CA ILE A 572 60.695 19.116 1.919 1.00 34.55 C ATOM 762 C ILE A 572 60.887 18.048 0.832 1.00 33.92 C ATOM 763 O ILE A 572 61.992 17.502 0.708 1.00 31.64 O ATOM 764 CB ILE A 572 61.409 20.387 1.521 1.00 35.33 C ATOM 765 CG1 ILE A 572 61.434 21.400 2.701 1.00 36.82 C ATOM 766 CG2 ILE A 572 60.780 21.023 0.266 1.00 37.28 C ATOM 767 CD1 ILE A 572 60.110 22.051 3.025 1.00 38.58 C ATOM 768 H ILE A 572 62.275 18.393 3.230 1.00 0.00 H ATOM 769 N VAL A 573 59.836 17.709 0.069 1.00 32.76 N ATOM 770 CA VAL A 573 59.949 16.717 -0.987 1.00 32.91 C ATOM 771 C VAL A 573 61.117 17.144 -1.929 1.00 32.83 C ATOM 772 O VAL A 573 61.145 18.279 -2.328 1.00 33.91 O ATOM 773 CB VAL A 573 58.615 16.613 -1.735 1.00 34.42 C ATOM 774 CG1 VAL A 573 58.840 15.779 -2.994 1.00 31.17 C ATOM 775 CG2 VAL A 573 57.542 16.003 -0.815 1.00 34.55 C ATOM 776 H VAL A 573 58.918 18.168 0.238 1.00 0.00 H ATOM 777 N ARG A 574 62.134 16.296 -2.112 1.00 34.10 N ATOM 778 CA ARG A 574 63.348 16.693 -2.812 1.00 38.84 C ATOM 779 C ARG A 574 63.227 16.797 -4.368 1.00 35.25 C ATOM 780 O ARG A 574 62.671 15.934 -5.005 1.00 35.68 O ATOM 781 CB ARG A 574 64.469 15.711 -2.566 1.00 44.96 C ATOM 782 CG ARG A 574 65.834 16.407 -2.780 1.00 54.43 C ATOM 783 CD ARG A 574 66.930 15.451 -2.339 1.00 71.30 C ATOM 784 NE ARG A 574 68.292 15.841 -2.741 1.00 93.77 N ATOM 785 CZ ARG A 574 69.372 15.037 -2.755 1.00 89.98 C ATOM 786 NH1 ARG A 574 69.302 13.750 -2.408 1.00 81.53 N ATOM 787 NH2 ARG A 574 70.546 15.528 -3.143 1.00 98.63 N ATOM 788 HE ARG A 574 68.432 16.827 -3.041 1.00 0.00 H ATOM 789 HH12 ARG A 574 70.157 13.158 -2.431 1.00 0.00 H ATOM 790 HH11 ARG A 574 68.393 13.339 -2.115 1.00 0.00 H ATOM 791 HH22 ARG A 574 71.387 14.916 -3.158 1.00 0.00 H ATOM 792 HH21 ARG A 574 70.623 16.524 -3.432 1.00 0.00 H ATOM 793 H ARG A 574 62.056 15.326 -1.744 1.00 0.00 H ATOM 794 N PHE A 575 63.831 17.825 -4.906 1.00 33.31 N ATOM 795 CA PHE A 575 63.861 18.146 -6.309 1.00 38.01 C ATOM 796 C PHE A 575 65.225 17.778 -6.773 1.00 40.05 C ATOM 797 O PHE A 575 66.176 18.237 -6.224 1.00 38.07 O ATOM 798 CB PHE A 575 63.596 19.623 -6.476 1.00 38.08 C ATOM 799 CG PHE A 575 63.867 20.158 -7.861 1.00 43.55 C ATOM 800 CD1 PHE A 575 63.066 19.765 -8.942 1.00 38.53 C ATOM 801 CD2 PHE A 575 64.947 21.026 -8.090 1.00 36.36 C ATOM 802 CE1 PHE A 575 63.313 20.240 -10.216 1.00 39.42 C ATOM 803 CE2 PHE A 575 65.163 21.493 -9.338 1.00 38.97 C ATOM 804 CZ PHE A 575 64.350 21.114 -10.402 1.00 33.85 C ATOM 805 H PHE A 575 64.335 18.468 -4.262 1.00 0.00 H ATOM 806 N PHE A 576 65.299 16.871 -7.732 1.00 38.85 N ATOM 807 CA PHE A 576 66.571 16.403 -8.264 1.00 36.84 C ATOM 808 C PHE A 576 67.013 17.139 -9.526 1.00 38.25 C ATOM 809 O PHE A 576 68.163 17.007 -9.889 1.00 41.64 O ATOM 810 CB PHE A 576 66.494 14.912 -8.601 1.00 38.40 C ATOM 811 CG PHE A 576 66.354 14.038 -7.405 1.00 38.19 C ATOM 812 CD1 PHE A 576 67.278 14.070 -6.394 1.00 44.80 C ATOM 813 CD2 PHE A 576 65.354 13.109 -7.330 1.00 40.15 C ATOM 814 CE1 PHE A 576 67.111 13.233 -5.272 1.00 51.31 C ATOM 815 CE2 PHE A 576 65.194 12.257 -6.230 1.00 43.69 C ATOM 816 CZ PHE A 576 66.066 12.325 -5.199 1.00 39.77 C ATOM 817 H PHE A 576 64.418 16.478 -8.120 1.00 0.00 H ATOM 818 N GLY A 577 66.132 17.860 -10.223 1.00 35.30 N ATOM 819 CA GLY A 577 66.520 18.534 -11.437 1.00 35.84 C ATOM 820 C GLY A 577 65.440 18.478 -12.513 1.00 39.44 C ATOM 821 O GLY A 577 64.305 18.032 -12.278 1.00 36.56 O ATOM 822 H GLY A 577 65.151 17.937 -9.885 1.00 0.00 H ATOM 823 N VAL A 578 65.839 18.954 -13.681 1.00 38.21 N ATOM 824 CA VAL A 578 65.024 19.031 -14.851 1.00 38.89 C ATOM 825 C VAL A 578 65.555 18.165 -16.003 1.00 39.46 C ATOM 826 O VAL A 578 66.723 17.851 -16.056 1.00 41.32 O ATOM 827 CB VAL A 578 64.801 20.473 -15.333 1.00 38.14 C ATOM 828 CG1 VAL A 578 64.045 21.294 -14.273 1.00 39.74 C ATOM 829 CG2 VAL A 578 66.113 21.103 -15.789 1.00 39.11 C ATOM 830 H VAL A 578 66.818 19.297 -13.752 1.00 0.00 H ATOM 831 N CYS A 579 64.639 17.739 -16.869 1.00 34.76 N ATOM 832 CA CYS A 579 64.979 17.086 -18.143 1.00 39.20 C ATOM 833 C CYS A 579 64.250 17.916 -19.198 1.00 39.45 C ATOM 834 O CYS A 579 63.025 17.887 -19.278 1.00 40.35 O ATOM 835 CB CYS A 579 64.568 15.598 -18.208 1.00 40.78 C ATOM 836 SG CYS A 579 65.223 14.718 -19.729 1.00 54.63 S ATOM 837 H CYS A 579 63.635 17.874 -16.634 1.00 0.00 H ATOM 838 N THR A 580 65.015 18.732 -19.940 1.00 43.38 N ATOM 839 CA THR A 580 64.525 19.583 -20.969 1.00 43.00 C ATOM 840 C THR A 580 65.051 19.186 -22.370 1.00 43.39 C ATOM 841 O THR A 580 64.937 19.952 -23.252 1.00 49.38 O ATOM 842 CB THR A 580 64.939 21.025 -20.711 1.00 43.54 C ATOM 843 OG1 THR A 580 66.342 21.029 -20.615 1.00 43.57 O ATOM 844 CG2 THR A 580 64.399 21.534 -19.433 1.00 46.81 C ATOM 845 HG1 THR A 580 66.657 21.952 -20.446 1.00 0.00 H ATOM 846 H THR A 580 66.037 18.743 -19.749 1.00 0.00 H ATOM 847 N GLU A 581 65.599 18.016 -22.582 1.00 44.35 N ATOM 848 CA GLU A 581 66.002 17.631 -23.951 1.00 51.76 C ATOM 849 C GLU A 581 64.923 16.707 -24.540 1.00 52.62 C ATOM 850 O GLU A 581 64.900 15.508 -24.286 1.00 63.06 O ATOM 851 CB GLU A 581 67.411 17.035 -23.966 1.00 48.78 C ATOM 852 CG GLU A 581 67.570 15.703 -23.322 1.00 51.72 C ATOM 853 CD GLU A 581 69.011 15.222 -23.203 1.00 60.12 C ATOM 854 OE1 GLU A 581 69.934 16.003 -22.908 1.00 68.57 O ATOM 855 OE2 GLU A 581 69.216 14.006 -23.326 1.00 66.97 O ATOM 856 H GLU A 581 65.750 17.360 -21.790 1.00 0.00 H ATOM 857 N GLY A 582 63.985 17.284 -25.265 1.00 50.82 N ATOM 858 CA GLY A 582 62.745 16.568 -25.662 1.00 52.85 C ATOM 859 C GLY A 582 61.451 17.052 -25.010 1.00 51.64 C ATOM 860 O GLY A 582 61.410 18.131 -24.374 1.00 44.40 O ATOM 861 H GLY A 582 64.117 18.270 -25.568 1.00 0.00 H ATOM 862 N ARG A 583 60.388 16.255 -25.187 1.00 44.22 N ATOM 863 CA ARG A 583 59.107 16.560 -24.602 1.00 44.22 C ATOM 864 C ARG A 583 58.619 15.256 -24.016 1.00 54.46 C ATOM 865 O ARG A 583 59.057 14.167 -24.476 1.00 48.77 O ATOM 866 CB ARG A 583 58.105 17.114 -25.564 1.00 46.83 C ATOM 867 CG ARG A 583 57.944 18.630 -25.648 1.00 54.85 C ATOM 868 CD ARG A 583 59.149 19.405 -25.215 1.00 70.94 C ATOM 869 NE ARG A 583 59.434 20.582 -26.006 1.00 89.20 N ATOM 870 CZ ARG A 583 58.906 21.779 -25.826 1.00 98.79 C ATOM 871 NH1 ARG A 583 58.012 22.000 -24.859 1.00108.05 N ATOM 872 NH2 ARG A 583 59.274 22.762 -26.644 1.00103.77 N ATOM 873 HE ARG A 583 60.115 20.476 -26.785 1.00 0.00 H ATOM 874 HH12 ARG A 583 57.607 22.949 -24.732 1.00 0.00 H ATOM 875 HH11 ARG A 583 57.721 21.223 -24.233 1.00 0.00 H ATOM 876 HH22 ARG A 583 58.874 23.715 -26.525 1.00 0.00 H ATOM 877 HH21 ARG A 583 59.962 22.578 -27.402 1.00 0.00 H ATOM 878 H ARG A 583 60.490 15.394 -25.761 1.00 0.00 H ATOM 879 N PRO A 584 57.797 15.353 -22.949 1.00 44.55 N ATOM 880 CA PRO A 584 57.546 16.590 -22.189 1.00 43.35 C ATOM 881 C PRO A 584 58.780 17.100 -21.406 1.00 37.99 C ATOM 882 O PRO A 584 59.707 16.326 -21.092 1.00 35.62 O ATOM 883 CB PRO A 584 56.482 16.123 -21.197 1.00 48.07 C ATOM 884 CG PRO A 584 56.956 14.742 -20.846 1.00 45.93 C ATOM 885 CD PRO A 584 57.379 14.171 -22.179 1.00 51.32 C ATOM 886 N LEU A 585 58.829 18.391 -21.136 1.00 37.42 N ATOM 887 CA LEU A 585 59.707 18.932 -20.095 1.00 39.35 C ATOM 888 C LEU A 585 59.273 18.349 -18.737 1.00 36.64 C ATOM 889 O LEU A 585 58.074 18.322 -18.393 1.00 36.71 O ATOM 890 CB LEU A 585 59.598 20.441 -20.019 1.00 43.71 C ATOM 891 CG LEU A 585 59.922 21.225 -21.298 1.00 46.65 C ATOM 892 CD1 LEU A 585 60.147 22.661 -20.904 1.00 49.48 C ATOM 893 CD2 LEU A 585 61.190 20.679 -21.904 1.00 51.20 C ATOM 894 H LEU A 585 58.227 19.043 -21.678 1.00 0.00 H ATOM 895 N LEU A 586 60.258 17.847 -18.018 1.00 34.43 N ATOM 896 CA LEU A 586 60.080 17.244 -16.703 1.00 36.50 C ATOM 897 C LEU A 586 60.810 18.003 -15.613 1.00 33.26 C ATOM 898 O LEU A 586 61.914 18.583 -15.802 1.00 36.40 O ATOM 899 CB LEU A 586 60.632 15.797 -16.625 1.00 37.50 C ATOM 900 CG LEU A 586 60.115 14.797 -17.650 1.00 42.02 C ATOM 901 CD1 LEU A 586 60.730 13.406 -17.461 1.00 43.44 C ATOM 902 CD2 LEU A 586 58.583 14.767 -17.556 1.00 43.36 C ATOM 903 H LEU A 586 61.219 17.884 -18.413 1.00 0.00 H ATOM 904 N MET A 587 60.174 17.983 -14.456 1.00 34.85 N ATOM 905 CA MET A 587 60.828 18.220 -13.176 1.00 35.13 C ATOM 906 C MET A 587 60.787 16.915 -12.424 1.00 33.46 C ATOM 907 O MET A 587 59.764 16.228 -12.388 1.00 34.56 O ATOM 908 CB MET A 587 60.083 19.264 -12.392 1.00 36.04 C ATOM 909 CG MET A 587 60.448 20.644 -12.816 1.00 38.76 C ATOM 910 SD MET A 587 59.656 21.841 -11.761 1.00 43.08 S ATOM 911 CE MET A 587 57.978 21.625 -12.389 1.00 39.99 C ATOM 912 H MET A 587 59.152 17.788 -14.459 1.00 0.00 H ATOM 913 N VAL A 588 61.905 16.581 -11.827 1.00 30.26 N ATOM 914 CA VAL A 588 62.077 15.246 -11.229 1.00 33.29 C ATOM 915 C VAL A 588 62.227 15.323 -9.725 1.00 32.34 C ATOM 916 O VAL A 588 63.062 16.072 -9.209 1.00 31.18 O ATOM 917 CB VAL A 588 63.323 14.575 -11.832 1.00 32.56 C ATOM 918 CG1 VAL A 588 63.540 13.263 -11.179 1.00 30.53 C ATOM 919 CG2 VAL A 588 63.266 14.490 -13.414 1.00 32.67 C ATOM 920 H VAL A 588 62.683 17.269 -11.775 1.00 0.00 H ATOM 921 N PHE A 589 61.414 14.543 -9.034 1.00 31.98 N ATOM 922 CA PHE A 589 61.346 14.601 -7.572 1.00 33.41 C ATOM 923 C PHE A 589 61.461 13.224 -6.983 1.00 34.27 C ATOM 924 O PHE A 589 61.122 12.220 -7.626 1.00 34.69 O ATOM 925 CB PHE A 589 59.944 15.132 -7.142 1.00 29.77 C ATOM 926 CG PHE A 589 59.680 16.525 -7.546 1.00 28.42 C ATOM 927 CD1 PHE A 589 60.190 17.581 -6.808 1.00 30.91 C ATOM 928 CD2 PHE A 589 58.935 16.808 -8.695 1.00 31.17 C ATOM 929 CE1 PHE A 589 59.916 18.899 -7.171 1.00 30.31 C ATOM 930 CE2 PHE A 589 58.671 18.100 -9.097 1.00 31.83 C ATOM 931 CZ PHE A 589 59.159 19.189 -8.341 1.00 28.05 C ATOM 932 H PHE A 589 60.806 13.870 -9.542 1.00 0.00 H ATOM 933 N GLU A 590 61.776 13.158 -5.697 1.00 35.62 N ATOM 934 CA GLU A 590 61.706 11.819 -5.004 1.00 38.08 C ATOM 935 C GLU A 590 60.262 11.304 -5.002 1.00 36.13 C ATOM 936 O GLU A 590 59.306 12.087 -4.968 1.00 38.36 O ATOM 937 CB GLU A 590 62.276 11.904 -3.581 1.00 39.73 C ATOM 938 CG GLU A 590 61.348 12.664 -2.619 1.00 41.78 C ATOM 939 CD GLU A 590 62.013 12.860 -1.244 1.00 45.10 C ATOM 940 OE1 GLU A 590 62.475 11.844 -0.739 1.00 47.77 O ATOM 941 OE2 GLU A 590 62.114 14.004 -0.684 1.00 41.61 O ATOM 942 H GLU A 590 62.065 14.011 -5.177 1.00 0.00 H ATOM 943 N TYR A 591 60.097 9.987 -5.011 1.00 33.94 N ATOM 944 CA TYR A 591 58.797 9.372 -4.988 1.00 31.53 C ATOM 945 C TYR A 591 58.332 9.128 -3.551 1.00 33.44 C ATOM 946 O TYR A 591 59.088 8.664 -2.778 1.00 36.24 O ATOM 947 CB TYR A 591 58.876 8.031 -5.772 1.00 33.77 C ATOM 948 CG TYR A 591 57.610 7.235 -5.756 1.00 30.66 C ATOM 949 CD1 TYR A 591 56.510 7.700 -6.321 1.00 32.81 C ATOM 950 CD2 TYR A 591 57.516 6.045 -5.047 1.00 36.21 C ATOM 951 CE1 TYR A 591 55.301 7.023 -6.243 1.00 36.44 C ATOM 952 CE2 TYR A 591 56.329 5.361 -4.979 1.00 34.08 C ATOM 953 CZ TYR A 591 55.214 5.863 -5.568 1.00 36.00 C ATOM 954 OH TYR A 591 54.002 5.159 -5.527 1.00 43.35 O ATOM 955 HH TYR A 591 53.306 5.675 -6.005 1.00 0.00 H ATOM 956 H TYR A 591 60.939 9.377 -5.036 1.00 0.00 H ATOM 957 N MET A 592 57.070 9.381 -3.236 1.00 34.03 N ATOM 958 CA MET A 592 56.526 9.374 -1.881 1.00 33.15 C ATOM 959 C MET A 592 55.400 8.414 -1.961 1.00 34.39 C ATOM 960 O MET A 592 54.318 8.698 -2.321 1.00 31.52 O ATOM 961 CB MET A 592 56.001 10.699 -1.496 1.00 33.41 C ATOM 962 CG MET A 592 57.145 11.720 -1.425 1.00 33.65 C ATOM 963 SD MET A 592 58.321 11.482 -0.118 1.00 37.01 S ATOM 964 CE MET A 592 57.425 11.923 1.367 1.00 37.48 C ATOM 965 H MET A 592 56.416 9.602 -4.014 1.00 0.00 H ATOM 966 N ARG A 593 55.685 7.224 -1.572 1.00 32.57 N ATOM 967 CA ARG A 593 54.799 6.093 -1.789 1.00 33.55 C ATOM 968 C ARG A 593 53.369 6.100 -1.298 1.00 30.39 C ATOM 969 O ARG A 593 52.549 5.434 -1.876 1.00 34.36 O ATOM 970 CB ARG A 593 55.593 4.967 -1.109 1.00 38.68 C ATOM 971 CG ARG A 593 54.915 3.823 -0.544 1.00 40.88 C ATOM 972 CD ARG A 593 56.021 2.901 -0.092 1.00 45.54 C ATOM 973 NE ARG A 593 55.366 1.677 -0.025 1.00 43.98 N ATOM 974 HE ARG A 593 54.356 1.614 -0.266 1.00 0.00 H ATOM 975 H ARG A 593 56.588 7.063 -1.081 1.00 0.00 H ATOM 976 N HIS A 594 53.083 6.747 -0.176 1.00 31.27 N ATOM 977 CA HIS A 594 51.762 6.756 0.394 1.00 29.14 C ATOM 978 C HIS A 594 50.853 7.891 -0.077 1.00 32.74 C ATOM 979 O HIS A 594 49.712 7.995 0.388 1.00 43.64 O ATOM 980 CB HIS A 594 51.866 6.807 1.896 1.00 36.25 C ATOM 981 CG HIS A 594 52.536 5.616 2.505 1.00 40.91 C ATOM 982 ND1 HIS A 594 52.058 4.330 2.338 1.00 40.49 N ATOM 983 CD2 HIS A 594 53.642 5.509 3.283 1.00 41.30 C ATOM 984 CE1 HIS A 594 52.842 3.484 2.990 1.00 39.32 C ATOM 985 NE2 HIS A 594 53.795 4.177 3.587 1.00 39.86 N ATOM 986 H HIS A 594 53.842 7.267 0.310 1.00 0.00 H ATOM 987 N GLY A 595 51.335 8.773 -0.921 1.00 31.17 N ATOM 988 CA GLY A 595 50.490 9.872 -1.424 1.00 34.51 C ATOM 989 C GLY A 595 50.359 10.991 -0.401 1.00 33.63 C ATOM 990 O GLY A 595 51.174 11.141 0.500 1.00 30.06 O ATOM 991 H GLY A 595 52.322 8.696 -1.238 1.00 0.00 H ATOM 992 N ASP A 596 49.275 11.737 -0.504 1.00 30.74 N ATOM 993 CA ASP A 596 49.176 12.962 0.263 1.00 34.77 C ATOM 994 C ASP A 596 48.755 12.667 1.689 1.00 27.71 C ATOM 995 O ASP A 596 48.047 11.689 1.959 1.00 28.27 O ATOM 996 CB ASP A 596 48.279 13.982 -0.456 1.00 35.23 C ATOM 997 CG ASP A 596 46.828 13.778 -0.209 1.00 35.79 C ATOM 998 OD1 ASP A 596 46.295 13.905 0.921 1.00 36.60 O ATOM 999 OD2 ASP A 596 46.155 13.541 -1.193 1.00 39.05 O ATOM 1000 H ASP A 596 48.498 11.447 -1.131 1.00 0.00 H ATOM 1001 N LEU A 597 49.197 13.510 2.588 1.00 27.15 N ATOM 1002 CA LEU A 597 48.928 13.283 3.970 1.00 27.08 C ATOM 1003 C LEU A 597 47.470 13.290 4.341 1.00 29.54 C ATOM 1004 O LEU A 597 47.114 12.678 5.365 1.00 32.14 O ATOM 1005 CB LEU A 597 49.621 14.346 4.837 1.00 28.00 C ATOM 1006 CG LEU A 597 49.529 14.244 6.356 1.00 26.35 C ATOM 1007 CD1 LEU A 597 50.067 12.897 6.842 1.00 29.63 C ATOM 1008 CD2 LEU A 597 50.339 15.405 6.984 1.00 27.52 C ATOM 1009 H LEU A 597 49.744 14.345 2.295 1.00 0.00 H ATOM 1010 N ASN A 598 46.628 14.069 3.630 1.00 29.80 N ATOM 1011 CA ASN A 598 45.235 14.087 3.999 1.00 30.55 C ATOM 1012 C ASN A 598 44.593 12.671 3.799 1.00 31.32 C ATOM 1013 O ASN A 598 43.801 12.159 4.634 1.00 31.67 O ATOM 1014 CB ASN A 598 44.414 15.180 3.258 1.00 35.20 C ATOM 1015 CG ASN A 598 43.032 15.282 3.811 1.00 33.02 C ATOM 1016 OD1 ASN A 598 42.790 15.852 4.898 1.00 40.55 O ATOM 1017 ND2 ASN A 598 42.163 14.543 3.198 1.00 31.21 N ATOM 1018 HD22 ASN A 598 42.411 14.089 2.296 1.00 0.00 H ATOM 1019 HD21 ASN A 598 41.218 14.403 3.608 1.00 0.00 H ATOM 1020 H ASN A 598 46.976 14.642 2.835 1.00 0.00 H ATOM 1021 N ARG A 599 44.895 12.094 2.670 1.00 33.38 N ATOM 1022 CA ARG A 599 44.357 10.803 2.307 1.00 35.65 C ATOM 1023 C ARG A 599 44.945 9.743 3.230 1.00 32.80 C ATOM 1024 O ARG A 599 44.236 8.833 3.651 1.00 28.56 O ATOM 1025 CB ARG A 599 44.671 10.468 0.848 1.00 36.08 C ATOM 1026 CG ARG A 599 43.977 9.210 0.455 1.00 46.05 C ATOM 1027 CD ARG A 599 43.895 9.067 -1.039 1.00 62.33 C ATOM 1028 NE ARG A 599 45.220 9.016 -1.649 1.00 78.98 N ATOM 1029 CZ ARG A 599 45.966 7.912 -1.781 1.00 93.42 C ATOM 1030 NH1 ARG A 599 45.553 6.733 -1.299 1.00 97.66 N ATOM 1031 NH2 ARG A 599 47.153 7.985 -2.394 1.00 96.62 N ATOM 1032 HE ARG A 599 45.616 9.908 -2.010 1.00 0.00 H ATOM 1033 HH12 ARG A 599 46.148 5.888 -1.412 1.00 0.00 H ATOM 1034 HH11 ARG A 599 44.637 6.663 -0.811 1.00 0.00 H ATOM 1035 HH22 ARG A 599 47.737 7.131 -2.500 1.00 0.00 H ATOM 1036 HH21 ARG A 599 47.492 8.896 -2.765 1.00 0.00 H ATOM 1037 H ARG A 599 45.541 12.576 2.012 1.00 0.00 H ATOM 1038 N PHE A 600 46.222 9.883 3.552 1.00 31.48 N ATOM 1039 CA PHE A 600 46.855 8.983 4.519 1.00 33.35 C ATOM 1040 C PHE A 600 46.235 9.026 5.901 1.00 37.73 C ATOM 1041 O PHE A 600 45.985 7.971 6.506 1.00 33.77 O ATOM 1042 CB PHE A 600 48.285 9.309 4.665 1.00 35.58 C ATOM 1043 CG PHE A 600 49.039 8.312 5.527 1.00 39.33 C ATOM 1044 CD1 PHE A 600 49.577 7.145 4.958 1.00 39.20 C ATOM 1045 CD2 PHE A 600 49.247 8.550 6.865 1.00 40.11 C ATOM 1046 CE1 PHE A 600 50.327 6.261 5.732 1.00 36.53 C ATOM 1047 CE2 PHE A 600 49.979 7.626 7.683 1.00 42.09 C ATOM 1048 CZ PHE A 600 50.524 6.494 7.097 1.00 36.39 C ATOM 1049 H PHE A 600 46.782 10.641 3.113 1.00 0.00 H ATOM 1050 N LEU A 601 45.885 10.232 6.373 1.00 35.95 N ATOM 1051 CA LEU A 601 45.237 10.322 7.657 1.00 32.10 C ATOM 1052 C LEU A 601 43.891 9.646 7.616 1.00 33.36 C ATOM 1053 O LEU A 601 43.522 8.905 8.555 1.00 34.95 O ATOM 1054 CB LEU A 601 45.063 11.767 8.129 1.00 30.03 C ATOM 1055 CG LEU A 601 46.338 12.450 8.509 1.00 27.79 C ATOM 1056 CD1 LEU A 601 46.245 13.973 8.407 1.00 28.70 C ATOM 1057 CD2 LEU A 601 46.834 12.101 9.906 1.00 31.17 C ATOM 1058 H LEU A 601 46.079 11.091 5.819 1.00 0.00 H ATOM 1059 N ARG A 602 43.117 9.963 6.599 1.00 35.03 N ATOM 1060 CA ARG A 602 41.734 9.443 6.503 1.00 36.65 C ATOM 1061 C ARG A 602 41.712 7.937 6.397 1.00 36.58 C ATOM 1062 O ARG A 602 40.885 7.258 6.993 1.00 38.62 O ATOM 1063 CB ARG A 602 41.024 9.999 5.309 1.00 37.58 C ATOM 1064 CG ARG A 602 40.525 11.430 5.501 1.00 41.38 C ATOM 1065 CD ARG A 602 39.987 11.968 4.173 1.00 42.12 C ATOM 1066 NE ARG A 602 39.656 13.387 4.311 1.00 57.13 N ATOM 1067 CZ ARG A 602 38.477 13.933 4.729 1.00 57.92 C ATOM 1068 NH1 ARG A 602 37.440 13.166 5.115 1.00 55.30 N ATOM 1069 NH2 ARG A 602 38.330 15.300 4.766 1.00 45.91 N ATOM 1070 HE ARG A 602 40.409 14.059 4.061 1.00 0.00 H ATOM 1071 HH12 ARG A 602 36.553 13.610 5.429 1.00 0.00 H ATOM 1072 HH11 ARG A 602 37.526 12.130 5.099 1.00 0.00 H ATOM 1073 HH22 ARG A 602 37.432 15.718 5.084 1.00 0.00 H ATOM 1074 HH21 ARG A 602 39.116 15.916 4.476 1.00 0.00 H ATOM 1075 H ARG A 602 43.482 10.588 5.852 1.00 0.00 H ATOM 1076 N SER A 603 42.660 7.392 5.668 1.00 36.68 N ATOM 1077 CA SER A 603 42.724 5.944 5.533 1.00 37.72 C ATOM 1078 C SER A 603 43.334 5.180 6.766 1.00 43.89 C ATOM 1079 O SER A 603 43.188 3.974 6.849 1.00 42.12 O ATOM 1080 CB SER A 603 43.346 5.652 4.200 1.00 37.71 C ATOM 1081 OG SER A 603 44.667 5.852 4.337 1.00 50.77 O ATOM 1082 HG SER A 603 44.831 6.791 4.604 1.00 0.00 H ATOM 1083 H SER A 603 43.361 7.993 5.190 1.00 0.00 H ATOM 1084 N HIS A 604 43.909 5.892 7.759 1.00 37.28 N ATOM 1085 CA HIS A 604 44.376 5.297 8.969 1.00 34.44 C ATOM 1086 C HIS A 604 43.643 5.848 10.169 1.00 36.62 C ATOM 1087 O HIS A 604 44.162 5.820 11.290 1.00 38.61 O ATOM 1088 CB HIS A 604 45.914 5.398 9.112 1.00 38.49 C ATOM 1089 CG HIS A 604 46.659 4.664 8.045 1.00 40.46 C ATOM 1090 ND1 HIS A 604 46.924 5.204 6.804 1.00 42.48 N ATOM 1091 CD2 HIS A 604 47.130 3.391 8.006 1.00 41.11 C ATOM 1092 CE1 HIS A 604 47.510 4.292 6.039 1.00 41.14 C ATOM 1093 NE2 HIS A 604 47.696 3.206 6.773 1.00 43.36 N ATOM 1094 H HIS A 604 44.016 6.919 7.636 1.00 0.00 H ATOM 1095 N GLY A 605 42.424 6.317 9.962 1.00 36.53 N ATOM 1096 CA GLY A 605 41.639 6.873 11.032 1.00 35.88 C ATOM 1097 C GLY A 605 40.491 5.942 11.487 1.00 44.06 C ATOM 1098 O GLY A 605 40.244 4.878 10.874 1.00 43.84 O ATOM 1099 H GLY A 605 42.023 6.283 9.003 1.00 0.00 H ATOM 1100 N PRO A 606 39.769 6.360 12.552 1.00 46.02 N ATOM 1101 CA PRO A 606 38.686 5.597 13.096 1.00 50.13 C ATOM 1102 C PRO A 606 37.575 5.325 12.128 1.00 50.64 C ATOM 1103 O PRO A 606 36.825 4.476 12.419 1.00 52.57 O ATOM 1104 CB PRO A 606 38.174 6.466 14.262 1.00 54.10 C ATOM 1105 CG PRO A 606 39.221 7.474 14.538 1.00 50.61 C ATOM 1106 CD PRO A 606 39.900 7.675 13.235 1.00 50.42 C ATOM 1107 N ASP A 607 37.464 5.996 10.987 1.00 53.44 N ATOM 1108 CA ASP A 607 36.480 5.609 9.978 1.00 56.15 C ATOM 1109 C ASP A 607 37.025 4.819 8.824 1.00 57.73 C ATOM 1110 O ASP A 607 36.305 4.605 7.880 1.00 70.77 O ATOM 1111 CB ASP A 607 35.757 6.867 9.411 1.00 64.73 C ATOM 1112 CG ASP A 607 34.961 7.585 10.475 1.00 68.69 C ATOM 1113 OD1 ASP A 607 34.487 6.901 11.408 1.00 80.50 O ATOM 1114 OD2 ASP A 607 34.838 8.815 10.425 1.00 69.80 O ATOM 1115 H ASP A 607 38.087 6.809 10.809 1.00 0.00 H ATOM 1116 N ALA A 608 38.274 4.396 8.851 1.00 56.55 N ATOM 1117 CA ALA A 608 38.798 3.602 7.742 1.00 60.05 C ATOM 1118 C ALA A 608 38.102 2.193 7.656 1.00 62.47 C ATOM 1119 O ALA A 608 37.662 1.647 8.685 1.00 56.50 O ATOM 1120 CB ALA A 608 40.320 3.453 7.869 1.00 55.03 C ATOM 1121 H ALA A 608 38.885 4.627 9.660 1.00 0.00 H ATOM 1122 N LYS A 609 37.992 1.659 6.426 1.00 75.00 N ATOM 1123 CA LYS A 609 37.695 0.225 6.145 1.00 82.69 C ATOM 1124 C LYS A 609 38.786 -0.703 6.777 1.00 78.53 C ATOM 1125 O LYS A 609 38.571 -1.274 7.836 1.00 83.18 O ATOM 1126 CB LYS A 609 37.564 0.043 4.606 1.00 94.68 C ATOM 1127 CG LYS A 609 37.656 -1.379 4.006 1.00106.03 C ATOM 1128 CD LYS A 609 36.313 -2.038 3.693 1.00109.00 C ATOM 1129 CE LYS A 609 36.511 -3.255 2.790 1.00106.73 C ATOM 1130 NZ LYS A 609 35.330 -4.162 2.806 1.00109.29 N ATOM 1131 HZ1 LYS A 609 35.167 -4.500 3.776 1.00 0.00 H ATOM 1132 HZ2 LYS A 609 34.492 -3.644 2.473 1.00 0.00 H ATOM 1133 HZ3 LYS A 609 35.509 -4.973 2.180 1.00 0.00 H ATOM 1134 H LYS A 609 38.124 2.293 5.612 1.00 0.00 H ATOM 1135 N LEU A 610 39.947 -0.828 6.130 1.00 76.50 N ATOM 1136 CA LEU A 610 41.031 -1.717 6.566 1.00 73.85 C ATOM 1137 C LEU A 610 41.866 -0.939 7.576 1.00 68.15 C ATOM 1138 O LEU A 610 42.304 0.192 7.292 1.00 67.74 O ATOM 1139 CB LEU A 610 41.908 -2.141 5.354 1.00 72.89 C ATOM 1140 H LEU A 610 40.092 -0.264 5.268 1.00 0.00 H ATOM 1141 N LEU A 611 42.036 -1.484 8.785 1.00 58.97 N ATOM 1142 CA LEU A 611 43.065 -0.952 9.706 1.00 52.78 C ATOM 1143 C LEU A 611 43.992 -2.106 10.129 1.00 51.10 C ATOM 1144 O LEU A 611 44.270 -2.305 11.273 1.00 45.27 O ATOM 1145 CB LEU A 611 42.435 -0.205 10.893 1.00 53.45 C ATOM 1146 CG LEU A 611 41.744 1.159 10.551 1.00 61.43 C ATOM 1147 CD1 LEU A 611 40.855 1.688 11.705 1.00 48.53 C ATOM 1148 CD2 LEU A 611 42.788 2.206 10.069 1.00 55.92 C ATOM 1149 H LEU A 611 41.442 -2.286 9.080 1.00 0.00 H ATOM 1150 N ALA A 612 44.451 -2.874 9.161 1.00 51.46 N ATOM 1151 CA ALA A 612 45.329 -3.966 9.407 1.00 52.23 C ATOM 1152 C ALA A 612 46.741 -3.408 9.621 1.00 54.96 C ATOM 1153 O ALA A 612 47.091 -2.314 9.149 1.00 56.15 O ATOM 1154 CB ALA A 612 45.265 -4.885 8.203 1.00 60.01 C ATOM 1155 H ALA A 612 44.161 -2.674 8.182 1.00 0.00 H ATOM 1156 N GLY A 613 47.559 -4.120 10.368 1.00 54.88 N ATOM 1157 CA GLY A 613 48.931 -3.630 10.569 1.00 53.63 C ATOM 1158 C GLY A 613 49.671 -3.842 9.266 1.00 50.77 C ATOM 1159 O GLY A 613 49.311 -4.704 8.503 1.00 53.27 O ATOM 1160 H GLY A 613 47.242 -5.009 10.806 1.00 0.00 H ATOM 1161 N GLY A 614 50.682 -3.044 8.985 1.00 43.99 N ATOM 1162 CA GLY A 614 51.453 -3.248 7.776 1.00 38.65 C ATOM 1163 C GLY A 614 52.837 -2.755 7.984 1.00 41.31 C ATOM 1164 O GLY A 614 53.351 -2.713 9.131 1.00 42.74 O ATOM 1165 H GLY A 614 50.926 -2.267 9.632 1.00 0.00 H ATOM 1166 N GLU A 615 53.450 -2.365 6.886 1.00 38.62 N ATOM 1167 CA GLU A 615 54.857 -2.028 6.896 1.00 43.10 C ATOM 1168 C GLU A 615 55.177 -0.899 7.828 1.00 39.64 C ATOM 1169 O GLU A 615 56.183 -0.918 8.530 1.00 42.04 O ATOM 1170 CB GLU A 615 55.297 -1.698 5.458 1.00 48.93 C ATOM 1171 CG GLU A 615 56.796 -1.503 5.373 1.00 52.21 C ATOM 1172 CD GLU A 615 57.371 -1.652 3.947 1.00 49.37 C ATOM 1173 OE1 GLU A 615 56.938 -2.463 3.110 1.00 60.21 O ATOM 1174 OE2 GLU A 615 58.315 -0.927 3.665 1.00 49.63 O ATOM 1175 H GLU A 615 52.914 -2.298 5.997 1.00 0.00 H ATOM 1176 N ASP A 616 54.337 0.126 7.810 1.00 44.71 N ATOM 1177 CA ASP A 616 54.726 1.444 8.393 1.00 44.37 C ATOM 1178 C ASP A 616 53.866 1.809 9.547 1.00 42.55 C ATOM 1179 O ASP A 616 54.192 2.706 10.268 1.00 46.48 O ATOM 1180 CB ASP A 616 54.579 2.562 7.335 1.00 46.84 C ATOM 1181 CG ASP A 616 55.698 2.543 6.308 1.00 47.23 C ATOM 1182 OD1 ASP A 616 56.816 2.154 6.675 1.00 48.86 O ATOM 1183 OD2 ASP A 616 55.483 2.878 5.135 1.00 51.46 O ATOM 1184 H ASP A 616 53.395 0.011 7.384 1.00 0.00 H ATOM 1185 N VAL A 617 52.743 1.121 9.682 1.00 42.62 N ATOM 1186 CA VAL A 617 51.732 1.462 10.633 1.00 42.91 C ATOM 1187 C VAL A 617 51.257 0.176 11.345 1.00 41.18 C ATOM 1188 O VAL A 617 51.034 -0.878 10.714 1.00 43.05 O ATOM 1189 CB VAL A 617 50.619 2.148 9.831 1.00 45.60 C ATOM 1190 CG1 VAL A 617 49.405 2.399 10.660 1.00 55.57 C ATOM 1191 CG2 VAL A 617 51.136 3.468 9.360 1.00 54.73 C ATOM 1192 H VAL A 617 52.590 0.295 9.069 1.00 0.00 H ATOM 1193 N ALA A 618 51.040 0.284 12.646 1.00 42.04 N ATOM 1194 CA ALA A 618 50.413 -0.740 13.458 1.00 39.87 C ATOM 1195 C ALA A 618 48.944 -0.904 13.163 1.00 42.10 C ATOM 1196 O ALA A 618 48.353 -0.089 12.480 1.00 44.66 O ATOM 1197 CB ALA A 618 50.646 -0.434 14.924 1.00 38.55 C ATOM 1198 H ALA A 618 51.339 1.162 13.117 1.00 0.00 H ATOM 1199 N PRO A 619 48.330 -1.964 13.682 1.00 46.32 N ATOM 1200 CA PRO A 619 46.944 -2.205 13.361 1.00 49.10 C ATOM 1201 C PRO A 619 45.936 -1.196 13.802 1.00 45.72 C ATOM 1202 O PRO A 619 44.883 -1.055 13.199 1.00 48.72 O ATOM 1203 CB PRO A 619 46.612 -3.523 14.112 1.00 51.30 C ATOM 1204 CG PRO A 619 47.898 -4.293 14.080 1.00 45.83 C ATOM 1205 CD PRO A 619 48.981 -3.220 14.124 1.00 52.78 C ATOM 1206 N GLY A 620 46.017 -0.496 14.849 1.00 44.25 N ATOM 1207 CA GLY A 620 44.694 0.367 14.835 1.00 53.98 C ATOM 1208 C GLY A 620 44.640 1.627 13.899 1.00 48.47 C ATOM 1209 O GLY A 620 45.440 1.799 12.936 1.00 40.98 O ATOM 1210 H GLY A 620 46.779 -0.489 15.557 1.00 0.00 H ATOM 1211 N PRO A 621 43.796 2.580 14.260 1.00 44.56 N ATOM 1212 CA PRO A 621 44.027 3.963 13.846 1.00 40.85 C ATOM 1213 C PRO A 621 45.363 4.469 14.377 1.00 41.20 C ATOM 1214 O PRO A 621 45.791 4.015 15.407 1.00 41.56 O ATOM 1215 CB PRO A 621 42.928 4.759 14.597 1.00 46.18 C ATOM 1216 CG PRO A 621 41.941 3.733 15.027 1.00 51.87 C ATOM 1217 CD PRO A 621 42.738 2.466 15.270 1.00 46.78 C ATOM 1218 N LEU A 622 45.973 5.455 13.759 1.00 33.61 N ATOM 1219 CA LEU A 622 47.246 5.958 14.271 1.00 37.65 C ATOM 1220 C LEU A 622 47.132 6.368 15.734 1.00 37.57 C ATOM 1221 O LEU A 622 46.126 7.017 16.136 1.00 35.40 O ATOM 1222 CB LEU A 622 47.725 7.167 13.450 1.00 37.85 C ATOM 1223 CG LEU A 622 47.811 7.019 11.935 1.00 36.49 C ATOM 1224 CD1 LEU A 622 48.036 8.385 11.350 1.00 36.37 C ATOM 1225 CD2 LEU A 622 48.958 6.037 11.632 1.00 39.92 C ATOM 1226 H LEU A 622 45.551 5.877 12.907 1.00 0.00 H ATOM 1227 N GLY A 623 48.139 6.050 16.528 1.00 34.43 N ATOM 1228 CA GLY A 623 48.096 6.426 17.952 1.00 31.83 C ATOM 1229 C GLY A 623 48.728 7.773 18.096 1.00 34.69 C ATOM 1230 O GLY A 623 49.285 8.351 17.129 1.00 34.05 O ATOM 1231 H GLY A 623 48.960 5.536 16.149 1.00 0.00 H ATOM 1232 N LEU A 624 48.746 8.206 19.353 1.00 35.21 N ATOM 1233 CA LEU A 624 49.166 9.532 19.745 1.00 38.23 C ATOM 1234 C LEU A 624 50.570 9.837 19.357 1.00 33.33 C ATOM 1235 O LEU A 624 50.879 10.908 18.798 1.00 34.84 O ATOM 1236 CB LEU A 624 48.952 9.722 21.266 1.00 35.71 C ATOM 1237 CG LEU A 624 49.401 11.081 21.798 1.00 35.29 C ATOM 1238 CD1 LEU A 624 48.628 12.211 21.109 1.00 34.22 C ATOM 1239 CD2 LEU A 624 49.175 11.117 23.293 1.00 37.21 C ATOM 1240 H LEU A 624 48.439 7.550 20.100 1.00 0.00 H ATOM 1241 N GLY A 625 51.447 8.914 19.682 1.00 33.28 N ATOM 1242 CA GLY A 625 52.850 9.079 19.366 1.00 31.84 C ATOM 1243 C GLY A 625 53.104 9.222 17.857 1.00 33.30 C ATOM 1244 O GLY A 625 53.954 9.996 17.451 1.00 34.55 O ATOM 1245 H GLY A 625 51.129 8.054 20.173 1.00 0.00 H ATOM 1246 N GLN A 626 52.311 8.556 17.048 1.00 33.30 N ATOM 1247 CA GLN A 626 52.434 8.653 15.575 1.00 39.16 C ATOM 1248 C GLN A 626 51.845 9.989 15.016 1.00 34.03 C ATOM 1249 O GLN A 626 52.461 10.615 14.136 1.00 34.64 O ATOM 1250 CB GLN A 626 51.759 7.499 14.806 1.00 40.81 C ATOM 1251 CG GLN A 626 52.338 6.110 14.973 1.00 51.81 C ATOM 1252 CD GLN A 626 52.307 5.627 16.433 1.00 59.27 C ATOM 1253 OE1 GLN A 626 51.299 5.756 17.155 1.00 69.39 O ATOM 1254 NE2 GLN A 626 53.436 5.098 16.889 1.00 75.13 N ATOM 1255 HE22 GLN A 626 54.258 5.005 16.259 1.00 0.00 H ATOM 1256 HE21 GLN A 626 53.498 4.776 17.876 1.00 0.00 H ATOM 1257 H GLN A 626 51.576 7.943 17.454 1.00 0.00 H ATOM 1258 N LEU A 627 50.694 10.407 15.536 1.00 32.84 N ATOM 1259 CA LEU A 627 50.100 11.745 15.175 1.00 33.01 C ATOM 1260 C LEU A 627 51.076 12.806 15.573 1.00 35.53 C ATOM 1261 O LEU A 627 51.304 13.754 14.809 1.00 30.35 O ATOM 1262 CB LEU A 627 48.748 12.005 15.835 1.00 32.84 C ATOM 1263 CG LEU A 627 47.654 10.979 15.485 1.00 36.60 C ATOM 1264 CD1 LEU A 627 46.390 11.080 16.328 1.00 36.88 C ATOM 1265 CD2 LEU A 627 47.313 11.059 14.041 1.00 35.10 C ATOM 1266 H LEU A 627 50.191 9.795 16.209 1.00 0.00 H ATOM 1267 N LEU A 628 51.760 12.602 16.720 1.00 34.79 N ATOM 1268 CA LEU A 628 52.763 13.593 17.114 1.00 34.24 C ATOM 1269 C LEU A 628 53.968 13.589 16.200 1.00 32.97 C ATOM 1270 O LEU A 628 54.499 14.639 15.929 1.00 29.46 O ATOM 1271 CB LEU A 628 53.223 13.435 18.590 1.00 34.51 C ATOM 1272 CG LEU A 628 52.179 13.848 19.625 1.00 35.28 C ATOM 1273 CD1 LEU A 628 52.527 13.274 21.005 1.00 35.95 C ATOM 1274 CD2 LEU A 628 52.043 15.370 19.712 1.00 34.12 C ATOM 1275 H LEU A 628 51.579 11.763 17.308 1.00 0.00 H ATOM 1276 N ALA A 629 54.386 12.417 15.713 1.00 33.73 N ATOM 1277 CA ALA A 629 55.568 12.374 14.862 1.00 34.45 C ATOM 1278 C ALA A 629 55.230 13.042 13.478 1.00 32.29 C ATOM 1279 O ALA A 629 56.008 13.753 12.944 1.00 37.44 O ATOM 1280 CB ALA A 629 56.073 10.899 14.696 1.00 31.21 C ATOM 1281 H ALA A 629 53.872 11.542 15.940 1.00 0.00 H ATOM 1282 N VAL A 630 54.049 12.800 12.944 1.00 31.54 N ATOM 1283 CA VAL A 630 53.563 13.470 11.696 1.00 32.76 C ATOM 1284 C VAL A 630 53.596 14.950 11.850 1.00 30.53 C ATOM 1285 O VAL A 630 54.153 15.605 11.021 1.00 29.64 O ATOM 1286 CB VAL A 630 52.146 12.987 11.358 1.00 32.34 C ATOM 1287 CG1 VAL A 630 51.497 13.835 10.279 1.00 35.10 C ATOM 1288 CG2 VAL A 630 52.183 11.520 10.913 1.00 33.95 C ATOM 1289 H VAL A 630 53.426 12.111 13.412 1.00 0.00 H ATOM 1290 N ALA A 631 53.063 15.472 12.958 1.00 32.03 N ATOM 1291 CA ALA A 631 53.011 16.924 13.176 1.00 32.12 C ATOM 1292 C ALA A 631 54.379 17.594 13.257 1.00 33.69 C ATOM 1293 O ALA A 631 54.649 18.651 12.724 1.00 31.59 O ATOM 1294 CB ALA A 631 52.213 17.260 14.472 1.00 33.69 C ATOM 1295 H ALA A 631 52.676 14.836 13.684 1.00 0.00 H ATOM 1296 N SER A 632 55.231 16.914 13.976 1.00 32.51 N ATOM 1297 CA SER A 632 56.572 17.322 14.158 1.00 32.97 C ATOM 1298 C SER A 632 57.374 17.450 12.851 1.00 28.80 C ATOM 1299 O SER A 632 58.174 18.329 12.676 1.00 29.61 O ATOM 1300 CB SER A 632 57.137 16.164 15.020 1.00 37.17 C ATOM 1301 OG SER A 632 58.346 16.554 15.420 1.00 48.59 O ATOM 1302 HG SER A 632 58.753 15.844 15.978 1.00 0.00 H ATOM 1303 H SER A 632 54.910 16.037 14.433 1.00 0.00 H ATOM 1304 N GLN A 633 57.220 16.472 11.991 1.00 27.27 N ATOM 1305 CA GLN A 633 57.885 16.491 10.689 1.00 32.74 C ATOM 1306 C GLN A 633 57.356 17.621 9.829 1.00 28.14 C ATOM 1307 O GLN A 633 58.114 18.321 9.200 1.00 28.98 O ATOM 1308 CB GLN A 633 57.722 15.123 10.008 1.00 32.39 C ATOM 1309 CG GLN A 633 58.493 13.983 10.715 1.00 28.63 C ATOM 1310 CD GLN A 633 58.219 12.702 10.012 1.00 33.02 C ATOM 1311 OE1 GLN A 633 57.378 11.889 10.417 1.00 39.31 O ATOM 1312 NE2 GLN A 633 58.857 12.536 8.911 1.00 31.18 N ATOM 1313 HE22 GLN A 633 59.557 13.242 8.604 1.00 0.00 H ATOM 1314 HE21 GLN A 633 58.674 11.696 8.326 1.00 0.00 H ATOM 1315 H GLN A 633 56.612 15.666 12.240 1.00 0.00 H ATOM 1316 N VAL A 634 56.061 17.855 9.847 1.00 29.37 N ATOM 1317 CA VAL A 634 55.515 19.011 9.050 1.00 29.42 C ATOM 1318 C VAL A 634 56.056 20.307 9.666 1.00 29.28 C ATOM 1319 O VAL A 634 56.538 21.197 8.986 1.00 30.65 O ATOM 1320 CB VAL A 634 53.992 19.041 9.052 1.00 31.68 C ATOM 1321 CG1 VAL A 634 53.482 20.300 8.298 1.00 35.13 C ATOM 1322 CG2 VAL A 634 53.456 17.792 8.424 1.00 31.96 C ATOM 1323 H VAL A 634 55.424 17.250 10.404 1.00 0.00 H ATOM 1324 N ALA A 635 56.103 20.373 10.984 1.00 29.87 N ATOM 1325 CA ALA A 635 56.630 21.577 11.590 1.00 31.45 C ATOM 1326 C ALA A 635 58.101 21.793 11.256 1.00 29.69 C ATOM 1327 O ALA A 635 58.566 22.891 11.042 1.00 30.59 O ATOM 1328 CB ALA A 635 56.383 21.535 13.105 1.00 35.03 C ATOM 1329 H ALA A 635 55.770 19.581 11.571 1.00 0.00 H ATOM 1330 N ALA A 636 58.856 20.724 11.209 1.00 30.44 N ATOM 1331 CA ALA A 636 60.277 20.806 10.863 1.00 31.51 C ATOM 1332 C ALA A 636 60.496 21.325 9.442 1.00 32.49 C ATOM 1333 O ALA A 636 61.363 22.164 9.202 1.00 30.96 O ATOM 1334 CB ALA A 636 60.945 19.391 11.022 1.00 29.13 C ATOM 1335 H ALA A 636 58.437 19.796 11.422 1.00 0.00 H ATOM 1336 N GLY A 637 59.672 20.881 8.496 1.00 36.97 N ATOM 1337 CA GLY A 637 59.757 21.446 7.139 1.00 33.67 C ATOM 1338 C GLY A 637 59.520 22.956 7.173 1.00 35.06 C ATOM 1339 O GLY A 637 60.175 23.706 6.409 1.00 30.80 O ATOM 1340 H GLY A 637 58.974 20.141 8.713 1.00 0.00 H ATOM 1341 N MET A 638 58.582 23.399 8.016 1.00 33.99 N ATOM 1342 CA MET A 638 58.233 24.821 8.097 1.00 36.28 C ATOM 1343 C MET A 638 59.306 25.682 8.771 1.00 37.62 C ATOM 1344 O MET A 638 59.460 26.837 8.410 1.00 35.49 O ATOM 1345 CB MET A 638 56.948 25.008 8.848 1.00 38.89 C ATOM 1346 CG MET A 638 55.681 24.707 8.117 1.00 42.46 C ATOM 1347 SD MET A 638 54.450 25.029 9.394 1.00 53.57 S ATOM 1348 CE MET A 638 54.376 26.830 9.339 1.00 53.63 C ATOM 1349 H MET A 638 58.088 22.719 8.629 1.00 0.00 H ATOM 1350 N VAL A 639 60.011 25.129 9.769 1.00 34.25 N ATOM 1351 CA VAL A 639 61.159 25.812 10.385 1.00 33.79 C ATOM 1352 C VAL A 639 62.214 26.070 9.295 1.00 34.11 C ATOM 1353 O VAL A 639 62.763 27.153 9.166 1.00 35.70 O ATOM 1354 CB VAL A 639 61.864 24.918 11.469 1.00 33.65 C ATOM 1355 CG1 VAL A 639 63.193 25.521 11.928 1.00 31.02 C ATOM 1356 CG2 VAL A 639 60.960 24.618 12.656 1.00 37.25 C ATOM 1357 H VAL A 639 59.738 24.188 10.118 1.00 0.00 H ATOM 1358 N TYR A 640 62.482 25.055 8.475 1.00 35.73 N ATOM 1359 CA TYR A 640 63.398 25.225 7.334 1.00 37.26 C ATOM 1360 C TYR A 640 62.954 26.339 6.388 1.00 35.23 C ATOM 1361 O TYR A 640 63.756 27.218 6.021 1.00 33.34 O ATOM 1362 CB TYR A 640 63.584 23.894 6.543 1.00 43.75 C ATOM 1363 CG TYR A 640 64.455 23.991 5.292 1.00 47.19 C ATOM 1364 CD1 TYR A 640 65.836 24.077 5.389 1.00 50.71 C ATOM 1365 CD2 TYR A 640 63.875 24.019 4.013 1.00 52.04 C ATOM 1366 CE1 TYR A 640 66.624 24.172 4.271 1.00 46.29 C ATOM 1367 CE2 TYR A 640 64.657 24.095 2.892 1.00 51.29 C ATOM 1368 CZ TYR A 640 66.029 24.186 3.040 1.00 50.23 C ATOM 1369 OH TYR A 640 66.791 24.253 1.934 1.00 51.40 O ATOM 1370 HH TYR A 640 66.539 25.054 1.409 1.00 0.00 H ATOM 1371 H TYR A 640 62.038 24.129 8.643 1.00 0.00 H ATOM 1372 N LEU A 641 61.692 26.307 5.982 1.00 35.49 N ATOM 1373 CA LEU A 641 61.215 27.361 5.073 1.00 35.64 C ATOM 1374 C LEU A 641 61.349 28.705 5.741 1.00 41.29 C ATOM 1375 O LEU A 641 61.856 29.607 5.127 1.00 39.65 O ATOM 1376 CB LEU A 641 59.812 27.165 4.596 1.00 33.21 C ATOM 1377 CG LEU A 641 59.504 25.890 3.844 1.00 33.87 C ATOM 1378 CD1 LEU A 641 58.048 25.816 3.579 1.00 35.94 C ATOM 1379 CD2 LEU A 641 60.310 25.808 2.550 1.00 36.21 C ATOM 1380 H LEU A 641 61.052 25.552 6.300 1.00 0.00 H ATOM 1381 N ALA A 642 60.901 28.862 6.987 1.00 39.06 N ATOM 1382 CA ALA A 642 61.064 30.203 7.660 1.00 38.09 C ATOM 1383 C ALA A 642 62.540 30.637 7.736 1.00 38.62 C ATOM 1384 O ALA A 642 62.824 31.772 7.513 1.00 38.75 O ATOM 1385 CB ALA A 642 60.442 30.246 9.028 1.00 35.78 C ATOM 1386 H ALA A 642 60.446 28.072 7.488 1.00 0.00 H ATOM 1387 N GLY A 643 63.471 29.693 7.933 1.00 41.06 N ATOM 1388 CA GLY A 643 64.898 29.997 7.960 1.00 42.01 C ATOM 1389 C GLY A 643 65.407 30.613 6.675 1.00 51.82 C ATOM 1390 O GLY A 643 66.339 31.433 6.688 1.00 52.28 O ATOM 1391 H GLY A 643 63.165 28.709 8.072 1.00 0.00 H ATOM 1392 N LEU A 644 64.792 30.209 5.558 1.00 51.97 N ATOM 1393 CA LEU A 644 65.172 30.672 4.236 1.00 46.36 C ATOM 1394 C LEU A 644 64.262 31.770 3.683 1.00 46.73 C ATOM 1395 O LEU A 644 64.332 32.036 2.495 1.00 45.27 O ATOM 1396 CB LEU A 644 65.305 29.470 3.265 1.00 50.04 C ATOM 1397 CG LEU A 644 66.458 28.493 3.628 1.00 50.31 C ATOM 1398 CD1 LEU A 644 66.580 27.459 2.537 1.00 61.07 C ATOM 1399 CD2 LEU A 644 67.809 29.196 3.760 1.00 56.87 C ATOM 1400 H LEU A 644 64.006 29.533 5.641 1.00 0.00 H ATOM 1401 N HIS A 645 63.452 32.404 4.538 1.00 42.46 N ATOM 1402 CA HIS A 645 62.522 33.471 4.128 1.00 50.88 C ATOM 1403 C HIS A 645 61.440 33.051 3.112 1.00 51.17 C ATOM 1404 O HIS A 645 60.878 33.876 2.461 1.00 49.30 O ATOM 1405 CB HIS A 645 63.297 34.700 3.612 1.00 55.42 C ATOM 1406 CG HIS A 645 64.341 35.208 4.567 1.00 66.20 C ATOM 1407 ND1 HIS A 645 64.120 35.342 5.926 1.00 66.50 N ATOM 1408 CD2 HIS A 645 65.624 35.586 4.361 1.00 74.57 C ATOM 1409 CE1 HIS A 645 65.223 35.748 6.518 1.00 64.13 C ATOM 1410 NE2 HIS A 645 66.146 35.926 5.589 1.00 66.53 N ATOM 1411 H HIS A 645 63.480 32.131 5.541 1.00 0.00 H ATOM 1412 N PHE A 646 61.127 31.767 2.999 1.00 49.35 N ATOM 1413 CA PHE A 646 60.028 31.345 2.155 1.00 42.69 C ATOM 1414 C PHE A 646 58.684 31.396 2.943 1.00 41.95 C ATOM 1415 O PHE A 646 58.622 31.106 4.138 1.00 44.43 O ATOM 1416 CB PHE A 646 60.240 29.916 1.729 1.00 44.40 C ATOM 1417 CG PHE A 646 61.134 29.727 0.540 1.00 52.84 C ATOM 1418 CD1 PHE A 646 62.496 29.399 0.708 1.00 60.93 C ATOM 1419 CD2 PHE A 646 60.599 29.696 -0.737 1.00 48.37 C ATOM 1420 CE1 PHE A 646 63.309 29.116 -0.401 1.00 68.69 C ATOM 1421 CE2 PHE A 646 61.414 29.424 -1.863 1.00 54.37 C ATOM 1422 CZ PHE A 646 62.769 29.149 -1.699 1.00 58.67 C ATOM 1423 H PHE A 646 61.677 31.056 3.522 1.00 0.00 H ATOM 1424 N VAL A 647 57.606 31.701 2.236 1.00 36.61 N ATOM 1425 CA VAL A 647 56.298 31.629 2.772 1.00 36.23 C ATOM 1426 C VAL A 647 55.478 30.745 1.824 1.00 34.96 C ATOM 1427 O VAL A 647 55.464 30.929 0.603 1.00 35.24 O ATOM 1428 CB VAL A 647 55.687 33.023 2.878 1.00 35.50 C ATOM 1429 CG1 VAL A 647 54.307 32.933 3.496 1.00 39.66 C ATOM 1430 CG2 VAL A 647 56.606 33.917 3.727 1.00 33.71 C ATOM 1431 H VAL A 647 57.725 32.005 1.249 1.00 0.00 H ATOM 1432 N HIS A 648 54.785 29.776 2.383 1.00 33.92 N ATOM 1433 CA HIS A 648 54.088 28.767 1.560 1.00 33.75 C ATOM 1434 C HIS A 648 52.741 29.253 1.048 1.00 29.94 C ATOM 1435 O HIS A 648 52.427 29.157 -0.174 1.00 30.00 O ATOM 1436 CB HIS A 648 53.925 27.481 2.354 1.00 30.20 C ATOM 1437 CG HIS A 648 53.523 26.284 1.533 1.00 31.14 C ATOM 1438 ND1 HIS A 648 52.253 26.102 1.049 1.00 32.04 N ATOM 1439 CD2 HIS A 648 54.206 25.161 1.188 1.00 33.65 C ATOM 1440 CE1 HIS A 648 52.172 24.965 0.385 1.00 33.84 C ATOM 1441 NE2 HIS A 648 53.343 24.354 0.494 1.00 33.28 N ATOM 1442 H HIS A 648 54.727 29.720 3.420 1.00 0.00 H ATOM 1443 N ARG A 649 51.929 29.725 1.995 1.00 29.51 N ATOM 1444 CA ARG A 649 50.573 30.310 1.736 1.00 29.54 C ATOM 1445 C ARG A 649 49.446 29.301 1.461 1.00 36.52 C ATOM 1446 O ARG A 649 48.281 29.722 1.348 1.00 29.66 O ATOM 1447 CB ARG A 649 50.552 31.283 0.586 1.00 30.82 C ATOM 1448 CG ARG A 649 51.608 32.354 0.598 1.00 34.05 C ATOM 1449 CD ARG A 649 51.564 33.073 -0.753 1.00 35.93 C ATOM 1450 NE ARG A 649 52.440 34.203 -0.613 1.00 45.21 N ATOM 1451 CZ ARG A 649 53.773 34.172 -0.610 1.00 48.54 C ATOM 1452 NH1 ARG A 649 54.479 33.059 -0.859 1.00 55.04 N ATOM 1453 NH2 ARG A 649 54.421 35.295 -0.387 1.00 53.36 N ATOM 1454 HE ARG A 649 51.991 35.135 -0.503 1.00 0.00 H ATOM 1455 HH12 ARG A 649 55.518 33.088 -0.844 1.00 0.00 H ATOM 1456 HH11 ARG A 649 53.987 32.167 -1.067 1.00 0.00 H ATOM 1457 HH22 ARG A 649 55.461 35.302 -0.379 1.00 0.00 H ATOM 1458 HH21 ARG A 649 53.893 36.175 -0.219 1.00 0.00 H ATOM 1459 H ARG A 649 52.259 29.684 2.980 1.00 0.00 H ATOM 1460 N ASP A 650 49.781 28.025 1.214 1.00 30.47 N ATOM 1461 CA ASP A 650 48.720 26.980 1.114 1.00 30.54 C ATOM 1462 C ASP A 650 49.127 25.770 1.963 1.00 30.17 C ATOM 1463 O ASP A 650 48.934 24.639 1.554 1.00 29.05 O ATOM 1464 CB ASP A 650 48.397 26.599 -0.387 1.00 29.25 C ATOM 1465 CG ASP A 650 47.122 25.789 -0.530 1.00 30.03 C ATOM 1466 OD1 ASP A 650 46.278 25.705 0.434 1.00 31.30 O ATOM 1467 OD2 ASP A 650 46.919 25.230 -1.642 1.00 32.48 O ATOM 1468 H ASP A 650 50.780 27.764 1.092 1.00 0.00 H ATOM 1469 N LEU A 651 49.601 25.994 3.187 1.00 32.42 N ATOM 1470 CA LEU A 651 49.901 24.856 4.037 1.00 32.92 C ATOM 1471 C LEU A 651 48.639 24.142 4.480 1.00 30.97 C ATOM 1472 O LEU A 651 47.650 24.730 4.904 1.00 32.52 O ATOM 1473 CB LEU A 651 50.844 25.211 5.201 1.00 33.13 C ATOM 1474 CG LEU A 651 51.170 23.992 6.050 1.00 43.96 C ATOM 1475 CD1 LEU A 651 52.202 23.029 5.381 1.00 41.97 C ATOM 1476 CD2 LEU A 651 51.613 24.467 7.446 1.00 43.82 C ATOM 1477 H LEU A 651 49.753 26.965 3.527 1.00 0.00 H ATOM 1478 N ALA A 652 48.654 22.836 4.288 1.00 29.71 N ATOM 1479 CA ALA A 652 47.546 21.950 4.617 1.00 30.08 C ATOM 1480 C ALA A 652 47.990 20.485 4.406 1.00 29.72 C ATOM 1481 O ALA A 652 48.966 20.231 3.634 1.00 29.17 O ATOM 1482 CB ALA A 652 46.353 22.273 3.746 1.00 29.35 C ATOM 1483 H ALA A 652 49.510 22.414 3.876 1.00 0.00 H ATOM 1484 N THR A 653 47.233 19.517 4.949 1.00 27.46 N ATOM 1485 CA THR A 653 47.679 18.138 4.860 1.00 30.10 C ATOM 1486 C THR A 653 47.670 17.634 3.430 1.00 31.23 C ATOM 1487 O THR A 653 48.525 16.803 3.078 1.00 32.48 O ATOM 1488 CB THR A 653 46.927 17.154 5.747 1.00 31.91 C ATOM 1489 OG1 THR A 653 45.562 17.148 5.354 1.00 28.30 O ATOM 1490 CG2 THR A 653 47.084 17.556 7.233 1.00 34.01 C ATOM 1491 HG1 THR A 653 45.185 18.057 5.461 1.00 0.00 H ATOM 1492 H THR A 653 46.340 19.752 5.427 1.00 0.00 H ATOM 1493 N ARG A 654 46.769 18.144 2.594 1.00 30.93 N ATOM 1494 CA ARG A 654 46.781 17.885 1.115 1.00 30.14 C ATOM 1495 C ARG A 654 48.058 18.221 0.426 1.00 27.11 C ATOM 1496 O ARG A 654 48.395 17.581 -0.560 1.00 26.00 O ATOM 1497 CB ARG A 654 45.622 18.583 0.399 1.00 34.74 C ATOM 1498 CG ARG A 654 45.572 20.087 0.502 1.00 33.84 C ATOM 1499 CD ARG A 654 44.336 20.680 -0.274 1.00 35.27 C ATOM 1500 NE ARG A 654 44.404 22.099 -0.065 1.00 35.06 N ATOM 1501 CZ ARG A 654 43.951 22.748 1.015 1.00 35.93 C ATOM 1502 NH1 ARG A 654 43.242 22.117 1.934 1.00 37.91 N ATOM 1503 NH2 ARG A 654 44.179 24.046 1.140 1.00 32.71 N ATOM 1504 HE ARG A 654 44.842 22.671 -0.815 1.00 0.00 H ATOM 1505 HH12 ARG A 654 42.896 22.632 2.768 1.00 0.00 H ATOM 1506 HH11 ARG A 654 43.030 21.105 1.823 1.00 0.00 H ATOM 1507 HH22 ARG A 654 43.830 24.557 1.976 1.00 0.00 H ATOM 1508 HH21 ARG A 654 44.707 24.555 0.402 1.00 0.00 H ATOM 1509 H ARG A 654 46.020 18.751 2.984 1.00 0.00 H ATOM 1510 N ASN A 655 48.765 19.206 0.960 1.00 25.26 N ATOM 1511 CA ASN A 655 50.037 19.678 0.426 1.00 27.80 C ATOM 1512 C ASN A 655 51.289 19.214 1.151 1.00 29.14 C ATOM 1513 O ASN A 655 52.402 19.836 1.094 1.00 29.52 O ATOM 1514 CB ASN A 655 49.983 21.238 0.364 1.00 28.35 C ATOM 1515 CG ASN A 655 49.106 21.734 -0.801 1.00 28.87 C ATOM 1516 OD1 ASN A 655 48.924 21.048 -1.805 1.00 31.60 O ATOM 1517 ND2 ASN A 655 48.458 22.857 -0.607 1.00 28.98 N ATOM 1518 HD22 ASN A 655 48.633 23.416 0.252 1.00 0.00 H ATOM 1519 HD21 ASN A 655 47.769 23.188 -1.312 1.00 0.00 H ATOM 1520 H ASN A 655 48.390 19.671 1.812 1.00 0.00 H ATOM 1521 N CYS A 656 51.153 18.058 1.771 1.00 32.54 N ATOM 1522 CA CYS A 656 52.286 17.290 2.272 1.00 32.04 C ATOM 1523 C CYS A 656 52.158 15.889 1.722 1.00 29.18 C ATOM 1524 O CYS A 656 51.033 15.418 1.518 1.00 27.54 O ATOM 1525 CB CYS A 656 52.183 17.208 3.835 1.00 36.26 C ATOM 1526 SG CYS A 656 52.109 18.785 4.688 1.00 32.65 S ATOM 1527 H CYS A 656 50.195 17.678 1.909 1.00 0.00 H ATOM 1528 N LEU A 657 53.297 15.202 1.622 1.00 28.69 N ATOM 1529 CA LEU A 657 53.345 13.848 1.147 1.00 30.96 C ATOM 1530 C LEU A 657 54.021 12.913 2.167 1.00 35.04 C ATOM 1531 O LEU A 657 54.848 13.329 2.986 1.00 35.46 O ATOM 1532 CB LEU A 657 54.091 13.808 -0.173 1.00 30.21 C ATOM 1533 CG LEU A 657 53.353 14.546 -1.338 1.00 30.69 C ATOM 1534 CD1 LEU A 657 54.303 14.762 -2.497 1.00 35.80 C ATOM 1535 CD2 LEU A 657 52.168 13.759 -1.792 1.00 29.37 C ATOM 1536 H LEU A 657 54.186 15.666 1.899 1.00 0.00 H ATOM 1537 N VAL A 658 53.625 11.643 2.091 1.00 31.75 N ATOM 1538 CA VAL A 658 54.003 10.642 3.036 1.00 31.80 C ATOM 1539 C VAL A 658 54.693 9.514 2.272 1.00 33.64 C ATOM 1540 O VAL A 658 54.184 8.962 1.261 1.00 34.35 O ATOM 1541 CB VAL A 658 52.796 10.078 3.777 1.00 33.71 C ATOM 1542 CG1 VAL A 658 53.278 9.086 4.848 1.00 36.90 C ATOM 1543 CG2 VAL A 658 51.983 11.170 4.405 1.00 34.91 C ATOM 1544 H VAL A 658 53.008 11.366 1.301 1.00 0.00 H ATOM 1545 N GLY A 659 55.906 9.268 2.686 1.00 34.44 N ATOM 1546 CA GLY A 659 56.739 8.245 2.121 1.00 37.69 C ATOM 1547 C GLY A 659 56.920 7.037 3.016 1.00 39.18 C ATOM 1548 O GLY A 659 56.447 6.958 4.137 1.00 32.19 O ATOM 1549 H GLY A 659 56.288 9.842 3.464 1.00 0.00 H ATOM 1550 N GLN A 660 57.681 6.117 2.472 1.00 42.17 N ATOM 1551 CA GLN A 660 58.127 4.941 3.160 1.00 45.15 C ATOM 1552 C GLN A 660 58.790 5.147 4.529 1.00 36.03 C ATOM 1553 O GLN A 660 59.666 5.929 4.686 1.00 36.74 O ATOM 1554 CB GLN A 660 59.092 4.170 2.269 1.00 49.13 C ATOM 1555 CG GLN A 660 59.191 2.748 2.784 1.00 56.69 C ATOM 1556 CD GLN A 660 60.351 2.018 2.184 1.00 62.52 C ATOM 1557 OE1 GLN A 660 60.955 2.457 1.222 1.00 54.87 O ATOM 1558 NE2 GLN A 660 60.681 0.894 2.774 1.00 70.74 N ATOM 1559 HE22 GLN A 660 60.136 0.557 3.593 1.00 0.00 H ATOM 1560 HE21 GLN A 660 61.488 0.339 2.422 1.00 0.00 H ATOM 1561 H GLN A 660 57.978 6.249 1.484 1.00 0.00 H ATOM 1562 N GLY A 661 58.332 4.408 5.517 1.00 36.16 N ATOM 1563 CA GLY A 661 58.754 4.626 6.889 1.00 37.55 C ATOM 1564 C GLY A 661 57.936 5.689 7.591 1.00 41.94 C ATOM 1565 O GLY A 661 58.263 6.147 8.694 1.00 38.56 O ATOM 1566 H GLY A 661 57.651 3.649 5.310 1.00 0.00 H ATOM 1567 N LEU A 662 56.841 6.109 6.997 1.00 43.63 N ATOM 1568 CA LEU A 662 56.084 7.203 7.603 1.00 44.71 C ATOM 1569 C LEU A 662 56.912 8.507 7.694 1.00 33.63 C ATOM 1570 O LEU A 662 56.814 9.237 8.658 1.00 35.54 O ATOM 1571 CB LEU A 662 55.461 6.784 8.948 1.00 41.61 C ATOM 1572 CG LEU A 662 53.924 7.012 8.966 1.00 53.34 C ATOM 1573 CD1 LEU A 662 53.243 6.351 10.143 1.00 60.07 C ATOM 1574 CD2 LEU A 662 53.578 8.491 8.987 1.00 56.19 C ATOM 1575 H LEU A 662 56.519 5.670 6.111 1.00 0.00 H ATOM 1576 N VAL A 663 57.688 8.787 6.646 1.00 31.64 N ATOM 1577 CA VAL A 663 58.372 10.074 6.519 1.00 33.61 C ATOM 1578 C VAL A 663 57.387 11.072 5.867 1.00 33.01 C ATOM 1579 O VAL A 663 56.746 10.790 4.815 1.00 31.48 O ATOM 1580 CB VAL A 663 59.708 9.996 5.788 1.00 37.17 C ATOM 1581 CG1 VAL A 663 59.534 9.689 4.370 1.00 47.56 C ATOM 1582 CG2 VAL A 663 60.442 11.340 5.816 1.00 40.06 C ATOM 1583 H VAL A 663 57.810 8.072 5.900 1.00 0.00 H ATOM 1584 N VAL A 664 57.188 12.186 6.537 1.00 30.61 N ATOM 1585 CA VAL A 664 56.261 13.219 6.101 1.00 28.19 C ATOM 1586 C VAL A 664 57.101 14.428 5.699 1.00 32.25 C ATOM 1587 O VAL A 664 58.068 14.832 6.425 1.00 29.83 O ATOM 1588 CB VAL A 664 55.257 13.533 7.193 1.00 29.61 C ATOM 1589 CG1 VAL A 664 54.241 14.574 6.725 1.00 33.19 C ATOM 1590 CG2 VAL A 664 54.518 12.261 7.678 1.00 31.93 C ATOM 1591 H VAL A 664 57.718 12.335 7.419 1.00 0.00 H ATOM 1592 N LYS A 665 56.823 14.896 4.465 1.00 29.56 N ATOM 1593 CA LYS A 665 57.495 16.074 3.881 1.00 30.18 C ATOM 1594 C LYS A 665 56.495 17.017 3.233 1.00 26.93 C ATOM 1595 O LYS A 665 55.395 16.604 2.832 1.00 29.92 O ATOM 1596 CB LYS A 665 58.456 15.620 2.827 1.00 32.62 C ATOM 1597 CG LYS A 665 59.412 14.533 3.325 1.00 31.12 C ATOM 1598 CD LYS A 665 60.496 14.333 2.330 1.00 31.78 C ATOM 1599 CE LYS A 665 61.173 12.963 2.571 1.00 32.81 C ATOM 1600 NZ LYS A 665 62.566 13.249 2.227 1.00 34.38 N ATOM 1601 HZ1 LYS A 665 62.620 13.563 1.237 1.00 0.00 H ATOM 1602 HZ2 LYS A 665 62.929 13.999 2.850 1.00 0.00 H ATOM 1603 HZ3 LYS A 665 63.136 12.388 2.351 1.00 0.00 H ATOM 1604 H LYS A 665 56.102 14.405 3.899 1.00 0.00 H ATOM 1605 N ILE A 666 56.846 18.269 3.196 1.00 26.80 N ATOM 1606 CA ILE A 666 55.994 19.322 2.571 1.00 28.60 C ATOM 1607 C ILE A 666 56.235 19.274 1.017 1.00 30.45 C ATOM 1608 O ILE A 666 57.366 19.285 0.585 1.00 35.57 O ATOM 1609 CB ILE A 666 56.318 20.727 3.099 1.00 28.81 C ATOM 1610 CG1 ILE A 666 55.963 20.790 4.612 1.00 29.14 C ATOM 1611 CG2 ILE A 666 55.425 21.757 2.398 1.00 29.41 C ATOM 1612 CD1 ILE A 666 56.594 21.978 5.227 1.00 35.03 C ATOM 1613 H ILE A 666 57.755 18.546 3.618 1.00 0.00 H ATOM 1614 N GLY A 667 55.163 19.107 0.260 1.00 27.16 N ATOM 1615 CA GLY A 667 55.231 19.154 -1.182 1.00 32.50 C ATOM 1616 C GLY A 667 53.959 18.771 -1.877 1.00 30.07 C ATOM 1617 O GLY A 667 53.075 18.144 -1.286 1.00 26.93 O ATOM 1618 H GLY A 667 54.244 18.937 0.717 1.00 0.00 H ATOM 1619 N ASP A 668 53.822 19.264 -3.114 1.00 31.44 N ATOM 1620 CA ASP A 668 52.655 18.982 -3.904 1.00 30.43 C ATOM 1621 C ASP A 668 53.035 19.180 -5.414 1.00 31.05 C ATOM 1622 O ASP A 668 54.052 19.862 -5.724 1.00 27.75 O ATOM 1623 CB ASP A 668 51.529 19.926 -3.450 1.00 32.14 C ATOM 1624 CG ASP A 668 51.765 21.325 -3.874 1.00 33.74 C ATOM 1625 OD1 ASP A 668 52.490 22.067 -3.110 1.00 29.68 O ATOM 1626 OD2 ASP A 668 51.313 21.652 -5.030 1.00 33.27 O ATOM 1627 H ASP A 668 54.574 19.862 -3.511 1.00 0.00 H ATOM 1628 N PHE A 669 52.238 18.588 -6.290 1.00 30.73 N ATOM 1629 CA PHE A 669 52.500 18.689 -7.730 1.00 35.90 C ATOM 1630 C PHE A 669 51.656 19.739 -8.459 1.00 40.14 C ATOM 1631 O PHE A 669 51.540 19.703 -9.685 1.00 38.43 O ATOM 1632 CB PHE A 669 52.350 17.318 -8.379 1.00 33.29 C ATOM 1633 CG PHE A 669 53.370 16.325 -7.906 1.00 33.19 C ATOM 1634 CD1 PHE A 669 54.624 16.288 -8.447 1.00 36.03 C ATOM 1635 CD2 PHE A 669 53.078 15.469 -6.871 1.00 34.84 C ATOM 1636 CE1 PHE A 669 55.583 15.401 -8.002 1.00 37.61 C ATOM 1637 CE2 PHE A 669 54.019 14.568 -6.395 1.00 34.11 C ATOM 1638 CZ PHE A 669 55.273 14.515 -6.961 1.00 37.15 C ATOM 1639 H PHE A 669 51.417 18.045 -5.954 1.00 0.00 H ATOM 1640 N GLY A 670 51.082 20.663 -7.712 1.00 36.09 N ATOM 1641 CA GLY A 670 50.379 21.783 -8.269 1.00 33.53 C ATOM 1642 C GLY A 670 48.993 21.492 -8.740 1.00 37.67 C ATOM 1643 O GLY A 670 48.533 22.178 -9.621 1.00 37.71 O ATOM 1644 H GLY A 670 51.142 20.576 -6.677 1.00 0.00 H ATOM 1645 N MET A 671 48.304 20.537 -8.142 1.00 35.25 N ATOM 1646 CA MET A 671 46.989 20.086 -8.579 1.00 35.28 C ATOM 1647 C MET A 671 45.990 20.014 -7.412 1.00 34.30 C ATOM 1648 O MET A 671 44.917 19.327 -7.501 1.00 34.78 O ATOM 1649 CB MET A 671 47.094 18.647 -9.147 1.00 46.28 C ATOM 1650 CG MET A 671 48.137 18.420 -10.264 1.00 59.26 C ATOM 1651 SD MET A 671 48.506 16.637 -10.594 1.00 65.63 S ATOM 1652 CE MET A 671 48.731 15.946 -8.960 1.00 79.53 C ATOM 1653 H MET A 671 48.725 20.079 -7.309 1.00 0.00 H ATOM 1654 N SER A 672 46.344 20.607 -6.286 1.00 33.12 N ATOM 1655 CA SER A 672 45.440 20.498 -5.126 1.00 39.14 C ATOM 1656 C SER A 672 44.099 21.171 -5.363 1.00 36.19 C ATOM 1657 O SER A 672 43.079 20.651 -4.931 1.00 36.37 O ATOM 1658 CB SER A 672 46.094 21.017 -3.853 1.00 38.00 C ATOM 1659 OG SER A 672 47.255 20.232 -3.546 1.00 36.71 O ATOM 1660 HG SER A 672 47.674 20.575 -2.718 1.00 0.00 H ATOM 1661 H SER A 672 47.237 21.137 -6.219 1.00 0.00 H ATOM 1662 N ARG A 673 44.090 22.265 -6.122 1.00 37.17 N ATOM 1663 CA ARG A 673 42.813 22.873 -6.513 1.00 40.24 C ATOM 1664 C ARG A 673 41.962 21.977 -7.425 1.00 38.59 C ATOM 1665 O ARG A 673 40.785 22.101 -7.389 1.00 42.72 O ATOM 1666 CB ARG A 673 43.005 24.271 -7.101 1.00 36.89 C ATOM 1667 CG ARG A 673 43.449 25.289 -6.047 1.00 40.07 C ATOM 1668 CD ARG A 673 44.135 26.459 -6.735 1.00 37.61 C ATOM 1669 NE ARG A 673 44.512 27.498 -5.779 1.00 36.48 N ATOM 1670 CZ ARG A 673 45.638 27.514 -5.088 1.00 36.17 C ATOM 1671 NH1 ARG A 673 46.522 26.512 -5.171 1.00 39.49 N ATOM 1672 NH2 ARG A 673 45.872 28.502 -4.276 1.00 36.79 N ATOM 1673 HE ARG A 673 43.845 28.282 -5.632 1.00 0.00 H ATOM 1674 HH12 ARG A 673 47.402 26.547 -4.617 1.00 0.00 H ATOM 1675 HH11 ARG A 673 46.329 25.698 -5.789 1.00 0.00 H ATOM 1676 HH22 ARG A 673 46.755 28.526 -3.727 1.00 0.00 H ATOM 1677 HH21 ARG A 673 45.176 29.269 -4.176 1.00 0.00 H ATOM 1678 H ARG A 673 44.986 22.688 -6.437 1.00 0.00 H ATOM 1679 N ASP A 674 42.536 21.051 -8.181 1.00 38.80 N ATOM 1680 CA ASP A 674 41.723 20.086 -8.997 1.00 38.22 C ATOM 1681 C ASP A 674 41.285 18.905 -8.179 1.00 42.58 C ATOM 1682 O ASP A 674 40.158 18.545 -8.197 1.00 44.86 O ATOM 1683 CB ASP A 674 42.521 19.593 -10.209 1.00 43.86 C ATOM 1684 CG ASP A 674 43.068 20.748 -11.079 1.00 57.16 C ATOM 1685 OD1 ASP A 674 42.260 21.495 -11.647 1.00 64.63 O ATOM 1686 OD2 ASP A 674 44.305 20.949 -11.152 1.00 66.18 O ATOM 1687 H ASP A 674 43.574 20.991 -8.210 1.00 0.00 H ATOM 1688 N ILE A 675 42.186 18.356 -7.365 1.00 42.27 N ATOM 1689 CA ILE A 675 41.863 17.205 -6.604 1.00 38.41 C ATOM 1690 C ILE A 675 41.019 17.536 -5.376 1.00 35.54 C ATOM 1691 O ILE A 675 40.226 16.734 -5.013 1.00 35.66 O ATOM 1692 CB ILE A 675 43.162 16.454 -6.165 1.00 42.28 C ATOM 1693 CG1 ILE A 675 43.960 16.014 -7.364 1.00 45.43 C ATOM 1694 CG2 ILE A 675 42.834 15.230 -5.329 1.00 43.09 C ATOM 1695 CD1 ILE A 675 45.417 15.850 -6.976 1.00 55.42 C ATOM 1696 H ILE A 675 43.134 18.776 -7.288 1.00 0.00 H ATOM 1697 N TYR A 676 41.243 18.653 -4.683 1.00 33.61 N ATOM 1698 CA TYR A 676 40.531 18.961 -3.443 1.00 35.32 C ATOM 1699 C TYR A 676 39.874 20.324 -3.559 1.00 36.88 C ATOM 1700 O TYR A 676 40.109 21.249 -2.769 1.00 36.86 O ATOM 1701 CB TYR A 676 41.550 18.994 -2.284 1.00 40.27 C ATOM 1702 CG TYR A 676 42.089 17.638 -1.861 1.00 35.33 C ATOM 1703 CD1 TYR A 676 41.348 16.828 -1.078 1.00 36.58 C ATOM 1704 CD2 TYR A 676 43.372 17.224 -2.240 1.00 35.88 C ATOM 1705 CE1 TYR A 676 41.828 15.579 -0.671 1.00 38.85 C ATOM 1706 CE2 TYR A 676 43.875 15.976 -1.852 1.00 38.50 C ATOM 1707 CZ TYR A 676 43.085 15.161 -1.059 1.00 36.01 C ATOM 1708 OH TYR A 676 43.518 13.929 -0.662 1.00 38.54 O ATOM 1709 HH TYR A 676 44.350 14.027 -0.134 1.00 0.00 H ATOM 1710 H TYR A 676 41.949 19.329 -5.037 1.00 0.00 H ATOM 1711 N SER A 677 39.058 20.476 -4.577 1.00 37.84 N ATOM 1712 CA SER A 677 38.530 21.790 -4.954 1.00 41.77 C ATOM 1713 C SER A 677 37.543 22.256 -3.893 1.00 39.64 C ATOM 1714 O SER A 677 37.453 23.449 -3.606 1.00 42.90 O ATOM 1715 CB SER A 677 37.921 21.722 -6.382 1.00 43.12 C ATOM 1716 OG SER A 677 36.797 20.935 -6.257 1.00 47.67 O ATOM 1717 HG SER A 677 36.356 20.849 -7.139 1.00 0.00 H ATOM 1718 H SER A 677 38.779 19.641 -5.131 1.00 0.00 H ATOM 1719 N THR A 678 36.898 21.300 -3.223 1.00 38.89 N ATOM 1720 CA THR A 678 36.102 21.580 -2.054 1.00 40.20 C ATOM 1721 C THR A 678 36.900 22.283 -0.907 1.00 40.94 C ATOM 1722 O THR A 678 36.332 22.939 -0.109 1.00 37.54 O ATOM 1723 CB THR A 678 35.428 20.277 -1.533 1.00 46.18 C ATOM 1724 OG1 THR A 678 34.508 20.620 -0.520 1.00 55.28 O ATOM 1725 CG2 THR A 678 36.426 19.328 -0.873 1.00 44.82 C ATOM 1726 HG1 THR A 678 34.987 21.071 0.220 1.00 0.00 H ATOM 1727 H THR A 678 36.972 20.317 -3.556 1.00 0.00 H ATOM 1728 N ASP A 679 38.225 22.223 -0.839 1.00 39.66 N ATOM 1729 CA ASP A 679 38.917 22.997 0.192 1.00 39.00 C ATOM 1730 C ASP A 679 39.232 24.422 -0.192 1.00 39.38 C ATOM 1731 O ASP A 679 40.032 25.077 0.478 1.00 36.66 O ATOM 1732 CB ASP A 679 40.227 22.291 0.521 1.00 44.16 C ATOM 1733 CG ASP A 679 40.022 20.951 1.276 1.00 42.86 C ATOM 1734 OD1 ASP A 679 38.947 20.743 1.908 1.00 37.62 O ATOM 1735 OD2 ASP A 679 40.996 20.188 1.261 1.00 35.79 O ATOM 1736 H ASP A 679 38.762 21.635 -1.508 1.00 0.00 H ATOM 1737 N TYR A 680 38.700 24.874 -1.313 1.00 38.33 N ATOM 1738 CA TYR A 680 38.977 26.232 -1.802 1.00 39.67 C ATOM 1739 C TYR A 680 37.678 26.994 -2.023 1.00 40.19 C ATOM 1740 O TYR A 680 36.579 26.405 -2.237 1.00 38.82 O ATOM 1741 CB TYR A 680 39.745 26.176 -3.115 1.00 40.84 C ATOM 1742 CG TYR A 680 41.127 25.572 -2.915 1.00 42.05 C ATOM 1743 CD1 TYR A 680 41.298 24.186 -2.923 1.00 33.26 C ATOM 1744 CD2 TYR A 680 42.231 26.389 -2.651 1.00 36.25 C ATOM 1745 CE1 TYR A 680 42.555 23.628 -2.709 1.00 36.52 C ATOM 1746 CE2 TYR A 680 43.468 25.841 -2.410 1.00 33.70 C ATOM 1747 CZ TYR A 680 43.644 24.459 -2.490 1.00 35.53 C ATOM 1748 OH TYR A 680 44.881 23.912 -2.244 1.00 28.83 O ATOM 1749 HH TYR A 680 45.163 24.139 -1.323 1.00 0.00 H ATOM 1750 H TYR A 680 38.071 24.255 -1.862 1.00 0.00 H ATOM 1751 N TYR A 681 37.771 28.289 -1.872 1.00 41.13 N ATOM 1752 CA TYR A 681 36.622 29.194 -2.038 1.00 36.78 C ATOM 1753 C TYR A 681 36.916 30.016 -3.296 1.00 38.87 C ATOM 1754 O TYR A 681 37.898 30.767 -3.344 1.00 39.42 O ATOM 1755 CB TYR A 681 36.593 30.103 -0.893 1.00 41.49 C ATOM 1756 CG TYR A 681 35.560 31.232 -0.945 1.00 46.44 C ATOM 1757 CD1 TYR A 681 34.235 30.990 -1.267 1.00 45.09 C ATOM 1758 CD2 TYR A 681 35.931 32.517 -0.599 1.00 45.28 C ATOM 1759 CE1 TYR A 681 33.320 32.015 -1.272 1.00 53.63 C ATOM 1760 CE2 TYR A 681 35.029 33.550 -0.556 1.00 48.94 C ATOM 1761 CZ TYR A 681 33.736 33.298 -0.894 1.00 52.88 C ATOM 1762 OH TYR A 681 32.867 34.330 -0.840 1.00 63.32 O ATOM 1763 HH TYR A 681 31.967 34.016 -1.108 1.00 0.00 H ATOM 1764 H TYR A 681 38.695 28.697 -1.624 1.00 0.00 H ATOM 1765 N ARG A 682 36.072 29.878 -4.297 1.00 42.48 N ATOM 1766 CA ARG A 682 36.252 30.555 -5.561 1.00 52.09 C ATOM 1767 C ARG A 682 35.639 31.925 -5.457 1.00 55.85 C ATOM 1768 O ARG A 682 34.441 32.048 -5.292 1.00 62.23 O ATOM 1769 CB ARG A 682 35.622 29.770 -6.712 1.00 62.04 C ATOM 1770 CG ARG A 682 36.092 30.324 -8.073 1.00 85.28 C ATOM 1771 CD ARG A 682 35.386 29.726 -9.294 1.00 90.99 C ATOM 1772 NE ARG A 682 36.058 28.523 -9.775 1.00 89.07 N ATOM 1773 CZ ARG A 682 35.850 27.283 -9.315 1.00100.50 C ATOM 1774 NH1 ARG A 682 34.984 27.017 -8.322 1.00102.75 N ATOM 1775 NH2 ARG A 682 36.526 26.279 -9.857 1.00 87.35 N ATOM 1776 HE ARG A 682 36.756 28.638 -10.538 1.00 0.00 H ATOM 1777 HH12 ARG A 682 34.853 26.039 -7.995 1.00 0.00 H ATOM 1778 HH11 ARG A 682 34.445 27.790 -7.881 1.00 0.00 H ATOM 1779 HH22 ARG A 682 36.379 25.308 -9.514 1.00 0.00 H ATOM 1780 HH21 ARG A 682 37.203 26.462 -10.625 1.00 0.00 H ATOM 1781 H ARG A 682 35.245 29.259 -4.174 1.00 0.00 H ATOM 1782 N VAL A 683 36.479 32.935 -5.500 1.00 54.17 N ATOM 1783 CA VAL A 683 36.045 34.316 -5.500 1.00 67.36 C ATOM 1784 C VAL A 683 36.050 34.864 -6.921 1.00 76.76 C ATOM 1785 O VAL A 683 35.068 35.423 -7.341 1.00 94.31 O ATOM 1786 CB VAL A 683 36.857 35.185 -4.512 1.00 73.61 C ATOM 1787 CG1 VAL A 683 36.841 34.513 -3.155 1.00 80.69 C ATOM 1788 CG2 VAL A 683 38.296 35.417 -4.949 1.00 74.93 C ATOM 1789 H VAL A 683 37.499 32.733 -5.536 1.00 0.00 H ATOM 1790 N GLY A 684 37.099 34.624 -7.698 1.00 85.19 N ATOM 1791 CA GLY A 684 37.185 35.201 -9.022 1.00 89.80 C ATOM 1792 C GLY A 684 36.402 34.364 -9.984 1.00 89.04 C ATOM 1793 O GLY A 684 35.634 33.485 -9.605 1.00 96.47 O ATOM 1794 H GLY A 684 37.867 34.015 -7.351 1.00 0.00 H ATOM 1795 N GLY A 685 36.599 34.648 -11.251 1.00 89.45 N ATOM 1796 CA GLY A 685 36.316 33.662 -12.258 1.00 93.00 C ATOM 1797 C GLY A 685 37.270 32.494 -12.055 1.00 92.29 C ATOM 1798 O GLY A 685 36.840 31.366 -12.160 1.00 96.96 O ATOM 1799 H GLY A 685 36.959 35.584 -11.525 1.00 0.00 H ATOM 1800 N ARG A 686 38.556 32.746 -11.765 1.00 84.51 N ATOM 1801 CA ARG A 686 39.507 31.623 -11.533 1.00 91.10 C ATOM 1802 C ARG A 686 40.235 31.524 -10.145 1.00 77.75 C ATOM 1803 O ARG A 686 40.834 30.492 -9.878 1.00 79.34 O ATOM 1804 CB ARG A 686 40.515 31.494 -12.698 1.00 93.58 C ATOM 1805 CG ARG A 686 41.560 32.587 -12.761 1.00100.24 C ATOM 1806 CD ARG A 686 42.365 32.556 -14.056 1.00103.78 C ATOM 1807 NE ARG A 686 43.131 33.803 -14.186 1.00114.12 N ATOM 1808 CZ ARG A 686 43.998 34.095 -15.158 1.00117.82 C ATOM 1809 NH1 ARG A 686 44.252 33.230 -16.143 1.00114.99 N ATOM 1810 NH2 ARG A 686 44.626 35.274 -15.143 1.00120.09 N ATOM 1811 HE ARG A 686 42.984 34.525 -13.452 1.00 0.00 H ATOM 1812 HH12 ARG A 686 44.931 33.478 -16.890 1.00 0.00 H ATOM 1813 HH11 ARG A 686 43.771 32.308 -16.163 1.00 0.00 H ATOM 1814 HH22 ARG A 686 45.304 35.512 -15.895 1.00 0.00 H ATOM 1815 HH21 ARG A 686 44.437 35.954 -14.379 1.00 0.00 H ATOM 1816 H ARG A 686 38.890 33.729 -11.702 1.00 0.00 H ATOM 1817 N THR A 687 40.149 32.543 -9.284 1.00 59.45 N ATOM 1818 CA THR A 687 40.795 32.533 -7.989 1.00 58.38 C ATOM 1819 C THR A 687 40.135 31.556 -6.998 1.00 58.07 C ATOM 1820 O THR A 687 38.925 31.564 -6.793 1.00 53.79 O ATOM 1821 CB THR A 687 40.787 33.907 -7.337 1.00 60.27 C ATOM 1822 OG1 THR A 687 41.530 34.796 -8.153 1.00 59.37 O ATOM 1823 CG2 THR A 687 41.469 33.885 -5.997 1.00 64.52 C ATOM 1824 HG1 THR A 687 41.534 35.696 -7.740 1.00 0.00 H ATOM 1825 H THR A 687 39.594 33.379 -9.557 1.00 0.00 H ATOM 1826 N MET A 688 40.981 30.730 -6.399 1.00 47.73 N ATOM 1827 CA MET A 688 40.596 29.717 -5.424 1.00 43.22 C ATOM 1828 C MET A 688 41.453 29.844 -4.184 1.00 40.15 C ATOM 1829 O MET A 688 42.674 29.608 -4.233 1.00 39.56 O ATOM 1830 CB MET A 688 40.764 28.399 -6.085 1.00 45.24 C ATOM 1831 CG MET A 688 39.550 28.159 -6.945 1.00 51.45 C ATOM 1832 SD MET A 688 39.929 26.678 -7.807 1.00 55.26 S ATOM 1833 CE MET A 688 39.034 25.449 -6.806 1.00 44.41 C ATOM 1834 H MET A 688 41.989 30.810 -6.641 1.00 0.00 H ATOM 1835 N LEU A 689 40.808 30.245 -3.086 1.00 37.45 N ATOM 1836 CA LEU A 689 41.488 30.583 -1.875 1.00 38.78 C ATOM 1837 C LEU A 689 41.246 29.489 -0.837 1.00 37.77 C ATOM 1838 O LEU A 689 40.104 29.070 -0.629 1.00 36.80 O ATOM 1839 CB LEU A 689 40.978 31.922 -1.342 1.00 45.07 C ATOM 1840 CG LEU A 689 41.066 33.142 -2.327 1.00 45.71 C ATOM 1841 CD1 LEU A 689 40.659 34.408 -1.642 1.00 44.73 C ATOM 1842 CD2 LEU A 689 42.435 33.366 -2.913 1.00 45.39 C ATOM 1843 H LEU A 689 39.771 30.314 -3.113 1.00 0.00 H ATOM 1844 N PRO A 690 42.320 29.032 -0.156 1.00 37.42 N ATOM 1845 CA PRO A 690 42.138 28.062 0.935 1.00 34.09 C ATOM 1846 C PRO A 690 41.659 28.770 2.257 1.00 37.45 C ATOM 1847 O PRO A 690 42.371 28.704 3.287 1.00 33.01 O ATOM 1848 CB PRO A 690 43.543 27.459 1.062 1.00 32.55 C ATOM 1849 CG PRO A 690 44.482 28.621 0.748 1.00 37.23 C ATOM 1850 CD PRO A 690 43.744 29.466 -0.289 1.00 35.47 C ATOM 1851 N ILE A 691 40.461 29.384 2.242 1.00 36.62 N ATOM 1852 CA ILE A 691 40.077 30.273 3.308 1.00 34.73 C ATOM 1853 C ILE A 691 40.017 29.568 4.633 1.00 35.84 C ATOM 1854 O ILE A 691 40.391 30.152 5.630 1.00 33.17 O ATOM 1855 CB ILE A 691 38.758 31.111 3.100 1.00 41.65 C ATOM 1856 CG1 ILE A 691 37.565 30.206 2.879 1.00 43.71 C ATOM 1857 CG2 ILE A 691 38.916 32.316 2.094 1.00 38.19 C ATOM 1858 CD1 ILE A 691 36.789 30.020 4.194 1.00 47.66 C ATOM 1859 H ILE A 691 39.806 29.215 1.452 1.00 0.00 H ATOM 1860 N ARG A 692 39.617 28.308 4.670 1.00 34.21 N ATOM 1861 CA ARG A 692 39.597 27.614 6.005 1.00 38.28 C ATOM 1862 C ARG A 692 40.944 27.426 6.732 1.00 35.41 C ATOM 1863 O ARG A 692 40.945 27.253 7.972 1.00 33.25 O ATOM 1864 CB ARG A 692 38.973 26.240 5.914 1.00 35.77 C ATOM 1865 CG ARG A 692 37.540 26.266 5.390 1.00 34.34 C ATOM 1866 CD ARG A 692 37.124 24.905 4.873 1.00 33.63 C ATOM 1867 NE ARG A 692 35.862 25.078 4.190 1.00 37.46 N ATOM 1868 CZ ARG A 692 34.639 24.975 4.717 1.00 38.82 C ATOM 1869 NH1 ARG A 692 34.417 24.657 6.018 1.00 37.84 N ATOM 1870 NH2 ARG A 692 33.594 25.272 3.928 1.00 38.83 N ATOM 1871 HE ARG A 692 35.912 25.308 3.177 1.00 0.00 H ATOM 1872 HH12 ARG A 692 33.444 24.590 6.378 1.00 0.00 H ATOM 1873 HH11 ARG A 692 35.220 24.481 6.655 1.00 0.00 H ATOM 1874 HH22 ARG A 692 32.625 25.204 4.301 1.00 0.00 H ATOM 1875 HH21 ARG A 692 33.753 25.570 2.944 1.00 0.00 H ATOM 1876 H ARG A 692 39.325 27.812 3.803 1.00 0.00 H ATOM 1877 N TRP A 693 42.058 27.543 5.996 1.00 30.49 N ATOM 1878 CA TRP A 693 43.413 27.513 6.566 1.00 32.89 C ATOM 1879 C TRP A 693 44.031 28.923 6.796 1.00 32.30 C ATOM 1880 O TRP A 693 45.176 29.069 7.248 1.00 31.60 O ATOM 1881 CB TRP A 693 44.335 26.674 5.647 1.00 34.49 C ATOM 1882 CG TRP A 693 44.043 25.220 5.715 1.00 30.89 C ATOM 1883 CD1 TRP A 693 44.759 24.332 6.392 1.00 30.72 C ATOM 1884 CD2 TRP A 693 42.988 24.481 5.077 1.00 33.58 C ATOM 1885 NE1 TRP A 693 44.240 23.098 6.297 1.00 30.79 N ATOM 1886 CE2 TRP A 693 43.144 23.132 5.494 1.00 31.77 C ATOM 1887 CE3 TRP A 693 41.932 24.819 4.201 1.00 32.39 C ATOM 1888 CZ2 TRP A 693 42.262 22.120 5.132 1.00 33.20 C ATOM 1889 CZ3 TRP A 693 41.067 23.838 3.813 1.00 32.82 C ATOM 1890 CH2 TRP A 693 41.207 22.490 4.297 1.00 34.81 C ATOM 1891 HE1 TRP A 693 44.617 22.249 6.764 1.00 0.00 H ATOM 1892 H TRP A 693 41.959 27.661 4.968 1.00 0.00 H ATOM 1893 N MET A 694 43.304 29.969 6.430 1.00 32.73 N ATOM 1894 CA MET A 694 43.896 31.353 6.386 1.00 33.06 C ATOM 1895 C MET A 694 43.472 32.173 7.618 1.00 35.08 C ATOM 1896 O MET A 694 42.324 32.008 8.079 1.00 37.54 O ATOM 1897 CB MET A 694 43.402 32.044 5.132 1.00 35.66 C ATOM 1898 CG MET A 694 44.120 31.549 3.883 1.00 32.08 C ATOM 1899 SD MET A 694 43.242 31.883 2.359 1.00 35.75 S ATOM 1900 CE MET A 694 43.647 33.600 2.255 1.00 40.81 C ATOM 1901 H MET A 694 42.307 29.832 6.169 1.00 0.00 H ATOM 1902 N PRO A 695 44.387 32.947 8.180 1.00 34.30 N ATOM 1903 CA PRO A 695 44.056 33.905 9.231 1.00 39.56 C ATOM 1904 C PRO A 695 43.346 35.177 8.650 1.00 43.70 C ATOM 1905 O PRO A 695 43.357 35.416 7.407 1.00 39.14 O ATOM 1906 CB PRO A 695 45.421 34.280 9.795 1.00 36.23 C ATOM 1907 CG PRO A 695 46.295 34.266 8.606 1.00 35.60 C ATOM 1908 CD PRO A 695 45.797 33.101 7.760 1.00 34.88 C ATOM 1909 N PRO A 696 42.741 35.996 9.538 1.00 43.80 N ATOM 1910 CA PRO A 696 41.948 37.159 9.024 1.00 39.57 C ATOM 1911 C PRO A 696 42.794 38.098 8.161 1.00 34.88 C ATOM 1912 O PRO A 696 42.329 38.559 7.062 1.00 38.86 O ATOM 1913 CB PRO A 696 41.415 37.865 10.323 1.00 38.88 C ATOM 1914 CG PRO A 696 41.711 36.922 11.462 1.00 45.45 C ATOM 1915 CD PRO A 696 42.800 35.948 11.019 1.00 43.41 C ATOM 1916 N GLU A 697 44.052 38.334 8.551 1.00 37.53 N ATOM 1917 CA GLU A 697 44.836 39.278 7.762 1.00 39.56 C ATOM 1918 C GLU A 697 45.114 38.791 6.336 1.00 46.45 C ATOM 1919 O GLU A 697 45.331 39.612 5.416 1.00 43.36 O ATOM 1920 CB GLU A 697 46.122 39.705 8.457 1.00 39.14 C ATOM 1921 CG GLU A 697 47.326 38.756 8.332 1.00 41.81 C ATOM 1922 CD GLU A 697 47.347 37.651 9.360 1.00 42.95 C ATOM 1923 OE1 GLU A 697 46.325 37.473 10.058 1.00 39.09 O ATOM 1924 OE2 GLU A 697 48.404 36.993 9.517 1.00 41.40 O ATOM 1925 H GLU A 697 44.456 37.862 9.385 1.00 0.00 H ATOM 1926 N SER A 698 45.132 37.465 6.144 1.00 41.46 N ATOM 1927 CA SER A 698 45.417 36.928 4.801 1.00 40.07 C ATOM 1928 C SER A 698 44.151 36.952 4.014 1.00 38.00 C ATOM 1929 O SER A 698 44.140 37.201 2.782 1.00 38.74 O ATOM 1930 CB SER A 698 45.976 35.479 4.896 1.00 37.75 C ATOM 1931 OG SER A 698 47.236 35.492 5.574 1.00 35.04 O ATOM 1932 HG SER A 698 47.874 36.058 5.072 1.00 0.00 H ATOM 1933 H SER A 698 44.946 36.819 6.937 1.00 0.00 H ATOM 1934 N ILE A 699 43.049 36.648 4.679 1.00 34.89 N ATOM 1935 CA ILE A 699 41.759 36.665 3.969 1.00 40.85 C ATOM 1936 C ILE A 699 41.374 38.101 3.504 1.00 44.32 C ATOM 1937 O ILE A 699 40.952 38.293 2.365 1.00 40.66 O ATOM 1938 CB ILE A 699 40.612 36.137 4.817 1.00 40.18 C ATOM 1939 CG1 ILE A 699 40.902 34.681 5.225 1.00 38.02 C ATOM 1940 CG2 ILE A 699 39.287 36.337 4.054 1.00 41.25 C ATOM 1941 CD1 ILE A 699 39.853 34.049 6.113 1.00 36.33 C ATOM 1942 H ILE A 699 43.093 36.401 5.688 1.00 0.00 H ATOM 1943 N LEU A 700 41.549 39.071 4.393 1.00 44.68 N ATOM 1944 CA LEU A 700 41.086 40.433 4.122 1.00 47.66 C ATOM 1945 C LEU A 700 42.070 41.296 3.335 1.00 46.41 C ATOM 1946 O LEU A 700 41.629 42.032 2.473 1.00 46.83 O ATOM 1947 CB LEU A 700 40.707 41.156 5.408 1.00 47.49 C ATOM 1948 CG LEU A 700 39.510 40.546 6.109 1.00 46.12 C ATOM 1949 CD1 LEU A 700 39.239 41.328 7.366 1.00 46.58 C ATOM 1950 CD2 LEU A 700 38.311 40.490 5.195 1.00 48.29 C ATOM 1951 H LEU A 700 42.022 38.860 5.295 1.00 0.00 H ATOM 1952 N TYR A 701 43.352 41.263 3.673 1.00 42.65 N ATOM 1953 CA TYR A 701 44.345 42.108 3.032 1.00 39.42 C ATOM 1954 C TYR A 701 45.259 41.364 2.034 1.00 47.04 C ATOM 1955 O TYR A 701 46.123 41.977 1.453 1.00 50.33 O ATOM 1956 CB TYR A 701 45.238 42.697 4.094 1.00 37.77 C ATOM 1957 CG TYR A 701 44.485 43.343 5.215 1.00 43.95 C ATOM 1958 CD1 TYR A 701 43.779 44.549 5.014 1.00 43.71 C ATOM 1959 CD2 TYR A 701 44.490 42.813 6.492 1.00 42.52 C ATOM 1960 CE1 TYR A 701 43.103 45.196 6.062 1.00 47.51 C ATOM 1961 CE2 TYR A 701 43.797 43.457 7.558 1.00 50.82 C ATOM 1962 CZ TYR A 701 43.110 44.663 7.333 1.00 50.53 C ATOM 1963 OH TYR A 701 42.424 45.281 8.341 1.00 44.02 O ATOM 1964 HH TYR A 701 42.008 46.110 7.996 1.00 0.00 H ATOM 1965 H TYR A 701 43.657 40.610 4.423 1.00 0.00 H ATOM 1966 N ARG A 702 45.126 40.041 1.883 1.00 48.95 N ATOM 1967 CA ARG A 702 46.092 39.247 1.126 1.00 45.53 C ATOM 1968 C ARG A 702 47.508 39.454 1.708 1.00 42.54 C ATOM 1969 O ARG A 702 48.447 39.505 0.975 1.00 40.20 O ATOM 1970 CB ARG A 702 45.939 39.539 -0.398 1.00 43.05 C ATOM 1971 H ARG A 702 44.311 39.563 2.317 1.00 0.00 H ATOM 1972 N LYS A 703 47.675 39.617 3.037 1.00 41.69 N ATOM 1973 CA LYS A 703 49.047 39.666 3.623 1.00 40.80 C ATOM 1974 C LYS A 703 49.468 38.243 4.024 1.00 42.16 C ATOM 1975 O LYS A 703 48.696 37.537 4.721 1.00 44.61 O ATOM 1976 CB LYS A 703 49.179 40.570 4.874 1.00 44.44 C ATOM 1977 H LYS A 703 46.844 39.709 3.656 1.00 0.00 H ATOM 1978 N PHE A 704 50.712 37.871 3.669 1.00 39.81 N ATOM 1979 CA PHE A 704 51.242 36.518 3.882 1.00 37.92 C ATOM 1980 C PHE A 704 52.597 36.628 4.465 1.00 39.43 C ATOM 1981 O PHE A 704 53.438 37.212 3.872 1.00 41.67 O ATOM 1982 CB PHE A 704 51.309 35.758 2.588 1.00 36.10 C ATOM 1983 CG PHE A 704 49.979 35.487 2.010 1.00 38.18 C ATOM 1984 CD1 PHE A 704 49.200 34.447 2.529 1.00 34.02 C ATOM 1985 CD2 PHE A 704 49.463 36.296 0.997 1.00 35.60 C ATOM 1986 CE1 PHE A 704 47.919 34.181 2.002 1.00 42.11 C ATOM 1987 CE2 PHE A 704 48.168 36.070 0.489 1.00 37.97 C ATOM 1988 CZ PHE A 704 47.388 35.016 0.972 1.00 38.07 C ATOM 1989 H PHE A 704 51.329 38.578 3.221 1.00 0.00 H ATOM 1990 N THR A 705 52.812 36.056 5.644 1.00 38.32 N ATOM 1991 CA THR A 705 54.100 36.109 6.288 1.00 35.93 C ATOM 1992 C THR A 705 54.393 34.723 6.886 1.00 35.21 C ATOM 1993 O THR A 705 53.542 33.765 6.799 1.00 32.86 O ATOM 1994 CB THR A 705 53.997 37.114 7.420 1.00 37.55 C ATOM 1995 OG1 THR A 705 52.931 36.651 8.270 1.00 36.39 O ATOM 1996 CG2 THR A 705 53.661 38.560 6.892 1.00 34.97 C ATOM 1997 HG1 THR A 705 52.089 36.611 7.750 1.00 0.00 H ATOM 1998 H THR A 705 52.030 35.557 6.115 1.00 0.00 H ATOM 1999 N THR A 706 55.537 34.634 7.551 1.00 35.00 N ATOM 2000 CA THR A 706 55.793 33.442 8.350 1.00 45.15 C ATOM 2001 C THR A 706 54.688 33.216 9.393 1.00 43.47 C ATOM 2002 O THR A 706 54.383 32.048 9.793 1.00 38.11 O ATOM 2003 CB THR A 706 57.220 33.458 8.951 1.00 49.66 C ATOM 2004 OG1 THR A 706 57.409 34.677 9.660 1.00 52.08 O ATOM 2005 CG2 THR A 706 58.239 33.378 7.828 1.00 45.58 C ATOM 2006 HG1 THR A 706 56.739 34.742 10.386 1.00 0.00 H ATOM 2007 H THR A 706 56.238 35.400 7.503 1.00 0.00 H ATOM 2008 N GLU A 707 54.037 34.323 9.787 1.00 41.91 N ATOM 2009 CA GLU A 707 53.036 34.265 10.820 1.00 36.37 C ATOM 2010 C GLU A 707 51.700 33.771 10.296 1.00 35.31 C ATOM 2011 O GLU A 707 50.965 33.169 11.069 1.00 36.34 O ATOM 2012 CB GLU A 707 52.798 35.635 11.505 1.00 42.56 C ATOM 2013 CG GLU A 707 53.932 36.114 12.407 1.00 42.97 C ATOM 2014 CD GLU A 707 55.146 36.612 11.646 1.00 47.00 C ATOM 2015 OE1 GLU A 707 55.003 37.278 10.595 1.00 52.28 O ATOM 2016 OE2 GLU A 707 56.255 36.273 12.061 1.00 61.45 O ATOM 2017 H GLU A 707 54.259 35.235 9.339 1.00 0.00 H ATOM 2018 N SER A 708 51.296 34.104 9.055 1.00 37.85 N ATOM 2019 CA SER A 708 50.068 33.510 8.530 1.00 36.60 C ATOM 2020 C SER A 708 50.336 31.998 8.282 1.00 33.68 C ATOM 2021 O SER A 708 49.418 31.142 8.396 1.00 36.08 O ATOM 2022 CB SER A 708 49.595 34.274 7.275 1.00 36.48 C ATOM 2023 OG SER A 708 50.618 34.381 6.301 1.00 35.50 O ATOM 2024 HG SER A 708 51.390 34.867 6.687 1.00 0.00 H ATOM 2025 H SER A 708 51.848 34.772 8.480 1.00 0.00 H ATOM 2026 N ASP A 709 51.568 31.655 7.910 1.00 30.33 N ATOM 2027 CA ASP A 709 51.914 30.216 7.793 1.00 34.43 C ATOM 2028 C ASP A 709 51.794 29.459 9.135 1.00 33.67 C ATOM 2029 O ASP A 709 51.264 28.296 9.178 1.00 31.65 O ATOM 2030 CB ASP A 709 53.299 29.966 7.175 1.00 34.30 C ATOM 2031 CG ASP A 709 53.291 29.849 5.645 1.00 33.86 C ATOM 2032 OD1 ASP A 709 52.203 29.890 4.980 1.00 34.41 O ATOM 2033 OD2 ASP A 709 54.445 29.745 5.124 1.00 32.97 O ATOM 2034 H ASP A 709 52.279 32.386 7.704 1.00 0.00 H ATOM 2035 N VAL A 710 52.185 30.121 10.230 1.00 33.50 N ATOM 2036 CA VAL A 710 52.010 29.520 11.545 1.00 32.19 C ATOM 2037 C VAL A 710 50.546 29.235 11.843 1.00 35.31 C ATOM 2038 O VAL A 710 50.226 28.182 12.412 1.00 38.05 O ATOM 2039 CB VAL A 710 52.775 30.284 12.644 1.00 41.39 C ATOM 2040 CG1 VAL A 710 51.879 30.760 13.778 1.00 48.57 C ATOM 2041 CG2 VAL A 710 53.799 29.392 13.248 1.00 41.65 C ATOM 2042 H VAL A 710 52.614 31.064 10.142 1.00 0.00 H ATOM 2043 N TRP A 711 49.652 30.157 11.443 1.00 32.17 N ATOM 2044 CA TRP A 711 48.237 29.996 11.708 1.00 31.81 C ATOM 2045 C TRP A 711 47.801 28.742 10.961 1.00 33.73 C ATOM 2046 O TRP A 711 47.068 27.906 11.502 1.00 33.74 O ATOM 2047 CB TRP A 711 47.465 31.225 11.200 1.00 34.18 C ATOM 2048 CG TRP A 711 45.957 31.109 11.206 1.00 34.82 C ATOM 2049 CD1 TRP A 711 45.169 30.310 10.408 1.00 33.59 C ATOM 2050 CD2 TRP A 711 45.061 31.819 12.077 1.00 35.90 C ATOM 2051 NE1 TRP A 711 43.826 30.488 10.726 1.00 35.87 N ATOM 2052 CE2 TRP A 711 43.737 31.451 11.710 1.00 37.90 C ATOM 2053 CE3 TRP A 711 45.248 32.821 13.053 1.00 39.24 C ATOM 2054 CZ2 TRP A 711 42.619 31.983 12.345 1.00 35.77 C ATOM 2055 CZ3 TRP A 711 44.118 33.363 13.684 1.00 36.71 C ATOM 2056 CH2 TRP A 711 42.836 32.899 13.364 1.00 34.82 C ATOM 2057 HE1 TRP A 711 43.026 29.982 10.295 1.00 0.00 H ATOM 2058 H TRP A 711 49.983 31.001 10.934 1.00 0.00 H ATOM 2059 N SER A 712 48.217 28.640 9.700 1.00 33.35 N ATOM 2060 CA SER A 712 47.875 27.457 8.880 1.00 34.65 C ATOM 2061 C SER A 712 48.393 26.161 9.527 1.00 31.70 C ATOM 2062 O SER A 712 47.697 25.113 9.489 1.00 32.57 O ATOM 2063 CB SER A 712 48.426 27.557 7.444 1.00 35.33 C ATOM 2064 OG SER A 712 47.841 28.659 6.754 1.00 33.10 O ATOM 2065 HG SER A 712 46.859 28.537 6.712 1.00 0.00 H ATOM 2066 H SER A 712 48.790 29.403 9.286 1.00 0.00 H ATOM 2067 N PHE A 713 49.586 26.227 10.102 1.00 30.43 N ATOM 2068 CA PHE A 713 50.132 25.067 10.755 1.00 30.45 C ATOM 2069 C PHE A 713 49.254 24.638 11.934 1.00 34.28 C ATOM 2070 O PHE A 713 48.986 23.435 12.110 1.00 29.51 O ATOM 2071 CB PHE A 713 51.553 25.278 11.242 1.00 30.37 C ATOM 2072 CG PHE A 713 52.084 24.057 11.878 1.00 33.57 C ATOM 2073 CD1 PHE A 713 52.391 22.919 11.082 1.00 34.06 C ATOM 2074 CD2 PHE A 713 52.070 23.925 13.263 1.00 32.36 C ATOM 2075 CE1 PHE A 713 52.793 21.733 11.706 1.00 34.91 C ATOM 2076 CE2 PHE A 713 52.393 22.710 13.876 1.00 34.19 C ATOM 2077 CZ PHE A 713 52.770 21.622 13.109 1.00 35.66 C ATOM 2078 H PHE A 713 50.126 27.116 10.081 1.00 0.00 H ATOM 2079 N GLY A 714 48.784 25.606 12.722 1.00 34.51 N ATOM 2080 CA GLY A 714 47.730 25.306 13.734 1.00 32.51 C ATOM 2081 C GLY A 714 46.546 24.525 13.148 1.00 34.21 C ATOM 2082 O GLY A 714 46.046 23.531 13.728 1.00 34.64 O ATOM 2083 H GLY A 714 49.154 26.574 12.631 1.00 0.00 H ATOM 2084 N VAL A 715 46.045 24.992 12.013 1.00 33.70 N ATOM 2085 CA VAL A 715 44.960 24.270 11.315 1.00 33.66 C ATOM 2086 C VAL A 715 45.406 22.867 10.842 1.00 28.65 C ATOM 2087 O VAL A 715 44.642 21.902 11.007 1.00 27.34 O ATOM 2088 CB VAL A 715 44.322 25.079 10.174 1.00 33.53 C ATOM 2089 CG1 VAL A 715 43.153 24.291 9.534 1.00 33.61 C ATOM 2090 CG2 VAL A 715 43.844 26.404 10.723 1.00 35.61 C ATOM 2091 H VAL A 715 46.419 25.875 11.610 1.00 0.00 H ATOM 2092 N VAL A 716 46.601 22.750 10.282 1.00 28.00 N ATOM 2093 CA VAL A 716 47.195 21.401 10.010 1.00 30.70 C ATOM 2094 C VAL A 716 47.166 20.440 11.225 1.00 34.09 C ATOM 2095 O VAL A 716 46.786 19.233 11.087 1.00 33.96 O ATOM 2096 CB VAL A 716 48.601 21.486 9.374 1.00 31.77 C ATOM 2097 CG1 VAL A 716 49.365 20.128 9.332 1.00 30.92 C ATOM 2098 CG2 VAL A 716 48.433 21.997 7.948 1.00 35.43 C ATOM 2099 H VAL A 716 47.134 23.606 10.028 1.00 0.00 H ATOM 2100 N LEU A 717 47.586 20.965 12.379 1.00 34.57 N ATOM 2101 CA LEU A 717 47.546 20.217 13.643 1.00 33.71 C ATOM 2102 C LEU A 717 46.157 19.675 13.946 1.00 32.64 C ATOM 2103 O LEU A 717 45.972 18.471 14.281 1.00 31.19 O ATOM 2104 CB LEU A 717 47.994 21.078 14.805 1.00 37.76 C ATOM 2105 CG LEU A 717 49.375 20.982 15.347 1.00 49.64 C ATOM 2106 CD1 LEU A 717 49.443 21.831 16.615 1.00 50.48 C ATOM 2107 CD2 LEU A 717 49.715 19.522 15.638 1.00 49.22 C ATOM 2108 H LEU A 717 47.954 21.938 12.383 1.00 0.00 H ATOM 2109 N TRP A 718 45.162 20.550 13.758 1.00 31.85 N ATOM 2110 CA TRP A 718 43.804 20.174 13.909 1.00 31.56 C ATOM 2111 C TRP A 718 43.425 19.081 12.874 1.00 33.79 C ATOM 2112 O TRP A 718 42.776 18.066 13.217 1.00 34.91 O ATOM 2113 CB TRP A 718 42.945 21.432 13.773 1.00 35.81 C ATOM 2114 CG TRP A 718 41.514 21.205 14.127 1.00 32.94 C ATOM 2115 CD1 TRP A 718 40.939 21.378 15.386 1.00 31.65 C ATOM 2116 CD2 TRP A 718 40.473 20.699 13.267 1.00 33.22 C ATOM 2117 NE1 TRP A 718 39.598 21.012 15.324 1.00 34.03 N ATOM 2118 CE2 TRP A 718 39.286 20.617 14.044 1.00 32.62 C ATOM 2119 CE3 TRP A 718 40.430 20.300 11.928 1.00 35.40 C ATOM 2120 CZ2 TRP A 718 38.083 20.198 13.519 1.00 32.66 C ATOM 2121 CZ3 TRP A 718 39.216 19.846 11.406 1.00 34.19 C ATOM 2122 CH2 TRP A 718 38.057 19.824 12.194 1.00 39.83 C ATOM 2123 HE1 TRP A 718 38.933 21.034 16.123 1.00 0.00 H ATOM 2124 H TRP A 718 45.391 21.530 13.495 1.00 0.00 H ATOM 2125 N GLU A 719 43.796 19.267 11.609 1.00 33.24 N ATOM 2126 CA GLU A 719 43.568 18.186 10.619 1.00 32.34 C ATOM 2127 C GLU A 719 44.256 16.861 11.076 1.00 32.79 C ATOM 2128 O GLU A 719 43.663 15.786 10.930 1.00 31.73 O ATOM 2129 CB GLU A 719 44.139 18.519 9.225 1.00 32.07 C ATOM 2130 CG GLU A 719 43.563 19.706 8.450 1.00 31.75 C ATOM 2131 CD GLU A 719 44.273 19.788 7.136 1.00 28.92 C ATOM 2132 OE1 GLU A 719 43.889 19.048 6.241 1.00 30.11 O ATOM 2133 OE2 GLU A 719 45.275 20.505 7.012 1.00 27.50 O ATOM 2134 H GLU A 719 44.241 20.161 11.318 1.00 0.00 H ATOM 2135 N ILE A 720 45.474 16.918 11.614 1.00 28.79 N ATOM 2136 CA ILE A 720 46.174 15.619 11.967 1.00 30.47 C ATOM 2137 C ILE A 720 45.380 14.918 13.089 1.00 33.55 C ATOM 2138 O ILE A 720 45.011 13.753 12.987 1.00 31.89 O ATOM 2139 CB ILE A 720 47.604 15.898 12.379 1.00 30.78 C ATOM 2140 CG1 ILE A 720 48.425 16.294 11.134 1.00 32.35 C ATOM 2141 CG2 ILE A 720 48.258 14.699 13.105 1.00 35.16 C ATOM 2142 CD1 ILE A 720 49.694 17.068 11.541 1.00 34.99 C ATOM 2143 H ILE A 720 45.935 17.834 11.788 1.00 0.00 H ATOM 2144 N PHE A 721 45.030 15.681 14.127 1.00 34.17 N ATOM 2145 CA PHE A 721 44.289 15.129 15.276 1.00 33.76 C ATOM 2146 C PHE A 721 42.821 14.777 15.114 1.00 33.19 C ATOM 2147 O PHE A 721 42.191 14.215 16.013 1.00 40.50 O ATOM 2148 CB PHE A 721 44.529 16.019 16.469 1.00 32.91 C ATOM 2149 CG PHE A 721 45.867 15.736 17.076 1.00 31.82 C ATOM 2150 CD1 PHE A 721 45.997 14.713 17.985 1.00 35.61 C ATOM 2151 CD2 PHE A 721 46.987 16.385 16.641 1.00 32.10 C ATOM 2152 CE1 PHE A 721 47.215 14.392 18.540 1.00 32.58 C ATOM 2153 CE2 PHE A 721 48.242 16.032 17.134 1.00 35.91 C ATOM 2154 CZ PHE A 721 48.344 15.070 18.106 1.00 31.01 C ATOM 2155 H PHE A 721 45.286 16.689 14.125 1.00 0.00 H ATOM 2156 N THR A 722 42.331 15.013 13.918 1.00 34.06 N ATOM 2157 CA THR A 722 40.940 14.738 13.502 1.00 34.81 C ATOM 2158 C THR A 722 41.021 13.657 12.418 1.00 32.99 C ATOM 2159 O THR A 722 40.026 13.268 11.813 1.00 36.95 O ATOM 2160 CB THR A 722 40.506 16.151 13.058 1.00 39.74 C ATOM 2161 OG1 THR A 722 39.387 16.632 13.760 1.00 44.29 O ATOM 2162 CG2 THR A 722 40.496 16.382 11.684 1.00 30.48 C ATOM 2163 HG1 THR A 722 39.158 17.538 13.432 1.00 0.00 H ATOM 2164 H THR A 722 42.971 15.425 13.210 1.00 0.00 H ATOM 2165 N TYR A 723 42.226 13.146 12.131 1.00 29.85 N ATOM 2166 CA TYR A 723 42.328 12.167 11.069 1.00 31.84 C ATOM 2167 C TYR A 723 41.807 12.673 9.727 1.00 32.09 C ATOM 2168 O TYR A 723 41.244 11.896 8.897 1.00 34.32 O ATOM 2169 CB TYR A 723 41.657 10.798 11.460 1.00 31.66 C ATOM 2170 CG TYR A 723 42.256 10.185 12.711 1.00 31.52 C ATOM 2171 CD1 TYR A 723 43.406 9.356 12.618 1.00 33.80 C ATOM 2172 CD2 TYR A 723 41.695 10.415 13.979 1.00 36.18 C ATOM 2173 CE1 TYR A 723 43.980 8.782 13.737 1.00 36.18 C ATOM 2174 CE2 TYR A 723 42.271 9.839 15.136 1.00 38.39 C ATOM 2175 CZ TYR A 723 43.393 9.023 14.990 1.00 38.55 C ATOM 2176 OH TYR A 723 43.987 8.467 16.048 1.00 38.38 O ATOM 2177 HH TYR A 723 44.760 7.927 15.745 1.00 0.00 H ATOM 2178 H TYR A 723 43.070 13.446 12.660 1.00 0.00 H ATOM 2179 N GLY A 724 42.102 13.941 9.457 1.00 33.08 N ATOM 2180 CA GLY A 724 41.954 14.496 8.122 1.00 32.09 C ATOM 2181 C GLY A 724 40.656 15.183 7.856 1.00 35.54 C ATOM 2182 O GLY A 724 40.341 15.410 6.695 1.00 40.76 O ATOM 2183 H GLY A 724 42.449 14.553 10.223 1.00 0.00 H ATOM 2184 N LYS A 725 39.850 15.423 8.892 1.00 34.09 N ATOM 2185 CA LYS A 725 38.611 16.191 8.684 1.00 39.90 C ATOM 2186 C LYS A 725 38.832 17.621 8.160 1.00 38.30 C ATOM 2187 O LYS A 725 39.817 18.278 8.483 1.00 35.75 O ATOM 2188 CB LYS A 725 37.705 16.281 9.911 1.00 45.68 C ATOM 2189 CG LYS A 725 37.240 14.952 10.452 1.00 64.45 C ATOM 2190 CD LYS A 725 36.405 15.035 11.733 1.00 79.66 C ATOM 2191 CE LYS A 725 35.121 15.819 11.513 1.00 97.52 C ATOM 2192 NZ LYS A 725 34.298 15.414 10.325 1.00107.30 N ATOM 2193 HZ1 LYS A 725 34.861 15.532 9.458 1.00 0.00 H ATOM 2194 HZ2 LYS A 725 34.016 14.418 10.424 1.00 0.00 H ATOM 2195 HZ3 LYS A 725 33.449 16.013 10.272 1.00 0.00 H ATOM 2196 H LYS A 725 40.095 15.070 9.839 1.00 0.00 H ATOM 2197 N GLN A 726 37.880 18.090 7.366 1.00 33.01 N ATOM 2198 CA GLN A 726 37.924 19.482 6.903 1.00 36.26 C ATOM 2199 C GLN A 726 37.628 20.433 8.026 1.00 34.13 C ATOM 2200 O GLN A 726 36.650 20.250 8.698 1.00 37.80 O ATOM 2201 CB GLN A 726 36.899 19.681 5.785 1.00 38.00 C ATOM 2202 CG GLN A 726 37.210 20.959 5.009 1.00 37.07 C ATOM 2203 CD GLN A 726 36.117 21.335 4.032 1.00 41.27 C ATOM 2204 OE1 GLN A 726 36.359 21.498 2.813 1.00 40.28 O ATOM 2205 NE2 GLN A 726 34.896 21.445 4.548 1.00 40.30 N ATOM 2206 HE22 GLN A 726 34.747 21.300 5.567 1.00 0.00 H ATOM 2207 HE21 GLN A 726 34.090 21.676 3.932 1.00 0.00 H ATOM 2208 H GLN A 726 37.099 17.470 7.070 1.00 0.00 H ATOM 2209 N PRO A 727 38.510 21.429 8.300 1.00 34.20 N ATOM 2210 CA PRO A 727 38.159 22.430 9.311 1.00 36.01 C ATOM 2211 C PRO A 727 36.813 23.107 9.028 1.00 39.40 C ATOM 2212 O PRO A 727 36.444 23.384 7.827 1.00 34.44 O ATOM 2213 CB PRO A 727 39.248 23.478 9.187 1.00 39.22 C ATOM 2214 CG PRO A 727 40.335 22.826 8.394 1.00 38.93 C ATOM 2215 CD PRO A 727 39.680 21.826 7.519 1.00 34.18 C ATOM 2216 N TRP A 728 36.052 23.330 10.089 1.00 37.54 N ATOM 2217 CA TRP A 728 34.738 23.962 9.924 1.00 40.69 C ATOM 2218 C TRP A 728 33.825 23.195 8.982 1.00 42.00 C ATOM 2219 O TRP A 728 33.041 23.781 8.286 1.00 41.30 O ATOM 2220 CB TRP A 728 34.907 25.422 9.436 1.00 40.21 C ATOM 2221 CG TRP A 728 35.686 26.309 10.374 1.00 38.25 C ATOM 2222 CD1 TRP A 728 36.878 26.946 10.123 1.00 43.00 C ATOM 2223 CD2 TRP A 728 35.325 26.654 11.725 1.00 41.68 C ATOM 2224 NE1 TRP A 728 37.296 27.676 11.254 1.00 44.23 N ATOM 2225 CE2 TRP A 728 36.337 27.524 12.231 1.00 41.43 C ATOM 2226 CE3 TRP A 728 34.244 26.312 12.553 1.00 47.52 C ATOM 2227 CZ2 TRP A 728 36.296 28.034 13.512 1.00 45.10 C ATOM 2228 CZ3 TRP A 728 34.206 26.832 13.853 1.00 44.16 C ATOM 2229 CH2 TRP A 728 35.216 27.675 14.314 1.00 40.37 C ATOM 2230 HE1 TRP A 728 38.172 28.230 11.336 1.00 0.00 H ATOM 2231 H TRP A 728 36.385 23.058 11.036 1.00 0.00 H ATOM 2232 N TYR A 729 33.919 21.872 8.973 1.00 39.55 N ATOM 2233 CA TYR A 729 33.245 21.040 7.980 1.00 45.11 C ATOM 2234 C TYR A 729 31.715 21.209 8.035 1.00 44.68 C ATOM 2235 O TYR A 729 31.035 20.900 7.071 1.00 47.67 O ATOM 2236 CB TYR A 729 33.597 19.494 8.114 1.00 47.66 C ATOM 2237 CG TYR A 729 33.200 18.894 9.450 1.00 47.96 C ATOM 2238 CD1 TYR A 729 34.027 19.037 10.566 1.00 54.90 C ATOM 2239 CD2 TYR A 729 32.008 18.206 9.609 1.00 53.43 C ATOM 2240 CE1 TYR A 729 33.676 18.522 11.791 1.00 61.30 C ATOM 2241 CE2 TYR A 729 31.632 17.705 10.851 1.00 63.08 C ATOM 2242 CZ TYR A 729 32.482 17.858 11.931 1.00 66.34 C ATOM 2243 OH TYR A 729 32.190 17.342 13.168 1.00 74.27 O ATOM 2244 HH TYR A 729 32.923 17.561 13.797 1.00 0.00 H ATOM 2245 H TYR A 729 34.496 21.408 9.703 1.00 0.00 H ATOM 2246 N GLN A 730 31.195 21.628 9.175 1.00 48.43 N ATOM 2247 CA GLN A 730 29.751 21.904 9.349 1.00 59.01 C ATOM 2248 C GLN A 730 29.267 23.155 8.520 1.00 58.97 C ATOM 2249 O GLN A 730 28.076 23.323 8.322 1.00 62.65 O ATOM 2250 CB GLN A 730 29.405 22.157 10.843 1.00 61.18 C ATOM 2251 CG GLN A 730 30.153 21.375 11.943 1.00 76.25 C ATOM 2252 CD GLN A 730 31.641 21.781 12.149 1.00 84.64 C ATOM 2253 OE1 GLN A 730 32.136 22.699 11.524 1.00 58.71 O ATOM 2254 NE2 GLN A 730 32.359 21.042 13.003 1.00100.81 N ATOM 2255 HE22 GLN A 730 31.907 20.263 13.523 1.00 0.00 H ATOM 2256 HE21 GLN A 730 33.369 21.247 13.146 1.00 0.00 H ATOM 2257 H GLN A 730 31.829 21.770 9.987 1.00 0.00 H ATOM 2258 N LEU A 731 30.202 24.008 8.085 1.00 46.57 N ATOM 2259 CA LEU A 731 29.960 25.348 7.623 1.00 41.84 C ATOM 2260 C LEU A 731 30.294 25.519 6.142 1.00 41.58 C ATOM 2261 O LEU A 731 31.188 24.900 5.598 1.00 43.17 O ATOM 2262 CB LEU A 731 30.783 26.321 8.432 1.00 41.62 C ATOM 2263 CG LEU A 731 30.666 26.343 9.963 1.00 45.24 C ATOM 2264 CD1 LEU A 731 31.449 27.546 10.485 1.00 45.19 C ATOM 2265 CD2 LEU A 731 29.225 26.319 10.423 1.00 46.79 C ATOM 2266 H LEU A 731 31.187 23.673 8.081 1.00 0.00 H ATOM 2267 N SER A 732 29.559 26.399 5.478 1.00 41.87 N ATOM 2268 CA SER A 732 29.842 26.825 4.093 1.00 36.30 C ATOM 2269 C SER A 732 31.078 27.707 4.180 1.00 34.01 C ATOM 2270 O SER A 732 31.501 28.145 5.269 1.00 36.44 O ATOM 2271 CB SER A 732 28.674 27.732 3.592 1.00 46.89 C ATOM 2272 OG SER A 732 28.619 28.962 4.363 1.00 44.47 O ATOM 2273 HG SER A 732 27.874 29.524 4.033 1.00 0.00 H ATOM 2274 H SER A 732 28.736 26.813 5.960 1.00 0.00 H ATOM 2275 N ASN A 733 31.593 28.061 3.020 1.00 35.37 N ATOM 2276 CA ASN A 733 32.758 28.904 2.936 1.00 38.09 C ATOM 2277 C ASN A 733 32.565 30.244 3.607 1.00 39.87 C ATOM 2278 O ASN A 733 33.484 30.750 4.312 1.00 46.45 O ATOM 2279 CB ASN A 733 33.125 29.073 1.467 1.00 38.70 C ATOM 2280 CG ASN A 733 33.838 27.835 0.893 1.00 45.34 C ATOM 2281 OD1 ASN A 733 34.670 27.245 1.546 1.00 44.36 O ATOM 2282 ND2 ASN A 733 33.595 27.523 -0.365 1.00 45.52 N ATOM 2283 HD22 ASN A 733 32.874 28.047 -0.901 1.00 0.00 H ATOM 2284 HD21 ASN A 733 34.124 26.752 -0.821 1.00 0.00 H ATOM 2285 H ASN A 733 31.147 27.723 2.143 1.00 0.00 H ATOM 2286 N THR A 734 31.393 30.851 3.372 1.00 41.63 N ATOM 2287 CA THR A 734 31.176 32.231 3.856 1.00 44.66 C ATOM 2288 C THR A 734 30.987 32.160 5.334 1.00 40.82 C ATOM 2289 O THR A 734 31.565 32.959 6.073 1.00 41.51 O ATOM 2290 CB THR A 734 30.029 33.028 3.125 1.00 42.09 C ATOM 2291 OG1 THR A 734 28.836 32.284 3.135 1.00 46.22 O ATOM 2292 CG2 THR A 734 30.424 33.351 1.682 1.00 43.34 C ATOM 2293 HG1 THR A 734 28.125 32.796 2.673 1.00 0.00 H ATOM 2294 H THR A 734 30.641 30.354 2.853 1.00 0.00 H ATOM 2295 N GLU A 735 30.247 31.153 5.795 1.00 38.14 N ATOM 2296 CA GLU A 735 30.147 30.975 7.261 1.00 38.00 C ATOM 2297 C GLU A 735 31.487 30.772 7.963 1.00 40.73 C ATOM 2298 O GLU A 735 31.703 31.195 9.104 1.00 39.86 O ATOM 2299 CB GLU A 735 29.309 29.734 7.578 1.00 44.00 C ATOM 2300 CG GLU A 735 27.855 29.870 7.278 1.00 46.62 C ATOM 2301 CD GLU A 735 27.085 28.566 7.306 1.00 51.63 C ATOM 2302 OE1 GLU A 735 27.654 27.483 7.085 1.00 53.46 O ATOM 2303 OE2 GLU A 735 25.868 28.626 7.527 1.00 49.42 O ATOM 2304 H GLU A 735 29.753 30.510 5.143 1.00 0.00 H ATOM 2305 N ALA A 736 32.385 30.033 7.321 1.00 38.23 N ATOM 2306 CA ALA A 736 33.689 29.878 7.905 1.00 39.17 C ATOM 2307 C ALA A 736 34.394 31.225 7.991 1.00 34.31 C ATOM 2308 O ALA A 736 35.002 31.559 8.989 1.00 38.25 O ATOM 2309 CB ALA A 736 34.488 28.859 7.079 1.00 40.94 C ATOM 2310 H ALA A 736 32.150 29.577 6.416 1.00 0.00 H ATOM 2311 N ILE A 737 34.336 32.004 6.919 1.00 39.10 N ATOM 2312 CA ILE A 737 34.875 33.376 6.959 1.00 40.89 C ATOM 2313 C ILE A 737 34.323 34.161 8.136 1.00 36.13 C ATOM 2314 O ILE A 737 35.096 34.782 8.853 1.00 32.63 O ATOM 2315 CB ILE A 737 34.621 34.172 5.662 1.00 43.70 C ATOM 2316 CG1 ILE A 737 35.381 33.485 4.507 1.00 46.87 C ATOM 2317 CG2 ILE A 737 35.134 35.604 5.823 1.00 43.34 C ATOM 2318 CD1 ILE A 737 35.025 33.971 3.122 1.00 47.16 C ATOM 2319 H ILE A 737 33.907 31.644 6.043 1.00 0.00 H ATOM 2320 N ASP A 738 33.024 34.042 8.339 1.00 40.46 N ATOM 2321 CA ASP A 738 32.296 34.652 9.472 1.00 43.15 C ATOM 2322 C ASP A 738 32.866 34.203 10.832 1.00 42.97 C ATOM 2323 O ASP A 738 33.292 35.031 11.650 1.00 39.73 O ATOM 2324 CB ASP A 738 30.799 34.259 9.366 1.00 43.66 C ATOM 2325 CG ASP A 738 29.888 35.111 10.252 1.00 47.56 C ATOM 2326 OD1 ASP A 738 30.367 36.022 10.975 1.00 40.00 O ATOM 2327 OD2 ASP A 738 28.681 34.844 10.214 1.00 43.22 O ATOM 2328 H ASP A 738 32.476 33.481 7.656 1.00 0.00 H ATOM 2329 N CYS A 739 32.953 32.890 11.042 1.00 42.94 N ATOM 2330 CA CYS A 739 33.743 32.344 12.197 1.00 39.56 C ATOM 2331 C CYS A 739 35.156 32.843 12.362 1.00 36.25 C ATOM 2332 O CYS A 739 35.554 33.266 13.454 1.00 36.25 O ATOM 2333 CB CYS A 739 33.823 30.843 12.132 1.00 43.67 C ATOM 2334 SG CYS A 739 32.448 29.990 12.887 1.00 55.90 S ATOM 2335 H CYS A 739 32.467 32.234 10.397 1.00 0.00 H ATOM 2336 N ILE A 740 35.942 32.723 11.304 1.00 36.19 N ATOM 2337 CA ILE A 740 37.344 33.102 11.429 1.00 40.10 C ATOM 2338 C ILE A 740 37.444 34.569 11.799 1.00 40.72 C ATOM 2339 O ILE A 740 38.169 34.972 12.709 1.00 39.83 O ATOM 2340 CB ILE A 740 38.124 32.817 10.122 1.00 37.27 C ATOM 2341 CG1 ILE A 740 38.299 31.290 9.923 1.00 40.02 C ATOM 2342 CG2 ILE A 740 39.484 33.475 10.182 1.00 36.05 C ATOM 2343 CD1 ILE A 740 38.351 30.845 8.474 1.00 41.00 C ATOM 2344 H ILE A 740 35.567 32.366 10.402 1.00 0.00 H ATOM 2345 N THR A 741 36.673 35.375 11.080 1.00 41.02 N ATOM 2346 CA THR A 741 36.684 36.797 11.350 1.00 44.91 C ATOM 2347 C THR A 741 36.241 37.281 12.715 1.00 41.01 C ATOM 2348 O THR A 741 36.851 38.234 13.292 1.00 38.28 O ATOM 2349 CB THR A 741 35.827 37.630 10.360 1.00 38.48 C ATOM 2350 OG1 THR A 741 36.139 37.331 9.024 1.00 55.06 O ATOM 2351 CG2 THR A 741 36.474 38.946 10.428 1.00 79.91 C ATOM 2352 HG1 THR A 741 35.968 36.371 8.853 1.00 0.00 H ATOM 2353 H THR A 741 36.066 34.988 10.329 1.00 0.00 H ATOM 2354 N GLN A 742 35.145 36.712 13.194 1.00 39.57 N ATOM 2355 CA GLN A 742 34.734 36.964 14.594 1.00 43.73 C ATOM 2356 C GLN A 742 35.761 36.516 15.619 1.00 47.73 C ATOM 2357 O GLN A 742 35.557 36.782 16.748 1.00 44.40 O ATOM 2358 CB GLN A 742 33.556 36.065 14.939 1.00 48.56 C ATOM 2359 CG GLN A 742 32.287 36.512 14.361 1.00 54.91 C ATOM 2360 CD GLN A 742 31.219 35.491 14.574 1.00 55.63 C ATOM 2361 OE1 GLN A 742 31.009 35.027 15.680 1.00 55.48 O ATOM 2362 NE2 GLN A 742 30.532 35.141 13.517 1.00 59.13 N ATOM 2363 HE22 GLN A 742 30.748 35.565 12.592 1.00 0.00 H ATOM 2364 HE21 GLN A 742 29.770 34.439 13.601 1.00 0.00 H ATOM 2365 H GLN A 742 34.574 36.089 12.588 1.00 0.00 H ATOM 2366 N GLY A 743 36.761 35.685 15.289 1.00 48.74 N ATOM 2367 CA GLY A 743 37.678 35.180 16.338 1.00 43.13 C ATOM 2368 C GLY A 743 37.286 33.841 16.982 1.00 41.81 C ATOM 2369 O GLY A 743 37.849 33.450 17.976 1.00 40.38 O ATOM 2370 H GLY A 743 36.893 35.396 14.299 1.00 0.00 H ATOM 2371 N ARG A 744 36.333 33.108 16.426 1.00 42.45 N ATOM 2372 CA ARG A 744 36.061 31.772 16.912 1.00 43.97 C ATOM 2373 C ARG A 744 37.189 30.819 16.494 1.00 43.70 C ATOM 2374 O ARG A 744 37.734 30.993 15.444 1.00 43.62 O ATOM 2375 CB ARG A 744 34.806 31.208 16.263 1.00 47.51 C ATOM 2376 CG ARG A 744 33.564 31.974 16.528 1.00 56.15 C ATOM 2377 CD ARG A 744 33.284 32.165 18.002 1.00 67.14 C ATOM 2378 NE ARG A 744 31.874 32.444 18.066 1.00 84.88 N ATOM 2379 CZ ARG A 744 30.930 31.516 17.904 1.00102.53 C ATOM 2380 NH1 ARG A 744 31.252 30.216 17.741 1.00 89.76 N ATOM 2381 NH2 ARG A 744 29.648 31.889 17.913 1.00105.24 N ATOM 2382 HE ARG A 744 31.575 33.423 18.249 1.00 0.00 H ATOM 2383 HH12 ARG A 744 30.502 29.506 17.616 1.00 0.00 H ATOM 2384 HH11 ARG A 744 32.250 29.924 17.740 1.00 0.00 H ATOM 2385 HH22 ARG A 744 28.899 31.179 17.788 1.00 0.00 H ATOM 2386 HH21 ARG A 744 29.399 32.890 18.045 1.00 0.00 H ATOM 2387 H ARG A 744 35.777 33.494 15.636 1.00 0.00 H ATOM 2388 N GLU A 745 37.430 29.789 17.286 1.00 44.30 N ATOM 2389 CA GLU A 745 38.523 28.836 17.147 1.00 39.64 C ATOM 2390 C GLU A 745 37.936 27.486 16.938 1.00 40.24 C ATOM 2391 O GLU A 745 36.932 27.125 17.530 1.00 37.39 O ATOM 2392 CB GLU A 745 39.293 28.780 18.424 1.00 42.04 C ATOM 2393 CG GLU A 745 40.078 30.058 18.716 1.00 46.95 C ATOM 2394 CD GLU A 745 41.042 29.854 19.868 1.00 50.85 C ATOM 2395 OE1 GLU A 745 40.747 29.058 20.790 1.00 66.95 O ATOM 2396 OE2 GLU A 745 42.106 30.466 19.853 1.00 65.81 O ATOM 2397 H GLU A 745 36.778 29.645 18.083 1.00 0.00 H ATOM 2398 N LEU A 746 38.561 26.678 16.097 1.00 41.20 N ATOM 2399 CA LEU A 746 38.160 25.255 16.032 1.00 41.55 C ATOM 2400 C LEU A 746 38.240 24.594 17.442 1.00 38.49 C ATOM 2401 O LEU A 746 39.093 24.948 18.296 1.00 39.35 O ATOM 2402 CB LEU A 746 39.112 24.513 15.074 1.00 38.15 C ATOM 2403 CG LEU A 746 39.035 24.954 13.622 1.00 37.30 C ATOM 2404 CD1 LEU A 746 40.372 24.684 12.953 1.00 41.49 C ATOM 2405 CD2 LEU A 746 37.910 24.202 12.938 1.00 40.08 C ATOM 2406 H LEU A 746 39.324 27.038 15.489 1.00 0.00 H ATOM 2407 N GLU A 747 37.380 23.634 17.665 1.00 41.57 N ATOM 2408 CA GLU A 747 37.269 22.966 18.960 1.00 41.55 C ATOM 2409 C GLU A 747 38.320 21.913 19.084 1.00 46.04 C ATOM 2410 O GLU A 747 38.834 21.414 18.073 1.00 38.49 O ATOM 2411 CB GLU A 747 35.942 22.280 19.023 1.00 47.31 C ATOM 2412 CG GLU A 747 34.811 23.283 19.144 1.00 72.97 C ATOM 2413 CD GLU A 747 33.492 22.621 19.476 1.00 83.78 C ATOM 2414 OE1 GLU A 747 33.351 21.393 19.224 1.00 85.63 O ATOM 2415 OE2 GLU A 747 32.617 23.341 19.991 1.00 94.73 O ATOM 2416 H GLU A 747 36.752 23.335 16.892 1.00 0.00 H ATOM 2417 N ARG A 748 38.631 21.541 20.309 1.00 39.25 N ATOM 2418 CA ARG A 748 39.615 20.487 20.534 1.00 38.31 C ATOM 2419 C ARG A 748 39.130 19.170 19.933 1.00 41.70 C ATOM 2420 O ARG A 748 38.092 18.707 20.257 1.00 36.71 O ATOM 2421 CB ARG A 748 39.886 20.285 21.998 1.00 38.66 C ATOM 2422 CG ARG A 748 41.040 19.337 22.307 1.00 44.58 C ATOM 2423 CD ARG A 748 41.548 19.532 23.738 1.00 50.91 C ATOM 2424 NE ARG A 748 40.512 19.122 24.678 1.00 51.27 N ATOM 2425 CZ ARG A 748 40.205 17.882 24.983 1.00 54.83 C ATOM 2426 NH1 ARG A 748 40.868 16.870 24.471 1.00 58.05 N ATOM 2427 NH2 ARG A 748 39.206 17.652 25.799 1.00 60.01 N ATOM 2428 HE ARG A 748 39.970 19.875 25.147 1.00 0.00 H ATOM 2429 HH12 ARG A 748 40.608 15.896 24.726 1.00 0.00 H ATOM 2430 HH11 ARG A 748 41.653 17.043 23.811 1.00 0.00 H ATOM 2431 HH22 ARG A 748 38.953 16.675 26.048 1.00 0.00 H ATOM 2432 HH21 ARG A 748 38.666 18.447 26.197 1.00 0.00 H ATOM 2433 H ARG A 748 38.172 22.001 21.121 1.00 0.00 H ATOM 2434 N PRO A 749 39.904 18.553 19.022 1.00 38.69 N ATOM 2435 CA PRO A 749 39.498 17.211 18.552 1.00 37.77 C ATOM 2436 C PRO A 749 39.514 16.182 19.694 1.00 41.31 C ATOM 2437 O PRO A 749 40.220 16.385 20.672 1.00 40.33 O ATOM 2438 CB PRO A 749 40.597 16.860 17.538 1.00 38.14 C ATOM 2439 CG PRO A 749 41.145 18.226 17.111 1.00 37.52 C ATOM 2440 CD PRO A 749 41.124 19.042 18.366 1.00 38.43 C ATOM 2441 N ARG A 750 38.745 15.112 19.571 1.00 44.07 N ATOM 2442 CA ARG A 750 38.677 14.041 20.568 1.00 45.31 C ATOM 2443 C ARG A 750 40.040 13.388 20.822 1.00 49.61 C ATOM 2444 O ARG A 750 40.393 13.137 21.995 1.00 49.85 O ATOM 2445 CB ARG A 750 37.677 12.973 20.074 1.00 54.72 C ATOM 2446 CG ARG A 750 37.472 11.769 20.992 1.00 66.88 C ATOM 2447 CD ARG A 750 36.514 10.724 20.427 1.00 75.65 C ATOM 2448 NE ARG A 750 35.779 11.179 19.232 1.00 99.49 N ATOM 2449 CZ ARG A 750 34.769 12.066 19.197 1.00110.08 C ATOM 2450 NH1 ARG A 750 34.338 12.674 20.306 1.00118.20 N ATOM 2451 NH2 ARG A 750 34.201 12.376 18.024 1.00108.10 N ATOM 2452 HE ARG A 750 36.073 10.771 18.321 1.00 0.00 H ATOM 2453 HH12 ARG A 750 33.555 13.357 20.254 1.00 0.00 H ATOM 2454 HH11 ARG A 750 34.785 12.465 21.221 1.00 0.00 H ATOM 2455 HH22 ARG A 750 33.419 13.061 17.990 1.00 0.00 H ATOM 2456 HH21 ARG A 750 34.542 11.931 17.148 1.00 0.00 H ATOM 2457 H ARG A 750 38.156 15.027 18.718 1.00 0.00 H ATOM 2458 N ALA A 751 40.828 13.141 19.757 1.00 43.90 N ATOM 2459 CA ALA A 751 42.174 12.527 19.915 1.00 43.65 C ATOM 2460 C ALA A 751 43.265 13.472 20.364 1.00 41.29 C ATOM 2461 O ALA A 751 44.415 13.053 20.523 1.00 46.25 O ATOM 2462 CB ALA A 751 42.610 11.867 18.631 1.00 43.59 C ATOM 2463 H ALA A 751 40.488 13.385 18.805 1.00 0.00 H ATOM 2464 N CYS A 752 42.934 14.746 20.520 1.00 41.27 N ATOM 2465 CA CYS A 752 43.894 15.816 20.909 1.00 42.28 C ATOM 2466 C CYS A 752 43.990 16.049 22.454 1.00 47.15 C ATOM 2467 O CYS A 752 43.058 16.497 23.090 1.00 40.54 O ATOM 2468 CB CYS A 752 43.497 17.140 20.266 1.00 38.33 C ATOM 2469 SG CYS A 752 44.774 18.394 20.403 1.00 42.65 S ATOM 2470 H CYS A 752 41.942 15.015 20.361 1.00 0.00 H ATOM 2471 N PRO A 753 45.141 15.772 23.046 1.00 48.04 N ATOM 2472 CA PRO A 753 45.327 16.147 24.431 1.00 48.05 C ATOM 2473 C PRO A 753 45.332 17.638 24.647 1.00 51.85 C ATOM 2474 O PRO A 753 45.803 18.382 23.774 1.00 43.92 O ATOM 2475 CB PRO A 753 46.756 15.695 24.747 1.00 45.98 C ATOM 2476 CG PRO A 753 47.192 14.873 23.620 1.00 51.13 C ATOM 2477 CD PRO A 753 46.116 14.784 22.587 1.00 44.31 C ATOM 2478 N PRO A 754 44.927 18.077 25.849 1.00 50.24 N ATOM 2479 CA PRO A 754 44.984 19.516 26.105 1.00 44.15 C ATOM 2480 C PRO A 754 46.312 20.196 25.891 1.00 43.10 C ATOM 2481 O PRO A 754 46.371 21.329 25.480 1.00 44.04 O ATOM 2482 CB PRO A 754 44.539 19.604 27.565 1.00 46.68 C ATOM 2483 CG PRO A 754 43.477 18.534 27.650 1.00 46.75 C ATOM 2484 CD PRO A 754 44.031 17.391 26.807 1.00 46.34 C ATOM 2485 N GLU A 755 47.390 19.515 26.134 1.00 47.18 N ATOM 2486 CA GLU A 755 48.700 20.074 25.883 1.00 48.61 C ATOM 2487 C GLU A 755 48.864 20.403 24.403 1.00 45.56 C ATOM 2488 O GLU A 755 49.452 21.440 24.024 1.00 50.95 O ATOM 2489 CB GLU A 755 49.794 19.036 26.252 1.00 60.23 C ATOM 2490 CG GLU A 755 49.994 18.804 27.720 1.00 71.86 C ATOM 2491 CD GLU A 755 48.949 17.899 28.361 1.00 78.01 C ATOM 2492 OE1 GLU A 755 47.979 17.447 27.704 1.00 75.13 O ATOM 2493 OE2 GLU A 755 49.112 17.650 29.566 1.00 85.47 O ATOM 2494 H GLU A 755 47.310 18.551 26.516 1.00 0.00 H ATOM 2495 N VAL A 756 48.375 19.509 23.544 1.00 36.53 N ATOM 2496 CA VAL A 756 48.517 19.738 22.092 1.00 42.19 C ATOM 2497 C VAL A 756 47.557 20.863 21.642 1.00 36.96 C ATOM 2498 O VAL A 756 47.935 21.749 20.874 1.00 39.03 O ATOM 2499 CB VAL A 756 48.336 18.444 21.290 1.00 44.35 C ATOM 2500 CG1 VAL A 756 48.354 18.703 19.784 1.00 48.33 C ATOM 2501 CG2 VAL A 756 49.416 17.429 21.661 1.00 49.31 C ATOM 2502 H VAL A 756 47.896 18.655 23.894 1.00 0.00 H ATOM 2503 N TYR A 757 46.344 20.869 22.161 1.00 37.12 N ATOM 2504 CA TYR A 757 45.418 21.998 21.875 1.00 38.35 C ATOM 2505 C TYR A 757 45.933 23.414 22.195 1.00 37.87 C ATOM 2506 O TYR A 757 45.673 24.402 21.465 1.00 39.34 O ATOM 2507 CB TYR A 757 44.104 21.738 22.564 1.00 37.82 C ATOM 2508 CG TYR A 757 42.997 22.621 22.106 1.00 41.39 C ATOM 2509 CD1 TYR A 757 42.623 22.633 20.757 1.00 41.95 C ATOM 2510 CD2 TYR A 757 42.287 23.454 23.023 1.00 43.45 C ATOM 2511 CE1 TYR A 757 41.580 23.415 20.317 1.00 41.17 C ATOM 2512 CE2 TYR A 757 41.256 24.291 22.586 1.00 42.01 C ATOM 2513 CZ TYR A 757 40.893 24.241 21.232 1.00 43.64 C ATOM 2514 OH TYR A 757 39.864 24.985 20.736 1.00 40.37 O ATOM 2515 HH TYR A 757 39.769 24.809 19.766 1.00 0.00 H ATOM 2516 H TYR A 757 46.035 20.085 22.770 1.00 0.00 H ATOM 2517 N ALA A 758 46.696 23.524 23.280 1.00 38.84 N ATOM 2518 CA ALA A 758 47.334 24.771 23.650 1.00 37.78 C ATOM 2519 C ALA A 758 48.297 25.246 22.569 1.00 35.69 C ATOM 2520 O ALA A 758 48.358 26.419 22.213 1.00 39.15 O ATOM 2521 CB ALA A 758 48.075 24.608 24.988 1.00 37.85 C ATOM 2522 H ALA A 758 46.839 22.688 23.882 1.00 0.00 H ATOM 2523 N ILE A 759 49.032 24.300 21.997 1.00 43.60 N ATOM 2524 CA ILE A 759 49.870 24.584 20.852 1.00 37.54 C ATOM 2525 C ILE A 759 49.052 25.123 19.671 1.00 35.57 C ATOM 2526 O ILE A 759 49.367 26.182 19.091 1.00 40.38 O ATOM 2527 CB ILE A 759 50.695 23.340 20.424 1.00 45.17 C ATOM 2528 CG1 ILE A 759 51.585 22.907 21.586 1.00 39.28 C ATOM 2529 CG2 ILE A 759 51.599 23.741 19.244 1.00 44.35 C ATOM 2530 CD1 ILE A 759 52.416 21.712 21.353 1.00 41.43 C ATOM 2531 H ILE A 759 49.005 23.334 22.380 1.00 0.00 H ATOM 2532 N MET A 760 48.007 24.420 19.289 1.00 37.06 N ATOM 2533 CA MET A 760 47.142 24.967 18.219 1.00 39.51 C ATOM 2534 C MET A 760 46.740 26.400 18.525 1.00 40.26 C ATOM 2535 O MET A 760 46.872 27.294 17.685 1.00 37.93 O ATOM 2536 CB MET A 760 45.841 24.171 18.070 1.00 38.58 C ATOM 2537 CG MET A 760 46.040 22.784 17.675 1.00 39.61 C ATOM 2538 SD MET A 760 44.439 21.978 17.553 1.00 43.59 S ATOM 2539 CE MET A 760 45.031 20.314 17.563 1.00 35.15 C ATOM 2540 H MET A 760 47.794 23.502 19.728 1.00 0.00 H ATOM 2541 N ARG A 761 46.285 26.616 19.766 1.00 41.05 N ATOM 2542 CA ARG A 761 45.783 27.951 20.157 1.00 40.73 C ATOM 2543 C ARG A 761 46.844 28.953 20.089 1.00 37.36 C ATOM 2544 O ARG A 761 46.620 30.108 19.745 1.00 42.51 O ATOM 2545 CB ARG A 761 45.210 27.939 21.556 1.00 42.58 C ATOM 2546 CG ARG A 761 43.945 27.064 21.561 1.00 47.22 C ATOM 2547 CD ARG A 761 43.194 27.175 22.857 1.00 50.06 C ATOM 2548 NE ARG A 761 42.662 28.510 22.882 1.00 60.25 N ATOM 2549 CZ ARG A 761 41.841 28.995 23.788 1.00 67.57 C ATOM 2550 NH1 ARG A 761 41.389 28.248 24.785 1.00 83.37 N ATOM 2551 NH2 ARG A 761 41.447 30.239 23.641 1.00 68.61 N ATOM 2552 HE ARG A 761 42.952 29.150 22.115 1.00 0.00 H ATOM 2553 HH12 ARG A 761 40.741 28.656 25.488 1.00 0.00 H ATOM 2554 HH11 ARG A 761 41.683 27.253 24.864 1.00 0.00 H ATOM 2555 HH22 ARG A 761 40.798 30.664 24.333 1.00 0.00 H ATOM 2556 HH21 ARG A 761 41.784 30.799 22.832 1.00 0.00 H ATOM 2557 H ARG A 761 46.285 25.840 20.459 1.00 0.00 H ATOM 2558 N GLY A 762 48.059 28.582 20.355 1.00 38.59 N ATOM 2559 CA GLY A 762 49.072 29.702 20.268 1.00 38.77 C ATOM 2560 C GLY A 762 49.374 30.077 18.837 1.00 38.48 C ATOM 2561 O GLY A 762 50.046 31.078 18.615 1.00 40.35 O ATOM 2562 H GLY A 762 48.313 27.605 20.605 1.00 0.00 H ATOM 2563 N CYS A 763 48.957 29.225 17.864 1.00 34.02 N ATOM 2564 CA CYS A 763 49.130 29.564 16.461 1.00 34.70 C ATOM 2565 C CYS A 763 47.982 30.450 15.972 1.00 36.93 C ATOM 2566 O CYS A 763 48.119 31.101 14.929 1.00 39.25 O ATOM 2567 CB CYS A 763 49.190 28.300 15.590 1.00 35.42 C ATOM 2568 SG CYS A 763 50.519 27.122 15.951 1.00 38.11 S ATOM 2569 H CYS A 763 48.510 28.323 18.125 1.00 0.00 H ATOM 2570 N TRP A 764 46.859 30.451 16.688 1.00 38.89 N ATOM 2571 CA TRP A 764 45.643 31.170 16.296 1.00 40.01 C ATOM 2572 C TRP A 764 45.376 32.492 16.996 1.00 46.10 C ATOM 2573 O TRP A 764 44.265 32.941 16.996 1.00 53.34 O ATOM 2574 CB TRP A 764 44.433 30.280 16.525 1.00 45.17 C ATOM 2575 CG TRP A 764 44.456 29.055 15.760 1.00 39.94 C ATOM 2576 CD1 TRP A 764 45.070 28.836 14.498 1.00 43.93 C ATOM 2577 CD2 TRP A 764 43.814 27.836 16.120 1.00 37.38 C ATOM 2578 NE1 TRP A 764 44.858 27.515 14.120 1.00 45.56 N ATOM 2579 CE2 TRP A 764 44.107 26.880 15.098 1.00 38.88 C ATOM 2580 CE3 TRP A 764 43.054 27.440 17.215 1.00 41.06 C ATOM 2581 CZ2 TRP A 764 43.596 25.588 15.121 1.00 34.57 C ATOM 2582 CZ3 TRP A 764 42.619 26.102 17.278 1.00 35.48 C ATOM 2583 CH2 TRP A 764 42.854 25.214 16.206 1.00 37.72 C ATOM 2584 HE1 TRP A 764 45.206 27.074 13.245 1.00 0.00 H ATOM 2585 H TRP A 764 46.844 29.911 17.576 1.00 0.00 H ATOM 2586 N GLN A 765 46.387 33.164 17.508 1.00 44.12 N ATOM 2587 CA GLN A 765 46.219 34.537 17.961 1.00 42.10 C ATOM 2588 C GLN A 765 45.826 35.411 16.790 1.00 44.49 C ATOM 2589 O GLN A 765 46.354 35.262 15.682 1.00 43.54 O ATOM 2590 CB GLN A 765 47.532 35.068 18.528 1.00 51.19 C ATOM 2591 CG GLN A 765 48.129 34.256 19.689 1.00 54.15 C ATOM 2592 CD GLN A 765 47.190 34.193 20.864 1.00 63.20 C ATOM 2593 OE1 GLN A 765 46.943 33.143 21.405 1.00 75.32 O ATOM 2594 NE2 GLN A 765 46.652 35.334 21.255 1.00 66.91 N ATOM 2595 HE22 GLN A 765 46.891 36.218 20.762 1.00 0.00 H ATOM 2596 HE21 GLN A 765 45.989 35.349 22.056 1.00 0.00 H ATOM 2597 H GLN A 765 47.318 32.707 17.590 1.00 0.00 H ATOM 2598 N ARG A 766 44.857 36.304 17.017 1.00 44.85 N ATOM 2599 CA ARG A 766 44.425 37.264 16.005 1.00 43.97 C ATOM 2600 C ARG A 766 45.571 38.182 15.589 1.00 44.29 C ATOM 2601 O ARG A 766 45.749 38.483 14.418 1.00 47.29 O ATOM 2602 CB ARG A 766 43.276 38.079 16.542 1.00 46.27 C ATOM 2603 CG ARG A 766 42.845 39.140 15.598 1.00 51.54 C ATOM 2604 CD ARG A 766 41.460 39.662 15.907 1.00 56.04 C ATOM 2605 NE ARG A 766 40.955 39.702 14.574 1.00 63.35 N ATOM 2606 CZ ARG A 766 39.861 39.115 14.143 1.00 57.18 C ATOM 2607 NH1 ARG A 766 38.975 38.542 14.977 1.00 55.61 N ATOM 2608 NH2 ARG A 766 39.615 39.218 12.850 1.00 55.21 N ATOM 2609 HE ARG A 766 41.504 40.246 13.878 1.00 0.00 H ATOM 2610 HH12 ARG A 766 38.121 38.087 14.596 1.00 0.00 H ATOM 2611 HH11 ARG A 766 39.144 38.554 16.003 1.00 0.00 H ATOM 2612 HH22 ARG A 766 38.765 38.776 12.446 1.00 0.00 H ATOM 2613 HH21 ARG A 766 40.271 39.741 12.236 1.00 0.00 H ATOM 2614 H ARG A 766 44.394 36.315 17.948 1.00 0.00 H ATOM 2615 N GLU A 767 46.352 38.653 16.533 1.00 50.07 N ATOM 2616 CA GLU A 767 47.473 39.527 16.193 1.00 52.04 C ATOM 2617 C GLU A 767 48.657 38.635 15.735 1.00 47.10 C ATOM 2618 O GLU A 767 49.174 37.791 16.515 1.00 44.35 O ATOM 2619 CB GLU A 767 47.831 40.432 17.389 1.00 55.92 C ATOM 2620 CG GLU A 767 49.179 41.184 17.323 1.00 71.26 C ATOM 2621 CD GLU A 767 49.435 41.984 16.024 1.00 79.46 C ATOM 2622 OE1 GLU A 767 48.494 42.746 15.629 1.00 86.04 O ATOM 2623 OE2 GLU A 767 50.580 41.858 15.408 1.00 64.51 O ATOM 2624 H GLU A 767 46.172 38.403 17.527 1.00 0.00 H ATOM 2625 N PRO A 768 49.093 38.826 14.490 1.00 44.51 N ATOM 2626 CA PRO A 768 50.231 38.052 13.973 1.00 45.73 C ATOM 2627 C PRO A 768 51.477 38.026 14.836 1.00 46.56 C ATOM 2628 O PRO A 768 52.070 36.982 14.977 1.00 44.03 O ATOM 2629 CB PRO A 768 50.550 38.703 12.638 1.00 39.32 C ATOM 2630 CG PRO A 768 49.297 39.351 12.176 1.00 43.61 C ATOM 2631 CD PRO A 768 48.510 39.702 13.451 1.00 43.67 C ATOM 2632 N GLN A 769 51.859 39.139 15.432 1.00 48.89 N ATOM 2633 CA GLN A 769 53.040 39.135 16.323 1.00 52.65 C ATOM 2634 C GLN A 769 52.816 38.418 17.640 1.00 45.70 C ATOM 2635 O GLN A 769 53.796 38.097 18.321 1.00 46.58 O ATOM 2636 CB GLN A 769 53.502 40.532 16.636 1.00 63.14 C ATOM 2637 CG GLN A 769 54.302 41.225 15.567 1.00 79.37 C ATOM 2638 CD GLN A 769 54.490 42.678 15.988 1.00 92.78 C ATOM 2639 OE1 GLN A 769 53.513 43.427 16.084 1.00 97.22 O ATOM 2640 NE2 GLN A 769 55.718 43.058 16.321 1.00 93.17 N ATOM 2641 HE22 GLN A 769 56.512 42.394 16.224 1.00 0.00 H ATOM 2642 HE21 GLN A 769 55.886 44.020 16.679 1.00 0.00 H ATOM 2643 H GLN A 769 51.329 40.020 15.275 1.00 0.00 H ATOM 2644 N GLN A 770 51.568 38.105 18.003 1.00 45.87 N ATOM 2645 CA GLN A 770 51.338 37.301 19.183 1.00 51.04 C ATOM 2646 C GLN A 770 51.450 35.791 18.967 1.00 48.62 C ATOM 2647 O GLN A 770 51.342 35.048 19.936 1.00 47.87 O ATOM 2648 CB GLN A 770 49.935 37.577 19.795 1.00 60.61 C ATOM 2649 CG GLN A 770 49.623 38.978 20.315 1.00 66.50 C ATOM 2650 CD GLN A 770 50.662 39.548 21.228 1.00 74.12 C ATOM 2651 OE1 GLN A 770 51.261 38.842 22.035 1.00 81.84 O ATOM 2652 NE2 GLN A 770 50.880 40.853 21.119 1.00 85.25 N ATOM 2653 HE22 GLN A 770 50.349 41.412 20.421 1.00 0.00 H ATOM 2654 HE21 GLN A 770 51.581 41.316 21.732 1.00 0.00 H ATOM 2655 H GLN A 770 50.762 38.440 17.437 1.00 0.00 H ATOM 2656 N ARG A 771 51.553 35.321 17.729 1.00 43.86 N ATOM 2657 CA ARG A 771 51.480 33.880 17.444 1.00 42.12 C ATOM 2658 C ARG A 771 52.802 33.259 17.871 1.00 37.70 C ATOM 2659 O ARG A 771 53.807 33.934 17.884 1.00 38.44 O ATOM 2660 CB ARG A 771 51.173 33.616 15.955 1.00 37.40 C ATOM 2661 CG ARG A 771 49.789 34.110 15.546 1.00 38.62 C ATOM 2662 CD ARG A 771 49.537 34.044 14.065 1.00 40.52 C ATOM 2663 NE ARG A 771 48.340 34.788 13.763 1.00 40.91 N ATOM 2664 CZ ARG A 771 48.049 35.358 12.602 1.00 41.18 C ATOM 2665 NH1 ARG A 771 48.858 35.218 11.559 1.00 41.43 N ATOM 2666 NH2 ARG A 771 46.919 36.097 12.491 1.00 43.86 N ATOM 2667 HE ARG A 771 47.640 34.887 14.526 1.00 0.00 H ATOM 2668 HH12 ARG A 771 48.621 35.669 10.653 1.00 0.00 H ATOM 2669 HH11 ARG A 771 49.729 34.657 11.648 1.00 0.00 H ATOM 2670 HH22 ARG A 771 46.680 36.549 11.585 1.00 0.00 H ATOM 2671 HH21 ARG A 771 46.290 36.212 13.311 1.00 0.00 H ATOM 2672 H ARG A 771 51.688 35.988 16.942 1.00 0.00 H ATOM 2673 N HIS A 772 52.791 32.039 18.342 1.00 38.70 N ATOM 2674 CA HIS A 772 54.067 31.315 18.525 1.00 41.24 C ATOM 2675 C HIS A 772 54.934 31.267 17.264 1.00 42.96 C ATOM 2676 O HIS A 772 54.480 31.342 16.124 1.00 44.40 O ATOM 2677 CB HIS A 772 53.737 29.912 18.988 1.00 48.83 C ATOM 2678 CG HIS A 772 53.147 29.874 20.364 1.00 53.65 C ATOM 2679 ND1 HIS A 772 52.608 28.736 20.921 1.00 59.68 N ATOM 2680 CD2 HIS A 772 52.995 30.854 21.287 1.00 63.19 C ATOM 2681 CE1 HIS A 772 52.204 28.999 22.150 1.00 59.46 C ATOM 2682 NE2 HIS A 772 52.430 30.277 22.395 1.00 66.37 N ATOM 2683 H HIS A 772 51.890 31.581 18.586 1.00 0.00 H ATOM 2684 N SER A 773 56.206 31.179 17.500 1.00 43.72 N ATOM 2685 CA SER A 773 57.219 31.004 16.514 1.00 42.98 C ATOM 2686 C SER A 773 57.187 29.535 16.090 1.00 45.87 C ATOM 2687 O SER A 773 57.123 28.689 16.968 1.00 41.40 O ATOM 2688 CB SER A 773 58.545 31.192 17.216 1.00 42.38 C ATOM 2689 OG SER A 773 59.554 30.639 16.437 1.00 56.28 O ATOM 2690 HG SER A 773 59.378 29.673 16.309 1.00 0.00 H ATOM 2691 H SER A 773 56.512 31.241 18.492 1.00 0.00 H ATOM 2692 N ILE A 774 57.323 29.230 14.792 1.00 35.81 N ATOM 2693 CA ILE A 774 57.383 27.828 14.351 1.00 36.14 C ATOM 2694 C ILE A 774 58.539 27.042 15.011 1.00 31.57 C ATOM 2695 O ILE A 774 58.413 25.808 15.206 1.00 34.92 O ATOM 2696 CB ILE A 774 57.352 27.678 12.744 1.00 34.34 C ATOM 2697 CG1 ILE A 774 57.052 26.258 12.263 1.00 36.99 C ATOM 2698 CG2 ILE A 774 58.688 28.057 12.129 1.00 37.25 C ATOM 2699 CD1 ILE A 774 55.725 25.669 12.744 1.00 39.29 C ATOM 2700 H ILE A 774 57.387 29.993 14.089 1.00 0.00 H ATOM 2701 N LYS A 775 59.681 27.683 15.312 1.00 33.39 N ATOM 2702 CA LYS A 775 60.847 26.974 15.971 1.00 34.19 C ATOM 2703 C LYS A 775 60.440 26.400 17.326 1.00 34.71 C ATOM 2704 O LYS A 775 60.830 25.252 17.654 1.00 34.41 O ATOM 2705 CB LYS A 775 62.125 27.840 16.141 1.00 37.30 C ATOM 2706 H LYS A 775 59.767 28.695 15.086 1.00 0.00 H ATOM 2707 N ASP A 776 59.590 27.146 18.055 1.00 36.49 N ATOM 2708 CA ASP A 776 59.045 26.740 19.360 1.00 38.54 C ATOM 2709 C ASP A 776 57.952 25.687 19.214 1.00 39.15 C ATOM 2710 O ASP A 776 57.940 24.733 19.927 1.00 39.00 O ATOM 2711 CB ASP A 776 58.452 27.953 20.140 1.00 43.91 C ATOM 2712 CG ASP A 776 59.536 28.979 20.552 1.00 50.75 C ATOM 2713 OD1 ASP A 776 60.712 28.605 20.714 1.00 54.82 O ATOM 2714 OD2 ASP A 776 59.229 30.170 20.704 1.00 64.56 O ATOM 2715 H ASP A 776 59.300 28.068 17.672 1.00 0.00 H ATOM 2716 N VAL A 777 57.032 25.851 18.279 1.00 39.52 N ATOM 2717 CA VAL A 777 56.071 24.784 17.952 1.00 33.21 C ATOM 2718 C VAL A 777 56.814 23.495 17.571 1.00 32.80 C ATOM 2719 O VAL A 777 56.500 22.425 18.048 1.00 35.50 O ATOM 2720 CB VAL A 777 55.144 25.232 16.802 1.00 36.61 C ATOM 2721 CG1 VAL A 777 54.104 24.147 16.437 1.00 38.94 C ATOM 2722 CG2 VAL A 777 54.445 26.557 17.163 1.00 41.07 C ATOM 2723 H VAL A 777 56.986 26.753 17.763 1.00 0.00 H ATOM 2724 N HIS A 778 57.782 23.572 16.667 1.00 37.75 N ATOM 2725 CA HIS A 778 58.549 22.357 16.328 1.00 35.36 C ATOM 2726 C HIS A 778 59.128 21.697 17.587 1.00 36.22 C ATOM 2727 O HIS A 778 58.907 20.488 17.856 1.00 33.49 O ATOM 2728 CB HIS A 778 59.640 22.641 15.297 1.00 31.21 C ATOM 2729 CG HIS A 778 60.586 21.508 15.120 1.00 29.63 C ATOM 2730 ND1 HIS A 778 60.261 20.359 14.444 1.00 36.43 N ATOM 2731 CD2 HIS A 778 61.800 21.299 15.627 1.00 28.19 C ATOM 2732 CE1 HIS A 778 61.240 19.480 14.528 1.00 29.03 C ATOM 2733 NE2 HIS A 778 62.184 20.026 15.256 1.00 32.91 N ATOM 2734 H HIS A 778 57.998 24.477 16.203 1.00 0.00 H ATOM 2735 N ALA A 779 59.914 22.491 18.313 1.00 38.37 N ATOM 2736 CA ALA A 779 60.558 22.034 19.597 1.00 38.30 C ATOM 2737 C ALA A 779 59.591 21.336 20.541 1.00 35.70 C ATOM 2738 O ALA A 779 59.877 20.244 20.955 1.00 37.59 O ATOM 2739 CB ALA A 779 61.175 23.175 20.311 1.00 38.53 C ATOM 2740 H ALA A 779 60.090 23.461 17.982 1.00 0.00 H ATOM 2741 N ARG A 780 58.418 21.910 20.809 1.00 39.82 N ATOM 2742 CA ARG A 780 57.451 21.247 21.685 1.00 38.10 C ATOM 2743 C ARG A 780 56.886 19.989 21.107 1.00 39.00 C ATOM 2744 O ARG A 780 56.748 18.992 21.823 1.00 38.74 O ATOM 2745 CB ARG A 780 56.260 22.154 22.022 1.00 45.55 C ATOM 2746 CG ARG A 780 56.541 23.501 22.686 1.00 59.37 C ATOM 2747 CD ARG A 780 55.236 24.287 23.050 1.00 70.34 C ATOM 2748 NE ARG A 780 55.614 25.648 23.422 1.00 80.80 N ATOM 2749 CZ ARG A 780 55.533 26.762 22.682 1.00 91.60 C ATOM 2750 NH1 ARG A 780 54.971 26.762 21.475 1.00100.69 N ATOM 2751 NH2 ARG A 780 55.995 27.917 23.193 1.00 82.37 N ATOM 2752 HE ARG A 780 55.994 25.767 24.383 1.00 0.00 H ATOM 2753 HH12 ARG A 780 54.923 27.643 20.924 1.00 0.00 H ATOM 2754 HH11 ARG A 780 54.580 25.881 21.083 1.00 0.00 H ATOM 2755 HH22 ARG A 780 55.941 28.792 22.633 1.00 0.00 H ATOM 2756 HH21 ARG A 780 56.407 27.935 24.148 1.00 0.00 H ATOM 2757 H ARG A 780 58.189 22.835 20.393 1.00 0.00 H ATOM 2758 N LEU A 781 56.482 20.013 19.820 1.00 35.98 N ATOM 2759 CA LEU A 781 55.877 18.797 19.234 1.00 34.21 C ATOM 2760 C LEU A 781 56.892 17.677 19.171 1.00 32.49 C ATOM 2761 O LEU A 781 56.550 16.505 19.330 1.00 29.26 O ATOM 2762 CB LEU A 781 55.338 19.038 17.806 1.00 33.93 C ATOM 2763 CG LEU A 781 54.164 19.994 17.754 1.00 34.75 C ATOM 2764 CD1 LEU A 781 53.838 20.446 16.344 1.00 32.95 C ATOM 2765 CD2 LEU A 781 52.981 19.274 18.342 1.00 36.57 C ATOM 2766 H LEU A 781 56.594 20.874 19.248 1.00 0.00 H ATOM 2767 N GLN A 782 58.117 18.001 18.794 1.00 31.95 N ATOM 2768 CA GLN A 782 59.086 16.914 18.641 1.00 35.82 C ATOM 2769 C GLN A 782 59.376 16.275 20.031 1.00 37.37 C ATOM 2770 O GLN A 782 59.458 15.049 20.145 1.00 42.24 O ATOM 2771 CB GLN A 782 60.398 17.456 18.067 1.00 40.25 C ATOM 2772 CG GLN A 782 61.518 16.440 18.088 1.00 43.61 C ATOM 2773 CD GLN A 782 62.731 16.971 17.389 1.00 47.52 C ATOM 2774 OE1 GLN A 782 63.070 16.529 16.340 1.00 62.12 O ATOM 2775 NE2 GLN A 782 63.359 17.927 17.949 1.00 49.90 N ATOM 2776 HE22 GLN A 782 63.038 18.293 18.868 1.00 0.00 H ATOM 2777 HE21 GLN A 782 64.193 18.342 17.487 1.00 0.00 H ATOM 2778 H GLN A 782 58.382 18.990 18.613 1.00 0.00 H ATOM 2779 N ALA A 783 59.549 17.156 21.046 1.00 34.36 N ATOM 2780 CA ALA A 783 59.726 16.723 22.444 1.00 37.35 C ATOM 2781 C ALA A 783 58.563 15.852 22.889 1.00 33.22 C ATOM 2782 O ALA A 783 58.770 14.774 23.411 1.00 37.27 O ATOM 2783 CB ALA A 783 60.000 17.916 23.387 1.00 34.41 C ATOM 2784 H ALA A 783 59.557 18.174 20.831 1.00 0.00 H ATOM 2785 N LEU A 784 57.337 16.225 22.544 1.00 35.36 N ATOM 2786 CA LEU A 784 56.253 15.330 22.854 1.00 35.53 C ATOM 2787 C LEU A 784 56.262 14.027 22.124 1.00 39.30 C ATOM 2788 O LEU A 784 55.915 12.981 22.725 1.00 37.13 O ATOM 2789 CB LEU A 784 54.947 16.018 22.642 1.00 42.49 C ATOM 2790 CG LEU A 784 54.591 17.020 23.743 1.00 47.49 C ATOM 2791 CD1 LEU A 784 53.374 17.845 23.291 1.00 51.45 C ATOM 2792 CD2 LEU A 784 54.346 16.323 25.095 1.00 43.05 C ATOM 2793 H LEU A 784 57.165 17.133 22.066 1.00 0.00 H ATOM 2794 N ALA A 785 56.601 14.059 20.822 1.00 37.86 N ATOM 2795 CA ALA A 785 56.672 12.813 20.012 1.00 36.40 C ATOM 2796 C ALA A 785 57.675 11.774 20.587 1.00 34.68 C ATOM 2797 O ALA A 785 57.464 10.541 20.490 1.00 34.71 O ATOM 2798 CB ALA A 785 57.035 13.120 18.554 1.00 41.63 C ATOM 2799 H ALA A 785 56.817 14.972 20.374 1.00 0.00 H ATOM 2800 N GLN A 786 58.748 12.291 21.147 1.00 33.91 N ATOM 2801 CA GLN A 786 59.783 11.499 21.787 1.00 40.61 C ATOM 2802 C GLN A 786 59.601 11.354 23.326 1.00 47.03 C ATOM 2803 O GLN A 786 60.522 10.886 23.984 1.00 43.13 O ATOM 2804 CB GLN A 786 61.103 12.205 21.560 1.00 39.87 C ATOM 2805 CG GLN A 786 61.523 12.213 20.100 1.00 41.43 C ATOM 2806 CD GLN A 786 62.677 13.146 19.848 1.00 49.57 C ATOM 2807 OE1 GLN A 786 63.190 13.834 20.723 1.00 56.30 O ATOM 2808 NE2 GLN A 786 63.053 13.218 18.634 1.00 66.80 N ATOM 2809 HE22 GLN A 786 62.599 12.622 17.913 1.00 0.00 H ATOM 2810 HE21 GLN A 786 63.814 13.873 18.363 1.00 0.00 H ATOM 2811 H GLN A 786 58.861 13.325 21.130 1.00 0.00 H ATOM 2812 N ALA A 787 58.470 11.768 23.900 1.00 44.44 N ATOM 2813 CA ALA A 787 58.211 11.548 25.342 1.00 42.03 C ATOM 2814 C ALA A 787 58.020 10.054 25.706 1.00 42.32 C ATOM 2815 O ALA A 787 57.581 9.241 24.893 1.00 42.12 O ATOM 2816 CB ALA A 787 56.985 12.390 25.828 1.00 40.86 C ATOM 2817 H ALA A 787 57.755 12.255 23.323 1.00 0.00 H ATOM 2818 N PRO A 788 58.267 9.687 26.967 1.00 41.34 N ATOM 2819 CA PRO A 788 58.038 8.286 27.352 1.00 40.18 C ATOM 2820 C PRO A 788 56.623 7.835 27.077 1.00 38.56 C ATOM 2821 O PRO A 788 55.678 8.560 27.309 1.00 43.05 O ATOM 2822 CB PRO A 788 58.324 8.285 28.867 1.00 41.79 C ATOM 2823 CG PRO A 788 59.220 9.438 29.083 1.00 45.37 C ATOM 2824 CD PRO A 788 58.768 10.494 28.091 1.00 44.33 C ATOM 2825 N PRO A 789 56.444 6.618 26.605 1.00 43.98 N ATOM 2826 CA PRO A 789 55.067 6.100 26.415 1.00 40.09 C ATOM 2827 C PRO A 789 54.194 6.104 27.662 1.00 41.72 C ATOM 2828 O PRO A 789 52.967 6.246 27.575 1.00 41.55 O ATOM 2829 CB PRO A 789 55.292 4.657 25.940 1.00 41.40 C ATOM 2830 CG PRO A 789 56.618 4.756 25.253 1.00 42.44 C ATOM 2831 CD PRO A 789 57.463 5.755 25.989 1.00 41.82 C ATOM 2832 N VAL A 790 54.809 5.923 28.816 1.00 39.02 N ATOM 2833 CA VAL A 790 54.066 6.005 30.075 1.00 40.45 C ATOM 2834 C VAL A 790 53.366 7.396 30.238 1.00 37.64 C ATOM 2835 O VAL A 790 52.251 7.503 30.763 1.00 35.79 O ATOM 2836 CB VAL A 790 55.040 5.691 31.242 1.00 38.15 C ATOM 2837 CG1 VAL A 790 54.481 6.119 32.576 1.00 41.65 C ATOM 2838 CG2 VAL A 790 55.364 4.207 31.269 1.00 38.67 C ATOM 2839 H VAL A 790 55.829 5.721 28.831 1.00 0.00 H ATOM 2840 N TYR A 791 54.055 8.462 29.835 1.00 36.47 N ATOM 2841 CA TYR A 791 53.526 9.840 29.907 1.00 35.63 C ATOM 2842 C TYR A 791 52.424 10.034 28.810 1.00 35.62 C ATOM 2843 O TYR A 791 51.295 10.498 29.080 1.00 35.35 O ATOM 2844 CB TYR A 791 54.699 10.830 29.740 1.00 37.30 C ATOM 2845 CG TYR A 791 54.243 12.261 29.716 1.00 35.65 C ATOM 2846 CD1 TYR A 791 53.793 12.904 30.885 1.00 37.70 C ATOM 2847 CD2 TYR A 791 54.220 12.947 28.532 1.00 40.84 C ATOM 2848 CE1 TYR A 791 53.315 14.194 30.851 1.00 42.63 C ATOM 2849 CE2 TYR A 791 53.780 14.252 28.486 1.00 46.54 C ATOM 2850 CZ TYR A 791 53.312 14.856 29.633 1.00 42.82 C ATOM 2851 OH TYR A 791 52.909 16.131 29.500 1.00 53.80 O ATOM 2852 HH TYR A 791 52.594 16.469 30.375 1.00 0.00 H ATOM 2853 H TYR A 791 55.011 8.318 29.451 1.00 0.00 H ATOM 2854 N LEU A 792 52.738 9.598 27.607 1.00 35.49 N ATOM 2855 CA LEU A 792 51.824 9.773 26.467 1.00 41.10 C ATOM 2856 C LEU A 792 50.606 8.945 26.647 1.00 38.23 C ATOM 2857 O LEU A 792 49.520 9.455 26.415 1.00 36.41 O ATOM 2858 CB LEU A 792 52.499 9.377 25.151 1.00 39.45 C ATOM 2859 CG LEU A 792 53.616 10.302 24.699 1.00 39.22 C ATOM 2860 CD1 LEU A 792 54.138 9.785 23.380 1.00 42.75 C ATOM 2861 CD2 LEU A 792 53.143 11.714 24.545 1.00 37.32 C ATOM 2862 H LEU A 792 53.650 9.121 27.460 1.00 0.00 H ATOM 2863 N ASP A 793 50.752 7.734 27.183 1.00 38.04 N ATOM 2864 CA ASP A 793 49.558 6.900 27.506 1.00 39.66 C ATOM 2865 C ASP A 793 48.555 7.586 28.383 1.00 40.95 C ATOM 2866 O ASP A 793 47.430 7.246 28.354 1.00 39.56 O ATOM 2867 CB ASP A 793 49.891 5.536 28.128 1.00 48.26 C ATOM 2868 CG ASP A 793 50.448 4.522 27.109 1.00 67.91 C ATOM 2869 OD1 ASP A 793 50.620 4.874 25.916 1.00 80.53 O ATOM 2870 OD2 ASP A 793 50.752 3.361 27.490 1.00 77.90 O ATOM 2871 H ASP A 793 51.706 7.367 27.378 1.00 0.00 H ATOM 2872 N VAL A 794 48.930 8.616 29.114 1.00 42.41 N ATOM 2873 CA VAL A 794 48.052 9.171 30.094 1.00 44.43 C ATOM 2874 C VAL A 794 47.630 10.597 29.720 1.00 46.30 C ATOM 2875 O VAL A 794 46.933 11.240 30.483 1.00 43.50 O ATOM 2876 CB VAL A 794 48.875 9.040 31.441 1.00 51.62 C ATOM 2877 CG1 VAL A 794 49.213 10.347 32.059 1.00 46.79 C ATOM 2878 CG2 VAL A 794 48.250 8.068 32.402 1.00 47.69 C ATOM 2879 H VAL A 794 49.875 9.029 28.976 1.00 0.00 H ATOM 2880 N LEU A 795 48.081 11.118 28.580 1.00 45.07 N ATOM 2881 CA LEU A 795 47.611 12.434 28.080 1.00 52.93 C ATOM 2882 C LEU A 795 46.171 12.405 27.516 1.00 54.83 C ATOM 2883 O LEU A 795 45.778 11.449 26.877 1.00 64.70 O ATOM 2884 CB LEU A 795 48.551 12.959 26.994 1.00 51.68 C ATOM 2885 CG LEU A 795 49.912 13.489 27.360 1.00 53.53 C ATOM 2886 CD1 LEU A 795 50.433 14.384 26.256 1.00 49.06 C ATOM 2887 CD2 LEU A 795 49.855 14.258 28.672 1.00 47.26 C ATOM 2888 H LEU A 795 48.782 10.588 28.025 1.00 0.00 H ATOM 2889 N GLY A 796 45.399 13.450 27.777 1.00 61.69 N ATOM 2890 HN3 GLY A 796 44.567 13.139 28.318 1.00 0.00 H ATOM 2891 HN2 GLY A 796 45.090 13.883 26.883 1.00 0.00 H ATOM 2892 HN1 GLY A 796 45.936 14.146 28.333 1.00 0.00 H TER 2893 GLY A 796 HETATM 2894 NA NA A 1 50.336 31.931 4.841 1.00 47.23 NA HETATM 2895 O HOH 2 38.487 40.473 11.152 1.00 41.50 O HETATM 2896 O HOH 3 38.239 18.540 2.533 1.00 62.29 O HETATM 2897 O HOH 4 46.377 1.049 10.819 1.00 50.59 O HETATM 2898 O HOH 5 57.604 8.723 22.246 1.00 48.01 O HETATM 2899 O HOH 6 50.630 37.672 8.002 1.00 53.76 O HETATM 2900 O HOH 7 73.040 33.373 -7.629 1.00 47.76 O HETATM 2901 O HOH 8 62.739 8.679 -5.013 1.00 42.76 O HETATM 2902 O HOH 9 63.748 15.372 1.371 1.00 39.97 O HETATM 2903 O HOH 10 69.881 11.518 -23.399 1.00 56.34 O HETATM 2904 O HOH 11 40.012 13.238 16.997 1.00 43.08 O HETATM 2905 O HOH 12 42.090 18.014 2.143 1.00 39.64 O HETATM 2906 O HOH 13 56.236 19.521 -21.692 1.00 48.56 O HETATM 2907 O HOH 14 51.062 5.628 32.153 1.00 46.07 O HETATM 2908 O HOH 15 60.795 14.250 24.990 1.00 37.93 O HETATM 2909 O HOH 16 62.705 23.696 16.671 1.00 48.85 O HETATM 2910 O HOH 17 53.396 21.799 -0.656 1.00 26.02 O HETATM 2911 O HOH 18 34.393 25.044 -1.649 1.00 46.94 O HETATM 2912 O HOH 19 47.330 9.049 0.905 1.00 48.07 O HETATM 2913 O HOH 20 57.368 28.562 8.379 1.00 31.90 O HETATM 2914 O HOH 21 57.207 4.791 29.098 1.00 48.23 O HETATM 2915 O HOH 22 41.900 12.729 1.098 1.00 41.55 O HETATM 2916 O HOH 23 36.597 25.389 1.507 1.00 41.27 O HETATM 2917 O HOH 24 41.763 40.855 12.296 1.00 44.68 O HETATM 2918 O HOH 25 39.640 33.337 14.244 1.00 45.31 O HETATM 2919 O HOH 26 38.895 10.586 8.975 1.00 40.68 O HETATM 2920 O HOH 27 41.271 18.508 5.906 1.00 38.59 O HETATM 2921 O HOH 28 51.153 24.374 -2.704 1.00 33.12 O HETATM 2922 O HOH 29 41.648 29.594 9.408 1.00 36.16 O HETATM 2923 O HOH 30 48.629 24.667 -3.652 1.00 36.48 O HETATM 2924 O HOH 31 46.591 6.679 -10.702 1.00 65.00 O HETATM 2925 O HOH 32 54.821 33.072 14.055 1.00 49.74 O HETATM 2926 O HOH 33 49.827 28.603 4.652 1.00 25.65 O HETATM 2927 O HOH 34 50.724 16.941 -1.953 1.00 28.98 O HETATM 2928 O HOH 35 67.136 30.745 -7.187 1.00 53.85 O HETATM 2929 O HOH 36 38.857 26.653 2.372 1.00 36.14 O HETATM 2930 O HOH 37 56.827 30.427 6.300 1.00 38.81 O HETATM 2931 O HOH 38 48.232 2.474 13.451 1.00 56.03 O HETATM 2932 O HOH 39 37.260 22.587 22.449 1.00 53.03 O HETATM 2933 O HOH 40 56.548 9.399 18.146 1.00 52.77 O HETATM 2934 O HOH 41 56.836 3.443 10.048 1.00 61.45 O HETATM 2935 O HOH 42 46.683 29.342 3.559 1.00 38.07 O HETATM 2936 O HOH 43 47.807 31.113 5.475 1.00 36.22 O HETATM 2937 O HOH 44 56.164 29.993 10.323 1.00 42.48 O HETATM 2938 O HOH 45 66.291 27.077 7.136 1.00 40.25 O HETATM 2939 O HOH 46 53.144 30.643 -2.414 1.00 41.25 O HETATM 2940 O HOH 47 46.162 26.368 3.134 1.00 31.83 O HETATM 2941 O HOH 48 64.301 18.806 -0.136 1.00 34.98 O HETATM 2942 O HOH 49 56.967 31.058 12.715 1.00 46.30 O HETATM 2943 O HOH 50 48.702 22.542 -5.456 1.00 32.79 O HETATM 2944 O HOH 51 50.015 4.040 15.365 1.00 55.59 O HETATM 2945 O HOH 52 60.083 34.016 -7.865 1.00 58.95 O HETATM 2946 O HOH 53 46.820 14.679 -3.665 1.00 52.00 O HETATM 2947 O HOH 54 46.151 1.596 16.794 1.00 61.96 O HETATM 2948 O HOH 55 26.530 30.401 3.148 1.00 57.68 O HETATM 2949 O HOH 56 67.438 17.696 6.479 1.00 54.21 O HETATM 2950 O HOH 57 52.633 23.718 -11.948 1.00 42.53 O HETATM 2951 O HOH 58 66.974 32.217 -4.810 1.00 56.72 O HETATM 2952 O HOH 59 52.469 3.267 -4.065 1.00 57.56 O HETATM 2953 O HOH 60 34.992 22.113 12.651 1.00 42.52 O HETATM 2954 O HOH 61 47.315 11.105 -2.500 1.00 51.98 O HETATM 2955 O HOH 62 39.301 7.967 9.278 1.00 56.51 O HETATM 2956 O HOH 63 47.731 24.920 -9.261 1.00 57.92 O HETATM 2957 O HOH 64 44.162 19.207 3.375 1.00 32.77 O HETATM 2958 O HOH 65 56.096 1.146 -18.928 1.00 63.66 O HETATM 2959 O HOH 66 72.238 25.283 -6.936 1.00 40.83 O HETATM 2960 O HOH 67 40.118 17.492 3.969 1.00 57.25 O HETATM 2961 O HOH 68 60.768 7.211 -21.065 1.00 40.82 O HETATM 2962 O HOH 69 35.605 16.488 6.409 1.00 45.38 O HETATM 2963 O HOH 70 59.176 -3.997 1.965 1.00 50.53 O HETATM 2964 O HOH 71 46.574 24.025 -6.751 1.00 34.77 O HETATM 2965 O HOH 72 52.070 0.431 5.942 1.00 51.94 O HETATM 2966 O HOH 73 58.317 6.438 -0.449 1.00 38.36 O HETATM 2967 O HOH 74 65.444 32.694 -2.852 1.00 59.51 O HETATM 2968 O HOH 75 51.594 6.894 -5.489 1.00 66.30 O HETATM 2969 O HOH 76 50.430 16.712 -4.859 1.00 33.29 O HETATM 2970 O HOH 77 57.450 36.742 6.649 1.00 48.90 O HETATM 2971 O HOH 78 46.778 17.086 -3.025 1.00 48.69 O HETATM 2972 O HOH 79 68.877 20.932 -9.186 1.00 52.90 O HETATM 2973 O HOH 80 45.108 31.400 -4.108 1.00 49.20 O HETATM 2974 O HOH 81 50.173 5.293 -17.722 1.00 37.83 O HETATM 2975 O HOH 82 48.856 18.599 -5.872 1.00 39.96 O HETATM 2976 O HOH 83 47.244 6.498 21.398 1.00 48.87 O HETATM 2977 O HOH 84 36.888 18.234 -3.762 1.00 54.04 O HETATM 2978 O HOH 85 56.819 20.529 -14.927 1.00 52.35 O HETATM 2979 O HOH 86 40.781 28.259 14.508 1.00 51.61 O HETATM 2980 O HOH 87 61.559 16.626 13.566 1.00 53.37 O HETATM 2981 O HOH 88 40.284 28.572 11.900 1.00 47.90 O HETATM 2982 O HOH 89 51.888 6.430 21.638 1.00 60.70 O HETATM 2983 O HOH 90 35.115 23.033 15.359 1.00 50.78 O HETATM 2984 O HOH 91 53.108 3.910 13.169 1.00 72.42 O HETATM 2985 O HOH 92 47.106 6.663 1.977 1.00 55.66 O HETATM 2986 O HOH 93 30.344 25.900 0.783 1.00 67.97 O HETATM 2987 O HOH 94 52.419 39.671 1.406 1.00 65.41 O HETATM 2988 O HOH 95 49.195 2.394 17.963 1.00 59.41 O HETATM 2989 CAP UNN A 96 55.650 25.872 -2.164 1.00 -0.03 C HETATM 2990 CAK UNN A 96 55.912 27.113 -1.576 1.00 0.16 C HETATM 2991 FBF UNN A 96 55.253 28.267 -1.966 1.00 -0.19 F HETATM 2992 CAQ UNN A 96 56.908 27.212 -0.651 1.00 0.16 C HETATM 2993 FBG UNN A 96 57.121 28.335 -0.108 1.00 -0.19 F HETATM 2994 CAD UNN A 96 57.668 26.087 -0.263 1.00 -0.04 C HETATM 2995 CAA UNN A 96 57.396 24.849 -0.845 1.00 -0.07 C HETATM 2996 CAN UNN A 96 56.369 24.720 -1.806 1.00 -0.04 C HETATM 2997 CBJ UNN A 96 56.050 23.454 -2.391 1.00 0.06 C HETATM 2998 CAZ UNN A 96 57.221 22.489 -2.237 1.00 -0.02 C HETATM 2999 NAB UNN A 96 56.912 21.484 -3.283 1.00 0.24 N HETATM 3000 CBD UNN A 96 58.034 20.499 -3.456 1.00 -0.01 C HETATM 3001 CAW UNN A 96 57.696 19.436 -4.473 1.00 0.09 C HETATM 3002 OAM UNN A 96 56.733 18.508 -4.005 1.00 -0.38 O HETATM 3003 CBI UNN A 96 56.171 17.639 -4.968 1.00 0.04 C HETATM 3004 H12 UNN A 96 55.443 16.973 -4.481 1.00 0.05 H HETATM 3005 H13 UNN A 96 56.968 17.037 -5.428 1.00 0.05 H HETATM 3006 H14 UNN A 96 55.664 18.231 -5.744 1.00 0.05 H HETATM 3007 H10 UNN A 96 58.616 18.889 -4.727 1.00 0.06 H HETATM 3008 H11 UNN A 96 57.301 19.927 -5.375 1.00 0.06 H HETATM 3009 H8 UNN A 96 58.235 20.015 -2.489 1.00 0.08 H HETATM 3010 H9 UNN A 96 58.933 21.038 -3.790 1.00 0.08 H HETATM 3011 CAR UNN A 96 56.536 22.263 -4.467 1.00 -0.01 C HETATM 3012 CBH UNN A 96 55.875 23.623 -3.921 1.00 0.10 C HETATM 3013 NAJ UNN A 96 54.514 23.637 -4.428 1.00 -0.26 N HETATM 3014 CAS UNN A 96 54.102 24.323 -5.512 1.00 0.29 C HETATM 3015 OBA UNN A 96 54.859 25.161 -6.006 1.00 -0.39 O HETATM 3016 NAO UNN A 96 52.824 24.119 -5.913 1.00 -0.20 N HETATM 3017 CAV UNN A 96 52.369 24.589 -7.073 1.00 0.19 C HETATM 3018 CAG UNN A 96 51.259 25.239 -7.399 1.00 0.01 C HETATM 3019 CBE UNN A 96 50.235 25.859 -6.475 1.00 -0.05 C HETATM 3020 H20 UNN A 96 50.431 25.537 -5.442 1.00 0.03 H HETATM 3021 H21 UNN A 96 49.227 25.536 -6.775 1.00 0.03 H HETATM 3022 H22 UNN A 96 50.302 26.955 -6.536 1.00 0.03 H HETATM 3023 CAX UNN A 96 51.273 25.452 -8.731 1.00 0.12 C HETATM 3024 OAI UNN A 96 50.366 26.140 -9.496 1.00 -0.32 O HETATM 3025 CAL UNN A 96 50.811 26.110 -10.896 1.00 0.06 C HETATM 3026 CAF UNN A 96 50.265 27.348 -11.637 1.00 -0.04 C HETATM 3027 H25 UNN A 96 50.599 27.325 -12.685 1.00 0.03 H HETATM 3028 H26 UNN A 96 50.642 28.261 -11.153 1.00 0.03 H HETATM 3029 H27 UNN A 96 49.166 27.341 -11.602 1.00 0.03 H HETATM 3030 H23 UNN A 96 50.434 25.197 -11.381 1.00 0.06 H HETATM 3031 H24 UNN A 96 51.910 26.117 -10.931 1.00 0.06 H HETATM 3032 NAT UNN A 96 52.304 24.814 -9.263 1.00 -0.22 N HETATM 3033 NAY UNN A 96 52.983 24.256 -8.277 1.00 -0.16 N HETATM 3034 CAE UNN A 96 54.119 23.549 -8.530 1.00 0.10 C HETATM 3035 CAU UNN A 96 54.422 22.338 -7.905 1.00 -0.03 C HETATM 3036 CAH UNN A 96 55.570 21.590 -8.135 1.00 -0.07 C HETATM 3037 CBB UNN A 96 56.476 22.060 -9.048 1.00 -0.07 C HETATM 3038 CBC UNN A 96 56.162 23.226 -9.746 1.00 -0.07 C HETATM 3039 CAC UNN A 96 55.008 23.978 -9.495 1.00 -0.03 C HETATM 3040 H32 UNN A 96 54.815 24.887 -10.053 1.00 0.06 H HETATM 3041 H31 UNN A 96 56.843 23.566 -10.518 1.00 0.06 H HETATM 3042 H30 UNN A 96 57.411 21.540 -9.223 1.00 0.05 H HETATM 3043 H29 UNN A 96 55.744 20.660 -7.606 1.00 0.06 H HETATM 3044 H28 UNN A 96 53.708 21.952 -7.186 1.00 0.06 H HETATM 3045 H19 UNN A 96 52.206 23.601 -5.322 1.00 0.23 H HETATM 3046 H18 UNN A 96 53.831 23.097 -3.936 1.00 0.19 H HETATM 3047 H17 UNN A 96 56.405 24.521 -4.269 1.00 0.06 H HETATM 3048 H15 UNN A 96 55.810 21.704 -5.076 1.00 0.08 H HETATM 3049 H16 UNN A 96 57.426 22.489 -5.073 1.00 0.08 H HETATM 3050 H7 UNN A 96 56.105 20.953 -2.995 1.00 0.20 H HETATM 3051 H5 UNN A 96 57.239 22.035 -1.235 1.00 0.08 H HETATM 3052 H6 UNN A 96 58.182 22.988 -2.430 1.00 0.08 H HETATM 3053 H4 UNN A 96 55.139 23.044 -1.930 1.00 0.05 H HETATM 3054 H3 UNN A 96 57.977 23.980 -0.558 1.00 0.05 H HETATM 3055 H2 UNN A 96 58.453 26.184 0.478 1.00 0.06 H HETATM 3056 H1 UNN A 96 54.872 25.797 -2.915 1.00 0.05 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 467 468 479 480 481 CONECT 479 467 CONECT 480 467 CONECT 481 467 CONECT 567 568 572 573 574 CONECT 572 567 CONECT 573 567 CONECT 574 567 CONECT 2889 2882 2890 2891 2892 CONECT 2890 2889 CONECT 2891 2889 CONECT 2892 2889 CONECT 2989 2990 2996 3056 CONECT 2990 2989 2991 2992 CONECT 2991 2990 CONECT 2992 2990 2993 2994 CONECT 2993 2992 CONECT 2994 2992 2995 3055 CONECT 2995 2994 2996 3054 CONECT 2996 2989 2995 2997 CONECT 2997 2996 2998 3012 3053 CONECT 2998 2997 2999 3051 3052 CONECT 2999 2998 3000 3011 3050 CONECT 3000 2999 3001 3009 3010 CONECT 3001 3000 3002 3007 3008 CONECT 3002 3001 3003 CONECT 3003 3002 3004 3005 3006 CONECT 3004 3003 CONECT 3005 3003 CONECT 3006 3003 CONECT 3007 3001 CONECT 3008 3001 CONECT 3009 3000 CONECT 3010 3000 CONECT 3011 2999 3012 3048 3049 CONECT 3012 2997 3011 3013 3047 CONECT 3013 3012 3014 3046 CONECT 3014 3013 3015 3016 CONECT 3015 3014 CONECT 3016 3014 3017 3045 CONECT 3017 3016 3018 3033 CONECT 3018 3017 3019 3023 CONECT 3019 3018 3020 3021 3022 CONECT 3020 3019 CONECT 3021 3019 CONECT 3022 3019 CONECT 3023 3018 3024 3032 CONECT 3024 3023 3025 CONECT 3025 3024 3026 3030 3031 CONECT 3026 3025 3027 3028 3029 CONECT 3027 3026 CONECT 3028 3026 CONECT 3029 3026 CONECT 3030 3025 CONECT 3031 3025 CONECT 3032 3023 3033 CONECT 3033 3017 3032 3034 CONECT 3034 3033 3035 3039 CONECT 3035 3034 3036 3044 CONECT 3036 3035 3037 3043 CONECT 3037 3036 3038 3042 CONECT 3038 3037 3039 3041 CONECT 3039 3034 3038 3040 CONECT 3040 3039 CONECT 3041 3038 CONECT 3042 3037 CONECT 3043 3036 CONECT 3044 3035 CONECT 3045 3016 CONECT 3046 3013 CONECT 3047 3012 CONECT 3048 3011 CONECT 3049 3011 CONECT 3050 2999 CONECT 3051 2998 CONECT 3052 2998 CONECT 3053 2997 CONECT 3054 2995 CONECT 3055 2994 CONECT 3056 2989 MASTER 0 0 0 0 0 0 0 0 3053 3 84 24 END
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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
5h3q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
tropomyosin receptor kinase A
Ligand Name
7HF
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
IC50=6nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Bioorg. Med. Chem. Lett. Vol. 27: pp. 1233-1236
Ligand Properties
Formula
C
2
6
H
3
2
F
2
N
5
O
3
Molecular Weight
500.561
Exact Mass
500.247
No. of atoms
68
No. of bonds
71
Polar Surface Area
81.85
LOGP Value
3.95 (
Computed with XLOGP3
)
4.71 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
COCC[N@@H+]1C[C@H]([C@@H](C1)c1ccc(c(c1)F)F)NC(=O)Nc1c(C)c(nn1c1ccccc1)OCC
InChI String
InChI=1S/C26H31F2N5O3/c1-4-36-25-17(2)24(33(31-25)19-8-6-5-7-9-19)30-26(34)29-23-16-32(12-13-35-3)15-20(23)18-10-11-21(27)22(28)14-18/h5-11,14,20,23H,4,12-13,15-16H2,1-3H3,(H2,29,30,34)/p+1/t20-,23+/m0/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):
P04629
Entrez Gene ID
NCBI Entrez Gene ID:
4914
ASD
Information of known allosteric effects of PDB entries
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