Browse entries in the PDBbind-CN Database
HEADER 5G57_COMPLEX COMPND 5G57_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 333 VAL THR ALA ILE THR LYS VAL GLU ARG GLU ALA VAL LEU SEQRES 2 A 333 VAL CYS GLU LEU PRO SER PHE ASP VAL THR ASP VAL GLU SEQRES 3 A 333 PHE ASP LEU PHE ARG ALA ARG GLU SER THR ASP LYS PRO SEQRES 4 A 333 LEU ASP VAL ALA ALA ALA ILE ALA TYR ARG LEU LEU LEU SEQRES 5 A 333 GLY SER GLY LEU PRO GLN LYS PHE GLY CYS SER ASP GLU SEQRES 6 A 333 VAL LEU LEU ASN PHE ILE LEU GLN CYS ARG LYS LYS TYR SEQRES 7 A 333 ARG ASN VAL PRO TYR HIS ASN PHE TYR HIS VAL VAL ASP SEQRES 8 A 333 VAL CYS GLN THR ILE HIS THR PHE LEU TYR ARG GLY ASN SEQRES 9 A 333 VAL TYR GLU LYS LEU THR GLU LEU GLU CYS PHE VAL LEU SEQRES 10 A 333 LEU ILE THR ALA LEU VAL HIS ASP LEU ASP HIS MET GLY SEQRES 11 A 333 LEU ASN ASN SER PHE TYR LEU LYS THR GLU SER PRO LEU SEQRES 12 A 333 GLY ILE LEU SER SER ALA SER GLY ASN THR SER VAL LEU SEQRES 13 A 333 GLU VAL HIS HIS CYS ASN LEU ALA VAL GLU ILE LEU SER SEQRES 14 A 333 ASP PRO GLU SER ASP VAL PHE ASP GLY LEU GLU GLY ALA SEQRES 15 A 333 GLU ARG THR LEU ALA PHE ARG SER MET ILE ASP CYS VAL SEQRES 16 A 333 LEU ALA THR ASP MET ALA LYS HIS GLY SER ALA LEU GLU SEQRES 17 A 333 ALA PHE LEU ALA SER ALA ALA ASP GLN SER SER ASP GLU SEQRES 18 A 333 ALA ALA PHE HIS ARG MET THR MET GLU ILE ILE LEU LYS SEQRES 19 A 333 ALA GLY ASP ILE SER ASN VAL THR LYS PRO PHE ASP ILE SEQRES 20 A 333 SER ARG GLN TRP ALA MET ALA VAL THR GLU GLU PHE TYR SEQRES 21 A 333 ARG GLN GLY ASP MET GLU LYS GLU ARG GLY VAL GLU VAL SEQRES 22 A 333 LEU PRO MET PHE ASP ARG SER LYS ASN MET GLU LEU ALA SEQRES 23 A 333 LYS GLY GLN ILE GLY PHE ILE ASP PHE VAL ALA ALA PRO SEQRES 24 A 333 PHE PHE GLN LYS ILE VAL ASP ALA CYS LEU GLN GLY MET SEQRES 25 A 333 GLN TRP THR VAL ASP ARG ILE LYS SER ASN ARG ALA GLN SEQRES 26 A 333 TRP GLU ARG VAL LEU GLU THR ARG HET ZN A 1 1 HET MG A 2 1 HET UNN A 609 83 ATOM 1 N VAL A 586 38.245 -18.644 -6.870 1.00 72.35 N ATOM 2 CA VAL A 586 38.991 -17.697 -5.972 1.00 68.06 C ATOM 3 C VAL A 586 39.890 -18.482 -4.990 1.00 58.56 C ATOM 4 O VAL A 586 39.519 -19.548 -4.499 1.00 55.88 O ATOM 5 CB VAL A 586 38.011 -16.742 -5.217 1.00 73.43 C ATOM 6 CG1 VAL A 586 38.757 -15.768 -4.306 1.00 72.87 C ATOM 7 CG2 VAL A 586 37.155 -15.946 -6.202 1.00 76.56 C ATOM 8 HN3 VAL A 586 37.650 -19.271 -6.292 1.00 0.00 H ATOM 9 HN2 VAL A 586 38.925 -19.213 -7.413 1.00 0.00 H ATOM 10 HN1 VAL A 586 37.646 -18.101 -7.524 1.00 0.00 H ATOM 11 N THR A 587 41.067 -17.938 -4.712 1.00 54.86 N ATOM 12 CA THR A 587 42.051 -18.570 -3.828 1.00 53.01 C ATOM 13 C THR A 587 41.664 -18.502 -2.351 1.00 51.63 C ATOM 14 O THR A 587 41.206 -17.459 -1.890 1.00 49.47 O ATOM 15 CB THR A 587 43.372 -17.832 -3.968 1.00 55.52 C ATOM 16 OG1 THR A 587 43.495 -17.384 -5.323 1.00 61.85 O ATOM 17 CG2 THR A 587 44.536 -18.732 -3.593 1.00 62.47 C ATOM 18 HG1 THR A 587 44.352 -16.900 -5.433 1.00 0.00 H ATOM 19 H THR A 587 41.303 -17.020 -5.141 1.00 0.00 H ATOM 20 N ALA A 588 41.889 -19.590 -1.611 1.00 49.41 N ATOM 21 CA ALA A 588 41.453 -19.705 -0.208 1.00 48.19 C ATOM 22 C ALA A 588 42.166 -18.705 0.689 1.00 45.09 C ATOM 23 O ALA A 588 43.312 -18.381 0.441 1.00 45.33 O ATOM 24 CB ALA A 588 41.690 -21.118 0.312 1.00 44.94 C ATOM 25 H ALA A 588 42.393 -20.390 -2.043 1.00 0.00 H ATOM 26 N ILE A 589 41.470 -18.207 1.716 1.00 41.62 N ATOM 27 CA ILE A 589 42.074 -17.305 2.698 1.00 37.89 C ATOM 28 C ILE A 589 42.987 -18.153 3.606 1.00 39.62 C ATOM 29 O ILE A 589 42.591 -19.229 4.036 1.00 39.56 O ATOM 30 CB ILE A 589 40.998 -16.591 3.570 1.00 36.75 C ATOM 31 CG1 ILE A 589 40.044 -15.725 2.705 1.00 34.03 C ATOM 32 CG2 ILE A 589 41.634 -15.762 4.688 1.00 33.11 C ATOM 33 CD1 ILE A 589 40.741 -14.723 1.822 1.00 35.20 C ATOM 34 H ILE A 589 40.469 -18.468 1.820 1.00 0.00 H ATOM 35 N THR A 590 44.186 -17.639 3.893 1.00 42.80 N ATOM 36 CA THR A 590 45.195 -18.331 4.725 1.00 41.46 C ATOM 37 C THR A 590 45.010 -18.075 6.217 1.00 44.46 C ATOM 38 O THR A 590 44.411 -17.070 6.629 1.00 43.73 O ATOM 39 CB THR A 590 46.640 -17.893 4.361 1.00 41.49 C ATOM 40 OG1 THR A 590 46.809 -16.494 4.628 1.00 44.43 O ATOM 41 CG2 THR A 590 46.951 -18.127 2.910 1.00 41.38 C ATOM 42 HG1 THR A 590 46.164 -15.975 4.085 1.00 0.00 H ATOM 43 H THR A 590 44.423 -16.701 3.511 1.00 0.00 H ATOM 44 N LYS A 591 45.577 -18.974 7.028 1.00 43.62 N ATOM 45 CA LYS A 591 45.644 -18.825 8.480 1.00 45.74 C ATOM 46 C LYS A 591 46.287 -17.489 8.881 1.00 42.91 C ATOM 47 O LYS A 591 45.818 -16.809 9.814 1.00 42.70 O ATOM 48 CB LYS A 591 46.454 -19.994 9.077 1.00 52.97 C ATOM 49 CG LYS A 591 46.602 -20.002 10.598 1.00 62.07 C ATOM 50 CD LYS A 591 47.963 -20.557 11.011 1.00 68.87 C ATOM 51 CE LYS A 591 48.130 -20.604 12.521 1.00 69.32 C ATOM 52 NZ LYS A 591 47.108 -21.486 13.154 1.00 71.00 N ATOM 53 HZ1 LYS A 591 46.157 -21.124 12.938 1.00 0.00 H ATOM 54 HZ2 LYS A 591 47.206 -22.452 12.780 1.00 0.00 H ATOM 55 HZ3 LYS A 591 47.250 -21.496 14.184 1.00 0.00 H ATOM 56 H LYS A 591 45.993 -19.826 6.602 1.00 0.00 H ATOM 57 N VAL A 592 47.352 -17.130 8.172 1.00 39.51 N ATOM 58 CA VAL A 592 48.134 -15.941 8.485 1.00 43.12 C ATOM 59 C VAL A 592 47.313 -14.662 8.229 1.00 43.02 C ATOM 60 O VAL A 592 47.383 -13.677 8.991 1.00 39.42 O ATOM 61 CB VAL A 592 49.473 -15.940 7.671 1.00 46.73 C ATOM 62 CG1 VAL A 592 50.213 -14.619 7.819 1.00 47.06 C ATOM 63 CG2 VAL A 592 50.379 -17.073 8.157 1.00 46.15 C ATOM 64 H VAL A 592 47.638 -17.719 7.364 1.00 0.00 H ATOM 65 N GLU A 593 46.548 -14.685 7.143 1.00 44.17 N ATOM 66 CA GLU A 593 45.640 -13.579 6.818 1.00 42.23 C ATOM 67 C GLU A 593 44.610 -13.426 7.909 1.00 35.33 C ATOM 68 O GLU A 593 44.403 -12.320 8.383 1.00 36.46 O ATOM 69 CB GLU A 593 44.962 -13.802 5.473 1.00 43.75 C ATOM 70 CG GLU A 593 45.846 -13.476 4.282 1.00 45.12 C ATOM 71 CD GLU A 593 45.245 -13.958 2.963 1.00 46.08 C ATOM 72 OE1 GLU A 593 44.868 -15.149 2.835 1.00 43.44 O ATOM 73 OE2 GLU A 593 45.140 -13.131 2.042 1.00 53.28 O ATOM 74 H GLU A 593 46.594 -15.507 6.508 1.00 0.00 H ATOM 75 N ARG A 594 43.993 -14.533 8.331 1.00 36.13 N ATOM 76 CA ARG A 594 43.022 -14.473 9.435 1.00 36.15 C ATOM 77 C ARG A 594 43.651 -13.939 10.726 1.00 36.62 C ATOM 78 O ARG A 594 43.040 -13.120 11.414 1.00 33.00 O ATOM 79 CB ARG A 594 42.309 -15.818 9.690 1.00 35.73 C ATOM 80 CG ARG A 594 41.366 -16.268 8.562 1.00 34.86 C ATOM 81 CD ARG A 594 40.473 -17.427 9.020 1.00 38.08 C ATOM 82 NE ARG A 594 41.264 -18.650 9.136 1.00 37.52 N ATOM 83 CZ ARG A 594 41.660 -19.408 8.116 1.00 41.61 C ATOM 84 NH1 ARG A 594 41.302 -19.135 6.864 1.00 39.66 N ATOM 85 NH2 ARG A 594 42.414 -20.485 8.351 1.00 42.91 N ATOM 86 HE ARG A 594 41.540 -18.952 10.092 1.00 0.00 H ATOM 87 HH12 ARG A 594 41.626 -19.744 6.086 1.00 0.00 H ATOM 88 HH11 ARG A 594 40.698 -18.312 6.663 1.00 0.00 H ATOM 89 HH22 ARG A 594 42.728 -21.083 7.560 1.00 0.00 H ATOM 90 HH21 ARG A 594 42.687 -20.726 9.325 1.00 0.00 H ATOM 91 H ARG A 594 44.201 -15.445 7.876 1.00 0.00 H ATOM 92 N GLU A 595 44.868 -14.396 11.054 1.00 38.58 N ATOM 93 CA GLU A 595 45.503 -14.018 12.326 1.00 39.33 C ATOM 94 C GLU A 595 45.821 -12.531 12.421 1.00 36.07 C ATOM 95 O GLU A 595 45.674 -11.940 13.487 1.00 39.87 O ATOM 96 CB GLU A 595 46.762 -14.875 12.596 1.00 46.84 C ATOM 97 CG GLU A 595 46.435 -16.244 13.177 1.00 52.15 C ATOM 98 CD GLU A 595 45.808 -16.189 14.586 1.00 61.20 C ATOM 99 OE1 GLU A 595 46.169 -15.277 15.392 1.00 65.64 O ATOM 100 OE2 GLU A 595 44.967 -17.077 14.899 1.00 60.74 O ATOM 101 H GLU A 595 45.371 -15.028 10.399 1.00 0.00 H ATOM 102 N ALA A 596 46.227 -11.928 11.308 1.00 37.14 N ATOM 103 CA ALA A 596 46.469 -10.481 11.243 1.00 40.02 C ATOM 104 C ALA A 596 45.217 -9.636 11.553 1.00 41.44 C ATOM 105 O ALA A 596 45.326 -8.505 12.033 1.00 37.40 O ATOM 106 CB ALA A 596 47.045 -10.100 9.878 1.00 39.49 C ATOM 107 H ALA A 596 46.379 -12.501 10.453 1.00 0.00 H ATOM 108 N VAL A 597 44.025 -10.180 11.309 1.00 36.33 N ATOM 109 CA VAL A 597 42.806 -9.480 11.735 1.00 35.00 C ATOM 110 C VAL A 597 42.553 -9.762 13.198 1.00 35.85 C ATOM 111 O VAL A 597 42.175 -8.856 13.963 1.00 38.05 O ATOM 112 CB VAL A 597 41.573 -9.933 10.911 1.00 33.92 C ATOM 113 CG1 VAL A 597 40.298 -9.256 11.421 1.00 35.54 C ATOM 114 CG2 VAL A 597 41.816 -9.627 9.452 1.00 32.35 C ATOM 115 H VAL A 597 43.958 -11.095 10.820 1.00 0.00 H ATOM 116 N LEU A 598 42.721 -11.027 13.581 1.00 36.39 N ATOM 117 CA LEU A 598 42.333 -11.462 14.918 1.00 39.61 C ATOM 118 C LEU A 598 43.146 -10.793 16.053 1.00 38.51 C ATOM 119 O LEU A 598 42.604 -10.566 17.139 1.00 39.69 O ATOM 120 CB LEU A 598 42.337 -13.000 15.013 1.00 40.15 C ATOM 121 CG LEU A 598 41.198 -13.722 14.271 1.00 43.41 C ATOM 122 CD1 LEU A 598 41.405 -15.221 14.343 1.00 45.78 C ATOM 123 CD2 LEU A 598 39.834 -13.361 14.836 1.00 42.76 C ATOM 124 H LEU A 598 43.134 -11.713 12.918 1.00 0.00 H ATOM 125 N VAL A 599 44.393 -10.424 15.789 1.00 44.20 N ATOM 126 CA VAL A 599 45.193 -9.619 16.764 1.00 47.64 C ATOM 127 C VAL A 599 44.693 -8.188 17.039 1.00 51.24 C ATOM 128 O VAL A 599 45.053 -7.609 18.064 1.00 46.82 O ATOM 129 CB VAL A 599 46.689 -9.470 16.367 1.00 49.37 C ATOM 130 CG1 VAL A 599 47.389 -10.825 16.316 1.00 51.89 C ATOM 131 CG2 VAL A 599 46.859 -8.695 15.062 1.00 48.47 C ATOM 132 H VAL A 599 44.824 -10.701 14.884 1.00 0.00 H ATOM 133 N CYS A 600 43.919 -7.593 16.124 1.00 48.35 N ATOM 134 CA CYS A 600 43.426 -6.221 16.312 1.00 43.74 C ATOM 135 C CYS A 600 42.394 -6.134 17.429 1.00 49.12 C ATOM 136 O CYS A 600 41.284 -6.664 17.298 1.00 49.59 O ATOM 137 CB CYS A 600 42.804 -5.696 15.024 1.00 42.44 C ATOM 138 SG CYS A 600 43.983 -5.647 13.670 1.00 44.72 S ATOM 139 H CYS A 600 43.661 -8.113 15.261 1.00 0.00 H ATOM 140 N GLU A 601 42.739 -5.447 18.515 1.00 46.66 N ATOM 141 CA GLU A 601 41.871 -5.415 19.685 1.00 49.38 C ATOM 142 C GLU A 601 40.916 -4.220 19.755 1.00 47.16 C ATOM 143 O GLU A 601 39.985 -4.229 20.580 1.00 45.47 O ATOM 144 CB GLU A 601 42.713 -5.533 20.961 1.00 56.57 C ATOM 145 CG GLU A 601 43.315 -6.924 21.112 1.00 60.71 C ATOM 146 CD GLU A 601 44.107 -7.084 22.388 1.00 65.98 C ATOM 147 OE1 GLU A 601 44.929 -6.192 22.691 1.00 70.08 O ATOM 148 OE2 GLU A 601 43.916 -8.109 23.071 1.00 65.76 O ATOM 149 H GLU A 601 43.639 -4.926 18.529 1.00 0.00 H ATOM 150 N LEU A 602 41.155 -3.200 18.929 1.00 46.05 N ATOM 151 CA LEU A 602 40.295 -2.014 18.864 1.00 47.95 C ATOM 152 C LEU A 602 40.115 -1.296 20.217 1.00 50.80 C ATOM 153 O LEU A 602 39.010 -0.842 20.532 1.00 44.98 O ATOM 154 CB LEU A 602 38.912 -2.394 18.281 1.00 45.90 C ATOM 155 CG LEU A 602 38.915 -3.172 16.962 1.00 47.39 C ATOM 156 CD1 LEU A 602 37.487 -3.450 16.520 1.00 45.25 C ATOM 157 CD2 LEU A 602 39.671 -2.405 15.889 1.00 48.18 C ATOM 158 H LEU A 602 41.986 -3.248 18.305 1.00 0.00 H ATOM 159 N PRO A 603 41.204 -1.178 21.021 1.00 54.34 N ATOM 160 CA PRO A 603 41.019 -0.556 22.345 1.00 55.88 C ATOM 161 C PRO A 603 40.496 0.874 22.227 1.00 50.35 C ATOM 162 O PRO A 603 40.975 1.633 21.375 1.00 53.92 O ATOM 163 CB PRO A 603 42.433 -0.576 22.946 1.00 56.06 C ATOM 164 CG PRO A 603 43.343 -0.590 21.767 1.00 55.76 C ATOM 165 CD PRO A 603 42.628 -1.449 20.748 1.00 55.94 C ATOM 166 N SER A 604 39.518 1.204 23.064 1.00 48.42 N ATOM 167 CA SER A 604 38.908 2.538 23.140 1.00 55.42 C ATOM 168 C SER A 604 37.858 2.845 22.032 1.00 52.30 C ATOM 169 O SER A 604 37.498 4.011 21.852 1.00 53.86 O ATOM 170 CB SER A 604 39.978 3.647 23.136 1.00 57.07 C ATOM 171 OG SER A 604 40.366 3.998 21.804 1.00 61.09 O ATOM 172 HG SER A 604 40.738 3.201 21.349 1.00 0.00 H ATOM 173 H SER A 604 39.161 0.469 23.708 1.00 0.00 H ATOM 174 N PHE A 605 37.394 1.834 21.295 1.00 48.37 N ATOM 175 CA PHE A 605 36.376 2.034 20.246 1.00 42.34 C ATOM 176 C PHE A 605 35.115 1.280 20.646 1.00 40.33 C ATOM 177 O PHE A 605 35.211 0.157 21.146 1.00 40.36 O ATOM 178 CB PHE A 605 36.894 1.518 18.896 1.00 42.93 C ATOM 179 CG PHE A 605 37.932 2.403 18.270 1.00 42.35 C ATOM 180 CD1 PHE A 605 37.576 3.647 17.757 1.00 46.60 C ATOM 181 CD2 PHE A 605 39.281 2.005 18.205 1.00 48.56 C ATOM 182 CE1 PHE A 605 38.537 4.486 17.183 1.00 48.50 C ATOM 183 CE2 PHE A 605 40.251 2.843 17.648 1.00 47.52 C ATOM 184 CZ PHE A 605 39.880 4.090 17.150 1.00 48.01 C ATOM 185 H PHE A 605 37.761 0.876 21.465 1.00 0.00 H ATOM 186 N ASP A 606 33.948 1.889 20.431 1.00 32.94 N ATOM 187 CA ASP A 606 32.682 1.195 20.542 1.00 31.06 C ATOM 188 C ASP A 606 32.127 1.184 19.131 1.00 29.77 C ATOM 189 O ASP A 606 31.579 2.184 18.672 1.00 29.69 O ATOM 190 CB ASP A 606 31.715 1.905 21.477 1.00 31.70 C ATOM 191 CG ASP A 606 30.397 1.155 21.623 1.00 34.41 C ATOM 192 OD1 ASP A 606 30.154 0.123 20.926 1.00 33.88 O ATOM 193 OD2 ASP A 606 29.578 1.583 22.443 1.00 35.43 O ATOM 194 H ASP A 606 33.947 2.897 20.175 1.00 0.00 H ATOM 195 N VAL A 607 32.268 0.048 18.461 1.00 30.31 N ATOM 196 CA VAL A 607 31.818 -0.097 17.079 1.00 30.02 C ATOM 197 C VAL A 607 30.300 -0.006 16.950 1.00 29.00 C ATOM 198 O VAL A 607 29.791 0.177 15.834 1.00 29.03 O ATOM 199 CB VAL A 607 32.348 -1.382 16.392 1.00 29.73 C ATOM 200 CG1 VAL A 607 33.860 -1.387 16.355 1.00 30.02 C ATOM 201 CG2 VAL A 607 31.809 -2.657 17.036 1.00 30.51 C ATOM 202 H VAL A 607 32.713 -0.764 18.934 1.00 0.00 H ATOM 203 N THR A 608 29.560 -0.154 18.042 1.00 27.34 N ATOM 204 CA THR A 608 28.105 -0.020 17.973 1.00 27.63 C ATOM 205 C THR A 608 27.575 1.405 18.056 1.00 27.82 C ATOM 206 O THR A 608 26.364 1.592 17.984 1.00 24.68 O ATOM 207 CB THR A 608 27.416 -0.852 19.075 1.00 31.72 C ATOM 208 OG1 THR A 608 27.535 -0.186 20.354 1.00 30.47 O ATOM 209 CG2 THR A 608 27.997 -2.299 19.087 1.00 31.39 C ATOM 210 HG1 THR A 608 28.493 -0.078 20.581 1.00 0.00 H ATOM 211 H THR A 608 30.017 -0.366 18.952 1.00 0.00 H ATOM 212 N ASP A 609 28.451 2.401 18.273 1.00 26.86 N ATOM 213 CA ASP A 609 28.011 3.751 18.691 1.00 28.45 C ATOM 214 C ASP A 609 27.741 4.651 17.477 1.00 26.55 C ATOM 215 O ASP A 609 28.484 4.583 16.515 1.00 26.75 O ATOM 216 CB ASP A 609 29.129 4.383 19.560 1.00 30.65 C ATOM 217 CG ASP A 609 28.669 5.616 20.312 1.00 36.90 C ATOM 218 OD1 ASP A 609 28.413 6.663 19.700 1.00 35.67 O ATOM 219 OD2 ASP A 609 28.562 5.549 21.549 1.00 47.30 O ATOM 220 H ASP A 609 29.467 2.218 18.144 1.00 0.00 H ATOM 221 N VAL A 610 26.744 5.528 17.540 1.00 26.10 N ATOM 222 CA VAL A 610 26.467 6.416 16.388 1.00 28.17 C ATOM 223 C VAL A 610 27.569 7.451 16.118 1.00 32.30 C ATOM 224 O VAL A 610 27.646 8.005 15.016 1.00 30.58 O ATOM 225 CB VAL A 610 25.111 7.130 16.472 1.00 31.57 C ATOM 226 CG1 VAL A 610 23.992 6.091 16.634 1.00 31.99 C ATOM 227 CG2 VAL A 610 25.067 8.174 17.588 1.00 32.30 C ATOM 228 H VAL A 610 26.159 5.590 18.398 1.00 0.00 H ATOM 229 N GLU A 611 28.414 7.701 17.119 1.00 30.97 N ATOM 230 CA GLU A 611 29.545 8.618 16.975 1.00 33.65 C ATOM 231 C GLU A 611 30.864 7.891 16.794 1.00 32.74 C ATOM 232 O GLU A 611 31.915 8.509 16.765 1.00 30.59 O ATOM 233 CB GLU A 611 29.577 9.575 18.168 1.00 36.33 C ATOM 234 CG GLU A 611 28.222 10.261 18.283 1.00 41.99 C ATOM 235 CD GLU A 611 28.230 11.570 19.015 1.00 51.12 C ATOM 236 OE1 GLU A 611 29.043 11.741 19.936 1.00 54.42 O ATOM 237 OE2 GLU A 611 27.365 12.405 18.684 1.00 57.59 O ATOM 238 H GLU A 611 28.264 7.228 18.033 1.00 0.00 H ATOM 239 N PHE A 612 30.817 6.588 16.547 1.00 27.68 N ATOM 240 CA PHE A 612 32.028 5.883 16.164 1.00 28.49 C ATOM 241 C PHE A 612 32.749 6.527 14.989 1.00 28.97 C ATOM 242 O PHE A 612 32.122 6.920 14.005 1.00 30.81 O ATOM 243 CB PHE A 612 31.692 4.443 15.807 1.00 28.67 C ATOM 244 CG PHE A 612 32.828 3.705 15.216 1.00 26.47 C ATOM 245 CD1 PHE A 612 33.832 3.220 16.031 1.00 29.44 C ATOM 246 CD2 PHE A 612 32.885 3.458 13.842 1.00 27.98 C ATOM 247 CE1 PHE A 612 34.889 2.509 15.487 1.00 29.60 C ATOM 248 CE2 PHE A 612 33.933 2.756 13.294 1.00 29.14 C ATOM 249 CZ PHE A 612 34.946 2.284 14.122 1.00 31.63 C ATOM 250 H PHE A 612 29.917 6.074 16.627 1.00 0.00 H ATOM 251 N ASP A 613 34.080 6.602 15.061 1.00 26.08 N ATOM 252 CA ASP A 613 34.884 7.339 14.088 1.00 28.29 C ATOM 253 C ASP A 613 35.840 6.404 13.352 1.00 29.56 C ATOM 254 O ASP A 613 36.921 6.085 13.845 1.00 27.84 O ATOM 255 CB ASP A 613 35.636 8.477 14.795 1.00 30.99 C ATOM 256 CG ASP A 613 36.345 9.412 13.849 1.00 33.03 C ATOM 257 OD1 ASP A 613 36.630 9.082 12.675 1.00 35.02 O ATOM 258 OD2 ASP A 613 36.666 10.532 14.301 1.00 39.06 O ATOM 259 H ASP A 613 34.565 6.116 15.842 1.00 0.00 H ATOM 260 N LEU A 614 35.452 5.974 12.137 1.00 27.56 N ATOM 261 CA LEU A 614 36.298 5.092 11.339 1.00 27.56 C ATOM 262 C LEU A 614 37.624 5.722 10.898 1.00 29.04 C ATOM 263 O LEU A 614 38.639 5.008 10.745 1.00 28.63 O ATOM 264 CB LEU A 614 35.528 4.566 10.123 1.00 29.59 C ATOM 265 CG LEU A 614 36.239 3.530 9.267 1.00 31.00 C ATOM 266 CD1 LEU A 614 36.624 2.277 10.051 1.00 28.85 C ATOM 267 CD2 LEU A 614 35.342 3.169 8.062 1.00 32.43 C ATOM 268 H LEU A 614 34.531 6.276 11.759 1.00 0.00 H ATOM 269 N PHE A 615 37.629 7.030 10.656 1.00 28.25 N ATOM 270 CA PHE A 615 38.885 7.717 10.308 1.00 30.85 C ATOM 271 C PHE A 615 39.919 7.630 11.460 1.00 30.20 C ATOM 272 O PHE A 615 41.086 7.321 11.219 1.00 31.78 O ATOM 273 CB PHE A 615 38.634 9.159 9.900 1.00 30.39 C ATOM 274 CG PHE A 615 37.886 9.291 8.595 1.00 29.03 C ATOM 275 CD1 PHE A 615 38.542 9.141 7.401 1.00 27.30 C ATOM 276 CD2 PHE A 615 36.526 9.531 8.580 1.00 27.31 C ATOM 277 CE1 PHE A 615 37.869 9.257 6.183 1.00 29.73 C ATOM 278 CE2 PHE A 615 35.838 9.628 7.370 1.00 27.78 C ATOM 279 CZ PHE A 615 36.514 9.517 6.165 1.00 26.28 C ATOM 280 H PHE A 615 36.742 7.570 10.713 1.00 0.00 H ATOM 281 N ARG A 616 39.450 7.833 12.694 1.00 33.04 N ATOM 282 CA ARG A 616 40.309 7.697 13.894 1.00 35.10 C ATOM 283 C ARG A 616 40.811 6.267 14.040 1.00 34.47 C ATOM 284 O ARG A 616 41.988 6.043 14.331 1.00 37.83 O ATOM 285 CB ARG A 616 39.602 8.127 15.177 1.00 37.05 C ATOM 286 CG ARG A 616 40.570 8.160 16.367 1.00 44.63 C ATOM 287 CD ARG A 616 39.956 8.787 17.610 1.00 51.96 C ATOM 288 NE ARG A 616 39.015 7.898 18.304 1.00 58.92 N ATOM 289 CZ ARG A 616 39.333 6.963 19.218 1.00 69.45 C ATOM 290 NH1 ARG A 616 40.604 6.721 19.577 1.00 74.21 N ATOM 291 NH2 ARG A 616 38.359 6.237 19.779 1.00 65.55 N ATOM 292 HE ARG A 616 38.008 8.001 18.067 1.00 0.00 H ATOM 293 HH12 ARG A 616 40.814 5.991 20.287 1.00 0.00 H ATOM 294 HH11 ARG A 616 41.379 7.264 19.145 1.00 0.00 H ATOM 295 HH22 ARG A 616 38.593 5.512 20.487 1.00 0.00 H ATOM 296 HH21 ARG A 616 37.368 6.398 19.507 1.00 0.00 H ATOM 297 H ARG A 616 38.451 8.095 12.817 1.00 0.00 H ATOM 298 N ALA A 617 39.920 5.296 13.819 1.00 32.69 N ATOM 299 CA ALA A 617 40.297 3.864 13.792 1.00 30.53 C ATOM 300 C ALA A 617 41.376 3.551 12.775 1.00 31.40 C ATOM 301 O ALA A 617 42.342 2.855 13.091 1.00 32.59 O ATOM 302 CB ALA A 617 39.070 2.981 13.562 1.00 32.53 C ATOM 303 H ALA A 617 38.925 5.555 13.660 1.00 0.00 H ATOM 304 N ARG A 618 41.250 4.070 11.563 1.00 30.45 N ATOM 305 CA ARG A 618 42.266 3.873 10.543 1.00 30.48 C ATOM 306 C ARG A 618 43.612 4.548 10.908 1.00 34.98 C ATOM 307 O ARG A 618 44.658 4.079 10.476 1.00 34.84 O ATOM 308 CB ARG A 618 41.831 4.461 9.211 1.00 30.97 C ATOM 309 CG ARG A 618 40.686 3.690 8.542 1.00 33.74 C ATOM 310 CD ARG A 618 39.963 4.593 7.536 1.00 31.99 C ATOM 311 NE ARG A 618 40.744 4.904 6.342 1.00 32.12 N ATOM 312 CZ ARG A 618 40.284 5.580 5.296 1.00 32.60 C ATOM 313 NH1 ARG A 618 39.029 6.029 5.252 1.00 33.62 N ATOM 314 NH2 ARG A 618 41.068 5.785 4.262 1.00 35.99 N ATOM 315 HE ARG A 618 41.729 4.573 6.309 1.00 0.00 H ATOM 316 HH12 ARG A 618 38.694 6.556 4.420 1.00 0.00 H ATOM 317 HH11 ARG A 618 38.385 5.852 6.049 1.00 0.00 H ATOM 318 HH22 ARG A 618 40.715 6.314 3.439 1.00 0.00 H ATOM 319 HH21 ARG A 618 42.041 5.419 4.267 1.00 0.00 H ATOM 320 H ARG A 618 40.404 4.631 11.336 1.00 0.00 H ATOM 321 N GLU A 619 43.568 5.690 11.592 1.00 37.51 N ATOM 322 CA GLU A 619 44.830 6.358 12.020 1.00 42.92 C ATOM 323 C GLU A 619 45.476 5.708 13.258 1.00 41.57 C ATOM 324 O GLU A 619 46.629 5.998 13.563 1.00 46.99 O ATOM 325 CB GLU A 619 44.622 7.866 12.231 1.00 44.21 C ATOM 326 CG GLU A 619 44.293 8.629 10.953 1.00 51.96 C ATOM 327 CD GLU A 619 45.364 8.475 9.866 1.00 65.52 C ATOM 328 OE1 GLU A 619 46.580 8.581 10.185 1.00 75.51 O ATOM 329 OE2 GLU A 619 44.994 8.248 8.687 1.00 69.47 O ATOM 330 H GLU A 619 42.650 6.117 11.828 1.00 0.00 H ATOM 331 N SER A 620 44.762 4.822 13.941 1.00 38.76 N ATOM 332 CA SER A 620 45.238 4.239 15.184 1.00 42.12 C ATOM 333 C SER A 620 46.344 3.185 15.019 1.00 43.85 C ATOM 334 O SER A 620 46.962 2.825 16.004 1.00 48.31 O ATOM 335 CB SER A 620 44.069 3.636 15.974 1.00 41.45 C ATOM 336 OG SER A 620 43.638 2.409 15.385 1.00 42.59 O ATOM 337 HG SER A 620 43.343 2.577 14.455 1.00 0.00 H ATOM 338 H SER A 620 43.832 4.536 13.575 1.00 0.00 H ATOM 339 N THR A 621 46.556 2.661 13.818 1.00 43.68 N ATOM 340 CA THR A 621 47.620 1.678 13.579 1.00 42.74 C ATOM 341 C THR A 621 48.137 1.846 12.186 1.00 40.87 C ATOM 342 O THR A 621 47.577 2.594 11.373 1.00 40.56 O ATOM 343 CB THR A 621 47.202 0.175 13.754 1.00 44.39 C ATOM 344 OG1 THR A 621 46.572 -0.331 12.566 1.00 41.72 O ATOM 345 CG2 THR A 621 46.318 -0.078 14.991 1.00 46.43 C ATOM 346 HG1 THR A 621 45.761 0.202 12.371 1.00 0.00 H ATOM 347 H THR A 621 45.952 2.955 13.024 1.00 0.00 H ATOM 348 N ASP A 622 49.229 1.151 11.909 1.00 40.80 N ATOM 349 CA ASP A 622 49.797 1.141 10.581 1.00 40.98 C ATOM 350 C ASP A 622 49.241 0.024 9.705 1.00 39.29 C ATOM 351 O ASP A 622 49.678 -0.100 8.570 1.00 38.65 O ATOM 352 CB ASP A 622 51.337 1.092 10.640 1.00 50.57 C ATOM 353 CG ASP A 622 51.873 -0.185 11.268 1.00 53.85 C ATOM 354 OD1 ASP A 622 51.306 -0.649 12.282 1.00 66.14 O ATOM 355 OD2 ASP A 622 52.871 -0.733 10.753 1.00 70.11 O ATOM 356 H ASP A 622 49.687 0.601 12.663 1.00 0.00 H ATOM 357 N LYS A 623 48.250 -0.746 10.189 1.00 37.98 N ATOM 358 CA LYS A 623 47.534 -1.754 9.346 1.00 39.74 C ATOM 359 C LYS A 623 46.002 -1.453 9.304 1.00 36.07 C ATOM 360 O LYS A 623 45.196 -2.181 9.881 1.00 34.69 O ATOM 361 CB LYS A 623 47.828 -3.171 9.855 1.00 41.99 C ATOM 362 CG LYS A 623 49.253 -3.640 9.537 1.00 45.96 C ATOM 363 CD LYS A 623 49.749 -4.698 10.520 1.00 55.40 C ATOM 364 CE LYS A 623 51.125 -4.367 11.103 1.00 63.38 C ATOM 365 NZ LYS A 623 52.164 -4.265 10.042 1.00 67.48 N ATOM 366 HZ1 LYS A 623 52.232 -5.171 9.537 1.00 0.00 H ATOM 367 HZ2 LYS A 623 51.902 -3.513 9.373 1.00 0.00 H ATOM 368 HZ3 LYS A 623 53.081 -4.040 10.477 1.00 0.00 H ATOM 369 H LYS A 623 47.971 -0.637 11.185 1.00 0.00 H ATOM 370 N PRO A 624 45.625 -0.329 8.699 1.00 32.62 N ATOM 371 CA PRO A 624 44.207 0.095 8.718 1.00 31.67 C ATOM 372 C PRO A 624 43.240 -0.904 8.014 1.00 30.37 C ATOM 373 O PRO A 624 42.090 -1.023 8.421 1.00 30.48 O ATOM 374 CB PRO A 624 44.250 1.453 8.014 1.00 30.09 C ATOM 375 CG PRO A 624 45.438 1.364 7.129 1.00 30.75 C ATOM 376 CD PRO A 624 46.448 0.660 7.991 1.00 31.77 C ATOM 377 N LEU A 625 43.737 -1.657 7.046 1.00 29.96 N ATOM 378 CA LEU A 625 42.921 -2.690 6.391 1.00 32.30 C ATOM 379 C LEU A 625 42.580 -3.834 7.341 1.00 33.59 C ATOM 380 O LEU A 625 41.505 -4.446 7.221 1.00 28.65 O ATOM 381 CB LEU A 625 43.598 -3.216 5.136 1.00 31.52 C ATOM 382 CG LEU A 625 43.633 -2.269 3.951 1.00 33.23 C ATOM 383 CD1 LEU A 625 44.546 -2.806 2.882 1.00 34.51 C ATOM 384 CD2 LEU A 625 42.240 -2.035 3.373 1.00 34.34 C ATOM 385 H LEU A 625 44.722 -1.516 6.743 1.00 0.00 H ATOM 386 N ASP A 626 43.483 -4.123 8.291 1.00 30.85 N ATOM 387 CA ASP A 626 43.234 -5.151 9.294 1.00 30.90 C ATOM 388 C ASP A 626 42.284 -4.670 10.356 1.00 29.38 C ATOM 389 O ASP A 626 41.384 -5.405 10.763 1.00 29.79 O ATOM 390 CB ASP A 626 44.573 -5.649 9.915 1.00 33.94 C ATOM 391 CG ASP A 626 45.363 -6.522 8.959 1.00 39.24 C ATOM 392 OD1 ASP A 626 44.736 -7.142 8.052 1.00 36.80 O ATOM 393 OD2 ASP A 626 46.611 -6.602 9.103 1.00 41.40 O ATOM 394 H ASP A 626 44.382 -3.601 8.312 1.00 0.00 H ATOM 395 N VAL A 627 42.473 -3.437 10.814 1.00 27.92 N ATOM 396 CA VAL A 627 41.554 -2.823 11.749 1.00 30.40 C ATOM 397 C VAL A 627 40.131 -2.758 11.137 1.00 28.50 C ATOM 398 O VAL A 627 39.173 -3.035 11.825 1.00 28.14 O ATOM 399 CB VAL A 627 42.030 -1.412 12.182 1.00 32.26 C ATOM 400 CG1 VAL A 627 40.928 -0.648 12.903 1.00 34.59 C ATOM 401 CG2 VAL A 627 43.230 -1.538 13.113 1.00 34.29 C ATOM 402 H VAL A 627 43.303 -2.899 10.492 1.00 0.00 H ATOM 403 N ALA A 628 40.038 -2.385 9.866 1.00 27.31 N ATOM 404 CA ALA A 628 38.716 -2.285 9.155 1.00 26.34 C ATOM 405 C ALA A 628 38.015 -3.657 9.109 1.00 26.73 C ATOM 406 O ALA A 628 36.834 -3.770 9.462 1.00 26.26 O ATOM 407 CB ALA A 628 38.918 -1.754 7.767 1.00 26.65 C ATOM 408 H ALA A 628 40.908 -2.154 9.345 1.00 0.00 H ATOM 409 N ALA A 629 38.761 -4.698 8.740 1.00 26.91 N ATOM 410 CA ALA A 629 38.221 -6.074 8.768 1.00 26.92 C ATOM 411 C ALA A 629 37.814 -6.531 10.175 1.00 27.94 C ATOM 412 O ALA A 629 36.770 -7.158 10.327 1.00 26.83 O ATOM 413 CB ALA A 629 39.196 -7.031 8.116 1.00 26.42 C ATOM 414 H ALA A 629 39.740 -4.540 8.427 1.00 0.00 H ATOM 415 N ALA A 630 38.589 -6.165 11.208 1.00 26.12 N ATOM 416 CA ALA A 630 38.239 -6.490 12.593 1.00 24.77 C ATOM 417 C ALA A 630 37.001 -5.788 13.079 1.00 24.44 C ATOM 418 O ALA A 630 36.221 -6.381 13.859 1.00 26.32 O ATOM 419 CB ALA A 630 39.391 -6.130 13.535 1.00 27.08 C ATOM 420 H ALA A 630 39.464 -5.635 11.020 1.00 0.00 H ATOM 421 N ILE A 631 36.795 -4.547 12.610 1.00 25.52 N ATOM 422 CA ILE A 631 35.549 -3.808 12.905 1.00 26.47 C ATOM 423 C ILE A 631 34.365 -4.598 12.321 1.00 23.97 C ATOM 424 O ILE A 631 33.406 -4.874 13.016 1.00 27.31 O ATOM 425 CB ILE A 631 35.574 -2.357 12.369 1.00 25.60 C ATOM 426 CG1 ILE A 631 36.597 -1.525 13.176 1.00 27.42 C ATOM 427 CG2 ILE A 631 34.196 -1.702 12.434 1.00 26.07 C ATOM 428 CD1 ILE A 631 37.068 -0.245 12.527 1.00 28.36 C ATOM 429 H ILE A 631 37.528 -4.096 12.026 1.00 0.00 H ATOM 430 N ALA A 632 34.465 -4.986 11.076 1.00 23.49 N ATOM 431 CA ALA A 632 33.348 -5.728 10.412 1.00 24.98 C ATOM 432 C ALA A 632 33.085 -7.054 11.113 1.00 25.14 C ATOM 433 O ALA A 632 31.948 -7.407 11.403 1.00 23.68 O ATOM 434 CB ALA A 632 33.673 -5.955 8.937 1.00 25.25 C ATOM 435 H ALA A 632 35.332 -4.776 10.541 1.00 0.00 H ATOM 436 N TYR A 633 34.165 -7.764 11.429 1.00 26.93 N ATOM 437 CA TYR A 633 34.082 -9.044 12.171 1.00 26.26 C ATOM 438 C TYR A 633 33.410 -8.882 13.540 1.00 26.72 C ATOM 439 O TYR A 633 32.488 -9.616 13.878 1.00 25.12 O ATOM 440 CB TYR A 633 35.494 -9.592 12.282 1.00 28.33 C ATOM 441 CG TYR A 633 35.646 -10.953 12.920 1.00 29.73 C ATOM 442 CD1 TYR A 633 35.148 -12.101 12.314 1.00 32.47 C ATOM 443 CD2 TYR A 633 36.370 -11.106 14.103 1.00 34.07 C ATOM 444 CE1 TYR A 633 35.354 -13.358 12.882 1.00 30.90 C ATOM 445 CE2 TYR A 633 36.563 -12.347 14.681 1.00 33.66 C ATOM 446 CZ TYR A 633 36.059 -13.474 14.053 1.00 35.06 C ATOM 447 OH TYR A 633 36.246 -14.716 14.611 1.00 36.22 O ATOM 448 HH TYR A 633 35.832 -14.738 15.510 1.00 0.00 H ATOM 449 H TYR A 633 35.100 -7.408 11.145 1.00 0.00 H ATOM 450 N ARG A 634 33.817 -7.866 14.301 1.00 26.06 N ATOM 451 CA ARG A 634 33.199 -7.588 15.588 1.00 28.41 C ATOM 452 C ARG A 634 31.730 -7.201 15.517 1.00 28.89 C ATOM 453 O ARG A 634 30.916 -7.618 16.385 1.00 28.47 O ATOM 454 CB ARG A 634 33.989 -6.482 16.340 1.00 31.35 C ATOM 455 CG ARG A 634 33.301 -6.054 17.646 1.00 37.08 C ATOM 456 CD ARG A 634 34.125 -5.103 18.499 1.00 39.99 C ATOM 457 NE ARG A 634 35.410 -5.693 18.888 1.00 39.48 N ATOM 458 CZ ARG A 634 36.297 -5.106 19.682 1.00 42.15 C ATOM 459 NH1 ARG A 634 36.066 -3.897 20.203 1.00 45.27 N ATOM 460 NH2 ARG A 634 37.427 -5.743 19.958 1.00 41.57 N ATOM 461 HE ARG A 634 35.642 -6.636 18.516 1.00 0.00 H ATOM 462 HH12 ARG A 634 36.774 -3.454 20.823 1.00 0.00 H ATOM 463 HH11 ARG A 634 35.178 -3.399 19.988 1.00 0.00 H ATOM 464 HH22 ARG A 634 38.135 -5.301 20.578 1.00 0.00 H ATOM 465 HH21 ARG A 634 37.605 -6.685 19.554 1.00 0.00 H ATOM 466 H ARG A 634 34.593 -7.259 13.967 1.00 0.00 H ATOM 467 N LEU A 635 31.368 -6.385 14.518 1.00 27.31 N ATOM 468 CA LEU A 635 29.964 -5.997 14.334 1.00 29.21 C ATOM 469 C LEU A 635 29.137 -7.232 14.075 1.00 27.24 C ATOM 470 O LEU A 635 28.052 -7.381 14.652 1.00 28.16 O ATOM 471 CB LEU A 635 29.785 -5.046 13.143 1.00 27.34 C ATOM 472 CG LEU A 635 30.229 -3.625 13.409 1.00 30.34 C ATOM 473 CD1 LEU A 635 30.512 -2.907 12.107 1.00 30.39 C ATOM 474 CD2 LEU A 635 29.175 -2.906 14.236 1.00 29.87 C ATOM 475 H LEU A 635 32.091 -6.022 13.864 1.00 0.00 H ATOM 476 N LEU A 636 29.636 -8.110 13.208 1.00 26.28 N ATOM 477 CA LEU A 636 28.834 -9.292 12.792 1.00 28.22 C ATOM 478 C LEU A 636 28.689 -10.315 13.938 1.00 28.44 C ATOM 479 O LEU A 636 27.581 -10.766 14.211 1.00 26.13 O ATOM 480 CB LEU A 636 29.364 -9.944 11.513 1.00 28.88 C ATOM 481 CG LEU A 636 28.777 -9.463 10.176 1.00 30.34 C ATOM 482 CD1 LEU A 636 27.327 -9.916 9.991 1.00 29.30 C ATOM 483 CD2 LEU A 636 28.877 -7.978 10.029 1.00 34.42 C ATOM 484 H LEU A 636 30.590 -7.969 12.820 1.00 0.00 H ATOM 485 N LEU A 637 29.774 -10.610 14.648 1.00 30.12 N ATOM 486 CA LEU A 637 29.674 -11.481 15.858 1.00 31.64 C ATOM 487 C LEU A 637 28.859 -10.883 16.982 1.00 31.04 C ATOM 488 O LEU A 637 28.067 -11.593 17.580 1.00 32.19 O ATOM 489 CB LEU A 637 31.041 -11.866 16.377 1.00 34.05 C ATOM 490 CG LEU A 637 31.836 -12.746 15.433 1.00 35.45 C ATOM 491 CD1 LEU A 637 33.228 -13.010 15.993 1.00 39.66 C ATOM 492 CD2 LEU A 637 31.102 -14.057 15.202 1.00 36.82 C ATOM 493 H LEU A 637 30.699 -10.232 14.359 1.00 0.00 H ATOM 494 N GLY A 638 28.981 -9.575 17.211 1.00 28.10 N ATOM 495 CA GLY A 638 28.236 -8.903 18.263 1.00 29.56 C ATOM 496 C GLY A 638 26.750 -8.919 18.068 1.00 31.96 C ATOM 497 O GLY A 638 25.983 -8.853 19.047 1.00 30.20 O ATOM 498 H GLY A 638 29.629 -9.018 16.618 1.00 0.00 H ATOM 499 N SER A 639 26.322 -8.997 16.801 1.00 27.72 N ATOM 500 CA SER A 639 24.901 -9.057 16.512 1.00 28.76 C ATOM 501 C SER A 639 24.320 -10.385 17.006 1.00 27.23 C ATOM 502 O SER A 639 23.110 -10.469 17.243 1.00 29.39 O ATOM 503 CB SER A 639 24.655 -8.936 15.001 1.00 28.02 C ATOM 504 OG SER A 639 25.135 -10.093 14.328 1.00 27.50 O ATOM 505 HG SER A 639 26.107 -10.189 14.491 1.00 0.00 H ATOM 506 H SER A 639 27.010 -9.015 16.022 1.00 0.00 H ATOM 507 N GLY A 640 25.173 -11.407 17.065 1.00 28.78 N ATOM 508 CA GLY A 640 24.765 -12.769 17.462 1.00 32.69 C ATOM 509 C GLY A 640 24.085 -13.519 16.318 1.00 31.06 C ATOM 510 O GLY A 640 23.633 -14.649 16.491 1.00 29.40 O ATOM 511 H GLY A 640 26.170 -11.238 16.821 1.00 0.00 H ATOM 512 N LEU A 641 24.041 -12.905 15.125 1.00 26.72 N ATOM 513 CA LEU A 641 23.305 -13.485 14.007 1.00 24.75 C ATOM 514 C LEU A 641 23.993 -14.624 13.251 1.00 24.44 C ATOM 515 O LEU A 641 23.345 -15.627 12.968 1.00 26.89 O ATOM 516 CB LEU A 641 22.945 -12.375 13.029 1.00 24.92 C ATOM 517 CG LEU A 641 22.014 -11.295 13.586 1.00 26.06 C ATOM 518 CD1 LEU A 641 22.025 -10.108 12.640 1.00 27.72 C ATOM 519 CD2 LEU A 641 20.633 -11.835 13.759 1.00 28.14 C ATOM 520 H LEU A 641 24.540 -12.001 14.996 1.00 0.00 H ATOM 521 N PRO A 642 25.292 -14.500 12.935 1.00 24.10 N ATOM 522 CA PRO A 642 25.938 -15.566 12.166 1.00 25.04 C ATOM 523 C PRO A 642 25.854 -16.942 12.816 1.00 29.44 C ATOM 524 O PRO A 642 25.549 -17.932 12.149 1.00 27.63 O ATOM 525 CB PRO A 642 27.406 -15.129 12.105 1.00 25.76 C ATOM 526 CG PRO A 642 27.380 -13.646 12.367 1.00 23.85 C ATOM 527 CD PRO A 642 26.226 -13.413 13.273 1.00 24.86 C ATOM 528 N GLN A 643 26.099 -16.955 14.120 1.00 30.01 N ATOM 529 CA GLN A 643 25.941 -18.108 15.008 1.00 34.81 C ATOM 530 C GLN A 643 24.565 -18.779 14.801 1.00 34.06 C ATOM 531 O GLN A 643 24.474 -19.999 14.611 1.00 30.81 O ATOM 532 CB GLN A 643 26.106 -17.664 16.495 1.00 37.71 C ATOM 533 CG GLN A 643 27.482 -17.059 16.957 1.00 44.68 C ATOM 534 CD GLN A 643 27.741 -15.547 16.623 1.00 46.87 C ATOM 535 OE1 GLN A 643 27.690 -15.164 15.449 1.00 42.86 O ATOM 536 NE2 GLN A 643 28.102 -14.707 17.654 1.00 36.54 N ATOM 537 HE22 GLN A 643 28.134 -15.065 18.630 1.00 0.00 H ATOM 538 HE21 GLN A 643 28.343 -13.715 17.456 1.00 0.00 H ATOM 539 H GLN A 643 26.433 -16.068 14.549 1.00 0.00 H ATOM 540 N LYS A 644 23.500 -17.974 14.787 1.00 27.80 N ATOM 541 CA LYS A 644 22.161 -18.477 14.622 1.00 27.16 C ATOM 542 C LYS A 644 21.886 -19.131 13.303 1.00 27.86 C ATOM 543 O LYS A 644 20.943 -19.917 13.221 1.00 29.41 O ATOM 544 CB LYS A 644 21.105 -17.356 14.838 1.00 29.89 C ATOM 545 CG LYS A 644 21.061 -16.874 16.283 1.00 33.72 C ATOM 546 CD LYS A 644 20.099 -15.718 16.492 1.00 35.30 C ATOM 547 CE LYS A 644 20.185 -15.255 17.942 1.00 36.59 C ATOM 548 NZ LYS A 644 18.942 -14.604 18.416 1.00 36.41 N ATOM 549 HZ1 LYS A 644 18.743 -13.769 17.828 1.00 0.00 H ATOM 550 HZ2 LYS A 644 18.151 -15.276 18.345 1.00 0.00 H ATOM 551 HZ3 LYS A 644 19.061 -14.311 19.407 1.00 0.00 H ATOM 552 H LYS A 644 23.642 -16.950 14.899 1.00 0.00 H ATOM 553 N PHE A 645 22.658 -18.800 12.269 1.00 26.15 N ATOM 554 CA PHE A 645 22.406 -19.297 10.921 1.00 25.83 C ATOM 555 C PHE A 645 23.490 -20.249 10.439 1.00 27.51 C ATOM 556 O PHE A 645 23.632 -20.459 9.253 1.00 25.36 O ATOM 557 CB PHE A 645 22.192 -18.102 9.969 1.00 25.14 C ATOM 558 CG PHE A 645 20.916 -17.357 10.286 1.00 23.35 C ATOM 559 CD1 PHE A 645 19.700 -17.976 10.124 1.00 24.72 C ATOM 560 CD2 PHE A 645 20.950 -16.092 10.847 1.00 23.84 C ATOM 561 CE1 PHE A 645 18.511 -17.315 10.440 1.00 23.73 C ATOM 562 CE2 PHE A 645 19.785 -15.445 11.199 1.00 22.58 C ATOM 563 CZ PHE A 645 18.565 -16.059 11.009 1.00 22.65 C ATOM 564 H PHE A 645 23.467 -18.166 12.428 1.00 0.00 H ATOM 565 N GLY A 646 24.209 -20.854 11.378 1.00 26.52 N ATOM 566 CA GLY A 646 25.186 -21.889 11.061 1.00 28.49 C ATOM 567 C GLY A 646 26.434 -21.391 10.386 1.00 29.05 C ATOM 568 O GLY A 646 27.123 -22.172 9.709 1.00 29.67 O ATOM 569 H GLY A 646 24.071 -20.580 12.372 1.00 0.00 H ATOM 570 N CYS A 647 26.756 -20.105 10.548 1.00 28.09 N ATOM 571 CA CYS A 647 27.961 -19.532 9.982 1.00 26.55 C ATOM 572 C CYS A 647 29.043 -19.482 11.069 1.00 28.66 C ATOM 573 O CYS A 647 28.939 -18.707 12.032 1.00 28.21 O ATOM 574 CB CYS A 647 27.696 -18.104 9.462 1.00 28.32 C ATOM 575 SG CYS A 647 29.155 -17.290 8.746 1.00 29.19 S ATOM 576 H CYS A 647 26.120 -19.494 11.099 1.00 0.00 H ATOM 577 N SER A 648 30.109 -20.245 10.902 1.00 28.75 N ATOM 578 CA SER A 648 31.174 -20.280 11.900 1.00 30.15 C ATOM 579 C SER A 648 31.965 -18.988 11.883 1.00 31.28 C ATOM 580 O SER A 648 31.952 -18.243 10.886 1.00 29.53 O ATOM 581 CB SER A 648 32.138 -21.451 11.603 1.00 30.62 C ATOM 582 OG SER A 648 32.864 -21.262 10.402 1.00 27.14 O ATOM 583 HG SER A 648 33.465 -22.035 10.256 1.00 0.00 H ATOM 584 H SER A 648 30.191 -20.830 10.046 1.00 0.00 H ATOM 585 N ASP A 649 32.717 -18.764 12.963 1.00 30.64 N ATOM 586 CA ASP A 649 33.623 -17.627 13.059 1.00 30.99 C ATOM 587 C ASP A 649 34.616 -17.606 11.914 1.00 27.84 C ATOM 588 O ASP A 649 34.912 -16.549 11.372 1.00 29.34 O ATOM 589 CB ASP A 649 34.355 -17.602 14.416 1.00 31.98 C ATOM 590 CG ASP A 649 33.405 -17.405 15.628 1.00 37.99 C ATOM 591 OD1 ASP A 649 32.189 -17.134 15.464 1.00 35.78 O ATOM 592 OD2 ASP A 649 33.891 -17.538 16.781 1.00 40.51 O ATOM 593 H ASP A 649 32.654 -19.424 13.764 1.00 0.00 H ATOM 594 N GLU A 650 35.120 -18.763 11.511 1.00 28.46 N ATOM 595 CA GLU A 650 36.135 -18.806 10.470 1.00 27.66 C ATOM 596 C GLU A 650 35.572 -18.498 9.057 1.00 27.09 C ATOM 597 O GLU A 650 36.217 -17.854 8.265 1.00 28.53 O ATOM 598 CB GLU A 650 36.786 -20.191 10.452 1.00 33.60 C ATOM 599 CG GLU A 650 37.906 -20.390 9.412 1.00 37.63 C ATOM 600 CD GLU A 650 38.629 -21.738 9.583 1.00 45.40 C ATOM 601 OE1 GLU A 650 38.214 -22.528 10.453 1.00 51.18 O ATOM 602 OE2 GLU A 650 39.608 -22.015 8.849 1.00 48.01 O ATOM 603 H GLU A 650 34.787 -19.649 11.943 1.00 0.00 H ATOM 604 N VAL A 651 34.406 -19.038 8.751 1.00 26.13 N ATOM 605 CA VAL A 651 33.743 -18.768 7.489 1.00 25.88 C ATOM 606 C VAL A 651 33.423 -17.247 7.401 1.00 25.27 C ATOM 607 O VAL A 651 33.633 -16.641 6.363 1.00 25.35 O ATOM 608 CB VAL A 651 32.490 -19.680 7.296 1.00 26.19 C ATOM 609 CG1 VAL A 651 31.640 -19.220 6.094 1.00 27.43 C ATOM 610 CG2 VAL A 651 32.946 -21.135 7.078 1.00 27.07 C ATOM 611 H VAL A 651 33.950 -19.675 9.435 1.00 0.00 H ATOM 612 N LEU A 652 32.920 -16.651 8.489 1.00 26.75 N ATOM 613 CA LEU A 652 32.655 -15.196 8.515 1.00 25.57 C ATOM 614 C LEU A 652 33.884 -14.401 8.185 1.00 27.81 C ATOM 615 O LEU A 652 33.854 -13.472 7.340 1.00 25.27 O ATOM 616 CB LEU A 652 32.118 -14.765 9.875 1.00 28.23 C ATOM 617 CG LEU A 652 31.811 -13.293 10.079 1.00 28.93 C ATOM 618 CD1 LEU A 652 30.646 -12.875 9.173 1.00 29.19 C ATOM 619 CD2 LEU A 652 31.468 -13.013 11.534 1.00 29.89 C ATOM 620 H LEU A 652 32.711 -17.222 9.333 1.00 0.00 H ATOM 621 N LEU A 653 34.980 -14.731 8.867 1.00 25.63 N ATOM 622 CA LEU A 653 36.224 -14.013 8.655 1.00 25.30 C ATOM 623 C LEU A 653 36.762 -14.240 7.259 1.00 23.07 C ATOM 624 O LEU A 653 37.252 -13.287 6.618 1.00 25.79 O ATOM 625 CB LEU A 653 37.288 -14.358 9.758 1.00 26.86 C ATOM 626 CG LEU A 653 38.564 -13.497 9.709 1.00 31.04 C ATOM 627 CD1 LEU A 653 38.286 -11.999 9.690 1.00 30.39 C ATOM 628 CD2 LEU A 653 39.478 -13.840 10.905 1.00 35.74 C ATOM 629 H LEU A 653 34.944 -15.509 9.556 1.00 0.00 H ATOM 630 N ASN A 654 36.655 -15.456 6.726 1.00 22.62 N ATOM 631 CA ASN A 654 37.072 -15.704 5.358 1.00 23.72 C ATOM 632 C ASN A 654 36.255 -14.824 4.327 1.00 24.35 C ATOM 633 O ASN A 654 36.777 -14.274 3.379 1.00 23.14 O ATOM 634 CB ASN A 654 36.843 -17.159 4.957 1.00 26.17 C ATOM 635 CG ASN A 654 37.834 -18.122 5.566 1.00 29.45 C ATOM 636 OD1 ASN A 654 38.921 -17.729 6.035 1.00 31.10 O ATOM 637 ND2 ASN A 654 37.473 -19.413 5.533 1.00 28.91 N ATOM 638 HD22 ASN A 654 36.554 -19.686 5.130 1.00 0.00 H ATOM 639 HD21 ASN A 654 38.112 -20.141 5.910 1.00 0.00 H ATOM 640 H ASN A 654 36.269 -16.236 7.296 1.00 0.00 H ATOM 641 N PHE A 655 34.948 -14.787 4.517 1.00 23.76 N ATOM 642 CA PHE A 655 34.104 -13.952 3.689 1.00 23.55 C ATOM 643 C PHE A 655 34.558 -12.483 3.727 1.00 22.16 C ATOM 644 O PHE A 655 34.724 -11.853 2.667 1.00 24.26 O ATOM 645 CB PHE A 655 32.665 -14.098 4.133 1.00 23.46 C ATOM 646 CG PHE A 655 31.759 -13.088 3.522 1.00 23.79 C ATOM 647 CD1 PHE A 655 31.225 -13.278 2.264 1.00 24.02 C ATOM 648 CD2 PHE A 655 31.450 -11.924 4.227 1.00 24.52 C ATOM 649 CE1 PHE A 655 30.410 -12.317 1.684 1.00 24.41 C ATOM 650 CE2 PHE A 655 30.605 -10.968 3.656 1.00 26.08 C ATOM 651 CZ PHE A 655 30.088 -11.176 2.387 1.00 24.63 C ATOM 652 H PHE A 655 34.521 -15.364 5.270 1.00 0.00 H ATOM 653 N ILE A 656 34.772 -11.957 4.930 1.00 22.31 N ATOM 654 CA ILE A 656 35.217 -10.547 5.086 1.00 24.48 C ATOM 655 C ILE A 656 36.489 -10.308 4.283 1.00 25.02 C ATOM 656 O ILE A 656 36.603 -9.312 3.567 1.00 22.49 O ATOM 657 CB ILE A 656 35.364 -10.133 6.553 1.00 24.20 C ATOM 658 CG1 ILE A 656 33.996 -10.141 7.229 1.00 23.05 C ATOM 659 CG2 ILE A 656 35.990 -8.750 6.692 1.00 24.77 C ATOM 660 CD1 ILE A 656 34.014 -10.092 8.721 1.00 24.69 C ATOM 661 H ILE A 656 34.625 -12.543 5.777 1.00 0.00 H ATOM 662 N LEU A 657 37.446 -11.234 4.396 1.00 26.28 N ATOM 663 CA LEU A 657 38.727 -11.096 3.692 1.00 26.69 C ATOM 664 C LEU A 657 38.622 -11.272 2.174 1.00 25.82 C ATOM 665 O LEU A 657 39.321 -10.591 1.410 1.00 26.02 O ATOM 666 CB LEU A 657 39.780 -12.035 4.327 1.00 29.70 C ATOM 667 CG LEU A 657 40.119 -11.679 5.784 1.00 31.53 C ATOM 668 CD1 LEU A 657 41.021 -12.704 6.461 1.00 36.21 C ATOM 669 CD2 LEU A 657 40.767 -10.316 5.823 1.00 33.98 C ATOM 670 H LEU A 657 37.280 -12.068 4.994 1.00 0.00 H ATOM 671 N GLN A 658 37.737 -12.150 1.692 1.00 25.56 N ATOM 672 CA GLN A 658 37.510 -12.256 0.264 1.00 24.15 C ATOM 673 C GLN A 658 36.853 -10.950 -0.308 1.00 24.46 C ATOM 674 O GLN A 658 37.162 -10.562 -1.422 1.00 26.94 O ATOM 675 CB GLN A 658 36.599 -13.449 -0.094 1.00 25.20 C ATOM 676 CG GLN A 658 37.177 -14.815 0.200 1.00 27.00 C ATOM 677 CD GLN A 658 38.330 -15.232 -0.701 1.00 30.80 C ATOM 678 OE1 GLN A 658 38.864 -14.440 -1.458 1.00 30.33 O ATOM 679 NE2 GLN A 658 38.718 -16.524 -0.606 1.00 32.31 N ATOM 680 HE22 GLN A 658 38.234 -17.165 0.054 1.00 0.00 H ATOM 681 HE21 GLN A 658 39.501 -16.876 -1.193 1.00 0.00 H ATOM 682 H GLN A 658 37.208 -12.761 2.346 1.00 0.00 H ATOM 683 N CYS A 659 35.947 -10.320 0.459 1.00 22.74 N ATOM 684 CA CYS A 659 35.369 -9.030 0.058 1.00 22.16 C ATOM 685 C CYS A 659 36.518 -7.995 -0.003 1.00 24.52 C ATOM 686 O CYS A 659 36.681 -7.282 -1.023 1.00 21.26 O ATOM 687 CB CYS A 659 34.325 -8.550 1.038 1.00 22.44 C ATOM 688 SG CYS A 659 32.773 -9.509 0.958 1.00 25.95 S ATOM 689 H CYS A 659 35.649 -10.755 1.355 1.00 0.00 H ATOM 690 N ARG A 660 37.358 -8.006 1.048 1.00 24.85 N ATOM 691 CA ARG A 660 38.421 -7.004 1.142 1.00 26.03 C ATOM 692 C ARG A 660 39.330 -7.024 -0.067 1.00 27.50 C ATOM 693 O ARG A 660 39.636 -5.970 -0.611 1.00 27.67 O ATOM 694 CB ARG A 660 39.232 -7.143 2.446 1.00 26.31 C ATOM 695 CG ARG A 660 40.144 -5.950 2.718 1.00 27.34 C ATOM 696 CD ARG A 660 40.850 -6.151 4.053 1.00 30.84 C ATOM 697 NE ARG A 660 41.884 -7.188 3.962 1.00 31.60 N ATOM 698 CZ ARG A 660 42.708 -7.543 4.953 1.00 32.34 C ATOM 699 NH1 ARG A 660 42.635 -6.975 6.154 1.00 33.96 N ATOM 700 NH2 ARG A 660 43.588 -8.518 4.757 1.00 33.59 N ATOM 701 HE ARG A 660 41.984 -7.686 3.055 1.00 0.00 H ATOM 702 HH12 ARG A 660 43.288 -7.269 6.909 1.00 0.00 H ATOM 703 HH11 ARG A 660 41.925 -6.237 6.338 1.00 0.00 H ATOM 704 HH22 ARG A 660 44.232 -8.799 5.524 1.00 0.00 H ATOM 705 HH21 ARG A 660 43.633 -9.000 3.837 1.00 0.00 H ATOM 706 H ARG A 660 37.252 -8.725 1.792 1.00 0.00 H ATOM 707 N LYS A 661 39.735 -8.220 -0.505 1.00 30.33 N ATOM 708 CA LYS A 661 40.618 -8.371 -1.689 1.00 32.30 C ATOM 709 C LYS A 661 40.057 -7.807 -2.992 1.00 31.20 C ATOM 710 O LYS A 661 40.818 -7.563 -3.929 1.00 27.93 O ATOM 711 CB LYS A 661 40.906 -9.852 -1.981 1.00 35.42 C ATOM 712 CG LYS A 661 41.755 -10.632 -1.001 1.00 43.09 C ATOM 713 CD LYS A 661 41.933 -12.024 -1.625 1.00 46.50 C ATOM 714 CE LYS A 661 42.498 -13.069 -0.691 1.00 53.86 C ATOM 715 NZ LYS A 661 42.294 -14.420 -1.329 1.00 58.62 N ATOM 716 HZ1 LYS A 661 41.278 -14.582 -1.478 1.00 0.00 H ATOM 717 HZ2 LYS A 661 42.789 -14.448 -2.243 1.00 0.00 H ATOM 718 HZ3 LYS A 661 42.676 -15.158 -0.704 1.00 0.00 H ATOM 719 H LYS A 661 39.421 -9.073 0.000 1.00 0.00 H ATOM 720 N LYS A 662 38.730 -7.667 -3.089 1.00 27.62 N ATOM 721 CA LYS A 662 38.115 -7.126 -4.290 1.00 28.44 C ATOM 722 C LYS A 662 37.839 -5.620 -4.256 1.00 26.54 C ATOM 723 O LYS A 662 37.293 -5.093 -5.219 1.00 30.00 O ATOM 724 CB LYS A 662 36.838 -7.907 -4.636 1.00 28.36 C ATOM 725 CG LYS A 662 37.096 -9.396 -4.892 1.00 33.84 C ATOM 726 CD LYS A 662 35.850 -10.102 -5.428 1.00 38.72 C ATOM 727 CE LYS A 662 36.065 -11.590 -5.650 1.00 42.50 C ATOM 728 NZ LYS A 662 37.045 -11.825 -6.750 1.00 46.28 N ATOM 729 HZ1 LYS A 662 36.685 -11.403 -7.630 1.00 0.00 H ATOM 730 HZ2 LYS A 662 37.955 -11.387 -6.501 1.00 0.00 H ATOM 731 HZ3 LYS A 662 37.176 -12.848 -6.883 1.00 0.00 H ATOM 732 H LYS A 662 38.127 -7.950 -2.290 1.00 0.00 H ATOM 733 N TYR A 663 38.246 -4.923 -3.207 1.00 26.68 N ATOM 734 CA TYR A 663 38.163 -3.435 -3.193 1.00 25.49 C ATOM 735 C TYR A 663 39.478 -2.862 -3.674 1.00 29.17 C ATOM 736 O TYR A 663 40.533 -3.442 -3.439 1.00 29.42 O ATOM 737 CB TYR A 663 37.754 -2.875 -1.832 1.00 24.87 C ATOM 738 CG TYR A 663 36.284 -3.171 -1.628 1.00 22.54 C ATOM 739 CD1 TYR A 663 35.319 -2.342 -2.216 1.00 22.61 C ATOM 740 CD2 TYR A 663 35.866 -4.330 -0.969 1.00 22.29 C ATOM 741 CE1 TYR A 663 33.961 -2.630 -2.101 1.00 22.22 C ATOM 742 CE2 TYR A 663 34.506 -4.636 -0.831 1.00 21.29 C ATOM 743 CZ TYR A 663 33.558 -3.782 -1.419 1.00 20.99 C ATOM 744 OH TYR A 663 32.186 -4.078 -1.347 1.00 20.59 O ATOM 745 HH TYR A 663 31.908 -4.119 -0.398 1.00 0.00 H ATOM 746 H TYR A 663 38.630 -5.422 -2.379 1.00 0.00 H ATOM 747 N ARG A 664 39.387 -1.748 -4.370 1.00 29.68 N ATOM 748 CA ARG A 664 40.532 -1.134 -5.010 1.00 32.30 C ATOM 749 C ARG A 664 40.984 0.062 -4.206 1.00 33.08 C ATOM 750 O ARG A 664 40.287 0.522 -3.316 1.00 30.12 O ATOM 751 CB ARG A 664 40.158 -0.742 -6.418 1.00 32.44 C ATOM 752 CG ARG A 664 39.864 -1.956 -7.250 1.00 39.52 C ATOM 753 CD ARG A 664 39.653 -1.556 -8.680 1.00 45.89 C ATOM 754 NE ARG A 664 39.422 -2.722 -9.543 1.00 53.42 N ATOM 755 CZ ARG A 664 40.349 -3.386 -10.253 1.00 54.49 C ATOM 756 NH1 ARG A 664 41.634 -3.016 -10.270 1.00 54.87 N ATOM 757 NH2 ARG A 664 39.971 -4.426 -10.991 1.00 53.35 N ATOM 758 HE ARG A 664 38.444 -3.068 -9.611 1.00 0.00 H ATOM 759 HH12 ARG A 664 42.323 -3.555 -10.832 1.00 0.00 H ATOM 760 HH11 ARG A 664 41.944 -2.189 -9.721 1.00 0.00 H ATOM 761 HH22 ARG A 664 40.675 -4.952 -11.547 1.00 0.00 H ATOM 762 HH21 ARG A 664 38.972 -4.713 -11.012 1.00 0.00 H ATOM 763 H ARG A 664 38.457 -1.291 -4.464 1.00 0.00 H ATOM 764 N ASN A 665 42.175 0.539 -4.517 1.00 35.33 N ATOM 765 CA ASN A 665 42.748 1.715 -3.879 1.00 36.43 C ATOM 766 C ASN A 665 42.226 2.943 -4.638 1.00 39.55 C ATOM 767 O ASN A 665 42.884 3.454 -5.542 1.00 44.05 O ATOM 768 CB ASN A 665 44.278 1.625 -3.938 1.00 40.05 C ATOM 769 CG ASN A 665 44.973 2.786 -3.235 1.00 46.42 C ATOM 770 OD1 ASN A 665 44.483 3.321 -2.245 1.00 45.22 O ATOM 771 ND2 ASN A 665 46.146 3.159 -3.738 1.00 49.23 N ATOM 772 HD22 ASN A 665 46.527 2.680 -4.579 1.00 0.00 H ATOM 773 HD21 ASN A 665 46.682 3.930 -3.291 1.00 0.00 H ATOM 774 H ASN A 665 42.729 0.053 -5.251 1.00 0.00 H ATOM 775 N VAL A 666 41.001 3.357 -4.323 1.00 31.88 N ATOM 776 CA VAL A 666 40.376 4.558 -4.879 1.00 30.79 C ATOM 777 C VAL A 666 40.036 5.432 -3.670 1.00 27.09 C ATOM 778 O VAL A 666 40.057 4.929 -2.534 1.00 26.86 O ATOM 779 CB VAL A 666 39.126 4.254 -5.750 1.00 31.03 C ATOM 780 CG1 VAL A 666 39.521 3.549 -7.046 1.00 33.33 C ATOM 781 CG2 VAL A 666 38.120 3.410 -4.978 1.00 31.98 C ATOM 782 H VAL A 666 40.455 2.793 -3.641 1.00 0.00 H ATOM 783 N PRO A 667 39.792 6.736 -3.891 1.00 26.74 N ATOM 784 CA PRO A 667 39.637 7.625 -2.746 1.00 27.95 C ATOM 785 C PRO A 667 38.382 7.384 -1.883 1.00 25.04 C ATOM 786 O PRO A 667 38.438 7.587 -0.679 1.00 26.15 O ATOM 787 CB PRO A 667 39.563 9.019 -3.393 1.00 28.87 C ATOM 788 CG PRO A 667 40.234 8.881 -4.691 1.00 30.17 C ATOM 789 CD PRO A 667 39.880 7.501 -5.146 1.00 28.60 C ATOM 790 N TYR A 668 37.259 7.001 -2.506 1.00 24.87 N ATOM 791 CA TYR A 668 35.983 6.866 -1.758 1.00 22.47 C ATOM 792 C TYR A 668 35.441 5.416 -1.730 1.00 20.83 C ATOM 793 O TYR A 668 35.205 4.870 -0.641 1.00 21.86 O ATOM 794 CB TYR A 668 34.944 7.839 -2.278 1.00 23.17 C ATOM 795 CG TYR A 668 33.644 7.799 -1.492 1.00 23.87 C ATOM 796 CD1 TYR A 668 33.482 8.536 -0.333 1.00 25.72 C ATOM 797 CD2 TYR A 668 32.577 7.027 -1.925 1.00 25.44 C ATOM 798 CE1 TYR A 668 32.313 8.486 0.397 1.00 25.46 C ATOM 799 CE2 TYR A 668 31.407 6.936 -1.179 1.00 24.42 C ATOM 800 CZ TYR A 668 31.272 7.678 -0.043 1.00 23.89 C ATOM 801 OH TYR A 668 30.135 7.646 0.692 1.00 21.52 O ATOM 802 HH TYR A 668 30.231 8.248 1.472 1.00 0.00 H ATOM 803 H TYR A 668 37.281 6.796 -3.525 1.00 0.00 H ATOM 804 N HIS A 669 35.295 4.820 -2.907 1.00 22.55 N ATOM 805 CA HIS A 669 34.657 3.474 -3.041 1.00 23.69 C ATOM 806 C HIS A 669 35.655 2.337 -2.831 1.00 23.97 C ATOM 807 O HIS A 669 35.810 1.460 -3.668 1.00 27.06 O ATOM 808 CB HIS A 669 33.926 3.340 -4.382 1.00 25.71 C ATOM 809 CG HIS A 669 32.659 4.127 -4.458 1.00 25.83 C ATOM 810 ND1 HIS A 669 32.532 5.278 -5.201 1.00 24.66 N ATOM 811 CD2 HIS A 669 31.466 3.940 -3.857 1.00 26.89 C ATOM 812 CE1 HIS A 669 31.317 5.768 -5.056 1.00 24.92 C ATOM 813 NE2 HIS A 669 30.648 4.972 -4.247 1.00 27.51 N ATOM 814 H HIS A 669 35.635 5.304 -3.763 1.00 0.00 H ATOM 815 N ASN A 670 36.234 2.336 -1.651 1.00 24.03 N ATOM 816 CA ASN A 670 37.233 1.386 -1.188 1.00 24.11 C ATOM 817 C ASN A 670 36.648 0.586 -0.053 1.00 24.62 C ATOM 818 O ASN A 670 35.433 0.740 0.286 1.00 23.73 O ATOM 819 CB ASN A 670 38.520 2.133 -0.810 1.00 23.97 C ATOM 820 CG ASN A 670 38.300 3.213 0.239 1.00 24.63 C ATOM 821 OD1 ASN A 670 37.582 3.016 1.215 1.00 23.75 O ATOM 822 ND2 ASN A 670 38.881 4.397 0.008 1.00 25.35 N ATOM 823 HD22 ASN A 670 39.483 4.526 -0.830 1.00 0.00 H ATOM 824 HD21 ASN A 670 38.730 5.188 0.667 1.00 0.00 H ATOM 825 H ASN A 670 35.951 3.084 -0.986 1.00 0.00 H ATOM 826 N PHE A 671 37.454 -0.277 0.574 1.00 22.77 N ATOM 827 CA PHE A 671 36.960 -1.132 1.653 1.00 21.78 C ATOM 828 C PHE A 671 36.423 -0.361 2.846 1.00 21.89 C ATOM 829 O PHE A 671 35.501 -0.826 3.512 1.00 22.99 O ATOM 830 CB PHE A 671 38.082 -2.108 2.084 1.00 24.12 C ATOM 831 CG PHE A 671 37.666 -3.152 3.081 1.00 24.76 C ATOM 832 CD1 PHE A 671 36.666 -4.067 2.762 1.00 24.81 C ATOM 833 CD2 PHE A 671 38.342 -3.277 4.318 1.00 26.73 C ATOM 834 CE1 PHE A 671 36.306 -5.046 3.677 1.00 26.42 C ATOM 835 CE2 PHE A 671 38.005 -4.275 5.227 1.00 27.86 C ATOM 836 CZ PHE A 671 36.974 -5.171 4.894 1.00 26.63 C ATOM 837 H PHE A 671 38.452 -0.342 0.289 1.00 0.00 H ATOM 838 N TYR A 672 36.972 0.839 3.116 1.00 21.57 N ATOM 839 CA TYR A 672 36.574 1.621 4.268 1.00 22.48 C ATOM 840 C TYR A 672 35.128 2.113 4.105 1.00 20.16 C ATOM 841 O TYR A 672 34.407 2.164 5.094 1.00 21.53 O ATOM 842 CB TYR A 672 37.528 2.814 4.521 1.00 24.52 C ATOM 843 CG TYR A 672 38.973 2.353 4.669 1.00 24.78 C ATOM 844 CD1 TYR A 672 39.353 1.605 5.779 1.00 27.29 C ATOM 845 CD2 TYR A 672 39.929 2.619 3.682 1.00 28.73 C ATOM 846 CE1 TYR A 672 40.629 1.099 5.892 1.00 29.83 C ATOM 847 CE2 TYR A 672 41.248 2.125 3.802 1.00 28.32 C ATOM 848 CZ TYR A 672 41.578 1.379 4.916 1.00 31.10 C ATOM 849 OH TYR A 672 42.854 0.886 5.113 1.00 33.95 O ATOM 850 HH TYR A 672 43.094 0.285 4.364 1.00 0.00 H ATOM 851 H TYR A 672 37.703 1.215 2.479 1.00 0.00 H ATOM 852 N HIS A 673 34.744 2.451 2.882 1.00 20.62 N ATOM 853 CA HIS A 673 33.325 2.803 2.600 1.00 22.10 C ATOM 854 C HIS A 673 32.361 1.686 2.955 1.00 20.69 C ATOM 855 O HIS A 673 31.335 1.930 3.596 1.00 21.03 O ATOM 856 CB HIS A 673 33.148 3.217 1.167 1.00 21.54 C ATOM 857 CG HIS A 673 31.712 3.317 0.727 1.00 21.36 C ATOM 858 ND1 HIS A 673 30.811 4.226 1.244 1.00 20.14 N ATOM 859 CD2 HIS A 673 31.043 2.607 -0.203 1.00 21.26 C ATOM 860 CE1 HIS A 673 29.636 4.051 0.657 1.00 20.76 C ATOM 861 NE2 HIS A 673 29.760 3.083 -0.239 1.00 20.45 N ATOM 862 H HIS A 673 35.442 2.471 2.111 1.00 0.00 H ATOM 863 N VAL A 674 32.673 0.463 2.574 1.00 21.42 N ATOM 864 CA VAL A 674 31.716 -0.654 2.860 1.00 19.90 C ATOM 865 C VAL A 674 31.693 -1.061 4.310 1.00 19.60 C ATOM 866 O VAL A 674 30.642 -1.442 4.848 1.00 19.95 O ATOM 867 CB VAL A 674 31.837 -1.841 1.869 1.00 19.77 C ATOM 868 CG1 VAL A 674 31.740 -1.370 0.426 1.00 20.12 C ATOM 869 CG2 VAL A 674 33.109 -2.658 2.067 1.00 20.40 C ATOM 870 H VAL A 674 33.570 0.276 2.082 1.00 0.00 H ATOM 871 N VAL A 675 32.821 -0.975 5.019 1.00 20.29 N ATOM 872 CA VAL A 675 32.824 -1.201 6.451 1.00 21.01 C ATOM 873 C VAL A 675 32.021 -0.111 7.135 1.00 20.03 C ATOM 874 O VAL A 675 31.225 -0.364 8.065 1.00 20.91 O ATOM 875 CB VAL A 675 34.306 -1.317 7.000 1.00 21.63 C ATOM 876 CG1 VAL A 675 34.313 -1.379 8.511 1.00 23.66 C ATOM 877 CG2 VAL A 675 34.946 -2.549 6.425 1.00 22.42 C ATOM 878 H VAL A 675 33.712 -0.742 4.536 1.00 0.00 H ATOM 879 N ASP A 676 32.176 1.121 6.654 1.00 20.40 N ATOM 880 CA ASP A 676 31.405 2.242 7.203 1.00 20.34 C ATOM 881 C ASP A 676 29.905 1.972 7.006 1.00 20.39 C ATOM 882 O ASP A 676 29.113 2.180 7.917 1.00 20.42 O ATOM 883 CB ASP A 676 31.790 3.553 6.527 1.00 21.17 C ATOM 884 CG ASP A 676 30.925 4.712 6.958 1.00 22.15 C ATOM 885 OD1 ASP A 676 30.772 4.974 8.184 1.00 24.17 O ATOM 886 OD2 ASP A 676 30.343 5.369 6.072 1.00 23.85 O ATOM 887 H ASP A 676 32.851 1.290 5.881 1.00 0.00 H ATOM 888 N VAL A 677 29.516 1.543 5.816 1.00 20.08 N ATOM 889 CA VAL A 677 28.059 1.256 5.557 1.00 19.79 C ATOM 890 C VAL A 677 27.542 0.135 6.478 1.00 18.17 C ATOM 891 O VAL A 677 26.440 0.255 7.031 1.00 17.97 O ATOM 892 CB VAL A 677 27.810 0.988 4.053 1.00 20.20 C ATOM 893 CG1 VAL A 677 26.389 0.486 3.789 1.00 21.96 C ATOM 894 CG2 VAL A 677 28.048 2.239 3.229 1.00 20.58 C ATOM 895 H VAL A 677 30.216 1.404 5.059 1.00 0.00 H ATOM 896 N CYS A 678 28.333 -0.933 6.659 1.00 17.58 N ATOM 897 CA CYS A 678 28.000 -2.021 7.561 1.00 19.00 C ATOM 898 C CYS A 678 27.794 -1.519 9.007 1.00 20.65 C ATOM 899 O CYS A 678 26.780 -1.825 9.641 1.00 18.88 O ATOM 900 CB CYS A 678 29.132 -3.056 7.497 1.00 22.22 C ATOM 901 SG CYS A 678 28.875 -4.538 8.513 1.00 23.49 S ATOM 902 H CYS A 678 29.226 -0.984 6.129 1.00 0.00 H ATOM 903 N GLN A 679 28.762 -0.719 9.508 1.00 21.26 N ATOM 904 CA GLN A 679 28.678 -0.121 10.845 1.00 21.44 C ATOM 905 C GLN A 679 27.470 0.773 10.984 1.00 20.65 C ATOM 906 O GLN A 679 26.763 0.723 11.990 1.00 20.27 O ATOM 907 CB GLN A 679 29.958 0.672 11.171 1.00 23.65 C ATOM 908 CG GLN A 679 30.132 1.033 12.654 1.00 23.17 C ATOM 909 CD GLN A 679 29.486 2.329 13.041 1.00 24.91 C ATOM 910 OE1 GLN A 679 29.328 3.258 12.217 1.00 25.61 O ATOM 911 NE2 GLN A 679 29.099 2.419 14.300 1.00 23.66 N ATOM 912 HE22 GLN A 679 29.251 1.621 14.949 1.00 0.00 H ATOM 913 HE21 GLN A 679 28.642 3.288 14.643 1.00 0.00 H ATOM 914 H GLN A 679 29.598 -0.520 8.923 1.00 0.00 H ATOM 915 N THR A 680 27.200 1.564 9.953 1.00 20.74 N ATOM 916 CA THR A 680 26.081 2.505 9.977 1.00 20.67 C ATOM 917 C THR A 680 24.731 1.787 9.999 1.00 20.47 C ATOM 918 O THR A 680 23.831 2.113 10.780 1.00 19.92 O ATOM 919 CB THR A 680 26.160 3.476 8.788 1.00 21.21 C ATOM 920 OG1 THR A 680 27.428 4.150 8.829 1.00 23.39 O ATOM 921 CG2 THR A 680 25.014 4.472 8.836 1.00 21.26 C ATOM 922 HG1 THR A 680 28.157 3.483 8.769 1.00 0.00 H ATOM 923 H THR A 680 27.800 1.513 9.105 1.00 0.00 H ATOM 924 N ILE A 681 24.612 0.791 9.147 1.00 21.27 N ATOM 925 CA ILE A 681 23.413 -0.098 9.158 1.00 20.67 C ATOM 926 C ILE A 681 23.204 -0.760 10.508 1.00 19.03 C ATOM 927 O ILE A 681 22.055 -0.863 10.976 1.00 19.04 O ATOM 928 CB ILE A 681 23.481 -1.125 7.991 1.00 20.78 C ATOM 929 CG1 ILE A 681 23.258 -0.351 6.676 1.00 21.62 C ATOM 930 CG2 ILE A 681 22.439 -2.260 8.155 1.00 21.45 C ATOM 931 CD1 ILE A 681 23.385 -1.222 5.415 1.00 23.49 C ATOM 932 H ILE A 681 25.368 0.620 8.453 1.00 0.00 H ATOM 933 N HIS A 682 24.300 -1.213 11.142 1.00 19.00 N ATOM 934 CA HIS A 682 24.218 -1.797 12.473 1.00 19.37 C ATOM 935 C HIS A 682 23.551 -0.785 13.422 1.00 19.81 C ATOM 936 O HIS A 682 22.616 -1.128 14.135 1.00 19.07 O ATOM 937 CB HIS A 682 25.591 -2.266 12.972 1.00 20.47 C ATOM 938 CG HIS A 682 25.541 -3.031 14.260 1.00 22.44 C ATOM 939 ND1 HIS A 682 25.310 -2.433 15.476 1.00 23.79 N ATOM 940 CD2 HIS A 682 25.676 -4.355 14.518 1.00 25.41 C ATOM 941 CE1 HIS A 682 25.330 -3.346 16.440 1.00 25.14 C ATOM 942 NE2 HIS A 682 25.523 -4.527 15.886 1.00 25.49 N ATOM 943 H HIS A 682 25.225 -1.145 10.672 1.00 0.00 H ATOM 944 N THR A 683 23.971 0.475 13.374 1.00 18.12 N ATOM 945 CA THR A 683 23.329 1.508 14.196 1.00 18.56 C ATOM 946 C THR A 683 21.878 1.747 13.846 1.00 20.10 C ATOM 947 O THR A 683 21.055 1.933 14.742 1.00 20.77 O ATOM 948 CB THR A 683 24.113 2.877 14.215 1.00 19.36 C ATOM 949 OG1 THR A 683 23.940 3.618 13.002 1.00 20.01 O ATOM 950 CG2 THR A 683 25.592 2.697 14.489 1.00 19.86 C ATOM 951 HG1 THR A 683 24.274 3.083 12.239 1.00 0.00 H ATOM 952 H THR A 683 24.761 0.731 12.749 1.00 0.00 H ATOM 953 N PHE A 684 21.535 1.745 12.559 1.00 17.54 N ATOM 954 CA PHE A 684 20.114 1.941 12.191 1.00 19.01 C ATOM 955 C PHE A 684 19.244 0.793 12.737 1.00 19.60 C ATOM 956 O PHE A 684 18.132 1.036 13.274 1.00 19.82 O ATOM 957 CB PHE A 684 19.944 2.078 10.666 1.00 19.30 C ATOM 958 CG PHE A 684 20.641 3.265 10.061 1.00 18.85 C ATOM 959 CD1 PHE A 684 21.046 4.395 10.838 1.00 20.70 C ATOM 960 CD2 PHE A 684 20.804 3.325 8.667 1.00 20.13 C ATOM 961 CE1 PHE A 684 21.654 5.486 10.234 1.00 20.38 C ATOM 962 CE2 PHE A 684 21.401 4.425 8.064 1.00 20.40 C ATOM 963 CZ PHE A 684 21.823 5.506 8.839 1.00 20.49 C ATOM 964 H PHE A 684 22.256 1.608 11.822 1.00 0.00 H ATOM 965 N LEU A 685 19.741 -0.433 12.583 1.00 19.76 N ATOM 966 CA LEU A 685 19.009 -1.624 13.078 1.00 21.28 C ATOM 967 C LEU A 685 18.839 -1.616 14.589 1.00 21.39 C ATOM 968 O LEU A 685 17.726 -1.833 15.084 1.00 22.43 O ATOM 969 CB LEU A 685 19.703 -2.911 12.643 1.00 20.31 C ATOM 970 CG LEU A 685 19.662 -3.148 11.145 1.00 20.52 C ATOM 971 CD1 LEU A 685 20.522 -4.324 10.833 1.00 19.74 C ATOM 972 CD2 LEU A 685 18.233 -3.416 10.646 1.00 22.48 C ATOM 973 H LEU A 685 20.658 -0.557 12.108 1.00 0.00 H ATOM 974 N TYR A 686 19.910 -1.335 15.303 1.00 21.75 N ATOM 975 CA TYR A 686 19.947 -1.575 16.755 1.00 23.65 C ATOM 976 C TYR A 686 19.857 -0.307 17.631 1.00 26.97 C ATOM 977 O TYR A 686 19.228 -0.361 18.667 1.00 31.31 O ATOM 978 CB TYR A 686 21.170 -2.457 17.083 1.00 22.99 C ATOM 979 CG TYR A 686 21.022 -3.801 16.410 1.00 22.56 C ATOM 980 CD1 TYR A 686 19.966 -4.661 16.740 1.00 23.75 C ATOM 981 CD2 TYR A 686 21.900 -4.208 15.416 1.00 24.43 C ATOM 982 CE1 TYR A 686 19.819 -5.912 16.126 1.00 24.04 C ATOM 983 CE2 TYR A 686 21.749 -5.444 14.765 1.00 24.91 C ATOM 984 CZ TYR A 686 20.721 -6.292 15.118 1.00 26.24 C ATOM 985 OH TYR A 686 20.588 -7.504 14.472 1.00 27.39 O ATOM 986 HH TYR A 686 19.807 -7.989 14.840 1.00 0.00 H ATOM 987 H TYR A 686 20.746 -0.935 14.831 1.00 0.00 H ATOM 988 N ARG A 687 20.441 0.820 17.212 1.00 25.66 N ATOM 989 CA ARG A 687 20.191 2.097 17.908 1.00 24.70 C ATOM 990 C ARG A 687 18.907 2.726 17.446 1.00 25.14 C ATOM 991 O ARG A 687 18.243 3.389 18.229 1.00 25.56 O ATOM 992 CB ARG A 687 21.324 3.101 17.736 1.00 26.28 C ATOM 993 CG ARG A 687 22.669 2.616 18.127 1.00 29.35 C ATOM 994 CD ARG A 687 22.811 2.494 19.617 1.00 32.96 C ATOM 995 NE ARG A 687 24.188 2.114 19.961 1.00 34.17 N ATOM 996 CZ ARG A 687 24.742 2.282 21.170 1.00 41.71 C ATOM 997 NH1 ARG A 687 24.060 2.868 22.156 1.00 41.78 N ATOM 998 NH2 ARG A 687 25.992 1.881 21.396 1.00 37.66 N ATOM 999 HE ARG A 687 24.773 1.685 19.215 1.00 0.00 H ATOM 1000 HH12 ARG A 687 24.500 2.993 23.090 1.00 0.00 H ATOM 1001 HH11 ARG A 687 23.088 3.200 21.991 1.00 0.00 H ATOM 1002 HH22 ARG A 687 26.419 2.013 22.335 1.00 0.00 H ATOM 1003 HH21 ARG A 687 26.541 1.436 20.633 1.00 0.00 H ATOM 1004 H ARG A 687 21.077 0.797 16.389 1.00 0.00 H ATOM 1005 N GLY A 688 18.535 2.552 16.178 1.00 23.06 N ATOM 1006 CA GLY A 688 17.295 3.119 15.663 1.00 22.40 C ATOM 1007 C GLY A 688 16.101 2.178 15.672 1.00 20.84 C ATOM 1008 O GLY A 688 15.038 2.535 15.189 1.00 22.15 O ATOM 1009 H GLY A 688 19.144 1.999 15.541 1.00 0.00 H ATOM 1010 N ASN A 689 16.325 0.962 16.152 1.00 22.79 N ATOM 1011 CA ASN A 689 15.310 -0.049 16.363 1.00 24.23 C ATOM 1012 C ASN A 689 14.622 -0.535 15.113 1.00 22.90 C ATOM 1013 O ASN A 689 13.562 -1.136 15.198 1.00 23.10 O ATOM 1014 CB ASN A 689 14.276 0.429 17.402 1.00 27.56 C ATOM 1015 CG ASN A 689 14.883 0.603 18.755 1.00 28.59 C ATOM 1016 OD1 ASN A 689 15.775 -0.148 19.161 1.00 35.04 O ATOM 1017 ND2 ASN A 689 14.386 1.566 19.482 1.00 33.28 N ATOM 1018 HD22 ASN A 689 13.635 2.174 19.097 1.00 0.00 H ATOM 1019 HD21 ASN A 689 14.741 1.726 20.446 1.00 0.00 H ATOM 1020 H ASN A 689 17.306 0.716 16.396 1.00 0.00 H ATOM 1021 N VAL A 690 15.248 -0.333 13.953 1.00 21.39 N ATOM 1022 CA VAL A 690 14.712 -0.868 12.711 1.00 21.62 C ATOM 1023 C VAL A 690 14.731 -2.420 12.695 1.00 20.67 C ATOM 1024 O VAL A 690 13.957 -3.023 11.941 1.00 20.78 O ATOM 1025 CB VAL A 690 15.413 -0.246 11.472 1.00 24.28 C ATOM 1026 CG1 VAL A 690 14.820 -0.811 10.193 1.00 24.55 C ATOM 1027 CG2 VAL A 690 15.261 1.276 11.484 1.00 25.07 C ATOM 1028 H VAL A 690 16.132 0.215 13.936 1.00 0.00 H ATOM 1029 N TYR A 691 15.542 -3.065 13.526 1.00 19.72 N ATOM 1030 CA TYR A 691 15.528 -4.539 13.643 1.00 21.87 C ATOM 1031 C TYR A 691 14.088 -5.047 13.924 1.00 22.96 C ATOM 1032 O TYR A 691 13.718 -6.146 13.559 1.00 20.23 O ATOM 1033 CB TYR A 691 16.524 -5.054 14.700 1.00 22.30 C ATOM 1034 CG TYR A 691 15.944 -4.992 16.122 1.00 22.21 C ATOM 1035 CD1 TYR A 691 15.100 -6.011 16.593 1.00 24.83 C ATOM 1036 CD2 TYR A 691 16.146 -3.900 16.922 1.00 22.06 C ATOM 1037 CE1 TYR A 691 14.492 -5.923 17.840 1.00 23.46 C ATOM 1038 CE2 TYR A 691 15.547 -3.807 18.189 1.00 25.39 C ATOM 1039 CZ TYR A 691 14.710 -4.829 18.629 1.00 26.97 C ATOM 1040 OH TYR A 691 14.126 -4.753 19.890 1.00 25.17 O ATOM 1041 HH TYR A 691 13.563 -3.941 19.943 1.00 0.00 H ATOM 1042 H TYR A 691 16.206 -2.518 14.111 1.00 0.00 H ATOM 1043 N GLU A 692 13.299 -4.235 14.629 1.00 23.47 N ATOM 1044 CA GLU A 692 11.908 -4.577 14.900 1.00 25.28 C ATOM 1045 C GLU A 692 11.016 -4.800 13.669 1.00 25.96 C ATOM 1046 O GLU A 692 9.996 -5.496 13.765 1.00 26.05 O ATOM 1047 CB GLU A 692 11.268 -3.504 15.782 1.00 26.48 C ATOM 1048 CG GLU A 692 11.838 -3.391 17.191 1.00 27.61 C ATOM 1049 CD GLU A 692 11.071 -2.327 18.000 1.00 33.00 C ATOM 1050 OE1 GLU A 692 9.847 -2.163 17.792 1.00 38.69 O ATOM 1051 OE2 GLU A 692 11.673 -1.639 18.810 1.00 30.15 O ATOM 1052 H GLU A 692 13.684 -3.340 14.993 1.00 0.00 H ATOM 1053 N LYS A 693 11.407 -4.272 12.517 1.00 23.80 N ATOM 1054 CA LYS A 693 10.589 -4.376 11.290 1.00 26.51 C ATOM 1055 C LYS A 693 10.980 -5.600 10.423 1.00 25.69 C ATOM 1056 O LYS A 693 10.308 -5.868 9.405 1.00 23.50 O ATOM 1057 CB LYS A 693 10.818 -3.151 10.405 1.00 26.65 C ATOM 1058 CG LYS A 693 10.669 -1.803 11.046 1.00 32.74 C ATOM 1059 CD LYS A 693 9.294 -1.645 11.613 1.00 33.19 C ATOM 1060 CE LYS A 693 9.092 -0.158 11.855 1.00 39.98 C ATOM 1061 NZ LYS A 693 8.151 0.069 12.965 1.00 43.58 N ATOM 1062 HZ1 LYS A 693 7.233 -0.361 12.733 1.00 0.00 H ATOM 1063 HZ2 LYS A 693 8.529 -0.364 13.832 1.00 0.00 H ATOM 1064 HZ3 LYS A 693 8.029 1.091 13.111 1.00 0.00 H ATOM 1065 H LYS A 693 12.317 -3.770 12.476 1.00 0.00 H ATOM 1066 N LEU A 694 12.080 -6.267 10.798 1.00 21.37 N ATOM 1067 CA LEU A 694 12.724 -7.289 9.991 1.00 21.78 C ATOM 1068 C LEU A 694 12.934 -8.593 10.794 1.00 22.99 C ATOM 1069 O LEU A 694 12.990 -8.581 12.026 1.00 23.17 O ATOM 1070 CB LEU A 694 14.073 -6.779 9.472 1.00 21.69 C ATOM 1071 CG LEU A 694 14.057 -5.501 8.607 1.00 22.07 C ATOM 1072 CD1 LEU A 694 15.484 -5.090 8.337 1.00 22.93 C ATOM 1073 CD2 LEU A 694 13.282 -5.767 7.305 1.00 22.93 C ATOM 1074 H LEU A 694 12.498 -6.039 11.723 1.00 0.00 H ATOM 1075 N THR A 695 13.066 -9.713 10.090 1.00 21.22 N ATOM 1076 CA THR A 695 13.412 -10.964 10.721 1.00 20.15 C ATOM 1077 C THR A 695 14.923 -10.907 11.086 1.00 20.97 C ATOM 1078 O THR A 695 15.680 -10.061 10.570 1.00 20.19 O ATOM 1079 CB THR A 695 13.139 -12.172 9.811 1.00 21.04 C ATOM 1080 OG1 THR A 695 13.981 -12.100 8.637 1.00 20.01 O ATOM 1081 CG2 THR A 695 11.708 -12.224 9.375 1.00 20.67 C ATOM 1082 HG1 THR A 695 13.801 -12.880 8.055 1.00 0.00 H ATOM 1083 H THR A 695 12.917 -9.687 9.061 1.00 0.00 H ATOM 1084 N GLU A 696 15.365 -11.849 11.906 1.00 20.65 N ATOM 1085 CA GLU A 696 16.771 -11.976 12.211 1.00 20.40 C ATOM 1086 C GLU A 696 17.533 -12.274 10.927 1.00 20.53 C ATOM 1087 O GLU A 696 18.624 -11.744 10.740 1.00 19.75 O ATOM 1088 CB GLU A 696 17.067 -13.051 13.249 1.00 24.69 C ATOM 1089 CG GLU A 696 16.614 -12.601 14.646 1.00 27.84 C ATOM 1090 CD GLU A 696 16.998 -13.578 15.736 1.00 33.42 C ATOM 1091 OE1 GLU A 696 16.783 -14.790 15.537 1.00 38.21 O ATOM 1092 OE2 GLU A 696 17.472 -13.133 16.812 1.00 35.08 O ATOM 1093 H GLU A 696 14.687 -12.509 12.338 1.00 0.00 H ATOM 1094 N LEU A 697 16.995 -13.145 10.074 1.00 18.83 N ATOM 1095 CA LEU A 697 17.731 -13.436 8.807 1.00 20.99 C ATOM 1096 C LEU A 697 17.935 -12.192 7.948 1.00 19.47 C ATOM 1097 O LEU A 697 18.991 -11.969 7.415 1.00 20.19 O ATOM 1098 CB LEU A 697 17.014 -14.513 7.989 1.00 22.01 C ATOM 1099 CG LEU A 697 17.611 -14.925 6.641 1.00 23.01 C ATOM 1100 CD1 LEU A 697 19.052 -15.402 6.813 1.00 23.47 C ATOM 1101 CD2 LEU A 697 16.757 -16.017 5.983 1.00 24.15 C ATOM 1102 H LEU A 697 16.088 -13.609 10.284 1.00 0.00 H ATOM 1103 N GLU A 698 16.894 -11.394 7.796 1.00 18.65 N ATOM 1104 CA GLU A 698 17.006 -10.129 7.065 1.00 18.46 C ATOM 1105 C GLU A 698 18.057 -9.183 7.643 1.00 18.44 C ATOM 1106 O GLU A 698 18.786 -8.551 6.882 1.00 18.72 O ATOM 1107 CB GLU A 698 15.636 -9.489 6.965 1.00 19.24 C ATOM 1108 CG GLU A 698 14.693 -10.297 6.085 1.00 18.92 C ATOM 1109 CD GLU A 698 13.230 -9.917 6.173 1.00 23.15 C ATOM 1110 OE1 GLU A 698 12.756 -9.354 7.209 1.00 23.68 O ATOM 1111 OE2 GLU A 698 12.507 -10.222 5.187 1.00 23.50 O ATOM 1112 H GLU A 698 15.977 -11.669 8.203 1.00 0.00 H ATOM 1113 N CYS A 699 18.139 -9.058 8.979 1.00 18.55 N ATOM 1114 CA CYS A 699 19.188 -8.274 9.624 1.00 18.92 C ATOM 1115 C CYS A 699 20.594 -8.778 9.246 1.00 20.37 C ATOM 1116 O CYS A 699 21.514 -7.977 8.948 1.00 19.24 O ATOM 1117 CB CYS A 699 19.006 -8.259 11.174 1.00 19.42 C ATOM 1118 SG CYS A 699 17.490 -7.336 11.650 1.00 24.37 S ATOM 1119 H CYS A 699 17.431 -9.536 9.573 1.00 0.00 H ATOM 1120 N PHE A 700 20.759 -10.100 9.306 1.00 19.78 N ATOM 1121 CA PHE A 700 22.024 -10.739 8.948 1.00 18.53 C ATOM 1122 C PHE A 700 22.347 -10.471 7.488 1.00 18.47 C ATOM 1123 O PHE A 700 23.460 -10.036 7.162 1.00 17.21 O ATOM 1124 CB PHE A 700 21.900 -12.227 9.208 1.00 19.97 C ATOM 1125 CG PHE A 700 23.094 -13.049 8.850 1.00 19.85 C ATOM 1126 CD1 PHE A 700 24.390 -12.665 9.227 1.00 22.90 C ATOM 1127 CD2 PHE A 700 22.918 -14.260 8.217 1.00 21.65 C ATOM 1128 CE1 PHE A 700 25.477 -13.475 8.936 1.00 22.95 C ATOM 1129 CE2 PHE A 700 24.000 -15.074 7.900 1.00 21.96 C ATOM 1130 CZ PHE A 700 25.271 -14.672 8.273 1.00 24.02 C ATOM 1131 H PHE A 700 19.964 -10.694 9.617 1.00 0.00 H ATOM 1132 N VAL A 701 21.349 -10.615 6.602 1.00 16.79 N ATOM 1133 CA VAL A 701 21.591 -10.367 5.166 1.00 18.07 C ATOM 1134 C VAL A 701 22.027 -8.900 4.942 1.00 16.90 C ATOM 1135 O VAL A 701 22.934 -8.624 4.157 1.00 18.29 O ATOM 1136 CB VAL A 701 20.373 -10.762 4.290 1.00 20.16 C ATOM 1137 CG1 VAL A 701 20.542 -10.282 2.837 1.00 21.20 C ATOM 1138 CG2 VAL A 701 20.135 -12.263 4.332 1.00 21.53 C ATOM 1139 H VAL A 701 20.404 -10.902 6.927 1.00 0.00 H ATOM 1140 N LEU A 702 21.411 -7.959 5.631 1.00 17.17 N ATOM 1141 CA LEU A 702 21.731 -6.557 5.425 1.00 17.71 C ATOM 1142 C LEU A 702 23.137 -6.241 5.834 1.00 20.75 C ATOM 1143 O LEU A 702 23.822 -5.537 5.115 1.00 20.54 O ATOM 1144 CB LEU A 702 20.830 -5.658 6.258 1.00 19.93 C ATOM 1145 CG LEU A 702 19.565 -5.165 5.601 1.00 20.27 C ATOM 1146 CD1 LEU A 702 18.735 -4.399 6.625 1.00 21.89 C ATOM 1147 CD2 LEU A 702 19.913 -4.304 4.379 1.00 20.78 C ATOM 1148 H LEU A 702 20.688 -8.224 6.330 1.00 0.00 H ATOM 1149 N LEU A 703 23.573 -6.765 6.984 1.00 20.65 N ATOM 1150 CA LEU A 703 24.967 -6.557 7.435 1.00 21.08 C ATOM 1151 C LEU A 703 26.017 -7.154 6.470 1.00 20.35 C ATOM 1152 O LEU A 703 27.008 -6.514 6.189 1.00 21.87 O ATOM 1153 CB LEU A 703 25.165 -7.034 8.881 1.00 21.71 C ATOM 1154 CG LEU A 703 24.328 -6.301 9.959 1.00 21.38 C ATOM 1155 CD1 LEU A 703 24.490 -6.972 11.311 1.00 24.40 C ATOM 1156 CD2 LEU A 703 24.677 -4.822 10.021 1.00 22.85 C ATOM 1157 H LEU A 703 22.923 -7.327 7.570 1.00 0.00 H ATOM 1158 N ILE A 704 25.770 -8.353 5.929 1.00 19.39 N ATOM 1159 CA ILE A 704 26.606 -8.985 4.916 1.00 19.45 C ATOM 1160 C ILE A 704 26.601 -8.201 3.587 1.00 19.39 C ATOM 1161 O ILE A 704 27.637 -7.992 2.906 1.00 20.21 O ATOM 1162 CB ILE A 704 26.113 -10.457 4.707 1.00 19.86 C ATOM 1163 CG1 ILE A 704 26.360 -11.302 5.968 1.00 21.73 C ATOM 1164 CG2 ILE A 704 26.683 -11.074 3.462 1.00 21.62 C ATOM 1165 CD1 ILE A 704 27.780 -11.347 6.460 1.00 23.64 C ATOM 1166 H ILE A 704 24.926 -8.868 6.253 1.00 0.00 H ATOM 1167 N THR A 705 25.398 -7.765 3.182 1.00 18.35 N ATOM 1168 CA THR A 705 25.216 -7.095 1.931 1.00 19.18 C ATOM 1169 C THR A 705 26.015 -5.786 1.902 1.00 18.88 C ATOM 1170 O THR A 705 26.591 -5.421 0.873 1.00 19.39 O ATOM 1171 CB THR A 705 23.715 -6.870 1.642 1.00 19.11 C ATOM 1172 OG1 THR A 705 23.121 -8.166 1.524 1.00 21.05 O ATOM 1173 CG2 THR A 705 23.534 -6.113 0.333 1.00 21.26 C ATOM 1174 HG1 THR A 705 23.247 -8.664 2.371 1.00 0.00 H ATOM 1175 H THR A 705 24.573 -7.919 3.796 1.00 0.00 H ATOM 1176 N ALA A 706 26.064 -5.112 3.030 1.00 19.15 N ATOM 1177 CA ALA A 706 26.883 -3.909 3.130 1.00 19.76 C ATOM 1178 C ALA A 706 28.296 -4.141 2.626 1.00 20.47 C ATOM 1179 O ALA A 706 28.825 -3.307 1.908 1.00 18.99 O ATOM 1180 CB ALA A 706 26.926 -3.376 4.541 1.00 19.85 C ATOM 1181 H ALA A 706 25.518 -5.437 3.853 1.00 0.00 H ATOM 1182 N LEU A 707 28.889 -5.279 2.972 1.00 19.80 N ATOM 1183 CA LEU A 707 30.275 -5.560 2.624 1.00 21.37 C ATOM 1184 C LEU A 707 30.480 -5.943 1.165 1.00 21.20 C ATOM 1185 O LEU A 707 31.587 -5.788 0.660 1.00 22.07 O ATOM 1186 CB LEU A 707 30.864 -6.637 3.567 1.00 21.55 C ATOM 1187 CG LEU A 707 30.758 -6.366 5.055 1.00 22.69 C ATOM 1188 CD1 LEU A 707 31.137 -7.623 5.843 1.00 25.24 C ATOM 1189 CD2 LEU A 707 31.641 -5.174 5.448 1.00 25.17 C ATOM 1190 H LEU A 707 28.348 -5.989 3.506 1.00 0.00 H ATOM 1191 N VAL A 708 29.428 -6.389 0.445 1.00 19.85 N ATOM 1192 CA VAL A 708 29.545 -6.717 -0.987 1.00 20.34 C ATOM 1193 C VAL A 708 29.061 -5.628 -1.958 1.00 19.44 C ATOM 1194 O VAL A 708 29.237 -5.760 -3.162 1.00 20.07 O ATOM 1195 CB VAL A 708 28.812 -8.043 -1.385 1.00 20.66 C ATOM 1196 CG1 VAL A 708 29.188 -9.180 -0.501 1.00 22.62 C ATOM 1197 CG2 VAL A 708 27.303 -7.886 -1.384 1.00 21.77 C ATOM 1198 H VAL A 708 28.508 -6.504 0.915 1.00 0.00 H ATOM 1199 N HIS A 709 28.414 -4.582 -1.452 1.00 19.09 N ATOM 1200 CA HIS A 709 27.559 -3.762 -2.294 1.00 18.91 C ATOM 1201 C HIS A 709 28.295 -2.875 -3.315 1.00 18.80 C ATOM 1202 O HIS A 709 27.677 -2.366 -4.237 1.00 20.05 O ATOM 1203 CB HIS A 709 26.563 -2.955 -1.439 1.00 18.95 C ATOM 1204 CG HIS A 709 27.079 -1.622 -1.028 1.00 18.91 C ATOM 1205 ND1 HIS A 709 27.871 -1.444 0.091 1.00 19.62 N ATOM 1206 CD2 HIS A 709 26.966 -0.411 -1.609 1.00 20.28 C ATOM 1207 CE1 HIS A 709 28.233 -0.178 0.171 1.00 19.65 C ATOM 1208 NE2 HIS A 709 27.686 0.463 -0.839 1.00 20.01 N ATOM 1209 H HIS A 709 28.521 -4.349 -0.444 1.00 0.00 H ATOM 1210 N ASP A 710 29.604 -2.705 -3.163 1.00 18.86 N ATOM 1211 CA ASP A 710 30.433 -1.963 -4.123 1.00 20.92 C ATOM 1212 C ASP A 710 31.671 -2.718 -4.637 1.00 21.79 C ATOM 1213 O ASP A 710 32.613 -2.078 -5.092 1.00 20.26 O ATOM 1214 CB ASP A 710 30.896 -0.608 -3.488 1.00 20.44 C ATOM 1215 CG ASP A 710 29.843 0.482 -3.598 1.00 19.32 C ATOM 1216 OD1 ASP A 710 29.091 0.558 -4.606 1.00 20.56 O ATOM 1217 OD2 ASP A 710 29.740 1.302 -2.655 1.00 21.07 O ATOM 1218 H ASP A 710 30.063 -3.116 -2.325 1.00 0.00 H ATOM 1219 N LEU A 711 31.640 -4.062 -4.621 1.00 21.12 N ATOM 1220 CA LEU A 711 32.812 -4.876 -4.970 1.00 22.09 C ATOM 1221 C LEU A 711 33.415 -4.463 -6.314 1.00 21.94 C ATOM 1222 O LEU A 711 32.715 -4.371 -7.311 1.00 21.56 O ATOM 1223 CB LEU A 711 32.456 -6.380 -5.089 1.00 20.90 C ATOM 1224 CG LEU A 711 32.168 -7.064 -3.768 1.00 21.50 C ATOM 1225 CD1 LEU A 711 31.407 -8.354 -4.017 1.00 21.60 C ATOM 1226 CD2 LEU A 711 33.448 -7.310 -2.991 1.00 23.08 C ATOM 1227 H LEU A 711 30.757 -4.541 -4.353 1.00 0.00 H ATOM 1228 N ASP A 712 34.737 -4.247 -6.315 1.00 23.52 N ATOM 1229 CA ASP A 712 35.518 -3.972 -7.543 1.00 25.39 C ATOM 1230 C ASP A 712 35.169 -2.627 -8.192 1.00 25.88 C ATOM 1231 O ASP A 712 35.396 -2.435 -9.386 1.00 26.12 O ATOM 1232 CB ASP A 712 35.380 -5.144 -8.523 1.00 25.87 C ATOM 1233 CG ASP A 712 36.411 -5.129 -9.660 1.00 30.14 C ATOM 1234 OD1 ASP A 712 37.579 -4.758 -9.436 1.00 29.77 O ATOM 1235 OD2 ASP A 712 36.009 -5.493 -10.782 1.00 31.02 O ATOM 1236 H ASP A 712 35.241 -4.274 -5.406 1.00 0.00 H ATOM 1237 N HIS A 713 34.649 -1.674 -7.402 1.00 23.44 N ATOM 1238 CA HIS A 713 34.402 -0.341 -7.893 1.00 23.54 C ATOM 1239 C HIS A 713 35.739 0.263 -8.293 1.00 25.85 C ATOM 1240 O HIS A 713 36.705 0.111 -7.557 1.00 26.22 O ATOM 1241 CB HIS A 713 33.789 0.534 -6.769 1.00 23.24 C ATOM 1242 CG HIS A 713 32.965 1.656 -7.274 1.00 23.26 C ATOM 1243 ND1 HIS A 713 33.511 2.759 -7.894 1.00 24.14 N ATOM 1244 CD2 HIS A 713 31.633 1.879 -7.214 1.00 23.97 C ATOM 1245 CE1 HIS A 713 32.548 3.610 -8.199 1.00 24.66 C ATOM 1246 NE2 HIS A 713 31.399 3.077 -7.823 1.00 23.35 N ATOM 1247 H HIS A 713 34.419 -1.902 -6.414 1.00 0.00 H ATOM 1248 N MET A 714 35.774 0.960 -9.424 1.00 29.53 N ATOM 1249 CA MET A 714 37.019 1.560 -9.941 1.00 34.29 C ATOM 1250 C MET A 714 37.046 3.093 -9.823 1.00 34.45 C ATOM 1251 O MET A 714 37.906 3.754 -10.373 1.00 32.48 O ATOM 1252 CB MET A 714 37.223 1.138 -11.407 1.00 38.60 C ATOM 1253 CG MET A 714 37.578 -0.327 -11.594 1.00 49.00 C ATOM 1254 SD MET A 714 39.372 -0.573 -11.589 1.00 67.50 S ATOM 1255 CE MET A 714 39.907 0.365 -13.037 1.00 63.51 C ATOM 1256 H MET A 714 34.894 1.087 -9.963 1.00 0.00 H ATOM 1257 N GLY A 715 36.165 3.653 -9.022 1.00 29.64 N ATOM 1258 CA GLY A 715 36.004 5.105 -8.906 1.00 30.13 C ATOM 1259 C GLY A 715 35.374 5.877 -10.042 1.00 29.30 C ATOM 1260 O GLY A 715 35.518 7.099 -10.101 1.00 27.14 O ATOM 1261 H GLY A 715 35.556 3.038 -8.446 1.00 0.00 H ATOM 1262 N LEU A 716 34.635 5.168 -10.902 1.00 28.37 N ATOM 1263 CA LEU A 716 33.924 5.707 -12.040 1.00 27.89 C ATOM 1264 C LEU A 716 32.469 5.271 -11.922 1.00 27.77 C ATOM 1265 O LEU A 716 32.176 4.097 -11.616 1.00 27.73 O ATOM 1266 CB LEU A 716 34.512 5.168 -13.347 1.00 29.31 C ATOM 1267 CG LEU A 716 36.021 5.368 -13.520 1.00 31.27 C ATOM 1268 CD1 LEU A 716 36.637 4.435 -14.552 1.00 33.78 C ATOM 1269 CD2 LEU A 716 36.277 6.841 -13.848 1.00 32.34 C ATOM 1270 H LEU A 716 34.566 4.143 -10.739 1.00 0.00 H ATOM 1271 N ASN A 717 31.560 6.191 -12.186 1.00 25.43 N ATOM 1272 CA ASN A 717 30.121 5.902 -12.077 1.00 28.10 C ATOM 1273 C ASN A 717 29.529 5.253 -13.331 1.00 25.30 C ATOM 1274 O ASN A 717 30.220 5.122 -14.354 1.00 25.87 O ATOM 1275 CB ASN A 717 29.353 7.153 -11.676 1.00 29.70 C ATOM 1276 CG ASN A 717 29.275 8.205 -12.759 1.00 32.00 C ATOM 1277 OD1 ASN A 717 29.704 8.048 -13.911 1.00 28.90 O ATOM 1278 ND2 ASN A 717 28.733 9.333 -12.358 1.00 33.40 N ATOM 1279 HD22 ASN A 717 28.385 9.425 -11.382 1.00 0.00 H ATOM 1280 HD21 ASN A 717 28.652 10.134 -13.016 1.00 0.00 H ATOM 1281 H ASN A 717 31.867 7.141 -12.477 1.00 0.00 H ATOM 1282 N ASN A 718 28.255 4.880 -13.275 1.00 24.53 N ATOM 1283 CA ASN A 718 27.630 4.191 -14.419 1.00 26.74 C ATOM 1284 C ASN A 718 27.694 5.021 -15.716 1.00 28.60 C ATOM 1285 O ASN A 718 27.978 4.511 -16.806 1.00 28.14 O ATOM 1286 CB ASN A 718 26.169 3.817 -14.134 1.00 26.14 C ATOM 1287 CG ASN A 718 26.047 2.668 -13.145 1.00 27.32 C ATOM 1288 OD1 ASN A 718 27.008 1.879 -12.952 1.00 27.67 O ATOM 1289 ND2 ASN A 718 24.916 2.602 -12.454 1.00 25.46 N ATOM 1290 HD22 ASN A 718 24.148 3.276 -12.648 1.00 0.00 H ATOM 1291 HD21 ASN A 718 24.798 1.876 -11.718 1.00 0.00 H ATOM 1292 H ASN A 718 27.696 5.075 -12.420 1.00 0.00 H ATOM 1293 N SER A 719 27.454 6.311 -15.570 1.00 27.85 N ATOM 1294 CA SER A 719 27.507 7.227 -16.692 1.00 29.57 C ATOM 1295 C SER A 719 28.830 7.182 -17.459 1.00 26.00 C ATOM 1296 O SER A 719 28.836 7.223 -18.697 1.00 28.54 O ATOM 1297 CB SER A 719 27.209 8.679 -16.237 1.00 31.25 C ATOM 1298 OG SER A 719 27.091 9.467 -17.393 1.00 37.68 O ATOM 1299 HG SER A 719 26.352 9.121 -17.953 1.00 0.00 H ATOM 1300 H SER A 719 27.221 6.679 -14.626 1.00 0.00 H ATOM 1301 N PHE A 720 29.932 7.122 -16.745 1.00 25.56 N ATOM 1302 CA PHE A 720 31.227 7.029 -17.380 1.00 26.48 C ATOM 1303 C PHE A 720 31.323 5.846 -18.396 1.00 29.00 C ATOM 1304 O PHE A 720 31.839 6.009 -19.526 1.00 27.15 O ATOM 1305 CB PHE A 720 32.331 6.916 -16.338 1.00 27.57 C ATOM 1306 CG PHE A 720 33.705 6.817 -16.954 1.00 29.32 C ATOM 1307 CD1 PHE A 720 34.422 7.984 -17.257 1.00 31.40 C ATOM 1308 CD2 PHE A 720 34.252 5.573 -17.302 1.00 30.43 C ATOM 1309 CE1 PHE A 720 35.682 7.902 -17.856 1.00 32.37 C ATOM 1310 CE2 PHE A 720 35.499 5.475 -17.908 1.00 33.07 C ATOM 1311 CZ PHE A 720 36.232 6.650 -18.160 1.00 35.30 C ATOM 1312 H PHE A 720 29.871 7.142 -15.707 1.00 0.00 H ATOM 1313 N TYR A 721 30.853 4.671 -17.971 1.00 26.24 N ATOM 1314 CA TYR A 721 30.927 3.478 -18.820 1.00 27.72 C ATOM 1315 C TYR A 721 30.037 3.620 -20.051 1.00 29.57 C ATOM 1316 O TYR A 721 30.405 3.164 -21.117 1.00 31.11 O ATOM 1317 CB TYR A 721 30.589 2.214 -18.010 1.00 27.27 C ATOM 1318 CG TYR A 721 31.626 1.929 -16.947 1.00 26.11 C ATOM 1319 CD1 TYR A 721 32.766 1.226 -17.233 1.00 28.46 C ATOM 1320 CD2 TYR A 721 31.462 2.389 -15.648 1.00 24.90 C ATOM 1321 CE1 TYR A 721 33.741 0.994 -16.268 1.00 30.64 C ATOM 1322 CE2 TYR A 721 32.397 2.131 -14.680 1.00 25.78 C ATOM 1323 CZ TYR A 721 33.530 1.445 -14.980 1.00 29.86 C ATOM 1324 OH TYR A 721 34.467 1.223 -14.015 1.00 29.32 O ATOM 1325 HH TYR A 721 34.061 0.705 -13.275 1.00 0.00 H ATOM 1326 H TYR A 721 30.428 4.601 -17.024 1.00 0.00 H ATOM 1327 N LEU A 722 28.872 4.233 -19.903 1.00 27.59 N ATOM 1328 CA LEU A 722 27.970 4.411 -21.021 1.00 31.91 C ATOM 1329 C LEU A 722 28.450 5.500 -22.011 1.00 37.53 C ATOM 1330 O LEU A 722 28.433 5.294 -23.231 1.00 36.00 O ATOM 1331 CB LEU A 722 26.555 4.683 -20.532 1.00 31.12 C ATOM 1332 CG LEU A 722 25.950 3.549 -19.678 1.00 34.36 C ATOM 1333 CD1 LEU A 722 24.675 4.034 -18.997 1.00 37.32 C ATOM 1334 CD2 LEU A 722 25.671 2.288 -20.484 1.00 35.72 C ATOM 1335 H LEU A 722 28.600 4.593 -18.966 1.00 0.00 H ATOM 1336 N LYS A 723 28.928 6.631 -21.488 1.00 36.00 N ATOM 1337 CA LYS A 723 29.403 7.732 -22.329 1.00 36.19 C ATOM 1338 C LYS A 723 30.629 7.376 -23.138 1.00 34.14 C ATOM 1339 O LYS A 723 30.772 7.859 -24.262 1.00 39.20 O ATOM 1340 CB LYS A 723 29.760 8.960 -21.470 1.00 37.53 C ATOM 1341 CG LYS A 723 28.555 9.674 -20.922 1.00 41.83 C ATOM 1342 CD LYS A 723 28.958 10.965 -20.197 1.00 45.40 C ATOM 1343 CE LYS A 723 30.021 10.751 -19.122 1.00 44.99 C ATOM 1344 NZ LYS A 723 30.126 11.951 -18.227 1.00 44.10 N ATOM 1345 HZ1 LYS A 723 30.386 12.783 -18.794 1.00 0.00 H ATOM 1346 HZ2 LYS A 723 29.210 12.118 -17.764 1.00 0.00 H ATOM 1347 HZ3 LYS A 723 30.855 11.781 -17.505 1.00 0.00 H ATOM 1348 H LYS A 723 28.964 6.733 -20.454 1.00 0.00 H ATOM 1349 N THR A 724 31.553 6.632 -22.551 1.00 31.47 N ATOM 1350 CA THR A 724 32.768 6.264 -23.225 1.00 32.42 C ATOM 1351 C THR A 724 32.601 4.997 -24.114 1.00 34.92 C ATOM 1352 O THR A 724 33.558 4.611 -24.762 1.00 35.22 O ATOM 1353 CB THR A 724 33.886 6.004 -22.232 1.00 34.34 C ATOM 1354 OG1 THR A 724 33.492 4.970 -21.313 1.00 31.56 O ATOM 1355 CG2 THR A 724 34.259 7.305 -21.479 1.00 35.61 C ATOM 1356 HG1 THR A 724 32.680 5.256 -20.824 1.00 0.00 H ATOM 1357 H THR A 724 31.396 6.305 -21.576 1.00 0.00 H ATOM 1358 N GLU A 725 31.409 4.384 -24.140 1.00 33.60 N ATOM 1359 CA GLU A 725 31.166 3.096 -24.815 1.00 36.38 C ATOM 1360 C GLU A 725 32.250 2.108 -24.430 1.00 36.27 C ATOM 1361 O GLU A 725 32.844 1.454 -25.294 1.00 35.75 O ATOM 1362 CB GLU A 725 31.069 3.296 -26.333 1.00 40.25 C ATOM 1363 CG GLU A 725 30.029 4.332 -26.712 1.00 45.24 C ATOM 1364 CD GLU A 725 29.826 4.500 -28.200 1.00 47.45 C ATOM 1365 OE1 GLU A 725 30.769 4.936 -28.890 1.00 50.81 O ATOM 1366 OE2 GLU A 725 28.716 4.203 -28.676 1.00 49.89 O ATOM 1367 H GLU A 725 30.611 4.843 -23.657 1.00 0.00 H ATOM 1368 N SER A 726 32.522 1.989 -23.122 1.00 30.48 N ATOM 1369 CA SER A 726 33.465 1.006 -22.651 1.00 31.93 C ATOM 1370 C SER A 726 32.828 -0.391 -22.879 1.00 30.29 C ATOM 1371 O SER A 726 31.609 -0.493 -23.017 1.00 29.83 O ATOM 1372 CB SER A 726 33.736 1.190 -21.154 1.00 35.57 C ATOM 1373 OG SER A 726 32.581 0.773 -20.425 1.00 39.55 O ATOM 1374 HG SER A 726 31.804 1.323 -20.697 1.00 0.00 H ATOM 1375 H SER A 726 32.047 2.613 -22.440 1.00 0.00 H ATOM 1376 N PRO A 727 33.633 -1.459 -22.878 1.00 32.45 N ATOM 1377 CA PRO A 727 33.084 -2.816 -23.074 1.00 30.06 C ATOM 1378 C PRO A 727 31.972 -3.167 -22.074 1.00 30.29 C ATOM 1379 O PRO A 727 30.943 -3.706 -22.444 1.00 28.10 O ATOM 1380 CB PRO A 727 34.309 -3.705 -22.861 1.00 31.43 C ATOM 1381 CG PRO A 727 35.438 -2.886 -23.364 1.00 33.18 C ATOM 1382 CD PRO A 727 35.103 -1.466 -22.942 1.00 34.03 C ATOM 1383 N LEU A 728 32.156 -2.787 -20.825 1.00 32.79 N ATOM 1384 CA LEU A 728 31.150 -3.105 -19.786 1.00 33.65 C ATOM 1385 C LEU A 728 29.837 -2.329 -20.014 1.00 29.14 C ATOM 1386 O LEU A 728 28.743 -2.858 -19.790 1.00 29.58 O ATOM 1387 CB LEU A 728 31.752 -2.832 -18.396 1.00 38.43 C ATOM 1388 CG LEU A 728 31.459 -3.889 -17.329 1.00 49.95 C ATOM 1389 CD1 LEU A 728 32.050 -5.252 -17.685 1.00 50.59 C ATOM 1390 CD2 LEU A 728 32.036 -3.380 -16.005 1.00 55.44 C ATOM 1391 H LEU A 728 33.015 -2.260 -20.567 1.00 0.00 H ATOM 1392 N GLY A 729 29.961 -1.074 -20.460 1.00 26.06 N ATOM 1393 CA GLY A 729 28.827 -0.276 -20.876 1.00 28.38 C ATOM 1394 C GLY A 729 28.069 -0.834 -22.062 1.00 28.67 C ATOM 1395 O GLY A 729 26.834 -0.859 -22.080 1.00 28.88 O ATOM 1396 H GLY A 729 30.911 -0.654 -20.510 1.00 0.00 H ATOM 1397 N ILE A 730 28.819 -1.300 -23.060 1.00 29.52 N ATOM 1398 CA ILE A 730 28.189 -1.895 -24.246 1.00 28.53 C ATOM 1399 C ILE A 730 27.398 -3.144 -23.796 1.00 27.48 C ATOM 1400 O ILE A 730 26.234 -3.324 -24.160 1.00 28.32 O ATOM 1401 CB ILE A 730 29.264 -2.206 -25.322 1.00 31.81 C ATOM 1402 CG1 ILE A 730 29.880 -0.896 -25.866 1.00 32.08 C ATOM 1403 CG2 ILE A 730 28.683 -3.097 -26.439 1.00 29.65 C ATOM 1404 CD1 ILE A 730 31.133 -1.070 -26.710 1.00 33.69 C ATOM 1405 H ILE A 730 29.856 -1.242 -22.999 1.00 0.00 H ATOM 1406 N LEU A 731 28.017 -3.976 -22.967 1.00 26.38 N ATOM 1407 CA LEU A 731 27.356 -5.187 -22.452 1.00 28.29 C ATOM 1408 C LEU A 731 26.066 -4.862 -21.698 1.00 31.27 C ATOM 1409 O LEU A 731 25.019 -5.501 -21.906 1.00 29.17 O ATOM 1410 CB LEU A 731 28.300 -6.013 -21.574 1.00 29.72 C ATOM 1411 CG LEU A 731 27.684 -7.303 -20.964 1.00 32.29 C ATOM 1412 CD1 LEU A 731 26.873 -8.139 -21.972 1.00 33.89 C ATOM 1413 CD2 LEU A 731 28.755 -8.184 -20.370 1.00 34.50 C ATOM 1414 H LEU A 731 28.993 -3.767 -22.674 1.00 0.00 H ATOM 1415 N SER A 732 26.133 -3.855 -20.814 1.00 30.89 N ATOM 1416 CA SER A 732 24.943 -3.413 -20.090 1.00 32.46 C ATOM 1417 C SER A 732 23.820 -2.950 -21.022 1.00 31.31 C ATOM 1418 O SER A 732 22.691 -3.403 -20.870 1.00 35.31 O ATOM 1419 CB SER A 732 25.315 -2.304 -19.103 1.00 34.81 C ATOM 1420 OG SER A 732 26.278 -2.832 -18.176 1.00 43.32 O ATOM 1421 HG SER A 732 27.081 -3.131 -18.671 1.00 0.00 H ATOM 1422 H SER A 732 27.044 -3.383 -20.642 1.00 0.00 H ATOM 1423 N SER A 733 24.127 -2.078 -21.973 1.00 33.46 N ATOM 1424 CA SER A 733 23.137 -1.623 -22.954 1.00 38.05 C ATOM 1425 C SER A 733 22.573 -2.808 -23.753 1.00 36.81 C ATOM 1426 O SER A 733 21.369 -2.932 -23.882 1.00 38.69 O ATOM 1427 CB SER A 733 23.731 -0.618 -23.942 1.00 40.85 C ATOM 1428 OG SER A 733 24.431 0.398 -23.263 1.00 50.66 O ATOM 1429 HG SER A 733 25.166 -0.005 -22.736 1.00 0.00 H ATOM 1430 H SER A 733 25.097 -1.707 -22.024 1.00 0.00 H ATOM 1431 N ALA A 734 23.455 -3.662 -24.278 1.00 34.13 N ATOM 1432 CA ALA A 734 23.006 -4.832 -25.080 1.00 34.72 C ATOM 1433 C ALA A 734 22.112 -5.763 -24.291 1.00 35.01 C ATOM 1434 O ALA A 734 21.125 -6.242 -24.834 1.00 34.12 O ATOM 1435 CB ALA A 734 24.195 -5.576 -25.663 1.00 34.16 C ATOM 1436 H ALA A 734 24.472 -3.507 -24.124 1.00 0.00 H ATOM 1437 N SER A 735 22.416 -6.001 -23.003 1.00 32.01 N ATOM 1438 CA SER A 735 21.640 -6.949 -22.186 1.00 36.00 C ATOM 1439 C SER A 735 20.432 -6.334 -21.525 1.00 36.86 C ATOM 1440 O SER A 735 19.666 -7.056 -20.885 1.00 36.62 O ATOM 1441 CB SER A 735 22.501 -7.664 -21.118 1.00 37.39 C ATOM 1442 OG SER A 735 23.251 -6.736 -20.374 1.00 39.48 O ATOM 1443 HG SER A 735 23.792 -7.217 -19.699 1.00 0.00 H ATOM 1444 H SER A 735 23.221 -5.502 -22.572 1.00 0.00 H ATOM 1445 N GLY A 736 20.258 -5.023 -21.692 1.00 37.76 N ATOM 1446 CA GLY A 736 19.064 -4.319 -21.253 1.00 39.24 C ATOM 1447 C GLY A 736 19.054 -3.831 -19.808 1.00 40.17 C ATOM 1448 O GLY A 736 17.991 -3.529 -19.298 1.00 41.30 O ATOM 1449 H GLY A 736 21.011 -4.478 -22.158 1.00 0.00 H ATOM 1450 N ASN A 737 20.201 -3.755 -19.133 1.00 40.19 N ATOM 1451 CA ASN A 737 20.225 -3.209 -17.764 1.00 40.04 C ATOM 1452 C ASN A 737 21.296 -2.138 -17.651 1.00 40.86 C ATOM 1453 O ASN A 737 22.464 -2.451 -17.718 1.00 42.32 O ATOM 1454 CB ASN A 737 20.439 -4.317 -16.711 1.00 42.30 C ATOM 1455 CG ASN A 737 20.237 -3.810 -15.280 1.00 42.11 C ATOM 1456 OD1 ASN A 737 20.655 -2.707 -14.939 1.00 37.17 O ATOM 1457 ND2 ASN A 737 19.552 -4.597 -14.454 1.00 41.21 N ATOM 1458 HD22 ASN A 737 19.215 -5.525 -14.780 1.00 0.00 H ATOM 1459 HD21 ASN A 737 19.354 -4.284 -13.482 1.00 0.00 H ATOM 1460 H ASN A 737 21.084 -4.083 -19.575 1.00 0.00 H ATOM 1461 N THR A 738 20.879 -0.900 -17.404 1.00 39.37 N ATOM 1462 CA THR A 738 21.792 0.243 -17.275 1.00 41.30 C ATOM 1463 C THR A 738 22.522 0.373 -15.930 1.00 36.22 C ATOM 1464 O THR A 738 23.388 1.260 -15.788 1.00 31.67 O ATOM 1465 CB THR A 738 21.036 1.576 -17.517 1.00 45.54 C ATOM 1466 OG1 THR A 738 19.908 1.657 -16.631 1.00 52.43 O ATOM 1467 CG2 THR A 738 20.544 1.639 -18.941 1.00 48.87 C ATOM 1468 HG1 THR A 738 20.223 1.622 -15.693 1.00 0.00 H ATOM 1469 H THR A 738 19.858 -0.733 -17.297 1.00 0.00 H ATOM 1470 N SER A 739 22.223 -0.491 -14.955 1.00 31.06 N ATOM 1471 CA SER A 739 22.951 -0.435 -13.674 1.00 28.73 C ATOM 1472 C SER A 739 24.250 -1.197 -13.812 1.00 26.92 C ATOM 1473 O SER A 739 24.421 -2.292 -13.285 1.00 26.10 O ATOM 1474 CB SER A 739 22.087 -0.967 -12.540 1.00 27.73 C ATOM 1475 OG SER A 739 20.869 -0.242 -12.451 1.00 27.11 O ATOM 1476 HG SER A 739 21.066 0.713 -12.281 1.00 0.00 H ATOM 1477 H SER A 739 21.478 -1.202 -15.100 1.00 0.00 H ATOM 1478 N VAL A 740 25.182 -0.579 -14.529 1.00 26.31 N ATOM 1479 CA VAL A 740 26.416 -1.226 -14.944 1.00 26.25 C ATOM 1480 C VAL A 740 27.179 -1.790 -13.757 1.00 26.13 C ATOM 1481 O VAL A 740 27.543 -2.973 -13.726 1.00 24.52 O ATOM 1482 CB VAL A 740 27.339 -0.228 -15.697 1.00 27.97 C ATOM 1483 CG1 VAL A 740 28.641 -0.910 -16.080 1.00 28.83 C ATOM 1484 CG2 VAL A 740 26.621 0.337 -16.912 1.00 30.54 C ATOM 1485 H VAL A 740 25.022 0.411 -14.805 1.00 0.00 H ATOM 1486 N LEU A 741 27.443 -0.925 -12.775 1.00 23.63 N ATOM 1487 CA LEU A 741 28.253 -1.328 -11.640 1.00 25.37 C ATOM 1488 C LEU A 741 27.513 -2.313 -10.712 1.00 22.56 C ATOM 1489 O LEU A 741 28.126 -3.260 -10.197 1.00 21.24 O ATOM 1490 CB LEU A 741 28.710 -0.135 -10.805 1.00 27.10 C ATOM 1491 CG LEU A 741 29.766 0.711 -11.495 1.00 32.68 C ATOM 1492 CD1 LEU A 741 29.808 2.065 -10.827 1.00 35.82 C ATOM 1493 CD2 LEU A 741 31.117 0.036 -11.460 1.00 35.62 C ATOM 1494 H LEU A 741 27.066 0.043 -12.824 1.00 0.00 H ATOM 1495 N GLU A 742 26.232 -2.052 -10.477 1.00 21.83 N ATOM 1496 CA GLU A 742 25.480 -2.791 -9.481 1.00 20.63 C ATOM 1497 C GLU A 742 25.325 -4.239 -9.910 1.00 21.87 C ATOM 1498 O GLU A 742 25.535 -5.154 -9.096 1.00 21.12 O ATOM 1499 CB GLU A 742 24.120 -2.137 -9.170 1.00 21.77 C ATOM 1500 CG GLU A 742 24.239 -0.765 -8.456 1.00 23.70 C ATOM 1501 CD GLU A 742 24.693 0.394 -9.352 1.00 27.30 C ATOM 1502 OE1 GLU A 742 24.631 0.293 -10.609 1.00 26.86 O ATOM 1503 OE2 GLU A 742 25.147 1.414 -8.788 1.00 29.02 O ATOM 1504 H GLU A 742 25.758 -1.302 -11.019 1.00 0.00 H ATOM 1505 N VAL A 743 25.077 -4.476 -11.201 1.00 21.01 N ATOM 1506 CA VAL A 743 25.095 -5.859 -11.703 1.00 23.13 C ATOM 1507 C VAL A 743 26.471 -6.538 -11.522 1.00 23.02 C ATOM 1508 O VAL A 743 26.558 -7.713 -11.128 1.00 22.06 O ATOM 1509 CB VAL A 743 24.572 -5.935 -13.146 1.00 24.45 C ATOM 1510 CG1 VAL A 743 24.751 -7.331 -13.703 1.00 26.19 C ATOM 1511 CG2 VAL A 743 23.080 -5.579 -13.164 1.00 26.27 C ATOM 1512 H VAL A 743 24.872 -3.688 -11.848 1.00 0.00 H ATOM 1513 N HIS A 744 27.534 -5.785 -11.794 1.00 22.51 N ATOM 1514 CA HIS A 744 28.897 -6.254 -11.596 1.00 22.83 C ATOM 1515 C HIS A 744 29.174 -6.636 -10.151 1.00 23.65 C ATOM 1516 O HIS A 744 29.739 -7.695 -9.894 1.00 23.25 O ATOM 1517 CB HIS A 744 29.875 -5.209 -12.110 1.00 24.53 C ATOM 1518 CG HIS A 744 31.307 -5.615 -12.028 1.00 27.83 C ATOM 1519 ND1 HIS A 744 31.846 -6.578 -12.861 1.00 31.32 N ATOM 1520 CD2 HIS A 744 32.335 -5.133 -11.288 1.00 27.54 C ATOM 1521 CE1 HIS A 744 33.139 -6.697 -12.608 1.00 30.01 C ATOM 1522 NE2 HIS A 744 33.458 -5.845 -11.647 1.00 29.64 N ATOM 1523 H HIS A 744 27.385 -4.824 -12.162 1.00 0.00 H ATOM 1524 N HIS A 745 28.767 -5.776 -9.196 1.00 20.85 N ATOM 1525 CA HIS A 745 28.936 -6.060 -7.787 1.00 21.11 C ATOM 1526 C HIS A 745 28.221 -7.372 -7.422 1.00 20.83 C ATOM 1527 O HIS A 745 28.792 -8.206 -6.714 1.00 22.23 O ATOM 1528 CB HIS A 745 28.431 -4.928 -6.854 1.00 21.30 C ATOM 1529 CG HIS A 745 28.920 -3.551 -7.182 1.00 20.11 C ATOM 1530 ND1 HIS A 745 30.235 -3.268 -7.510 1.00 21.71 N ATOM 1531 CD2 HIS A 745 28.264 -2.364 -7.193 1.00 20.80 C ATOM 1532 CE1 HIS A 745 30.348 -1.969 -7.737 1.00 21.43 C ATOM 1533 NE2 HIS A 745 29.178 -1.397 -7.508 1.00 22.23 N ATOM 1534 H HIS A 745 28.318 -4.882 -9.480 1.00 0.00 H ATOM 1535 N CYS A 746 26.996 -7.558 -7.906 1.00 20.17 N ATOM 1536 CA CYS A 746 26.248 -8.784 -7.615 1.00 21.92 C ATOM 1537 C CYS A 746 26.956 -10.027 -8.158 1.00 21.28 C ATOM 1538 O CYS A 746 26.982 -11.059 -7.499 1.00 21.49 O ATOM 1539 CB CYS A 746 24.852 -8.704 -8.227 1.00 21.83 C ATOM 1540 SG CYS A 746 23.744 -7.528 -7.371 1.00 23.89 S ATOM 1541 H CYS A 746 26.563 -6.822 -8.500 1.00 0.00 H ATOM 1542 N ASN A 747 27.459 -9.948 -9.389 1.00 21.35 N ATOM 1543 CA ASN A 747 28.255 -11.043 -9.926 1.00 22.54 C ATOM 1544 C ASN A 747 29.409 -11.487 -9.060 1.00 21.87 C ATOM 1545 O ASN A 747 29.615 -12.698 -8.848 1.00 21.27 O ATOM 1546 CB ASN A 747 28.705 -10.755 -11.366 1.00 22.97 C ATOM 1547 CG ASN A 747 27.634 -11.180 -12.341 1.00 28.21 C ATOM 1548 OD1 ASN A 747 27.387 -12.400 -12.522 1.00 35.08 O ATOM 1549 ND2 ASN A 747 26.942 -10.250 -12.878 1.00 27.05 N ATOM 1550 HD22 ASN A 747 27.183 -9.254 -12.700 1.00 0.00 H ATOM 1551 HD21 ASN A 747 26.138 -10.489 -13.493 1.00 0.00 H ATOM 1552 H ASN A 747 27.283 -9.102 -9.968 1.00 0.00 H ATOM 1553 N LEU A 748 30.126 -10.524 -8.498 1.00 22.17 N ATOM 1554 CA LEU A 748 31.263 -10.851 -7.687 1.00 22.09 C ATOM 1555 C LEU A 748 30.851 -11.362 -6.322 1.00 22.28 C ATOM 1556 O LEU A 748 31.548 -12.205 -5.751 1.00 21.72 O ATOM 1557 CB LEU A 748 32.210 -9.684 -7.596 1.00 24.86 C ATOM 1558 CG LEU A 748 32.903 -9.305 -8.901 1.00 28.24 C ATOM 1559 CD1 LEU A 748 33.653 -7.989 -8.765 1.00 29.48 C ATOM 1560 CD2 LEU A 748 33.875 -10.388 -9.359 1.00 32.40 C ATOM 1561 H LEU A 748 29.863 -9.529 -8.646 1.00 0.00 H ATOM 1562 N ALA A 749 29.713 -10.888 -5.802 1.00 20.67 N ATOM 1563 CA ALA A 749 29.216 -11.395 -4.536 1.00 20.34 C ATOM 1564 C ALA A 749 28.877 -12.883 -4.694 1.00 21.05 C ATOM 1565 O ALA A 749 29.221 -13.702 -3.842 1.00 21.28 O ATOM 1566 CB ALA A 749 27.983 -10.635 -4.098 1.00 20.47 C ATOM 1567 H ALA A 749 29.181 -10.152 -6.308 1.00 0.00 H ATOM 1568 N VAL A 750 28.183 -13.208 -5.772 1.00 22.23 N ATOM 1569 CA VAL A 750 27.774 -14.598 -6.038 1.00 25.45 C ATOM 1570 C VAL A 750 29.013 -15.515 -6.134 1.00 25.53 C ATOM 1571 O VAL A 750 28.993 -16.649 -5.636 1.00 26.17 O ATOM 1572 CB VAL A 750 26.840 -14.661 -7.292 1.00 27.14 C ATOM 1573 CG1 VAL A 750 26.772 -16.046 -7.881 1.00 32.23 C ATOM 1574 CG2 VAL A 750 25.450 -14.141 -6.934 1.00 27.64 C ATOM 1575 H VAL A 750 27.919 -12.464 -6.449 1.00 0.00 H ATOM 1576 N GLU A 751 30.069 -15.023 -6.767 1.00 26.48 N ATOM 1577 CA GLU A 751 31.339 -15.745 -6.879 1.00 28.17 C ATOM 1578 C GLU A 751 31.952 -16.065 -5.504 1.00 26.52 C ATOM 1579 O GLU A 751 32.331 -17.226 -5.236 1.00 24.39 O ATOM 1580 CB GLU A 751 32.290 -14.922 -7.736 1.00 33.70 C ATOM 1581 CG GLU A 751 33.636 -15.534 -8.035 1.00 44.52 C ATOM 1582 CD GLU A 751 34.430 -14.642 -8.994 1.00 49.93 C ATOM 1583 OE1 GLU A 751 33.945 -14.441 -10.123 1.00 51.16 O ATOM 1584 OE2 GLU A 751 35.487 -14.103 -8.588 1.00 55.76 O ATOM 1585 H GLU A 751 29.992 -14.082 -7.204 1.00 0.00 H ATOM 1586 N ILE A 752 32.005 -15.074 -4.608 1.00 24.22 N ATOM 1587 CA ILE A 752 32.516 -15.298 -3.261 1.00 24.32 C ATOM 1588 C ILE A 752 31.695 -16.345 -2.518 1.00 24.69 C ATOM 1589 O ILE A 752 32.240 -17.266 -1.838 1.00 25.12 O ATOM 1590 CB ILE A 752 32.553 -14.000 -2.432 1.00 25.05 C ATOM 1591 CG1 ILE A 752 33.604 -13.063 -3.010 1.00 26.09 C ATOM 1592 CG2 ILE A 752 32.860 -14.320 -0.967 1.00 25.88 C ATOM 1593 CD1 ILE A 752 33.578 -11.650 -2.474 1.00 27.03 C ATOM 1594 H ILE A 752 31.675 -14.125 -4.877 1.00 0.00 H ATOM 1595 N LEU A 753 30.383 -16.235 -2.657 1.00 22.33 N ATOM 1596 CA LEU A 753 29.507 -17.128 -1.962 1.00 22.75 C ATOM 1597 C LEU A 753 29.431 -18.544 -2.568 1.00 24.34 C ATOM 1598 O LEU A 753 28.791 -19.413 -1.990 1.00 25.78 O ATOM 1599 CB LEU A 753 28.115 -16.527 -1.857 1.00 23.55 C ATOM 1600 CG LEU A 753 28.091 -15.225 -1.018 1.00 22.54 C ATOM 1601 CD1 LEU A 753 26.728 -14.538 -1.188 1.00 23.92 C ATOM 1602 CD2 LEU A 753 28.392 -15.439 0.470 1.00 23.41 C ATOM 1603 H LEU A 753 29.987 -15.497 -3.274 1.00 0.00 H ATOM 1604 N SER A 754 30.012 -18.760 -3.735 1.00 23.34 N ATOM 1605 CA SER A 754 29.920 -20.086 -4.408 1.00 23.97 C ATOM 1606 C SER A 754 30.923 -21.122 -3.789 1.00 26.92 C ATOM 1607 O SER A 754 30.858 -22.312 -4.117 1.00 26.36 O ATOM 1608 CB SER A 754 30.177 -19.945 -5.906 1.00 25.20 C ATOM 1609 OG SER A 754 31.547 -19.663 -6.155 1.00 24.08 O ATOM 1610 HG SER A 754 31.795 -18.817 -5.706 1.00 0.00 H ATOM 1611 H SER A 754 30.543 -17.991 -4.192 1.00 0.00 H ATOM 1612 N ASP A 755 31.821 -20.648 -2.929 1.00 26.85 N ATOM 1613 CA ASP A 755 32.794 -21.482 -2.199 1.00 30.25 C ATOM 1614 C ASP A 755 32.282 -21.609 -0.767 1.00 27.97 C ATOM 1615 O ASP A 755 32.166 -20.585 -0.059 1.00 27.11 O ATOM 1616 CB ASP A 755 34.167 -20.829 -2.193 1.00 30.33 C ATOM 1617 CG ASP A 755 35.250 -21.696 -1.486 1.00 37.82 C ATOM 1618 OD1 ASP A 755 34.927 -22.762 -0.888 1.00 37.16 O ATOM 1619 OD2 ASP A 755 36.433 -21.278 -1.490 1.00 43.07 O ATOM 1620 H ASP A 755 31.838 -19.622 -2.761 1.00 0.00 H ATOM 1621 N PRO A 756 32.029 -22.844 -0.301 1.00 29.14 N ATOM 1622 CA PRO A 756 31.601 -23.057 1.104 1.00 28.44 C ATOM 1623 C PRO A 756 32.493 -22.400 2.152 1.00 26.93 C ATOM 1624 O PRO A 756 31.985 -21.943 3.169 1.00 28.91 O ATOM 1625 CB PRO A 756 31.623 -24.596 1.253 1.00 32.19 C ATOM 1626 CG PRO A 756 31.325 -25.066 -0.135 1.00 33.57 C ATOM 1627 CD PRO A 756 32.074 -24.127 -1.043 1.00 33.42 C ATOM 1628 N GLU A 757 33.794 -22.312 1.912 1.00 26.50 N ATOM 1629 CA GLU A 757 34.706 -21.751 2.927 1.00 29.77 C ATOM 1630 C GLU A 757 34.481 -20.236 3.157 1.00 29.21 C ATOM 1631 O GLU A 757 34.931 -19.704 4.164 1.00 27.90 O ATOM 1632 CB GLU A 757 36.189 -22.021 2.596 1.00 38.10 C ATOM 1633 CG GLU A 757 36.704 -23.395 3.038 1.00 48.10 C ATOM 1634 CD GLU A 757 36.657 -23.587 4.561 1.00 56.66 C ATOM 1635 OE1 GLU A 757 37.599 -23.144 5.275 1.00 61.15 O ATOM 1636 OE2 GLU A 757 35.651 -24.181 5.049 1.00 65.51 O ATOM 1637 H GLU A 757 34.174 -22.641 1.002 1.00 0.00 H ATOM 1638 N SER A 758 33.799 -19.561 2.220 1.00 29.74 N ATOM 1639 CA SER A 758 33.450 -18.127 2.389 1.00 27.93 C ATOM 1640 C SER A 758 31.964 -17.851 2.178 1.00 27.93 C ATOM 1641 O SER A 758 31.552 -16.672 1.998 1.00 26.71 O ATOM 1642 CB SER A 758 34.318 -17.250 1.478 1.00 26.63 C ATOM 1643 OG SER A 758 34.309 -17.653 0.114 1.00 27.72 O ATOM 1644 HG SER A 758 33.383 -17.613 -0.235 1.00 0.00 H ATOM 1645 H SER A 758 33.507 -20.054 1.352 1.00 0.00 H ATOM 1646 N ASP A 759 31.144 -18.898 2.262 1.00 24.96 N ATOM 1647 CA ASP A 759 29.691 -18.724 2.126 1.00 22.94 C ATOM 1648 C ASP A 759 29.004 -18.583 3.479 1.00 22.53 C ATOM 1649 O ASP A 759 28.657 -19.573 4.134 1.00 21.81 O ATOM 1650 CB ASP A 759 29.078 -19.864 1.336 1.00 23.40 C ATOM 1651 CG ASP A 759 27.563 -19.663 1.084 1.00 25.52 C ATOM 1652 OD1 ASP A 759 27.034 -18.538 1.335 1.00 24.50 O ATOM 1653 OD2 ASP A 759 26.911 -20.604 0.621 1.00 25.75 O ATOM 1654 H ASP A 759 31.536 -19.847 2.425 1.00 0.00 H ATOM 1655 N VAL A 760 28.761 -17.327 3.880 1.00 22.89 N ATOM 1656 CA VAL A 760 28.068 -17.016 5.149 1.00 21.21 C ATOM 1657 C VAL A 760 26.603 -17.486 5.162 1.00 20.67 C ATOM 1658 O VAL A 760 25.943 -17.461 6.219 1.00 22.44 O ATOM 1659 CB VAL A 760 28.141 -15.510 5.465 1.00 23.57 C ATOM 1660 CG1 VAL A 760 29.587 -15.048 5.704 1.00 23.73 C ATOM 1661 CG2 VAL A 760 27.525 -14.661 4.356 1.00 23.23 C ATOM 1662 H VAL A 760 29.072 -16.540 3.275 1.00 0.00 H ATOM 1663 N PHE A 761 26.075 -17.879 3.995 1.00 19.85 N ATOM 1664 CA PHE A 761 24.720 -18.467 3.893 1.00 19.38 C ATOM 1665 C PHE A 761 24.714 -20.008 3.732 1.00 21.41 C ATOM 1666 O PHE A 761 23.674 -20.590 3.453 1.00 21.17 O ATOM 1667 CB PHE A 761 23.961 -17.839 2.732 1.00 20.45 C ATOM 1668 CG PHE A 761 23.880 -16.300 2.797 1.00 22.11 C ATOM 1669 CD1 PHE A 761 23.595 -15.650 3.991 1.00 22.45 C ATOM 1670 CD2 PHE A 761 24.065 -15.541 1.649 1.00 24.37 C ATOM 1671 CE1 PHE A 761 23.553 -14.243 4.033 1.00 23.59 C ATOM 1672 CE2 PHE A 761 23.985 -14.130 1.670 1.00 24.31 C ATOM 1673 CZ PHE A 761 23.720 -13.497 2.875 1.00 22.77 C ATOM 1674 H PHE A 761 26.638 -17.767 3.128 1.00 0.00 H ATOM 1675 N ASP A 762 25.864 -20.652 3.909 1.00 22.73 N ATOM 1676 CA ASP A 762 25.967 -22.121 3.730 1.00 24.55 C ATOM 1677 C ASP A 762 25.124 -22.893 4.763 1.00 26.32 C ATOM 1678 O ASP A 762 24.716 -24.042 4.525 1.00 27.05 O ATOM 1679 CB ASP A 762 27.448 -22.553 3.799 1.00 26.14 C ATOM 1680 CG ASP A 762 27.688 -23.952 3.222 1.00 29.54 C ATOM 1681 OD1 ASP A 762 26.910 -24.416 2.371 1.00 28.41 O ATOM 1682 OD2 ASP A 762 28.672 -24.575 3.619 1.00 32.91 O ATOM 1683 H ASP A 762 26.711 -20.113 4.179 1.00 0.00 H ATOM 1684 N GLY A 763 24.818 -22.271 5.900 1.00 24.33 N ATOM 1685 CA GLY A 763 23.916 -22.900 6.873 1.00 26.05 C ATOM 1686 C GLY A 763 22.452 -22.875 6.535 1.00 26.65 C ATOM 1687 O GLY A 763 21.631 -23.472 7.243 1.00 28.64 O ATOM 1688 H GLY A 763 25.221 -21.333 6.100 1.00 0.00 H ATOM 1689 N LEU A 764 22.089 -22.205 5.453 1.00 24.88 N ATOM 1690 CA LEU A 764 20.692 -22.103 5.011 1.00 24.32 C ATOM 1691 C LEU A 764 20.404 -23.035 3.848 1.00 26.81 C ATOM 1692 O LEU A 764 21.309 -23.407 3.097 1.00 24.85 O ATOM 1693 CB LEU A 764 20.395 -20.672 4.520 1.00 25.15 C ATOM 1694 CG LEU A 764 20.784 -19.514 5.417 1.00 25.31 C ATOM 1695 CD1 LEU A 764 20.558 -18.174 4.722 1.00 24.56 C ATOM 1696 CD2 LEU A 764 20.008 -19.570 6.728 1.00 26.67 C ATOM 1697 H LEU A 764 22.825 -21.730 4.892 1.00 0.00 H ATOM 1698 N GLU A 765 19.130 -23.342 3.671 1.00 28.29 N ATOM 1699 CA GLU A 765 18.683 -24.153 2.568 1.00 31.68 C ATOM 1700 C GLU A 765 17.276 -23.785 2.193 1.00 30.74 C ATOM 1701 O GLU A 765 16.610 -23.037 2.918 1.00 31.72 O ATOM 1702 CB GLU A 765 18.744 -25.618 2.958 1.00 40.38 C ATOM 1703 CG GLU A 765 17.836 -26.011 4.103 1.00 43.60 C ATOM 1704 CD GLU A 765 18.100 -27.456 4.540 1.00 57.56 C ATOM 1705 OE1 GLU A 765 18.020 -28.347 3.663 1.00 57.59 O ATOM 1706 OE2 GLU A 765 18.395 -27.691 5.743 1.00 64.75 O ATOM 1707 H GLU A 765 18.428 -22.986 4.351 1.00 0.00 H ATOM 1708 N GLY A 766 16.836 -24.291 1.043 1.00 27.05 N ATOM 1709 CA GLY A 766 15.482 -24.076 0.588 1.00 27.63 C ATOM 1710 C GLY A 766 15.143 -22.583 0.515 1.00 28.20 C ATOM 1711 O GLY A 766 15.976 -21.748 0.104 1.00 26.52 O ATOM 1712 H GLY A 766 17.484 -24.856 0.457 1.00 0.00 H ATOM 1713 N ALA A 767 13.953 -22.249 0.969 1.00 28.53 N ATOM 1714 CA ALA A 767 13.421 -20.892 0.834 1.00 29.92 C ATOM 1715 C ALA A 767 14.244 -19.842 1.586 1.00 28.07 C ATOM 1716 O ALA A 767 14.349 -18.714 1.108 1.00 27.74 O ATOM 1717 CB ALA A 767 11.971 -20.854 1.311 1.00 33.29 C ATOM 1718 H ALA A 767 13.372 -22.973 1.439 1.00 0.00 H ATOM 1719 N GLU A 768 14.825 -20.207 2.712 1.00 24.82 N ATOM 1720 CA GLU A 768 15.639 -19.286 3.471 1.00 26.95 C ATOM 1721 C GLU A 768 16.870 -18.913 2.673 1.00 23.69 C ATOM 1722 O GLU A 768 17.234 -17.791 2.631 1.00 20.10 O ATOM 1723 CB GLU A 768 16.061 -19.832 4.828 1.00 29.22 C ATOM 1724 CG GLU A 768 15.059 -19.619 5.936 1.00 33.30 C ATOM 1725 CD GLU A 768 15.577 -20.091 7.280 1.00 38.14 C ATOM 1726 OE1 GLU A 768 16.575 -20.793 7.317 1.00 37.72 O ATOM 1727 OE2 GLU A 768 14.972 -19.776 8.302 1.00 41.72 O ATOM 1728 H GLU A 768 14.695 -21.178 3.061 1.00 0.00 H ATOM 1729 N ARG A 769 17.491 -19.895 2.047 1.00 20.51 N ATOM 1730 CA ARG A 769 18.667 -19.610 1.226 1.00 22.40 C ATOM 1731 C ARG A 769 18.333 -18.735 0.029 1.00 20.90 C ATOM 1732 O ARG A 769 19.030 -17.844 -0.303 1.00 20.04 O ATOM 1733 CB ARG A 769 19.365 -20.880 0.755 1.00 23.04 C ATOM 1734 CG ARG A 769 20.674 -20.643 0.040 1.00 24.16 C ATOM 1735 CD ARG A 769 21.522 -21.883 -0.082 1.00 25.80 C ATOM 1736 NE ARG A 769 22.616 -21.712 -1.011 1.00 25.34 N ATOM 1737 CZ ARG A 769 23.831 -21.322 -0.678 1.00 24.94 C ATOM 1738 NH1 ARG A 769 24.139 -21.076 0.553 1.00 24.40 N ATOM 1739 NH2 ARG A 769 24.742 -21.194 -1.593 1.00 25.66 N ATOM 1740 HE ARG A 769 22.432 -21.911 -2.015 1.00 0.00 H ATOM 1741 HH12 ARG A 769 25.102 -20.769 0.797 1.00 0.00 H ATOM 1742 HH11 ARG A 769 23.423 -21.185 1.300 1.00 0.00 H ATOM 1743 HH22 ARG A 769 25.701 -20.887 -1.333 1.00 0.00 H ATOM 1744 HH21 ARG A 769 24.513 -21.399 -2.587 1.00 0.00 H ATOM 1745 H ARG A 769 17.144 -20.871 2.138 1.00 0.00 H ATOM 1746 N THR A 770 17.229 -19.036 -0.605 1.00 21.39 N ATOM 1747 CA THR A 770 16.780 -18.273 -1.731 1.00 21.19 C ATOM 1748 C THR A 770 16.511 -16.828 -1.339 1.00 20.62 C ATOM 1749 O THR A 770 16.882 -15.952 -2.028 1.00 20.57 O ATOM 1750 CB THR A 770 15.536 -18.898 -2.343 1.00 21.48 C ATOM 1751 OG1 THR A 770 15.876 -20.193 -2.791 1.00 24.06 O ATOM 1752 CG2 THR A 770 15.058 -18.091 -3.458 1.00 24.27 C ATOM 1753 HG1 THR A 770 15.080 -20.621 -3.194 1.00 0.00 H ATOM 1754 H THR A 770 16.664 -19.848 -0.284 1.00 0.00 H ATOM 1755 N LEU A 771 15.843 -16.635 -0.216 1.00 20.84 N ATOM 1756 CA LEU A 771 15.549 -15.285 0.294 1.00 20.74 C ATOM 1757 C LEU A 771 16.830 -14.517 0.579 1.00 20.55 C ATOM 1758 O LEU A 771 16.908 -13.351 0.239 1.00 20.45 O ATOM 1759 CB LEU A 771 14.666 -15.336 1.555 1.00 23.83 C ATOM 1760 CG LEU A 771 14.259 -13.943 2.129 1.00 25.45 C ATOM 1761 CD1 LEU A 771 12.979 -14.046 2.925 1.00 30.40 C ATOM 1762 CD2 LEU A 771 15.308 -13.403 3.096 1.00 29.08 C ATOM 1763 H LEU A 771 15.515 -17.461 0.324 1.00 0.00 H ATOM 1764 N ALA A 772 17.828 -15.172 1.168 1.00 19.09 N ATOM 1765 CA ALA A 772 19.079 -14.536 1.462 1.00 18.89 C ATOM 1766 C ALA A 772 19.724 -13.991 0.184 1.00 19.48 C ATOM 1767 O ALA A 772 20.127 -12.828 0.135 1.00 18.99 O ATOM 1768 CB ALA A 772 20.025 -15.510 2.164 1.00 20.01 C ATOM 1769 H ALA A 772 17.697 -16.172 1.422 1.00 0.00 H ATOM 1770 N PHE A 773 19.817 -14.826 -0.868 1.00 17.77 N ATOM 1771 CA PHE A 773 20.447 -14.383 -2.108 1.00 19.04 C ATOM 1772 C PHE A 773 19.599 -13.317 -2.812 1.00 18.66 C ATOM 1773 O PHE A 773 20.142 -12.322 -3.290 1.00 18.97 O ATOM 1774 CB PHE A 773 20.735 -15.560 -3.073 1.00 20.18 C ATOM 1775 CG PHE A 773 21.991 -16.296 -2.750 1.00 20.42 C ATOM 1776 CD1 PHE A 773 21.993 -17.319 -1.822 1.00 23.05 C ATOM 1777 CD2 PHE A 773 23.177 -15.953 -3.355 1.00 22.86 C ATOM 1778 CE1 PHE A 773 23.158 -17.994 -1.510 1.00 22.87 C ATOM 1779 CE2 PHE A 773 24.362 -16.615 -3.033 1.00 23.26 C ATOM 1780 CZ PHE A 773 24.339 -17.630 -2.115 1.00 23.21 C ATOM 1781 H PHE A 773 19.438 -15.792 -0.797 1.00 0.00 H ATOM 1782 N ARG A 774 18.301 -13.531 -2.925 1.00 18.13 N ATOM 1783 CA ARG A 774 17.454 -12.595 -3.648 1.00 19.45 C ATOM 1784 C ARG A 774 17.423 -11.238 -2.970 1.00 19.05 C ATOM 1785 O ARG A 774 17.423 -10.224 -3.656 1.00 19.25 O ATOM 1786 CB ARG A 774 16.048 -13.135 -3.811 1.00 20.13 C ATOM 1787 CG ARG A 774 15.109 -12.285 -4.666 1.00 24.18 C ATOM 1788 CD ARG A 774 15.698 -11.792 -6.001 1.00 27.18 C ATOM 1789 NE ARG A 774 14.806 -10.867 -6.725 1.00 30.44 N ATOM 1790 CZ ARG A 774 13.900 -11.220 -7.632 1.00 35.92 C ATOM 1791 NH1 ARG A 774 13.720 -12.489 -8.014 1.00 35.41 N ATOM 1792 NH2 ARG A 774 13.185 -10.264 -8.193 1.00 39.55 N ATOM 1793 HE ARG A 774 14.893 -9.854 -6.508 1.00 0.00 H ATOM 1794 HH12 ARG A 774 12.999 -12.720 -8.727 1.00 0.00 H ATOM 1795 HH11 ARG A 774 14.301 -13.245 -7.598 1.00 0.00 H ATOM 1796 HH22 ARG A 774 12.467 -10.502 -8.907 1.00 0.00 H ATOM 1797 HH21 ARG A 774 13.339 -9.272 -7.922 1.00 0.00 H ATOM 1798 H ARG A 774 17.880 -14.378 -2.493 1.00 0.00 H ATOM 1799 N SER A 775 17.313 -11.230 -1.626 1.00 18.69 N ATOM 1800 CA SER A 775 17.248 -9.981 -0.878 1.00 19.87 C ATOM 1801 C SER A 775 18.588 -9.260 -0.958 1.00 19.05 C ATOM 1802 O SER A 775 18.606 -8.061 -1.213 1.00 18.57 O ATOM 1803 CB SER A 775 16.734 -10.197 0.573 1.00 21.80 C ATOM 1804 OG SER A 775 17.721 -10.869 1.367 1.00 25.67 O ATOM 1805 HG SER A 775 17.922 -11.751 0.964 1.00 0.00 H ATOM 1806 H SER A 775 17.274 -12.134 -1.113 1.00 0.00 H ATOM 1807 N MET A 776 19.711 -9.982 -0.888 1.00 18.87 N ATOM 1808 CA MET A 776 20.993 -9.343 -1.068 1.00 18.62 C ATOM 1809 C MET A 776 21.088 -8.676 -2.452 1.00 18.99 C ATOM 1810 O MET A 776 21.475 -7.479 -2.563 1.00 16.99 O ATOM 1811 CB MET A 776 22.160 -10.362 -0.924 1.00 21.04 C ATOM 1812 CG MET A 776 23.505 -9.870 -1.419 1.00 22.40 C ATOM 1813 SD MET A 776 24.763 -11.210 -1.346 1.00 23.78 S ATOM 1814 CE MET A 776 24.290 -12.040 -2.879 1.00 25.36 C ATOM 1815 H MET A 776 19.661 -11.004 -0.704 1.00 0.00 H ATOM 1816 N ILE A 777 20.754 -9.427 -3.507 1.00 17.73 N ATOM 1817 CA ILE A 777 20.840 -8.887 -4.870 1.00 19.23 C ATOM 1818 C ILE A 777 19.855 -7.688 -5.094 1.00 19.46 C ATOM 1819 O ILE A 777 20.248 -6.655 -5.629 1.00 19.26 O ATOM 1820 CB ILE A 777 20.592 -10.023 -5.887 1.00 19.50 C ATOM 1821 CG1 ILE A 777 21.799 -10.942 -5.924 1.00 20.07 C ATOM 1822 CG2 ILE A 777 20.247 -9.495 -7.274 1.00 19.21 C ATOM 1823 CD1 ILE A 777 21.467 -12.329 -6.456 1.00 21.58 C ATOM 1824 H ILE A 777 20.430 -10.404 -3.361 1.00 0.00 H ATOM 1825 N ASP A 778 18.607 -7.825 -4.648 1.00 19.85 N ATOM 1826 CA ASP A 778 17.631 -6.735 -4.760 1.00 20.34 C ATOM 1827 C ASP A 778 18.192 -5.459 -4.072 1.00 21.16 C ATOM 1828 O ASP A 778 18.055 -4.349 -4.599 1.00 21.37 O ATOM 1829 CB ASP A 778 16.309 -7.058 -4.092 1.00 21.85 C ATOM 1830 CG ASP A 778 15.401 -7.987 -4.913 1.00 26.88 C ATOM 1831 OD1 ASP A 778 15.674 -8.217 -6.122 1.00 26.13 O ATOM 1832 OD2 ASP A 778 14.437 -8.523 -4.279 1.00 27.05 O ATOM 1833 H ASP A 778 18.318 -8.724 -4.211 1.00 0.00 H ATOM 1834 N CYS A 779 18.770 -5.611 -2.897 1.00 19.15 N ATOM 1835 CA CYS A 779 19.317 -4.454 -2.185 1.00 19.27 C ATOM 1836 C CYS A 779 20.476 -3.783 -2.960 1.00 18.85 C ATOM 1837 O CYS A 779 20.512 -2.543 -3.097 1.00 19.62 O ATOM 1838 CB CYS A 779 19.756 -4.856 -0.784 1.00 19.04 C ATOM 1839 SG CYS A 779 18.397 -5.175 0.363 1.00 21.32 S ATOM 1840 H CYS A 779 18.838 -6.558 -2.473 1.00 0.00 H ATOM 1841 N VAL A 780 21.425 -4.580 -3.424 1.00 18.53 N ATOM 1842 CA VAL A 780 22.533 -4.064 -4.212 1.00 19.50 C ATOM 1843 C VAL A 780 22.015 -3.346 -5.469 1.00 20.28 C ATOM 1844 O VAL A 780 22.455 -2.234 -5.767 1.00 18.65 O ATOM 1845 CB VAL A 780 23.582 -5.141 -4.579 1.00 19.96 C ATOM 1846 CG1 VAL A 780 24.644 -4.558 -5.500 1.00 21.06 C ATOM 1847 CG2 VAL A 780 24.200 -5.731 -3.344 1.00 19.84 C ATOM 1848 H VAL A 780 21.377 -5.599 -3.220 1.00 0.00 H ATOM 1849 N LEU A 781 21.056 -3.951 -6.189 1.00 19.66 N ATOM 1850 CA LEU A 781 20.513 -3.308 -7.381 1.00 21.21 C ATOM 1851 C LEU A 781 19.817 -1.964 -7.055 1.00 20.80 C ATOM 1852 O LEU A 781 19.902 -0.998 -7.845 1.00 22.03 O ATOM 1853 CB LEU A 781 19.574 -4.255 -8.131 1.00 20.65 C ATOM 1854 CG LEU A 781 20.226 -5.512 -8.749 1.00 22.03 C ATOM 1855 CD1 LEU A 781 19.152 -6.408 -9.373 1.00 22.84 C ATOM 1856 CD2 LEU A 781 21.330 -5.172 -9.729 1.00 22.73 C ATOM 1857 H LEU A 781 20.699 -4.883 -5.895 1.00 0.00 H ATOM 1858 N ALA A 782 19.185 -1.878 -5.880 1.00 20.28 N ATOM 1859 CA ALA A 782 18.540 -0.646 -5.446 1.00 21.48 C ATOM 1860 C ALA A 782 19.478 0.506 -5.063 1.00 22.38 C ATOM 1861 O ALA A 782 18.982 1.587 -4.802 1.00 22.58 O ATOM 1862 CB ALA A 782 17.605 -0.942 -4.278 1.00 23.52 C ATOM 1863 H ALA A 782 19.153 -2.712 -5.260 1.00 0.00 H ATOM 1864 N THR A 783 20.787 0.281 -4.964 1.00 20.30 N ATOM 1865 CA THR A 783 21.729 1.346 -4.621 1.00 21.65 C ATOM 1866 C THR A 783 22.082 2.237 -5.817 1.00 23.38 C ATOM 1867 O THR A 783 22.737 3.256 -5.645 1.00 23.92 O ATOM 1868 CB THR A 783 23.029 0.824 -3.983 1.00 21.21 C ATOM 1869 OG1 THR A 783 23.722 -0.073 -4.867 1.00 21.71 O ATOM 1870 CG2 THR A 783 22.734 0.166 -2.692 1.00 22.80 C ATOM 1871 HG1 THR A 783 23.140 -0.846 -5.074 1.00 0.00 H ATOM 1872 H THR A 783 21.149 -0.679 -5.135 1.00 0.00 H ATOM 1873 N ASP A 784 21.641 1.886 -7.026 1.00 22.92 N ATOM 1874 CA ASP A 784 21.842 2.773 -8.181 1.00 22.65 C ATOM 1875 C ASP A 784 21.038 4.067 -7.979 1.00 22.00 C ATOM 1876 O ASP A 784 19.812 4.039 -7.953 1.00 22.20 O ATOM 1877 CB ASP A 784 21.418 2.051 -9.456 1.00 24.46 C ATOM 1878 CG ASP A 784 21.639 2.886 -10.732 1.00 27.73 C ATOM 1879 OD1 ASP A 784 21.985 4.071 -10.657 1.00 28.05 O ATOM 1880 OD2 ASP A 784 21.436 2.324 -11.821 1.00 31.98 O ATOM 1881 H ASP A 784 21.151 0.977 -7.153 1.00 0.00 H ATOM 1882 N MET A 785 21.725 5.194 -7.842 1.00 22.73 N ATOM 1883 CA MET A 785 21.047 6.483 -7.594 1.00 24.41 C ATOM 1884 C MET A 785 20.096 6.974 -8.688 1.00 26.67 C ATOM 1885 O MET A 785 19.257 7.845 -8.428 1.00 24.67 O ATOM 1886 CB MET A 785 22.043 7.562 -7.173 1.00 25.69 C ATOM 1887 CG MET A 785 22.594 7.384 -5.774 1.00 26.24 C ATOM 1888 SD MET A 785 21.374 7.470 -4.408 1.00 28.75 S ATOM 1889 CE MET A 785 21.022 9.207 -4.439 1.00 29.65 C ATOM 1890 H MET A 785 22.762 5.169 -7.911 1.00 0.00 H ATOM 1891 N ALA A 786 20.180 6.407 -9.891 1.00 25.93 N ATOM 1892 CA ALA A 786 19.181 6.677 -10.940 1.00 28.52 C ATOM 1893 C ALA A 786 17.799 6.146 -10.536 1.00 30.05 C ATOM 1894 O ALA A 786 16.792 6.634 -11.030 1.00 31.30 O ATOM 1895 CB ALA A 786 19.628 6.063 -12.271 1.00 31.50 C ATOM 1896 H ALA A 786 20.968 5.760 -10.094 1.00 0.00 H ATOM 1897 N LYS A 787 17.746 5.193 -9.598 1.00 28.09 N ATOM 1898 CA LYS A 787 16.497 4.626 -9.094 1.00 29.20 C ATOM 1899 C LYS A 787 16.079 5.226 -7.728 1.00 28.88 C ATOM 1900 O LYS A 787 15.139 4.704 -7.063 1.00 27.84 O ATOM 1901 CB LYS A 787 16.636 3.098 -8.966 1.00 33.49 C ATOM 1902 CG LYS A 787 16.900 2.320 -10.271 1.00 38.30 C ATOM 1903 CD LYS A 787 17.196 0.833 -9.935 1.00 45.73 C ATOM 1904 CE LYS A 787 18.023 0.046 -10.990 1.00 48.41 C ATOM 1905 NZ LYS A 787 18.907 -1.107 -10.489 1.00 38.01 N ATOM 1906 HZ1 LYS A 787 19.606 -0.738 -9.813 1.00 0.00 H ATOM 1907 HZ2 LYS A 787 18.312 -1.820 -10.020 1.00 0.00 H ATOM 1908 HZ3 LYS A 787 19.399 -1.541 -11.296 1.00 0.00 H ATOM 1909 H LYS A 787 18.641 4.837 -9.207 1.00 0.00 H ATOM 1910 N HIS A 788 16.761 6.290 -7.286 1.00 25.95 N ATOM 1911 CA HIS A 788 16.548 6.848 -5.940 1.00 25.86 C ATOM 1912 C HIS A 788 15.072 7.214 -5.695 1.00 27.29 C ATOM 1913 O HIS A 788 14.450 6.705 -4.736 1.00 25.19 O ATOM 1914 CB HIS A 788 17.455 8.059 -5.698 1.00 25.89 C ATOM 1915 CG HIS A 788 17.222 8.755 -4.399 1.00 25.61 C ATOM 1916 ND1 HIS A 788 17.709 8.286 -3.204 1.00 26.05 N ATOM 1917 CD2 HIS A 788 16.536 9.885 -4.103 1.00 26.31 C ATOM 1918 CE1 HIS A 788 17.330 9.082 -2.224 1.00 26.93 C ATOM 1919 NE2 HIS A 788 16.623 10.069 -2.745 1.00 25.61 N ATOM 1920 H HIS A 788 17.462 6.736 -7.912 1.00 0.00 H ATOM 1921 N GLY A 789 14.518 8.080 -6.551 1.00 25.77 N ATOM 1922 CA GLY A 789 13.170 8.587 -6.348 1.00 27.30 C ATOM 1923 C GLY A 789 12.129 7.486 -6.375 1.00 28.58 C ATOM 1924 O GLY A 789 11.231 7.470 -5.521 1.00 27.46 O ATOM 1925 H GLY A 789 15.062 8.397 -7.378 1.00 0.00 H ATOM 1926 N SER A 790 12.262 6.542 -7.308 1.00 28.71 N ATOM 1927 CA SER A 790 11.283 5.460 -7.423 1.00 29.84 C ATOM 1928 C SER A 790 11.382 4.445 -6.255 1.00 28.59 C ATOM 1929 O SER A 790 10.361 3.980 -5.761 1.00 26.25 O ATOM 1930 CB SER A 790 11.335 4.800 -8.798 1.00 34.17 C ATOM 1931 OG SER A 790 12.546 4.141 -8.966 1.00 39.34 O ATOM 1932 HG SER A 790 12.568 3.717 -9.860 1.00 0.00 H ATOM 1933 H SER A 790 13.071 6.575 -7.961 1.00 0.00 H ATOM 1934 N ALA A 791 12.590 4.128 -5.786 1.00 25.25 N ATOM 1935 CA ALA A 791 12.762 3.277 -4.614 1.00 24.05 C ATOM 1936 C ALA A 791 12.151 3.926 -3.344 1.00 25.12 C ATOM 1937 O ALA A 791 11.452 3.264 -2.569 1.00 25.23 O ATOM 1938 CB ALA A 791 14.225 2.969 -4.395 1.00 26.00 C ATOM 1939 H ALA A 791 13.433 4.498 -6.270 1.00 0.00 H ATOM 1940 N LEU A 792 12.404 5.210 -3.137 1.00 23.89 N ATOM 1941 CA LEU A 792 11.842 5.940 -2.007 1.00 24.89 C ATOM 1942 C LEU A 792 10.324 5.991 -2.081 1.00 24.56 C ATOM 1943 O LEU A 792 9.667 5.638 -1.088 1.00 23.41 O ATOM 1944 CB LEU A 792 12.442 7.328 -1.873 1.00 23.30 C ATOM 1945 CG LEU A 792 11.877 8.276 -0.814 1.00 23.99 C ATOM 1946 CD1 LEU A 792 12.078 7.735 0.590 1.00 24.03 C ATOM 1947 CD2 LEU A 792 12.523 9.644 -0.937 1.00 25.44 C ATOM 1948 H LEU A 792 13.024 5.714 -3.803 1.00 0.00 H ATOM 1949 N GLU A 793 9.777 6.354 -3.242 1.00 29.10 N ATOM 1950 CA GLU A 793 8.314 6.418 -3.410 1.00 31.41 C ATOM 1951 C GLU A 793 7.628 5.075 -3.149 1.00 27.47 C ATOM 1952 O GLU A 793 6.603 5.056 -2.507 1.00 27.77 O ATOM 1953 CB GLU A 793 7.867 6.948 -4.795 1.00 38.02 C ATOM 1954 CG GLU A 793 8.050 8.457 -5.016 1.00 49.37 C ATOM 1955 CD GLU A 793 7.477 9.367 -3.902 1.00 58.22 C ATOM 1956 OE1 GLU A 793 6.251 9.600 -3.911 1.00 66.80 O ATOM 1957 OE2 GLU A 793 8.251 9.874 -3.031 1.00 57.80 O ATOM 1958 H GLU A 793 10.394 6.596 -4.043 1.00 0.00 H ATOM 1959 N ALA A 794 8.200 3.980 -3.643 1.00 26.68 N ATOM 1960 CA ALA A 794 7.641 2.640 -3.401 1.00 26.01 C ATOM 1961 C ALA A 794 7.628 2.306 -1.911 1.00 26.33 C ATOM 1962 O ALA A 794 6.621 1.826 -1.365 1.00 24.63 O ATOM 1963 CB ALA A 794 8.421 1.598 -4.178 1.00 28.32 C ATOM 1964 H ALA A 794 9.064 4.073 -4.215 1.00 0.00 H ATOM 1965 N PHE A 795 8.745 2.554 -1.225 1.00 23.72 N ATOM 1966 CA PHE A 795 8.772 2.323 0.211 1.00 23.22 C ATOM 1967 C PHE A 795 7.722 3.103 0.959 1.00 22.30 C ATOM 1968 O PHE A 795 7.030 2.559 1.814 1.00 23.51 O ATOM 1969 CB PHE A 795 10.162 2.609 0.801 1.00 22.10 C ATOM 1970 CG PHE A 795 10.180 2.585 2.289 1.00 21.53 C ATOM 1971 CD1 PHE A 795 10.206 1.365 2.987 1.00 22.47 C ATOM 1972 CD2 PHE A 795 10.151 3.774 3.019 1.00 20.94 C ATOM 1973 CE1 PHE A 795 10.223 1.347 4.375 1.00 21.26 C ATOM 1974 CE2 PHE A 795 10.183 3.747 4.400 1.00 20.23 C ATOM 1975 CZ PHE A 795 10.219 2.546 5.077 1.00 21.07 C ATOM 1976 H PHE A 795 9.591 2.910 -1.714 1.00 0.00 H ATOM 1977 N LEU A 796 7.645 4.393 0.680 1.00 23.82 N ATOM 1978 CA LEU A 796 6.682 5.277 1.346 1.00 23.90 C ATOM 1979 C LEU A 796 5.222 4.847 1.125 1.00 23.62 C ATOM 1980 O LEU A 796 4.445 4.853 2.072 1.00 23.00 O ATOM 1981 CB LEU A 796 6.911 6.744 0.969 1.00 25.41 C ATOM 1982 CG LEU A 796 8.282 7.419 1.331 1.00 25.90 C ATOM 1983 CD1 LEU A 796 8.355 8.818 0.762 1.00 27.53 C ATOM 1984 CD2 LEU A 796 8.539 7.503 2.810 1.00 25.32 C ATOM 1985 H LEU A 796 8.287 4.793 -0.034 1.00 0.00 H ATOM 1986 N ALA A 797 4.898 4.416 -0.081 1.00 25.06 N ATOM 1987 CA ALA A 797 3.548 3.946 -0.411 1.00 24.05 C ATOM 1988 C ALA A 797 3.236 2.638 0.288 1.00 25.68 C ATOM 1989 O ALA A 797 2.111 2.431 0.741 1.00 26.10 O ATOM 1990 CB ALA A 797 3.377 3.819 -1.893 1.00 25.59 C ATOM 1991 H ALA A 797 5.626 4.410 -0.823 1.00 0.00 H ATOM 1992 N SER A 798 4.233 1.758 0.423 1.00 23.76 N ATOM 1993 CA SER A 798 4.034 0.537 1.173 1.00 24.19 C ATOM 1994 C SER A 798 3.881 0.827 2.675 1.00 24.95 C ATOM 1995 O SER A 798 2.982 0.270 3.342 1.00 23.25 O ATOM 1996 CB SER A 798 5.158 -0.474 0.870 1.00 24.38 C ATOM 1997 OG SER A 798 5.134 -1.602 1.754 1.00 26.18 O ATOM 1998 HG SER A 798 4.268 -2.072 1.664 1.00 0.00 H ATOM 1999 H SER A 798 5.157 1.952 -0.013 1.00 0.00 H ATOM 2000 N ALA A 799 4.721 1.714 3.235 1.00 22.17 N ATOM 2001 CA ALA A 799 4.612 2.056 4.665 1.00 25.08 C ATOM 2002 C ALA A 799 3.267 2.673 5.032 1.00 26.57 C ATOM 2003 O ALA A 799 2.785 2.457 6.132 1.00 27.76 O ATOM 2004 CB ALA A 799 5.715 3.015 5.088 1.00 26.84 C ATOM 2005 H ALA A 799 5.456 2.164 2.653 1.00 0.00 H ATOM 2006 N ALA A 800 2.693 3.458 4.127 1.00 26.37 N ATOM 2007 CA ALA A 800 1.384 4.095 4.369 1.00 26.49 C ATOM 2008 C ALA A 800 0.182 3.158 4.213 1.00 28.50 C ATOM 2009 O ALA A 800 -0.912 3.519 4.612 1.00 29.84 O ATOM 2010 CB ALA A 800 1.203 5.260 3.460 1.00 26.70 C ATOM 2011 H ALA A 800 3.179 3.628 3.224 1.00 0.00 H ATOM 2012 N ASP A 801 0.389 1.979 3.641 1.00 26.30 N ATOM 2013 CA ASP A 801 -0.673 1.051 3.298 1.00 24.91 C ATOM 2014 C ASP A 801 -0.697 -0.057 4.316 1.00 26.18 C ATOM 2015 O ASP A 801 0.150 -0.986 4.280 1.00 23.53 O ATOM 2016 CB ASP A 801 -0.436 0.513 1.886 1.00 23.74 C ATOM 2017 CG ASP A 801 -1.449 -0.551 1.459 1.00 24.18 C ATOM 2018 OD1 ASP A 801 -2.493 -0.678 2.109 1.00 25.86 O ATOM 2019 OD2 ASP A 801 -1.195 -1.238 0.452 1.00 24.23 O ATOM 2020 H ASP A 801 1.369 1.704 3.426 1.00 0.00 H ATOM 2021 N GLN A 802 -1.687 -0.037 5.210 1.00 25.87 N ATOM 2022 CA GLN A 802 -1.810 -1.146 6.201 1.00 29.38 C ATOM 2023 C GLN A 802 -2.048 -2.533 5.560 1.00 28.93 C ATOM 2024 O GLN A 802 -1.768 -3.545 6.188 1.00 29.29 O ATOM 2025 CB GLN A 802 -2.907 -0.853 7.245 1.00 34.38 C ATOM 2026 CG GLN A 802 -2.474 0.140 8.317 1.00 41.45 C ATOM 2027 CD GLN A 802 -3.633 0.605 9.190 1.00 51.69 C ATOM 2028 OE1 GLN A 802 -4.511 -0.182 9.563 1.00 59.94 O ATOM 2029 NE2 GLN A 802 -3.648 1.895 9.510 1.00 60.96 N ATOM 2030 HE22 GLN A 802 -2.889 2.523 9.175 1.00 0.00 H ATOM 2031 HE21 GLN A 802 -4.418 2.277 10.095 1.00 0.00 H ATOM 2032 H GLN A 802 -2.370 0.748 5.216 1.00 0.00 H ATOM 2033 N SER A 803 -2.522 -2.582 4.313 1.00 26.07 N ATOM 2034 CA SER A 803 -2.672 -3.831 3.573 1.00 26.67 C ATOM 2035 C SER A 803 -1.554 -4.138 2.589 1.00 25.63 C ATOM 2036 O SER A 803 -1.733 -4.958 1.705 1.00 26.00 O ATOM 2037 CB SER A 803 -4.039 -3.840 2.829 1.00 28.01 C ATOM 2038 OG SER A 803 -5.087 -3.916 3.808 1.00 29.89 O ATOM 2039 HG SER A 803 -5.033 -3.131 4.409 1.00 0.00 H ATOM 2040 H SER A 803 -2.796 -1.692 3.849 1.00 0.00 H ATOM 2041 N SER A 804 -0.390 -3.507 2.747 1.00 24.71 N ATOM 2042 CA SER A 804 0.737 -3.844 1.896 1.00 24.82 C ATOM 2043 C SER A 804 1.103 -5.311 2.077 1.00 24.12 C ATOM 2044 O SER A 804 1.050 -5.841 3.197 1.00 24.63 O ATOM 2045 CB SER A 804 1.974 -2.975 2.221 1.00 26.41 C ATOM 2046 OG SER A 804 2.917 -3.111 1.162 1.00 31.52 O ATOM 2047 HG SER A 804 3.715 -2.558 1.359 1.00 0.00 H ATOM 2048 H SER A 804 -0.290 -2.775 3.479 1.00 0.00 H ATOM 2049 N ASP A 805 1.501 -5.957 0.994 1.00 24.26 N ATOM 2050 CA ASP A 805 2.064 -7.303 1.086 1.00 25.37 C ATOM 2051 C ASP A 805 3.253 -7.271 2.072 1.00 26.18 C ATOM 2052 O ASP A 805 4.175 -6.461 1.915 1.00 22.87 O ATOM 2053 CB ASP A 805 2.546 -7.794 -0.277 1.00 26.88 C ATOM 2054 CG ASP A 805 3.168 -9.196 -0.203 1.00 31.14 C ATOM 2055 OD1 ASP A 805 2.430 -10.187 -0.096 1.00 31.22 O ATOM 2056 OD2 ASP A 805 4.403 -9.321 -0.207 1.00 30.26 O ATOM 2057 H ASP A 805 1.412 -5.501 0.064 1.00 0.00 H ATOM 2058 N GLU A 806 3.243 -8.181 3.023 1.00 24.34 N ATOM 2059 CA GLU A 806 4.237 -8.233 4.127 1.00 28.30 C ATOM 2060 C GLU A 806 5.663 -8.498 3.602 1.00 25.15 C ATOM 2061 O GLU A 806 6.612 -7.760 3.946 1.00 24.89 O ATOM 2062 CB GLU A 806 3.822 -9.298 5.161 1.00 35.00 C ATOM 2063 CG GLU A 806 4.672 -9.386 6.436 1.00 45.39 C ATOM 2064 CD GLU A 806 4.384 -10.657 7.280 1.00 59.86 C ATOM 2065 OE1 GLU A 806 3.288 -11.271 7.106 1.00 66.74 O ATOM 2066 OE2 GLU A 806 5.244 -11.055 8.121 1.00 59.35 O ATOM 2067 H GLU A 806 2.497 -8.905 3.001 1.00 0.00 H ATOM 2068 N ALA A 807 5.817 -9.535 2.787 1.00 23.89 N ATOM 2069 CA ALA A 807 7.097 -9.852 2.151 1.00 25.51 C ATOM 2070 C ALA A 807 7.622 -8.662 1.325 1.00 26.17 C ATOM 2071 O ALA A 807 8.805 -8.329 1.423 1.00 22.30 O ATOM 2072 CB ALA A 807 6.995 -11.092 1.269 1.00 26.23 C ATOM 2073 H ALA A 807 4.997 -10.145 2.593 1.00 0.00 H ATOM 2074 N ALA A 808 6.757 -8.021 0.511 1.00 23.34 N ATOM 2075 CA ALA A 808 7.171 -6.822 -0.200 1.00 23.46 C ATOM 2076 C ALA A 808 7.629 -5.669 0.711 1.00 21.99 C ATOM 2077 O ALA A 808 8.640 -5.011 0.382 1.00 22.07 O ATOM 2078 CB ALA A 808 6.057 -6.311 -1.132 1.00 27.03 C ATOM 2079 H ALA A 808 5.791 -8.386 0.392 1.00 0.00 H ATOM 2080 N PHE A 809 6.889 -5.391 1.800 1.00 21.64 N ATOM 2081 CA PHE A 809 7.287 -4.364 2.767 1.00 22.33 C ATOM 2082 C PHE A 809 8.664 -4.674 3.388 1.00 20.98 C ATOM 2083 O PHE A 809 9.520 -3.784 3.483 1.00 21.00 O ATOM 2084 CB PHE A 809 6.255 -4.162 3.844 1.00 23.39 C ATOM 2085 CG PHE A 809 6.645 -3.115 4.867 1.00 26.17 C ATOM 2086 CD1 PHE A 809 6.721 -1.779 4.518 1.00 28.12 C ATOM 2087 CD2 PHE A 809 6.962 -3.489 6.172 1.00 29.62 C ATOM 2088 CE1 PHE A 809 7.118 -0.812 5.445 1.00 28.70 C ATOM 2089 CE2 PHE A 809 7.369 -2.522 7.099 1.00 34.58 C ATOM 2090 CZ PHE A 809 7.425 -1.191 6.727 1.00 31.07 C ATOM 2091 H PHE A 809 6.008 -5.921 1.960 1.00 0.00 H ATOM 2092 N HIS A 810 8.886 -5.927 3.751 1.00 20.29 N ATOM 2093 CA HIS A 810 10.167 -6.322 4.332 1.00 20.48 C ATOM 2094 C HIS A 810 11.275 -6.042 3.334 1.00 20.13 C ATOM 2095 O HIS A 810 12.312 -5.471 3.686 1.00 20.10 O ATOM 2096 CB HIS A 810 10.174 -7.791 4.757 1.00 19.83 C ATOM 2097 CG HIS A 810 9.534 -8.035 6.098 1.00 22.75 C ATOM 2098 ND1 HIS A 810 10.192 -8.634 7.141 1.00 24.29 N ATOM 2099 CD2 HIS A 810 8.303 -7.730 6.566 1.00 24.77 C ATOM 2100 CE1 HIS A 810 9.398 -8.696 8.197 1.00 25.70 C ATOM 2101 NE2 HIS A 810 8.238 -8.159 7.866 1.00 24.21 N ATOM 2102 H HIS A 810 8.139 -6.639 3.621 1.00 0.00 H ATOM 2103 N ARG A 811 11.076 -6.475 2.099 1.00 19.32 N ATOM 2104 CA ARG A 811 12.094 -6.274 1.049 1.00 19.59 C ATOM 2105 C ARG A 811 12.407 -4.808 0.814 1.00 19.49 C ATOM 2106 O ARG A 811 13.565 -4.424 0.678 1.00 18.31 O ATOM 2107 CB ARG A 811 11.704 -6.959 -0.259 1.00 20.96 C ATOM 2108 CG ARG A 811 12.764 -6.892 -1.340 1.00 23.62 C ATOM 2109 CD ARG A 811 14.101 -7.546 -0.888 1.00 26.54 C ATOM 2110 NE ARG A 811 13.890 -8.876 -0.279 1.00 31.57 N ATOM 2111 CZ ARG A 811 13.606 -10.014 -0.942 1.00 33.61 C ATOM 2112 NH1 ARG A 811 13.547 -10.043 -2.261 1.00 33.24 N ATOM 2113 NH2 ARG A 811 13.376 -11.143 -0.259 1.00 36.46 N ATOM 2114 HE ARG A 811 13.968 -8.939 0.756 1.00 0.00 H ATOM 2115 HH12 ARG A 811 13.326 -10.933 -2.752 1.00 0.00 H ATOM 2116 HH11 ARG A 811 13.721 -9.176 -2.809 1.00 0.00 H ATOM 2117 HH22 ARG A 811 13.157 -12.023 -0.768 1.00 0.00 H ATOM 2118 HH21 ARG A 811 13.417 -11.140 0.780 1.00 0.00 H ATOM 2119 H ARG A 811 10.189 -6.964 1.865 1.00 0.00 H ATOM 2120 N MET A 812 11.376 -3.972 0.712 1.00 18.55 N ATOM 2121 CA MET A 812 11.590 -2.538 0.533 1.00 19.78 C ATOM 2122 C MET A 812 12.270 -1.871 1.708 1.00 18.95 C ATOM 2123 O MET A 812 13.058 -0.935 1.498 1.00 19.90 O ATOM 2124 CB MET A 812 10.272 -1.831 0.155 1.00 20.95 C ATOM 2125 CG MET A 812 9.882 -2.201 -1.261 1.00 24.04 C ATOM 2126 SD MET A 812 8.396 -1.322 -1.817 1.00 30.64 S ATOM 2127 CE MET A 812 7.118 -2.412 -1.215 1.00 28.98 C ATOM 2128 H MET A 812 10.406 -4.344 0.760 1.00 0.00 H ATOM 2129 N THR A 813 11.951 -2.331 2.924 1.00 18.41 N ATOM 2130 CA THR A 813 12.606 -1.866 4.131 1.00 19.28 C ATOM 2131 C THR A 813 14.121 -2.197 4.057 1.00 19.27 C ATOM 2132 O THR A 813 14.950 -1.324 4.327 1.00 17.71 O ATOM 2133 CB THR A 813 11.956 -2.411 5.401 1.00 20.68 C ATOM 2134 OG1 THR A 813 10.598 -1.981 5.441 1.00 20.44 O ATOM 2135 CG2 THR A 813 12.672 -1.896 6.639 1.00 20.74 C ATOM 2136 HG1 THR A 813 10.121 -2.325 4.645 1.00 0.00 H ATOM 2137 H THR A 813 11.204 -3.050 3.006 1.00 0.00 H ATOM 2138 N MET A 814 14.465 -3.418 3.650 1.00 18.09 N ATOM 2139 CA MET A 814 15.875 -3.718 3.450 1.00 18.31 C ATOM 2140 C MET A 814 16.546 -2.791 2.428 1.00 18.93 C ATOM 2141 O MET A 814 17.668 -2.312 2.638 1.00 18.74 O ATOM 2142 CB MET A 814 16.072 -5.184 3.057 1.00 17.94 C ATOM 2143 CG MET A 814 15.656 -6.186 4.109 1.00 18.99 C ATOM 2144 SD MET A 814 15.771 -7.896 3.506 1.00 21.43 S ATOM 2145 CE MET A 814 17.543 -8.113 3.522 1.00 20.72 C ATOM 2146 H MET A 814 13.740 -4.143 3.478 1.00 0.00 H ATOM 2147 N GLU A 815 15.887 -2.574 1.303 1.00 18.69 N ATOM 2148 CA GLU A 815 16.443 -1.751 0.245 1.00 19.58 C ATOM 2149 C GLU A 815 16.684 -0.334 0.737 1.00 19.18 C ATOM 2150 O GLU A 815 17.662 0.262 0.483 1.00 17.43 O ATOM 2151 CB GLU A 815 15.526 -1.761 -0.977 1.00 20.61 C ATOM 2152 CG GLU A 815 15.385 -3.117 -1.635 1.00 21.91 C ATOM 2153 CD GLU A 815 14.354 -3.144 -2.744 1.00 26.92 C ATOM 2154 OE1 GLU A 815 13.721 -2.149 -2.986 1.00 31.43 O ATOM 2155 OE2 GLU A 815 14.176 -4.156 -3.372 1.00 28.79 O ATOM 2156 H GLU A 815 14.949 -3.003 1.173 1.00 0.00 H ATOM 2157 N ILE A 816 15.722 0.155 1.463 1.00 18.40 N ATOM 2158 CA ILE A 816 15.762 1.488 1.985 1.00 20.72 C ATOM 2159 C ILE A 816 16.875 1.662 3.033 1.00 19.14 C ATOM 2160 O ILE A 816 17.450 2.695 3.117 1.00 18.58 O ATOM 2161 CB ILE A 816 14.344 1.829 2.488 1.00 24.08 C ATOM 2162 CG1 ILE A 816 13.536 2.526 1.422 1.00 29.78 C ATOM 2163 CG2 ILE A 816 14.292 2.489 3.829 1.00 28.17 C ATOM 2164 CD1 ILE A 816 14.102 3.761 0.838 1.00 30.17 C ATOM 2165 H ILE A 816 14.896 -0.442 1.671 1.00 0.00 H ATOM 2166 N ILE A 817 17.120 0.633 3.822 1.00 17.65 N ATOM 2167 CA ILE A 817 18.158 0.689 4.843 1.00 19.47 C ATOM 2168 C ILE A 817 19.542 0.667 4.191 1.00 19.38 C ATOM 2169 O ILE A 817 20.406 1.367 4.583 1.00 18.49 O ATOM 2170 CB ILE A 817 17.990 -0.380 5.926 1.00 20.53 C ATOM 2171 CG1 ILE A 817 16.750 -0.076 6.736 1.00 22.56 C ATOM 2172 CG2 ILE A 817 19.178 -0.439 6.854 1.00 21.21 C ATOM 2173 CD1 ILE A 817 16.905 1.152 7.587 1.00 26.26 C ATOM 2174 H ILE A 817 16.560 -0.237 3.713 1.00 0.00 H ATOM 2175 N LEU A 818 19.721 -0.130 3.162 1.00 18.22 N ATOM 2176 CA LEU A 818 21.007 -0.122 2.484 1.00 19.01 C ATOM 2177 C LEU A 818 21.219 1.218 1.787 1.00 19.94 C ATOM 2178 O LEU A 818 22.279 1.736 1.817 1.00 18.34 O ATOM 2179 CB LEU A 818 21.170 -1.253 1.483 1.00 20.53 C ATOM 2180 CG LEU A 818 22.509 -1.303 0.749 1.00 21.05 C ATOM 2181 CD1 LEU A 818 23.714 -1.390 1.647 1.00 21.16 C ATOM 2182 CD2 LEU A 818 22.551 -2.439 -0.229 1.00 20.97 C ATOM 2183 H LEU A 818 18.956 -0.756 2.838 1.00 0.00 H ATOM 2184 N LYS A 819 20.181 1.763 1.172 1.00 18.01 N ATOM 2185 CA LYS A 819 20.293 3.066 0.553 1.00 19.81 C ATOM 2186 C LYS A 819 20.640 4.114 1.640 1.00 19.01 C ATOM 2187 O LYS A 819 21.479 4.928 1.441 1.00 19.24 O ATOM 2188 CB LYS A 819 19.002 3.465 -0.159 1.00 19.86 C ATOM 2189 CG LYS A 819 18.801 2.882 -1.530 1.00 21.75 C ATOM 2190 CD LYS A 819 17.492 3.344 -2.161 1.00 23.71 C ATOM 2191 CE LYS A 819 17.429 4.840 -2.300 1.00 23.71 C ATOM 2192 NZ LYS A 819 18.672 5.414 -2.842 1.00 24.14 N ATOM 2193 HZ1 LYS A 819 19.463 5.186 -2.207 1.00 0.00 H ATOM 2194 HZ2 LYS A 819 18.855 5.014 -3.784 1.00 0.00 H ATOM 2195 HZ3 LYS A 819 18.572 6.447 -2.916 1.00 0.00 H ATOM 2196 H LYS A 819 19.277 1.250 1.133 1.00 0.00 H ATOM 2197 N ALA A 820 19.954 4.060 2.771 1.00 18.97 N ATOM 2198 CA ALA A 820 20.205 4.975 3.883 1.00 19.07 C ATOM 2199 C ALA A 820 21.691 4.928 4.299 1.00 19.50 C ATOM 2200 O ALA A 820 22.320 5.973 4.498 1.00 18.87 O ATOM 2201 CB ALA A 820 19.326 4.669 5.053 1.00 18.96 C ATOM 2202 H ALA A 820 19.210 3.341 2.872 1.00 0.00 H ATOM 2203 N GLY A 821 22.240 3.724 4.425 1.00 19.77 N ATOM 2204 CA GLY A 821 23.642 3.580 4.772 1.00 20.28 C ATOM 2205 C GLY A 821 24.546 4.201 3.724 1.00 20.59 C ATOM 2206 O GLY A 821 25.577 4.847 4.023 1.00 21.08 O ATOM 2207 H GLY A 821 21.658 2.875 4.273 1.00 0.00 H ATOM 2208 N ASP A 822 24.203 3.987 2.481 1.00 20.98 N ATOM 2209 CA ASP A 822 24.999 4.491 1.392 1.00 22.10 C ATOM 2210 C ASP A 822 25.004 6.039 1.300 1.00 22.65 C ATOM 2211 O ASP A 822 25.987 6.606 0.835 1.00 25.07 O ATOM 2212 CB ASP A 822 24.461 3.884 0.083 1.00 23.95 C ATOM 2213 CG ASP A 822 25.525 3.533 -0.915 1.00 23.73 C ATOM 2214 OD1 ASP A 822 26.729 3.375 -0.581 1.00 19.33 O ATOM 2215 OD2 ASP A 822 25.097 3.352 -2.064 1.00 27.05 O ATOM 2216 H ASP A 822 23.341 3.444 2.275 1.00 0.00 H ATOM 2217 N ILE A 823 23.942 6.730 1.715 1.00 20.73 N ATOM 2218 CA ILE A 823 23.940 8.226 1.784 1.00 21.85 C ATOM 2219 C ILE A 823 23.988 8.814 3.212 1.00 20.54 C ATOM 2220 O ILE A 823 23.579 9.965 3.443 1.00 22.55 O ATOM 2221 CB ILE A 823 22.769 8.823 0.972 1.00 23.53 C ATOM 2222 CG1 ILE A 823 21.423 8.391 1.511 1.00 24.42 C ATOM 2223 CG2 ILE A 823 22.883 8.409 -0.484 1.00 26.12 C ATOM 2224 CD1 ILE A 823 20.283 9.126 0.836 1.00 27.56 C ATOM 2225 H ILE A 823 23.086 6.213 2.000 1.00 0.00 H ATOM 2226 N SER A 824 24.557 8.043 4.141 1.00 18.76 N ATOM 2227 CA SER A 824 24.595 8.361 5.555 1.00 20.01 C ATOM 2228 C SER A 824 25.772 9.287 5.969 1.00 18.82 C ATOM 2229 O SER A 824 25.847 9.643 7.141 1.00 20.34 O ATOM 2230 CB SER A 824 24.736 7.100 6.409 1.00 19.88 C ATOM 2231 OG SER A 824 25.975 6.423 6.184 1.00 20.02 O ATOM 2232 HG SER A 824 26.036 6.156 5.233 1.00 0.00 H ATOM 2233 H SER A 824 25.002 7.156 3.830 1.00 0.00 H ATOM 2234 N ASN A 825 26.652 9.654 5.041 1.00 18.62 N ATOM 2235 CA ASN A 825 27.860 10.403 5.426 1.00 20.81 C ATOM 2236 C ASN A 825 27.470 11.738 6.120 1.00 21.62 C ATOM 2237 O ASN A 825 28.174 12.193 7.058 1.00 21.74 O ATOM 2238 CB ASN A 825 28.751 10.731 4.219 1.00 22.47 C ATOM 2239 CG ASN A 825 29.479 9.510 3.573 1.00 21.43 C ATOM 2240 OD1 ASN A 825 29.932 9.655 2.463 1.00 23.43 O ATOM 2241 ND2 ASN A 825 29.560 8.372 4.217 1.00 23.08 N ATOM 2242 HD22 ASN A 825 29.158 8.285 5.172 1.00 0.00 H ATOM 2243 HD21 ASN A 825 30.027 7.555 3.773 1.00 0.00 H ATOM 2244 H ASN A 825 26.487 9.412 4.043 1.00 0.00 H ATOM 2245 N VAL A 826 26.373 12.350 5.656 1.00 20.46 N ATOM 2246 CA VAL A 826 25.835 13.631 6.183 1.00 21.32 C ATOM 2247 C VAL A 826 25.106 13.498 7.499 1.00 21.49 C ATOM 2248 O VAL A 826 24.688 14.503 8.091 1.00 22.92 O ATOM 2249 CB VAL A 826 24.976 14.432 5.155 1.00 22.51 C ATOM 2250 CG1 VAL A 826 25.812 14.844 3.958 1.00 23.33 C ATOM 2251 CG2 VAL A 826 23.756 13.658 4.711 1.00 22.95 C ATOM 2252 H VAL A 826 25.862 11.897 4.872 1.00 0.00 H ATOM 2253 N THR A 827 24.921 12.267 7.969 1.00 19.90 N ATOM 2254 CA THR A 827 24.259 12.027 9.251 1.00 19.61 C ATOM 2255 C THR A 827 25.276 11.841 10.380 1.00 20.77 C ATOM 2256 O THR A 827 24.888 11.577 11.534 1.00 23.64 O ATOM 2257 CB THR A 827 23.363 10.762 9.220 1.00 19.47 C ATOM 2258 OG1 THR A 827 24.156 9.575 9.209 1.00 20.80 O ATOM 2259 CG2 THR A 827 22.380 10.759 8.054 1.00 20.99 C ATOM 2260 HG1 THR A 827 24.736 9.574 8.407 1.00 0.00 H ATOM 2261 H THR A 827 25.255 11.456 7.411 1.00 0.00 H ATOM 2262 N LYS A 828 26.562 11.990 10.073 1.00 22.26 N ATOM 2263 CA LYS A 828 27.639 11.731 11.047 1.00 23.13 C ATOM 2264 C LYS A 828 28.125 13.063 11.660 1.00 24.50 C ATOM 2265 O LYS A 828 27.904 14.114 11.074 1.00 22.82 O ATOM 2266 CB LYS A 828 28.821 11.049 10.359 1.00 21.21 C ATOM 2267 CG LYS A 828 28.431 9.758 9.583 1.00 21.92 C ATOM 2268 CD LYS A 828 27.626 8.813 10.466 1.00 22.74 C ATOM 2269 CE LYS A 828 27.221 7.500 9.767 1.00 23.65 C ATOM 2270 NZ LYS A 828 28.359 6.601 9.618 1.00 23.23 N ATOM 2271 HZ1 LYS A 828 29.094 7.065 9.047 1.00 0.00 H ATOM 2272 HZ2 LYS A 828 28.742 6.370 10.557 1.00 0.00 H ATOM 2273 HZ3 LYS A 828 28.050 5.728 9.144 1.00 0.00 H ATOM 2274 H LYS A 828 26.817 12.300 9.113 1.00 0.00 H ATOM 2275 N PRO A 829 28.818 12.990 12.811 1.00 25.30 N ATOM 2276 CA PRO A 829 29.447 14.231 13.333 1.00 27.35 C ATOM 2277 C PRO A 829 30.218 14.973 12.246 1.00 24.02 C ATOM 2278 O PRO A 829 30.810 14.350 11.357 1.00 24.79 O ATOM 2279 CB PRO A 829 30.385 13.719 14.429 1.00 27.04 C ATOM 2280 CG PRO A 829 29.706 12.470 14.922 1.00 28.76 C ATOM 2281 CD PRO A 829 29.074 11.840 13.685 1.00 24.77 C ATOM 2282 N PHE A 830 30.145 16.296 12.285 1.00 24.27 N ATOM 2283 CA PHE A 830 30.645 17.146 11.204 1.00 23.92 C ATOM 2284 C PHE A 830 32.008 16.765 10.688 1.00 23.95 C ATOM 2285 O PHE A 830 32.192 16.672 9.477 1.00 24.73 O ATOM 2286 CB PHE A 830 30.689 18.617 11.662 1.00 26.91 C ATOM 2287 CG PHE A 830 31.100 19.553 10.581 1.00 25.40 C ATOM 2288 CD1 PHE A 830 30.193 19.924 9.608 1.00 25.66 C ATOM 2289 CD2 PHE A 830 32.396 20.036 10.514 1.00 27.34 C ATOM 2290 CE1 PHE A 830 30.560 20.788 8.604 1.00 27.30 C ATOM 2291 CE2 PHE A 830 32.773 20.887 9.496 1.00 28.82 C ATOM 2292 CZ PHE A 830 31.848 21.268 8.538 1.00 26.28 C ATOM 2293 H PHE A 830 29.715 16.748 13.117 1.00 0.00 H ATOM 2294 N ASP A 831 32.990 16.576 11.570 1.00 25.96 N ATOM 2295 CA ASP A 831 34.358 16.300 11.057 1.00 28.32 C ATOM 2296 C ASP A 831 34.464 14.969 10.313 1.00 27.79 C ATOM 2297 O ASP A 831 35.211 14.857 9.332 1.00 27.61 O ATOM 2298 CB ASP A 831 35.432 16.323 12.138 1.00 31.98 C ATOM 2299 CG ASP A 831 36.855 16.105 11.538 1.00 35.58 C ATOM 2300 OD1 ASP A 831 37.341 16.942 10.743 1.00 38.82 O ATOM 2301 OD2 ASP A 831 37.453 15.053 11.797 1.00 41.55 O ATOM 2302 H ASP A 831 32.804 16.621 12.592 1.00 0.00 H ATOM 2303 N ILE A 832 33.683 13.974 10.745 1.00 27.34 N ATOM 2304 CA ILE A 832 33.605 12.700 9.976 1.00 26.12 C ATOM 2305 C ILE A 832 32.962 12.942 8.593 1.00 23.83 C ATOM 2306 O ILE A 832 33.493 12.540 7.543 1.00 24.97 O ATOM 2307 CB ILE A 832 32.852 11.627 10.799 1.00 25.36 C ATOM 2308 CG1 ILE A 832 33.675 11.269 12.057 1.00 26.08 C ATOM 2309 CG2 ILE A 832 32.614 10.376 9.962 1.00 25.44 C ATOM 2310 CD1 ILE A 832 32.886 10.596 13.157 1.00 25.96 C ATOM 2311 H ILE A 832 33.130 14.089 11.618 1.00 0.00 H ATOM 2312 N SER A 833 31.838 13.663 8.607 1.00 24.10 N ATOM 2313 CA SER A 833 31.087 14.021 7.383 1.00 24.81 C ATOM 2314 C SER A 833 31.986 14.761 6.388 1.00 25.58 C ATOM 2315 O SER A 833 32.023 14.455 5.220 1.00 21.97 O ATOM 2316 CB SER A 833 29.867 14.834 7.802 1.00 27.58 C ATOM 2317 OG SER A 833 29.023 15.103 6.707 1.00 32.30 O ATOM 2318 HG SER A 833 28.711 14.249 6.315 1.00 0.00 H ATOM 2319 H SER A 833 31.472 13.989 9.524 1.00 0.00 H ATOM 2320 N ARG A 834 32.768 15.724 6.888 1.00 24.72 N ATOM 2321 CA ARG A 834 33.687 16.470 6.052 1.00 25.61 C ATOM 2322 C ARG A 834 34.773 15.606 5.417 1.00 24.27 C ATOM 2323 O ARG A 834 35.093 15.771 4.237 1.00 24.48 O ATOM 2324 CB ARG A 834 34.323 17.618 6.873 1.00 28.28 C ATOM 2325 CG ARG A 834 35.300 18.445 6.047 1.00 32.58 C ATOM 2326 CD ARG A 834 35.935 19.550 6.890 1.00 38.43 C ATOM 2327 NE ARG A 834 37.313 19.774 6.481 1.00 44.32 N ATOM 2328 CZ ARG A 834 38.378 19.091 6.916 1.00 46.15 C ATOM 2329 NH1 ARG A 834 38.290 18.120 7.828 1.00 43.70 N ATOM 2330 NH2 ARG A 834 39.571 19.405 6.418 1.00 53.09 N ATOM 2331 HE ARG A 834 37.485 20.532 5.790 1.00 0.00 H ATOM 2332 HH12 ARG A 834 39.146 17.616 8.136 1.00 0.00 H ATOM 2333 HH11 ARG A 834 37.365 17.867 8.231 1.00 0.00 H ATOM 2334 HH22 ARG A 834 40.418 18.893 6.736 1.00 0.00 H ATOM 2335 HH21 ARG A 834 39.656 20.163 5.711 1.00 0.00 H ATOM 2336 H ARG A 834 32.715 15.943 7.903 1.00 0.00 H ATOM 2337 N GLN A 835 35.334 14.686 6.181 1.00 25.69 N ATOM 2338 CA GLN A 835 36.334 13.768 5.632 1.00 26.40 C ATOM 2339 C GLN A 835 35.754 12.849 4.503 1.00 26.29 C ATOM 2340 O GLN A 835 36.392 12.609 3.495 1.00 23.61 O ATOM 2341 CB GLN A 835 37.011 12.966 6.726 1.00 27.22 C ATOM 2342 CG GLN A 835 37.929 13.838 7.613 1.00 29.96 C ATOM 2343 CD GLN A 835 38.538 13.068 8.726 1.00 27.97 C ATOM 2344 OE1 GLN A 835 38.019 13.037 9.851 1.00 33.69 O ATOM 2345 NE2 GLN A 835 39.590 12.369 8.412 1.00 28.42 N ATOM 2346 HE22 GLN A 835 39.988 12.430 7.453 1.00 0.00 H ATOM 2347 HE21 GLN A 835 40.033 11.749 9.120 1.00 0.00 H ATOM 2348 H GLN A 835 35.063 14.613 7.182 1.00 0.00 H ATOM 2349 N TRP A 836 34.522 12.385 4.669 1.00 26.73 N ATOM 2350 CA TRP A 836 33.878 11.618 3.579 1.00 24.30 C ATOM 2351 C TRP A 836 33.688 12.537 2.353 1.00 23.09 C ATOM 2352 O TRP A 836 33.936 12.112 1.225 1.00 23.14 O ATOM 2353 CB TRP A 836 32.525 11.056 4.035 1.00 23.24 C ATOM 2354 CG TRP A 836 32.611 9.935 5.031 1.00 22.02 C ATOM 2355 CD1 TRP A 836 32.065 9.914 6.261 1.00 23.55 C ATOM 2356 CD2 TRP A 836 33.242 8.686 4.852 1.00 22.46 C ATOM 2357 NE1 TRP A 836 32.302 8.723 6.875 1.00 24.25 N ATOM 2358 CE2 TRP A 836 33.049 7.948 6.037 1.00 23.66 C ATOM 2359 CE3 TRP A 836 33.936 8.084 3.787 1.00 23.54 C ATOM 2360 CZ2 TRP A 836 33.556 6.663 6.206 1.00 24.35 C ATOM 2361 CZ3 TRP A 836 34.440 6.787 3.976 1.00 22.62 C ATOM 2362 CH2 TRP A 836 34.253 6.117 5.160 1.00 22.39 C ATOM 2363 HE1 TRP A 836 31.970 8.450 7.822 1.00 0.00 H ATOM 2364 H TRP A 836 34.012 12.559 5.559 1.00 0.00 H ATOM 2365 N ALA A 837 33.215 13.768 2.567 1.00 23.12 N ATOM 2366 CA ALA A 837 33.002 14.726 1.485 1.00 24.45 C ATOM 2367 C ALA A 837 34.289 15.001 0.716 1.00 24.89 C ATOM 2368 O ALA A 837 34.262 15.072 -0.480 1.00 23.00 O ATOM 2369 CB ALA A 837 32.426 16.030 2.006 1.00 25.41 C ATOM 2370 H ALA A 837 32.990 14.055 3.541 1.00 0.00 H ATOM 2371 N MET A 838 35.416 15.116 1.409 1.00 26.35 N ATOM 2372 CA MET A 838 36.715 15.278 0.704 1.00 27.83 C ATOM 2373 C MET A 838 37.098 14.098 -0.182 1.00 27.73 C ATOM 2374 O MET A 838 37.588 14.300 -1.301 1.00 26.25 O ATOM 2375 CB MET A 838 37.859 15.575 1.696 1.00 32.15 C ATOM 2376 CG MET A 838 37.777 16.989 2.279 1.00 38.67 C ATOM 2377 SD MET A 838 38.781 17.156 3.782 1.00 48.07 S ATOM 2378 CE MET A 838 40.389 17.123 3.016 1.00 45.63 C ATOM 2379 H MET A 838 35.390 15.093 2.448 1.00 0.00 H ATOM 2380 N ALA A 839 36.905 12.887 0.332 1.00 26.58 N ATOM 2381 CA ALA A 839 37.239 11.643 -0.387 1.00 27.02 C ATOM 2382 C ALA A 839 36.344 11.528 -1.628 1.00 24.68 C ATOM 2383 O ALA A 839 36.811 11.247 -2.732 1.00 24.25 O ATOM 2384 CB ALA A 839 37.055 10.429 0.540 1.00 25.63 C ATOM 2385 H ALA A 839 36.499 12.813 1.287 1.00 0.00 H ATOM 2386 N VAL A 840 35.057 11.812 -1.475 1.00 24.11 N ATOM 2387 CA VAL A 840 34.144 11.646 -2.648 1.00 25.21 C ATOM 2388 C VAL A 840 34.418 12.710 -3.738 1.00 27.19 C ATOM 2389 O VAL A 840 34.369 12.424 -4.934 1.00 24.53 O ATOM 2390 CB VAL A 840 32.664 11.560 -2.216 1.00 28.29 C ATOM 2391 CG1 VAL A 840 32.089 12.913 -1.942 1.00 32.48 C ATOM 2392 CG2 VAL A 840 31.817 10.840 -3.275 1.00 34.09 C ATOM 2393 H VAL A 840 34.691 12.143 -0.559 1.00 0.00 H ATOM 2394 N THR A 841 34.736 13.941 -3.316 1.00 27.10 N ATOM 2395 CA THR A 841 35.128 14.999 -4.247 1.00 28.34 C ATOM 2396 C THR A 841 36.369 14.616 -5.043 1.00 26.70 C ATOM 2397 O THR A 841 36.387 14.754 -6.258 1.00 27.66 O ATOM 2398 CB THR A 841 35.372 16.323 -3.504 1.00 32.48 C ATOM 2399 OG1 THR A 841 34.158 16.698 -2.861 1.00 31.87 O ATOM 2400 CG2 THR A 841 35.816 17.443 -4.480 1.00 33.30 C ATOM 2401 HG1 THR A 841 33.893 15.991 -2.221 1.00 0.00 H ATOM 2402 H THR A 841 34.703 14.150 -2.298 1.00 0.00 H ATOM 2403 N GLU A 842 37.379 14.092 -4.371 1.00 28.40 N ATOM 2404 CA GLU A 842 38.578 13.693 -5.078 1.00 29.83 C ATOM 2405 C GLU A 842 38.315 12.570 -6.071 1.00 30.78 C ATOM 2406 O GLU A 842 38.847 12.587 -7.184 1.00 30.55 O ATOM 2407 CB GLU A 842 39.678 13.281 -4.119 1.00 32.73 C ATOM 2408 CG GLU A 842 40.995 12.909 -4.802 1.00 37.41 C ATOM 2409 CD GLU A 842 41.559 13.996 -5.752 1.00 40.72 C ATOM 2410 OE1 GLU A 842 41.322 15.210 -5.555 1.00 39.68 O ATOM 2411 OE2 GLU A 842 42.230 13.620 -6.732 1.00 44.29 O ATOM 2412 H GLU A 842 37.313 13.967 -3.341 1.00 0.00 H ATOM 2413 N GLU A 843 37.493 11.596 -5.674 1.00 28.18 N ATOM 2414 CA GLU A 843 37.110 10.541 -6.601 1.00 28.27 C ATOM 2415 C GLU A 843 36.373 11.090 -7.808 1.00 27.35 C ATOM 2416 O GLU A 843 36.710 10.713 -8.939 1.00 30.16 O ATOM 2417 CB GLU A 843 36.295 9.450 -5.901 1.00 27.99 C ATOM 2418 CG GLU A 843 36.092 8.252 -6.785 1.00 28.46 C ATOM 2419 CD GLU A 843 35.529 7.075 -6.023 1.00 27.21 C ATOM 2420 OE1 GLU A 843 36.210 6.531 -5.147 1.00 25.23 O ATOM 2421 OE2 GLU A 843 34.379 6.700 -6.351 1.00 29.36 O ATOM 2422 H GLU A 843 37.126 11.591 -4.701 1.00 0.00 H ATOM 2423 N PHE A 844 35.418 12.005 -7.595 1.00 27.36 N ATOM 2424 CA PHE A 844 34.698 12.642 -8.716 1.00 26.86 C ATOM 2425 C PHE A 844 35.634 13.425 -9.658 1.00 30.20 C ATOM 2426 O PHE A 844 35.504 13.344 -10.898 1.00 28.43 O ATOM 2427 CB PHE A 844 33.599 13.590 -8.243 1.00 28.92 C ATOM 2428 CG PHE A 844 32.373 12.923 -7.622 1.00 30.37 C ATOM 2429 CD1 PHE A 844 32.131 11.534 -7.673 1.00 30.72 C ATOM 2430 CD2 PHE A 844 31.409 13.728 -7.025 1.00 34.27 C ATOM 2431 CE1 PHE A 844 30.979 10.992 -7.114 1.00 31.84 C ATOM 2432 CE2 PHE A 844 30.252 13.175 -6.467 1.00 35.66 C ATOM 2433 CZ PHE A 844 30.037 11.814 -6.522 1.00 33.36 C ATOM 2434 H PHE A 844 35.178 12.273 -6.619 1.00 0.00 H ATOM 2435 N TYR A 845 36.575 14.172 -9.074 1.00 30.83 N ATOM 2436 CA TYR A 845 37.546 14.942 -9.880 1.00 33.14 C ATOM 2437 C TYR A 845 38.435 14.039 -10.736 1.00 33.71 C ATOM 2438 O TYR A 845 38.739 14.361 -11.889 1.00 32.83 O ATOM 2439 CB TYR A 845 38.420 15.861 -8.993 1.00 33.57 C ATOM 2440 CG TYR A 845 37.721 17.072 -8.424 1.00 33.56 C ATOM 2441 CD1 TYR A 845 36.495 17.517 -8.923 1.00 33.16 C ATOM 2442 CD2 TYR A 845 38.318 17.823 -7.401 1.00 36.47 C ATOM 2443 CE1 TYR A 845 35.869 18.639 -8.401 1.00 37.36 C ATOM 2444 CE2 TYR A 845 37.699 18.948 -6.874 1.00 36.31 C ATOM 2445 CZ TYR A 845 36.471 19.350 -7.379 1.00 38.11 C ATOM 2446 OH TYR A 845 35.817 20.462 -6.884 1.00 44.72 O ATOM 2447 HH TYR A 845 34.963 20.584 -7.369 1.00 0.00 H ATOM 2448 H TYR A 845 36.625 14.212 -8.036 1.00 0.00 H ATOM 2449 N ARG A 846 38.850 12.910 -10.177 1.00 34.42 N ATOM 2450 CA ARG A 846 39.599 11.928 -10.958 1.00 34.44 C ATOM 2451 C ARG A 846 38.790 11.390 -12.136 1.00 33.55 C ATOM 2452 O ARG A 846 39.363 11.171 -13.240 1.00 34.59 O ATOM 2453 CB ARG A 846 40.145 10.819 -10.070 1.00 35.44 C ATOM 2454 CG ARG A 846 41.258 11.310 -9.171 1.00 36.60 C ATOM 2455 CD ARG A 846 41.961 10.190 -8.442 1.00 39.44 C ATOM 2456 NE ARG A 846 42.741 10.697 -7.303 1.00 37.04 N ATOM 2457 CZ ARG A 846 43.406 9.945 -6.436 1.00 40.44 C ATOM 2458 NH1 ARG A 846 43.416 8.621 -6.550 1.00 41.17 N ATOM 2459 NH2 ARG A 846 44.071 10.526 -5.434 1.00 42.45 N ATOM 2460 HE ARG A 846 42.774 11.727 -7.166 1.00 0.00 H ATOM 2461 HH12 ARG A 846 43.942 8.044 -5.863 1.00 0.00 H ATOM 2462 HH11 ARG A 846 42.898 8.162 -7.326 1.00 0.00 H ATOM 2463 HH22 ARG A 846 44.595 9.943 -4.750 1.00 0.00 H ATOM 2464 HH21 ARG A 846 44.065 11.561 -5.337 1.00 0.00 H ATOM 2465 H ARG A 846 38.641 12.722 -9.176 1.00 0.00 H ATOM 2466 N GLN A 847 37.479 11.185 -11.951 1.00 31.48 N ATOM 2467 CA GLN A 847 36.628 10.765 -13.075 1.00 30.41 C ATOM 2468 C GLN A 847 36.601 11.850 -14.141 1.00 33.51 C ATOM 2469 O GLN A 847 36.800 11.565 -15.325 1.00 34.48 O ATOM 2470 CB GLN A 847 35.202 10.396 -12.672 1.00 27.00 C ATOM 2471 CG GLN A 847 34.294 10.196 -13.863 1.00 26.65 C ATOM 2472 CD GLN A 847 32.954 9.597 -13.537 1.00 26.75 C ATOM 2473 OE1 GLN A 847 32.818 8.804 -12.607 1.00 29.50 O ATOM 2474 NE2 GLN A 847 31.951 9.956 -14.295 1.00 28.83 N ATOM 2475 HE22 GLN A 847 32.102 10.629 -15.073 1.00 0.00 H ATOM 2476 HE21 GLN A 847 31.002 9.568 -14.120 1.00 0.00 H ATOM 2477 H GLN A 847 37.061 11.323 -11.009 1.00 0.00 H ATOM 2478 N GLY A 848 36.342 13.085 -13.723 1.00 32.95 N ATOM 2479 CA GLY A 848 36.329 14.233 -14.654 1.00 35.15 C ATOM 2480 C GLY A 848 37.638 14.440 -15.432 1.00 34.66 C ATOM 2481 O GLY A 848 37.604 14.761 -16.617 1.00 37.36 O ATOM 2482 H GLY A 848 36.143 13.248 -12.715 1.00 0.00 H ATOM 2483 N ASP A 849 38.770 14.243 -14.775 1.00 36.03 N ATOM 2484 CA ASP A 849 40.070 14.271 -15.446 1.00 40.18 C ATOM 2485 C ASP A 849 40.177 13.213 -16.564 1.00 45.07 C ATOM 2486 O ASP A 849 40.653 13.507 -17.671 1.00 46.28 O ATOM 2487 CB ASP A 849 41.204 14.095 -14.431 1.00 39.88 C ATOM 2488 CG ASP A 849 41.360 15.307 -13.474 1.00 41.51 C ATOM 2489 OD1 ASP A 849 40.692 16.345 -13.661 1.00 42.28 O ATOM 2490 OD2 ASP A 849 42.120 15.182 -12.488 1.00 47.47 O ATOM 2491 H ASP A 849 38.734 14.063 -13.751 1.00 0.00 H ATOM 2492 N MET A 850 39.727 11.991 -16.296 1.00 40.10 N ATOM 2493 CA MET A 850 39.708 10.951 -17.329 1.00 40.54 C ATOM 2494 C MET A 850 38.702 11.236 -18.424 1.00 42.19 C ATOM 2495 O MET A 850 38.945 10.880 -19.578 1.00 42.66 O ATOM 2496 CB MET A 850 39.405 9.579 -16.735 1.00 41.46 C ATOM 2497 CG MET A 850 40.495 9.072 -15.830 1.00 48.53 C ATOM 2498 SD MET A 850 40.098 7.498 -15.052 1.00 55.93 S ATOM 2499 CE MET A 850 39.828 6.428 -16.475 1.00 51.00 C ATOM 2500 H MET A 850 39.383 11.770 -15.340 1.00 0.00 H ATOM 2501 N GLU A 851 37.575 11.853 -18.083 1.00 37.98 N ATOM 2502 CA GLU A 851 36.570 12.166 -19.091 1.00 39.76 C ATOM 2503 C GLU A 851 37.061 13.238 -20.079 1.00 47.67 C ATOM 2504 O GLU A 851 36.693 13.197 -21.265 1.00 46.61 O ATOM 2505 CB GLU A 851 35.277 12.632 -18.451 1.00 40.40 C ATOM 2506 CG GLU A 851 34.537 11.530 -17.698 1.00 40.70 C ATOM 2507 CD GLU A 851 33.316 12.041 -16.947 1.00 45.29 C ATOM 2508 OE1 GLU A 851 33.317 13.202 -16.441 1.00 42.42 O ATOM 2509 OE2 GLU A 851 32.334 11.268 -16.875 1.00 42.27 O ATOM 2510 H GLU A 851 37.409 12.114 -17.090 1.00 0.00 H ATOM 2511 N LYS A 852 37.860 14.191 -19.572 1.00 45.21 N ATOM 2512 CA LYS A 852 38.443 15.271 -20.385 1.00 48.90 C ATOM 2513 C LYS A 852 39.348 14.675 -21.426 1.00 50.47 C ATOM 2514 O LYS A 852 39.209 14.973 -22.606 1.00 52.06 O ATOM 2515 CB LYS A 852 39.252 16.253 -19.519 1.00 45.38 C ATOM 2516 CG LYS A 852 38.377 17.156 -18.666 1.00 49.30 C ATOM 2517 CD LYS A 852 39.175 17.971 -17.652 1.00 50.05 C ATOM 2518 CE LYS A 852 38.246 18.919 -16.901 1.00 52.51 C ATOM 2519 NZ LYS A 852 39.008 19.860 -16.031 1.00 54.13 N ATOM 2520 HZ1 LYS A 852 39.558 19.318 -15.334 1.00 0.00 H ATOM 2521 HZ2 LYS A 852 39.653 20.427 -16.617 1.00 0.00 H ATOM 2522 HZ3 LYS A 852 38.343 20.489 -15.537 1.00 0.00 H ATOM 2523 H LYS A 852 38.078 14.165 -18.555 1.00 0.00 H ATOM 2524 N GLU A 853 40.263 13.832 -20.959 1.00 57.19 N ATOM 2525 CA GLU A 853 41.204 13.098 -21.802 1.00 63.28 C ATOM 2526 C GLU A 853 40.523 12.263 -22.902 1.00 65.17 C ATOM 2527 O GLU A 853 41.063 12.145 -23.995 1.00 67.91 O ATOM 2528 CB GLU A 853 42.110 12.223 -20.920 1.00 65.87 C ATOM 2529 CG GLU A 853 43.131 11.364 -21.656 1.00 77.51 C ATOM 2530 CD GLU A 853 44.116 12.154 -22.518 1.00 87.58 C ATOM 2531 OE1 GLU A 853 44.438 13.318 -22.178 1.00 89.11 O ATOM 2532 OE2 GLU A 853 44.590 11.592 -23.538 1.00 93.63 O ATOM 2533 H GLU A 853 40.312 13.686 -19.931 1.00 0.00 H ATOM 2534 N ARG A 854 39.351 11.694 -22.626 1.00 61.25 N ATOM 2535 CA ARG A 854 38.592 10.957 -23.651 1.00 56.53 C ATOM 2536 C ARG A 854 37.654 11.817 -24.494 1.00 53.82 C ATOM 2537 O ARG A 854 36.977 11.300 -25.378 1.00 56.59 O ATOM 2538 CB ARG A 854 37.800 9.824 -22.997 1.00 52.76 C ATOM 2539 CG ARG A 854 38.703 8.701 -22.576 1.00 50.37 C ATOM 2540 CD ARG A 854 38.238 8.073 -21.303 1.00 51.91 C ATOM 2541 NE ARG A 854 39.366 7.407 -20.662 1.00 56.13 N ATOM 2542 CZ ARG A 854 39.597 6.098 -20.660 1.00 61.64 C ATOM 2543 NH1 ARG A 854 38.772 5.235 -21.276 1.00 64.58 N ATOM 2544 NH2 ARG A 854 40.675 5.641 -20.027 1.00 61.31 N ATOM 2545 HE ARG A 854 40.050 8.010 -20.162 1.00 0.00 H ATOM 2546 HH12 ARG A 854 38.978 4.216 -21.258 1.00 0.00 H ATOM 2547 HH11 ARG A 854 37.927 5.586 -21.771 1.00 0.00 H ATOM 2548 HH22 ARG A 854 40.876 4.621 -20.012 1.00 0.00 H ATOM 2549 HH21 ARG A 854 41.316 6.304 -19.547 1.00 0.00 H ATOM 2550 H ARG A 854 38.963 11.772 -21.664 1.00 0.00 H ATOM 2551 N GLY A 855 37.598 13.116 -24.222 1.00 51.99 N ATOM 2552 CA GLY A 855 36.704 14.004 -24.932 1.00 47.41 C ATOM 2553 C GLY A 855 35.239 13.688 -24.744 1.00 48.68 C ATOM 2554 O GLY A 855 34.470 13.849 -25.675 1.00 49.65 O ATOM 2555 H GLY A 855 38.213 13.505 -23.479 1.00 0.00 H ATOM 2556 N VAL A 856 34.830 13.245 -23.552 1.00 45.05 N ATOM 2557 CA VAL A 856 33.379 13.076 -23.273 1.00 47.39 C ATOM 2558 C VAL A 856 32.938 14.142 -22.287 1.00 43.51 C ATOM 2559 O VAL A 856 33.767 14.784 -21.676 1.00 47.88 O ATOM 2560 CB VAL A 856 33.001 11.629 -22.789 1.00 49.46 C ATOM 2561 CG1 VAL A 856 33.512 10.590 -23.793 1.00 51.38 C ATOM 2562 CG2 VAL A 856 33.530 11.346 -21.396 1.00 45.00 C ATOM 2563 H VAL A 856 35.529 13.017 -22.816 1.00 0.00 H ATOM 2564 N GLU A 857 31.637 14.348 -22.176 1.00 46.03 N ATOM 2565 CA GLU A 857 31.059 15.373 -21.293 1.00 49.05 C ATOM 2566 C GLU A 857 31.509 15.264 -19.822 1.00 48.54 C ATOM 2567 O GLU A 857 31.483 14.170 -19.244 1.00 43.89 O ATOM 2568 CB GLU A 857 29.534 15.272 -21.347 1.00 55.50 C ATOM 2569 CG GLU A 857 28.787 16.332 -20.547 1.00 60.20 C ATOM 2570 CD GLU A 857 27.276 16.231 -20.702 1.00 67.74 C ATOM 2571 OE1 GLU A 857 26.767 15.123 -20.987 1.00 74.75 O ATOM 2572 OE2 GLU A 857 26.595 17.261 -20.528 1.00 69.04 O ATOM 2573 H GLU A 857 30.992 13.758 -22.739 1.00 0.00 H ATOM 2574 N VAL A 858 31.908 16.397 -19.232 1.00 43.84 N ATOM 2575 CA VAL A 858 32.330 16.472 -17.821 1.00 44.69 C ATOM 2576 C VAL A 858 31.337 17.348 -17.090 1.00 44.16 C ATOM 2577 O VAL A 858 31.282 18.541 -17.356 1.00 49.57 O ATOM 2578 CB VAL A 858 33.740 17.081 -17.669 1.00 43.25 C ATOM 2579 CG1 VAL A 858 34.185 17.111 -16.208 1.00 43.33 C ATOM 2580 CG2 VAL A 858 34.733 16.309 -18.520 1.00 45.35 C ATOM 2581 H VAL A 858 31.921 17.270 -19.798 1.00 0.00 H ATOM 2582 N LEU A 859 30.551 16.780 -16.173 1.00 45.09 N ATOM 2583 CA LEU A 859 29.560 17.568 -15.435 1.00 42.11 C ATOM 2584 C LEU A 859 30.302 18.461 -14.444 1.00 41.98 C ATOM 2585 O LEU A 859 31.403 18.099 -13.988 1.00 39.14 O ATOM 2586 CB LEU A 859 28.535 16.687 -14.720 1.00 46.53 C ATOM 2587 CG LEU A 859 27.634 15.789 -15.585 1.00 50.33 C ATOM 2588 CD1 LEU A 859 26.608 15.031 -14.742 1.00 52.34 C ATOM 2589 CD2 LEU A 859 26.952 16.573 -16.703 1.00 54.76 C ATOM 2590 H LEU A 859 30.643 15.762 -15.979 1.00 0.00 H ATOM 2591 N PRO A 860 29.723 19.635 -14.101 1.00 43.54 N ATOM 2592 CA PRO A 860 30.415 20.589 -13.208 1.00 43.74 C ATOM 2593 C PRO A 860 30.954 20.003 -11.912 1.00 40.65 C ATOM 2594 O PRO A 860 32.080 20.278 -11.540 1.00 37.43 O ATOM 2595 CB PRO A 860 29.340 21.642 -12.911 1.00 48.51 C ATOM 2596 CG PRO A 860 28.376 21.559 -14.043 1.00 47.80 C ATOM 2597 CD PRO A 860 28.423 20.157 -14.572 1.00 46.54 C ATOM 2598 N MET A 861 30.137 19.180 -11.261 1.00 41.32 N ATOM 2599 CA MET A 861 30.485 18.448 -10.042 1.00 40.83 C ATOM 2600 C MET A 861 31.759 17.587 -10.134 1.00 40.15 C ATOM 2601 O MET A 861 32.380 17.290 -9.107 1.00 40.41 O ATOM 2602 CB MET A 861 29.268 17.573 -9.691 1.00 47.85 C ATOM 2603 CG MET A 861 29.312 16.781 -8.404 1.00 53.97 C ATOM 2604 SD MET A 861 27.781 15.856 -8.109 1.00 53.60 S ATOM 2605 CE MET A 861 26.478 17.048 -8.442 1.00 48.54 C ATOM 2606 H MET A 861 29.180 19.047 -11.646 1.00 0.00 H ATOM 2607 N PHE A 862 32.158 17.204 -11.350 1.00 37.21 N ATOM 2608 CA PHE A 862 33.350 16.374 -11.590 1.00 37.02 C ATOM 2609 C PHE A 862 34.536 17.146 -12.154 1.00 40.44 C ATOM 2610 O PHE A 862 35.592 16.549 -12.468 1.00 34.62 O ATOM 2611 CB PHE A 862 32.976 15.246 -12.571 1.00 38.52 C ATOM 2612 CG PHE A 862 31.947 14.290 -12.036 1.00 36.69 C ATOM 2613 CD1 PHE A 862 30.618 14.654 -11.938 1.00 40.16 C ATOM 2614 CD2 PHE A 862 32.303 13.006 -11.650 1.00 36.71 C ATOM 2615 CE1 PHE A 862 29.667 13.765 -11.443 1.00 40.26 C ATOM 2616 CE2 PHE A 862 31.362 12.119 -11.171 1.00 32.72 C ATOM 2617 CZ PHE A 862 30.048 12.495 -11.055 1.00 36.47 C ATOM 2618 H PHE A 862 31.597 17.508 -12.171 1.00 0.00 H ATOM 2619 N ASP A 863 34.378 18.468 -12.266 1.00 39.27 N ATOM 2620 CA ASP A 863 35.364 19.319 -12.940 1.00 42.38 C ATOM 2621 C ASP A 863 36.236 20.114 -11.948 1.00 41.03 C ATOM 2622 O ASP A 863 35.756 21.057 -11.321 1.00 38.31 O ATOM 2623 CB ASP A 863 34.600 20.269 -13.854 1.00 44.39 C ATOM 2624 CG ASP A 863 35.488 20.985 -14.845 1.00 44.54 C ATOM 2625 OD1 ASP A 863 36.731 21.076 -14.635 1.00 42.22 O ATOM 2626 OD2 ASP A 863 34.900 21.435 -15.850 1.00 47.27 O ATOM 2627 H ASP A 863 33.527 18.908 -11.862 1.00 0.00 H ATOM 2628 N ARG A 864 37.504 19.724 -11.821 1.00 40.08 N ATOM 2629 CA ARG A 864 38.461 20.388 -10.930 1.00 45.39 C ATOM 2630 C ARG A 864 38.540 21.895 -11.163 1.00 49.46 C ATOM 2631 O ARG A 864 38.603 22.685 -10.229 1.00 53.88 O ATOM 2632 CB ARG A 864 39.869 19.894 -11.186 1.00 42.29 C ATOM 2633 CG ARG A 864 40.232 18.625 -10.523 1.00 46.78 C ATOM 2634 CD ARG A 864 41.735 18.413 -10.576 1.00 44.63 C ATOM 2635 NE ARG A 864 41.974 16.986 -10.425 1.00 47.27 N ATOM 2636 CZ ARG A 864 41.977 16.332 -9.270 1.00 43.00 C ATOM 2637 NH1 ARG A 864 41.806 16.960 -8.110 1.00 40.86 N ATOM 2638 NH2 ARG A 864 42.160 15.016 -9.281 1.00 48.73 N ATOM 2639 HE ARG A 864 42.157 16.436 -11.289 1.00 0.00 H ATOM 2640 HH12 ARG A 864 41.813 16.421 -7.221 1.00 0.00 H ATOM 2641 HH11 ARG A 864 41.665 17.990 -8.092 1.00 0.00 H ATOM 2642 HH22 ARG A 864 42.166 14.484 -8.387 1.00 0.00 H ATOM 2643 HH21 ARG A 864 42.297 14.518 -10.183 1.00 0.00 H ATOM 2644 H ARG A 864 37.830 18.910 -12.380 1.00 0.00 H ATOM 2645 N SER A 865 38.576 22.280 -12.425 1.00 51.77 N ATOM 2646 CA SER A 865 38.796 23.674 -12.778 1.00 51.51 C ATOM 2647 C SER A 865 37.591 24.549 -12.439 1.00 52.36 C ATOM 2648 O SER A 865 37.724 25.771 -12.421 1.00 56.60 O ATOM 2649 CB SER A 865 39.153 23.789 -14.275 1.00 49.76 C ATOM 2650 OG SER A 865 37.985 23.715 -15.085 1.00 51.19 O ATOM 2651 HG SER A 865 37.533 22.848 -14.932 1.00 0.00 H ATOM 2652 H SER A 865 38.445 21.576 -13.179 1.00 0.00 H ATOM 2653 N LYS A 866 36.416 23.958 -12.189 1.00 52.14 N ATOM 2654 CA LYS A 866 35.280 24.747 -11.690 1.00 54.59 C ATOM 2655 C LYS A 866 35.427 25.227 -10.226 1.00 58.69 C ATOM 2656 O LYS A 866 34.645 26.081 -9.789 1.00 56.77 O ATOM 2657 CB LYS A 866 33.959 24.008 -11.876 1.00 60.87 C ATOM 2658 CG LYS A 866 33.443 24.028 -13.308 1.00 65.50 C ATOM 2659 CD LYS A 866 32.650 25.295 -13.609 1.00 67.25 C ATOM 2660 CE LYS A 866 32.575 25.577 -15.101 1.00 68.36 C ATOM 2661 NZ LYS A 866 32.230 24.371 -15.902 1.00 66.29 N ATOM 2662 HZ1 LYS A 866 32.954 23.639 -15.753 1.00 0.00 H ATOM 2663 HZ2 LYS A 866 31.303 24.010 -15.600 1.00 0.00 H ATOM 2664 HZ3 LYS A 866 32.193 24.625 -16.910 1.00 0.00 H ATOM 2665 H LYS A 866 36.306 22.936 -12.348 1.00 0.00 H ATOM 2666 N ASN A 867 36.401 24.685 -9.482 1.00 60.72 N ATOM 2667 CA ASN A 867 36.751 25.156 -8.121 1.00 64.14 C ATOM 2668 C ASN A 867 35.617 25.107 -7.060 1.00 55.10 C ATOM 2669 O ASN A 867 35.751 25.710 -6.003 1.00 56.85 O ATOM 2670 CB ASN A 867 37.326 26.594 -8.177 1.00 70.10 C ATOM 2671 CG ASN A 867 38.485 26.743 -9.158 1.00 78.64 C ATOM 2672 OD1 ASN A 867 38.524 27.685 -9.963 1.00 73.43 O ATOM 2673 ND2 ASN A 867 39.443 25.819 -9.090 1.00 84.80 N ATOM 2674 HD22 ASN A 867 39.371 25.045 -8.399 1.00 0.00 H ATOM 2675 HD21 ASN A 867 40.263 25.872 -9.728 1.00 0.00 H ATOM 2676 H ASN A 867 36.941 23.891 -9.881 1.00 0.00 H ATOM 2677 N MET A 868 34.546 24.362 -7.323 1.00 50.46 N ATOM 2678 CA MET A 868 33.308 24.427 -6.525 1.00 52.86 C ATOM 2679 C MET A 868 33.571 24.204 -5.028 1.00 46.01 C ATOM 2680 O MET A 868 34.383 23.368 -4.669 1.00 44.55 O ATOM 2681 CB MET A 868 32.254 23.461 -7.089 1.00 57.63 C ATOM 2682 CG MET A 868 31.691 23.980 -8.414 1.00 64.77 C ATOM 2683 SD MET A 868 30.534 22.926 -9.323 1.00 75.01 S ATOM 2684 CE MET A 868 29.904 24.129 -10.508 1.00 75.92 C ATOM 2685 H MET A 868 34.584 23.704 -8.128 1.00 0.00 H ATOM 2686 N GLU A 869 32.960 25.016 -4.163 1.00 39.74 N ATOM 2687 CA GLU A 869 33.299 24.971 -2.729 1.00 39.12 C ATOM 2688 C GLU A 869 32.652 23.743 -2.077 1.00 32.54 C ATOM 2689 O GLU A 869 31.483 23.473 -2.335 1.00 32.85 O ATOM 2690 CB GLU A 869 32.805 26.222 -1.989 1.00 42.84 C ATOM 2691 CG GLU A 869 33.303 27.541 -2.548 1.00 47.80 C ATOM 2692 CD GLU A 869 32.506 28.702 -1.984 1.00 49.98 C ATOM 2693 OE1 GLU A 869 32.273 28.735 -0.747 1.00 45.71 O ATOM 2694 OE2 GLU A 869 32.071 29.550 -2.783 1.00 60.62 O ATOM 2695 H GLU A 869 32.240 25.685 -4.503 1.00 0.00 H ATOM 2696 N LEU A 870 33.404 23.048 -1.240 1.00 32.54 N ATOM 2697 CA LEU A 870 32.897 21.892 -0.452 1.00 30.53 C ATOM 2698 C LEU A 870 31.573 22.203 0.273 1.00 29.25 C ATOM 2699 O LEU A 870 30.596 21.446 0.123 1.00 26.25 O ATOM 2700 CB LEU A 870 33.978 21.398 0.528 1.00 33.90 C ATOM 2701 CG LEU A 870 33.987 19.961 1.015 1.00 35.38 C ATOM 2702 CD1 LEU A 870 34.279 19.002 -0.133 1.00 35.41 C ATOM 2703 CD2 LEU A 870 35.034 19.772 2.105 1.00 38.63 C ATOM 2704 H LEU A 870 34.400 23.323 -1.127 1.00 0.00 H ATOM 2705 N ALA A 871 31.515 23.324 1.018 1.00 23.82 N ATOM 2706 CA ALA A 871 30.325 23.714 1.759 1.00 23.77 C ATOM 2707 C ALA A 871 29.084 23.796 0.908 1.00 23.74 C ATOM 2708 O ALA A 871 28.037 23.272 1.281 1.00 23.15 O ATOM 2709 CB ALA A 871 30.538 25.059 2.456 1.00 25.99 C ATOM 2710 H ALA A 871 32.355 23.935 1.065 1.00 0.00 H ATOM 2711 N LYS A 872 29.180 24.463 -0.245 1.00 22.95 N ATOM 2712 CA LYS A 872 28.014 24.619 -1.119 1.00 24.16 C ATOM 2713 C LYS A 872 27.514 23.262 -1.655 1.00 23.82 C ATOM 2714 O LYS A 872 26.311 23.058 -1.759 1.00 21.70 O ATOM 2715 CB LYS A 872 28.301 25.561 -2.271 1.00 25.18 C ATOM 2716 CG LYS A 872 28.563 27.007 -1.814 1.00 27.53 C ATOM 2717 CD LYS A 872 28.580 27.958 -3.006 1.00 29.50 C ATOM 2718 CE LYS A 872 28.793 29.390 -2.526 1.00 31.01 C ATOM 2719 NZ LYS A 872 29.138 30.296 -3.636 1.00 31.27 N ATOM 2720 HZ1 LYS A 872 30.016 29.970 -4.088 1.00 0.00 H ATOM 2721 HZ2 LYS A 872 28.367 30.297 -4.334 1.00 0.00 H ATOM 2722 HZ3 LYS A 872 29.274 31.259 -3.267 1.00 0.00 H ATOM 2723 H LYS A 872 30.092 24.876 -0.526 1.00 0.00 H ATOM 2724 N GLY A 873 28.452 22.386 -1.986 1.00 23.62 N ATOM 2725 CA GLY A 873 28.154 21.049 -2.461 1.00 25.03 C ATOM 2726 C GLY A 873 27.470 20.215 -1.396 1.00 23.56 C ATOM 2727 O GLY A 873 26.483 19.574 -1.691 1.00 23.40 O ATOM 2728 H GLY A 873 29.449 22.671 -1.901 1.00 0.00 H ATOM 2729 N GLN A 874 27.923 20.295 -0.147 1.00 20.96 N ATOM 2730 CA GLN A 874 27.268 19.572 0.941 1.00 21.70 C ATOM 2731 C GLN A 874 25.903 20.090 1.259 1.00 20.70 C ATOM 2732 O GLN A 874 24.975 19.305 1.491 1.00 22.14 O ATOM 2733 CB GLN A 874 28.161 19.522 2.187 1.00 22.82 C ATOM 2734 CG GLN A 874 29.422 18.715 1.958 1.00 24.29 C ATOM 2735 CD GLN A 874 29.116 17.236 1.639 1.00 24.44 C ATOM 2736 OE1 GLN A 874 28.693 16.488 2.526 1.00 24.30 O ATOM 2737 NE2 GLN A 874 29.361 16.826 0.401 1.00 24.45 N ATOM 2738 HE22 GLN A 874 29.717 17.498 -0.308 1.00 0.00 H ATOM 2739 HE21 GLN A 874 29.197 15.833 0.140 1.00 0.00 H ATOM 2740 H GLN A 874 28.757 20.882 0.058 1.00 0.00 H ATOM 2741 N ILE A 875 25.744 21.409 1.308 1.00 19.60 N ATOM 2742 CA ILE A 875 24.413 22.000 1.495 1.00 20.67 C ATOM 2743 C ILE A 875 23.432 21.559 0.410 1.00 21.62 C ATOM 2744 O ILE A 875 22.274 21.260 0.712 1.00 22.33 O ATOM 2745 CB ILE A 875 24.488 23.546 1.644 1.00 22.45 C ATOM 2746 CG1 ILE A 875 25.131 23.898 3.006 1.00 23.48 C ATOM 2747 CG2 ILE A 875 23.137 24.208 1.557 1.00 24.60 C ATOM 2748 CD1 ILE A 875 25.632 25.354 3.056 1.00 26.33 C ATOM 2749 H ILE A 875 26.573 22.030 1.213 1.00 0.00 H ATOM 2750 N GLY A 876 23.895 21.520 -0.833 1.00 21.82 N ATOM 2751 CA GLY A 876 23.070 21.091 -1.951 1.00 23.95 C ATOM 2752 C GLY A 876 22.678 19.611 -1.810 1.00 22.19 C ATOM 2753 O GLY A 876 21.511 19.266 -1.998 1.00 24.51 O ATOM 2754 H GLY A 876 24.879 21.805 -1.013 1.00 0.00 H ATOM 2755 N PHE A 877 23.623 18.760 -1.437 1.00 21.93 N ATOM 2756 CA PHE A 877 23.353 17.312 -1.267 1.00 22.53 C ATOM 2757 C PHE A 877 22.363 17.102 -0.109 1.00 24.18 C ATOM 2758 O PHE A 877 21.381 16.346 -0.202 1.00 22.12 O ATOM 2759 CB PHE A 877 24.661 16.550 -1.027 1.00 23.68 C ATOM 2760 CG PHE A 877 24.488 15.067 -0.937 1.00 24.84 C ATOM 2761 CD1 PHE A 877 24.291 14.309 -2.100 1.00 26.44 C ATOM 2762 CD2 PHE A 877 24.501 14.425 0.294 1.00 26.18 C ATOM 2763 CE1 PHE A 877 24.169 12.929 -2.031 1.00 27.52 C ATOM 2764 CE2 PHE A 877 24.339 13.047 0.366 1.00 28.46 C ATOM 2765 CZ PHE A 877 24.167 12.306 -0.804 1.00 28.13 C ATOM 2766 H PHE A 877 24.583 19.119 -1.258 1.00 0.00 H ATOM 2767 N ILE A 878 22.560 17.863 0.957 1.00 23.06 N ATOM 2768 CA ILE A 878 21.617 17.896 2.066 1.00 22.00 C ATOM 2769 C ILE A 878 20.230 18.313 1.640 1.00 24.30 C ATOM 2770 O ILE A 878 19.258 17.598 1.927 1.00 22.87 O ATOM 2771 CB ILE A 878 22.162 18.759 3.232 1.00 22.76 C ATOM 2772 CG1 ILE A 878 23.327 18.016 3.905 1.00 22.61 C ATOM 2773 CG2 ILE A 878 21.085 19.133 4.237 1.00 21.94 C ATOM 2774 CD1 ILE A 878 24.139 18.837 4.890 1.00 24.14 C ATOM 2775 H ILE A 878 23.414 18.455 1.003 1.00 0.00 H ATOM 2776 N ASP A 879 20.107 19.465 0.987 1.00 22.41 N ATOM 2777 CA ASP A 879 18.800 20.021 0.703 1.00 24.45 C ATOM 2778 C ASP A 879 17.988 19.213 -0.313 1.00 25.36 C ATOM 2779 O ASP A 879 16.785 19.069 -0.156 1.00 25.23 O ATOM 2780 CB ASP A 879 18.921 21.439 0.198 1.00 24.56 C ATOM 2781 CG ASP A 879 19.253 22.447 1.316 1.00 27.95 C ATOM 2782 OD1 ASP A 879 19.233 22.114 2.529 1.00 28.72 O ATOM 2783 OD2 ASP A 879 19.507 23.618 0.963 1.00 27.79 O ATOM 2784 H ASP A 879 20.960 19.973 0.676 1.00 0.00 H ATOM 2785 N PHE A 880 18.652 18.669 -1.304 1.00 24.47 N ATOM 2786 CA PHE A 880 17.966 18.051 -2.440 1.00 27.96 C ATOM 2787 C PHE A 880 17.931 16.521 -2.381 1.00 26.00 C ATOM 2788 O PHE A 880 17.055 15.918 -2.988 1.00 27.33 O ATOM 2789 CB PHE A 880 18.599 18.510 -3.741 1.00 31.79 C ATOM 2790 CG PHE A 880 18.313 19.948 -4.069 1.00 35.37 C ATOM 2791 CD1 PHE A 880 17.080 20.319 -4.647 1.00 42.18 C ATOM 2792 CD2 PHE A 880 19.258 20.939 -3.815 1.00 36.77 C ATOM 2793 CE1 PHE A 880 16.809 21.649 -4.968 1.00 43.92 C ATOM 2794 CE2 PHE A 880 18.993 22.269 -4.122 1.00 41.76 C ATOM 2795 CZ PHE A 880 17.759 22.630 -4.692 1.00 45.00 C ATOM 2796 H PHE A 880 19.692 18.677 -1.283 1.00 0.00 H ATOM 2797 N VAL A 881 18.861 15.897 -1.673 1.00 23.35 N ATOM 2798 CA VAL A 881 18.895 14.406 -1.554 1.00 24.32 C ATOM 2799 C VAL A 881 18.653 13.938 -0.122 1.00 24.09 C ATOM 2800 O VAL A 881 17.588 13.336 0.188 1.00 22.94 O ATOM 2801 CB VAL A 881 20.216 13.839 -2.069 1.00 24.78 C ATOM 2802 CG1 VAL A 881 20.198 12.297 -2.051 1.00 26.88 C ATOM 2803 CG2 VAL A 881 20.484 14.362 -3.470 1.00 26.63 C ATOM 2804 H VAL A 881 19.588 16.460 -1.186 1.00 0.00 H ATOM 2805 N ALA A 882 19.596 14.232 0.777 1.00 21.68 N ATOM 2806 CA ALA A 882 19.623 13.572 2.084 1.00 22.10 C ATOM 2807 C ALA A 882 18.572 14.028 3.078 1.00 21.97 C ATOM 2808 O ALA A 882 17.956 13.190 3.748 1.00 23.37 O ATOM 2809 CB ALA A 882 21.017 13.649 2.731 1.00 23.06 C ATOM 2810 H ALA A 882 20.322 14.940 0.545 1.00 0.00 H ATOM 2811 N ALA A 883 18.348 15.342 3.234 1.00 22.02 N ATOM 2812 CA ALA A 883 17.366 15.784 4.241 1.00 22.19 C ATOM 2813 C ALA A 883 15.959 15.259 3.908 1.00 22.78 C ATOM 2814 O ALA A 883 15.289 14.738 4.812 1.00 23.08 O ATOM 2815 CB ALA A 883 17.357 17.294 4.485 1.00 22.34 C ATOM 2816 H ALA A 883 18.859 16.037 2.654 1.00 0.00 H ATOM 2817 N PRO A 884 15.519 15.375 2.657 1.00 24.23 N ATOM 2818 CA PRO A 884 14.169 14.873 2.367 1.00 24.72 C ATOM 2819 C PRO A 884 14.057 13.334 2.529 1.00 24.03 C ATOM 2820 O PRO A 884 13.025 12.817 2.995 1.00 22.31 O ATOM 2821 CB PRO A 884 13.961 15.245 0.911 1.00 25.94 C ATOM 2822 CG PRO A 884 14.928 16.311 0.589 1.00 26.20 C ATOM 2823 CD PRO A 884 16.072 16.170 1.543 1.00 25.40 C ATOM 2824 N PHE A 885 15.105 12.616 2.127 1.00 23.25 N ATOM 2825 CA PHE A 885 15.089 11.143 2.258 1.00 22.02 C ATOM 2826 C PHE A 885 14.950 10.705 3.708 1.00 21.36 C ATOM 2827 O PHE A 885 14.036 9.942 4.049 1.00 21.89 O ATOM 2828 CB PHE A 885 16.313 10.544 1.583 1.00 21.87 C ATOM 2829 CG PHE A 885 16.460 9.045 1.764 1.00 20.86 C ATOM 2830 CD1 PHE A 885 15.928 8.161 0.845 1.00 22.50 C ATOM 2831 CD2 PHE A 885 17.197 8.539 2.817 1.00 22.35 C ATOM 2832 CE1 PHE A 885 16.100 6.785 1.012 1.00 22.00 C ATOM 2833 CE2 PHE A 885 17.396 7.177 2.956 1.00 22.27 C ATOM 2834 CZ PHE A 885 16.821 6.307 2.075 1.00 20.96 C ATOM 2835 H PHE A 885 15.935 13.092 1.721 1.00 0.00 H ATOM 2836 N PHE A 886 15.823 11.205 4.582 1.00 20.46 N ATOM 2837 CA PHE A 886 15.776 10.844 5.972 1.00 20.81 C ATOM 2838 C PHE A 886 14.512 11.334 6.659 1.00 22.19 C ATOM 2839 O PHE A 886 13.879 10.543 7.394 1.00 20.89 O ATOM 2840 CB PHE A 886 17.074 11.236 6.717 1.00 21.37 C ATOM 2841 CG PHE A 886 18.237 10.297 6.424 1.00 19.01 C ATOM 2842 CD1 PHE A 886 18.328 9.082 7.091 1.00 19.81 C ATOM 2843 CD2 PHE A 886 19.194 10.610 5.462 1.00 19.60 C ATOM 2844 CE1 PHE A 886 19.353 8.187 6.824 1.00 19.61 C ATOM 2845 CE2 PHE A 886 20.220 9.701 5.174 1.00 20.89 C ATOM 2846 CZ PHE A 886 20.290 8.497 5.847 1.00 19.40 C ATOM 2847 H PHE A 886 16.552 11.869 4.252 1.00 0.00 H ATOM 2848 N GLN A 887 14.071 12.565 6.378 1.00 23.66 N ATOM 2849 CA GLN A 887 12.825 13.033 7.016 1.00 26.10 C ATOM 2850 C GLN A 887 11.635 12.169 6.623 1.00 24.28 C ATOM 2851 O GLN A 887 10.818 11.808 7.492 1.00 25.48 O ATOM 2852 CB GLN A 887 12.489 14.499 6.684 1.00 30.84 C ATOM 2853 CG GLN A 887 11.288 15.074 7.461 1.00 34.35 C ATOM 2854 CD GLN A 887 11.488 15.062 9.005 1.00 44.60 C ATOM 2855 OE1 GLN A 887 11.245 14.040 9.690 1.00 58.30 O ATOM 2856 NE2 GLN A 887 11.936 16.187 9.562 1.00 44.54 N ATOM 2857 HE22 GLN A 887 12.129 17.020 8.969 1.00 0.00 H ATOM 2858 HE21 GLN A 887 12.092 16.232 10.589 1.00 0.00 H ATOM 2859 H GLN A 887 14.595 13.180 5.723 1.00 0.00 H ATOM 2860 N LYS A 888 11.521 11.868 5.330 1.00 23.51 N ATOM 2861 CA LYS A 888 10.386 11.069 4.828 1.00 23.67 C ATOM 2862 C LYS A 888 10.357 9.648 5.408 1.00 23.65 C ATOM 2863 O LYS A 888 9.290 9.176 5.835 1.00 22.16 O ATOM 2864 CB LYS A 888 10.352 11.050 3.320 1.00 26.46 C ATOM 2865 CG LYS A 888 9.834 12.374 2.736 1.00 30.62 C ATOM 2866 CD LYS A 888 9.984 12.366 1.236 1.00 33.02 C ATOM 2867 CE LYS A 888 9.765 13.742 0.638 1.00 38.65 C ATOM 2868 NZ LYS A 888 10.288 13.660 -0.749 1.00 44.62 N ATOM 2869 HZ1 LYS A 888 11.298 13.413 -0.723 1.00 0.00 H ATOM 2870 HZ2 LYS A 888 9.764 12.930 -1.273 1.00 0.00 H ATOM 2871 HZ3 LYS A 888 10.167 14.580 -1.219 1.00 0.00 H ATOM 2872 H LYS A 888 12.245 12.202 4.662 1.00 0.00 H ATOM 2873 N ILE A 889 11.512 8.974 5.484 1.00 23.23 N ATOM 2874 CA ILE A 889 11.488 7.586 6.009 1.00 22.39 C ATOM 2875 C ILE A 889 11.255 7.559 7.510 1.00 25.68 C ATOM 2876 O ILE A 889 10.576 6.642 8.032 1.00 22.71 O ATOM 2877 CB ILE A 889 12.706 6.718 5.576 1.00 20.80 C ATOM 2878 CG1 ILE A 889 14.002 7.138 6.279 1.00 22.48 C ATOM 2879 CG2 ILE A 889 12.872 6.763 4.081 1.00 20.26 C ATOM 2880 CD1 ILE A 889 15.203 6.370 5.789 1.00 21.98 C ATOM 2881 H ILE A 889 12.405 9.413 5.182 1.00 0.00 H ATOM 2882 N VAL A 890 11.828 8.535 8.234 1.00 23.77 N ATOM 2883 CA VAL A 890 11.613 8.613 9.663 1.00 25.78 C ATOM 2884 C VAL A 890 10.143 8.887 9.935 1.00 26.52 C ATOM 2885 O VAL A 890 9.528 8.197 10.762 1.00 28.66 O ATOM 2886 CB VAL A 890 12.513 9.679 10.337 1.00 25.04 C ATOM 2887 CG1 VAL A 890 12.103 9.954 11.770 1.00 25.81 C ATOM 2888 CG2 VAL A 890 13.949 9.242 10.314 1.00 24.59 C ATOM 2889 H VAL A 890 12.431 9.240 7.764 1.00 0.00 H ATOM 2890 N ASP A 891 9.566 9.849 9.223 1.00 25.79 N ATOM 2891 CA ASP A 891 8.150 10.195 9.449 1.00 28.12 C ATOM 2892 C ASP A 891 7.200 9.082 9.052 1.00 29.50 C ATOM 2893 O ASP A 891 6.194 8.894 9.719 1.00 29.26 O ATOM 2894 CB ASP A 891 7.742 11.473 8.741 1.00 29.76 C ATOM 2895 CG ASP A 891 8.375 12.708 9.354 1.00 33.24 C ATOM 2896 OD1 ASP A 891 9.009 12.623 10.439 1.00 36.22 O ATOM 2897 OD2 ASP A 891 8.264 13.760 8.716 1.00 38.08 O ATOM 2898 H ASP A 891 10.115 10.360 8.503 1.00 0.00 H ATOM 2899 N ALA A 892 7.516 8.358 7.984 1.00 27.92 N ATOM 2900 CA ALA A 892 6.653 7.277 7.464 1.00 30.77 C ATOM 2901 C ALA A 892 6.599 6.045 8.366 1.00 30.78 C ATOM 2902 O ALA A 892 5.583 5.350 8.406 1.00 32.76 O ATOM 2903 CB ALA A 892 7.101 6.862 6.067 1.00 31.99 C ATOM 2904 H ALA A 892 8.410 8.561 7.492 1.00 0.00 H ATOM 2905 N CYS A 893 7.663 5.764 9.101 1.00 27.76 N ATOM 2906 CA CYS A 893 7.850 4.443 9.623 1.00 30.08 C ATOM 2907 C CYS A 893 9.006 4.317 10.634 1.00 29.02 C ATOM 2908 O CYS A 893 8.861 3.661 11.666 1.00 30.41 O ATOM 2909 CB CYS A 893 8.132 3.526 8.414 1.00 33.68 C ATOM 2910 SG CYS A 893 8.183 1.822 8.820 1.00 43.54 S ATOM 2911 H CYS A 893 8.366 6.504 9.300 1.00 0.00 H ATOM 2912 N LEU A 894 10.153 4.918 10.331 1.00 25.08 N ATOM 2913 CA LEU A 894 11.405 4.622 11.055 1.00 24.11 C ATOM 2914 C LEU A 894 11.698 5.705 12.100 1.00 26.29 C ATOM 2915 O LEU A 894 12.777 6.317 12.118 1.00 23.88 O ATOM 2916 CB LEU A 894 12.575 4.388 10.084 1.00 23.34 C ATOM 2917 CG LEU A 894 12.285 3.463 8.878 1.00 23.62 C ATOM 2918 CD1 LEU A 894 13.444 3.435 7.899 1.00 25.14 C ATOM 2919 CD2 LEU A 894 11.897 2.064 9.319 1.00 24.16 C ATOM 2920 H LEU A 894 10.168 5.617 9.561 1.00 0.00 H ATOM 2921 N GLN A 895 10.766 5.843 13.063 1.00 26.33 N ATOM 2922 CA GLN A 895 10.822 6.899 14.102 1.00 29.37 C ATOM 2923 C GLN A 895 12.076 6.866 14.944 1.00 26.81 C ATOM 2924 O GLN A 895 12.582 7.912 15.363 1.00 26.52 O ATOM 2925 CB GLN A 895 9.633 6.811 15.059 1.00 34.87 C ATOM 2926 CG GLN A 895 8.519 7.751 14.718 1.00 45.33 C ATOM 2927 CD GLN A 895 7.808 7.359 13.455 1.00 54.84 C ATOM 2928 OE1 GLN A 895 7.432 6.188 13.269 1.00 62.48 O ATOM 2929 NE2 GLN A 895 7.601 8.336 12.572 1.00 62.40 N ATOM 2930 HE22 GLN A 895 7.935 9.300 12.775 1.00 0.00 H ATOM 2931 HE21 GLN A 895 7.105 8.135 11.680 1.00 0.00 H ATOM 2932 H GLN A 895 9.968 5.176 13.078 1.00 0.00 H ATOM 2933 N GLY A 896 12.616 5.678 15.169 1.00 25.09 N ATOM 2934 CA GLY A 896 13.818 5.547 15.973 1.00 23.23 C ATOM 2935 C GLY A 896 15.067 6.153 15.343 1.00 22.98 C ATOM 2936 O GLY A 896 16.080 6.274 16.022 1.00 23.39 O ATOM 2937 H GLY A 896 12.174 4.828 14.765 1.00 0.00 H ATOM 2938 N MET A 897 15.025 6.453 14.045 1.00 23.76 N ATOM 2939 CA MET A 897 16.168 7.038 13.318 1.00 23.95 C ATOM 2940 C MET A 897 16.087 8.598 13.302 1.00 25.09 C ATOM 2941 O MET A 897 16.755 9.261 12.497 1.00 23.35 O ATOM 2942 CB MET A 897 16.235 6.453 11.896 1.00 23.20 C ATOM 2943 CG MET A 897 16.926 5.079 11.830 1.00 23.93 C ATOM 2944 SD MET A 897 16.803 4.371 10.162 1.00 24.72 S ATOM 2945 CE MET A 897 17.751 5.581 9.216 1.00 24.04 C ATOM 2946 H MET A 897 14.146 6.266 13.521 1.00 0.00 H ATOM 2947 N GLN A 898 15.295 9.184 14.197 1.00 24.29 N ATOM 2948 CA GLN A 898 15.170 10.665 14.260 1.00 23.98 C ATOM 2949 C GLN A 898 16.522 11.341 14.353 1.00 22.99 C ATOM 2950 O GLN A 898 16.704 12.428 13.757 1.00 24.26 O ATOM 2951 CB GLN A 898 14.255 11.096 15.422 1.00 26.53 C ATOM 2952 CG GLN A 898 14.069 12.627 15.555 1.00 25.92 C ATOM 2953 CD GLN A 898 13.433 13.308 14.359 1.00 28.75 C ATOM 2954 OE1 GLN A 898 12.488 12.813 13.756 1.00 29.14 O ATOM 2955 NE2 GLN A 898 13.909 14.509 14.053 1.00 29.20 N ATOM 2956 HE22 GLN A 898 14.713 14.901 14.584 1.00 0.00 H ATOM 2957 HE21 GLN A 898 13.478 15.058 13.282 1.00 0.00 H ATOM 2958 H GLN A 898 14.754 8.597 14.864 1.00 0.00 H ATOM 2959 N TRP A 899 17.486 10.733 15.036 1.00 22.05 N ATOM 2960 CA TRP A 899 18.799 11.394 15.182 1.00 23.88 C ATOM 2961 C TRP A 899 19.473 11.733 13.851 1.00 25.16 C ATOM 2962 O TRP A 899 20.321 12.642 13.800 1.00 22.99 O ATOM 2963 CB TRP A 899 19.800 10.595 16.018 1.00 24.27 C ATOM 2964 CG TRP A 899 20.667 9.585 15.253 1.00 23.49 C ATOM 2965 CD1 TRP A 899 21.836 9.829 14.585 1.00 25.68 C ATOM 2966 CD2 TRP A 899 20.449 8.167 15.143 1.00 22.86 C ATOM 2967 NE1 TRP A 899 22.349 8.662 14.038 1.00 24.73 N ATOM 2968 CE2 TRP A 899 21.519 7.630 14.365 1.00 23.10 C ATOM 2969 CE3 TRP A 899 19.465 7.304 15.614 1.00 24.51 C ATOM 2970 CZ2 TRP A 899 21.612 6.283 14.056 1.00 24.10 C ATOM 2971 CZ3 TRP A 899 19.562 5.944 15.304 1.00 24.75 C ATOM 2972 CH2 TRP A 899 20.620 5.456 14.518 1.00 23.30 C ATOM 2973 HE1 TRP A 899 23.219 8.587 13.474 1.00 0.00 H ATOM 2974 H TRP A 899 17.318 9.800 15.464 1.00 0.00 H ATOM 2975 N THR A 900 19.175 10.975 12.796 1.00 21.23 N ATOM 2976 CA THR A 900 19.784 11.267 11.489 1.00 21.56 C ATOM 2977 C THR A 900 19.331 12.639 10.977 1.00 21.31 C ATOM 2978 O THR A 900 20.129 13.419 10.439 1.00 23.17 O ATOM 2979 CB THR A 900 19.460 10.173 10.446 1.00 21.37 C ATOM 2980 OG1 THR A 900 18.051 10.082 10.292 1.00 19.94 O ATOM 2981 CG2 THR A 900 20.047 8.833 10.891 1.00 22.78 C ATOM 2982 HG1 THR A 900 17.640 9.847 11.161 1.00 0.00 H ATOM 2983 H THR A 900 18.513 10.179 12.896 1.00 0.00 H ATOM 2984 N VAL A 901 18.038 12.915 11.113 1.00 22.01 N ATOM 2985 CA VAL A 901 17.432 14.161 10.664 1.00 23.37 C ATOM 2986 C VAL A 901 18.046 15.305 11.478 1.00 24.38 C ATOM 2987 O VAL A 901 18.363 16.344 10.928 1.00 26.98 O ATOM 2988 CB VAL A 901 15.933 14.140 10.893 1.00 24.23 C ATOM 2989 CG1 VAL A 901 15.309 15.531 10.733 1.00 27.68 C ATOM 2990 CG2 VAL A 901 15.274 13.139 9.947 1.00 25.27 C ATOM 2991 H VAL A 901 17.427 12.204 11.564 1.00 0.00 H ATOM 2992 N ASP A 902 18.246 15.074 12.773 1.00 23.85 N ATOM 2993 CA ASP A 902 18.773 16.105 13.706 1.00 24.36 C ATOM 2994 C ASP A 902 20.208 16.440 13.331 1.00 24.72 C ATOM 2995 O ASP A 902 20.582 17.628 13.301 1.00 23.28 O ATOM 2996 CB ASP A 902 18.766 15.609 15.153 1.00 25.97 C ATOM 2997 CG ASP A 902 17.386 15.334 15.701 1.00 28.15 C ATOM 2998 OD1 ASP A 902 16.388 15.865 15.187 1.00 34.04 O ATOM 2999 OD2 ASP A 902 17.307 14.553 16.672 1.00 33.33 O ATOM 3000 H ASP A 902 18.024 14.130 13.149 1.00 0.00 H ATOM 3001 N ARG A 903 21.018 15.405 13.053 1.00 21.99 N ATOM 3002 CA ARG A 903 22.407 15.615 12.698 1.00 23.30 C ATOM 3003 C ARG A 903 22.574 16.266 11.321 1.00 23.01 C ATOM 3004 O ARG A 903 23.460 17.102 11.147 1.00 21.29 O ATOM 3005 CB ARG A 903 23.208 14.330 12.770 1.00 26.66 C ATOM 3006 CG ARG A 903 24.654 14.506 12.357 1.00 31.47 C ATOM 3007 CD ARG A 903 25.514 15.258 13.360 1.00 36.60 C ATOM 3008 NE ARG A 903 25.721 14.468 14.574 1.00 42.25 N ATOM 3009 CZ ARG A 903 26.379 14.885 15.670 1.00 47.04 C ATOM 3010 NH1 ARG A 903 26.933 16.102 15.743 1.00 42.91 N ATOM 3011 NH2 ARG A 903 26.489 14.063 16.710 1.00 49.26 N ATOM 3012 HE ARG A 903 25.327 13.506 14.591 1.00 0.00 H ATOM 3013 HH12 ARG A 903 27.435 16.394 16.606 1.00 0.00 H ATOM 3014 HH11 ARG A 903 26.861 16.755 14.937 1.00 0.00 H ATOM 3015 HH22 ARG A 903 26.995 14.371 17.565 1.00 0.00 H ATOM 3016 HH21 ARG A 903 26.069 13.112 16.668 1.00 0.00 H ATOM 3017 H ARG A 903 20.642 14.436 13.093 1.00 0.00 H ATOM 3018 N ILE A 904 21.731 15.897 10.353 1.00 21.72 N ATOM 3019 CA ILE A 904 21.741 16.588 9.069 1.00 22.65 C ATOM 3020 C ILE A 904 21.493 18.078 9.277 1.00 22.71 C ATOM 3021 O ILE A 904 22.133 18.935 8.639 1.00 22.83 O ATOM 3022 CB ILE A 904 20.744 15.987 8.067 1.00 21.66 C ATOM 3023 CG1 ILE A 904 21.216 14.593 7.633 1.00 23.39 C ATOM 3024 CG2 ILE A 904 20.617 16.828 6.798 1.00 21.44 C ATOM 3025 CD1 ILE A 904 20.110 13.789 6.952 1.00 24.27 C ATOM 3026 H ILE A 904 21.065 15.115 10.516 1.00 0.00 H ATOM 3027 N LYS A 905 20.531 18.388 10.130 1.00 23.22 N ATOM 3028 CA LYS A 905 20.189 19.792 10.377 1.00 24.66 C ATOM 3029 C LYS A 905 21.373 20.537 10.997 1.00 23.76 C ATOM 3030 O LYS A 905 21.660 21.678 10.590 1.00 23.42 O ATOM 3031 CB LYS A 905 18.928 19.890 11.241 1.00 26.36 C ATOM 3032 CG LYS A 905 18.637 21.289 11.737 1.00 32.28 C ATOM 3033 CD LYS A 905 17.407 21.345 12.611 1.00 37.47 C ATOM 3034 CE LYS A 905 17.172 22.798 13.019 1.00 45.40 C ATOM 3035 NZ LYS A 905 16.065 22.920 14.010 1.00 52.75 N ATOM 3036 HZ1 LYS A 905 15.187 22.550 13.594 1.00 0.00 H ATOM 3037 HZ2 LYS A 905 16.303 22.374 14.863 1.00 0.00 H ATOM 3038 HZ3 LYS A 905 15.936 23.921 14.262 1.00 0.00 H ATOM 3039 H LYS A 905 20.016 17.634 10.627 1.00 0.00 H ATOM 3040 N SER A 906 22.036 19.889 11.950 1.00 24.59 N ATOM 3041 CA SER A 906 23.238 20.437 12.634 1.00 26.02 C ATOM 3042 C SER A 906 24.404 20.611 11.664 1.00 26.17 C ATOM 3043 O SER A 906 25.067 21.671 11.618 1.00 21.85 O ATOM 3044 CB SER A 906 23.614 19.536 13.820 1.00 27.56 C ATOM 3045 OG SER A 906 24.828 19.949 14.347 1.00 36.04 O ATOM 3046 HG SER A 906 25.528 19.887 13.649 1.00 0.00 H ATOM 3047 H SER A 906 21.696 18.948 12.233 1.00 0.00 H ATOM 3048 N ASN A 907 24.645 19.603 10.817 1.00 22.28 N ATOM 3049 CA ASN A 907 25.668 19.749 9.783 1.00 22.79 C ATOM 3050 C ASN A 907 25.384 20.829 8.776 1.00 22.30 C ATOM 3051 O ASN A 907 26.322 21.565 8.391 1.00 22.52 O ATOM 3052 CB ASN A 907 25.922 18.407 9.063 1.00 24.25 C ATOM 3053 CG ASN A 907 26.661 17.427 9.912 1.00 26.76 C ATOM 3054 OD1 ASN A 907 27.409 17.801 10.828 1.00 25.95 O ATOM 3055 ND2 ASN A 907 26.459 16.135 9.633 1.00 24.49 N ATOM 3056 HD22 ASN A 907 25.823 15.864 8.856 1.00 0.00 H ATOM 3057 HD21 ASN A 907 26.938 15.401 10.193 1.00 0.00 H ATOM 3058 H ASN A 907 24.105 18.717 10.894 1.00 0.00 H ATOM 3059 N ARG A 908 24.121 20.969 8.337 1.00 20.83 N ATOM 3060 CA ARG A 908 23.770 22.036 7.421 1.00 21.89 C ATOM 3061 C ARG A 908 24.098 23.424 8.076 1.00 23.86 C ATOM 3062 O ARG A 908 24.679 24.310 7.438 1.00 22.67 O ATOM 3063 CB ARG A 908 22.296 21.988 7.042 1.00 22.10 C ATOM 3064 CG ARG A 908 21.917 22.837 5.845 1.00 22.08 C ATOM 3065 CD ARG A 908 20.446 23.094 5.737 1.00 22.96 C ATOM 3066 NE ARG A 908 20.145 23.776 4.485 1.00 24.91 N ATOM 3067 CZ ARG A 908 20.382 25.075 4.233 1.00 26.83 C ATOM 3068 NH1 ARG A 908 20.851 25.892 5.176 1.00 26.55 N ATOM 3069 NH2 ARG A 908 20.106 25.568 3.018 1.00 26.12 N ATOM 3070 HE ARG A 908 19.712 23.213 3.725 1.00 0.00 H ATOM 3071 HH12 ARG A 908 21.026 26.893 4.956 1.00 0.00 H ATOM 3072 HH11 ARG A 908 21.042 25.528 6.131 1.00 0.00 H ATOM 3073 HH22 ARG A 908 20.285 26.571 2.811 1.00 0.00 H ATOM 3074 HH21 ARG A 908 19.713 24.947 2.282 1.00 0.00 H ATOM 3075 H ARG A 908 23.388 20.305 8.658 1.00 0.00 H ATOM 3076 N ALA A 909 23.715 23.587 9.333 1.00 22.80 N ATOM 3077 CA ALA A 909 23.981 24.852 10.062 1.00 24.43 C ATOM 3078 C ALA A 909 25.477 25.102 10.188 1.00 24.07 C ATOM 3079 O ALA A 909 25.918 26.250 10.053 1.00 24.88 O ATOM 3080 CB ALA A 909 23.319 24.857 11.437 1.00 24.73 C ATOM 3081 H ALA A 909 23.218 22.813 9.819 1.00 0.00 H ATOM 3082 N GLN A 910 26.274 24.054 10.372 1.00 22.57 N ATOM 3083 CA GLN A 910 27.718 24.227 10.470 1.00 23.99 C ATOM 3084 C GLN A 910 28.331 24.638 9.113 1.00 25.81 C ATOM 3085 O GLN A 910 29.204 25.543 9.054 1.00 22.62 O ATOM 3086 CB GLN A 910 28.360 22.991 11.011 1.00 27.51 C ATOM 3087 CG GLN A 910 29.831 23.095 11.310 1.00 31.46 C ATOM 3088 CD GLN A 910 30.143 23.892 12.596 1.00 46.93 C ATOM 3089 OE1 GLN A 910 29.255 24.464 13.252 1.00 49.64 O ATOM 3090 NE2 GLN A 910 31.421 23.905 12.969 1.00 51.88 N ATOM 3091 HE22 GLN A 910 32.136 23.415 12.394 1.00 0.00 H ATOM 3092 HE21 GLN A 910 31.705 24.405 13.835 1.00 0.00 H ATOM 3093 H GLN A 910 25.863 23.101 10.447 1.00 0.00 H ATOM 3094 N TRP A 911 27.854 24.037 8.018 1.00 21.47 N ATOM 3095 CA TRP A 911 28.334 24.461 6.678 1.00 22.62 C ATOM 3096 C TRP A 911 27.927 25.906 6.396 1.00 20.42 C ATOM 3097 O TRP A 911 28.681 26.657 5.756 1.00 21.14 O ATOM 3098 CB TRP A 911 27.828 23.525 5.566 1.00 22.01 C ATOM 3099 CG TRP A 911 28.540 22.201 5.494 1.00 22.54 C ATOM 3100 CD1 TRP A 911 27.974 20.955 5.656 1.00 23.06 C ATOM 3101 CD2 TRP A 911 29.937 21.963 5.250 1.00 23.67 C ATOM 3102 NE1 TRP A 911 28.932 19.980 5.532 1.00 23.48 N ATOM 3103 CE2 TRP A 911 30.139 20.558 5.285 1.00 25.10 C ATOM 3104 CE3 TRP A 911 31.040 22.793 5.008 1.00 26.73 C ATOM 3105 CZ2 TRP A 911 31.385 19.979 5.087 1.00 27.74 C ATOM 3106 CZ3 TRP A 911 32.257 22.212 4.781 1.00 27.21 C ATOM 3107 CH2 TRP A 911 32.427 20.826 4.829 1.00 27.11 C ATOM 3108 HE1 TRP A 911 28.762 18.957 5.614 1.00 0.00 H ATOM 3109 H TRP A 911 27.150 23.276 8.104 1.00 0.00 H ATOM 3110 N GLU A 912 26.739 26.312 6.857 1.00 20.51 N ATOM 3111 CA GLU A 912 26.311 27.692 6.718 1.00 22.63 C ATOM 3112 C GLU A 912 27.238 28.675 7.492 1.00 23.54 C ATOM 3113 O GLU A 912 27.468 29.780 7.000 1.00 24.89 O ATOM 3114 CB GLU A 912 24.849 27.905 7.109 1.00 24.98 C ATOM 3115 CG GLU A 912 23.851 27.334 6.123 1.00 27.26 C ATOM 3116 CD GLU A 912 23.653 28.136 4.822 1.00 33.03 C ATOM 3117 OE1 GLU A 912 24.427 29.060 4.510 1.00 34.06 O ATOM 3118 OE2 GLU A 912 22.693 27.829 4.078 1.00 35.11 O ATOM 3119 H GLU A 912 26.111 25.627 7.323 1.00 0.00 H ATOM 3120 N ARG A 913 27.745 28.258 8.652 1.00 23.47 N ATOM 3121 CA ARG A 913 28.782 29.018 9.409 1.00 23.94 C ATOM 3122 C ARG A 913 30.109 29.115 8.691 1.00 23.07 C ATOM 3123 O ARG A 913 30.776 30.172 8.708 1.00 22.70 O ATOM 3124 CB ARG A 913 28.988 28.463 10.819 1.00 25.20 C ATOM 3125 CG ARG A 913 27.817 28.674 11.722 1.00 30.95 C ATOM 3126 CD ARG A 913 28.112 28.174 13.130 1.00 37.91 C ATOM 3127 NE ARG A 913 26.850 27.920 13.796 1.00 47.10 N ATOM 3128 CZ ARG A 913 26.438 26.751 14.277 1.00 50.31 C ATOM 3129 NH1 ARG A 913 27.203 25.661 14.229 1.00 50.16 N ATOM 3130 NH2 ARG A 913 25.243 26.693 14.871 1.00 55.07 N ATOM 3131 HE ARG A 913 26.206 28.729 13.908 1.00 0.00 H ATOM 3132 HH12 ARG A 913 26.851 24.761 14.614 1.00 0.00 H ATOM 3133 HH11 ARG A 913 28.152 25.710 13.806 1.00 0.00 H ATOM 3134 HH22 ARG A 913 24.897 25.791 15.256 1.00 0.00 H ATOM 3135 HH21 ARG A 913 24.659 27.550 14.949 1.00 0.00 H ATOM 3136 H ARG A 913 27.401 27.360 9.048 1.00 0.00 H ATOM 3137 N VAL A 914 30.502 28.056 8.003 1.00 22.45 N ATOM 3138 CA VAL A 914 31.652 28.116 7.079 1.00 23.67 C ATOM 3139 C VAL A 914 31.464 29.175 6.000 1.00 24.26 C ATOM 3140 O VAL A 914 32.358 29.967 5.760 1.00 24.71 O ATOM 3141 CB VAL A 914 31.936 26.731 6.454 1.00 26.21 C ATOM 3142 CG1 VAL A 914 32.976 26.797 5.343 1.00 26.97 C ATOM 3143 CG2 VAL A 914 32.338 25.733 7.530 1.00 27.99 C ATOM 3144 H VAL A 914 29.988 27.159 8.116 1.00 0.00 H ATOM 3145 N LEU A 915 30.292 29.230 5.373 1.00 22.54 N ATOM 3146 CA LEU A 915 30.022 30.263 4.417 1.00 24.45 C ATOM 3147 C LEU A 915 29.949 31.647 5.083 1.00 22.84 C ATOM 3148 O LEU A 915 30.536 32.582 4.569 1.00 22.77 O ATOM 3149 CB LEU A 915 28.724 30.001 3.654 1.00 25.63 C ATOM 3150 CG LEU A 915 28.757 28.718 2.808 1.00 26.72 C ATOM 3151 CD1 LEU A 915 27.360 28.525 2.274 1.00 29.01 C ATOM 3152 CD2 LEU A 915 29.786 28.849 1.709 1.00 29.46 C ATOM 3153 H LEU A 915 29.564 28.516 5.579 1.00 0.00 H ATOM 3154 N GLU A 916 29.299 31.749 6.236 1.00 21.71 N ATOM 3155 CA GLU A 916 29.100 33.056 6.880 1.00 22.79 C ATOM 3156 C GLU A 916 30.436 33.714 7.212 1.00 24.46 C ATOM 3157 O GLU A 916 30.532 34.957 7.172 1.00 24.47 O ATOM 3158 CB GLU A 916 28.259 32.887 8.155 1.00 24.49 C ATOM 3159 CG GLU A 916 27.776 34.171 8.772 1.00 26.89 C ATOM 3160 CD GLU A 916 26.957 33.947 10.029 1.00 31.01 C ATOM 3161 OE1 GLU A 916 26.473 32.826 10.318 1.00 29.88 O ATOM 3162 OE2 GLU A 916 26.784 34.930 10.769 1.00 32.65 O ATOM 3163 H GLU A 916 28.925 30.892 6.691 1.00 0.00 H ATOM 3164 N THR A 917 31.441 32.912 7.568 1.00 23.50 N ATOM 3165 CA THR A 917 32.740 33.420 8.022 1.00 26.74 C ATOM 3166 C THR A 917 33.796 33.492 6.933 1.00 29.24 C ATOM 3167 O THR A 917 34.901 33.963 7.186 1.00 28.38 O ATOM 3168 CB THR A 917 33.306 32.557 9.170 1.00 27.49 C ATOM 3169 OG1 THR A 917 33.321 31.176 8.783 1.00 27.10 O ATOM 3170 CG2 THR A 917 32.426 32.684 10.390 1.00 30.00 C ATOM 3171 HG1 THR A 917 32.398 30.882 8.578 1.00 0.00 H ATOM 3172 H THR A 917 31.297 31.883 7.522 1.00 0.00 H ATOM 3173 N ARG A 918 33.477 33.043 5.724 1.00 29.30 N ATOM 3174 CA ARG A 918 34.481 33.085 4.655 1.00 32.71 C ATOM 3175 C ARG A 918 34.740 34.544 4.211 1.00 38.60 C ATOM 3176 O ARG A 918 35.876 34.895 3.863 1.00 34.71 O ATOM 3177 CB ARG A 918 34.041 32.261 3.447 1.00 31.82 C ATOM 3178 CG ARG A 918 35.198 31.909 2.535 1.00 34.21 C ATOM 3179 CD ARG A 918 34.758 31.038 1.366 1.00 33.24 C ATOM 3180 NE ARG A 918 34.197 31.780 0.252 1.00 30.21 N ATOM 3181 CZ ARG A 918 34.919 32.379 -0.712 1.00 30.21 C ATOM 3182 NH1 ARG A 918 36.250 32.404 -0.693 1.00 28.84 N ATOM 3183 NH2 ARG A 918 34.293 32.990 -1.696 1.00 29.88 N ATOM 3184 OXT ARG A 918 33.810 35.407 4.202 1.00 33.54 O ATOM 3185 HE ARG A 918 33.161 31.854 0.195 1.00 0.00 H ATOM 3186 HH12 ARG A 918 36.772 32.878 -1.458 1.00 0.00 H ATOM 3187 HH11 ARG A 918 36.768 31.950 0.086 1.00 0.00 H ATOM 3188 HH22 ARG A 918 34.838 33.457 -2.448 1.00 0.00 H ATOM 3189 HH21 ARG A 918 33.253 33.005 -1.721 1.00 0.00 H ATOM 3190 H ARG A 918 32.526 32.666 5.537 1.00 0.00 H TER 3191 ARG A 918 HETATM 3192 ZN ZN A 1 28.225 2.444 -1.678 1.00 23.76 ZN HETATM 3193 MG MG A 2 27.465 1.637 -5.339 1.00 11.80 MG HETATM 3194 O HOH 3 43.723 -21.532 -2.539 1.00 61.27 O HETATM 3195 O HOH 4 44.456 -15.966 0.239 1.00 49.97 O HETATM 3196 O HOH 5 38.285 -19.001 2.048 1.00 40.52 O HETATM 3197 O HOH 6 44.275 -21.611 3.414 1.00 61.55 O HETATM 3198 O HOH 7 42.547 -22.097 5.864 1.00 53.72 O HETATM 3199 O HOH 8 46.623 -21.355 5.975 1.00 54.11 O HETATM 3200 O HOH 9 49.360 -12.893 10.601 1.00 42.58 O HETATM 3201 O HOH 10 44.947 -9.930 7.067 1.00 39.03 O HETATM 3202 O HOH 11 41.795 -18.660 12.293 1.00 59.13 O HETATM 3203 O HOH 12 47.374 -6.780 11.668 1.00 42.29 O HETATM 3204 O HOH 13 43.081 -2.598 17.062 1.00 45.11 O HETATM 3205 O HOH 14 37.320 -2.258 21.814 1.00 49.79 O HETATM 3206 O HOH 15 33.664 -2.108 20.011 1.00 35.44 O HETATM 3207 O HOH 16 31.326 -2.429 21.321 1.00 50.52 O HETATM 3208 O HOH 17 30.090 3.970 23.327 1.00 57.68 O HETATM 3209 O HOH 18 24.504 -0.165 16.992 1.00 23.90 O HETATM 3210 O HOH 19 25.028 5.421 19.945 1.00 34.89 O HETATM 3211 O HOH 20 25.939 9.878 13.802 1.00 32.24 O HETATM 3212 O HOH 21 28.150 5.582 12.492 1.00 26.36 O HETATM 3213 O HOH 22 29.688 7.951 13.246 1.00 35.98 O HETATM 3214 O HOH 23 32.681 6.309 11.368 1.00 27.91 O HETATM 3215 O HOH 24 38.735 11.420 12.361 1.00 41.44 O HETATM 3216 O HOH 25 36.215 13.384 13.448 1.00 40.56 O HETATM 3217 O HOH 26 36.832 6.171 7.274 1.00 30.10 O HETATM 3218 O HOH 27 43.947 7.468 15.783 1.00 44.52 O HETATM 3219 O HOH 28 43.344 6.810 18.355 1.00 61.51 O HETATM 3220 O HOH 29 44.520 1.370 11.806 1.00 39.31 O HETATM 3221 O HOH 30 45.177 5.431 7.994 1.00 65.44 O HETATM 3222 O HOH 31 43.506 4.248 5.966 1.00 27.57 O HETATM 3223 O HOH 32 38.285 7.134 2.693 1.00 34.21 O HETATM 3224 O HOH 33 46.794 4.986 18.434 1.00 61.78 O HETATM 3225 O HOH 34 50.749 0.724 14.732 1.00 61.23 O HETATM 3226 O HOH 35 49.885 2.413 7.288 1.00 56.10 O HETATM 3227 O HOH 36 48.279 -7.629 7.501 1.00 38.33 O HETATM 3228 O HOH 37 37.017 -14.754 17.052 1.00 42.33 O HETATM 3229 O HOH 38 32.045 -9.020 19.084 1.00 52.42 O HETATM 3230 O HOH 39 26.900 -7.376 21.595 1.00 56.15 O HETATM 3231 O HOH 40 25.242 -5.652 19.828 1.00 70.61 O HETATM 3232 O HOH 41 20.705 -11.931 17.215 1.00 40.17 O HETATM 3233 O HOH 42 23.930 -15.451 19.153 1.00 39.08 O HETATM 3234 O HOH 43 26.076 -22.327 14.547 1.00 52.16 O HETATM 3235 O HOH 44 29.784 -17.501 14.445 1.00 39.81 O HETATM 3236 O HOH 45 26.317 -14.856 20.265 1.00 43.26 O HETATM 3237 O HOH 46 18.468 -17.260 19.883 1.00 45.79 O HETATM 3238 O HOH 47 25.171 -19.864 7.177 1.00 28.51 O HETATM 3239 O HOH 48 27.996 -20.465 6.735 1.00 38.17 O HETATM 3240 O HOH 49 34.068 -23.461 9.750 1.00 42.88 O HETATM 3241 O HOH 50 32.582 -20.786 15.347 1.00 39.47 O HETATM 3242 O HOH 51 35.262 -20.964 13.387 1.00 31.43 O HETATM 3243 O HOH 52 30.935 -17.076 17.901 1.00 53.98 O HETATM 3244 O HOH 53 36.425 -23.054 12.620 1.00 67.79 O HETATM 3245 O HOH 54 38.109 -12.474 -3.106 1.00 30.90 O HETATM 3246 O HOH 55 36.740 -18.834 0.213 1.00 46.16 O HETATM 3247 O HOH 56 41.056 -3.456 0.051 1.00 39.15 O HETATM 3248 O HOH 57 43.125 -7.570 1.017 1.00 41.06 O HETATM 3249 O HOH 58 41.181 -9.601 -6.153 1.00 60.58 O HETATM 3250 O HOH 59 41.268 -5.685 -6.129 1.00 50.65 O HETATM 3251 O HOH 60 41.599 -14.253 -4.560 1.00 61.00 O HETATM 3252 O HOH 61 39.243 -6.091 -7.560 1.00 53.97 O HETATM 3253 O HOH 62 39.729 -12.042 -5.179 1.00 50.87 O HETATM 3254 O HOH 63 36.799 -0.725 -4.964 1.00 23.65 O HETATM 3255 O HOH 64 40.287 -0.755 -0.508 1.00 28.73 O HETATM 3256 O HOH 65 37.994 -6.651 -12.407 1.00 56.44 O HETATM 3257 O HOH 66 43.665 -0.729 -6.676 1.00 41.53 O HETATM 3258 O HOH 67 40.575 9.041 0.390 1.00 40.53 O HETATM 3259 O HOH 68 36.403 5.467 1.734 1.00 32.36 O HETATM 3260 O HOH 69 31.237 6.003 3.441 1.00 21.00 O HETATM 3261 O HOH 70 27.936 6.668 -1.004 1.00 30.03 O HETATM 3262 O HOH 71 28.356 3.518 -5.583 1.00 25.56 O HETATM 3263 O HOH 72 28.410 4.506 -2.617 1.00 27.11 O HETATM 3264 O HOH 73 44.292 1.372 3.172 1.00 52.38 O HETATM 3265 O HOH 74 31.530 3.977 10.527 1.00 22.30 O HETATM 3266 O HOH 75 31.215 7.374 9.132 1.00 21.59 O HETATM 3267 O HOH 76 28.600 7.311 6.782 1.00 24.86 O HETATM 3268 O HOH 77 23.342 -6.100 17.768 1.00 41.21 O HETATM 3269 O HOH 78 25.427 5.921 12.480 1.00 23.34 O HETATM 3270 O HOH 79 17.805 0.471 21.143 1.00 51.54 O HETATM 3271 O HOH 80 17.813 -8.810 14.653 1.00 32.73 O HETATM 3272 O HOH 81 15.694 5.334 18.840 1.00 50.84 O HETATM 3273 O HOH 82 23.796 -1.388 19.407 1.00 29.45 O HETATM 3274 O HOH 83 13.800 -2.219 20.718 1.00 33.20 O HETATM 3275 O HOH 84 8.201 -1.558 15.351 1.00 41.10 O HETATM 3276 O HOH 85 8.608 -5.059 18.241 1.00 42.64 O HETATM 3277 O HOH 86 8.039 -2.112 19.903 1.00 66.05 O HETATM 3278 O HOH 87 7.662 -5.299 9.528 1.00 38.21 O HETATM 3279 O HOH 88 7.907 2.783 14.180 1.00 61.37 O HETATM 3280 O HOH 89 13.242 -13.760 6.703 1.00 27.17 O HETATM 3281 O HOH 90 13.034 -9.699 2.442 1.00 24.93 O HETATM 3282 O HOH 91 26.407 -0.189 -5.245 1.00 22.11 O HETATM 3283 O HOH 92 26.944 2.356 -3.413 1.00 24.62 O HETATM 3284 O HOH 93 28.079 1.215 -7.266 1.00 22.00 O HETATM 3285 O HOH 94 34.011 1.985 -11.354 1.00 26.90 O HETATM 3286 O HOH 95 28.868 4.716 -8.125 1.00 26.02 O HETATM 3287 O HOH 96 32.438 7.297 -8.259 1.00 36.33 O HETATM 3288 O HOH 97 37.872 8.345 -9.836 1.00 30.39 O HETATM 3289 O HOH 98 33.481 9.159 -9.886 1.00 32.42 O HETATM 3290 O HOH 99 26.000 7.506 -13.298 1.00 37.51 O HETATM 3291 O HOH 100 28.236 9.507 -9.192 1.00 41.44 O HETATM 3292 O HOH 101 27.000 5.208 -10.778 1.00 39.13 O HETATM 3293 O HOH 102 26.853 2.755 -9.613 1.00 51.26 O HETATM 3294 O HOH 103 23.157 4.934 -12.887 1.00 43.69 O HETATM 3295 O HOH 104 25.491 8.825 -19.653 1.00 51.14 O HETATM 3296 O HOH 105 34.419 0.987 -27.529 1.00 49.98 O HETATM 3297 O HOH 106 32.110 4.605 -31.333 1.00 45.04 O HETATM 3298 O HOH 107 28.119 3.715 -31.244 1.00 56.83 O HETATM 3299 O HOH 108 34.841 -1.849 -19.526 1.00 34.92 O HETATM 3300 O HOH 109 27.713 -4.956 -15.584 1.00 37.13 O HETATM 3301 O HOH 110 19.154 -7.129 -18.093 1.00 53.55 O HETATM 3302 O HOH 111 24.224 -7.371 -17.962 1.00 43.45 O HETATM 3303 O HOH 112 18.047 -0.417 -17.558 1.00 60.46 O HETATM 3304 O HOH 113 18.609 -0.519 -14.048 1.00 48.47 O HETATM 3305 O HOH 114 20.171 2.791 -14.252 1.00 49.19 O HETATM 3306 O HOH 115 25.729 2.406 -6.181 1.00 22.65 O HETATM 3307 O HOH 116 30.330 -8.107 -14.462 1.00 43.62 O HETATM 3308 O HOH 117 28.964 -14.443 -11.269 1.00 38.62 O HETATM 3309 O HOH 118 26.575 -13.272 -15.290 1.00 46.79 O HETATM 3310 O HOH 119 25.074 -10.654 -15.014 1.00 35.55 O HETATM 3311 O HOH 120 26.958 -18.487 -5.311 1.00 29.44 O HETATM 3312 O HOH 121 30.528 -23.324 5.088 1.00 31.04 O HETATM 3313 O HOH 122 35.835 -23.698 7.659 1.00 58.02 O HETATM 3314 O HOH 123 32.510 -24.957 5.859 1.00 48.58 O HETATM 3315 O HOH 124 19.026 -24.758 7.687 1.00 50.85 O HETATM 3316 O HOH 125 17.554 -22.952 6.093 1.00 26.86 O HETATM 3317 O HOH 126 12.280 -24.243 2.200 1.00 38.64 O HETATM 3318 O HOH 127 12.381 -17.554 -0.451 1.00 31.19 O HETATM 3319 O HOH 128 13.327 -21.315 -2.836 1.00 44.16 O HETATM 3320 O HOH 129 14.491 -15.136 -6.513 1.00 38.13 O HETATM 3321 O HOH 130 12.007 -9.193 -5.056 1.00 46.88 O HETATM 3322 O HOH 131 15.977 -3.878 -6.338 1.00 31.85 O HETATM 3323 O HOH 132 15.467 -6.574 -8.063 1.00 47.01 O HETATM 3324 O HOH 133 18.583 4.268 -5.455 1.00 25.28 O HETATM 3325 O HOH 134 22.740 4.124 -2.912 1.00 27.45 O HETATM 3326 O HOH 135 24.796 5.493 -7.539 1.00 33.08 O HETATM 3327 O HOH 136 20.948 5.672 -1.544 1.00 24.94 O HETATM 3328 O HOH 137 13.992 7.144 -9.801 1.00 38.18 O HETATM 3329 O HOH 138 15.802 9.423 -8.944 1.00 41.63 O HETATM 3330 O HOH 139 15.632 12.339 -1.491 1.00 23.82 O HETATM 3331 O HOH 140 10.577 10.121 -4.524 1.00 46.47 O HETATM 3332 O HOH 141 8.022 3.706 -7.243 1.00 38.77 O HETATM 3333 O HOH 142 13.487 4.782 -11.598 1.00 52.92 O HETATM 3334 O HOH 143 11.712 0.347 -2.305 1.00 38.10 O HETATM 3335 O HOH 144 5.116 7.440 -2.270 1.00 45.44 O HETATM 3336 O HOH 145 50.718 -11.494 8.806 1.00 52.69 O HETATM 3337 O HOH 146 4.960 0.415 -2.956 1.00 27.45 O HETATM 3338 O HOH 147 47.367 -9.694 5.755 1.00 46.87 O HETATM 3339 O HOH 148 50.031 -7.539 11.867 1.00 61.56 O HETATM 3340 O HOH 149 4.532 6.770 3.980 1.00 33.09 O HETATM 3341 O HOH 150 0.000 4.104 0.000 1.00 28.22 O HETATM 3342 O HOH 151 3.473 5.857 6.815 1.00 33.97 O HETATM 3343 O HOH 152 31.085 -4.567 20.083 1.00 47.62 O HETATM 3344 O HOH 153 -3.864 1.833 5.199 1.00 29.69 O HETATM 3345 O HOH 154 -3.760 4.485 5.486 1.00 62.08 O HETATM 3346 O HOH 155 -1.412 6.056 5.695 1.00 57.44 O HETATM 3347 O HOH 156 41.400 10.949 11.713 1.00 65.49 O HETATM 3348 O HOH 157 -5.790 -1.520 4.748 1.00 32.73 O HETATM 3349 O HOH 158 -5.693 -6.359 4.945 1.00 50.84 O HETATM 3350 O HOH 159 -1.432 -7.713 3.933 1.00 58.50 O HETATM 3351 O HOH 160 44.683 4.287 4.639 1.00 49.52 O HETATM 3352 O HOH 161 39.779 9.433 3.024 1.00 43.36 O HETATM 3353 O HOH 162 3.761 -11.573 2.241 1.00 34.07 O HETATM 3354 O HOH 163 6.050 -8.511 9.425 1.00 50.93 O HETATM 3355 O HOH 164 10.642 -10.374 1.694 1.00 24.81 O HETATM 3356 O HOH 165 5.470 -6.251 7.670 1.00 54.22 O HETATM 3357 O HOH 166 12.219 -13.120 -2.007 1.00 42.69 O HETATM 3358 O HOH 167 29.734 -20.095 15.396 1.00 56.12 O HETATM 3359 O HOH 168 42.407 0.738 0.414 1.00 46.57 O HETATM 3360 O HOH 169 41.407 11.200 -0.864 1.00 57.84 O HETATM 3361 O HOH 170 27.034 9.081 2.070 1.00 28.17 O HETATM 3362 O HOH 171 25.754 11.604 2.562 1.00 34.91 O HETATM 3363 O HOH 172 29.434 13.988 4.206 1.00 38.41 O HETATM 3364 O HOH 173 24.241 8.362 11.855 1.00 25.37 O HETATM 3365 O HOH 174 6.263 -3.708 11.001 1.00 55.71 O HETATM 3366 O HOH 175 32.915 16.565 14.293 1.00 35.29 O HETATM 3367 O HOH 176 30.432 17.590 15.244 1.00 51.13 O HETATM 3368 O HOH 177 36.366 19.194 9.992 1.00 40.00 O HETATM 3369 O HOH 178 28.489 17.280 5.265 1.00 36.08 O HETATM 3370 O HOH 179 39.020 12.222 3.498 1.00 32.15 O HETATM 3371 O HOH 180 40.604 12.159 6.046 1.00 42.56 O HETATM 3372 O HOH 181 41.781 10.890 9.138 1.00 42.97 O HETATM 3373 O HOH 182 29.778 7.341 -7.782 1.00 31.61 O HETATM 3374 O HOH 183 38.920 16.564 -1.889 1.00 40.35 O HETATM 3375 O HOH 184 30.171 4.142 -33.208 1.00 47.29 O HETATM 3376 O HOH 185 27.308 1.018 -30.695 1.00 51.71 O HETATM 3377 O HOH 186 36.909 -3.847 -20.314 1.00 42.46 O HETATM 3378 O HOH 187 40.182 16.975 -4.280 1.00 40.38 O HETATM 3379 O HOH 188 38.200 17.285 -13.437 1.00 42.24 O HETATM 3380 O HOH 189 42.284 10.623 -13.067 1.00 52.70 O HETATM 3381 O HOH 190 42.056 6.884 -8.102 1.00 46.94 O HETATM 3382 O HOH 191 41.229 18.832 -14.890 1.00 57.23 O HETATM 3383 O HOH 192 43.471 12.715 -11.892 1.00 49.83 O HETATM 3384 O HOH 193 11.458 -19.511 -2.196 1.00 38.73 O HETATM 3385 O HOH 194 12.607 -15.570 -2.055 1.00 39.32 O HETATM 3386 O HOH 195 10.535 -17.033 1.771 1.00 38.00 O HETATM 3387 O HOH 196 12.924 -24.168 -2.048 1.00 54.04 O HETATM 3388 O HOH 197 8.789 -18.980 1.715 1.00 41.13 O HETATM 3389 O HOH 198 9.272 -14.638 1.698 1.00 37.69 O HETATM 3390 O HOH 199 12.739 -15.530 -4.717 1.00 46.23 O HETATM 3391 O HOH 200 35.873 16.529 -22.735 1.00 51.45 O HETATM 3392 O HOH 201 16.069 -1.796 -8.057 1.00 49.65 O HETATM 3393 O HOH 202 29.462 12.473 -23.524 1.00 48.50 O HETATM 3394 O HOH 203 27.057 18.843 -11.812 1.00 54.28 O HETATM 3395 O HOH 204 12.555 11.705 -4.326 1.00 51.12 O HETATM 3396 O HOH 205 32.111 19.127 -6.508 1.00 49.57 O HETATM 3397 O HOH 206 3.023 7.782 -0.174 1.00 43.50 O HETATM 3398 O HOH 207 0.000 6.574 0.000 1.00 49.02 O HETATM 3399 O HOH 208 31.401 31.180 -0.422 1.00 27.05 O HETATM 3400 O HOH 209 33.611 27.665 1.544 1.00 45.37 O HETATM 3401 O HOH 210 32.850 30.930 -4.465 1.00 49.75 O HETATM 3402 O HOH 211 36.043 24.100 -1.029 1.00 41.83 O HETATM 3403 O HOH 212 33.935 24.766 1.761 1.00 32.31 O HETATM 3404 O HOH 213 30.527 18.778 -1.503 1.00 28.99 O HETATM 3405 O HOH 214 24.372 24.918 -2.074 1.00 33.91 O HETATM 3406 O HOH 215 26.735 30.210 -5.009 1.00 54.90 O HETATM 3407 O HOH 216 40.630 13.127 1.103 1.00 54.83 O HETATM 3408 O HOH 217 41.846 9.386 5.206 1.00 46.68 O HETATM 3409 O HOH 218 15.544 19.745 2.294 1.00 41.35 O HETATM 3410 O HOH 219 17.474 20.779 4.216 1.00 33.14 O HETATM 3411 O HOH 220 20.241 24.739 -1.190 1.00 39.04 O HETATM 3412 O HOH 221 15.753 16.048 7.224 1.00 43.42 O HETATM 3413 O HOH 222 12.348 16.652 12.513 1.00 46.47 O HETATM 3414 O HOH 223 6.927 10.513 5.111 1.00 33.00 O HETATM 3415 O HOH 224 13.025 13.138 -1.938 1.00 32.99 O HETATM 3416 O HOH 225 4.615 10.148 6.724 1.00 44.45 O HETATM 3417 O HOH 226 8.377 11.684 12.983 1.00 50.88 O HETATM 3418 O HOH 227 22.044 24.188 -2.935 1.00 37.97 O HETATM 3419 O HOH 228 24.980 27.031 -0.381 1.00 39.47 O HETATM 3420 O HOH 229 18.384 19.851 7.020 1.00 26.68 O HETATM 3421 O HOH 230 16.762 8.905 17.208 1.00 27.63 O HETATM 3422 O HOH 231 14.807 18.666 12.476 1.00 47.51 O HETATM 3423 O HOH 232 6.880 13.182 5.055 1.00 48.10 O HETATM 3424 O HOH 233 21.908 13.799 16.134 1.00 46.23 O HETATM 3425 O HOH 234 22.667 16.455 16.291 1.00 47.69 O HETATM 3426 O HOH 235 17.350 17.705 8.517 1.00 28.40 O HETATM 3427 O HOH 236 15.236 19.083 9.961 1.00 37.64 O HETATM 3428 O HOH 237 19.616 19.346 14.955 1.00 37.89 O HETATM 3429 O HOH 238 19.594 13.828 18.094 1.00 45.09 O HETATM 3430 O HOH 239 17.980 22.359 8.275 1.00 29.67 O HETATM 3431 O HOH 240 19.342 25.023 12.006 1.00 43.49 O HETATM 3432 O HOH 241 25.321 11.953 15.373 1.00 44.84 O HETATM 3433 O HOH 242 26.899 18.571 13.353 1.00 39.02 O HETATM 3434 O HOH 243 21.846 27.909 9.557 1.00 28.16 O HETATM 3435 O HOH 244 21.039 26.293 14.209 1.00 45.35 O HETATM 3436 O HOH 245 20.043 23.596 9.591 1.00 25.72 O HETATM 3437 O HOH 246 25.958 22.938 14.047 1.00 40.58 O HETATM 3438 O HOH 247 12.153 -17.774 4.066 1.00 39.12 O HETATM 3439 O HOH 248 21.167 25.585 8.099 1.00 25.79 O HETATM 3440 O HOH 249 20.932 27.343 0.112 1.00 50.72 O HETATM 3441 O HOH 250 24.270 28.458 10.516 1.00 26.15 O HETATM 3442 O HOH 251 31.651 25.949 14.992 1.00 50.52 O HETATM 3443 O HOH 252 32.083 20.790 14.244 1.00 47.30 O HETATM 3444 O HOH 253 25.087 30.837 9.249 1.00 31.36 O HETATM 3445 O HOH 254 25.111 31.306 6.228 1.00 42.94 O HETATM 3446 O HOH 255 23.142 28.057 1.331 1.00 38.10 O HETATM 3447 O HOH 256 21.131 29.705 7.527 1.00 53.17 O HETATM 3448 O HOH 257 24.378 29.544 13.260 1.00 30.69 O HETATM 3449 O HOH 258 27.738 24.314 16.974 1.00 45.66 O HETATM 3450 O HOH 259 23.563 24.843 14.963 1.00 48.47 O HETATM 3451 O HOH 260 22.131 28.592 15.065 1.00 34.31 O HETATM 3452 O HOH 261 35.029 29.804 5.384 1.00 57.73 O HETATM 3453 O HOH 262 31.447 36.077 4.856 1.00 31.63 O HETATM 3454 O HOH 263 31.372 37.691 7.928 1.00 42.32 O HETATM 3455 O HOH 264 37.251 32.051 8.266 1.00 45.54 O HETATM 3456 O HOH 265 38.063 33.641 5.979 1.00 53.66 O HETATM 3457 O HOH 266 35.368 29.867 7.849 1.00 45.81 O HETATM 3458 O HOH 267 38.204 34.048 3.185 1.00 53.41 O HETATM 3459 O HOH 268 38.634 32.130 0.948 1.00 39.08 O HETATM 3460 O HOH 269 11.426 -20.296 5.096 1.00 54.41 O HETATM 3461 O HOH 270 34.278 -10.279 18.848 1.00 59.55 O HETATM 3462 O HOH 271 12.715 -16.514 6.282 1.00 46.84 O HETATM 3463 O HOH 272 18.202 -19.372 17.607 1.00 35.44 O HETATM 3464 O HOH 273 11.104 6.104 18.845 1.00 61.83 O HETATM 3465 O HOH 274 3.541 -4.600 6.136 1.00 60.10 O HETATM 3466 O HOH 275 20.473 21.669 -6.908 1.00 48.98 O HETATM 3467 C1 UNN A 276 28.612 12.697 -0.661 1.00 0.12 C HETATM 3468 C2 UNN A 276 28.261 13.286 -1.894 1.00 0.12 C HETATM 3469 C14 UNN A 276 27.749 12.481 -2.901 1.00 -0.03 C HETATM 3470 C15 UNN A 276 27.625 11.099 -2.727 1.00 -0.03 C HETATM 3471 C18 UNN A 276 27.074 10.283 -3.843 1.00 0.04 C HETATM 3472 N4 UNN A 276 26.593 10.902 -4.862 1.00 -0.20 N HETATM 3473 N5 UNN A 276 25.976 10.170 -5.852 1.00 -0.17 N HETATM 3474 C26 UNN A 276 26.202 8.818 -6.076 1.00 0.22 C HETATM 3475 O3 UNN A 276 25.595 8.201 -6.953 1.00 -0.38 O HETATM 3476 C27 UNN A 276 27.176 8.155 -5.142 1.00 0.08 C HETATM 3477 C32 UNN A 276 27.009 8.765 -3.733 1.00 0.03 C HETATM 3478 C31 UNN A 276 25.651 8.331 -3.160 1.00 -0.02 C HETATM 3479 C30 UNN A 276 25.307 6.902 -3.407 1.00 -0.10 C HETATM 3480 C29 UNN A 276 25.893 6.168 -4.335 1.00 -0.10 C HETATM 3481 C28 UNN A 276 27.090 6.625 -5.104 1.00 -0.01 C HETATM 3482 H30 UNN A 276 27.997 6.227 -4.625 1.00 0.04 H HETATM 3483 H31 UNN A 276 27.021 6.244 -6.134 1.00 0.04 H HETATM 3484 H29 UNN A 276 25.484 5.182 -4.550 1.00 0.05 H HETATM 3485 H13 UNN A 276 24.535 6.441 -2.792 1.00 0.05 H HETATM 3486 H27 UNN A 276 25.667 8.498 -2.073 1.00 0.04 H HETATM 3487 H28 UNN A 276 24.869 8.957 -3.616 1.00 0.04 H HETATM 3488 H26 UNN A 276 27.816 8.409 -3.075 1.00 0.05 H HETATM 3489 H25 UNN A 276 28.186 8.404 -5.498 1.00 0.06 H HETATM 3490 C19 UNN A 276 25.066 10.952 -6.715 1.00 0.08 C HETATM 3491 C20 UNN A 276 23.885 11.466 -5.905 1.00 -0.02 C HETATM 3492 C21 UNN A 276 22.755 12.078 -6.727 1.00 -0.05 C HETATM 3493 C22 UNN A 276 23.201 13.270 -7.546 1.00 -0.05 C HETATM 3494 C23 UNN A 276 23.853 12.900 -8.877 1.00 -0.05 C HETATM 3495 C24 UNN A 276 25.318 12.460 -8.807 1.00 -0.05 C HETATM 3496 C25 UNN A 276 25.873 12.017 -7.454 1.00 -0.02 C HETATM 3497 H15 UNN A 276 26.884 11.618 -7.620 1.00 0.03 H HETATM 3498 H16 UNN A 276 25.930 12.905 -6.807 1.00 0.03 H HETATM 3499 H17 UNN A 276 25.439 11.616 -9.502 1.00 0.03 H HETATM 3500 H18 UNN A 276 25.930 13.307 -9.149 1.00 0.03 H HETATM 3501 H19 UNN A 276 23.274 12.075 -9.317 1.00 0.03 H HETATM 3502 H20 UNN A 276 23.797 13.779 -9.535 1.00 0.03 H HETATM 3503 H21 UNN A 276 22.320 13.896 -7.754 1.00 0.03 H HETATM 3504 H22 UNN A 276 23.927 13.845 -6.953 1.00 0.03 H HETATM 3505 H23 UNN A 276 21.958 12.402 -6.042 1.00 0.03 H HETATM 3506 H24 UNN A 276 22.362 11.310 -7.410 1.00 0.03 H HETATM 3507 H11 UNN A 276 24.256 12.234 -5.211 1.00 0.03 H HETATM 3508 H12 UNN A 276 23.472 10.623 -5.332 1.00 0.03 H HETATM 3509 H14 UNN A 276 24.655 10.275 -7.478 1.00 0.06 H HETATM 3510 C16 UNN A 276 27.954 10.534 -1.502 1.00 -0.07 C HETATM 3511 C17 UNN A 276 28.460 11.327 -0.484 1.00 -0.04 C HETATM 3512 H33 UNN A 276 28.740 10.874 0.460 1.00 0.05 H HETATM 3513 H32 UNN A 276 27.815 9.471 -1.342 1.00 0.05 H HETATM 3514 H37 UNN A 276 27.440 12.930 -3.838 1.00 0.05 H HETATM 3515 O1 UNN A 276 28.432 14.650 -2.017 1.00 -0.32 O HETATM 3516 C3 UNN A 276 28.151 15.274 -3.287 1.00 0.07 C HETATM 3517 C4 UNN A 276 28.295 16.774 -3.156 1.00 -0.02 C HETATM 3518 C5 UNN A 276 28.066 17.519 -4.457 1.00 -0.02 C HETATM 3519 C6 UNN A 276 26.695 18.120 -4.614 1.00 0.07 C HETATM 3520 O2 UNN A 276 25.697 17.081 -4.596 1.00 -0.31 O HETATM 3521 C7 UNN A 276 24.444 17.384 -5.066 1.00 0.10 C HETATM 3522 C8 UNN A 276 23.990 18.686 -5.246 1.00 -0.03 C HETATM 3523 C9 UNN A 276 22.717 18.911 -5.728 1.00 -0.05 C HETATM 3524 C10 UNN A 276 21.898 17.845 -6.074 1.00 0.03 C HETATM 3525 C11 UNN A 276 22.369 16.546 -5.915 1.00 -0.05 C HETATM 3526 C12 UNN A 276 23.632 16.314 -5.409 1.00 -0.03 C HETATM 3527 H38 UNN A 276 23.988 15.298 -5.280 1.00 0.06 H HETATM 3528 H39 UNN A 276 21.739 15.708 -6.191 1.00 0.06 H HETATM 3529 C13 UNN A 276 20.572 18.087 -6.629 1.00 0.18 C HETATM 3530 N3 UNN A 276 20.086 19.267 -6.980 1.00 -0.15 N HETATM 3531 N2 UNN A 276 18.827 19.042 -7.437 1.00 -0.07 N HETATM 3532 N1 UNN A 276 18.559 17.777 -7.394 1.00 -0.14 N HETATM 3533 N UNN A 276 19.646 17.162 -6.899 1.00 -0.21 N HETATM 3534 H9 UNN A 276 20.567 20.176 -6.919 1.00 0.27 H HETATM 3535 H40 UNN A 276 22.354 19.927 -5.837 1.00 0.06 H HETATM 3536 H10 UNN A 276 24.636 19.523 -5.008 1.00 0.06 H HETATM 3537 H7 UNN A 276 26.641 18.660 -5.571 1.00 0.06 H HETATM 3538 H8 UNN A 276 26.507 18.820 -3.787 1.00 0.06 H HETATM 3539 H5 UNN A 276 28.227 16.814 -5.286 1.00 0.03 H HETATM 3540 H6 UNN A 276 28.804 18.332 -4.519 1.00 0.03 H HETATM 3541 H3 UNN A 276 29.312 16.997 -2.802 1.00 0.03 H HETATM 3542 H4 UNN A 276 27.563 17.131 -2.417 1.00 0.03 H HETATM 3543 H1 UNN A 276 28.859 14.902 -4.042 1.00 0.06 H HETATM 3544 H2 UNN A 276 27.124 15.030 -3.596 1.00 0.06 H HETATM 3545 O UNN A 276 29.081 13.557 0.295 1.00 -0.32 O HETATM 3546 C UNN A 276 29.897 13.000 1.338 1.00 0.06 C HETATM 3547 H34 UNN A 276 30.201 13.798 2.031 1.00 0.06 H HETATM 3548 H35 UNN A 276 30.792 12.537 0.896 1.00 0.06 H HETATM 3549 H36 UNN A 276 29.323 12.238 1.886 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 861 859 860 3192 CONECT 1208 1206 1207 3192 CONECT 1216 1215 3193 CONECT 1217 1215 3192 CONECT 2214 2213 3192 CONECT 3192 861 1208 1217 2214 CONECT 3193 1216 CONECT 3467 3468 3511 3545 CONECT 3468 3467 3469 3515 CONECT 3469 3468 3470 3514 CONECT 3470 3469 3471 3510 CONECT 3471 3470 3472 3477 CONECT 3472 3471 3473 CONECT 3473 3472 3474 3490 CONECT 3474 3473 3475 3476 CONECT 3475 3474 CONECT 3476 3474 3477 3481 3489 CONECT 3477 3471 3476 3478 3488 CONECT 3478 3477 3479 3486 3487 CONECT 3479 3478 3480 3485 CONECT 3480 3479 3481 3484 CONECT 3481 3476 3480 3482 3483 CONECT 3482 3481 CONECT 3483 3481 CONECT 3484 3480 CONECT 3485 3479 CONECT 3486 3478 CONECT 3487 3478 CONECT 3488 3477 CONECT 3489 3476 CONECT 3490 3473 3491 3496 3509 CONECT 3491 3490 3492 3507 3508 CONECT 3492 3491 3493 3505 3506 CONECT 3493 3492 3494 3503 3504 CONECT 3494 3493 3495 3501 3502 CONECT 3495 3494 3496 3499 3500 CONECT 3496 3490 3495 3497 3498 CONECT 3497 3496 CONECT 3498 3496 CONECT 3499 3495 CONECT 3500 3495 CONECT 3501 3494 CONECT 3502 3494 CONECT 3503 3493 CONECT 3504 3493 CONECT 3505 3492 CONECT 3506 3492 CONECT 3507 3491 CONECT 3508 3491 CONECT 3509 3490 CONECT 3510 3470 3511 3513 CONECT 3511 3467 3510 3512 CONECT 3512 3511 CONECT 3513 3510 CONECT 3514 3469 CONECT 3515 3468 3516 CONECT 3516 3515 3517 3543 3544 CONECT 3517 3516 3518 3541 3542 CONECT 3518 3517 3519 3539 3540 CONECT 3519 3518 3520 3537 3538 CONECT 3520 3519 3521 CONECT 3521 3520 3522 3526 CONECT 3522 3521 3523 3536 CONECT 3523 3522 3524 3535 CONECT 3524 3523 3525 3529 CONECT 3525 3524 3526 3528 CONECT 3526 3521 3525 3527 CONECT 3527 3526 CONECT 3528 3525 CONECT 3529 3524 3530 3533 CONECT 3530 3529 3531 3534 CONECT 3531 3530 3532 CONECT 3532 3531 3533 CONECT 3533 3529 3532 CONECT 3534 3530 CONECT 3535 3523 CONECT 3536 3522 CONECT 3537 3519 CONECT 3538 3519 CONECT 3539 3518 CONECT 3540 3518 CONECT 3541 3517 CONECT 3542 3517 CONECT 3543 3516 CONECT 3544 3516 CONECT 3545 3467 3546 CONECT 3546 3545 3547 3548 3549 CONECT 3547 3546 CONECT 3548 3546 CONECT 3549 3546 MASTER 0 0 0 0 0 0 0 0 3548 1 94 26 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5g57
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5g2b
RCSB PDB
PDBbind
360aa, >5G2B_1|Chains... *
5g5v
RCSB PDB
PDBbind
360aa, >5G5V_1|Chains... at 100%
5l8c
RCSB PDB
PDBbind
360aa, >5L8C_1|Chains... at 100%
5l8y
RCSB PDB
PDBbind
360aa, >5L8Y_1|Chains... at 100%
5l9h
RCSB PDB
PDBbind
360aa, >5L9H_1|Chains... at 100%
6rfw
RCSB PDB
PDBbind
360aa, >6RFW_1|Chains... at 100%
6rfn
RCSB PDB
PDBbind
360aa, >6RFN_1|Chains... at 100%
6gxq
RCSB PDB
PDBbind
360aa, >6GXQ_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5laq
RCSB PDB
PDBbind
6M5
Entry Information
PDB ID
5g57
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
CLASS 1 PHOSPHODIESTERASE PDEB1
Ligand Name
6M5
EC.Number
E.C.3.1.4.-
Resolution
1.73(Å)
Affinity (Kd/Ki/IC50)
Ki=3.98nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 3870-3888
Ligand Properties
Formula
C
3
3
H
4
0
N
6
O
4
Molecular Weight
584.708
Exact Mass
584.311
No. of atoms
83
No. of bonds
88
Polar Surface Area
114.82
LOGP Value
6.29 (
Computed with XLOGP3
)
5.34 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 6
Canonical SMILES
COc1ccc(cc1OCCCCOc1ccc(cc1)c1nnn[nH]1)C1=NN(C2CCCCCC2)C(=O)[C@H]2[C@@H]1CC=CC2
InChI String
InChI=1S/C33H40N6O4/c1-41-29-19-16-24(31-27-12-6-7-13-28(27)33(40)39(36-31)25-10-4-2-3-5-11-25)22-30(29)43-21-9-8-20-42-26-17-14-23(15-18-26)32-34-37-38-35-32/h6-7,14-19,22,25,27-28H,2-5,8-13,20-21H2,1H3,(H,34,35,37,38)/t27-,28+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8WQX9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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