Browse entries in the PDBbind-CN Database
HEADER 5L6O_COMPLEX COMPND 5L6O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 10 CYS VAL LYS ILE GLU GLU VAL ILE GLY ALA SEQRES 1 A 135 GLY GLU VAL CYS ARG GLY ARG LEU LYS GLN PRO GLY ARG SEQRES 2 A 135 ARG GLU VAL PHE VAL ALA ILE LYS THR LEU LYS VAL GLY SEQRES 3 A 135 TYR THR GLU ARG GLN ARG ARG ASP PHE LEU SER GLU ALA SEQRES 4 A 135 SER ILE MET GLY GLN PHE ASP HIS PRO ASN ILE ILE ARG SEQRES 5 A 135 LEU GLU GLY VAL VAL THR LYS SER ARG PRO VAL MET ILE SEQRES 6 A 135 LEU THR GLU PHE MET GLU ASN CYS ALA LEU ASP SER PHE SEQRES 7 A 135 LEU ARG LEU ASN ASP GLY GLN PHE THR VAL ILE GLN LEU SEQRES 8 A 135 VAL GLY MET LEU ARG GLY ILE ALA ALA GLY MET LYS TYR SEQRES 9 A 135 LEU SER GLU MET ASN TYR VAL HIS ARG ASP LEU ALA ALA SEQRES 10 A 135 ARG ASN ILE LEU VAL ASN SER ASN LEU VAL CYS LYS VAL SEQRES 11 A 135 SER ASP PHE GLY LEU SEQRES 1 A 122 GLU ASP ASP PRO SER ASP PRO THR TYR THR SER SER LEU SEQRES 2 A 122 GLY GLY LYS ILE PRO ILE ARG TRP THR ALA PRO GLU ALA SEQRES 3 A 122 ILE ALA TYR ARG LYS PHE THR SER ALA SER ASP VAL TRP SEQRES 4 A 122 SER TYR GLY ILE VAL MET TRP GLU VAL MET SER TYR GLY SEQRES 5 A 122 GLU ARG PRO TYR TRP ASP MET SER ASN GLN ASP VAL ILE SEQRES 6 A 122 ASN ALA VAL GLU GLN ASP TYR ARG LEU PRO PRO PRO MET SEQRES 7 A 122 ASP CYS PRO THR ALA LEU HIS GLN LEU MET LEU ASP CYS SEQRES 8 A 122 TRP VAL ARG ASP ARG ASN LEU ARG PRO LYS PHE SER GLN SEQRES 9 A 122 ILE VAL ASN THR LEU ASP LYS LEU ILE ARG ASN PRO ALA SEQRES 10 A 122 SER LEU LYS VAL ILE HET UNN A 362 33 ATOM 1 N CYS A 632 14.985 3.810 14.020 1.00161.96 N ATOM 2 CA CYS A 632 15.633 2.848 13.128 1.00160.58 C ATOM 3 C CYS A 632 15.837 3.390 11.712 1.00161.96 C ATOM 4 O CYS A 632 16.884 3.137 11.113 1.00160.80 O ATOM 5 CB CYS A 632 14.882 1.519 13.114 1.00160.32 C ATOM 6 SG CYS A 632 15.054 0.554 14.638 1.00164.65 S ATOM 7 HN3 CYS A 632 14.050 4.059 13.639 1.00 0.00 H ATOM 8 HN2 CYS A 632 15.572 4.666 14.090 1.00 0.00 H ATOM 9 HN1 CYS A 632 14.874 3.386 14.963 1.00 0.00 H ATOM 10 N VAL A 633 14.840 4.121 11.176 1.00159.28 N ATOM 11 CA VAL A 633 14.900 4.689 9.824 1.00155.96 C ATOM 12 C VAL A 633 15.305 6.168 9.881 1.00161.73 C ATOM 13 O VAL A 633 14.657 6.959 10.569 1.00162.47 O ATOM 14 CB VAL A 633 13.592 4.460 9.003 1.00154.03 C ATOM 15 CG1 VAL A 633 13.746 4.938 7.560 1.00147.86 C ATOM 16 CG2 VAL A 633 13.160 2.995 9.031 1.00152.19 C ATOM 17 H VAL A 633 13.988 4.291 11.747 1.00 0.00 H ATOM 18 N LYS A 634 16.380 6.525 9.151 1.00159.31 N ATOM 19 CA LYS A 634 16.905 7.887 9.055 1.00159.92 C ATOM 20 C LYS A 634 16.983 8.304 7.583 1.00160.64 C ATOM 21 O LYS A 634 17.657 7.645 6.788 1.00157.00 O ATOM 22 CB LYS A 634 18.282 7.993 9.741 1.00163.13 C ATOM 23 CG LYS A 634 18.744 9.426 9.990 1.00177.08 C ATOM 24 CD LYS A 634 20.161 9.476 10.534 1.00186.58 C ATOM 25 CE LYS A 634 20.624 10.894 10.755 1.00197.64 C ATOM 26 NZ LYS A 634 21.990 10.944 11.339 1.00206.30 N ATOM 27 HZ1 LYS A 634 21.992 10.453 12.256 1.00 0.00 H ATOM 28 HZ2 LYS A 634 22.659 10.478 10.693 1.00 0.00 H ATOM 29 HZ3 LYS A 634 22.271 11.936 11.475 1.00 0.00 H ATOM 30 H LYS A 634 16.871 5.779 8.618 1.00 0.00 H ATOM 31 N ILE A 635 16.267 9.387 7.227 1.00156.67 N ATOM 32 CA ILE A 635 16.207 9.950 5.871 1.00151.45 C ATOM 33 C ILE A 635 17.453 10.815 5.579 1.00157.50 C ATOM 34 O ILE A 635 18.053 11.354 6.516 1.00160.34 O ATOM 35 CB ILE A 635 14.849 10.692 5.653 1.00152.59 C ATOM 36 CG1 ILE A 635 14.541 10.907 4.152 1.00146.81 C ATOM 37 CG2 ILE A 635 14.750 12.007 6.465 1.00158.39 C ATOM 38 CD1 ILE A 635 13.059 10.874 3.793 1.00153.86 C ATOM 39 H ILE A 635 15.714 9.862 7.969 1.00 0.00 H ATOM 40 N GLU A 636 17.850 10.929 4.292 1.00149.99 N ATOM 41 CA GLU A 636 19.019 11.715 3.894 1.00151.76 C ATOM 42 C GLU A 636 18.720 12.748 2.801 1.00153.05 C ATOM 43 O GLU A 636 18.991 13.933 3.007 1.00156.29 O ATOM 44 CB GLU A 636 20.195 10.807 3.498 1.00152.49 C ATOM 45 H GLU A 636 17.303 10.439 3.555 1.00 0.00 H ATOM 46 N GLU A 637 18.169 12.309 1.651 1.00143.79 N ATOM 47 CA GLU A 637 17.858 13.186 0.514 1.00140.79 C ATOM 48 C GLU A 637 16.716 12.656 -0.353 1.00139.86 C ATOM 49 O GLU A 637 16.550 11.444 -0.472 1.00136.69 O ATOM 50 CB GLU A 637 19.107 13.394 -0.356 1.00141.95 C ATOM 51 H GLU A 637 17.953 11.295 1.564 1.00 0.00 H ATOM 52 N VAL A 638 15.953 13.570 -0.982 1.00135.37 N ATOM 53 CA VAL A 638 14.836 13.238 -1.877 1.00130.20 C ATOM 54 C VAL A 638 15.352 13.023 -3.320 1.00129.88 C ATOM 55 O VAL A 638 16.169 13.812 -3.803 1.00130.65 O ATOM 56 CB VAL A 638 13.652 14.256 -1.764 1.00134.71 C ATOM 57 CG1 VAL A 638 14.076 15.689 -2.096 1.00136.73 C ATOM 58 CG2 VAL A 638 12.442 13.829 -2.596 1.00129.65 C ATOM 59 H VAL A 638 16.168 14.575 -0.824 1.00 0.00 H ATOM 60 N ILE A 639 14.906 11.928 -3.975 1.00121.91 N ATOM 61 CA ILE A 639 15.304 11.567 -5.344 1.00117.96 C ATOM 62 C ILE A 639 14.243 12.000 -6.373 1.00118.77 C ATOM 63 O ILE A 639 14.582 12.668 -7.352 1.00117.56 O ATOM 64 CB ILE A 639 15.690 10.058 -5.479 1.00118.88 C ATOM 65 CG1 ILE A 639 16.784 9.650 -4.459 1.00123.19 C ATOM 66 CG2 ILE A 639 16.123 9.722 -6.915 1.00115.63 C ATOM 67 CD1 ILE A 639 16.821 8.144 -4.100 1.00128.34 C ATOM 68 H ILE A 639 14.240 11.302 -3.480 1.00 0.00 H ATOM 69 N GLY A 640 12.990 11.600 -6.148 1.00113.94 N ATOM 70 CA GLY A 640 11.871 11.919 -7.030 1.00110.83 C ATOM 71 C GLY A 640 10.508 11.878 -6.367 1.00115.19 C ATOM 72 O GLY A 640 10.399 11.572 -5.175 1.00117.60 O ATOM 73 H GLY A 640 12.800 11.030 -5.299 1.00 0.00 H ATOM 74 N ALA A 641 9.454 12.197 -7.144 1.00109.13 N ATOM 75 CA ALA A 641 8.067 12.210 -6.677 1.00142.32 C ATOM 76 C ALA A 641 7.180 11.271 -7.500 1.00171.65 C ATOM 77 O ALA A 641 7.245 11.260 -8.728 1.00131.82 O ATOM 78 CB ALA A 641 7.514 13.626 -6.713 1.00144.71 C ATOM 79 H ALA A 641 9.637 12.449 -8.136 1.00 0.00 H TER 80 ALA A 641 ATOM 81 N GLY A 645 3.813 8.003 -3.953 1.00107.37 N ATOM 82 CA GLY A 645 4.239 9.213 -3.264 1.00110.54 C ATOM 83 C GLY A 645 5.612 9.691 -3.691 1.00113.86 C ATOM 84 O GLY A 645 5.765 10.217 -4.796 1.00111.40 O ATOM 85 HN3 GLY A 645 4.488 7.237 -3.756 1.00 0.00 H ATOM 86 HN2 GLY A 645 3.780 8.182 -4.977 1.00 0.00 H ATOM 87 HN1 GLY A 645 2.868 7.729 -3.617 1.00 0.00 H ATOM 88 N GLU A 646 6.623 9.509 -2.818 1.00112.48 N ATOM 89 CA GLU A 646 8.004 9.934 -3.080 1.00112.44 C ATOM 90 C GLU A 646 9.037 8.813 -2.896 1.00114.92 C ATOM 91 O GLU A 646 8.806 7.874 -2.133 1.00115.44 O ATOM 92 CB GLU A 646 8.387 11.139 -2.201 1.00118.41 C ATOM 93 CG GLU A 646 7.686 12.442 -2.554 1.00129.61 C ATOM 94 CD GLU A 646 6.337 12.659 -1.895 1.00151.32 C ATOM 95 OE1 GLU A 646 6.261 12.588 -0.647 1.00148.40 O ATOM 96 OE2 GLU A 646 5.361 12.939 -2.627 1.00143.50 O ATOM 97 H GLU A 646 6.414 9.043 -1.912 1.00 0.00 H ATOM 98 N VAL A 647 10.183 8.934 -3.594 1.00109.44 N ATOM 99 CA VAL A 647 11.327 8.022 -3.513 1.00108.92 C ATOM 100 C VAL A 647 12.502 8.832 -2.928 1.00115.87 C ATOM 101 O VAL A 647 12.876 9.862 -3.493 1.00115.30 O ATOM 102 CB VAL A 647 11.673 7.361 -4.879 1.00108.28 C ATOM 103 CG1 VAL A 647 12.935 6.506 -4.781 1.00108.73 C ATOM 104 CG2 VAL A 647 10.505 6.527 -5.404 1.00104.51 C ATOM 105 H VAL A 647 10.262 9.742 -4.244 1.00 0.00 H ATOM 106 N CYS A 648 13.050 8.384 -1.780 1.00115.61 N ATOM 107 CA CYS A 648 14.151 9.057 -1.083 1.00119.90 C ATOM 108 C CYS A 648 15.318 8.112 -0.768 1.00124.88 C ATOM 109 O CYS A 648 15.154 6.898 -0.813 1.00122.78 O ATOM 110 CB CYS A 648 13.642 9.744 0.182 1.00124.83 C ATOM 111 SG CYS A 648 12.316 10.945 -0.102 1.00127.82 S ATOM 112 H CYS A 648 12.669 7.510 -1.365 1.00 0.00 H ATOM 113 N ARG A 649 16.491 8.680 -0.446 1.00124.52 N ATOM 114 CA ARG A 649 17.708 7.960 -0.064 1.00126.51 C ATOM 115 C ARG A 649 17.915 8.163 1.443 1.00136.43 C ATOM 116 O ARG A 649 17.630 9.246 1.954 1.00138.95 O ATOM 117 CB ARG A 649 18.912 8.506 -0.855 1.00126.32 C ATOM 118 CG ARG A 649 20.193 7.692 -0.709 1.00136.31 C ATOM 119 CD ARG A 649 21.376 8.395 -1.339 1.00148.70 C ATOM 120 NE ARG A 649 22.639 7.752 -0.977 1.00165.93 N ATOM 121 CZ ARG A 649 23.841 8.201 -1.326 1.00186.59 C ATOM 122 NH1 ARG A 649 23.960 9.306 -2.053 1.00175.84 N ATOM 123 NH2 ARG A 649 24.934 7.550 -0.950 1.00177.36 N ATOM 124 HE ARG A 649 22.594 6.883 -0.407 1.00 0.00 H ATOM 125 HH12 ARG A 649 24.903 9.652 -2.323 1.00 0.00 H ATOM 126 HH11 ARG A 649 23.110 9.825 -2.353 1.00 0.00 H ATOM 127 HH22 ARG A 649 25.872 7.905 -1.226 1.00 0.00 H ATOM 128 HH21 ARG A 649 24.853 6.684 -0.380 1.00 0.00 H ATOM 129 H ARG A 649 16.540 9.719 -0.470 1.00 0.00 H ATOM 130 N GLY A 650 18.392 7.128 2.133 1.00135.00 N ATOM 131 CA GLY A 650 18.639 7.186 3.572 1.00140.73 C ATOM 132 C GLY A 650 19.459 6.043 4.136 1.00146.67 C ATOM 133 O GLY A 650 20.088 5.294 3.384 1.00143.02 O ATOM 134 H GLY A 650 18.597 6.243 1.627 1.00 0.00 H ATOM 135 N ARG A 651 19.458 5.914 5.480 1.00148.89 N ATOM 136 CA ARG A 651 20.180 4.872 6.220 1.00152.16 C ATOM 137 C ARG A 651 19.230 4.031 7.084 1.00157.00 C ATOM 138 O ARG A 651 18.172 4.522 7.486 1.00156.61 O ATOM 139 CB ARG A 651 21.268 5.497 7.096 1.00 20.00 C ATOM 140 H ARG A 651 18.906 6.602 6.031 1.00 0.00 H ATOM 141 N LEU A 652 19.613 2.769 7.372 1.00155.00 N ATOM 142 CA LEU A 652 18.833 1.840 8.197 1.00156.79 C ATOM 143 C LEU A 652 19.734 1.015 9.126 1.00163.25 C ATOM 144 O LEU A 652 20.742 0.465 8.678 1.00162.46 O ATOM 145 CB LEU A 652 17.951 0.927 7.314 1.00150.73 C ATOM 146 CG LEU A 652 17.141 -0.184 8.011 1.00156.43 C ATOM 147 CD1 LEU A 652 15.942 0.373 8.766 1.00158.58 C ATOM 148 CD2 LEU A 652 16.685 -1.222 7.018 1.00152.99 C ATOM 149 H LEU A 652 20.518 2.434 6.985 1.00 0.00 H ATOM 150 N LYS A 653 19.356 0.926 10.417 1.00163.54 N ATOM 151 CA LYS A 653 20.085 0.173 11.441 1.00165.16 C ATOM 152 C LYS A 653 19.131 -0.697 12.268 1.00169.14 C ATOM 153 O LYS A 653 18.205 -0.177 12.896 1.00169.44 O ATOM 154 CB LYS A 653 20.910 1.124 12.337 1.00168.54 C ATOM 155 CG LYS A 653 21.887 0.440 13.306 1.00181.63 C ATOM 156 CD LYS A 653 23.136 -0.116 12.614 1.00189.04 C ATOM 157 CE LYS A 653 24.333 -0.181 13.528 1.00199.20 C ATOM 158 NZ LYS A 653 24.972 1.152 13.695 1.00206.45 N ATOM 159 HZ1 LYS A 653 25.286 1.503 12.768 1.00 0.00 H ATOM 160 HZ2 LYS A 653 24.284 1.816 14.103 1.00 0.00 H ATOM 161 HZ3 LYS A 653 25.791 1.065 14.330 1.00 0.00 H ATOM 162 H LYS A 653 18.490 1.425 10.705 1.00 0.00 H ATOM 163 N GLN A 654 19.361 -2.022 12.249 1.00167.32 N ATOM 164 CA GLN A 654 18.571 -3.016 12.984 1.00168.23 C ATOM 165 C GLN A 654 19.415 -3.670 14.097 1.00173.11 C ATOM 166 O GLN A 654 20.608 -3.899 13.878 1.00172.78 O ATOM 167 CB GLN A 654 18.006 -4.082 12.030 1.00167.94 C ATOM 168 CG GLN A 654 16.812 -3.602 11.209 1.00180.47 C ATOM 169 CD GLN A 654 16.238 -4.694 10.340 1.00194.06 C ATOM 170 OE1 GLN A 654 16.808 -5.073 9.312 1.00189.95 O ATOM 171 NE2 GLN A 654 15.079 -5.207 10.722 1.00189.18 N ATOM 172 HE22 GLN A 654 14.622 -4.868 11.593 1.00 0.00 H ATOM 173 HE21 GLN A 654 14.625 -5.949 10.151 1.00 0.00 H ATOM 174 H GLN A 654 20.155 -2.366 11.672 1.00 0.00 H ATOM 175 N PRO A 655 18.837 -3.976 15.290 1.00172.68 N ATOM 176 CA PRO A 655 19.645 -4.583 16.367 1.00174.31 C ATOM 177 C PRO A 655 20.096 -6.015 16.065 1.00176.98 C ATOM 178 O PRO A 655 19.351 -6.976 16.279 1.00177.01 O ATOM 179 CB PRO A 655 18.740 -4.481 17.606 1.00177.02 C ATOM 180 CG PRO A 655 17.595 -3.595 17.204 1.00179.31 C ATOM 181 CD PRO A 655 17.446 -3.763 15.732 1.00174.18 C ATOM 182 N GLY A 656 21.320 -6.126 15.550 1.00174.13 N ATOM 183 CA GLY A 656 21.945 -7.388 15.165 1.00173.56 C ATOM 184 C GLY A 656 22.738 -7.304 13.873 1.00173.97 C ATOM 185 O GLY A 656 23.670 -8.086 13.669 1.00173.92 O ATOM 186 H GLY A 656 21.868 -5.253 15.413 1.00 0.00 H ATOM 187 N ARG A 657 22.370 -6.353 12.990 1.00169.41 N ATOM 188 CA ARG A 657 23.022 -6.126 11.698 1.00167.40 C ATOM 189 C ARG A 657 23.623 -4.717 11.596 1.00168.53 C ATOM 190 O ARG A 657 23.194 -3.808 12.312 1.00168.84 O ATOM 191 CB ARG A 657 22.037 -6.381 10.547 1.00166.02 C ATOM 192 H ARG A 657 21.569 -5.740 13.244 1.00 0.00 H ATOM 193 N ARG A 658 24.619 -4.543 10.703 1.00164.27 N ATOM 194 CA ARG A 658 25.302 -3.267 10.472 1.00163.50 C ATOM 195 C ARG A 658 24.479 -2.325 9.578 1.00162.78 C ATOM 196 O ARG A 658 23.588 -2.782 8.856 1.00161.16 O ATOM 197 CB ARG A 658 26.703 -3.501 9.884 1.00164.00 C ATOM 198 H ARG A 658 24.921 -5.366 10.143 1.00 0.00 H ATOM 199 N GLU A 659 24.783 -1.010 9.637 1.00159.20 N ATOM 200 CA GLU A 659 24.102 0.039 8.874 1.00157.28 C ATOM 201 C GLU A 659 24.374 -0.044 7.374 1.00156.22 C ATOM 202 O GLU A 659 25.527 -0.149 6.953 1.00156.20 O ATOM 203 CB GLU A 659 24.466 1.433 9.411 1.00159.16 C ATOM 204 H GLU A 659 25.556 -0.722 10.270 1.00 0.00 H ATOM 205 N VAL A 660 23.299 -0.005 6.575 1.00147.20 N ATOM 206 CA VAL A 660 23.347 -0.048 5.107 1.00139.41 C ATOM 207 C VAL A 660 22.479 1.054 4.495 1.00134.52 C ATOM 208 O VAL A 660 21.426 1.382 5.052 1.00133.11 O ATOM 209 CB VAL A 660 23.019 -1.445 4.501 1.00139.93 C ATOM 210 CG1 VAL A 660 24.178 -2.422 4.684 1.00142.62 C ATOM 211 CG2 VAL A 660 21.716 -2.023 5.057 1.00139.17 C ATOM 212 H VAL A 660 22.364 0.060 7.026 1.00 0.00 H ATOM 213 N PHE A 661 22.924 1.624 3.354 1.00125.48 N ATOM 214 CA PHE A 661 22.184 2.661 2.627 1.00120.55 C ATOM 215 C PHE A 661 20.909 2.069 2.029 1.00115.09 C ATOM 216 O PHE A 661 20.934 0.950 1.513 1.00111.99 O ATOM 217 CB PHE A 661 23.049 3.319 1.541 1.00120.84 C ATOM 218 CG PHE A 661 24.005 4.371 2.053 1.00127.22 C ATOM 219 CD1 PHE A 661 23.554 5.644 2.382 1.00132.10 C ATOM 220 CD2 PHE A 661 25.364 4.105 2.156 1.00132.46 C ATOM 221 CE1 PHE A 661 24.441 6.620 2.852 1.00137.99 C ATOM 222 CE2 PHE A 661 26.251 5.083 2.619 1.00140.46 C ATOM 223 CZ PHE A 661 25.784 6.335 2.961 1.00140.25 C ATOM 224 H PHE A 661 23.839 1.311 2.971 1.00 0.00 H ATOM 225 N VAL A 662 19.791 2.804 2.139 1.00107.85 N ATOM 226 CA VAL A 662 18.466 2.358 1.698 1.00102.11 C ATOM 227 C VAL A 662 17.702 3.379 0.836 1.00100.58 C ATOM 228 O VAL A 662 17.948 4.579 0.924 1.00101.67 O ATOM 229 CB VAL A 662 17.589 1.898 2.904 1.00108.55 C ATOM 230 CG1 VAL A 662 18.052 0.556 3.465 1.00110.08 C ATOM 231 CG2 VAL A 662 17.527 2.962 4.005 1.00113.59 C ATOM 232 H VAL A 662 19.870 3.750 2.564 1.00 0.00 H ATOM 233 N ALA A 663 16.763 2.879 0.008 1.00 91.79 N ATOM 234 CA ALA A 663 15.836 3.673 -0.792 1.00 87.87 C ATOM 235 C ALA A 663 14.497 3.550 -0.073 1.00 92.38 C ATOM 236 O ALA A 663 14.109 2.449 0.330 1.00 91.16 O ATOM 237 CB ALA A 663 15.732 3.134 -2.209 1.00 83.35 C ATOM 238 H ALA A 663 16.694 1.844 -0.067 1.00 0.00 H ATOM 239 N ILE A 664 13.833 4.686 0.157 1.00 91.20 N ATOM 240 CA ILE A 664 12.578 4.759 0.896 1.00 92.79 C ATOM 241 C ILE A 664 11.437 5.226 -0.011 1.00 95.86 C ATOM 242 O ILE A 664 11.454 6.361 -0.497 1.00 94.94 O ATOM 243 CB ILE A 664 12.732 5.657 2.167 1.00101.03 C ATOM 244 CG1 ILE A 664 13.926 5.223 3.048 1.00105.48 C ATOM 245 CG2 ILE A 664 11.444 5.706 2.990 1.00103.25 C ATOM 246 CD1 ILE A 664 14.877 6.353 3.396 1.00112.28 C ATOM 247 H ILE A 664 14.235 5.571 -0.213 1.00 0.00 H ATOM 248 N LYS A 665 10.448 4.347 -0.226 1.00 92.10 N ATOM 249 CA LYS A 665 9.251 4.663 -0.994 1.00 89.76 C ATOM 250 C LYS A 665 8.177 5.055 0.020 1.00100.12 C ATOM 251 O LYS A 665 7.801 4.250 0.878 1.00101.73 O ATOM 252 CB LYS A 665 8.804 3.479 -1.869 1.00 88.01 C ATOM 253 CG LYS A 665 7.771 3.869 -2.918 1.00 99.37 C ATOM 254 CD LYS A 665 6.908 2.694 -3.335 1.00106.73 C ATOM 255 CE LYS A 665 5.694 3.149 -4.111 1.00115.36 C ATOM 256 NZ LYS A 665 4.968 2.003 -4.723 1.00118.48 N ATOM 257 HZ1 LYS A 665 5.603 1.500 -5.375 1.00 0.00 H ATOM 258 HZ2 LYS A 665 4.653 1.354 -3.974 1.00 0.00 H ATOM 259 HZ3 LYS A 665 4.142 2.357 -5.246 1.00 0.00 H ATOM 260 H LYS A 665 10.540 3.392 0.175 1.00 0.00 H ATOM 261 N THR A 666 7.745 6.318 -0.040 1.00 99.98 N ATOM 262 CA THR A 666 6.736 6.875 0.859 1.00104.44 C ATOM 263 C THR A 666 5.416 7.071 0.123 1.00109.40 C ATOM 264 O THR A 666 5.394 7.111 -1.109 1.00104.76 O ATOM 265 CB THR A 666 7.224 8.204 1.471 1.00115.54 C ATOM 266 OG1 THR A 666 7.572 9.112 0.423 1.00111.68 O ATOM 267 CG2 THR A 666 8.396 8.023 2.432 1.00118.38 C ATOM 268 HG1 THR A 666 8.294 8.717 -0.128 1.00 0.00 H ATOM 269 H THR A 666 8.150 6.940 -0.768 1.00 0.00 H ATOM 270 N LEU A 667 4.317 7.178 0.878 1.00111.70 N ATOM 271 CA LEU A 667 2.995 7.441 0.322 1.00111.20 C ATOM 272 C LEU A 667 2.638 8.897 0.636 1.00119.96 C ATOM 273 O LEU A 667 2.894 9.360 1.755 1.00124.12 O ATOM 274 CB LEU A 667 1.940 6.492 0.919 1.00112.70 C ATOM 275 CG LEU A 667 1.091 5.680 -0.073 1.00113.52 C ATOM 276 CD1 LEU A 667 0.144 4.763 0.668 1.00116.00 C ATOM 277 CD2 LEU A 667 0.282 6.581 -1.005 1.00113.90 C ATOM 278 H LEU A 667 4.410 7.069 1.908 1.00 0.00 H ATOM 279 N LYS A 668 2.064 9.615 -0.356 1.00115.57 N ATOM 280 CA LYS A 668 1.657 11.025 -0.246 1.00118.08 C ATOM 281 C LYS A 668 0.732 11.281 0.947 1.00128.11 C ATOM 282 O LYS A 668 -0.062 10.406 1.301 1.00128.18 O ATOM 283 CB LYS A 668 0.996 11.500 -1.549 1.00116.99 C ATOM 284 H LYS A 668 1.898 9.135 -1.264 1.00 0.00 H ATOM 285 N VAL A 669 0.857 12.475 1.573 1.00129.56 N ATOM 286 CA VAL A 669 0.072 12.905 2.739 1.00134.94 C ATOM 287 C VAL A 669 -1.433 12.770 2.506 1.00139.51 C ATOM 288 O VAL A 669 -1.914 13.046 1.403 1.00135.41 O ATOM 289 CB VAL A 669 0.451 14.329 3.195 1.00142.42 C ATOM 290 H VAL A 669 1.564 13.140 1.200 1.00 0.00 H ATOM 291 N GLY A 670 -2.144 12.313 3.535 1.00140.88 N ATOM 292 CA GLY A 670 -3.584 12.083 3.483 1.00141.52 C ATOM 293 C GLY A 670 -3.926 10.850 2.671 1.00142.47 C ATOM 294 O GLY A 670 -4.729 10.921 1.737 1.00139.17 O ATOM 295 H GLY A 670 -1.646 12.109 4.425 1.00 0.00 H ATOM 296 N TYR A 671 -3.289 9.716 3.019 1.00139.84 N ATOM 297 CA TYR A 671 -3.453 8.414 2.368 1.00136.46 C ATOM 298 C TYR A 671 -4.837 7.810 2.612 1.00141.83 C ATOM 299 O TYR A 671 -5.340 7.850 3.737 1.00146.16 O ATOM 300 CB TYR A 671 -2.330 7.435 2.788 1.00137.97 C ATOM 301 CG TYR A 671 -2.209 7.210 4.283 1.00145.76 C ATOM 302 CD1 TYR A 671 -2.847 6.138 4.901 1.00149.88 C ATOM 303 CD2 TYR A 671 -1.425 8.046 5.074 1.00150.16 C ATOM 304 CE1 TYR A 671 -2.748 5.932 6.277 1.00156.16 C ATOM 305 CE2 TYR A 671 -1.318 7.849 6.451 1.00156.59 C ATOM 306 CZ TYR A 671 -1.976 6.786 7.047 1.00165.15 C ATOM 307 OH TYR A 671 -1.864 6.576 8.400 1.00170.40 O ATOM 308 HH TYR A 671 -2.395 5.780 8.654 1.00 0.00 H ATOM 309 H TYR A 671 -2.625 9.769 3.817 1.00 0.00 H ATOM 310 N THR A 672 -5.450 7.263 1.549 1.00134.59 N ATOM 311 CA THR A 672 -6.763 6.618 1.611 1.00135.35 C ATOM 312 C THR A 672 -6.610 5.140 1.989 1.00138.80 C ATOM 313 O THR A 672 -5.544 4.560 1.762 1.00136.04 O ATOM 314 CB THR A 672 -7.500 6.793 0.279 1.00140.07 C ATOM 315 H THR A 672 -4.964 7.300 0.630 1.00 0.00 H ATOM 316 N GLU A 673 -7.678 4.535 2.562 1.00137.72 N ATOM 317 CA GLU A 673 -7.723 3.128 2.986 1.00138.22 C ATOM 318 C GLU A 673 -7.398 2.150 1.847 1.00135.99 C ATOM 319 O GLU A 673 -6.687 1.168 2.074 1.00135.12 O ATOM 320 CB GLU A 673 -9.081 2.793 3.620 1.00143.75 C ATOM 321 H GLU A 673 -8.531 5.110 2.714 1.00 0.00 H ATOM 322 N ARG A 674 -7.897 2.436 0.625 1.00128.09 N ATOM 323 CA ARG A 674 -7.653 1.627 -0.573 1.00122.83 C ATOM 324 C ARG A 674 -6.208 1.797 -1.056 1.00122.27 C ATOM 325 O ARG A 674 -5.564 0.805 -1.406 1.00119.65 O ATOM 326 CB ARG A 674 -8.646 1.988 -1.689 1.00120.94 C ATOM 327 H ARG A 674 -8.492 3.284 0.528 1.00 0.00 H ATOM 328 N GLN A 675 -5.699 3.054 -1.050 1.00117.62 N ATOM 329 CA GLN A 675 -4.331 3.411 -1.451 1.00114.20 C ATOM 330 C GLN A 675 -3.303 2.772 -0.511 1.00117.87 C ATOM 331 O GLN A 675 -2.264 2.308 -0.979 1.00114.81 O ATOM 332 CB GLN A 675 -4.143 4.940 -1.495 1.00116.06 C ATOM 333 CG GLN A 675 -4.895 5.636 -2.630 1.00128.63 C ATOM 334 CD GLN A 675 -4.696 7.136 -2.639 1.00148.95 C ATOM 335 OE1 GLN A 675 -4.864 7.829 -1.627 1.00148.56 O ATOM 336 NE2 GLN A 675 -4.379 7.680 -3.803 1.00137.36 N ATOM 337 HE22 GLN A 675 -4.243 7.077 -4.639 1.00 0.00 H ATOM 338 HE21 GLN A 675 -4.266 8.711 -3.882 1.00 0.00 H ATOM 339 H GLN A 675 -6.324 3.824 -0.738 1.00 0.00 H ATOM 340 N ARG A 676 -3.607 2.737 0.806 1.00117.71 N ATOM 341 CA ARG A 676 -2.760 2.129 1.835 1.00119.62 C ATOM 342 C ARG A 676 -2.732 0.603 1.660 1.00121.29 C ATOM 343 O ARG A 676 -1.679 -0.009 1.848 1.00120.66 O ATOM 344 CB ARG A 676 -3.254 2.503 3.243 1.00124.57 C ATOM 345 CG ARG A 676 -2.226 2.239 4.336 1.00134.05 C ATOM 346 CD ARG A 676 -2.827 2.295 5.724 1.00142.06 C ATOM 347 NE ARG A 676 -1.869 1.843 6.734 1.00145.93 N ATOM 348 CZ ARG A 676 -1.863 0.628 7.276 1.00156.24 C ATOM 349 NH1 ARG A 676 -2.778 -0.268 6.926 1.00138.63 N ATOM 350 NH2 ARG A 676 -0.946 0.304 8.177 1.00144.66 N ATOM 351 HE ARG A 676 -1.143 2.518 7.050 1.00 0.00 H ATOM 352 HH12 ARG A 676 -2.768 -1.216 7.353 1.00 0.00 H ATOM 353 HH11 ARG A 676 -3.505 -0.022 6.224 1.00 0.00 H ATOM 354 HH22 ARG A 676 -0.944 -0.647 8.599 1.00 0.00 H ATOM 355 HH21 ARG A 676 -0.228 1.001 8.462 1.00 0.00 H ATOM 356 H ARG A 676 -4.502 3.171 1.109 1.00 0.00 H ATOM 357 N ARG A 677 -3.886 0.001 1.292 1.00116.31 N ATOM 358 CA ARG A 677 -4.029 -1.440 1.056 1.00114.56 C ATOM 359 C ARG A 677 -3.268 -1.867 -0.201 1.00111.55 C ATOM 360 O ARG A 677 -2.660 -2.935 -0.206 1.00110.74 O ATOM 361 CB ARG A 677 -5.510 -1.833 0.951 1.00115.90 C ATOM 362 H ARG A 677 -4.728 0.599 1.168 1.00 0.00 H ATOM 363 N ASP A 678 -3.294 -1.023 -1.254 1.00103.25 N ATOM 364 CA ASP A 678 -2.606 -1.257 -2.529 1.00 97.66 C ATOM 365 C ASP A 678 -1.081 -1.193 -2.373 1.00 98.24 C ATOM 366 O ASP A 678 -0.373 -2.008 -2.963 1.00 95.22 O ATOM 367 CB ASP A 678 -3.082 -0.254 -3.592 1.00 97.01 C ATOM 368 CG ASP A 678 -4.223 -0.768 -4.443 1.00108.39 C ATOM 369 OD1 ASP A 678 -3.953 -1.272 -5.558 1.00105.99 O ATOM 370 OD2 ASP A 678 -5.388 -0.663 -4.000 1.00117.36 O ATOM 371 H ASP A 678 -3.841 -0.144 -1.155 1.00 0.00 H ATOM 372 N PHE A 679 -0.591 -0.227 -1.573 1.00 95.38 N ATOM 373 CA PHE A 679 0.821 0.020 -1.270 1.00 94.72 C ATOM 374 C PHE A 679 1.413 -1.135 -0.458 1.00 99.21 C ATOM 375 O PHE A 679 2.511 -1.603 -0.769 1.00 97.19 O ATOM 376 CB PHE A 679 0.937 1.344 -0.501 1.00 99.40 C ATOM 377 CG PHE A 679 2.313 1.857 -0.156 1.00101.95 C ATOM 378 CD1 PHE A 679 3.033 2.626 -1.062 1.00102.35 C ATOM 379 CD2 PHE A 679 2.844 1.667 1.115 1.00108.24 C ATOM 380 CE1 PHE A 679 4.284 3.150 -0.721 1.00104.71 C ATOM 381 CE2 PHE A 679 4.097 2.186 1.452 1.00112.47 C ATOM 382 CZ PHE A 679 4.807 2.926 0.534 1.00107.84 C ATOM 383 H PHE A 679 -1.284 0.407 -1.126 1.00 0.00 H ATOM 384 N LEU A 680 0.678 -1.602 0.570 1.00 98.52 N ATOM 385 CA LEU A 680 1.116 -2.701 1.431 1.00100.44 C ATOM 386 C LEU A 680 1.051 -4.061 0.741 1.00 99.93 C ATOM 387 O LEU A 680 1.871 -4.928 1.049 1.00100.37 O ATOM 388 CB LEU A 680 0.371 -2.716 2.775 1.00105.69 C ATOM 389 CG LEU A 680 0.652 -1.546 3.735 1.00114.11 C ATOM 390 CD1 LEU A 680 -0.225 -1.639 4.961 1.00119.55 C ATOM 391 CD2 LEU A 680 2.122 -1.485 4.151 1.00117.65 C ATOM 392 H LEU A 680 -0.244 -1.161 0.761 1.00 0.00 H ATOM 393 N SER A 681 0.099 -4.247 -0.201 1.00 92.44 N ATOM 394 CA SER A 681 -0.012 -5.489 -0.976 1.00 89.51 C ATOM 395 C SER A 681 1.172 -5.597 -1.955 1.00 87.43 C ATOM 396 O SER A 681 1.572 -6.707 -2.308 1.00 85.58 O ATOM 397 CB SER A 681 -1.344 -5.562 -1.718 1.00 92.59 C ATOM 398 OG SER A 681 -1.488 -4.502 -2.649 1.00101.79 O ATOM 399 HG SER A 681 -1.445 -3.636 -2.171 1.00 0.00 H ATOM 400 H SER A 681 -0.580 -3.481 -0.384 1.00 0.00 H ATOM 401 N GLU A 682 1.745 -4.438 -2.360 1.00 80.75 N ATOM 402 CA GLU A 682 2.931 -4.355 -3.215 1.00 76.92 C ATOM 403 C GLU A 682 4.172 -4.693 -2.379 1.00 81.04 C ATOM 404 O GLU A 682 5.056 -5.402 -2.860 1.00 78.50 O ATOM 405 CB GLU A 682 3.046 -2.972 -3.881 1.00 76.54 C ATOM 406 CG GLU A 682 2.065 -2.808 -5.038 1.00 84.45 C ATOM 407 CD GLU A 682 2.045 -1.508 -5.827 1.00 96.35 C ATOM 408 OE1 GLU A 682 2.577 -0.483 -5.343 1.00 71.85 O ATOM 409 OE2 GLU A 682 1.497 -1.526 -6.953 1.00 91.73 O ATOM 410 H GLU A 682 1.313 -3.547 -2.042 1.00 0.00 H ATOM 411 N ALA A 683 4.205 -4.232 -1.105 1.00 80.29 N ATOM 412 CA ALA A 683 5.288 -4.505 -0.158 1.00 83.14 C ATOM 413 C ALA A 683 5.333 -6.001 0.186 1.00 88.03 C ATOM 414 O ALA A 683 6.421 -6.560 0.328 1.00 88.14 O ATOM 415 CB ALA A 683 5.093 -3.684 1.111 1.00 88.45 C ATOM 416 H ALA A 683 3.410 -3.647 -0.779 1.00 0.00 H ATOM 417 N SER A 684 4.145 -6.642 0.300 1.00 85.32 N ATOM 418 CA SER A 684 3.991 -8.070 0.591 1.00 86.61 C ATOM 419 C SER A 684 4.516 -8.932 -0.560 1.00 85.51 C ATOM 420 O SER A 684 5.087 -9.988 -0.305 1.00 86.23 O ATOM 421 CB SER A 684 2.533 -8.410 0.881 1.00 92.62 C ATOM 422 OG SER A 684 2.094 -7.829 2.098 1.00109.80 O ATOM 423 HG SER A 684 2.181 -6.844 2.043 1.00 0.00 H ATOM 424 H SER A 684 3.279 -6.080 0.172 1.00 0.00 H ATOM 425 N ILE A 685 4.342 -8.477 -1.819 1.00 77.70 N ATOM 426 CA ILE A 685 4.829 -9.198 -3.003 1.00 73.39 C ATOM 427 C ILE A 685 6.372 -9.235 -3.014 1.00 76.55 C ATOM 428 O ILE A 685 6.952 -10.316 -3.122 1.00 76.11 O ATOM 429 CB ILE A 685 4.213 -8.646 -4.324 1.00 72.29 C ATOM 430 CG1 ILE A 685 2.713 -9.022 -4.435 1.00 73.10 C ATOM 431 CG2 ILE A 685 4.992 -9.144 -5.551 1.00 68.56 C ATOM 432 CD1 ILE A 685 1.871 -8.156 -5.423 1.00 78.27 C ATOM 433 H ILE A 685 3.841 -7.576 -1.957 1.00 0.00 H ATOM 434 N MET A 686 7.019 -8.063 -2.864 1.00 73.36 N ATOM 435 CA MET A 686 8.480 -7.914 -2.843 1.00 74.29 C ATOM 436 C MET A 686 9.167 -8.745 -1.746 1.00 82.08 C ATOM 437 O MET A 686 10.278 -9.231 -1.961 1.00 81.64 O ATOM 438 CB MET A 686 8.866 -6.440 -2.672 1.00 77.62 C ATOM 439 CG MET A 686 8.453 -5.556 -3.829 1.00 77.99 C ATOM 440 SD MET A 686 8.662 -3.821 -3.374 1.00 84.42 S ATOM 441 CE MET A 686 10.358 -3.590 -3.820 1.00 80.83 C ATOM 442 H MET A 686 6.444 -7.203 -2.755 1.00 0.00 H ATOM 443 N GLY A 687 8.499 -8.889 -0.598 1.00 82.17 N ATOM 444 CA GLY A 687 8.996 -9.629 0.561 1.00 86.57 C ATOM 445 C GLY A 687 9.089 -11.132 0.381 1.00 90.21 C ATOM 446 O GLY A 687 9.861 -11.790 1.085 1.00 92.96 O ATOM 447 H GLY A 687 7.562 -8.445 -0.524 1.00 0.00 H ATOM 448 N GLN A 688 8.304 -11.683 -0.564 1.00 83.09 N ATOM 449 CA GLN A 688 8.256 -13.111 -0.890 1.00 81.92 C ATOM 450 C GLN A 688 9.521 -13.580 -1.601 1.00 81.80 C ATOM 451 O GLN A 688 9.841 -14.769 -1.540 1.00 83.16 O ATOM 452 CB GLN A 688 7.046 -13.419 -1.795 1.00 80.45 C ATOM 453 CG GLN A 688 5.678 -13.176 -1.154 1.00104.36 C ATOM 454 CD GLN A 688 4.513 -13.535 -2.056 1.00124.62 C ATOM 455 OE1 GLN A 688 3.536 -14.150 -1.618 1.00124.81 O ATOM 456 NE2 GLN A 688 4.567 -13.141 -3.326 1.00110.17 N ATOM 457 HE22 GLN A 688 5.399 -12.624 -3.675 1.00 0.00 H ATOM 458 HE21 GLN A 688 3.777 -13.350 -3.969 1.00 0.00 H ATOM 459 H GLN A 688 7.684 -11.046 -1.104 1.00 0.00 H ATOM 460 N PHE A 689 10.224 -12.664 -2.290 1.00 73.50 N ATOM 461 CA PHE A 689 11.401 -12.989 -3.095 1.00 70.87 C ATOM 462 C PHE A 689 12.741 -12.756 -2.407 1.00 77.50 C ATOM 463 O PHE A 689 12.868 -11.868 -1.567 1.00 80.51 O ATOM 464 CB PHE A 689 11.362 -12.246 -4.447 1.00 68.06 C ATOM 465 CG PHE A 689 10.019 -12.232 -5.142 1.00 66.50 C ATOM 466 CD1 PHE A 689 9.354 -13.419 -5.437 1.00 68.57 C ATOM 467 CD2 PHE A 689 9.428 -11.032 -5.521 1.00 65.75 C ATOM 468 CE1 PHE A 689 8.105 -13.400 -6.063 1.00 66.89 C ATOM 469 CE2 PHE A 689 8.183 -11.017 -6.149 1.00 65.75 C ATOM 470 CZ PHE A 689 7.531 -12.200 -6.416 1.00 63.41 C ATOM 471 H PHE A 689 9.914 -11.672 -2.248 1.00 0.00 H ATOM 472 N ASP A 690 13.738 -13.579 -2.779 1.00 72.71 N ATOM 473 CA ASP A 690 15.123 -13.550 -2.312 1.00 74.42 C ATOM 474 C ASP A 690 15.989 -14.162 -3.410 1.00 73.85 C ATOM 475 O ASP A 690 16.026 -15.386 -3.566 1.00 74.12 O ATOM 476 CB ASP A 690 15.286 -14.305 -0.969 1.00 81.28 C ATOM 477 CG ASP A 690 16.723 -14.482 -0.498 1.00 95.77 C ATOM 478 OD1 ASP A 690 17.530 -13.537 -0.669 1.00 95.57 O ATOM 479 OD2 ASP A 690 17.032 -15.554 0.077 1.00106.84 O ATOM 480 H ASP A 690 13.498 -14.315 -3.473 1.00 0.00 H ATOM 481 N HIS A 691 16.659 -13.305 -4.190 1.00 67.31 N ATOM 482 CA HIS A 691 17.505 -13.702 -5.326 1.00 64.93 C ATOM 483 C HIS A 691 18.517 -12.578 -5.607 1.00 69.75 C ATOM 484 O HIS A 691 18.155 -11.412 -5.424 1.00 68.89 O ATOM 485 CB HIS A 691 16.621 -13.940 -6.576 1.00 60.76 C ATOM 486 CG HIS A 691 17.353 -14.532 -7.745 1.00 61.83 C ATOM 487 ND1 HIS A 691 17.999 -13.734 -8.671 1.00 61.41 N ATOM 488 CD2 HIS A 691 17.566 -15.831 -8.066 1.00 62.83 C ATOM 489 CE1 HIS A 691 18.577 -14.568 -9.521 1.00 59.35 C ATOM 490 NE2 HIS A 691 18.335 -15.839 -9.204 1.00 60.51 N ATOM 491 H HIS A 691 16.576 -12.290 -3.979 1.00 0.00 H ATOM 492 N PRO A 692 19.759 -12.860 -6.084 1.00 67.65 N ATOM 493 CA PRO A 692 20.698 -11.751 -6.345 1.00 68.49 C ATOM 494 C PRO A 692 20.293 -10.801 -7.481 1.00 67.43 C ATOM 495 O PRO A 692 20.876 -9.723 -7.588 1.00 67.43 O ATOM 496 CB PRO A 692 22.033 -12.458 -6.614 1.00 72.55 C ATOM 497 CG PRO A 692 21.666 -13.828 -7.037 1.00 75.56 C ATOM 498 CD PRO A 692 20.403 -14.173 -6.309 1.00 70.79 C ATOM 499 N ASN A 693 19.279 -11.164 -8.300 1.00 59.57 N ATOM 500 CA ASN A 693 18.813 -10.319 -9.403 1.00 55.81 C ATOM 501 C ASN A 693 17.385 -9.785 -9.219 1.00 57.11 C ATOM 502 O ASN A 693 16.733 -9.387 -10.195 1.00 53.25 O ATOM 503 CB ASN A 693 18.974 -11.037 -10.734 1.00 53.65 C ATOM 504 CG ASN A 693 20.404 -11.415 -10.998 1.00 67.29 C ATOM 505 OD1 ASN A 693 20.796 -12.568 -10.828 1.00 60.49 O ATOM 506 ND2 ASN A 693 21.218 -10.435 -11.354 1.00 56.20 N ATOM 507 HD22 ASN A 693 20.846 -9.473 -11.488 1.00 0.00 H ATOM 508 HD21 ASN A 693 22.230 -10.627 -11.500 1.00 0.00 H ATOM 509 H ASN A 693 18.812 -12.079 -8.140 1.00 0.00 H ATOM 510 N ILE A 694 16.911 -9.769 -7.964 1.00 55.34 N ATOM 511 CA ILE A 694 15.605 -9.237 -7.579 1.00 54.33 C ATOM 512 C ILE A 694 15.908 -8.204 -6.513 1.00 60.92 C ATOM 513 O ILE A 694 16.742 -8.465 -5.652 1.00 63.71 O ATOM 514 CB ILE A 694 14.621 -10.340 -7.057 1.00 57.53 C ATOM 515 CG1 ILE A 694 14.351 -11.457 -8.120 1.00 54.45 C ATOM 516 CG2 ILE A 694 13.294 -9.728 -6.523 1.00 57.38 C ATOM 517 CD1 ILE A 694 13.730 -10.982 -9.473 1.00 56.03 C ATOM 518 H ILE A 694 17.514 -10.162 -7.213 1.00 0.00 H ATOM 519 N ILE A 695 15.269 -7.022 -6.582 1.00 55.78 N ATOM 520 CA ILE A 695 15.488 -5.984 -5.575 1.00 59.55 C ATOM 521 C ILE A 695 15.205 -6.528 -4.152 1.00 67.28 C ATOM 522 O ILE A 695 14.218 -7.237 -3.941 1.00 65.98 O ATOM 523 CB ILE A 695 14.706 -4.687 -5.934 1.00 61.01 C ATOM 524 CG1 ILE A 695 15.115 -3.495 -5.054 1.00 65.23 C ATOM 525 CG2 ILE A 695 13.198 -4.899 -5.927 1.00 60.43 C ATOM 526 CD1 ILE A 695 16.524 -2.992 -5.282 1.00 76.27 C ATOM 527 H ILE A 695 14.608 -6.843 -7.365 1.00 0.00 H ATOM 528 N ARG A 696 16.108 -6.250 -3.207 1.00 69.54 N ATOM 529 CA ARG A 696 15.955 -6.727 -1.836 1.00 74.32 C ATOM 530 C ARG A 696 15.131 -5.748 -1.001 1.00 80.76 C ATOM 531 O ARG A 696 15.459 -4.560 -0.933 1.00 80.64 O ATOM 532 CB ARG A 696 17.328 -6.972 -1.184 1.00 79.47 C ATOM 533 CG ARG A 696 17.284 -7.785 0.112 1.00 98.38 C ATOM 534 CD ARG A 696 18.378 -7.388 1.098 1.00118.99 C ATOM 535 NE ARG A 696 19.725 -7.494 0.531 1.00133.77 N ATOM 536 CZ ARG A 696 20.490 -8.581 0.594 1.00155.05 C ATOM 537 NH1 ARG A 696 20.051 -9.675 1.205 1.00146.19 N ATOM 538 NH2 ARG A 696 21.698 -8.581 0.048 1.00145.22 N ATOM 539 HE ARG A 696 20.111 -6.660 0.044 1.00 0.00 H ATOM 540 HH12 ARG A 696 20.653 -10.522 1.251 1.00 0.00 H ATOM 541 HH11 ARG A 696 19.105 -9.685 1.637 1.00 0.00 H ATOM 542 HH22 ARG A 696 22.292 -9.433 0.100 1.00 0.00 H ATOM 543 HH21 ARG A 696 22.052 -7.729 -0.432 1.00 0.00 H ATOM 544 H ARG A 696 16.941 -5.679 -3.455 1.00 0.00 H ATOM 545 N LEU A 697 14.067 -6.260 -0.362 1.00 79.46 N ATOM 546 CA LEU A 697 13.234 -5.481 0.550 1.00 82.42 C ATOM 547 C LEU A 697 13.897 -5.571 1.928 1.00 91.19 C ATOM 548 O LEU A 697 14.035 -6.669 2.475 1.00 92.62 O ATOM 549 CB LEU A 697 11.785 -6.017 0.587 1.00 81.54 C ATOM 550 CG LEU A 697 10.829 -5.341 1.585 1.00 88.92 C ATOM 551 CD1 LEU A 697 10.070 -4.205 0.939 1.00 85.98 C ATOM 552 CD2 LEU A 697 9.858 -6.338 2.165 1.00 92.64 C ATOM 553 H LEU A 697 13.825 -7.258 -0.524 1.00 0.00 H ATOM 554 N GLU A 698 14.359 -4.425 2.449 1.00 90.70 N ATOM 555 CA GLU A 698 15.025 -4.326 3.756 1.00 96.31 C ATOM 556 C GLU A 698 14.021 -4.285 4.905 1.00103.67 C ATOM 557 O GLU A 698 14.289 -4.851 5.965 1.00107.80 O ATOM 558 CB GLU A 698 15.976 -3.115 3.822 1.00 99.46 C ATOM 559 CG GLU A 698 17.103 -3.143 2.798 1.00109.48 C ATOM 560 CD GLU A 698 18.365 -3.902 3.163 1.00140.34 C ATOM 561 OE1 GLU A 698 18.266 -5.060 3.631 1.00141.78 O ATOM 562 OE2 GLU A 698 19.464 -3.356 2.914 1.00138.40 O ATOM 563 H GLU A 698 14.239 -3.553 1.895 1.00 0.00 H ATOM 564 N GLY A 699 12.884 -3.626 4.682 1.00 98.77 N ATOM 565 CA GLY A 699 11.825 -3.494 5.677 1.00102.45 C ATOM 566 C GLY A 699 10.646 -2.643 5.252 1.00104.96 C ATOM 567 O GLY A 699 10.673 -2.020 4.187 1.00100.24 O ATOM 568 H GLY A 699 12.745 -3.183 3.751 1.00 0.00 H ATOM 569 N VAL A 700 9.586 -2.635 6.087 1.00105.28 N ATOM 570 CA VAL A 700 8.334 -1.900 5.874 1.00104.48 C ATOM 571 C VAL A 700 7.898 -1.222 7.184 1.00115.86 C ATOM 572 O VAL A 700 7.965 -1.849 8.245 1.00119.97 O ATOM 573 CB VAL A 700 7.219 -2.828 5.287 1.00105.81 C ATOM 574 CG1 VAL A 700 5.851 -2.147 5.268 1.00105.74 C ATOM 575 CG2 VAL A 700 7.578 -3.315 3.886 1.00 99.68 C ATOM 576 H VAL A 700 9.663 -3.199 6.957 1.00 0.00 H ATOM 577 N VAL A 701 7.474 0.060 7.104 1.00113.71 N ATOM 578 CA VAL A 701 6.977 0.833 8.249 1.00119.66 C ATOM 579 C VAL A 701 5.440 0.815 8.181 1.00125.32 C ATOM 580 O VAL A 701 4.863 1.225 7.171 1.00120.01 O ATOM 581 CB VAL A 701 7.568 2.273 8.329 1.00124.60 C ATOM 582 CG1 VAL A 701 7.007 3.041 9.526 1.00130.08 C ATOM 583 CG2 VAL A 701 9.094 2.245 8.387 1.00125.38 C ATOM 584 H VAL A 701 7.502 0.526 6.175 1.00 0.00 H ATOM 585 N THR A 702 4.791 0.299 9.243 1.00128.73 N ATOM 586 CA THR A 702 3.331 0.162 9.327 1.00129.72 C ATOM 587 C THR A 702 2.737 0.818 10.572 1.00140.75 C ATOM 588 O THR A 702 1.637 1.368 10.499 1.00140.63 O ATOM 589 CB THR A 702 2.909 -1.320 9.243 1.00139.96 C ATOM 590 OG1 THR A 702 3.690 -2.099 10.154 1.00145.03 O ATOM 591 CG2 THR A 702 3.021 -1.888 7.838 1.00132.53 C ATOM 592 HG1 THR A 702 3.414 -3.048 10.095 1.00 0.00 H ATOM 593 H THR A 702 5.359 -0.022 10.053 1.00 0.00 H ATOM 594 N LYS A 703 3.457 0.740 11.710 1.00143.16 N ATOM 595 CA LYS A 703 3.049 1.272 13.012 1.00149.94 C ATOM 596 C LYS A 703 2.875 2.795 13.060 1.00154.89 C ATOM 597 O LYS A 703 2.061 3.277 13.850 1.00156.85 O ATOM 598 CB LYS A 703 4.022 0.811 14.106 1.00154.71 C ATOM 599 H LYS A 703 4.379 0.262 11.658 1.00 0.00 H ATOM 600 N SER A 704 3.636 3.547 12.239 1.00147.58 N ATOM 601 CA SER A 704 3.565 5.011 12.218 1.00148.22 C ATOM 602 C SER A 704 3.421 5.607 10.820 1.00145.55 C ATOM 603 O SER A 704 4.041 5.125 9.870 1.00140.03 O ATOM 604 CB SER A 704 4.766 5.621 12.934 1.00155.39 C ATOM 605 OG SER A 704 5.989 5.229 12.334 1.00160.22 O ATOM 606 HG SER A 704 6.003 5.528 11.390 1.00 0.00 H ATOM 607 H SER A 704 4.299 3.070 11.596 1.00 0.00 H ATOM 608 N ARG A 705 2.607 6.675 10.710 1.00142.64 N ATOM 609 CA ARG A 705 2.357 7.406 9.467 1.00136.95 C ATOM 610 C ARG A 705 3.467 8.449 9.232 1.00139.29 C ATOM 611 O ARG A 705 3.856 9.129 10.188 1.00144.51 O ATOM 612 CB ARG A 705 0.980 8.088 9.506 1.00139.08 C ATOM 613 H ARG A 705 2.122 7.003 11.569 1.00 0.00 H ATOM 614 N PRO A 706 4.010 8.595 7.998 1.00128.19 N ATOM 615 CA PRO A 706 3.661 7.878 6.756 1.00121.06 C ATOM 616 C PRO A 706 4.210 6.457 6.684 1.00121.86 C ATOM 617 O PRO A 706 5.220 6.152 7.324 1.00123.76 O ATOM 618 CB PRO A 706 4.263 8.773 5.666 1.00119.10 C ATOM 619 CG PRO A 706 5.474 9.369 6.316 1.00127.48 C ATOM 620 CD PRO A 706 5.076 9.592 7.760 1.00129.60 C ATOM 621 N VAL A 707 3.534 5.590 5.903 1.00113.51 N ATOM 622 CA VAL A 707 3.954 4.205 5.678 1.00111.01 C ATOM 623 C VAL A 707 5.156 4.205 4.734 1.00110.43 C ATOM 624 O VAL A 707 5.237 5.064 3.853 1.00107.81 O ATOM 625 CB VAL A 707 2.814 3.256 5.211 1.00112.57 C ATOM 626 CG1 VAL A 707 1.890 2.896 6.370 1.00117.26 C ATOM 627 CG2 VAL A 707 2.020 3.838 4.040 1.00108.17 C ATOM 628 H VAL A 707 2.667 5.923 5.435 1.00 0.00 H ATOM 629 N MET A 708 6.109 3.282 4.940 1.00105.90 N ATOM 630 CA MET A 708 7.329 3.236 4.128 1.00101.61 C ATOM 631 C MET A 708 7.665 1.847 3.596 1.00100.07 C ATOM 632 O MET A 708 7.310 0.841 4.210 1.00100.97 O ATOM 633 CB MET A 708 8.533 3.779 4.934 1.00108.18 C ATOM 634 CG MET A 708 8.435 5.247 5.312 1.00114.29 C ATOM 635 SD MET A 708 9.820 5.764 6.358 1.00124.53 S ATOM 636 CE MET A 708 9.188 7.319 6.986 1.00124.85 C ATOM 637 H MET A 708 5.978 2.580 5.696 1.00 0.00 H ATOM 638 N ILE A 709 8.364 1.809 2.448 1.00 91.00 N ATOM 639 CA ILE A 709 8.902 0.607 1.814 1.00 87.42 C ATOM 640 C ILE A 709 10.403 0.868 1.703 1.00 91.24 C ATOM 641 O ILE A 709 10.816 1.827 1.050 1.00 89.57 O ATOM 642 CB ILE A 709 8.237 0.246 0.455 1.00 84.96 C ATOM 643 CG1 ILE A 709 6.775 -0.219 0.657 1.00 85.17 C ATOM 644 CG2 ILE A 709 9.055 -0.828 -0.288 1.00 82.81 C ATOM 645 CD1 ILE A 709 5.917 -0.382 -0.669 1.00 82.30 C ATOM 646 H ILE A 709 8.537 2.715 1.969 1.00 0.00 H ATOM 647 N LEU A 710 11.207 0.064 2.408 1.00 89.93 N ATOM 648 CA LEU A 710 12.658 0.216 2.443 1.00 90.88 C ATOM 649 C LEU A 710 13.347 -0.879 1.659 1.00 90.56 C ATOM 650 O LEU A 710 13.103 -2.059 1.902 1.00 90.62 O ATOM 651 CB LEU A 710 13.180 0.285 3.893 1.00 97.01 C ATOM 652 CG LEU A 710 13.282 1.682 4.494 1.00105.91 C ATOM 653 CD1 LEU A 710 11.955 2.133 5.090 1.00107.68 C ATOM 654 CD2 LEU A 710 14.328 1.719 5.581 1.00114.72 C ATOM 655 H LEU A 710 10.777 -0.707 2.958 1.00 0.00 H ATOM 656 N THR A 711 14.175 -0.479 0.688 1.00 83.40 N ATOM 657 CA THR A 711 14.931 -1.384 -0.182 1.00 80.20 C ATOM 658 C THR A 711 16.408 -0.999 -0.162 1.00 84.65 C ATOM 659 O THR A 711 16.722 0.139 0.166 1.00 84.22 O ATOM 660 CB THR A 711 14.397 -1.329 -1.627 1.00 81.81 C ATOM 661 OG1 THR A 711 14.419 0.021 -2.087 1.00 81.72 O ATOM 662 CG2 THR A 711 12.998 -1.915 -1.772 1.00 78.14 C ATOM 663 HG1 THR A 711 14.076 0.058 -3.015 1.00 0.00 H ATOM 664 H THR A 711 14.290 0.544 0.540 1.00 0.00 H ATOM 665 N GLU A 712 17.304 -1.936 -0.536 1.00 82.03 N ATOM 666 CA GLU A 712 18.755 -1.713 -0.631 1.00 84.16 C ATOM 667 C GLU A 712 19.011 -0.675 -1.742 1.00 86.73 C ATOM 668 O GLU A 712 18.471 -0.821 -2.835 1.00 82.27 O ATOM 669 CB GLU A 712 19.502 -3.039 -0.929 1.00 84.89 C ATOM 670 CG GLU A 712 18.951 -3.788 -2.144 1.00 92.24 C ATOM 671 CD GLU A 712 19.800 -4.844 -2.826 1.00105.89 C ATOM 672 OE1 GLU A 712 21.039 -4.857 -2.641 1.00101.42 O ATOM 673 OE2 GLU A 712 19.214 -5.636 -3.597 1.00 93.22 O ATOM 674 H GLU A 712 16.944 -2.882 -0.774 1.00 0.00 H ATOM 675 N PHE A 713 19.779 0.389 -1.445 1.00 87.61 N ATOM 676 CA PHE A 713 20.067 1.449 -2.415 1.00 85.38 C ATOM 677 C PHE A 713 20.948 0.968 -3.565 1.00 84.54 C ATOM 678 O PHE A 713 22.002 0.367 -3.345 1.00 85.64 O ATOM 679 CB PHE A 713 20.649 2.703 -1.730 1.00 92.06 C ATOM 680 CG PHE A 713 20.751 3.914 -2.633 1.00 92.64 C ATOM 681 CD1 PHE A 713 19.609 4.595 -3.045 1.00 92.72 C ATOM 682 CD2 PHE A 713 21.990 4.394 -3.043 1.00 97.08 C ATOM 683 CE1 PHE A 713 19.703 5.712 -3.881 1.00 92.54 C ATOM 684 CE2 PHE A 713 22.082 5.513 -3.879 1.00 98.75 C ATOM 685 CZ PHE A 713 20.938 6.164 -4.292 1.00 93.60 C ATOM 686 H PHE A 713 20.184 0.462 -0.490 1.00 0.00 H ATOM 687 N MET A 714 20.443 1.183 -4.768 1.00 76.33 N ATOM 688 CA MET A 714 21.102 0.783 -5.975 1.00 73.31 C ATOM 689 C MET A 714 21.685 2.006 -6.571 1.00 79.58 C ATOM 690 O MET A 714 21.019 2.823 -7.146 1.00 76.24 O ATOM 691 CB MET A 714 20.134 0.085 -6.925 1.00 70.18 C ATOM 692 CG MET A 714 19.334 -1.005 -6.249 1.00 72.85 C ATOM 693 SD MET A 714 20.209 -2.553 -5.977 1.00 77.92 S ATOM 694 CE MET A 714 21.340 -2.465 -7.322 1.00 70.58 C ATOM 695 H MET A 714 19.524 1.665 -4.841 1.00 0.00 H ATOM 696 N GLU A 715 22.979 2.103 -6.399 1.00 81.94 N ATOM 697 CA GLU A 715 23.775 3.219 -6.830 1.00 84.22 C ATOM 698 C GLU A 715 23.585 3.780 -8.213 1.00 83.27 C ATOM 699 O GLU A 715 23.561 4.979 -8.374 1.00 83.04 O ATOM 700 CB GLU A 715 25.247 2.862 -6.626 1.00 90.05 C ATOM 701 CG GLU A 715 25.653 2.730 -5.173 1.00108.55 C ATOM 702 CD GLU A 715 25.315 1.378 -4.571 1.00148.17 C ATOM 703 OE1 GLU A 715 24.978 0.439 -5.329 1.00154.31 O ATOM 704 OE2 GLU A 715 25.394 1.249 -3.324 1.00148.79 O ATOM 705 H GLU A 715 23.464 1.319 -5.918 1.00 0.00 H ATOM 706 N ASN A 716 23.482 2.932 -9.219 1.00 75.97 N ATOM 707 CA ASN A 716 23.374 3.424 -10.587 1.00 72.85 C ATOM 708 C ASN A 716 21.965 3.686 -11.098 1.00 71.98 C ATOM 709 O ASN A 716 21.747 4.026 -12.228 1.00 68.58 O ATOM 710 CB ASN A 716 24.181 2.558 -11.533 1.00 71.79 C ATOM 711 CG ASN A 716 25.659 2.807 -11.420 1.00 91.34 C ATOM 712 OD1 ASN A 716 26.125 3.909 -11.647 1.00 87.57 O ATOM 713 ND2 ASN A 716 26.404 1.776 -11.096 1.00 81.94 N ATOM 714 HD22 ASN A 716 25.962 0.853 -10.911 1.00 0.00 H ATOM 715 HD21 ASN A 716 27.436 1.882 -11.025 1.00 0.00 H ATOM 716 H ASN A 716 23.478 1.908 -9.035 1.00 0.00 H ATOM 717 N CYS A 717 21.040 3.551 -10.189 1.00 68.54 N ATOM 718 CA CYS A 717 19.613 3.819 -10.411 1.00 65.77 C ATOM 719 C CYS A 717 18.988 2.945 -11.537 1.00 64.41 C ATOM 720 O CYS A 717 19.442 1.818 -11.719 1.00 62.34 O ATOM 721 CB CYS A 717 19.384 5.315 -10.633 1.00 67.41 C ATOM 722 SG CYS A 717 20.332 6.393 -9.502 1.00 77.40 S ATOM 723 H CYS A 717 21.332 3.232 -9.243 1.00 0.00 H ATOM 724 N ALA A 718 17.954 3.446 -12.258 1.00 58.52 N ATOM 725 CA ALA A 718 17.271 2.716 -13.338 1.00 54.83 C ATOM 726 C ALA A 718 18.181 2.450 -14.535 1.00 58.47 C ATOM 727 O ALA A 718 18.953 3.320 -14.934 1.00 60.39 O ATOM 728 CB ALA A 718 16.029 3.470 -13.780 1.00 53.79 C ATOM 729 H ALA A 718 17.623 4.406 -12.034 1.00 0.00 H ATOM 730 N LEU A 719 18.076 1.241 -15.106 1.00 53.22 N ATOM 731 CA LEU A 719 18.873 0.767 -16.233 1.00 51.68 C ATOM 732 C LEU A 719 18.810 1.643 -17.485 1.00 53.74 C ATOM 733 O LEU A 719 19.858 1.879 -18.098 1.00 55.97 O ATOM 734 CB LEU A 719 18.499 -0.694 -16.579 1.00 49.07 C ATOM 735 CG LEU A 719 19.276 -1.378 -17.715 1.00 52.56 C ATOM 736 CD1 LEU A 719 20.797 -1.415 -17.446 1.00 55.06 C ATOM 737 CD2 LEU A 719 18.759 -2.785 -17.943 1.00 51.66 C ATOM 738 H LEU A 719 17.369 0.588 -14.713 1.00 0.00 H ATOM 739 N ASP A 720 17.611 2.088 -17.880 1.00 48.63 N ATOM 740 CA ASP A 720 17.435 2.900 -19.092 1.00 48.56 C ATOM 741 C ASP A 720 18.166 4.255 -19.006 1.00 56.68 C ATOM 742 O ASP A 720 18.894 4.602 -19.937 1.00 57.13 O ATOM 743 CB ASP A 720 15.954 3.063 -19.469 1.00 47.32 C ATOM 744 CG ASP A 720 15.117 3.837 -18.472 1.00 63.05 C ATOM 745 OD1 ASP A 720 15.385 3.727 -17.252 1.00 64.57 O ATOM 746 OD2 ASP A 720 14.177 4.535 -18.906 1.00 72.97 O ATOM 747 H ASP A 720 16.775 1.851 -17.309 1.00 0.00 H ATOM 748 N SER A 721 18.017 4.979 -17.877 1.00 56.18 N ATOM 749 CA SER A 721 18.697 6.265 -17.670 1.00 59.39 C ATOM 750 C SER A 721 20.213 6.062 -17.556 1.00 65.30 C ATOM 751 O SER A 721 20.972 6.837 -18.133 1.00 67.54 O ATOM 752 CB SER A 721 18.128 7.005 -16.460 1.00 65.27 C ATOM 753 OG SER A 721 18.230 6.247 -15.266 1.00 77.81 O ATOM 754 HG SER A 721 17.729 5.400 -15.371 1.00 0.00 H ATOM 755 H SER A 721 17.398 4.613 -17.126 1.00 0.00 H ATOM 756 N PHE A 722 20.647 4.975 -16.885 1.00 60.76 N ATOM 757 CA PHE A 722 22.052 4.624 -16.729 1.00 62.96 C ATOM 758 C PHE A 722 22.734 4.379 -18.069 1.00 65.28 C ATOM 759 O PHE A 722 23.861 4.812 -18.251 1.00 66.33 O ATOM 760 CB PHE A 722 22.223 3.426 -15.778 1.00 65.48 C ATOM 761 CG PHE A 722 23.640 2.926 -15.587 1.00 70.57 C ATOM 762 CD1 PHE A 722 24.593 3.710 -14.941 1.00 77.72 C ATOM 763 CD2 PHE A 722 24.009 1.653 -16.012 1.00 72.16 C ATOM 764 CE1 PHE A 722 25.899 3.249 -14.767 1.00 81.92 C ATOM 765 CE2 PHE A 722 25.311 1.184 -15.818 1.00 77.95 C ATOM 766 CZ PHE A 722 26.245 1.984 -15.188 1.00 80.36 C ATOM 767 H PHE A 722 19.936 4.351 -16.453 1.00 0.00 H ATOM 768 N LEU A 723 22.045 3.727 -19.020 1.00 59.66 N ATOM 769 CA LEU A 723 22.632 3.443 -20.329 1.00 58.79 C ATOM 770 C LEU A 723 22.724 4.653 -21.255 1.00 61.66 C ATOM 771 O LEU A 723 23.714 4.768 -21.979 1.00 62.87 O ATOM 772 CB LEU A 723 21.912 2.283 -21.023 1.00 55.22 C ATOM 773 CG LEU A 723 22.282 0.882 -20.507 1.00 59.42 C ATOM 774 CD1 LEU A 723 21.433 -0.166 -21.157 1.00 56.16 C ATOM 775 CD2 LEU A 723 23.777 0.572 -20.698 1.00 65.19 C ATOM 776 H LEU A 723 21.072 3.417 -18.821 1.00 0.00 H ATOM 777 N ARG A 724 21.707 5.538 -21.241 1.00 57.04 N ATOM 778 CA ARG A 724 21.651 6.740 -22.077 1.00 58.48 C ATOM 779 C ARG A 724 22.802 7.698 -21.820 1.00 69.63 C ATOM 780 O ARG A 724 23.304 8.311 -22.761 1.00 72.39 O ATOM 781 CB ARG A 724 20.322 7.472 -21.889 1.00 57.55 C ATOM 782 CG ARG A 724 19.232 6.938 -22.790 1.00 61.36 C ATOM 783 CD ARG A 724 18.008 7.831 -22.787 1.00 70.28 C ATOM 784 NE ARG A 724 17.302 7.814 -21.503 1.00 76.53 N ATOM 785 CZ ARG A 724 16.389 6.911 -21.162 1.00 79.56 C ATOM 786 NH1 ARG A 724 16.071 5.931 -21.995 1.00 62.51 N ATOM 787 NH2 ARG A 724 15.790 6.979 -19.982 1.00 61.19 N ATOM 788 HE ARG A 724 17.531 8.558 -20.813 1.00 0.00 H ATOM 789 HH12 ARG A 724 15.355 5.228 -21.721 1.00 0.00 H ATOM 790 HH11 ARG A 724 16.537 5.865 -22.922 1.00 0.00 H ATOM 791 HH22 ARG A 724 15.076 6.270 -19.720 1.00 0.00 H ATOM 792 HH21 ARG A 724 16.034 7.742 -19.318 1.00 0.00 H ATOM 793 H ARG A 724 20.912 5.356 -20.596 1.00 0.00 H ATOM 794 N LEU A 725 23.219 7.826 -20.554 1.00 68.19 N ATOM 795 CA LEU A 725 24.323 8.714 -20.195 1.00 73.05 C ATOM 796 C LEU A 725 25.679 8.008 -20.330 1.00 78.80 C ATOM 797 O LEU A 725 26.710 8.674 -20.405 1.00 81.99 O ATOM 798 CB LEU A 725 24.132 9.395 -18.827 1.00 75.20 C ATOM 799 CG LEU A 725 23.319 8.680 -17.759 1.00 77.49 C ATOM 800 CD1 LEU A 725 24.214 7.969 -16.761 1.00 79.96 C ATOM 801 CD2 LEU A 725 22.389 9.645 -17.050 1.00 80.35 C ATOM 802 H LEU A 725 22.745 7.279 -19.807 1.00 0.00 H ATOM 803 N ASN A 726 25.661 6.662 -20.458 1.00 73.79 N ATOM 804 CA ASN A 726 26.855 5.846 -20.667 1.00 75.27 C ATOM 805 C ASN A 726 26.900 5.279 -22.097 1.00 77.63 C ATOM 806 O ASN A 726 27.500 4.231 -22.321 1.00 76.70 O ATOM 807 CB ASN A 726 26.962 4.749 -19.605 1.00 74.44 C ATOM 808 CG ASN A 726 27.371 5.270 -18.252 1.00 98.56 C ATOM 809 OD1 ASN A 726 28.534 5.602 -18.014 1.00 95.26 O ATOM 810 ND2 ASN A 726 26.421 5.362 -17.335 1.00 87.15 N ATOM 811 HD22 ASN A 726 25.448 5.075 -17.564 1.00 0.00 H ATOM 812 HD21 ASN A 726 26.648 5.722 -16.386 1.00 0.00 H ATOM 813 H ASN A 726 24.742 6.178 -20.404 1.00 0.00 H ATOM 814 N ASP A 727 26.290 6.007 -23.067 1.00 73.96 N ATOM 815 CA ASP A 727 26.190 5.657 -24.491 1.00 72.62 C ATOM 816 C ASP A 727 27.530 5.235 -25.123 1.00 79.85 C ATOM 817 O ASP A 727 28.408 6.072 -25.339 1.00 82.53 O ATOM 818 CB ASP A 727 25.531 6.808 -25.288 1.00 74.08 C ATOM 819 CG ASP A 727 25.075 6.441 -26.692 1.00 79.15 C ATOM 820 OD1 ASP A 727 24.468 5.363 -26.857 1.00 74.57 O ATOM 821 OD2 ASP A 727 25.293 7.253 -27.622 1.00 83.54 O ATOM 822 H ASP A 727 25.849 6.902 -22.773 1.00 0.00 H ATOM 823 N GLY A 728 27.654 3.933 -25.388 1.00 75.09 N ATOM 824 CA GLY A 728 28.830 3.302 -25.982 1.00 76.69 C ATOM 825 C GLY A 728 29.999 3.089 -25.041 1.00 83.70 C ATOM 826 O GLY A 728 31.115 2.825 -25.505 1.00 86.96 O ATOM 827 H GLY A 728 26.849 3.318 -25.153 1.00 0.00 H ATOM 828 N GLN A 729 29.763 3.188 -23.714 1.00 79.31 N ATOM 829 CA GLN A 729 30.826 3.059 -22.706 1.00 83.13 C ATOM 830 C GLN A 729 31.024 1.639 -22.160 1.00 85.01 C ATOM 831 O GLN A 729 31.875 1.448 -21.295 1.00 87.09 O ATOM 832 CB GLN A 729 30.631 4.062 -21.548 1.00 86.11 C ATOM 833 CG GLN A 729 30.600 5.540 -21.963 1.00104.67 C ATOM 834 CD GLN A 729 31.852 5.990 -22.675 1.00127.77 C ATOM 835 OE1 GLN A 729 32.971 5.872 -22.162 1.00127.92 O ATOM 836 NE2 GLN A 729 31.685 6.507 -23.880 1.00119.57 N ATOM 837 HE22 GLN A 729 30.729 6.592 -24.282 1.00 0.00 H ATOM 838 HE21 GLN A 729 32.509 6.829 -24.426 1.00 0.00 H ATOM 839 H GLN A 729 28.790 3.363 -23.392 1.00 0.00 H ATOM 840 N PHE A 730 30.271 0.647 -22.669 1.00 77.11 N ATOM 841 CA PHE A 730 30.397 -0.744 -22.225 1.00 75.63 C ATOM 842 C PHE A 730 30.728 -1.680 -23.375 1.00 77.30 C ATOM 843 O PHE A 730 30.359 -1.411 -24.521 1.00 76.66 O ATOM 844 CB PHE A 730 29.106 -1.221 -21.522 1.00 73.69 C ATOM 845 CG PHE A 730 28.715 -0.415 -20.306 1.00 75.91 C ATOM 846 CD1 PHE A 730 29.522 -0.403 -19.170 1.00 82.81 C ATOM 847 CD2 PHE A 730 27.541 0.329 -20.293 1.00 75.36 C ATOM 848 CE1 PHE A 730 29.169 0.357 -18.052 1.00 84.64 C ATOM 849 CE2 PHE A 730 27.179 1.072 -19.168 1.00 79.17 C ATOM 850 CZ PHE A 730 28.007 1.097 -18.063 1.00 81.05 C ATOM 851 H PHE A 730 29.573 0.876 -23.405 1.00 0.00 H ATOM 852 N THR A 731 31.401 -2.794 -23.063 1.00 73.14 N ATOM 853 CA THR A 731 31.710 -3.834 -24.045 1.00 72.01 C ATOM 854 C THR A 731 30.441 -4.700 -24.231 1.00 70.29 C ATOM 855 O THR A 731 29.532 -4.646 -23.397 1.00 65.88 O ATOM 856 CB THR A 731 32.897 -4.695 -23.587 1.00 77.69 C ATOM 857 OG1 THR A 731 32.542 -5.402 -22.396 1.00 70.64 O ATOM 858 CG2 THR A 731 34.195 -3.881 -23.380 1.00 82.13 C ATOM 859 HG1 THR A 731 32.311 -4.753 -21.685 1.00 0.00 H ATOM 860 H THR A 731 31.718 -2.926 -22.081 1.00 0.00 H ATOM 861 N VAL A 732 30.403 -5.489 -25.292 1.00 67.17 N ATOM 862 CA VAL A 732 29.273 -6.361 -25.545 1.00 63.94 C ATOM 863 C VAL A 732 29.159 -7.372 -24.420 1.00 64.90 C ATOM 864 O VAL A 732 28.067 -7.724 -24.006 1.00 59.27 O ATOM 865 CB VAL A 732 29.380 -7.069 -26.897 1.00 68.62 C ATOM 866 CG1 VAL A 732 28.268 -8.088 -27.042 1.00 64.31 C ATOM 867 CG2 VAL A 732 29.297 -6.053 -28.017 1.00 69.33 C ATOM 868 H VAL A 732 31.201 -5.484 -25.959 1.00 0.00 H ATOM 869 N ILE A 733 30.298 -7.839 -23.926 1.00 64.41 N ATOM 870 CA ILE A 733 30.308 -8.816 -22.847 1.00 64.74 C ATOM 871 C ILE A 733 29.657 -8.255 -21.587 1.00 67.15 C ATOM 872 O ILE A 733 28.942 -8.963 -20.897 1.00 65.17 O ATOM 873 CB ILE A 733 31.734 -9.352 -22.575 1.00 72.26 C ATOM 874 CG1 ILE A 733 32.107 -10.365 -23.643 1.00 72.52 C ATOM 875 CG2 ILE A 733 31.837 -10.042 -21.225 1.00 76.12 C ATOM 876 CD1 ILE A 733 31.289 -11.634 -23.557 1.00 76.91 C ATOM 877 H ILE A 733 31.201 -7.501 -24.317 1.00 0.00 H ATOM 878 N GLN A 734 29.922 -6.997 -21.270 1.00 64.08 N ATOM 879 CA GLN A 734 29.306 -6.402 -20.095 1.00 63.19 C ATOM 880 C GLN A 734 27.795 -6.294 -20.283 1.00 62.30 C ATOM 881 O GLN A 734 27.033 -6.598 -19.381 1.00 60.97 O ATOM 882 CB GLN A 734 29.905 -5.032 -19.805 1.00 66.60 C ATOM 883 CG GLN A 734 31.420 -5.026 -19.714 1.00 75.14 C ATOM 884 CD GLN A 734 31.976 -3.627 -19.657 1.00 93.24 C ATOM 885 OE1 GLN A 734 32.214 -3.002 -20.685 1.00 82.26 O ATOM 886 NE2 GLN A 734 32.172 -3.123 -18.452 1.00 96.13 N ATOM 887 HE22 GLN A 734 31.955 -3.692 -17.609 1.00 0.00 H ATOM 888 HE21 GLN A 734 32.543 -2.157 -18.346 1.00 0.00 H ATOM 889 H GLN A 734 30.569 -6.436 -21.860 1.00 0.00 H ATOM 890 N LEU A 735 27.375 -5.870 -21.469 1.00 58.05 N ATOM 891 CA LEU A 735 25.930 -5.760 -21.765 1.00 54.93 C ATOM 892 C LEU A 735 25.248 -7.130 -21.678 1.00 55.75 C ATOM 893 O LEU A 735 24.141 -7.226 -21.153 1.00 52.17 O ATOM 894 CB LEU A 735 25.650 -5.093 -23.129 1.00 54.05 C ATOM 895 CG LEU A 735 26.170 -3.651 -23.329 1.00 61.34 C ATOM 896 CD1 LEU A 735 26.036 -3.228 -24.779 1.00 61.60 C ATOM 897 CD2 LEU A 735 25.445 -2.636 -22.412 1.00 60.42 C ATOM 898 H LEU A 735 28.070 -5.612 -22.198 1.00 0.00 H ATOM 899 N VAL A 736 25.951 -8.201 -22.105 1.00 54.62 N ATOM 900 CA VAL A 736 25.428 -9.571 -22.043 1.00 52.95 C ATOM 901 C VAL A 736 25.286 -10.020 -20.574 1.00 56.39 C ATOM 902 O VAL A 736 24.234 -10.542 -20.215 1.00 52.07 O ATOM 903 CB VAL A 736 26.220 -10.558 -22.945 1.00 57.61 C ATOM 904 CG1 VAL A 736 25.797 -12.009 -22.702 1.00 56.01 C ATOM 905 CG2 VAL A 736 26.007 -10.198 -24.418 1.00 56.47 C ATOM 906 H VAL A 736 26.903 -8.049 -22.494 1.00 0.00 H ATOM 907 N GLY A 737 26.288 -9.708 -19.740 1.00 57.42 N ATOM 908 CA GLY A 737 26.264 -9.980 -18.303 1.00 58.86 C ATOM 909 C GLY A 737 25.058 -9.333 -17.632 1.00 58.73 C ATOM 910 O GLY A 737 24.382 -9.971 -16.823 1.00 57.42 O ATOM 911 H GLY A 737 27.131 -9.246 -20.137 1.00 0.00 H ATOM 912 N MET A 738 24.761 -8.072 -17.989 1.00 54.50 N ATOM 913 CA MET A 738 23.580 -7.331 -17.500 1.00 52.57 C ATOM 914 C MET A 738 22.298 -8.093 -17.894 1.00 52.50 C ATOM 915 O MET A 738 21.451 -8.372 -17.043 1.00 51.62 O ATOM 916 CB MET A 738 23.537 -5.905 -18.083 1.00 54.67 C ATOM 917 CG MET A 738 24.617 -4.972 -17.530 1.00 62.10 C ATOM 918 SD MET A 738 24.547 -3.340 -18.319 1.00 66.22 S ATOM 919 CE MET A 738 26.077 -2.647 -17.748 1.00 67.40 C ATOM 920 H MET A 738 25.402 -7.588 -18.650 1.00 0.00 H ATOM 921 N LEU A 739 22.192 -8.475 -19.175 1.00 46.33 N ATOM 922 CA LEU A 739 21.039 -9.225 -19.669 1.00 43.84 C ATOM 923 C LEU A 739 20.903 -10.609 -19.021 1.00 46.21 C ATOM 924 O LEU A 739 19.781 -11.061 -18.780 1.00 44.10 O ATOM 925 CB LEU A 739 21.058 -9.304 -21.204 1.00 42.72 C ATOM 926 CG LEU A 739 20.810 -7.966 -21.927 1.00 46.43 C ATOM 927 CD1 LEU A 739 21.121 -8.085 -23.402 1.00 47.68 C ATOM 928 CD2 LEU A 739 19.407 -7.454 -21.700 1.00 47.11 C ATOM 929 H LEU A 739 22.955 -8.230 -19.838 1.00 0.00 H ATOM 930 N ARG A 740 22.038 -11.246 -18.678 1.00 45.04 N ATOM 931 CA ARG A 740 22.050 -12.560 -18.033 1.00 45.76 C ATOM 932 C ARG A 740 21.476 -12.438 -16.619 1.00 49.49 C ATOM 933 O ARG A 740 20.632 -13.248 -16.239 1.00 48.12 O ATOM 934 CB ARG A 740 23.467 -13.176 -18.047 1.00 48.84 C ATOM 935 CG ARG A 740 23.464 -14.673 -17.780 1.00 55.62 C ATOM 936 CD ARG A 740 23.983 -15.019 -16.399 1.00 67.09 C ATOM 937 NE ARG A 740 24.122 -16.471 -16.249 1.00 66.99 N ATOM 938 CZ ARG A 740 23.695 -17.172 -15.204 1.00 77.54 C ATOM 939 NH1 ARG A 740 23.121 -16.561 -14.174 1.00 60.37 N ATOM 940 NH2 ARG A 740 23.850 -18.489 -15.174 1.00 68.46 N ATOM 941 HE ARG A 740 24.590 -16.991 -17.018 1.00 0.00 H ATOM 942 HH12 ARG A 740 22.789 -17.116 -13.359 1.00 0.00 H ATOM 943 HH11 ARG A 740 23.003 -15.528 -14.182 1.00 0.00 H ATOM 944 HH22 ARG A 740 23.514 -19.034 -14.354 1.00 0.00 H ATOM 945 HH21 ARG A 740 24.307 -18.977 -15.970 1.00 0.00 H ATOM 946 H ARG A 740 22.947 -10.784 -18.880 1.00 0.00 H ATOM 947 N GLY A 741 21.901 -11.410 -15.890 1.00 49.30 N ATOM 948 CA GLY A 741 21.375 -11.083 -14.565 1.00 50.46 C ATOM 949 C GLY A 741 19.861 -10.875 -14.579 1.00 50.34 C ATOM 950 O GLY A 741 19.147 -11.507 -13.801 1.00 49.43 O ATOM 951 H GLY A 741 22.649 -10.805 -16.284 1.00 0.00 H ATOM 952 N ILE A 742 19.345 -10.046 -15.512 1.00 44.83 N ATOM 953 CA ILE A 742 17.893 -9.802 -15.673 1.00 42.25 C ATOM 954 C ILE A 742 17.154 -11.133 -15.946 1.00 44.14 C ATOM 955 O ILE A 742 16.147 -11.431 -15.295 1.00 43.23 O ATOM 956 CB ILE A 742 17.600 -8.746 -16.771 1.00 42.67 C ATOM 957 CG1 ILE A 742 18.223 -7.361 -16.407 1.00 44.69 C ATOM 958 CG2 ILE A 742 16.074 -8.611 -17.033 1.00 40.43 C ATOM 959 CD1 ILE A 742 18.472 -6.467 -17.592 1.00 42.62 C ATOM 960 H ILE A 742 20.001 -9.553 -16.151 1.00 0.00 H ATOM 961 N ALA A 743 17.670 -11.925 -16.893 1.00 40.66 N ATOM 962 CA ALA A 743 17.092 -13.225 -17.256 1.00 39.72 C ATOM 963 C ALA A 743 17.124 -14.216 -16.065 1.00 44.90 C ATOM 964 O ALA A 743 16.146 -14.937 -15.878 1.00 43.93 O ATOM 965 CB ALA A 743 17.805 -13.807 -18.475 1.00 39.72 C ATOM 966 H ALA A 743 18.522 -11.604 -17.396 1.00 0.00 H ATOM 967 N ALA A 744 18.195 -14.197 -15.231 1.00 44.74 N ATOM 968 CA ALA A 744 18.290 -15.045 -14.030 1.00 47.00 C ATOM 969 C ALA A 744 17.208 -14.642 -13.004 1.00 48.58 C ATOM 970 O ALA A 744 16.537 -15.508 -12.446 1.00 47.99 O ATOM 971 CB ALA A 744 19.688 -14.966 -13.411 1.00 50.96 C ATOM 972 H ALA A 744 18.984 -13.555 -15.450 1.00 0.00 H ATOM 973 N GLY A 745 16.990 -13.341 -12.841 1.00 45.67 N ATOM 974 CA GLY A 745 15.949 -12.813 -11.965 1.00 45.96 C ATOM 975 C GLY A 745 14.567 -13.217 -12.442 1.00 46.66 C ATOM 976 O GLY A 745 13.723 -13.626 -11.643 1.00 47.71 O ATOM 977 H GLY A 745 17.589 -12.669 -13.362 1.00 0.00 H ATOM 978 N MET A 746 14.333 -13.109 -13.757 1.00 40.28 N ATOM 979 CA MET A 746 13.059 -13.477 -14.383 1.00 36.96 C ATOM 980 C MET A 746 12.826 -14.996 -14.328 1.00 42.36 C ATOM 981 O MET A 746 11.695 -15.441 -14.126 1.00 43.20 O ATOM 982 CB MET A 746 13.003 -12.961 -15.816 1.00 35.65 C ATOM 983 CG MET A 746 12.828 -11.425 -15.927 1.00 37.11 C ATOM 984 SD MET A 746 11.488 -10.728 -14.911 1.00 40.72 S ATOM 985 CE MET A 746 10.012 -11.573 -15.651 1.00 37.30 C ATOM 986 H MET A 746 15.094 -12.745 -14.365 1.00 0.00 H ATOM 987 N LYS A 747 13.900 -15.789 -14.480 1.00 40.64 N ATOM 988 CA LYS A 747 13.843 -17.252 -14.342 1.00 40.67 C ATOM 989 C LYS A 747 13.329 -17.587 -12.917 1.00 47.34 C ATOM 990 O LYS A 747 12.397 -18.389 -12.780 1.00 46.90 O ATOM 991 CB LYS A 747 15.234 -17.867 -14.619 1.00 43.33 C ATOM 992 CG LYS A 747 15.357 -19.359 -14.342 1.00 52.58 C ATOM 993 CD LYS A 747 16.803 -19.821 -14.575 1.00 53.40 C ATOM 994 CE LYS A 747 17.198 -21.066 -13.802 1.00 66.18 C ATOM 995 NZ LYS A 747 16.391 -22.252 -14.187 1.00 74.82 N ATOM 996 HZ1 LYS A 747 15.386 -22.062 -13.999 1.00 0.00 H ATOM 997 HZ2 LYS A 747 16.524 -22.447 -15.200 1.00 0.00 H ATOM 998 HZ3 LYS A 747 16.700 -23.075 -13.631 1.00 0.00 H ATOM 999 H LYS A 747 14.814 -15.348 -14.706 1.00 0.00 H ATOM 1000 N TYR A 748 13.882 -16.908 -11.879 1.00 45.87 N ATOM 1001 CA TYR A 748 13.465 -17.079 -10.482 1.00 48.48 C ATOM 1002 C TYR A 748 11.979 -16.721 -10.278 1.00 50.99 C ATOM 1003 O TYR A 748 11.256 -17.508 -9.674 1.00 51.67 O ATOM 1004 CB TYR A 748 14.392 -16.294 -9.534 1.00 52.23 C ATOM 1005 CG TYR A 748 13.906 -16.205 -8.104 1.00 57.26 C ATOM 1006 CD1 TYR A 748 14.167 -17.226 -7.192 1.00 62.45 C ATOM 1007 CD2 TYR A 748 13.229 -15.079 -7.647 1.00 58.18 C ATOM 1008 CE1 TYR A 748 13.732 -17.142 -5.868 1.00 66.33 C ATOM 1009 CE2 TYR A 748 12.796 -14.981 -6.327 1.00 62.13 C ATOM 1010 CZ TYR A 748 13.053 -16.013 -5.440 1.00 70.70 C ATOM 1011 OH TYR A 748 12.610 -15.914 -4.148 1.00 70.21 O ATOM 1012 HH TYR A 748 12.872 -16.727 -3.647 1.00 0.00 H ATOM 1013 H TYR A 748 14.643 -16.230 -12.085 1.00 0.00 H ATOM 1014 N LEU A 749 11.521 -15.564 -10.804 1.00 46.49 N ATOM 1015 CA LEU A 749 10.112 -15.143 -10.726 1.00 45.15 C ATOM 1016 C LEU A 749 9.171 -16.162 -11.372 1.00 48.27 C ATOM 1017 O LEU A 749 8.188 -16.555 -10.746 1.00 48.37 O ATOM 1018 CB LEU A 749 9.885 -13.740 -11.331 1.00 42.86 C ATOM 1019 CG LEU A 749 10.529 -12.570 -10.595 1.00 47.46 C ATOM 1020 CD1 LEU A 749 10.229 -11.252 -11.309 1.00 44.37 C ATOM 1021 CD2 LEU A 749 10.069 -12.501 -9.129 1.00 52.68 C ATOM 1022 H LEU A 749 12.197 -14.940 -11.288 1.00 0.00 H ATOM 1023 N SER A 750 9.496 -16.625 -12.595 1.00 45.57 N ATOM 1024 CA SER A 750 8.680 -17.611 -13.302 1.00 46.07 C ATOM 1025 C SER A 750 8.587 -18.937 -12.529 1.00 53.71 C ATOM 1026 O SER A 750 7.506 -19.527 -12.477 1.00 53.61 O ATOM 1027 CB SER A 750 9.164 -17.803 -14.733 1.00 50.02 C ATOM 1028 OG SER A 750 10.552 -18.090 -14.762 1.00 67.84 O ATOM 1029 HG SER A 750 10.727 -18.920 -14.252 1.00 0.00 H ATOM 1030 H SER A 750 10.359 -16.268 -13.053 1.00 0.00 H ATOM 1031 N GLU A 751 9.689 -19.331 -11.840 1.00 53.76 N ATOM 1032 CA GLU A 751 9.767 -20.512 -10.975 1.00 57.75 C ATOM 1033 C GLU A 751 8.832 -20.362 -9.762 1.00 64.45 C ATOM 1034 O GLU A 751 8.257 -21.357 -9.321 1.00 66.21 O ATOM 1035 CB GLU A 751 11.204 -20.724 -10.479 1.00 61.24 C ATOM 1036 CG GLU A 751 12.114 -21.441 -11.458 1.00 72.70 C ATOM 1037 CD GLU A 751 13.601 -21.395 -11.143 1.00 90.43 C ATOM 1038 OE1 GLU A 751 13.974 -20.990 -10.017 1.00 73.98 O ATOM 1039 OE2 GLU A 751 14.397 -21.775 -12.032 1.00 80.99 O ATOM 1040 H GLU A 751 10.546 -18.749 -11.933 1.00 0.00 H ATOM 1041 N MET A 752 8.684 -19.122 -9.230 1.00 60.56 N ATOM 1042 CA MET A 752 7.804 -18.791 -8.094 1.00 62.56 C ATOM 1043 C MET A 752 6.346 -18.600 -8.575 1.00 64.42 C ATOM 1044 O MET A 752 5.493 -18.225 -7.767 1.00 65.73 O ATOM 1045 CB MET A 752 8.272 -17.494 -7.380 1.00 65.79 C ATOM 1046 CG MET A 752 9.668 -17.547 -6.793 1.00 71.72 C ATOM 1047 SD MET A 752 9.772 -18.415 -5.216 1.00 81.92 S ATOM 1048 CE MET A 752 10.952 -19.689 -5.632 1.00 79.44 C ATOM 1049 H MET A 752 9.232 -18.347 -9.655 1.00 0.00 H ATOM 1050 N ASN A 753 6.079 -18.805 -9.899 1.00 57.47 N ATOM 1051 CA ASN A 753 4.774 -18.644 -10.565 1.00 55.46 C ATOM 1052 C ASN A 753 4.285 -17.173 -10.538 1.00 55.31 C ATOM 1053 O ASN A 753 3.079 -16.898 -10.528 1.00 55.17 O ATOM 1054 CB ASN A 753 3.712 -19.626 -10.016 1.00 61.02 C ATOM 1055 CG ASN A 753 4.151 -21.070 -9.987 1.00 89.99 C ATOM 1056 OD1 ASN A 753 4.356 -21.711 -11.025 1.00 82.50 O ATOM 1057 ND2 ASN A 753 4.284 -21.622 -8.789 1.00 86.17 N ATOM 1058 HD22 ASN A 753 4.105 -21.058 -7.934 1.00 0.00 H ATOM 1059 HD21 ASN A 753 4.568 -22.619 -8.704 1.00 0.00 H ATOM 1060 H ASN A 753 6.876 -19.104 -10.496 1.00 0.00 H ATOM 1061 N TYR A 754 5.238 -16.232 -10.546 1.00 48.45 N ATOM 1062 CA TYR A 754 4.935 -14.806 -10.539 1.00 46.54 C ATOM 1063 C TYR A 754 5.131 -14.227 -11.936 1.00 46.05 C ATOM 1064 O TYR A 754 6.197 -14.392 -12.526 1.00 43.97 O ATOM 1065 CB TYR A 754 5.800 -14.061 -9.507 1.00 48.51 C ATOM 1066 CG TYR A 754 5.442 -12.598 -9.383 1.00 47.73 C ATOM 1067 CD1 TYR A 754 4.360 -12.187 -8.608 1.00 51.23 C ATOM 1068 CD2 TYR A 754 6.179 -11.620 -10.048 1.00 45.57 C ATOM 1069 CE1 TYR A 754 4.001 -10.843 -8.521 1.00 50.77 C ATOM 1070 CE2 TYR A 754 5.837 -10.271 -9.959 1.00 45.48 C ATOM 1071 CZ TYR A 754 4.756 -9.887 -9.180 1.00 52.00 C ATOM 1072 OH TYR A 754 4.410 -8.566 -9.086 1.00 49.92 O ATOM 1073 HH TYR A 754 4.190 -8.219 -9.987 1.00 0.00 H ATOM 1074 H TYR A 754 6.234 -16.531 -10.558 1.00 0.00 H ATOM 1075 N VAL A 755 4.100 -13.537 -12.444 1.00 41.69 N ATOM 1076 CA VAL A 755 4.101 -12.865 -13.742 1.00 38.11 C ATOM 1077 C VAL A 755 4.311 -11.379 -13.430 1.00 41.92 C ATOM 1078 O VAL A 755 3.506 -10.775 -12.709 1.00 41.44 O ATOM 1079 CB VAL A 755 2.798 -13.160 -14.551 1.00 40.12 C ATOM 1080 CG1 VAL A 755 2.786 -12.410 -15.892 1.00 37.34 C ATOM 1081 CG2 VAL A 755 2.616 -14.674 -14.769 1.00 39.85 C ATOM 1082 H VAL A 755 3.234 -13.475 -11.871 1.00 0.00 H ATOM 1083 N HIS A 756 5.422 -10.810 -13.889 1.00 38.18 N ATOM 1084 CA HIS A 756 5.735 -9.411 -13.613 1.00 38.24 C ATOM 1085 C HIS A 756 4.782 -8.390 -14.238 1.00 39.99 C ATOM 1086 O HIS A 756 4.273 -7.521 -13.557 1.00 40.72 O ATOM 1087 CB HIS A 756 7.150 -9.141 -14.114 1.00 38.41 C ATOM 1088 CG HIS A 756 7.751 -7.866 -13.616 1.00 42.04 C ATOM 1089 ND1 HIS A 756 7.452 -6.640 -14.160 1.00 42.30 N ATOM 1090 CD2 HIS A 756 8.667 -7.634 -12.650 1.00 45.43 C ATOM 1091 CE1 HIS A 756 8.142 -5.704 -13.539 1.00 43.16 C ATOM 1092 NE2 HIS A 756 8.888 -6.282 -12.619 1.00 45.51 N ATOM 1093 H HIS A 756 6.084 -11.375 -14.458 1.00 0.00 H ATOM 1094 N ARG A 757 4.539 -8.529 -15.533 1.00 35.02 N ATOM 1095 CA ARG A 757 3.620 -7.684 -16.293 1.00 33.39 C ATOM 1096 C ARG A 757 4.149 -6.313 -16.713 1.00 36.30 C ATOM 1097 O ARG A 757 3.550 -5.659 -17.550 1.00 33.45 O ATOM 1098 CB ARG A 757 2.335 -7.466 -15.507 1.00 35.15 C ATOM 1099 CG ARG A 757 1.484 -8.698 -15.334 1.00 41.11 C ATOM 1100 CD ARG A 757 0.370 -8.434 -14.350 1.00 57.83 C ATOM 1101 NE ARG A 757 -0.883 -9.008 -14.806 1.00 74.07 N ATOM 1102 CZ ARG A 757 -1.404 -10.128 -14.327 1.00 94.77 C ATOM 1103 NH1 ARG A 757 -2.551 -10.578 -14.805 1.00 86.28 N ATOM 1104 NH2 ARG A 757 -0.778 -10.796 -13.372 1.00 86.48 N ATOM 1105 HE ARG A 757 -1.404 -8.509 -15.555 1.00 0.00 H ATOM 1106 HH12 ARG A 757 -2.961 -11.457 -14.430 1.00 0.00 H ATOM 1107 HH11 ARG A 757 -3.043 -10.053 -15.556 1.00 0.00 H ATOM 1108 HH22 ARG A 757 -1.189 -11.675 -12.997 1.00 0.00 H ATOM 1109 HH21 ARG A 757 0.125 -10.442 -12.996 1.00 0.00 H ATOM 1110 H ARG A 757 5.034 -9.289 -16.042 1.00 0.00 H ATOM 1111 N ASP A 758 5.265 -5.887 -16.142 1.00 34.82 N ATOM 1112 CA ASP A 758 5.827 -4.582 -16.462 1.00 34.72 C ATOM 1113 C ASP A 758 7.340 -4.609 -16.600 1.00 36.75 C ATOM 1114 O ASP A 758 8.028 -3.704 -16.151 1.00 35.98 O ATOM 1115 CB ASP A 758 5.369 -3.527 -15.443 1.00 38.42 C ATOM 1116 CG ASP A 758 5.529 -2.097 -15.949 1.00 40.00 C ATOM 1117 OD1 ASP A 758 5.862 -1.891 -17.124 1.00 38.74 O ATOM 1118 OD2 ASP A 758 5.325 -1.171 -15.152 1.00 43.69 O ATOM 1119 H ASP A 758 5.750 -6.496 -15.452 1.00 0.00 H ATOM 1120 N LEU A 759 7.853 -5.664 -17.215 1.00 31.87 N ATOM 1121 CA LEU A 759 9.296 -5.786 -17.404 1.00 31.40 C ATOM 1122 C LEU A 759 9.751 -4.780 -18.470 1.00 34.16 C ATOM 1123 O LEU A 759 9.311 -4.828 -19.617 1.00 31.88 O ATOM 1124 CB LEU A 759 9.670 -7.229 -17.797 1.00 30.12 C ATOM 1125 CG LEU A 759 11.153 -7.535 -17.978 1.00 33.96 C ATOM 1126 CD1 LEU A 759 11.934 -7.275 -16.672 1.00 37.25 C ATOM 1127 CD2 LEU A 759 11.324 -8.967 -18.417 1.00 33.62 C ATOM 1128 H LEU A 759 7.222 -6.412 -17.567 1.00 0.00 H ATOM 1129 N ALA A 760 10.611 -3.862 -18.059 1.00 32.88 N ATOM 1130 CA ALA A 760 11.131 -2.774 -18.886 1.00 31.63 C ATOM 1131 C ALA A 760 12.395 -2.275 -18.225 1.00 36.87 C ATOM 1132 O ALA A 760 12.556 -2.426 -17.008 1.00 37.07 O ATOM 1133 CB ALA A 760 10.102 -1.634 -18.964 1.00 31.56 C ATOM 1134 H ALA A 760 10.942 -3.919 -17.075 1.00 0.00 H ATOM 1135 N ALA A 761 13.293 -1.668 -19.007 1.00 36.23 N ATOM 1136 CA ALA A 761 14.546 -1.140 -18.453 1.00 39.54 C ATOM 1137 C ALA A 761 14.340 -0.077 -17.361 1.00 44.05 C ATOM 1138 O ALA A 761 15.152 -0.015 -16.447 1.00 45.84 O ATOM 1139 CB ALA A 761 15.460 -0.635 -19.552 1.00 41.07 C ATOM 1140 H ALA A 761 13.101 -1.568 -20.024 1.00 0.00 H ATOM 1141 N ARG A 762 13.202 0.662 -17.373 1.00 40.32 N ATOM 1142 CA ARG A 762 12.875 1.642 -16.320 1.00 41.82 C ATOM 1143 C ARG A 762 12.590 0.958 -14.961 1.00 45.77 C ATOM 1144 O ARG A 762 12.600 1.629 -13.940 1.00 45.28 O ATOM 1145 CB ARG A 762 11.690 2.549 -16.735 1.00 38.67 C ATOM 1146 CG ARG A 762 10.423 1.746 -16.996 1.00 38.65 C ATOM 1147 CD ARG A 762 9.224 2.584 -17.399 1.00 39.77 C ATOM 1148 NE ARG A 762 8.136 1.668 -17.730 1.00 35.62 N ATOM 1149 CZ ARG A 762 7.971 1.100 -18.915 1.00 40.35 C ATOM 1150 NH1 ARG A 762 8.764 1.420 -19.929 1.00 36.87 N ATOM 1151 NH2 ARG A 762 7.001 0.224 -19.104 1.00 34.10 N ATOM 1152 HE ARG A 762 7.444 1.447 -16.985 1.00 0.00 H ATOM 1153 HH12 ARG A 762 8.629 0.970 -20.857 1.00 0.00 H ATOM 1154 HH11 ARG A 762 9.521 2.121 -19.796 1.00 0.00 H ATOM 1155 HH22 ARG A 762 6.875 -0.220 -20.036 1.00 0.00 H ATOM 1156 HH21 ARG A 762 6.363 -0.022 -18.321 1.00 0.00 H ATOM 1157 H ARG A 762 12.532 0.532 -18.158 1.00 0.00 H ATOM 1158 N ASN A 763 12.280 -0.353 -14.968 1.00 42.59 N ATOM 1159 CA ASN A 763 11.981 -1.154 -13.771 1.00 44.16 C ATOM 1160 C ASN A 763 13.139 -2.085 -13.378 1.00 47.90 C ATOM 1161 O ASN A 763 12.948 -3.045 -12.626 1.00 48.93 O ATOM 1162 CB ASN A 763 10.667 -1.941 -13.973 1.00 42.67 C ATOM 1163 CG ASN A 763 9.438 -1.073 -13.873 1.00 50.42 C ATOM 1164 OD1 ASN A 763 9.396 -0.089 -13.144 1.00 50.73 O ATOM 1165 ND2 ASN A 763 8.421 -1.388 -14.633 1.00 39.00 N ATOM 1166 HD22 ASN A 763 8.470 -2.226 -15.247 1.00 0.00 H ATOM 1167 HD21 ASN A 763 7.563 -0.800 -14.623 1.00 0.00 H ATOM 1168 H ASN A 763 12.250 -0.835 -15.889 1.00 0.00 H ATOM 1169 N ILE A 764 14.321 -1.843 -13.947 1.00 43.33 N ATOM 1170 CA ILE A 764 15.519 -2.621 -13.634 1.00 43.89 C ATOM 1171 C ILE A 764 16.440 -1.640 -12.937 1.00 50.99 C ATOM 1172 O ILE A 764 16.694 -0.567 -13.487 1.00 49.67 O ATOM 1173 CB ILE A 764 16.214 -3.262 -14.880 1.00 45.16 C ATOM 1174 CG1 ILE A 764 15.273 -4.207 -15.691 1.00 44.10 C ATOM 1175 CG2 ILE A 764 17.541 -3.982 -14.482 1.00 47.89 C ATOM 1176 CD1 ILE A 764 14.605 -5.326 -14.931 1.00 50.59 C ATOM 1177 H ILE A 764 14.393 -1.071 -14.640 1.00 0.00 H ATOM 1178 N LEU A 765 16.927 -1.995 -11.738 1.00 52.02 N ATOM 1179 CA LEU A 765 17.852 -1.146 -10.981 1.00 56.26 C ATOM 1180 C LEU A 765 19.280 -1.672 -11.077 1.00 62.25 C ATOM 1181 O LEU A 765 19.486 -2.881 -11.170 1.00 61.13 O ATOM 1182 CB LEU A 765 17.390 -0.956 -9.522 1.00 59.03 C ATOM 1183 CG LEU A 765 16.015 -0.277 -9.344 1.00 62.99 C ATOM 1184 CD1 LEU A 765 15.479 -0.495 -7.954 1.00 65.72 C ATOM 1185 CD2 LEU A 765 16.078 1.222 -9.637 1.00 68.00 C ATOM 1186 H LEU A 765 16.637 -2.907 -11.330 1.00 0.00 H ATOM 1187 N VAL A 766 20.271 -0.757 -11.073 1.00 61.53 N ATOM 1188 CA VAL A 766 21.692 -1.089 -11.238 1.00 62.59 C ATOM 1189 C VAL A 766 22.518 -0.629 -10.023 1.00 69.76 C ATOM 1190 O VAL A 766 22.340 0.495 -9.557 1.00 69.89 O ATOM 1191 CB VAL A 766 22.257 -0.501 -12.573 1.00 65.29 C ATOM 1192 CG1 VAL A 766 23.680 -0.987 -12.849 1.00 67.62 C ATOM 1193 CG2 VAL A 766 21.348 -0.818 -13.766 1.00 60.73 C ATOM 1194 H VAL A 766 20.014 0.243 -10.946 1.00 0.00 H ATOM 1195 N ASN A 767 23.416 -1.492 -9.515 1.00 70.19 N ATOM 1196 CA ASN A 767 24.291 -1.109 -8.397 1.00 75.06 C ATOM 1197 C ASN A 767 25.680 -0.697 -8.922 1.00 82.25 C ATOM 1198 O ASN A 767 25.903 -0.732 -10.135 1.00 78.78 O ATOM 1199 CB ASN A 767 24.356 -2.204 -7.301 1.00 76.86 C ATOM 1200 CG ASN A 767 25.080 -3.488 -7.647 1.00 84.41 C ATOM 1201 OD1 ASN A 767 25.715 -3.633 -8.696 1.00 75.56 O ATOM 1202 ND2 ASN A 767 25.008 -4.459 -6.747 1.00 76.82 N ATOM 1203 HD22 ASN A 767 24.468 -4.316 -5.870 1.00 0.00 H ATOM 1204 HD21 ASN A 767 25.492 -5.364 -6.918 1.00 0.00 H ATOM 1205 H ASN A 767 23.493 -2.447 -9.920 1.00 0.00 H ATOM 1206 N SER A 768 26.611 -0.329 -8.012 1.00 84.80 N ATOM 1207 CA SER A 768 27.985 0.082 -8.335 1.00 88.62 C ATOM 1208 C SER A 768 28.808 -0.980 -9.088 1.00 94.65 C ATOM 1209 O SER A 768 29.686 -0.612 -9.872 1.00 96.16 O ATOM 1210 CB SER A 768 28.719 0.531 -7.074 1.00 96.90 C ATOM 1211 OG SER A 768 28.566 -0.418 -6.032 1.00104.81 O ATOM 1212 HG SER A 768 29.050 -0.104 -5.228 1.00 0.00 H ATOM 1213 H SER A 768 26.334 -0.337 -7.010 1.00 0.00 H ATOM 1214 N ASN A 769 28.514 -2.284 -8.865 1.00 90.46 N ATOM 1215 CA ASN A 769 29.186 -3.419 -9.508 1.00 89.93 C ATOM 1216 C ASN A 769 28.517 -3.860 -10.829 1.00 89.20 C ATOM 1217 O ASN A 769 28.851 -4.926 -11.353 1.00 88.04 O ATOM 1218 CB ASN A 769 29.298 -4.607 -8.531 1.00 91.66 C ATOM 1219 CG ASN A 769 30.231 -4.392 -7.359 1.00112.76 C ATOM 1220 OD1 ASN A 769 29.895 -4.702 -6.212 1.00106.03 O ATOM 1221 ND2 ASN A 769 31.438 -3.896 -7.615 1.00105.91 N ATOM 1222 HD22 ASN A 769 31.700 -3.642 -8.589 1.00 0.00 H ATOM 1223 HD21 ASN A 769 32.120 -3.762 -6.841 1.00 0.00 H ATOM 1224 H ASN A 769 27.755 -2.496 -8.187 1.00 0.00 H ATOM 1225 N LEU A 770 27.588 -3.029 -11.366 1.00 83.24 N ATOM 1226 CA LEU A 770 26.806 -3.239 -12.603 1.00 78.34 C ATOM 1227 C LEU A 770 25.833 -4.435 -12.531 1.00 77.27 C ATOM 1228 O LEU A 770 25.343 -4.886 -13.574 1.00 74.02 O ATOM 1229 CB LEU A 770 27.680 -3.333 -13.880 1.00 78.68 C ATOM 1230 CG LEU A 770 28.796 -2.309 -14.087 1.00 86.98 C ATOM 1231 CD1 LEU A 770 29.798 -2.818 -15.099 1.00 88.29 C ATOM 1232 CD2 LEU A 770 28.252 -0.966 -14.523 1.00 87.95 C ATOM 1233 H LEU A 770 27.406 -2.145 -10.849 1.00 0.00 H ATOM 1234 N VAL A 771 25.516 -4.922 -11.314 1.00 73.31 N ATOM 1235 CA VAL A 771 24.556 -6.021 -11.141 1.00 69.87 C ATOM 1236 C VAL A 771 23.143 -5.444 -11.335 1.00 68.76 C ATOM 1237 O VAL A 771 22.771 -4.481 -10.653 1.00 68.51 O ATOM 1238 CB VAL A 771 24.687 -6.755 -9.777 1.00 76.05 C ATOM 1239 CG1 VAL A 771 23.684 -7.905 -9.676 1.00 73.12 C ATOM 1240 CG2 VAL A 771 26.117 -7.251 -9.532 1.00 79.47 C ATOM 1241 H VAL A 771 25.965 -4.507 -10.472 1.00 0.00 H ATOM 1242 N CYS A 772 22.376 -6.027 -12.266 1.00 61.56 N ATOM 1243 CA CYS A 772 21.009 -5.598 -12.573 1.00 58.12 C ATOM 1244 C CYS A 772 19.995 -6.364 -11.753 1.00 58.01 C ATOM 1245 O CYS A 772 20.091 -7.589 -11.612 1.00 57.72 O ATOM 1246 CB CYS A 772 20.725 -5.708 -14.067 1.00 56.06 C ATOM 1247 SG CYS A 772 21.766 -4.639 -15.083 1.00 61.35 S ATOM 1248 H CYS A 772 22.772 -6.827 -12.799 1.00 0.00 H ATOM 1249 N LYS A 773 19.038 -5.639 -11.190 1.00 52.67 N ATOM 1250 CA LYS A 773 18.019 -6.238 -10.343 1.00 52.10 C ATOM 1251 C LYS A 773 16.638 -5.850 -10.784 1.00 53.28 C ATOM 1252 O LYS A 773 16.342 -4.662 -10.950 1.00 53.32 O ATOM 1253 CB LYS A 773 18.240 -5.892 -8.857 1.00 57.33 C ATOM 1254 CG LYS A 773 19.519 -6.490 -8.285 1.00 62.89 C ATOM 1255 CD LYS A 773 19.536 -6.416 -6.793 1.00 68.08 C ATOM 1256 CE LYS A 773 20.900 -6.733 -6.228 1.00 74.29 C ATOM 1257 NZ LYS A 773 20.771 -7.570 -5.013 1.00 78.85 N ATOM 1258 HZ1 LYS A 773 20.217 -7.057 -4.297 1.00 0.00 H ATOM 1259 HZ2 LYS A 773 20.288 -8.459 -5.255 1.00 0.00 H ATOM 1260 HZ3 LYS A 773 21.717 -7.780 -4.636 1.00 0.00 H ATOM 1261 H LYS A 773 19.016 -4.613 -11.359 1.00 0.00 H ATOM 1262 N VAL A 774 15.786 -6.857 -10.955 1.00 48.05 N ATOM 1263 CA VAL A 774 14.393 -6.664 -11.348 1.00 45.37 C ATOM 1264 C VAL A 774 13.649 -6.035 -10.183 1.00 51.82 C ATOM 1265 O VAL A 774 13.812 -6.447 -9.023 1.00 53.82 O ATOM 1266 CB VAL A 774 13.708 -7.953 -11.874 1.00 45.96 C ATOM 1267 CG1 VAL A 774 12.253 -7.684 -12.278 1.00 42.91 C ATOM 1268 CG2 VAL A 774 14.484 -8.543 -13.047 1.00 44.28 C ATOM 1269 H VAL A 774 16.128 -7.827 -10.802 1.00 0.00 H ATOM 1270 N SER A 775 12.897 -4.989 -10.501 1.00 47.40 N ATOM 1271 CA SER A 775 12.103 -4.231 -9.560 1.00 49.93 C ATOM 1272 C SER A 775 10.728 -3.959 -10.172 1.00 52.86 C ATOM 1273 O SER A 775 10.451 -4.370 -11.301 1.00 49.22 O ATOM 1274 CB SER A 775 12.815 -2.916 -9.250 1.00 56.44 C ATOM 1275 OG SER A 775 12.121 -2.130 -8.296 1.00 69.79 O ATOM 1276 HG SER A 775 12.623 -1.293 -8.132 1.00 0.00 H ATOM 1277 H SER A 775 12.877 -4.693 -11.498 1.00 0.00 H ATOM 1278 N ASP A 776 9.875 -3.270 -9.407 1.00 52.93 N ATOM 1279 CA ASP A 776 8.547 -2.784 -9.765 1.00 51.94 C ATOM 1280 C ASP A 776 8.087 -1.835 -8.659 1.00 61.05 C ATOM 1281 O ASP A 776 8.704 -1.797 -7.592 1.00 63.85 O ATOM 1282 CB ASP A 776 7.531 -3.935 -9.963 1.00 52.50 C ATOM 1283 CG ASP A 776 6.317 -3.558 -10.798 1.00 59.48 C ATOM 1284 OD1 ASP A 776 6.240 -2.392 -11.255 1.00 60.51 O ATOM 1285 OD2 ASP A 776 5.426 -4.408 -10.960 1.00 61.61 O ATOM 1286 H ASP A 776 10.197 -3.055 -8.442 1.00 0.00 H ATOM 1287 N PHE A 777 7.008 -1.070 -8.916 1.00 58.74 N ATOM 1288 CA PHE A 777 6.358 -0.130 -7.990 1.00 62.35 C ATOM 1289 C PHE A 777 7.284 1.031 -7.539 1.00 71.24 C ATOM 1290 O PHE A 777 7.170 1.514 -6.413 1.00 72.60 O ATOM 1291 CB PHE A 777 5.724 -0.865 -6.769 1.00 66.61 C ATOM 1292 CG PHE A 777 5.394 -2.338 -6.918 1.00 67.26 C ATOM 1293 CD1 PHE A 777 4.416 -2.765 -7.811 1.00 67.98 C ATOM 1294 CD2 PHE A 777 6.049 -3.295 -6.152 1.00 71.56 C ATOM 1295 CE1 PHE A 777 4.101 -4.123 -7.933 1.00 68.14 C ATOM 1296 CE2 PHE A 777 5.734 -4.653 -6.277 1.00 73.67 C ATOM 1297 CZ PHE A 777 4.763 -5.056 -7.168 1.00 69.17 C ATOM 1298 H PHE A 777 6.592 -1.153 -9.866 1.00 0.00 H ATOM 1299 N GLY A 778 8.154 1.488 -8.437 1.00 69.86 N ATOM 1300 CA GLY A 778 9.077 2.587 -8.160 1.00 73.12 C ATOM 1301 C GLY A 778 8.819 3.814 -9.013 1.00 80.08 C ATOM 1302 O GLY A 778 7.795 3.889 -9.703 1.00 78.67 O ATOM 1303 H GLY A 778 8.178 1.044 -9.377 1.00 0.00 H ATOM 1304 N LEU A 779 9.758 4.784 -8.973 1.00 79.88 N ATOM 1305 CA LEU A 779 9.709 6.046 -9.723 1.00114.88 C ATOM 1306 C LEU A 779 9.733 5.798 -11.237 1.00147.80 C ATOM 1307 O LEU A 779 9.012 6.461 -11.979 1.00111.19 O ATOM 1308 CB LEU A 779 10.893 6.945 -9.310 1.00117.87 C ATOM 1309 CG LEU A 779 10.914 8.380 -9.852 1.00123.08 C ATOM 1310 CD1 LEU A 779 10.026 9.299 -9.030 1.00127.42 C ATOM 1311 CD2 LEU A 779 12.329 8.918 -9.910 1.00125.31 C ATOM 1312 H LEU A 779 10.583 4.624 -8.361 1.00 0.00 H TER 1313 LEU A 779 ATOM 1314 N GLU A 784 8.852 10.790 -19.125 1.00 66.35 N ATOM 1315 CA GLU A 784 7.823 10.625 -20.154 1.00 63.82 C ATOM 1316 C GLU A 784 8.239 11.374 -21.435 1.00 66.18 C ATOM 1317 O GLU A 784 8.132 12.598 -21.488 1.00 66.29 O ATOM 1318 CB GLU A 784 6.448 11.101 -19.628 1.00 65.23 C ATOM 1319 CG GLU A 784 5.294 10.896 -20.596 1.00 69.92 C ATOM 1320 CD GLU A 784 4.697 9.506 -20.571 1.00 79.35 C ATOM 1321 OE1 GLU A 784 5.254 8.604 -21.235 1.00 47.78 O ATOM 1322 OE2 GLU A 784 3.668 9.318 -19.885 1.00 81.84 O ATOM 1323 HN3 GLU A 784 8.967 11.801 -18.910 1.00 0.00 H ATOM 1324 HN2 GLU A 784 9.753 10.404 -19.472 1.00 0.00 H ATOM 1325 HN1 GLU A 784 8.564 10.282 -18.264 1.00 0.00 H ATOM 1326 N ASP A 785 8.711 10.623 -22.458 1.00 60.50 N ATOM 1327 CA ASP A 785 9.172 11.155 -23.750 1.00 60.00 C ATOM 1328 C ASP A 785 8.106 11.978 -24.485 1.00 62.13 C ATOM 1329 O ASP A 785 8.410 13.067 -24.979 1.00 63.74 O ATOM 1330 CB ASP A 785 9.686 10.019 -24.653 1.00 60.04 C ATOM 1331 CG ASP A 785 10.898 9.256 -24.129 1.00 71.85 C ATOM 1332 OD1 ASP A 785 11.624 9.803 -23.256 1.00 72.25 O ATOM 1333 OD2 ASP A 785 11.138 8.121 -24.609 1.00 77.61 O ATOM 1334 H ASP A 785 8.751 9.593 -22.320 1.00 0.00 H ATOM 1335 N ASP A 786 6.864 11.449 -24.576 1.00 53.59 N ATOM 1336 CA ASP A 786 5.767 12.151 -25.243 1.00 52.75 C ATOM 1337 C ASP A 786 4.446 11.781 -24.565 1.00 49.73 C ATOM 1338 O ASP A 786 4.015 10.637 -24.708 1.00 46.48 O ATOM 1339 CB ASP A 786 5.735 11.805 -26.760 1.00 54.40 C ATOM 1340 CG ASP A 786 4.685 12.522 -27.607 1.00 67.41 C ATOM 1341 OD1 ASP A 786 4.047 13.475 -27.098 1.00 67.83 O ATOM 1342 OD2 ASP A 786 4.513 12.139 -28.786 1.00 76.10 O ATOM 1343 H ASP A 786 6.683 10.514 -24.159 1.00 0.00 H ATOM 1344 N PRO A 787 3.782 12.726 -23.847 1.00 45.32 N ATOM 1345 CA PRO A 787 2.470 12.406 -23.242 1.00 43.54 C ATOM 1346 C PRO A 787 1.404 12.056 -24.289 1.00 43.75 C ATOM 1347 O PRO A 787 0.391 11.458 -23.912 1.00 41.66 O ATOM 1348 CB PRO A 787 2.108 13.679 -22.462 1.00 47.95 C ATOM 1349 CG PRO A 787 3.409 14.446 -22.340 1.00 54.26 C ATOM 1350 CD PRO A 787 4.160 14.128 -23.584 1.00 49.04 C ATOM 1351 N SER A 788 1.643 12.408 -25.548 1.00 38.85 N ATOM 1352 CA SER A 788 0.759 12.071 -26.661 1.00 38.01 C ATOM 1353 C SER A 788 0.786 10.562 -26.984 1.00 37.74 C ATOM 1354 O SER A 788 -0.183 10.010 -27.467 1.00 36.53 O ATOM 1355 CB SER A 788 1.017 12.953 -27.883 1.00 41.68 C ATOM 1356 OG SER A 788 1.813 12.318 -28.848 1.00 49.08 O ATOM 1357 HG SER A 788 2.689 12.085 -28.450 1.00 0.00 H ATOM 1358 H SER A 788 2.505 12.952 -25.752 1.00 0.00 H ATOM 1359 N ASP A 789 1.920 9.927 -26.709 1.00 33.69 N ATOM 1360 CA ASP A 789 2.139 8.494 -26.911 1.00 33.03 C ATOM 1361 C ASP A 789 2.720 8.038 -25.586 1.00 37.39 C ATOM 1362 O ASP A 789 3.901 7.770 -25.467 1.00 36.30 O ATOM 1363 CB ASP A 789 3.121 8.241 -28.046 1.00 34.52 C ATOM 1364 CG ASP A 789 2.470 8.304 -29.406 1.00 43.47 C ATOM 1365 OD1 ASP A 789 1.314 7.879 -29.540 1.00 41.35 O ATOM 1366 OD2 ASP A 789 3.118 8.774 -30.350 1.00 44.24 O ATOM 1367 H ASP A 789 2.707 10.487 -26.323 1.00 0.00 H ATOM 1368 N PRO A 790 1.806 7.978 -24.549 1.00 34.65 N ATOM 1369 CA PRO A 790 2.380 7.635 -23.241 1.00 34.29 C ATOM 1370 C PRO A 790 2.901 6.219 -23.051 1.00 35.89 C ATOM 1371 O PRO A 790 2.467 5.303 -23.722 1.00 34.05 O ATOM 1372 CB PRO A 790 1.237 7.906 -22.270 1.00 36.64 C ATOM 1373 CG PRO A 790 0.033 7.554 -23.028 1.00 41.08 C ATOM 1374 CD PRO A 790 0.294 8.148 -24.364 1.00 36.01 C ATOM 1375 N THR A 791 3.831 6.081 -22.114 1.00 33.24 N ATOM 1376 CA THR A 791 4.438 4.809 -21.781 1.00 31.29 C ATOM 1377 C THR A 791 3.358 3.865 -21.294 1.00 36.14 C ATOM 1378 O THR A 791 3.364 2.701 -21.654 1.00 35.44 O ATOM 1379 CB THR A 791 5.507 4.981 -20.697 1.00 38.05 C ATOM 1380 OG1 THR A 791 6.512 5.876 -21.171 1.00 37.41 O ATOM 1381 CG2 THR A 791 6.136 3.650 -20.350 1.00 34.87 C ATOM 1382 HG1 THR A 791 6.924 5.503 -21.990 1.00 0.00 H ATOM 1383 H THR A 791 4.139 6.927 -21.594 1.00 0.00 H ATOM 1384 N TYR A 792 2.423 4.362 -20.491 1.00 33.11 N ATOM 1385 CA TYR A 792 1.311 3.510 -20.038 1.00 32.86 C ATOM 1386 C TYR A 792 0.004 4.042 -20.612 1.00 38.97 C ATOM 1387 O TYR A 792 -0.245 5.241 -20.565 1.00 37.77 O ATOM 1388 CB TYR A 792 1.203 3.476 -18.496 1.00 34.36 C ATOM 1389 CG TYR A 792 2.415 2.877 -17.826 1.00 34.94 C ATOM 1390 CD1 TYR A 792 2.523 1.500 -17.639 1.00 34.79 C ATOM 1391 CD2 TYR A 792 3.470 3.684 -17.398 1.00 37.34 C ATOM 1392 CE1 TYR A 792 3.650 0.939 -17.046 1.00 35.42 C ATOM 1393 CE2 TYR A 792 4.614 3.131 -16.822 1.00 38.60 C ATOM 1394 CZ TYR A 792 4.691 1.759 -16.635 1.00 43.27 C ATOM 1395 OH TYR A 792 5.805 1.210 -16.056 1.00 40.59 O ATOM 1396 HH TYR A 792 5.696 0.228 -15.999 1.00 0.00 H ATOM 1397 H TYR A 792 2.477 5.354 -20.182 1.00 0.00 H ATOM 1398 N THR A 793 -0.851 3.147 -21.091 1.00 36.45 N ATOM 1399 CA THR A 793 -2.155 3.541 -21.627 1.00 38.09 C ATOM 1400 C THR A 793 -3.172 3.176 -20.579 1.00 48.89 C ATOM 1401 O THR A 793 -3.194 2.026 -20.140 1.00 46.70 O ATOM 1402 CB THR A 793 -2.434 2.829 -22.955 1.00 38.54 C ATOM 1403 OG1 THR A 793 -1.420 3.217 -23.882 1.00 39.83 O ATOM 1404 CG2 THR A 793 -3.852 3.127 -23.519 1.00 38.41 C ATOM 1405 HG1 THR A 793 -0.534 2.952 -23.530 1.00 0.00 H ATOM 1406 H THR A 793 -0.588 2.141 -21.085 1.00 0.00 H ATOM 1407 N SER A 794 -4.028 4.153 -20.192 1.00 53.09 N ATOM 1408 CA SER A 794 -5.114 3.951 -19.230 1.00 57.60 C ATOM 1409 C SER A 794 -6.081 2.978 -19.899 1.00 67.49 C ATOM 1410 O SER A 794 -6.848 3.368 -20.786 1.00 67.79 O ATOM 1411 CB SER A 794 -5.789 5.283 -18.903 1.00 63.91 C ATOM 1412 OG SER A 794 -4.876 6.173 -18.283 1.00 72.10 O ATOM 1413 HG SER A 794 -5.335 7.027 -18.081 1.00 0.00 H ATOM 1414 H SER A 794 -3.907 5.101 -20.602 1.00 0.00 H ATOM 1415 N SER A 795 -5.993 1.719 -19.505 1.00 67.91 N ATOM 1416 CA SER A 795 -6.844 0.708 -20.076 1.00 69.64 C ATOM 1417 C SER A 795 -7.693 0.093 -18.997 1.00 79.03 C ATOM 1418 O SER A 795 -7.173 -0.471 -18.036 1.00 79.49 O ATOM 1419 CB SER A 795 -6.007 -0.383 -20.739 1.00 72.70 C ATOM 1420 OG SER A 795 -5.040 0.166 -21.611 1.00 82.20 O ATOM 1421 HG SER A 795 -4.435 0.759 -21.099 1.00 0.00 H ATOM 1422 H SER A 795 -5.301 1.456 -18.774 1.00 0.00 H ATOM 1423 N LEU A 796 -9.002 0.205 -19.203 1.00 78.70 N ATOM 1424 CA LEU A 796 -10.056 -0.316 -18.341 1.00 81.27 C ATOM 1425 C LEU A 796 -9.620 -0.872 -16.998 1.00 86.21 C ATOM 1426 O LEU A 796 -9.622 -0.159 -15.994 1.00 88.12 O ATOM 1427 CB LEU A 796 -10.882 -1.326 -19.127 1.00 81.68 C ATOM 1428 CG LEU A 796 -11.315 -0.669 -20.440 1.00 86.12 C ATOM 1429 CD1 LEU A 796 -10.595 -1.249 -21.646 1.00 84.16 C ATOM 1430 CD2 LEU A 796 -12.825 -0.671 -20.624 1.00 90.82 C ATOM 1431 H LEU A 796 -9.302 0.712 -20.060 1.00 0.00 H ATOM 1432 N GLY A 797 -9.249 -2.144 -16.980 1.00 81.17 N ATOM 1433 CA GLY A 797 -8.816 -2.769 -15.748 1.00 81.59 C ATOM 1434 C GLY A 797 -7.563 -2.166 -15.145 1.00 82.63 C ATOM 1435 O GLY A 797 -7.497 -1.960 -13.931 1.00 83.36 O ATOM 1436 H GLY A 797 -9.269 -2.699 -17.859 1.00 0.00 H ATOM 1437 N GLY A 798 -6.567 -1.886 -15.978 1.00 74.96 N ATOM 1438 CA GLY A 798 -5.322 -1.307 -15.498 1.00 71.82 C ATOM 1439 C GLY A 798 -4.447 -0.718 -16.588 1.00 67.21 C ATOM 1440 O GLY A 798 -4.674 -0.977 -17.763 1.00 65.29 O ATOM 1441 H GLY A 798 -6.679 -2.085 -16.993 1.00 0.00 H ATOM 1442 N LYS A 799 -3.444 0.063 -16.198 1.00 58.18 N ATOM 1443 CA LYS A 799 -2.497 0.649 -17.156 1.00 53.53 C ATOM 1444 C LYS A 799 -1.678 -0.438 -17.865 1.00 50.60 C ATOM 1445 O LYS A 799 -1.246 -1.394 -17.227 1.00 50.31 O ATOM 1446 CB LYS A 799 -1.543 1.628 -16.457 1.00 56.46 C ATOM 1447 CG LYS A 799 -2.216 2.899 -15.961 1.00 76.69 C ATOM 1448 CD LYS A 799 -1.250 3.768 -15.170 1.00 91.69 C ATOM 1449 CE LYS A 799 -1.931 4.997 -14.614 1.00107.28 C ATOM 1450 NZ LYS A 799 -1.017 5.792 -13.753 1.00118.64 N ATOM 1451 HZ1 LYS A 799 -0.697 5.206 -12.956 1.00 0.00 H ATOM 1452 HZ2 LYS A 799 -0.195 6.098 -14.312 1.00 0.00 H ATOM 1453 HZ3 LYS A 799 -1.522 6.626 -13.391 1.00 0.00 H ATOM 1454 H LYS A 799 -3.326 0.265 -15.185 1.00 0.00 H ATOM 1455 N ILE A 800 -1.453 -0.278 -19.177 1.00 42.06 N ATOM 1456 CA ILE A 800 -0.650 -1.231 -19.949 1.00 39.01 C ATOM 1457 C ILE A 800 0.441 -0.482 -20.730 1.00 37.98 C ATOM 1458 O ILE A 800 0.112 0.470 -21.452 1.00 35.96 O ATOM 1459 CB ILE A 800 -1.533 -2.165 -20.850 1.00 42.95 C ATOM 1460 CG1 ILE A 800 -2.153 -3.304 -19.999 1.00 46.05 C ATOM 1461 CG2 ILE A 800 -0.764 -2.767 -22.046 1.00 42.89 C ATOM 1462 CD1 ILE A 800 -3.151 -4.198 -20.722 1.00 59.11 C ATOM 1463 H ILE A 800 -1.860 0.547 -19.662 1.00 0.00 H ATOM 1464 N PRO A 801 1.718 -0.939 -20.615 1.00 32.85 N ATOM 1465 CA PRO A 801 2.809 -0.312 -21.390 1.00 31.43 C ATOM 1466 C PRO A 801 2.846 -0.974 -22.767 1.00 31.55 C ATOM 1467 O PRO A 801 3.460 -2.037 -22.949 1.00 27.86 O ATOM 1468 CB PRO A 801 4.057 -0.632 -20.554 1.00 33.43 C ATOM 1469 CG PRO A 801 3.732 -1.944 -19.874 1.00 37.57 C ATOM 1470 CD PRO A 801 2.224 -2.045 -19.766 1.00 34.23 C ATOM 1471 N ILE A 802 2.203 -0.363 -23.744 1.00 28.28 N ATOM 1472 CA ILE A 802 2.050 -0.976 -25.051 1.00 28.73 C ATOM 1473 C ILE A 802 3.341 -1.390 -25.761 1.00 31.44 C ATOM 1474 O ILE A 802 3.386 -2.453 -26.352 1.00 29.39 O ATOM 1475 CB ILE A 802 1.194 -0.063 -25.969 1.00 33.03 C ATOM 1476 CG1 ILE A 802 -0.238 0.007 -25.447 1.00 35.43 C ATOM 1477 CG2 ILE A 802 1.190 -0.536 -27.410 1.00 33.25 C ATOM 1478 CD1 ILE A 802 -1.102 0.984 -26.197 1.00 45.84 C ATOM 1479 H ILE A 802 1.797 0.579 -23.574 1.00 0.00 H ATOM 1480 N ARG A 803 4.372 -0.570 -25.697 1.00 27.95 N ATOM 1481 CA ARG A 803 5.632 -0.886 -26.361 1.00 27.43 C ATOM 1482 C ARG A 803 6.341 -2.136 -25.819 1.00 28.36 C ATOM 1483 O ARG A 803 7.102 -2.767 -26.522 1.00 29.05 O ATOM 1484 CB ARG A 803 6.534 0.344 -26.436 1.00 25.00 C ATOM 1485 CG ARG A 803 5.986 1.358 -27.420 1.00 27.54 C ATOM 1486 CD ARG A 803 6.637 2.728 -27.380 1.00 29.33 C ATOM 1487 NE ARG A 803 5.701 3.705 -27.910 1.00 33.74 N ATOM 1488 CZ ARG A 803 5.778 4.271 -29.105 1.00 41.54 C ATOM 1489 NH1 ARG A 803 6.783 4.017 -29.917 1.00 31.93 N ATOM 1490 NH2 ARG A 803 4.842 5.114 -29.479 1.00 38.44 N ATOM 1491 HE ARG A 803 4.905 3.983 -27.301 1.00 0.00 H ATOM 1492 HH12 ARG A 803 6.824 4.472 -30.851 1.00 0.00 H ATOM 1493 HH11 ARG A 803 7.535 3.361 -29.624 1.00 0.00 H ATOM 1494 HH22 ARG A 803 4.892 5.565 -30.415 1.00 0.00 H ATOM 1495 HH21 ARG A 803 4.051 5.331 -28.839 1.00 0.00 H ATOM 1496 H ARG A 803 4.285 0.318 -25.163 1.00 0.00 H ATOM 1497 N TRP A 804 6.108 -2.449 -24.556 1.00 24.67 N ATOM 1498 CA TRP A 804 6.716 -3.613 -23.927 1.00 26.87 C ATOM 1499 C TRP A 804 5.818 -4.847 -23.762 1.00 29.17 C ATOM 1500 O TRP A 804 6.282 -5.872 -23.293 1.00 28.89 O ATOM 1501 CB TRP A 804 7.211 -3.214 -22.531 1.00 26.61 C ATOM 1502 CG TRP A 804 8.388 -2.327 -22.548 1.00 28.64 C ATOM 1503 CD1 TRP A 804 9.682 -2.689 -22.364 1.00 31.71 C ATOM 1504 CD2 TRP A 804 8.393 -0.921 -22.788 1.00 29.14 C ATOM 1505 NE1 TRP A 804 10.495 -1.600 -22.468 1.00 32.62 N ATOM 1506 CE2 TRP A 804 9.728 -0.497 -22.729 1.00 34.05 C ATOM 1507 CE3 TRP A 804 7.399 0.022 -23.040 1.00 30.10 C ATOM 1508 CZ2 TRP A 804 10.093 0.829 -22.914 1.00 35.14 C ATOM 1509 CZ3 TRP A 804 7.762 1.328 -23.222 1.00 32.43 C ATOM 1510 CH2 TRP A 804 9.097 1.723 -23.161 1.00 34.33 C ATOM 1511 HE1 TRP A 804 11.530 -1.606 -22.366 1.00 0.00 H ATOM 1512 H TRP A 804 5.472 -1.847 -23.995 1.00 0.00 H ATOM 1513 N THR A 805 4.551 -4.748 -24.144 1.00 26.35 N ATOM 1514 CA THR A 805 3.590 -5.820 -23.893 1.00 25.44 C ATOM 1515 C THR A 805 3.363 -6.756 -25.088 1.00 28.68 C ATOM 1516 O THR A 805 3.182 -6.286 -26.215 1.00 27.84 O ATOM 1517 CB THR A 805 2.274 -5.198 -23.364 1.00 31.69 C ATOM 1518 OG1 THR A 805 2.594 -4.420 -22.204 1.00 28.66 O ATOM 1519 CG2 THR A 805 1.237 -6.256 -22.936 1.00 29.91 C ATOM 1520 HG1 THR A 805 3.236 -3.708 -22.452 1.00 0.00 H ATOM 1521 H THR A 805 4.234 -3.887 -24.634 1.00 0.00 H ATOM 1522 N ALA A 806 3.302 -8.098 -24.811 1.00 26.42 N ATOM 1523 CA ALA A 806 3.033 -9.103 -25.830 1.00 25.86 C ATOM 1524 C ALA A 806 1.662 -8.850 -26.493 1.00 29.22 C ATOM 1525 O ALA A 806 0.730 -8.397 -25.831 1.00 28.50 O ATOM 1526 CB ALA A 806 3.075 -10.520 -25.232 1.00 26.36 C ATOM 1527 H ALA A 806 3.454 -8.411 -23.831 1.00 0.00 H ATOM 1528 N PRO A 807 1.536 -9.094 -27.811 1.00 29.07 N ATOM 1529 CA PRO A 807 0.261 -8.819 -28.499 1.00 30.01 C ATOM 1530 C PRO A 807 -0.944 -9.506 -27.873 1.00 32.82 C ATOM 1531 O PRO A 807 -2.029 -8.901 -27.868 1.00 32.82 O ATOM 1532 CB PRO A 807 0.487 -9.336 -29.928 1.00 32.47 C ATOM 1533 CG PRO A 807 1.928 -9.506 -30.076 1.00 36.02 C ATOM 1534 CD PRO A 807 2.550 -9.635 -28.738 1.00 31.60 C ATOM 1535 N GLU A 808 -0.763 -10.735 -27.309 1.00 29.35 N ATOM 1536 CA GLU A 808 -1.908 -11.453 -26.713 1.00 30.28 C ATOM 1537 C GLU A 808 -2.311 -10.856 -25.361 1.00 33.18 C ATOM 1538 O GLU A 808 -3.471 -10.951 -24.981 1.00 35.17 O ATOM 1539 CB GLU A 808 -1.674 -12.981 -26.638 1.00 31.86 C ATOM 1540 CG GLU A 808 -0.658 -13.455 -25.601 1.00 34.43 C ATOM 1541 CD GLU A 808 0.826 -13.313 -25.914 1.00 33.20 C ATOM 1542 OE1 GLU A 808 1.190 -12.779 -26.990 1.00 30.46 O ATOM 1543 OE2 GLU A 808 1.635 -13.740 -25.059 1.00 32.46 O ATOM 1544 H GLU A 808 0.183 -11.167 -27.299 1.00 0.00 H ATOM 1545 N ALA A 809 -1.345 -10.242 -24.654 1.00 29.71 N ATOM 1546 CA ALA A 809 -1.618 -9.597 -23.373 1.00 30.49 C ATOM 1547 C ALA A 809 -2.319 -8.257 -23.648 1.00 36.19 C ATOM 1548 O ALA A 809 -3.218 -7.907 -22.891 1.00 35.27 O ATOM 1549 CB ALA A 809 -0.331 -9.394 -22.576 1.00 29.97 C ATOM 1550 H ALA A 809 -0.376 -10.226 -25.031 1.00 0.00 H ATOM 1551 N ILE A 810 -1.963 -7.538 -24.754 1.00 32.84 N ATOM 1552 CA ILE A 810 -2.656 -6.279 -25.114 1.00 33.46 C ATOM 1553 C ILE A 810 -4.108 -6.624 -25.522 1.00 40.19 C ATOM 1554 O ILE A 810 -5.046 -5.959 -25.071 1.00 39.93 O ATOM 1555 CB ILE A 810 -1.951 -5.504 -26.271 1.00 34.85 C ATOM 1556 CG1 ILE A 810 -0.568 -4.954 -25.846 1.00 32.46 C ATOM 1557 CG2 ILE A 810 -2.851 -4.330 -26.822 1.00 37.67 C ATOM 1558 CD1 ILE A 810 0.311 -4.500 -27.010 1.00 34.34 C ATOM 1559 H ILE A 810 -1.188 -7.882 -25.357 1.00 0.00 H ATOM 1560 N ALA A 811 -4.271 -7.639 -26.409 1.00 37.71 N ATOM 1561 CA ALA A 811 -5.563 -8.032 -26.979 1.00 40.19 C ATOM 1562 C ALA A 811 -6.531 -8.697 -26.007 1.00 48.24 C ATOM 1563 O ALA A 811 -7.711 -8.321 -25.975 1.00 47.27 O ATOM 1564 CB ALA A 811 -5.360 -8.931 -28.197 1.00 40.97 C ATOM 1565 H ALA A 811 -3.427 -8.171 -26.702 1.00 0.00 H ATOM 1566 N TYR A 812 -6.054 -9.698 -25.242 1.00 47.17 N ATOM 1567 CA TYR A 812 -6.930 -10.482 -24.360 1.00 50.02 C ATOM 1568 C TYR A 812 -6.568 -10.478 -22.876 1.00 52.40 C ATOM 1569 O TYR A 812 -7.210 -11.213 -22.114 1.00 54.58 O ATOM 1570 CB TYR A 812 -7.001 -11.943 -24.866 1.00 54.26 C ATOM 1571 CG TYR A 812 -7.229 -12.074 -26.357 1.00 60.18 C ATOM 1572 CD1 TYR A 812 -8.464 -11.763 -26.924 1.00 65.05 C ATOM 1573 CD2 TYR A 812 -6.212 -12.504 -27.202 1.00 60.83 C ATOM 1574 CE1 TYR A 812 -8.672 -11.858 -28.300 1.00 68.39 C ATOM 1575 CE2 TYR A 812 -6.413 -12.616 -28.577 1.00 62.98 C ATOM 1576 CZ TYR A 812 -7.642 -12.286 -29.123 1.00 75.71 C ATOM 1577 OH TYR A 812 -7.840 -12.400 -30.480 1.00 82.36 O ATOM 1578 HH TYR A 812 -7.199 -11.815 -30.956 1.00 0.00 H ATOM 1579 H TYR A 812 -5.039 -9.922 -25.276 1.00 0.00 H ATOM 1580 N ARG A 813 -5.558 -9.670 -22.451 1.00 45.02 N ATOM 1581 CA ARG A 813 -5.053 -9.634 -21.057 1.00 44.50 C ATOM 1582 C ARG A 813 -4.498 -11.021 -20.672 1.00 46.31 C ATOM 1583 O ARG A 813 -4.591 -11.461 -19.523 1.00 46.36 O ATOM 1584 CB ARG A 813 -6.119 -9.128 -20.038 1.00 48.14 C ATOM 1585 CG ARG A 813 -6.786 -7.788 -20.398 1.00 61.42 C ATOM 1586 CD ARG A 813 -5.922 -6.564 -20.148 1.00 72.26 C ATOM 1587 NE ARG A 813 -5.491 -6.447 -18.753 1.00 86.09 N ATOM 1588 CZ ARG A 813 -5.461 -5.312 -18.060 1.00101.47 C ATOM 1589 NH1 ARG A 813 -5.862 -4.174 -18.617 1.00 86.50 N ATOM 1590 NH2 ARG A 813 -5.044 -5.307 -16.802 1.00 91.19 N ATOM 1591 HE ARG A 813 -5.186 -7.315 -18.269 1.00 0.00 H ATOM 1592 HH12 ARG A 813 -5.836 -3.290 -18.070 1.00 0.00 H ATOM 1593 HH11 ARG A 813 -6.202 -4.168 -19.600 1.00 0.00 H ATOM 1594 HH22 ARG A 813 -5.023 -4.417 -16.265 1.00 0.00 H ATOM 1595 HH21 ARG A 813 -4.738 -6.193 -16.352 1.00 0.00 H ATOM 1596 H ARG A 813 -5.113 -9.039 -23.147 1.00 0.00 H ATOM 1597 N LYS A 814 -3.936 -11.727 -21.662 1.00 41.71 N ATOM 1598 CA LYS A 814 -3.342 -13.049 -21.425 1.00 41.08 C ATOM 1599 C LYS A 814 -1.917 -12.813 -20.912 1.00 41.61 C ATOM 1600 O LYS A 814 -0.968 -12.925 -21.688 1.00 39.05 O ATOM 1601 CB LYS A 814 -3.329 -13.891 -22.719 1.00 42.61 C ATOM 1602 CG LYS A 814 -4.687 -14.467 -23.117 1.00 49.35 C ATOM 1603 CD LYS A 814 -4.491 -15.589 -24.123 1.00 59.22 C ATOM 1604 CE LYS A 814 -5.775 -16.329 -24.420 1.00 78.99 C ATOM 1605 NZ LYS A 814 -5.547 -17.469 -25.348 1.00 86.95 N ATOM 1606 HZ1 LYS A 814 -5.158 -17.112 -26.244 1.00 0.00 H ATOM 1607 HZ2 LYS A 814 -4.875 -18.136 -24.918 1.00 0.00 H ATOM 1608 HZ3 LYS A 814 -6.450 -17.953 -25.529 1.00 0.00 H ATOM 1609 H LYS A 814 -3.920 -11.329 -22.623 1.00 0.00 H ATOM 1610 N PHE A 815 -1.778 -12.415 -19.630 1.00 38.81 N ATOM 1611 CA PHE A 815 -0.456 -12.166 -19.023 1.00 37.13 C ATOM 1612 C PHE A 815 0.099 -13.474 -18.467 1.00 39.82 C ATOM 1613 O PHE A 815 -0.537 -14.115 -17.621 1.00 39.51 O ATOM 1614 CB PHE A 815 -0.508 -11.060 -17.937 1.00 39.44 C ATOM 1615 CG PHE A 815 -0.668 -9.641 -18.451 1.00 38.55 C ATOM 1616 CD1 PHE A 815 0.436 -8.901 -18.856 1.00 38.89 C ATOM 1617 CD2 PHE A 815 -1.920 -9.030 -18.481 1.00 41.43 C ATOM 1618 CE1 PHE A 815 0.289 -7.590 -19.338 1.00 39.42 C ATOM 1619 CE2 PHE A 815 -2.068 -7.716 -18.954 1.00 43.34 C ATOM 1620 CZ PHE A 815 -0.960 -7.005 -19.378 1.00 39.90 C ATOM 1621 H PHE A 815 -2.631 -12.279 -19.051 1.00 0.00 H ATOM 1622 N THR A 816 1.261 -13.909 -18.978 1.00 33.66 N ATOM 1623 CA THR A 816 1.880 -15.177 -18.537 1.00 34.53 C ATOM 1624 C THR A 816 3.377 -14.961 -18.486 1.00 36.40 C ATOM 1625 O THR A 816 3.849 -13.906 -18.908 1.00 33.96 O ATOM 1626 CB THR A 816 1.589 -16.321 -19.555 1.00 40.08 C ATOM 1627 OG1 THR A 816 2.171 -15.953 -20.822 1.00 37.91 O ATOM 1628 CG2 THR A 816 0.081 -16.626 -19.719 1.00 36.60 C ATOM 1629 HG1 THR A 816 1.767 -15.106 -21.136 1.00 0.00 H ATOM 1630 H THR A 816 1.739 -13.338 -19.704 1.00 0.00 H ATOM 1631 N SER A 817 4.143 -15.991 -18.073 1.00 34.06 N ATOM 1632 CA SER A 817 5.603 -15.874 -18.128 1.00 33.39 C ATOM 1633 C SER A 817 6.056 -15.719 -19.595 1.00 33.19 C ATOM 1634 O SER A 817 7.030 -15.028 -19.834 1.00 31.09 O ATOM 1635 CB SER A 817 6.291 -17.058 -17.454 1.00 37.84 C ATOM 1636 OG SER A 817 6.120 -16.940 -16.050 1.00 45.87 O ATOM 1637 HG SER A 817 6.525 -16.092 -15.739 1.00 0.00 H ATOM 1638 H SER A 817 3.701 -16.863 -17.718 1.00 0.00 H ATOM 1639 N ALA A 818 5.312 -16.288 -20.566 1.00 29.66 N ATOM 1640 CA ALA A 818 5.632 -16.130 -21.999 1.00 28.94 C ATOM 1641 C ALA A 818 5.427 -14.676 -22.452 1.00 29.60 C ATOM 1642 O ALA A 818 6.137 -14.215 -23.360 1.00 26.37 O ATOM 1643 CB ALA A 818 4.752 -17.053 -22.842 1.00 30.23 C ATOM 1644 H ALA A 818 4.485 -16.857 -20.296 1.00 0.00 H ATOM 1645 N SER A 819 4.418 -13.955 -21.889 1.00 26.89 N ATOM 1646 CA SER A 819 4.274 -12.544 -22.291 1.00 25.59 C ATOM 1647 C SER A 819 5.392 -11.715 -21.613 1.00 29.07 C ATOM 1648 O SER A 819 5.892 -10.768 -22.208 1.00 26.51 O ATOM 1649 CB SER A 819 2.872 -12.001 -22.010 1.00 28.57 C ATOM 1650 OG SER A 819 2.549 -12.045 -20.630 1.00 30.23 O ATOM 1651 HG SER A 819 3.199 -11.498 -20.122 1.00 0.00 H ATOM 1652 H SER A 819 3.771 -14.386 -21.198 1.00 0.00 H ATOM 1653 N ASP A 820 5.888 -12.157 -20.429 1.00 27.50 N ATOM 1654 CA ASP A 820 7.040 -11.500 -19.796 1.00 27.41 C ATOM 1655 C ASP A 820 8.307 -11.722 -20.668 1.00 29.63 C ATOM 1656 O ASP A 820 9.178 -10.853 -20.701 1.00 28.33 O ATOM 1657 CB ASP A 820 7.317 -12.072 -18.401 1.00 29.52 C ATOM 1658 CG ASP A 820 6.507 -11.476 -17.267 1.00 36.76 C ATOM 1659 OD1 ASP A 820 5.840 -10.417 -17.489 1.00 33.77 O ATOM 1660 OD2 ASP A 820 6.512 -12.074 -16.166 1.00 36.99 O ATOM 1661 H ASP A 820 5.445 -12.974 -19.962 1.00 0.00 H ATOM 1662 N VAL A 821 8.383 -12.863 -21.371 1.00 26.36 N ATOM 1663 CA VAL A 821 9.518 -13.171 -22.278 1.00 25.41 C ATOM 1664 C VAL A 821 9.521 -12.168 -23.443 1.00 26.58 C ATOM 1665 O VAL A 821 10.587 -11.709 -23.863 1.00 26.64 O ATOM 1666 CB VAL A 821 9.537 -14.646 -22.742 1.00 28.69 C ATOM 1667 CG1 VAL A 821 10.454 -14.849 -23.973 1.00 27.21 C ATOM 1668 CG2 VAL A 821 9.964 -15.555 -21.585 1.00 29.40 C ATOM 1669 H VAL A 821 7.616 -13.559 -21.277 1.00 0.00 H ATOM 1670 N TRP A 822 8.345 -11.860 -23.984 1.00 24.45 N ATOM 1671 CA TRP A 822 8.215 -10.823 -25.026 1.00 24.72 C ATOM 1672 C TRP A 822 8.810 -9.511 -24.476 1.00 27.90 C ATOM 1673 O TRP A 822 9.660 -8.904 -25.146 1.00 26.46 O ATOM 1674 CB TRP A 822 6.720 -10.608 -25.399 1.00 22.72 C ATOM 1675 CG TRP A 822 6.532 -9.523 -26.427 1.00 23.00 C ATOM 1676 CD1 TRP A 822 6.764 -8.183 -26.272 1.00 25.48 C ATOM 1677 CD2 TRP A 822 6.206 -9.716 -27.807 1.00 22.49 C ATOM 1678 NE1 TRP A 822 6.480 -7.517 -27.444 1.00 24.89 N ATOM 1679 CE2 TRP A 822 6.170 -8.435 -28.412 1.00 26.21 C ATOM 1680 CE3 TRP A 822 5.871 -10.850 -28.578 1.00 24.99 C ATOM 1681 CZ2 TRP A 822 5.879 -8.257 -29.765 1.00 25.77 C ATOM 1682 CZ3 TRP A 822 5.542 -10.667 -29.914 1.00 27.13 C ATOM 1683 CH2 TRP A 822 5.610 -9.392 -30.509 1.00 27.47 C ATOM 1684 HE1 TRP A 822 6.498 -6.485 -27.573 1.00 0.00 H ATOM 1685 H TRP A 822 7.494 -12.364 -23.664 1.00 0.00 H ATOM 1686 N SER A 823 8.376 -9.078 -23.247 1.00 25.72 N ATOM 1687 CA SER A 823 8.884 -7.860 -22.607 1.00 25.20 C ATOM 1688 C SER A 823 10.401 -7.933 -22.458 1.00 30.15 C ATOM 1689 O SER A 823 11.103 -6.932 -22.677 1.00 28.53 O ATOM 1690 CB SER A 823 8.243 -7.667 -21.229 1.00 26.19 C ATOM 1691 OG SER A 823 6.820 -7.632 -21.332 1.00 29.15 O ATOM 1692 HG SER A 823 6.551 -6.880 -21.918 1.00 0.00 H ATOM 1693 H SER A 823 7.656 -9.638 -22.748 1.00 0.00 H ATOM 1694 N TYR A 824 10.920 -9.130 -22.082 1.00 27.27 N ATOM 1695 CA TYR A 824 12.357 -9.321 -21.949 1.00 28.04 C ATOM 1696 C TYR A 824 13.058 -9.035 -23.281 1.00 32.26 C ATOM 1697 O TYR A 824 14.141 -8.460 -23.264 1.00 32.60 O ATOM 1698 CB TYR A 824 12.707 -10.743 -21.459 1.00 28.78 C ATOM 1699 CG TYR A 824 14.205 -10.933 -21.346 1.00 31.71 C ATOM 1700 CD1 TYR A 824 14.899 -10.500 -20.220 1.00 34.58 C ATOM 1701 CD2 TYR A 824 14.938 -11.497 -22.390 1.00 32.06 C ATOM 1702 CE1 TYR A 824 16.282 -10.649 -20.124 1.00 37.69 C ATOM 1703 CE2 TYR A 824 16.322 -11.639 -22.307 1.00 34.44 C ATOM 1704 CZ TYR A 824 16.989 -11.207 -21.174 1.00 38.79 C ATOM 1705 OH TYR A 824 18.348 -11.326 -21.085 1.00 39.45 O ATOM 1706 HH TYR A 824 18.653 -10.969 -20.213 1.00 0.00 H ATOM 1707 H TYR A 824 10.279 -9.925 -21.885 1.00 0.00 H ATOM 1708 N GLY A 825 12.481 -9.500 -24.398 1.00 28.51 N ATOM 1709 CA GLY A 825 13.043 -9.213 -25.719 1.00 29.84 C ATOM 1710 C GLY A 825 13.149 -7.705 -25.946 1.00 30.18 C ATOM 1711 O GLY A 825 14.148 -7.225 -26.478 1.00 27.11 O ATOM 1712 H GLY A 825 11.618 -10.075 -24.325 1.00 0.00 H ATOM 1713 N ILE A 826 12.112 -6.934 -25.537 1.00 26.90 N ATOM 1714 CA ILE A 826 12.166 -5.476 -25.624 1.00 25.91 C ATOM 1715 C ILE A 826 13.287 -4.923 -24.726 1.00 30.32 C ATOM 1716 O ILE A 826 14.025 -4.053 -25.172 1.00 29.81 O ATOM 1717 CB ILE A 826 10.799 -4.799 -25.373 1.00 27.30 C ATOM 1718 CG1 ILE A 826 9.714 -5.382 -26.323 1.00 25.86 C ATOM 1719 CG2 ILE A 826 10.934 -3.240 -25.515 1.00 29.75 C ATOM 1720 CD1 ILE A 826 9.874 -4.996 -27.847 1.00 28.73 C ATOM 1721 H ILE A 826 11.260 -7.390 -25.153 1.00 0.00 H ATOM 1722 N VAL A 827 13.447 -5.463 -23.494 1.00 29.42 N ATOM 1723 CA VAL A 827 14.554 -5.075 -22.592 1.00 30.97 C ATOM 1724 C VAL A 827 15.924 -5.318 -23.277 1.00 34.92 C ATOM 1725 O VAL A 827 16.807 -4.474 -23.196 1.00 36.02 O ATOM 1726 CB VAL A 827 14.473 -5.755 -21.185 1.00 35.39 C ATOM 1727 CG1 VAL A 827 15.739 -5.471 -20.350 1.00 37.09 C ATOM 1728 CG2 VAL A 827 13.239 -5.286 -20.429 1.00 34.86 C ATOM 1729 H VAL A 827 12.765 -6.178 -23.169 1.00 0.00 H ATOM 1730 N MET A 828 16.088 -6.462 -23.963 1.00 32.93 N ATOM 1731 CA MET A 828 17.334 -6.762 -24.689 1.00 33.65 C ATOM 1732 C MET A 828 17.622 -5.646 -25.698 1.00 35.49 C ATOM 1733 O MET A 828 18.746 -5.188 -25.785 1.00 36.59 O ATOM 1734 CB MET A 828 17.221 -8.079 -25.461 1.00 34.97 C ATOM 1735 CG MET A 828 17.345 -9.316 -24.619 1.00 37.27 C ATOM 1736 SD MET A 828 17.192 -10.778 -25.701 1.00 39.08 S ATOM 1737 CE MET A 828 18.869 -10.775 -26.395 1.00 37.75 C ATOM 1738 H MET A 828 15.313 -7.155 -23.982 1.00 0.00 H ATOM 1739 N TRP A 829 16.603 -5.245 -26.471 1.00 32.99 N ATOM 1740 CA TRP A 829 16.708 -4.177 -27.471 1.00 33.20 C ATOM 1741 C TRP A 829 17.073 -2.827 -26.817 1.00 37.22 C ATOM 1742 O TRP A 829 17.930 -2.106 -27.343 1.00 36.76 O ATOM 1743 CB TRP A 829 15.412 -4.094 -28.288 1.00 30.42 C ATOM 1744 CG TRP A 829 15.550 -3.208 -29.492 1.00 32.78 C ATOM 1745 CD1 TRP A 829 15.880 -3.593 -30.758 1.00 36.24 C ATOM 1746 CD2 TRP A 829 15.297 -1.800 -29.551 1.00 32.91 C ATOM 1747 NE1 TRP A 829 15.876 -2.504 -31.597 1.00 35.85 N ATOM 1748 CE2 TRP A 829 15.518 -1.392 -30.884 1.00 37.27 C ATOM 1749 CE3 TRP A 829 14.934 -0.827 -28.594 1.00 34.21 C ATOM 1750 CZ2 TRP A 829 15.390 -0.054 -31.290 1.00 37.04 C ATOM 1751 CZ3 TRP A 829 14.787 0.496 -29.003 1.00 35.61 C ATOM 1752 CH2 TRP A 829 14.981 0.863 -30.342 1.00 36.94 C ATOM 1753 HE1 TRP A 829 16.108 -2.522 -32.611 1.00 0.00 H ATOM 1754 H TRP A 829 15.684 -5.719 -26.355 1.00 0.00 H ATOM 1755 N GLU A 830 16.447 -2.506 -25.655 1.00 34.08 N ATOM 1756 CA GLU A 830 16.740 -1.277 -24.897 1.00 35.65 C ATOM 1757 C GLU A 830 18.213 -1.301 -24.447 1.00 40.94 C ATOM 1758 O GLU A 830 18.912 -0.298 -24.560 1.00 42.19 O ATOM 1759 CB GLU A 830 15.839 -1.159 -23.649 1.00 35.78 C ATOM 1760 CG GLU A 830 14.369 -0.864 -23.912 1.00 37.31 C ATOM 1761 CD GLU A 830 13.644 -0.662 -22.595 1.00 47.35 C ATOM 1762 OE1 GLU A 830 13.282 -1.665 -21.937 1.00 34.33 O ATOM 1763 OE2 GLU A 830 13.541 0.504 -22.162 1.00 41.67 O ATOM 1764 H GLU A 830 15.727 -3.158 -25.283 1.00 0.00 H ATOM 1765 N VAL A 831 18.683 -2.448 -23.946 1.00 38.67 N ATOM 1766 CA VAL A 831 20.083 -2.590 -23.500 1.00 39.47 C ATOM 1767 C VAL A 831 21.080 -2.413 -24.666 1.00 44.43 C ATOM 1768 O VAL A 831 21.990 -1.588 -24.571 1.00 45.29 O ATOM 1769 CB VAL A 831 20.318 -3.906 -22.700 1.00 42.63 C ATOM 1770 CG1 VAL A 831 21.821 -4.207 -22.496 1.00 44.74 C ATOM 1771 CG2 VAL A 831 19.594 -3.852 -21.359 1.00 42.01 C ATOM 1772 H VAL A 831 18.043 -3.264 -23.868 1.00 0.00 H ATOM 1773 N MET A 832 20.894 -3.167 -25.765 1.00 41.30 N ATOM 1774 CA MET A 832 21.819 -3.131 -26.918 1.00 41.78 C ATOM 1775 C MET A 832 21.779 -1.786 -27.671 1.00 46.36 C ATOM 1776 O MET A 832 22.705 -1.477 -28.413 1.00 46.64 O ATOM 1777 CB MET A 832 21.567 -4.326 -27.874 1.00 41.60 C ATOM 1778 CG MET A 832 21.772 -5.706 -27.240 1.00 43.11 C ATOM 1779 SD MET A 832 23.244 -5.868 -26.171 1.00 47.85 S ATOM 1780 CE MET A 832 24.569 -5.644 -27.383 1.00 47.75 C ATOM 1781 H MET A 832 20.069 -3.799 -25.805 1.00 0.00 H ATOM 1782 N SER A 833 20.722 -0.972 -27.454 1.00 42.00 N ATOM 1783 CA SER A 833 20.614 0.339 -28.088 1.00 42.60 C ATOM 1784 C SER A 833 20.999 1.496 -27.135 1.00 46.76 C ATOM 1785 O SER A 833 20.879 2.659 -27.525 1.00 46.61 O ATOM 1786 CB SER A 833 19.197 0.542 -28.615 1.00 42.80 C ATOM 1787 OG SER A 833 18.299 0.741 -27.538 1.00 41.62 O ATOM 1788 HG SER A 833 18.315 -0.052 -26.946 1.00 0.00 H ATOM 1789 H SER A 833 19.963 -1.289 -26.817 1.00 0.00 H ATOM 1790 N TYR A 834 21.438 1.174 -25.891 1.00 43.68 N ATOM 1791 CA TYR A 834 21.766 2.132 -24.820 1.00 45.60 C ATOM 1792 C TYR A 834 20.553 3.011 -24.416 1.00 48.13 C ATOM 1793 O TYR A 834 20.664 4.223 -24.248 1.00 48.78 O ATOM 1794 CB TYR A 834 23.019 2.976 -25.137 1.00 49.76 C ATOM 1795 CG TYR A 834 24.311 2.199 -24.985 1.00 53.18 C ATOM 1796 CD1 TYR A 834 25.027 2.226 -23.792 1.00 56.99 C ATOM 1797 CD2 TYR A 834 24.796 1.405 -26.020 1.00 54.23 C ATOM 1798 CE1 TYR A 834 26.213 1.505 -23.642 1.00 59.98 C ATOM 1799 CE2 TYR A 834 25.995 0.696 -25.889 1.00 57.18 C ATOM 1800 CZ TYR A 834 26.690 0.736 -24.690 1.00 65.72 C ATOM 1801 OH TYR A 834 27.873 0.045 -24.544 1.00 70.09 O ATOM 1802 HH TYR A 834 28.226 0.187 -23.630 1.00 0.00 H ATOM 1803 H TYR A 834 21.553 0.163 -25.675 1.00 0.00 H ATOM 1804 N GLY A 835 19.399 2.380 -24.274 1.00 43.82 N ATOM 1805 CA GLY A 835 18.188 3.064 -23.841 1.00 43.26 C ATOM 1806 C GLY A 835 17.420 3.877 -24.864 1.00 47.52 C ATOM 1807 O GLY A 835 16.801 4.881 -24.500 1.00 47.82 O ATOM 1808 H GLY A 835 19.355 1.361 -24.478 1.00 0.00 H ATOM 1809 N GLU A 836 17.392 3.439 -26.134 1.00 42.75 N ATOM 1810 CA GLU A 836 16.559 4.114 -27.138 1.00 42.57 C ATOM 1811 C GLU A 836 15.075 3.793 -26.839 1.00 42.49 C ATOM 1812 O GLU A 836 14.780 2.847 -26.100 1.00 39.76 O ATOM 1813 CB GLU A 836 16.900 3.628 -28.557 1.00 43.87 C ATOM 1814 CG GLU A 836 18.207 4.192 -29.112 1.00 47.65 C ATOM 1815 CD GLU A 836 18.249 4.195 -30.629 1.00 54.53 C ATOM 1816 OE1 GLU A 836 17.363 4.825 -31.249 1.00 50.93 O ATOM 1817 OE2 GLU A 836 19.195 3.610 -31.199 1.00 56.40 O ATOM 1818 H GLU A 836 17.965 2.615 -26.408 1.00 0.00 H ATOM 1819 N ARG A 837 14.161 4.586 -27.400 1.00 39.16 N ATOM 1820 CA ARG A 837 12.719 4.389 -27.272 1.00 36.54 C ATOM 1821 C ARG A 837 12.283 3.326 -28.295 1.00 37.70 C ATOM 1822 O ARG A 837 12.431 3.533 -29.502 1.00 37.43 O ATOM 1823 CB ARG A 837 11.972 5.723 -27.512 1.00 38.09 C ATOM 1824 CG ARG A 837 10.431 5.616 -27.615 1.00 42.91 C ATOM 1825 CD ARG A 837 9.881 7.015 -27.880 1.00 47.95 C ATOM 1826 NE ARG A 837 8.452 7.041 -28.189 1.00 49.04 N ATOM 1827 CZ ARG A 837 7.488 7.112 -27.278 1.00 58.28 C ATOM 1828 NH1 ARG A 837 7.785 7.109 -25.983 1.00 51.03 N ATOM 1829 NH2 ARG A 837 6.221 7.150 -27.649 1.00 45.41 N ATOM 1830 HE ARG A 837 8.172 7.001 -29.190 1.00 0.00 H ATOM 1831 HH12 ARG A 837 7.025 7.165 -25.275 1.00 0.00 H ATOM 1832 HH11 ARG A 837 8.777 7.051 -25.677 1.00 0.00 H ATOM 1833 HH22 ARG A 837 5.470 7.206 -26.931 1.00 0.00 H ATOM 1834 HH21 ARG A 837 5.974 7.124 -28.659 1.00 0.00 H ATOM 1835 H ARG A 837 14.495 5.394 -27.963 1.00 0.00 H ATOM 1836 N PRO A 838 11.725 2.192 -27.838 1.00 32.89 N ATOM 1837 CA PRO A 838 11.242 1.173 -28.794 1.00 32.17 C ATOM 1838 C PRO A 838 10.210 1.768 -29.768 1.00 33.93 C ATOM 1839 O PRO A 838 9.310 2.486 -29.319 1.00 31.82 O ATOM 1840 CB PRO A 838 10.573 0.126 -27.884 1.00 32.47 C ATOM 1841 CG PRO A 838 11.179 0.330 -26.544 1.00 37.78 C ATOM 1842 CD PRO A 838 11.456 1.801 -26.438 1.00 35.03 C ATOM 1843 N TYR A 839 10.387 1.504 -31.050 1.00 30.55 N ATOM 1844 CA TYR A 839 9.472 1.937 -32.093 1.00 31.01 C ATOM 1845 C TYR A 839 9.518 3.426 -32.441 1.00 39.84 C ATOM 1846 O TYR A 839 8.708 3.899 -33.206 1.00 38.93 O ATOM 1847 CB TYR A 839 8.047 1.445 -31.822 1.00 29.17 C ATOM 1848 CG TYR A 839 7.971 -0.038 -31.523 1.00 28.78 C ATOM 1849 CD1 TYR A 839 7.961 -0.976 -32.545 1.00 29.30 C ATOM 1850 CD2 TYR A 839 7.918 -0.497 -30.220 1.00 27.24 C ATOM 1851 CE1 TYR A 839 7.894 -2.328 -32.274 1.00 28.61 C ATOM 1852 CE2 TYR A 839 7.851 -1.843 -29.938 1.00 26.68 C ATOM 1853 CZ TYR A 839 7.843 -2.757 -30.963 1.00 29.99 C ATOM 1854 OH TYR A 839 7.783 -4.092 -30.669 1.00 28.10 O ATOM 1855 HH TYR A 839 6.952 -4.281 -30.164 1.00 0.00 H ATOM 1856 H TYR A 839 11.226 0.957 -31.328 1.00 0.00 H ATOM 1857 N TRP A 840 10.452 4.159 -31.851 1.00 42.98 N ATOM 1858 CA TRP A 840 10.659 5.565 -32.189 1.00 46.63 C ATOM 1859 C TRP A 840 9.405 6.440 -32.280 1.00 51.50 C ATOM 1860 O TRP A 840 8.625 6.532 -31.338 1.00 50.79 O ATOM 1861 CB TRP A 840 11.598 5.708 -33.389 1.00 48.81 C ATOM 1862 CG TRP A 840 12.828 4.925 -33.207 1.00 51.25 C ATOM 1863 CD1 TRP A 840 13.828 5.174 -32.326 1.00 55.30 C ATOM 1864 CD2 TRP A 840 13.184 3.726 -33.892 1.00 51.29 C ATOM 1865 NE1 TRP A 840 14.801 4.216 -32.429 1.00 55.16 N ATOM 1866 CE2 TRP A 840 14.428 3.313 -33.388 1.00 56.19 C ATOM 1867 CE3 TRP A 840 12.575 2.964 -34.889 1.00 52.52 C ATOM 1868 CZ2 TRP A 840 15.077 2.175 -33.851 1.00 55.95 C ATOM 1869 CZ3 TRP A 840 13.216 1.836 -35.343 1.00 54.44 C ATOM 1870 CH2 TRP A 840 14.454 1.450 -34.826 1.00 55.74 C ATOM 1871 HE1 TRP A 840 15.678 4.180 -31.871 1.00 0.00 H ATOM 1872 H TRP A 840 11.055 3.720 -31.126 1.00 0.00 H ATOM 1873 N ASP A 841 9.256 7.084 -33.433 1.00 47.63 N ATOM 1874 CA ASP A 841 8.156 7.982 -33.761 1.00 49.54 C ATOM 1875 C ASP A 841 6.789 7.317 -33.963 1.00 50.74 C ATOM 1876 O ASP A 841 5.775 8.006 -33.986 1.00 52.17 O ATOM 1877 CB ASP A 841 8.511 8.797 -35.004 1.00 54.68 C ATOM 1878 CG ASP A 841 8.856 7.922 -36.190 1.00 70.56 C ATOM 1879 OD1 ASP A 841 9.261 6.759 -35.980 1.00 67.44 O ATOM 1880 OD2 ASP A 841 8.722 8.402 -37.335 1.00 83.51 O ATOM 1881 H ASP A 841 9.984 6.935 -34.161 1.00 0.00 H ATOM 1882 N MET A 842 6.762 5.995 -34.116 1.00 42.37 N ATOM 1883 CA MET A 842 5.511 5.280 -34.326 1.00 40.32 C ATOM 1884 C MET A 842 4.573 5.598 -33.174 1.00 40.93 C ATOM 1885 O MET A 842 5.000 5.624 -32.035 1.00 40.52 O ATOM 1886 CB MET A 842 5.767 3.766 -34.309 1.00 40.64 C ATOM 1887 CG MET A 842 5.843 3.081 -35.659 1.00 45.90 C ATOM 1888 SD MET A 842 6.268 1.329 -35.583 1.00 49.84 S ATOM 1889 CE MET A 842 4.720 0.618 -35.089 1.00 44.60 C ATOM 1890 H MET A 842 7.654 5.461 -34.085 1.00 0.00 H ATOM 1891 N SER A 843 3.300 5.844 -33.473 1.00 36.66 N ATOM 1892 CA SER A 843 2.317 6.127 -32.422 1.00 35.02 C ATOM 1893 C SER A 843 2.054 4.807 -31.667 1.00 36.26 C ATOM 1894 O SER A 843 2.437 3.743 -32.164 1.00 32.89 O ATOM 1895 CB SER A 843 1.020 6.640 -33.043 1.00 38.20 C ATOM 1896 OG SER A 843 0.307 5.579 -33.657 1.00 36.87 O ATOM 1897 HG SER A 843 0.866 5.175 -34.368 1.00 0.00 H ATOM 1898 H SER A 843 2.997 5.835 -34.468 1.00 0.00 H ATOM 1899 N ASN A 844 1.412 4.853 -30.477 1.00 33.74 N ATOM 1900 CA ASN A 844 1.100 3.610 -29.746 1.00 31.98 C ATOM 1901 C ASN A 844 0.194 2.687 -30.592 1.00 32.74 C ATOM 1902 O ASN A 844 0.412 1.472 -30.638 1.00 30.80 O ATOM 1903 CB ASN A 844 0.442 3.920 -28.390 1.00 30.46 C ATOM 1904 CG ASN A 844 1.389 4.453 -27.328 1.00 43.97 C ATOM 1905 OD1 ASN A 844 2.616 4.434 -27.479 1.00 39.74 O ATOM 1906 ND2 ASN A 844 0.835 4.935 -26.215 1.00 31.95 N ATOM 1907 HD22 ASN A 844 -0.200 4.941 -26.110 1.00 0.00 H ATOM 1908 HD21 ASN A 844 1.438 5.305 -25.452 1.00 0.00 H ATOM 1909 H ASN A 844 1.136 5.771 -30.074 1.00 0.00 H ATOM 1910 N GLN A 845 -0.782 3.270 -31.301 1.00 31.32 N ATOM 1911 CA GLN A 845 -1.688 2.501 -32.162 1.00 32.68 C ATOM 1912 C GLN A 845 -0.904 1.867 -33.340 1.00 35.84 C ATOM 1913 O GLN A 845 -1.209 0.739 -33.727 1.00 32.37 O ATOM 1914 CB GLN A 845 -2.851 3.371 -32.684 1.00 35.21 C ATOM 1915 CG GLN A 845 -3.917 2.551 -33.461 1.00 41.18 C ATOM 1916 CD GLN A 845 -4.595 1.501 -32.602 1.00 58.01 C ATOM 1917 OE1 GLN A 845 -5.355 1.819 -31.688 1.00 57.80 O ATOM 1918 NE2 GLN A 845 -4.319 0.218 -32.859 1.00 42.87 N ATOM 1919 HE22 GLN A 845 -3.674 -0.030 -33.636 1.00 0.00 H ATOM 1920 HE21 GLN A 845 -4.749 -0.532 -32.282 1.00 0.00 H ATOM 1921 H GLN A 845 -0.901 4.301 -31.239 1.00 0.00 H ATOM 1922 N ASP A 846 0.085 2.604 -33.900 1.00 33.38 N ATOM 1923 CA ASP A 846 0.941 2.114 -34.991 1.00 33.74 C ATOM 1924 C ASP A 846 1.692 0.899 -34.511 1.00 31.88 C ATOM 1925 O ASP A 846 1.880 -0.025 -35.284 1.00 30.73 O ATOM 1926 CB ASP A 846 1.997 3.161 -35.433 1.00 36.91 C ATOM 1927 CG ASP A 846 1.500 4.327 -36.267 1.00 50.60 C ATOM 1928 OD1 ASP A 846 0.441 4.185 -36.919 1.00 52.46 O ATOM 1929 OD2 ASP A 846 2.179 5.387 -36.272 1.00 53.18 O ATOM 1930 H ASP A 846 0.247 3.566 -33.540 1.00 0.00 H ATOM 1931 N VAL A 847 2.165 0.921 -33.255 1.00 28.26 N ATOM 1932 CA VAL A 847 2.913 -0.195 -32.669 1.00 27.23 C ATOM 1933 C VAL A 847 2.057 -1.453 -32.668 1.00 30.54 C ATOM 1934 O VAL A 847 2.513 -2.508 -33.126 1.00 29.96 O ATOM 1935 CB VAL A 847 3.520 0.123 -31.268 1.00 28.08 C ATOM 1936 CG1 VAL A 847 4.207 -1.129 -30.694 1.00 27.08 C ATOM 1937 CG2 VAL A 847 4.524 1.296 -31.375 1.00 28.29 C ATOM 1938 H VAL A 847 1.993 1.766 -32.673 1.00 0.00 H ATOM 1939 N ILE A 848 0.831 -1.354 -32.139 1.00 28.53 N ATOM 1940 CA ILE A 848 -0.072 -2.521 -32.111 1.00 28.47 C ATOM 1941 C ILE A 848 -0.303 -3.055 -33.540 1.00 34.29 C ATOM 1942 O ILE A 848 -0.225 -4.274 -33.764 1.00 34.27 O ATOM 1943 CB ILE A 848 -1.411 -2.149 -31.401 1.00 32.03 C ATOM 1944 CG1 ILE A 848 -1.169 -1.818 -29.897 1.00 30.71 C ATOM 1945 CG2 ILE A 848 -2.485 -3.279 -31.579 1.00 34.58 C ATOM 1946 CD1 ILE A 848 -2.408 -1.086 -29.175 1.00 37.95 C ATOM 1947 H ILE A 848 0.512 -0.446 -31.744 1.00 0.00 H ATOM 1948 N ASN A 849 -0.602 -2.152 -34.490 1.00 32.19 N ATOM 1949 CA ASN A 849 -0.897 -2.524 -35.884 1.00 34.70 C ATOM 1950 C ASN A 849 0.304 -3.159 -36.567 1.00 37.86 C ATOM 1951 O ASN A 849 0.147 -4.181 -37.247 1.00 38.69 O ATOM 1952 CB ASN A 849 -1.366 -1.297 -36.705 1.00 36.95 C ATOM 1953 CG ASN A 849 -2.671 -0.687 -36.246 1.00 58.99 C ATOM 1954 OD1 ASN A 849 -3.440 -1.282 -35.489 1.00 48.61 O ATOM 1955 ND2 ASN A 849 -2.941 0.535 -36.689 1.00 52.79 N ATOM 1956 HD22 ASN A 849 -2.275 1.016 -37.327 1.00 0.00 H ATOM 1957 HD21 ASN A 849 -3.818 1.012 -36.398 1.00 0.00 H ATOM 1958 H ASN A 849 -0.626 -1.146 -34.229 1.00 0.00 H ATOM 1959 N ALA A 850 1.501 -2.564 -36.384 1.00 33.87 N ATOM 1960 CA ALA A 850 2.726 -3.072 -37.009 1.00 34.18 C ATOM 1961 C ALA A 850 3.056 -4.478 -36.505 1.00 35.58 C ATOM 1962 O ALA A 850 3.268 -5.365 -37.331 1.00 35.31 O ATOM 1963 CB ALA A 850 3.888 -2.133 -36.761 1.00 34.65 C ATOM 1964 H ALA A 850 1.556 -1.719 -35.781 1.00 0.00 H ATOM 1965 N VAL A 851 3.043 -4.684 -35.170 1.00 30.89 N ATOM 1966 CA VAL A 851 3.323 -5.992 -34.542 1.00 32.29 C ATOM 1967 C VAL A 851 2.354 -7.061 -35.092 1.00 35.94 C ATOM 1968 O VAL A 851 2.788 -8.177 -35.435 1.00 35.64 O ATOM 1969 CB VAL A 851 3.330 -5.914 -32.989 1.00 36.14 C ATOM 1970 CG1 VAL A 851 3.284 -7.314 -32.369 1.00 37.48 C ATOM 1971 CG2 VAL A 851 4.572 -5.148 -32.477 1.00 35.55 C ATOM 1972 H VAL A 851 2.824 -3.878 -34.550 1.00 0.00 H ATOM 1973 N GLU A 852 1.060 -6.700 -35.224 1.00 34.31 N ATOM 1974 CA GLU A 852 0.025 -7.609 -35.764 1.00 36.58 C ATOM 1975 C GLU A 852 0.343 -8.035 -37.191 1.00 40.86 C ATOM 1976 O GLU A 852 -0.024 -9.136 -37.595 1.00 41.61 O ATOM 1977 CB GLU A 852 -1.350 -6.933 -35.762 1.00 39.53 C ATOM 1978 CG GLU A 852 -2.444 -7.798 -35.174 1.00 59.40 C ATOM 1979 CD GLU A 852 -2.995 -7.230 -33.879 1.00 91.11 C ATOM 1980 OE1 GLU A 852 -3.868 -6.333 -33.946 1.00 82.18 O ATOM 1981 OE2 GLU A 852 -2.534 -7.663 -32.797 1.00 87.10 O ATOM 1982 H GLU A 852 0.778 -5.742 -34.934 1.00 0.00 H ATOM 1983 N GLN A 853 1.023 -7.159 -37.946 1.00 36.87 N ATOM 1984 CA GLN A 853 1.413 -7.385 -39.347 1.00 38.97 C ATOM 1985 C GLN A 853 2.877 -7.900 -39.478 1.00 41.90 C ATOM 1986 O GLN A 853 3.474 -7.802 -40.552 1.00 42.94 O ATOM 1987 CB GLN A 853 1.195 -6.097 -40.178 1.00 41.65 C ATOM 1988 CG GLN A 853 -0.262 -5.606 -40.256 1.00 60.39 C ATOM 1989 CD GLN A 853 -1.170 -6.494 -41.078 1.00 87.34 C ATOM 1990 OE1 GLN A 853 -2.119 -7.096 -40.562 1.00 83.02 O ATOM 1991 NE2 GLN A 853 -0.914 -6.583 -42.377 1.00 85.85 N ATOM 1992 HE22 GLN A 853 -0.109 -6.066 -42.785 1.00 0.00 H ATOM 1993 HE21 GLN A 853 -1.518 -7.170 -42.987 1.00 0.00 H ATOM 1994 H GLN A 853 1.294 -6.255 -37.510 1.00 0.00 H ATOM 1995 N ASP A 854 3.438 -8.459 -38.383 1.00 36.68 N ATOM 1996 CA ASP A 854 4.753 -9.115 -38.332 1.00 36.67 C ATOM 1997 C ASP A 854 5.956 -8.178 -38.377 1.00 40.59 C ATOM 1998 O ASP A 854 7.077 -8.658 -38.565 1.00 39.47 O ATOM 1999 CB ASP A 854 4.894 -10.223 -39.405 1.00 40.95 C ATOM 2000 CG ASP A 854 3.895 -11.349 -39.200 1.00 54.75 C ATOM 2001 OD1 ASP A 854 3.622 -11.702 -38.019 1.00 53.27 O ATOM 2002 OD2 ASP A 854 3.360 -11.849 -40.204 1.00 65.25 O ATOM 2003 H ASP A 854 2.892 -8.422 -37.499 1.00 0.00 H ATOM 2004 N TYR A 855 5.753 -6.872 -38.112 1.00 35.05 N ATOM 2005 CA TYR A 855 6.882 -5.957 -37.984 1.00 34.41 C ATOM 2006 C TYR A 855 7.606 -6.314 -36.694 1.00 35.70 C ATOM 2007 O TYR A 855 6.959 -6.565 -35.681 1.00 32.75 O ATOM 2008 CB TYR A 855 6.407 -4.493 -37.864 1.00 35.27 C ATOM 2009 CG TYR A 855 7.537 -3.533 -37.550 1.00 36.83 C ATOM 2010 CD1 TYR A 855 8.308 -2.981 -38.566 1.00 40.26 C ATOM 2011 CD2 TYR A 855 7.880 -3.232 -36.230 1.00 35.76 C ATOM 2012 CE1 TYR A 855 9.373 -2.131 -38.285 1.00 41.24 C ATOM 2013 CE2 TYR A 855 8.965 -2.403 -35.936 1.00 36.88 C ATOM 2014 CZ TYR A 855 9.685 -1.828 -36.972 1.00 43.07 C ATOM 2015 OH TYR A 855 10.762 -1.026 -36.716 1.00 42.96 O ATOM 2016 HH TYR A 855 11.147 -0.709 -37.571 1.00 0.00 H ATOM 2017 H TYR A 855 4.783 -6.514 -37.998 1.00 0.00 H ATOM 2018 N ARG A 856 8.947 -6.311 -36.730 1.00 33.40 N ATOM 2019 CA ARG A 856 9.785 -6.537 -35.552 1.00 31.60 C ATOM 2020 C ARG A 856 10.906 -5.521 -35.580 1.00 37.32 C ATOM 2021 O ARG A 856 11.397 -5.170 -36.664 1.00 37.54 O ATOM 2022 CB ARG A 856 10.347 -7.974 -35.489 1.00 31.15 C ATOM 2023 CG ARG A 856 9.284 -9.076 -35.335 1.00 31.57 C ATOM 2024 CD ARG A 856 8.545 -9.021 -33.998 1.00 31.84 C ATOM 2025 NE ARG A 856 7.599 -10.138 -33.848 1.00 32.78 N ATOM 2026 CZ ARG A 856 6.318 -10.113 -34.195 1.00 35.90 C ATOM 2027 NH1 ARG A 856 5.794 -9.030 -34.758 1.00 32.14 N ATOM 2028 NH2 ARG A 856 5.545 -11.171 -33.976 1.00 31.38 N ATOM 2029 HE ARG A 856 7.964 -11.020 -33.436 1.00 0.00 H ATOM 2030 HH12 ARG A 856 4.789 -9.018 -35.027 1.00 0.00 H ATOM 2031 HH11 ARG A 856 6.388 -8.194 -34.930 1.00 0.00 H ATOM 2032 HH22 ARG A 856 4.542 -11.148 -34.249 1.00 0.00 H ATOM 2033 HH21 ARG A 856 5.943 -12.023 -33.531 1.00 0.00 H ATOM 2034 H ARG A 856 9.415 -6.139 -37.643 1.00 0.00 H ATOM 2035 N LEU A 857 11.296 -5.030 -34.386 1.00 33.28 N ATOM 2036 CA LEU A 857 12.364 -4.035 -34.227 1.00 33.89 C ATOM 2037 C LEU A 857 13.659 -4.480 -34.900 1.00 38.66 C ATOM 2038 O LEU A 857 14.004 -5.655 -34.831 1.00 37.82 O ATOM 2039 CB LEU A 857 12.600 -3.715 -32.733 1.00 32.74 C ATOM 2040 CG LEU A 857 11.508 -2.877 -32.071 1.00 35.95 C ATOM 2041 CD1 LEU A 857 11.644 -2.904 -30.530 1.00 34.76 C ATOM 2042 CD2 LEU A 857 11.549 -1.414 -32.585 1.00 38.00 C ATOM 2043 H LEU A 857 10.814 -5.375 -33.531 1.00 0.00 H ATOM 2044 N PRO A 858 14.356 -3.580 -35.618 1.00 38.26 N ATOM 2045 CA PRO A 858 15.608 -3.995 -36.283 1.00 40.39 C ATOM 2046 C PRO A 858 16.754 -4.168 -35.266 1.00 45.57 C ATOM 2047 O PRO A 858 16.655 -3.628 -34.154 1.00 43.38 O ATOM 2048 CB PRO A 858 15.881 -2.846 -37.266 1.00 44.03 C ATOM 2049 CG PRO A 858 15.305 -1.645 -36.608 1.00 47.17 C ATOM 2050 CD PRO A 858 14.077 -2.141 -35.826 1.00 39.69 C ATOM 2051 N PRO A 859 17.849 -4.890 -35.586 1.00 44.72 N ATOM 2052 CA PRO A 859 18.940 -4.978 -34.608 1.00 45.69 C ATOM 2053 C PRO A 859 19.574 -3.599 -34.364 1.00 50.11 C ATOM 2054 O PRO A 859 19.823 -2.895 -35.331 1.00 51.81 O ATOM 2055 CB PRO A 859 19.947 -5.939 -35.267 1.00 49.70 C ATOM 2056 CG PRO A 859 19.665 -5.875 -36.719 1.00 54.81 C ATOM 2057 CD PRO A 859 18.195 -5.574 -36.853 1.00 47.92 C ATOM 2058 N PRO A 860 19.818 -3.171 -33.106 1.00 46.14 N ATOM 2059 CA PRO A 860 20.506 -1.884 -32.894 1.00 48.98 C ATOM 2060 C PRO A 860 21.926 -1.885 -33.478 1.00 57.19 C ATOM 2061 O PRO A 860 22.504 -2.950 -33.741 1.00 56.45 O ATOM 2062 CB PRO A 860 20.553 -1.766 -31.364 1.00 50.06 C ATOM 2063 CG PRO A 860 19.443 -2.675 -30.873 1.00 50.37 C ATOM 2064 CD PRO A 860 19.518 -3.828 -31.819 1.00 45.71 C ATOM 2065 N MET A 861 22.479 -0.685 -33.693 1.00 57.96 N ATOM 2066 CA MET A 861 23.831 -0.467 -34.214 1.00 63.14 C ATOM 2067 C MET A 861 24.834 -1.351 -33.459 1.00 66.16 C ATOM 2068 O MET A 861 24.833 -1.369 -32.226 1.00 63.89 O ATOM 2069 CB MET A 861 24.199 1.023 -34.075 1.00 68.70 C ATOM 2070 CG MET A 861 25.486 1.444 -34.795 1.00 78.57 C ATOM 2071 SD MET A 861 25.440 1.448 -36.611 1.00 86.32 S ATOM 2072 CE MET A 861 24.050 2.562 -36.922 1.00 81.37 C ATOM 2073 H MET A 861 21.906 0.155 -33.474 1.00 0.00 H ATOM 2074 N ASP A 862 25.611 -2.147 -34.216 1.00 65.02 N ATOM 2075 CA ASP A 862 26.672 -3.047 -33.746 1.00 66.48 C ATOM 2076 C ASP A 862 26.178 -4.228 -32.892 1.00 66.26 C ATOM 2077 O ASP A 862 26.994 -4.892 -32.245 1.00 66.86 O ATOM 2078 CB ASP A 862 27.790 -2.260 -33.018 1.00 71.86 C ATOM 2079 CG ASP A 862 28.506 -1.260 -33.900 1.00 89.15 C ATOM 2080 OD1 ASP A 862 29.055 -1.677 -34.944 1.00 92.70 O ATOM 2081 OD2 ASP A 862 28.542 -0.062 -33.534 1.00 98.02 O ATOM 2082 H ASP A 862 25.442 -2.122 -35.242 1.00 0.00 H ATOM 2083 N CYS A 863 24.863 -4.529 -32.928 1.00 57.72 N ATOM 2084 CA CYS A 863 24.310 -5.655 -32.182 1.00 53.90 C ATOM 2085 C CYS A 863 24.678 -6.974 -32.846 1.00 58.78 C ATOM 2086 O CYS A 863 24.378 -7.149 -34.031 1.00 58.62 O ATOM 2087 CB CYS A 863 22.799 -5.524 -32.013 1.00 50.27 C ATOM 2088 SG CYS A 863 22.056 -6.826 -31.005 1.00 50.95 S ATOM 2089 H CYS A 863 24.226 -3.942 -33.503 1.00 0.00 H ATOM 2090 N PRO A 864 25.304 -7.921 -32.101 1.00 57.20 N ATOM 2091 CA PRO A 864 25.620 -9.233 -32.691 1.00 57.94 C ATOM 2092 C PRO A 864 24.354 -9.951 -33.141 1.00 59.75 C ATOM 2093 O PRO A 864 23.315 -9.851 -32.480 1.00 57.69 O ATOM 2094 CB PRO A 864 26.299 -9.995 -31.547 1.00 60.35 C ATOM 2095 CG PRO A 864 26.691 -8.969 -30.567 1.00 65.91 C ATOM 2096 CD PRO A 864 25.714 -7.861 -30.683 1.00 59.61 C ATOM 2097 N THR A 865 24.439 -10.630 -34.290 1.00 57.03 N ATOM 2098 CA THR A 865 23.345 -11.354 -34.930 1.00 54.97 C ATOM 2099 C THR A 865 22.686 -12.347 -33.966 1.00 55.43 C ATOM 2100 O THR A 865 21.460 -12.384 -33.916 1.00 52.05 O ATOM 2101 CB THR A 865 23.818 -11.985 -36.254 1.00 62.71 C ATOM 2102 OG1 THR A 865 24.477 -10.975 -37.012 1.00 65.34 O ATOM 2103 CG2 THR A 865 22.668 -12.537 -37.094 1.00 60.52 C ATOM 2104 HG1 THR A 865 25.252 -10.632 -36.500 1.00 0.00 H ATOM 2105 H THR A 865 25.363 -10.643 -34.768 1.00 0.00 H ATOM 2106 N ALA A 866 23.492 -13.106 -33.178 1.00 51.26 N ATOM 2107 CA ALA A 866 22.988 -14.069 -32.197 1.00 48.61 C ATOM 2108 C ALA A 866 22.055 -13.412 -31.165 1.00 48.73 C ATOM 2109 O ALA A 866 21.068 -14.026 -30.753 1.00 44.30 O ATOM 2110 CB ALA A 866 24.141 -14.749 -31.494 1.00 51.48 C ATOM 2111 H ALA A 866 24.522 -12.997 -33.277 1.00 0.00 H ATOM 2112 N LEU A 867 22.392 -12.204 -30.732 1.00 46.21 N ATOM 2113 CA LEU A 867 21.566 -11.474 -29.783 1.00 43.77 C ATOM 2114 C LEU A 867 20.231 -11.065 -30.402 1.00 44.89 C ATOM 2115 O LEU A 867 19.195 -11.176 -29.776 1.00 41.36 O ATOM 2116 CB LEU A 867 22.312 -10.266 -29.238 1.00 44.68 C ATOM 2117 CG LEU A 867 23.307 -10.606 -28.138 1.00 49.28 C ATOM 2118 CD1 LEU A 867 24.042 -9.360 -27.691 1.00 50.79 C ATOM 2119 CD2 LEU A 867 22.609 -11.268 -26.970 1.00 47.09 C ATOM 2120 H LEU A 867 23.270 -11.768 -31.080 1.00 0.00 H ATOM 2121 N HIS A 868 20.274 -10.595 -31.640 1.00 43.79 N ATOM 2122 CA HIS A 868 19.063 -10.199 -32.340 1.00 43.30 C ATOM 2123 C HIS A 868 18.158 -11.396 -32.581 1.00 43.63 C ATOM 2124 O HIS A 868 16.947 -11.290 -32.480 1.00 40.32 O ATOM 2125 CB HIS A 868 19.351 -9.475 -33.647 1.00 46.01 C ATOM 2126 CG HIS A 868 18.129 -8.898 -34.285 1.00 48.48 C ATOM 2127 ND1 HIS A 868 17.688 -9.280 -35.530 1.00 50.81 N ATOM 2128 CD2 HIS A 868 17.239 -7.983 -33.837 1.00 49.51 C ATOM 2129 CE1 HIS A 868 16.587 -8.618 -35.828 1.00 49.56 C ATOM 2130 NE2 HIS A 868 16.292 -7.825 -34.816 1.00 48.96 N ATOM 2131 H HIS A 868 21.192 -10.508 -32.120 1.00 0.00 H ATOM 2132 N GLN A 869 18.760 -12.532 -32.910 1.00 40.54 N ATOM 2133 CA GLN A 869 17.997 -13.739 -33.155 1.00 38.80 C ATOM 2134 C GLN A 869 17.269 -14.114 -31.879 1.00 40.15 C ATOM 2135 O GLN A 869 16.123 -14.521 -31.919 1.00 36.35 O ATOM 2136 CB GLN A 869 18.890 -14.876 -33.629 1.00 42.70 C ATOM 2137 CG GLN A 869 18.125 -16.114 -34.059 1.00 55.31 C ATOM 2138 CD GLN A 869 17.024 -15.801 -35.045 1.00 67.59 C ATOM 2139 OE1 GLN A 869 17.274 -15.254 -36.112 1.00 62.59 O ATOM 2140 NE2 GLN A 869 15.796 -16.143 -34.689 1.00 51.95 N ATOM 2141 HE22 GLN A 869 15.630 -16.606 -33.773 1.00 0.00 H ATOM 2142 HE21 GLN A 869 14.997 -15.949 -35.326 1.00 0.00 H ATOM 2143 H GLN A 869 19.796 -12.556 -32.993 1.00 0.00 H ATOM 2144 N LEU A 870 17.941 -13.968 -30.746 1.00 37.02 N ATOM 2145 CA LEU A 870 17.314 -14.244 -29.443 1.00 35.50 C ATOM 2146 C LEU A 870 16.121 -13.268 -29.192 1.00 34.90 C ATOM 2147 O LEU A 870 15.079 -13.693 -28.668 1.00 32.30 O ATOM 2148 CB LEU A 870 18.371 -14.168 -28.310 1.00 36.34 C ATOM 2149 CG LEU A 870 17.899 -14.476 -26.877 1.00 40.31 C ATOM 2150 CD1 LEU A 870 17.134 -15.810 -26.780 1.00 40.17 C ATOM 2151 CD2 LEU A 870 19.077 -14.496 -25.923 1.00 42.89 C ATOM 2152 H LEU A 870 18.931 -13.652 -30.778 1.00 0.00 H ATOM 2153 N MET A 871 16.255 -11.976 -29.600 1.00 31.82 N ATOM 2154 CA MET A 871 15.156 -11.006 -29.482 1.00 31.12 C ATOM 2155 C MET A 871 13.998 -11.475 -30.350 1.00 33.45 C ATOM 2156 O MET A 871 12.828 -11.468 -29.916 1.00 30.66 O ATOM 2157 CB MET A 871 15.591 -9.602 -29.956 1.00 32.96 C ATOM 2158 CG MET A 871 16.562 -8.906 -29.053 1.00 35.39 C ATOM 2159 SD MET A 871 17.052 -7.364 -29.857 1.00 39.21 S ATOM 2160 CE MET A 871 18.706 -7.135 -29.170 1.00 38.34 C ATOM 2161 H MET A 871 17.161 -11.666 -30.007 1.00 0.00 H ATOM 2162 N LEU A 872 14.315 -11.899 -31.584 1.00 32.79 N ATOM 2163 CA LEU A 872 13.276 -12.391 -32.507 1.00 33.00 C ATOM 2164 C LEU A 872 12.574 -13.634 -31.937 1.00 34.75 C ATOM 2165 O LEU A 872 11.362 -13.779 -32.119 1.00 32.36 O ATOM 2166 CB LEU A 872 13.874 -12.707 -33.900 1.00 34.70 C ATOM 2167 CG LEU A 872 14.309 -11.489 -34.753 1.00 39.20 C ATOM 2168 CD1 LEU A 872 14.854 -11.948 -36.123 1.00 41.20 C ATOM 2169 CD2 LEU A 872 13.136 -10.472 -34.952 1.00 38.25 C ATOM 2170 H LEU A 872 15.308 -11.880 -31.893 1.00 0.00 H ATOM 2171 N ASP A 873 13.320 -14.499 -31.215 1.00 31.00 N ATOM 2172 CA ASP A 873 12.721 -15.701 -30.589 1.00 30.29 C ATOM 2173 C ASP A 873 11.721 -15.284 -29.483 1.00 32.19 C ATOM 2174 O ASP A 873 10.646 -15.893 -29.343 1.00 30.31 O ATOM 2175 CB ASP A 873 13.816 -16.618 -29.999 1.00 32.23 C ATOM 2176 CG ASP A 873 14.733 -17.290 -31.012 1.00 46.04 C ATOM 2177 OD1 ASP A 873 14.361 -17.360 -32.198 1.00 46.19 O ATOM 2178 OD2 ASP A 873 15.824 -17.748 -30.610 1.00 49.28 O ATOM 2179 H ASP A 873 14.337 -14.317 -31.096 1.00 0.00 H ATOM 2180 N CYS A 874 12.091 -14.251 -28.701 1.00 28.85 N ATOM 2181 CA CYS A 874 11.265 -13.678 -27.621 1.00 28.42 C ATOM 2182 C CYS A 874 10.006 -13.056 -28.202 1.00 28.43 C ATOM 2183 O CYS A 874 8.982 -13.014 -27.523 1.00 28.26 O ATOM 2184 CB CYS A 874 12.053 -12.630 -26.835 1.00 29.24 C ATOM 2185 SG CYS A 874 13.365 -13.311 -25.794 1.00 34.51 S ATOM 2186 H CYS A 874 13.025 -13.827 -28.871 1.00 0.00 H ATOM 2187 N TRP A 875 10.071 -12.601 -29.454 1.00 25.92 N ATOM 2188 CA TRP A 875 8.940 -11.928 -30.111 1.00 26.54 C ATOM 2189 C TRP A 875 8.146 -12.798 -31.085 1.00 30.04 C ATOM 2190 O TRP A 875 7.467 -12.279 -31.978 1.00 29.49 O ATOM 2191 CB TRP A 875 9.412 -10.642 -30.816 1.00 26.18 C ATOM 2192 CG TRP A 875 10.125 -9.623 -29.959 1.00 26.97 C ATOM 2193 CD1 TRP A 875 9.896 -9.326 -28.639 1.00 28.76 C ATOM 2194 CD2 TRP A 875 11.137 -8.718 -30.406 1.00 27.09 C ATOM 2195 NE1 TRP A 875 10.756 -8.335 -28.226 1.00 27.58 N ATOM 2196 CE2 TRP A 875 11.513 -7.925 -29.299 1.00 29.23 C ATOM 2197 CE3 TRP A 875 11.784 -8.514 -31.642 1.00 29.33 C ATOM 2198 CZ2 TRP A 875 12.541 -6.977 -29.376 1.00 28.75 C ATOM 2199 CZ3 TRP A 875 12.779 -7.546 -31.727 1.00 31.22 C ATOM 2200 CH2 TRP A 875 13.134 -6.777 -30.609 1.00 31.60 C ATOM 2201 HE1 TRP A 875 10.823 -7.957 -27.259 1.00 0.00 H ATOM 2202 H TRP A 875 10.956 -12.727 -29.986 1.00 0.00 H ATOM 2203 N VAL A 876 8.199 -14.118 -30.917 1.00 27.73 N ATOM 2204 CA VAL A 876 7.396 -15.008 -31.748 1.00 28.68 C ATOM 2205 C VAL A 876 5.907 -14.693 -31.435 1.00 29.74 C ATOM 2206 O VAL A 876 5.544 -14.505 -30.264 1.00 27.59 O ATOM 2207 CB VAL A 876 7.798 -16.474 -31.448 1.00 33.99 C ATOM 2208 CG1 VAL A 876 6.727 -17.448 -31.859 1.00 38.54 C ATOM 2209 CG2 VAL A 876 9.101 -16.840 -32.163 1.00 35.12 C ATOM 2210 H VAL A 876 8.820 -14.519 -30.185 1.00 0.00 H ATOM 2211 N ARG A 877 5.064 -14.589 -32.470 1.00 26.76 N ATOM 2212 CA ARG A 877 3.629 -14.401 -32.282 1.00 25.13 C ATOM 2213 C ARG A 877 3.056 -15.610 -31.515 1.00 32.12 C ATOM 2214 O ARG A 877 2.247 -15.424 -30.613 1.00 31.96 O ATOM 2215 CB ARG A 877 2.906 -14.195 -33.630 1.00 25.01 C ATOM 2216 CG ARG A 877 1.442 -13.731 -33.496 1.00 29.83 C ATOM 2217 CD ARG A 877 1.253 -12.325 -32.884 1.00 29.35 C ATOM 2218 NE ARG A 877 -0.070 -11.770 -33.224 1.00 31.56 N ATOM 2219 CZ ARG A 877 -1.143 -11.769 -32.433 1.00 46.57 C ATOM 2220 NH1 ARG A 877 -1.076 -12.268 -31.201 1.00 32.10 N ATOM 2221 NH2 ARG A 877 -2.288 -11.257 -32.863 1.00 38.30 N ATOM 2222 HE ARG A 877 -0.176 -11.341 -34.165 1.00 0.00 H ATOM 2223 HH12 ARG A 877 -1.919 -12.263 -30.591 1.00 0.00 H ATOM 2224 HH11 ARG A 877 -0.181 -12.663 -30.848 1.00 0.00 H ATOM 2225 HH22 ARG A 877 -3.123 -11.258 -32.243 1.00 0.00 H ATOM 2226 HH21 ARG A 877 -2.351 -10.855 -33.820 1.00 0.00 H ATOM 2227 H ARG A 877 5.443 -14.644 -33.437 1.00 0.00 H ATOM 2228 N ASP A 878 3.506 -16.841 -31.846 1.00 30.47 N ATOM 2229 CA ASP A 878 3.056 -18.053 -31.131 1.00 30.40 C ATOM 2230 C ASP A 878 3.786 -18.017 -29.790 1.00 31.64 C ATOM 2231 O ASP A 878 5.004 -18.205 -29.748 1.00 30.31 O ATOM 2232 CB ASP A 878 3.416 -19.326 -31.933 1.00 32.67 C ATOM 2233 CG ASP A 878 3.003 -20.650 -31.295 1.00 33.78 C ATOM 2234 OD1 ASP A 878 2.741 -20.673 -30.064 1.00 34.05 O ATOM 2235 OD2 ASP A 878 2.909 -21.652 -32.029 1.00 35.46 O ATOM 2236 H ASP A 878 4.188 -16.938 -32.625 1.00 0.00 H ATOM 2237 N ARG A 879 3.054 -17.740 -28.700 1.00 29.54 N ATOM 2238 CA ARG A 879 3.658 -17.614 -27.366 1.00 28.73 C ATOM 2239 C ARG A 879 4.304 -18.920 -26.879 1.00 31.74 C ATOM 2240 O ARG A 879 5.182 -18.875 -26.033 1.00 32.79 O ATOM 2241 CB ARG A 879 2.644 -17.066 -26.331 1.00 28.63 C ATOM 2242 CG ARG A 879 1.459 -18.012 -26.042 1.00 32.22 C ATOM 2243 CD ARG A 879 0.508 -17.412 -25.021 1.00 31.17 C ATOM 2244 NE ARG A 879 -0.663 -18.273 -24.806 1.00 32.89 N ATOM 2245 CZ ARG A 879 -1.518 -18.123 -23.802 1.00 44.10 C ATOM 2246 NH1 ARG A 879 -1.319 -17.183 -22.887 1.00 36.73 N ATOM 2247 NH2 ARG A 879 -2.564 -18.925 -23.690 1.00 35.43 N ATOM 2248 HE ARG A 879 -0.832 -19.046 -25.481 1.00 0.00 H ATOM 2249 HH12 ARG A 879 -1.992 -17.070 -22.102 1.00 0.00 H ATOM 2250 HH11 ARG A 879 -0.490 -16.559 -22.954 1.00 0.00 H ATOM 2251 HH22 ARG A 879 -3.231 -18.803 -22.901 1.00 0.00 H ATOM 2252 HH21 ARG A 879 -2.720 -19.678 -24.391 1.00 0.00 H ATOM 2253 H ARG A 879 2.027 -17.610 -28.802 1.00 0.00 H ATOM 2254 N ASN A 880 3.837 -20.061 -27.379 1.00 30.03 N ATOM 2255 CA ASN A 880 4.332 -21.395 -27.017 1.00 31.06 C ATOM 2256 C ASN A 880 5.725 -21.652 -27.582 1.00 34.15 C ATOM 2257 O ASN A 880 6.421 -22.542 -27.082 1.00 33.97 O ATOM 2258 CB ASN A 880 3.357 -22.488 -27.496 1.00 32.95 C ATOM 2259 CG ASN A 880 1.954 -22.217 -27.028 1.00 40.97 C ATOM 2260 OD1 ASN A 880 1.597 -22.530 -25.898 1.00 33.42 O ATOM 2261 ND2 ASN A 880 1.159 -21.560 -27.864 1.00 32.49 N ATOM 2262 HD22 ASN A 880 1.497 -21.311 -28.816 1.00 0.00 H ATOM 2263 HD21 ASN A 880 0.198 -21.294 -27.567 1.00 0.00 H ATOM 2264 H ASN A 880 3.067 -20.004 -28.076 1.00 0.00 H ATOM 2265 N LEU A 881 6.126 -20.901 -28.634 1.00 31.79 N ATOM 2266 CA LEU A 881 7.446 -21.086 -29.266 1.00 33.91 C ATOM 2267 C LEU A 881 8.528 -20.174 -28.697 1.00 35.57 C ATOM 2268 O LEU A 881 9.715 -20.377 -28.965 1.00 34.51 O ATOM 2269 CB LEU A 881 7.370 -20.927 -30.792 1.00 34.74 C ATOM 2270 CG LEU A 881 6.453 -21.916 -31.555 1.00 41.03 C ATOM 2271 CD1 LEU A 881 6.394 -21.545 -33.015 1.00 42.27 C ATOM 2272 CD2 LEU A 881 6.910 -23.359 -31.392 1.00 43.52 C ATOM 2273 H LEU A 881 5.485 -20.172 -29.008 1.00 0.00 H ATOM 2274 N ARG A 882 8.126 -19.181 -27.907 1.00 29.75 N ATOM 2275 CA ARG A 882 9.086 -18.260 -27.262 1.00 28.40 C ATOM 2276 C ARG A 882 9.931 -19.090 -26.277 1.00 33.41 C ATOM 2277 O ARG A 882 9.420 -20.066 -25.695 1.00 32.46 O ATOM 2278 CB ARG A 882 8.340 -17.149 -26.479 1.00 27.16 C ATOM 2279 CG ARG A 882 7.605 -16.182 -27.382 1.00 29.24 C ATOM 2280 CD ARG A 882 6.796 -15.134 -26.626 1.00 27.76 C ATOM 2281 NE ARG A 882 5.757 -14.590 -27.511 1.00 25.86 N ATOM 2282 CZ ARG A 882 4.600 -14.101 -27.097 1.00 31.75 C ATOM 2283 NH1 ARG A 882 4.342 -14.002 -25.802 1.00 23.53 N ATOM 2284 NH2 ARG A 882 3.681 -13.725 -27.973 1.00 26.43 N ATOM 2285 HE ARG A 882 5.944 -14.589 -28.534 1.00 0.00 H ATOM 2286 HH12 ARG A 882 3.431 -13.617 -25.481 1.00 0.00 H ATOM 2287 HH11 ARG A 882 5.051 -14.309 -25.106 1.00 0.00 H ATOM 2288 HH22 ARG A 882 2.773 -13.341 -27.642 1.00 0.00 H ATOM 2289 HH21 ARG A 882 3.867 -13.814 -28.992 1.00 0.00 H ATOM 2290 H ARG A 882 7.108 -19.049 -27.739 1.00 0.00 H ATOM 2291 N PRO A 883 11.232 -18.770 -26.102 1.00 31.91 N ATOM 2292 CA PRO A 883 12.018 -19.535 -25.128 1.00 32.29 C ATOM 2293 C PRO A 883 11.550 -19.244 -23.697 1.00 33.62 C ATOM 2294 O PRO A 883 10.947 -18.203 -23.435 1.00 33.05 O ATOM 2295 CB PRO A 883 13.445 -19.011 -25.345 1.00 34.33 C ATOM 2296 CG PRO A 883 13.276 -17.603 -25.818 1.00 36.74 C ATOM 2297 CD PRO A 883 12.023 -17.661 -26.690 1.00 32.46 C ATOM 2298 N LYS A 884 11.817 -20.174 -22.785 1.00 32.09 N ATOM 2299 CA LYS A 884 11.549 -19.963 -21.363 1.00 33.12 C ATOM 2300 C LYS A 884 12.726 -19.144 -20.820 1.00 35.85 C ATOM 2301 O LYS A 884 13.784 -19.095 -21.457 1.00 34.28 O ATOM 2302 CB LYS A 884 11.456 -21.311 -20.608 1.00 37.62 C ATOM 2303 CG LYS A 884 10.444 -22.317 -21.187 1.00 47.92 C ATOM 2304 CD LYS A 884 9.020 -21.792 -21.289 1.00 47.04 C ATOM 2305 CE LYS A 884 8.150 -22.725 -22.101 1.00 62.47 C ATOM 2306 NZ LYS A 884 6.748 -22.234 -22.194 1.00 71.86 N ATOM 2307 HZ1 LYS A 884 6.344 -22.159 -21.239 1.00 0.00 H ATOM 2308 HZ2 LYS A 884 6.739 -21.299 -22.650 1.00 0.00 H ATOM 2309 HZ3 LYS A 884 6.185 -22.902 -22.758 1.00 0.00 H ATOM 2310 H LYS A 884 12.229 -21.078 -23.092 1.00 0.00 H ATOM 2311 N PHE A 885 12.578 -18.545 -19.630 1.00 34.09 N ATOM 2312 CA PHE A 885 13.705 -17.806 -19.056 1.00 34.41 C ATOM 2313 C PHE A 885 14.938 -18.701 -18.817 1.00 41.30 C ATOM 2314 O PHE A 885 16.059 -18.251 -19.039 1.00 41.81 O ATOM 2315 CB PHE A 885 13.296 -17.045 -17.818 1.00 35.41 C ATOM 2316 CG PHE A 885 12.514 -15.798 -18.156 1.00 33.36 C ATOM 2317 CD1 PHE A 885 13.124 -14.728 -18.811 1.00 34.16 C ATOM 2318 CD2 PHE A 885 11.162 -15.703 -17.854 1.00 32.52 C ATOM 2319 CE1 PHE A 885 12.398 -13.565 -19.118 1.00 32.44 C ATOM 2320 CE2 PHE A 885 10.440 -14.523 -18.132 1.00 33.27 C ATOM 2321 CZ PHE A 885 11.055 -13.475 -18.788 1.00 30.38 C ATOM 2322 H PHE A 885 11.673 -18.604 -19.120 1.00 0.00 H ATOM 2323 N SER A 886 14.732 -19.978 -18.448 1.00 41.25 N ATOM 2324 CA SER A 886 15.856 -20.911 -18.266 1.00 42.68 C ATOM 2325 C SER A 886 16.648 -21.074 -19.576 1.00 45.46 C ATOM 2326 O SER A 886 17.876 -21.117 -19.535 1.00 46.19 O ATOM 2327 CB SER A 886 15.375 -22.268 -17.758 1.00 47.89 C ATOM 2328 OG SER A 886 14.439 -22.843 -18.655 1.00 52.42 O ATOM 2329 HG SER A 886 14.143 -23.720 -18.304 1.00 0.00 H ATOM 2330 H SER A 886 13.760 -20.312 -18.288 1.00 0.00 H ATOM 2331 N GLN A 887 15.944 -21.137 -20.735 1.00 39.41 N ATOM 2332 CA GLN A 887 16.564 -21.273 -22.065 1.00 38.47 C ATOM 2333 C GLN A 887 17.311 -19.977 -22.462 1.00 41.02 C ATOM 2334 O GLN A 887 18.362 -20.046 -23.098 1.00 40.48 O ATOM 2335 CB GLN A 887 15.510 -21.629 -23.125 1.00 37.74 C ATOM 2336 CG GLN A 887 14.890 -23.016 -22.911 1.00 45.23 C ATOM 2337 CD GLN A 887 13.782 -23.313 -23.899 1.00 49.07 C ATOM 2338 OE1 GLN A 887 12.737 -22.665 -23.917 1.00 37.70 O ATOM 2339 NE2 GLN A 887 13.955 -24.358 -24.693 1.00 46.37 N ATOM 2340 HE22 GLN A 887 14.847 -24.893 -24.662 1.00 0.00 H ATOM 2341 HE21 GLN A 887 13.199 -24.644 -25.348 1.00 0.00 H ATOM 2342 H GLN A 887 14.907 -21.086 -20.681 1.00 0.00 H ATOM 2343 N ILE A 888 16.755 -18.806 -22.099 1.00 35.91 N ATOM 2344 CA ILE A 888 17.399 -17.510 -22.358 1.00 34.24 C ATOM 2345 C ILE A 888 18.723 -17.467 -21.580 1.00 39.93 C ATOM 2346 O ILE A 888 19.739 -17.079 -22.153 1.00 39.86 O ATOM 2347 CB ILE A 888 16.477 -16.303 -22.027 1.00 34.55 C ATOM 2348 CG1 ILE A 888 15.264 -16.241 -23.004 1.00 32.41 C ATOM 2349 CG2 ILE A 888 17.264 -14.968 -22.063 1.00 34.61 C ATOM 2350 CD1 ILE A 888 14.111 -15.345 -22.557 1.00 32.68 C ATOM 2351 H ILE A 888 15.834 -18.819 -21.616 1.00 0.00 H ATOM 2352 N VAL A 889 18.693 -17.836 -20.281 1.00 37.19 N ATOM 2353 CA VAL A 889 19.890 -17.882 -19.422 1.00 40.58 C ATOM 2354 C VAL A 889 20.937 -18.790 -20.078 1.00 45.98 C ATOM 2355 O VAL A 889 22.099 -18.385 -20.206 1.00 45.74 O ATOM 2356 CB VAL A 889 19.570 -18.306 -17.950 1.00 45.45 C ATOM 2357 CG1 VAL A 889 20.850 -18.625 -17.156 1.00 48.32 C ATOM 2358 CG2 VAL A 889 18.750 -17.223 -17.236 1.00 44.09 C ATOM 2359 H VAL A 889 17.777 -18.102 -19.865 1.00 0.00 H ATOM 2360 N ASN A 890 20.504 -19.985 -20.544 1.00 43.63 N ATOM 2361 CA ASN A 890 21.384 -20.964 -21.190 1.00 44.95 C ATOM 2362 C ASN A 890 22.013 -20.418 -22.462 1.00 48.20 C ATOM 2363 O ASN A 890 23.207 -20.620 -22.673 1.00 50.02 O ATOM 2364 CB ASN A 890 20.659 -22.298 -21.466 1.00 44.39 C ATOM 2365 CG ASN A 890 20.245 -23.076 -20.237 1.00 57.92 C ATOM 2366 OD1 ASN A 890 20.732 -22.865 -19.128 1.00 51.58 O ATOM 2367 ND2 ASN A 890 19.305 -23.987 -20.407 1.00 52.51 N ATOM 2368 HD22 ASN A 890 18.905 -24.151 -21.353 1.00 0.00 H ATOM 2369 HD21 ASN A 890 18.964 -24.540 -19.595 1.00 0.00 H ATOM 2370 H ASN A 890 19.497 -20.221 -20.439 1.00 0.00 H ATOM 2371 N THR A 891 21.219 -19.723 -23.296 1.00 43.22 N ATOM 2372 CA THR A 891 21.691 -19.124 -24.546 1.00 43.18 C ATOM 2373 C THR A 891 22.730 -18.029 -24.261 1.00 46.21 C ATOM 2374 O THR A 891 23.769 -18.006 -24.918 1.00 45.13 O ATOM 2375 CB THR A 891 20.514 -18.619 -25.394 1.00 46.56 C ATOM 2376 OG1 THR A 891 19.708 -19.740 -25.764 1.00 46.65 O ATOM 2377 CG2 THR A 891 20.978 -17.874 -26.645 1.00 46.08 C ATOM 2378 HG1 THR A 891 19.370 -20.186 -24.947 1.00 0.00 H ATOM 2379 H THR A 891 20.218 -19.605 -23.040 1.00 0.00 H ATOM 2380 N LEU A 892 22.442 -17.129 -23.289 1.00 41.81 N ATOM 2381 CA LEU A 892 23.378 -16.065 -22.902 1.00 43.05 C ATOM 2382 C LEU A 892 24.686 -16.626 -22.368 1.00 48.29 C ATOM 2383 O LEU A 892 25.749 -16.117 -22.732 1.00 48.79 O ATOM 2384 CB LEU A 892 22.744 -15.075 -21.934 1.00 41.95 C ATOM 2385 CG LEU A 892 21.525 -14.307 -22.516 1.00 43.83 C ATOM 2386 CD1 LEU A 892 20.860 -13.484 -21.460 1.00 44.73 C ATOM 2387 CD2 LEU A 892 21.909 -13.461 -23.733 1.00 42.96 C ATOM 2388 H LEU A 892 21.526 -17.194 -22.800 1.00 0.00 H ATOM 2389 N ASP A 893 24.621 -17.713 -21.562 1.00 47.27 N ATOM 2390 CA ASP A 893 25.828 -18.398 -21.052 1.00 50.30 C ATOM 2391 C ASP A 893 26.643 -18.995 -22.186 1.00 53.83 C ATOM 2392 O ASP A 893 27.868 -18.905 -22.166 1.00 56.35 O ATOM 2393 CB ASP A 893 25.475 -19.469 -20.008 1.00 53.20 C ATOM 2394 CG ASP A 893 25.083 -18.894 -18.660 1.00 60.25 C ATOM 2395 OD1 ASP A 893 25.332 -17.691 -18.431 1.00 63.00 O ATOM 2396 OD2 ASP A 893 24.511 -19.638 -17.845 1.00 61.29 O ATOM 2397 H ASP A 893 23.686 -18.080 -21.292 1.00 0.00 H ATOM 2398 N LYS A 894 25.961 -19.569 -23.197 1.00 49.45 N ATOM 2399 CA LYS A 894 26.591 -20.149 -24.395 1.00 49.36 C ATOM 2400 C LYS A 894 27.323 -19.027 -25.169 1.00 52.58 C ATOM 2401 O LYS A 894 28.409 -19.249 -25.681 1.00 53.62 O ATOM 2402 CB LYS A 894 25.527 -20.828 -25.282 1.00 49.54 C ATOM 2403 CG LYS A 894 26.091 -21.550 -26.505 1.00 62.11 C ATOM 2404 CD LYS A 894 25.019 -22.267 -27.322 1.00 69.73 C ATOM 2405 CE LYS A 894 24.864 -23.707 -26.897 1.00 86.65 C ATOM 2406 NZ LYS A 894 23.945 -24.459 -27.787 1.00 96.37 N ATOM 2407 HZ1 LYS A 894 23.005 -24.014 -27.769 1.00 0.00 H ATOM 2408 HZ2 LYS A 894 24.317 -24.447 -28.758 1.00 0.00 H ATOM 2409 HZ3 LYS A 894 23.870 -25.442 -27.455 1.00 0.00 H ATOM 2410 H LYS A 894 24.924 -19.605 -23.127 1.00 0.00 H ATOM 2411 N LEU A 895 26.733 -17.812 -25.226 1.00 47.60 N ATOM 2412 CA LEU A 895 27.395 -16.698 -25.912 1.00 48.50 C ATOM 2413 C LEU A 895 28.608 -16.213 -25.132 1.00 55.71 C ATOM 2414 O LEU A 895 29.632 -15.894 -25.740 1.00 58.39 O ATOM 2415 CB LEU A 895 26.415 -15.546 -26.223 1.00 45.83 C ATOM 2416 CG LEU A 895 25.242 -15.886 -27.150 1.00 48.90 C ATOM 2417 CD1 LEU A 895 24.274 -14.710 -27.276 1.00 46.70 C ATOM 2418 CD2 LEU A 895 25.708 -16.361 -28.516 1.00 50.80 C ATOM 2419 H LEU A 895 25.804 -17.667 -24.781 1.00 0.00 H ATOM 2420 N ILE A 896 28.511 -16.193 -23.785 1.00 53.90 N ATOM 2421 CA ILE A 896 29.620 -15.823 -22.897 1.00 58.40 C ATOM 2422 C ILE A 896 30.781 -16.832 -23.065 1.00 66.45 C ATOM 2423 O ILE A 896 31.938 -16.408 -23.151 1.00 70.22 O ATOM 2424 CB ILE A 896 29.155 -15.644 -21.413 1.00 61.30 C ATOM 2425 CG1 ILE A 896 28.316 -14.360 -21.255 1.00 59.18 C ATOM 2426 CG2 ILE A 896 30.360 -15.627 -20.425 1.00 65.41 C ATOM 2427 CD1 ILE A 896 27.167 -14.428 -20.191 1.00 64.72 C ATOM 2428 H ILE A 896 27.601 -16.454 -23.353 1.00 0.00 H ATOM 2429 N ARG A 897 30.468 -18.155 -23.177 1.00 62.05 N ATOM 2430 CA ARG A 897 31.487 -19.211 -23.357 1.00 64.76 C ATOM 2431 C ARG A 897 32.129 -19.151 -24.745 1.00 69.18 C ATOM 2432 O ARG A 897 33.256 -19.605 -24.906 1.00 72.70 O ATOM 2433 CB ARG A 897 30.879 -20.618 -23.173 1.00 63.77 C ATOM 2434 CG ARG A 897 30.574 -21.025 -21.741 1.00 69.10 C ATOM 2435 CD ARG A 897 30.298 -22.518 -21.612 1.00 65.44 C ATOM 2436 NE ARG A 897 29.236 -23.007 -22.504 1.00 57.68 N ATOM 2437 CZ ARG A 897 27.943 -23.047 -22.195 1.00 66.87 C ATOM 2438 NH1 ARG A 897 27.517 -22.578 -21.031 1.00 56.69 N ATOM 2439 NH2 ARG A 897 27.065 -23.538 -23.058 1.00 51.68 N ATOM 2440 HE ARG A 897 29.517 -23.347 -23.446 1.00 0.00 H ATOM 2441 HH12 ARG A 897 26.505 -22.612 -20.796 1.00 0.00 H ATOM 2442 HH11 ARG A 897 28.195 -22.176 -20.353 1.00 0.00 H ATOM 2443 HH22 ARG A 897 26.055 -23.567 -22.812 1.00 0.00 H ATOM 2444 HH21 ARG A 897 27.386 -23.894 -23.981 1.00 0.00 H ATOM 2445 H ARG A 897 29.467 -18.434 -23.134 1.00 0.00 H ATOM 2446 N ASN A 898 31.391 -18.650 -25.755 1.00 62.71 N ATOM 2447 CA ASN A 898 31.863 -18.545 -27.142 1.00 63.44 C ATOM 2448 C ASN A 898 31.829 -17.058 -27.560 1.00 67.30 C ATOM 2449 O ASN A 898 30.942 -16.688 -28.331 1.00 62.40 O ATOM 2450 CB ASN A 898 30.945 -19.374 -28.053 1.00 59.57 C ATOM 2451 CG ASN A 898 31.015 -20.841 -27.757 1.00 72.93 C ATOM 2452 OD1 ASN A 898 31.900 -21.538 -28.245 1.00 66.71 O ATOM 2453 ND2 ASN A 898 30.146 -21.310 -26.878 1.00 61.63 N ATOM 2454 HD22 ASN A 898 29.411 -20.685 -26.489 1.00 0.00 H ATOM 2455 HD21 ASN A 898 30.197 -22.304 -26.576 1.00 0.00 H ATOM 2456 H ASN A 898 30.429 -18.318 -25.540 1.00 0.00 H ATOM 2457 N PRO A 899 32.737 -16.181 -27.059 1.00 68.87 N ATOM 2458 CA PRO A 899 32.625 -14.742 -27.385 1.00 69.39 C ATOM 2459 C PRO A 899 32.802 -14.354 -28.857 1.00 75.51 C ATOM 2460 O PRO A 899 32.447 -13.232 -29.203 1.00 74.84 O ATOM 2461 CB PRO A 899 33.682 -14.090 -26.495 1.00 74.39 C ATOM 2462 CG PRO A 899 34.649 -15.166 -26.205 1.00 81.97 C ATOM 2463 CD PRO A 899 33.839 -16.417 -26.104 1.00 74.85 C ATOM 2464 N ALA A 900 33.302 -15.265 -29.722 1.00 73.99 N ATOM 2465 CA ALA A 900 33.458 -15.016 -31.160 1.00 75.39 C ATOM 2466 C ALA A 900 32.095 -14.807 -31.834 1.00 78.45 C ATOM 2467 O ALA A 900 31.988 -14.044 -32.796 1.00 79.58 O ATOM 2468 CB ALA A 900 34.183 -16.170 -31.811 1.00 78.84 C ATOM 2469 H ALA A 900 33.591 -16.191 -29.349 1.00 0.00 H ATOM 2470 N SER A 901 31.052 -15.468 -31.304 1.00 71.37 N ATOM 2471 CA SER A 901 29.678 -15.350 -31.776 1.00 68.26 C ATOM 2472 C SER A 901 29.131 -13.937 -31.514 1.00 70.32 C ATOM 2473 O SER A 901 28.132 -13.557 -32.127 1.00 70.13 O ATOM 2474 CB SER A 901 28.803 -16.394 -31.091 1.00 70.57 C ATOM 2475 OG SER A 901 28.710 -16.135 -29.699 1.00 80.71 O ATOM 2476 HG SER A 901 29.615 -16.162 -29.298 1.00 0.00 H ATOM 2477 H SER A 901 31.237 -16.106 -30.504 1.00 0.00 H ATOM 2478 N LEU A 902 29.770 -13.173 -30.594 1.00 65.94 N ATOM 2479 CA LEU A 902 29.360 -11.800 -30.251 1.00 64.50 C ATOM 2480 C LEU A 902 30.090 -10.742 -31.107 1.00 73.63 C ATOM 2481 O LEU A 902 29.940 -9.544 -30.866 1.00 73.16 O ATOM 2482 CB LEU A 902 29.534 -11.509 -28.742 1.00 63.72 C ATOM 2483 CG LEU A 902 28.706 -12.344 -27.761 1.00 64.43 C ATOM 2484 CD1 LEU A 902 29.228 -12.174 -26.356 1.00 65.29 C ATOM 2485 CD2 LEU A 902 27.208 -11.993 -27.824 1.00 61.74 C ATOM 2486 H LEU A 902 30.593 -13.578 -30.104 1.00 0.00 H ATOM 2487 N LYS A 903 30.888 -11.195 -32.097 1.00 73.71 N ATOM 2488 CA LYS A 903 31.613 -10.340 -33.036 1.00 77.22 C ATOM 2489 C LYS A 903 30.831 -10.194 -34.354 1.00 83.85 C ATOM 2490 O LYS A 903 30.872 -9.126 -34.966 1.00 85.33 O ATOM 2491 CB LYS A 903 33.025 -10.891 -33.294 1.00 83.23 C ATOM 2492 CG LYS A 903 33.991 -10.662 -32.129 1.00 97.12 C ATOM 2493 CD LYS A 903 35.125 -11.696 -32.078 1.00109.21 C ATOM 2494 CE LYS A 903 36.225 -11.479 -33.092 1.00121.53 C ATOM 2495 NZ LYS A 903 37.133 -12.655 -33.165 1.00131.08 N ATOM 2496 HZ1 LYS A 903 37.568 -12.814 -32.234 1.00 0.00 H ATOM 2497 HZ2 LYS A 903 36.588 -13.496 -33.443 1.00 0.00 H ATOM 2498 HZ3 LYS A 903 37.876 -12.474 -33.869 1.00 0.00 H ATOM 2499 H LYS A 903 30.995 -12.224 -32.199 1.00 0.00 H ATOM 2500 N VAL A 904 30.106 -11.263 -34.770 1.00 80.41 N ATOM 2501 CA VAL A 904 29.300 -11.338 -36.003 1.00 79.48 C ATOM 2502 C VAL A 904 28.148 -10.320 -35.971 1.00 79.42 C ATOM 2503 O VAL A 904 27.176 -10.509 -35.239 1.00 73.20 O ATOM 2504 CB VAL A 904 28.812 -12.793 -36.304 1.00 82.54 C ATOM 2505 CG1 VAL A 904 27.824 -12.841 -37.475 1.00 81.34 C ATOM 2506 CG2 VAL A 904 29.986 -13.735 -36.551 1.00 85.47 C ATOM 2507 H VAL A 904 30.120 -12.108 -34.163 1.00 0.00 H ATOM 2508 N ILE A 905 28.286 -9.236 -36.763 1.00 78.44 N ATOM 2509 CA ILE A 905 27.294 -8.159 -36.878 1.00 98.89 C ATOM 2510 C ILE A 905 26.761 -8.118 -38.314 1.00133.80 C ATOM 2511 O ILE A 905 25.552 -8.175 -38.526 1.00 96.65 O ATOM 2512 CB ILE A 905 27.874 -6.784 -36.417 1.00103.33 C ATOM 2513 CG1 ILE A 905 28.362 -6.838 -34.948 1.00103.04 C ATOM 2514 CG2 ILE A 905 26.847 -5.653 -36.604 1.00102.52 C ATOM 2515 CD1 ILE A 905 29.573 -5.958 -34.631 1.00112.92 C ATOM 2516 H ILE A 905 29.154 -9.158 -37.331 1.00 0.00 H TER 2517 ILE A 905 HETATM 2518 O HOH 1 19.030 -11.204 -36.583 1.00 66.69 O HETATM 2519 O HOH 2 1.054 -10.986 -11.567 1.00 56.35 O HETATM 2520 O HOH 3 5.330 -7.047 -10.981 1.00 45.29 O HETATM 2521 O HOH 4 6.588 -4.644 -28.294 1.00 26.54 O HETATM 2522 O HOH 5 3.936 -4.373 -28.091 1.00 27.06 O HETATM 2523 O HOH 6 3.643 -10.158 -19.109 1.00 32.24 O HETATM 2524 O HOH 7 14.469 2.695 -23.357 1.00 46.32 O HETATM 2525 O HOH 8 -2.064 4.779 -25.944 1.00 32.87 O HETATM 2526 O HOH 9 23.334 -22.011 -18.230 1.00 67.32 O HETATM 2527 O HOH 10 3.403 -21.675 -34.674 1.00 36.96 O HETATM 2528 O HOH 11 4.254 -1.198 -12.679 1.00 72.41 O HETATM 2529 O HOH 12 0.669 -14.825 -22.788 1.00 30.34 O HETATM 2530 O HOH 13 12.103 1.299 -20.024 1.00 33.33 O HETATM 2531 O HOH 14 18.473 -18.100 -30.229 1.00 57.60 O HETATM 2532 O HOH 15 2.747 6.883 -19.168 1.00 37.73 O HETATM 2533 O HOH 16 -0.709 11.101 -21.468 1.00 40.64 O HETATM 2534 O HOH 17 9.855 -12.527 -33.986 1.00 39.05 O HETATM 2535 O HOH 18 13.389 -22.702 -14.369 1.00 68.44 O HETATM 2536 O HOH 19 16.308 -19.639 -9.743 1.00 75.16 O HETATM 2537 O HOH 20 1.026 -13.195 -29.668 1.00 37.79 O HETATM 2538 O HOH 21 13.943 5.444 -15.725 1.00 68.78 O HETATM 2539 O HOH 22 11.815 -20.470 -14.445 1.00 66.93 O HETATM 2540 O HOH 23 11.982 5.868 -19.795 1.00 85.79 O HETATM 2541 O HOH 24 4.212 -14.253 -37.278 1.00 68.20 O HETATM 2542 O HOH 25 7.093 -14.522 -15.126 1.00 41.33 O HETATM 2543 O HOH 26 26.325 -12.809 -34.023 1.00 63.97 O HETATM 2544 O HOH 27 5.886 -23.885 -24.769 1.00 54.37 O HETATM 2545 O HOH 28 6.974 -20.122 -24.397 1.00 32.45 O HETATM 2546 O HOH 29 -2.491 -6.926 -29.698 1.00 40.14 O HETATM 2547 O HOH 30 5.292 -19.084 -14.569 1.00 63.26 O HETATM 2548 O HOH 31 24.459 -2.953 -30.028 1.00 57.34 O HETATM 2549 O HOH 32 3.154 -11.010 -35.413 1.00 35.42 O HETATM 2550 O HOH 33 12.661 4.347 -13.589 1.00 57.47 O HETATM 2551 O HOH 34 6.343 -7.782 -18.630 1.00 30.91 O HETATM 2552 O HOH 35 6.105 8.654 -24.073 1.00 48.57 O HETATM 2553 O HOH 36 1.287 -4.093 -17.220 1.00 52.68 O HETATM 2554 O HOH 37 6.657 -3.293 -19.380 1.00 49.63 O HETATM 2555 O HOH 38 29.212 9.237 -21.460 1.00 75.03 O HETATM 2556 O HOH 39 3.372 -4.998 -12.808 1.00 58.70 O HETATM 2557 O HOH 40 4.117 -8.665 -21.783 1.00 29.72 O HETATM 2558 O HOH 41 1.262 2.482 -23.734 1.00 33.79 O HETATM 2559 O HOH 42 6.712 14.950 -21.028 1.00 62.13 O HETATM 2560 O HOH 43 28.723 -21.580 -18.715 1.00 57.37 O HETATM 2561 O HOH 44 32.441 -5.012 -27.147 1.00 66.69 O HETATM 2562 O HOH 45 9.553 4.011 -36.473 1.00 62.35 O HETATM 2563 O HOH 46 -3.426 -12.344 -29.658 1.00 63.39 O HETATM 2564 O HOH 47 5.922 8.072 -30.291 1.00 43.69 O HETATM 2565 O HOH 48 7.286 5.245 -23.933 1.00 55.28 O HETATM 2566 O HOH 49 4.143 -5.871 -20.351 1.00 41.64 O HETATM 2567 O HOH 50 23.175 -8.456 -13.451 1.00 69.66 O HETATM 2568 O HOH 51 17.490 -18.004 -11.533 1.00 59.29 O HETATM 2569 O HOH 52 10.200 -22.808 -25.159 1.00 51.48 O HETATM 2570 O HOH 53 22.870 0.052 -0.644 1.00 71.64 O HETATM 2571 O HOH 54 24.313 -23.147 -21.918 1.00 56.86 O HETATM 2572 O HOH 55 4.505 1.905 -24.264 1.00 32.60 O HETATM 2573 O HOH 56 20.823 -16.882 -30.750 1.00 48.70 O HETATM 2574 O HOH 57 5.942 -14.675 -35.203 1.00 54.52 O HETATM 2575 O HOH 58 4.860 4.515 -25.286 1.00 34.75 O HETATM 2576 O HOH 59 18.874 -22.087 -17.021 1.00 54.18 O HETATM 2577 O HOH 60 7.013 1.015 -11.977 1.00 69.96 O HETATM 2578 O HOH 61 5.085 -17.372 -34.188 1.00 39.84 O HETATM 2579 O HOH 62 -3.160 -16.947 -20.689 1.00 48.22 O HETATM 2580 O HOH 63 8.128 -18.271 -22.761 1.00 33.73 O HETATM 2581 O HOH 64 10.587 3.618 -20.472 1.00 45.09 O HETATM 2582 O HOH 65 2.612 -18.016 -16.604 1.00 50.84 O HETATM 2583 O HOH 66 12.196 -20.643 -17.084 1.00 42.84 O HETATM 2584 O HOH 67 9.703 -5.968 -31.952 1.00 28.38 O HETATM 2585 O HOH 68 1.468 -13.805 -11.062 1.00 50.79 O HETATM 2586 O HOH 69 9.876 -18.835 -18.373 1.00 35.25 O HETATM 2587 O HOH 70 -3.167 -15.401 -18.445 1.00 56.39 O HETATM 2588 O HOH 71 13.369 -15.778 -36.487 1.00 61.40 O HETATM 2589 O HOH 72 -4.965 -10.934 -31.417 1.00 63.68 O HETATM 2590 O HOH 73 29.221 -19.009 -19.421 1.00 57.48 O HETATM 2591 O HOH 74 7.252 2.911 -13.955 1.00 78.10 O HETATM 2592 O HOH 75 21.431 -22.330 -25.834 1.00 54.94 O HETATM 2593 O HOH 76 12.445 3.231 -8.734 1.00 64.95 O HETATM 2594 O HOH 77 28.717 -1.298 -27.225 1.00 74.60 O HETATM 2595 O HOH 78 -6.210 -2.039 -31.790 1.00 58.92 O HETATM 2596 O HOH 79 3.787 -18.979 -20.007 1.00 44.27 O HETATM 2597 O HOH 80 16.620 6.372 -12.167 1.00 68.84 O HETATM 2598 O HOH 81 23.360 -13.794 -12.527 1.00 64.31 O HETATM 2599 O HOH 82 7.801 -18.348 -20.139 1.00 44.64 O HETATM 2600 O HOH 83 27.258 -7.226 -15.996 1.00 60.36 O HETATM 2601 O HOH 84 18.909 -10.763 -1.906 1.00 67.46 O HETATM 2602 O HOH 85 16.997 8.958 -11.240 1.00 76.36 O HETATM 2603 O HOH 86 12.732 0.965 -10.456 1.00 71.72 O HETATM 2604 O HOH 87 15.422 9.648 -23.954 1.00 62.54 O HETATM 2605 O HOH 88 -4.939 -5.437 -29.912 1.00 51.74 O HETATM 2606 O HOH 89 -3.822 3.163 -27.411 1.00 46.45 O HETATM 2607 O HOH 90 8.623 -21.076 -17.204 1.00 70.17 O HETATM 2608 O HOH 91 13.747 4.654 -10.669 1.00 78.34 O HETATM 2609 O HOH 92 1.700 -15.501 -36.676 1.00 59.32 O HETATM 2610 O HOH 93 10.696 -12.226 -36.759 1.00 50.39 O HETATM 2611 O HOH 94 -5.939 -3.058 -29.099 1.00 54.98 O HETATM 2612 C1 UNN A 95 10.572 -0.176 -5.130 1.00 -0.07 C HETATM 2613 C2 UNN A 95 11.566 0.561 -5.754 1.00 -0.04 C HETATM 2614 C3 UNN A 95 12.293 1.499 -5.029 1.00 0.07 C HETATM 2615 N3 UNN A 95 13.290 2.260 -5.668 1.00 -0.24 N HETATM 2616 C6 UNN A 95 14.644 2.184 -5.559 1.00 0.16 C HETATM 2617 C7 UNN A 95 15.473 3.201 -6.167 1.00 0.06 C HETATM 2618 C8 UNN A 95 15.014 4.334 -6.884 1.00 -0.04 C HETATM 2619 C9 UNN A 95 15.887 5.235 -7.415 1.00 -0.04 C HETATM 2620 C10 UNN A 95 17.268 5.084 -7.248 1.00 0.04 C HETATM 2621 C11 UNN A 95 17.750 3.991 -6.558 1.00 -0.02 C HETATM 2622 C12 UNN A 95 16.870 3.036 -6.000 1.00 0.05 C HETATM 2623 N1 UNN A 95 17.408 1.980 -5.312 1.00 -0.29 N HETATM 2624 C13 UNN A 95 16.519 1.123 -4.808 1.00 0.06 C HETATM 2625 N2 UNN A 95 15.181 1.158 -4.885 1.00 -0.25 N HETATM 2626 H6 UNN A 95 16.935 0.284 -4.262 1.00 0.11 H HETATM 2627 H5 UNN A 95 18.820 3.863 -6.442 1.00 0.07 H HETATM 2628 C14 UNN A 95 18.117 6.145 -7.872 1.00 0.13 C HETATM 2629 C15 UNN A 95 19.617 5.952 -7.890 1.00 0.01 C HETATM 2630 H7 UNN A 95 20.092 6.815 -8.380 1.00 0.05 H HETATM 2631 H8 UNN A 95 19.862 5.034 -8.445 1.00 0.05 H HETATM 2632 H9 UNN A 95 19.988 5.867 -6.858 1.00 0.05 H HETATM 2633 O1 UNN A 95 17.620 7.141 -8.368 1.00 -0.38 O HETATM 2634 H4 UNN A 95 15.506 6.081 -7.975 1.00 0.07 H HETATM 2635 H3 UNN A 95 13.948 4.487 -7.012 1.00 0.07 H HETATM 2636 H11 UNN A 95 12.943 2.982 -6.315 1.00 0.22 H HETATM 2637 C4 UNN A 95 12.004 1.701 -3.683 1.00 -0.04 C HETATM 2638 C5 UNN A 95 11.007 0.959 -3.071 1.00 -0.07 C HETATM 2639 C16 UNN A 95 10.288 0.024 -3.793 1.00 -0.07 C HETATM 2640 H10 UNN A 95 9.504 -0.550 -3.312 1.00 0.05 H HETATM 2641 H13 UNN A 95 10.789 1.112 -2.020 1.00 0.06 H HETATM 2642 H12 UNN A 95 12.559 2.438 -3.114 1.00 0.05 H HETATM 2643 H2 UNN A 95 11.777 0.406 -6.806 1.00 0.05 H HETATM 2644 H1 UNN A 95 10.014 -0.914 -5.695 1.00 0.06 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 81 82 85 86 87 CONECT 85 81 CONECT 86 81 CONECT 87 81 CONECT 1314 1315 1323 1324 1325 CONECT 1323 1314 CONECT 1324 1314 CONECT 1325 1314 CONECT 2612 2613 2639 2644 CONECT 2613 2612 2614 2643 CONECT 2614 2613 2615 2637 CONECT 2615 2614 2616 2636 CONECT 2616 2615 2617 2625 CONECT 2617 2616 2618 2622 CONECT 2618 2617 2619 2635 CONECT 2619 2618 2620 2634 CONECT 2620 2619 2621 2628 CONECT 2621 2620 2622 2627 CONECT 2622 2617 2621 2623 CONECT 2623 2622 2624 CONECT 2624 2623 2625 2626 CONECT 2625 2616 2624 CONECT 2626 2624 CONECT 2627 2621 CONECT 2628 2620 2629 2633 CONECT 2629 2628 2630 2631 2632 CONECT 2630 2629 CONECT 2631 2629 CONECT 2632 2629 CONECT 2633 2628 CONECT 2634 2619 CONECT 2635 2618 CONECT 2636 2615 CONECT 2637 2614 2638 2642 CONECT 2638 2637 2639 2641 CONECT 2639 2612 2638 2640 CONECT 2640 2639 CONECT 2641 2638 CONECT 2642 2637 CONECT 2643 2613 CONECT 2644 2612 MASTER 0 0 0 0 0 0 0 0 2641 3 45 22 END
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Structure:
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Related entries of code: 5l6o
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5l6p
RCSB PDB
PDBbind
298aa, >5L6P_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5l6o
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ephrin type-B receptor 3 (EphB3) kinase domain
Ligand Name
6P6
EC.Number
E.C.2.7.10.1
Resolution
1.88(Å)
Affinity (Kd/Ki/IC50)
IC50=6nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Am.Chem.Soc. Vol. 138: pp. 10554-10560
Ligand Properties
Formula
C
1
6
H
1
3
N
3
O
Molecular Weight
263.294
Exact Mass
263.106
No. of atoms
33
No. of bonds
35
Polar Surface Area
54.88
LOGP Value
3.10 (
Computed with XLOGP3
)
3.65 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
CC(=O)c1ccc2c(c1)ncnc2Nc1ccccc1
InChI String
InChI=1S/C16H13N3O/c1-11(20)12-7-8-14-15(9-12)17-10-18-16(14)19-13-5-3-2-4-6-13/h2-10H,1H3,(H,17,18,19)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P54753
Entrez Gene ID
NCBI Entrez Gene ID:
2049
ASD
Information of known allosteric effects of PDB entries
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