Browse entries in the PDBbind-CN Database
HEADER 5VP0_COMPLEX COMPND 5VP0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 334 THR LYS LEU LEU HIS ASP GLY ILE GLN PRO VAL ALA ALA SEQRES 2 A 334 ILE ASP SER ASN PHE ALA SER PHE THR TYR THR PRO ARG SEQRES 3 A 334 SER LEU PRO GLU ASP ASP THR SER MET ALA ILE LEU SER SEQRES 4 A 334 MET LEU GLN ASP MET ASN PHE ILE ASN ASN TYR LYS ILE SEQRES 5 A 334 ASP CYS PRO THR LEU ALA ARG PHE CYS LEU MET VAL LYS SEQRES 6 A 334 LYS GLY TYR ARG ASP PRO PRO TYR HIS ASN TRP MET HIS SEQRES 7 A 334 ALA PHE SER VAL SER HIS PHE CYS TYR LEU LEU TYR LYS SEQRES 8 A 334 ASN LEU GLU LEU THR ASN TYR LEU GLU ASP ILE GLU ILE SEQRES 9 A 334 PHE ALA LEU PHE ILE SER CYS MET CYS HIS ASP LEU ASP SEQRES 10 A 334 HIS ARG GLY THR ASN ASN SER PHE GLN VAL ALA SER LYS SEQRES 11 A 334 SER VAL LEU ALA ALA LEU TYR SER SER GLU GLY SER VAL SEQRES 12 A 334 MET GLU ARG HIS HIS PHE ALA GLN ALA ILE ALA ILE LEU SEQRES 13 A 334 ASN THR HIS GLY CYS ASN ILE PHE ASP HIS PHE SER ARG SEQRES 14 A 334 LYS ASP TYR GLN ARG MET LEU ASP LEU MET ARG ASP ILE SEQRES 15 A 334 ILE LEU ALA THR ASP LEU ALA HIS HIS LEU ARG ILE PHE SEQRES 16 A 334 LYS ASP LEU GLN LYS MET ALA GLU VAL GLY TYR ASP ARG SEQRES 17 A 334 ASN ASN LYS GLN HIS HIS ARG LEU LEU LEU CYS LEU LEU SEQRES 18 A 334 MET THR SER CYS ASP LEU SER ASP GLN THR LYS GLY TRP SEQRES 19 A 334 LYS THR THR ARG LYS ILE ALA GLU LEU ILE TYR LYS GLU SEQRES 20 A 334 PHE PHE SER GLN GLY ASP LEU GLU LYS ALA MET GLY ASN SEQRES 21 A 334 ARG PRO MET GLU MET MET ASP ARG GLU LYS ALA TYR ILE SEQRES 22 A 334 PRO GLU LEU GLN ILE SER PHE MET GLU HIS ILE ALA MET SEQRES 23 A 334 PRO ILE TYR LYS LEU LEU GLN ASP LEU PHE PRO LYS ALA SEQRES 24 A 334 ALA GLU LEU TYR GLU ARG VAL ALA SER ASN ARG GLU HIS SEQRES 25 A 334 TRP THR LYS VAL SER HIS LYS PHE THR ILE ARG GLY LEU SEQRES 26 A 334 PRO SER ASN ASN SER LEU ASP PHE LEU HET ZN A 1 1 HET MG A 2 1 HET UNN A 393 50 ATOM 1 N THR A 583 10.462 -24.795 14.744 1.00111.12 N ATOM 2 CA THR A 583 9.492 -25.786 15.316 1.00116.65 C ATOM 3 C THR A 583 8.804 -25.308 16.593 1.00123.87 C ATOM 4 O THR A 583 7.592 -25.443 16.715 1.00125.40 O ATOM 5 CB THR A 583 10.167 -27.138 15.625 1.00115.98 C ATOM 6 OG1 THR A 583 10.848 -27.606 14.461 1.00115.61 O ATOM 7 CG2 THR A 583 9.148 -28.179 16.045 1.00116.52 C ATOM 8 HG1 THR A 583 11.281 -28.474 14.660 1.00 0.00 H ATOM 9 HN3 THR A 583 11.207 -24.599 15.442 1.00 0.00 H ATOM 10 HN2 THR A 583 9.960 -23.914 14.514 1.00 0.00 H ATOM 11 HN1 THR A 583 10.889 -25.188 13.881 1.00 0.00 H ATOM 12 N LYS A 584 9.583 -24.793 17.549 1.00125.82 N ATOM 13 CA LYS A 584 9.047 -24.298 18.834 1.00125.76 C ATOM 14 C LYS A 584 8.275 -22.981 18.679 1.00119.51 C ATOM 15 O LYS A 584 7.272 -22.750 19.364 1.00125.06 O ATOM 16 CB LYS A 584 10.167 -24.143 19.876 1.00127.33 C ATOM 17 CG LYS A 584 10.787 -25.457 20.356 1.00131.35 C ATOM 18 CD LYS A 584 11.907 -25.211 21.367 1.00131.55 C ATOM 19 CE LYS A 584 12.940 -26.333 21.411 1.00132.91 C ATOM 20 NZ LYS A 584 12.451 -27.585 22.054 1.00137.37 N ATOM 21 HZ1 LYS A 584 12.175 -27.384 23.036 1.00 0.00 H ATOM 22 HZ2 LYS A 584 11.629 -27.945 21.528 1.00 0.00 H ATOM 23 HZ3 LYS A 584 13.209 -28.297 22.045 1.00 0.00 H ATOM 24 H LYS A 584 10.608 -24.738 17.382 1.00 0.00 H ATOM 25 N LEU A 585 8.726 -22.125 17.770 1.00111.88 N ATOM 26 CA LEU A 585 8.005 -20.884 17.480 1.00112.00 C ATOM 27 C LEU A 585 6.717 -21.116 16.704 1.00112.29 C ATOM 28 O LEU A 585 5.752 -20.352 16.841 1.00115.69 O ATOM 29 CB LEU A 585 8.899 -19.919 16.703 1.00108.82 C ATOM 30 CG LEU A 585 8.484 -18.443 16.695 1.00108.13 C ATOM 31 CD1 LEU A 585 8.316 -17.918 18.108 1.00108.05 C ATOM 32 CD2 LEU A 585 9.566 -17.676 15.956 1.00106.76 C ATOM 33 H LEU A 585 9.605 -22.339 17.256 1.00 0.00 H ATOM 34 N LEU A 586 6.712 -22.178 15.903 1.00114.30 N ATOM 35 CA LEU A 586 5.585 -22.504 15.043 1.00117.48 C ATOM 36 C LEU A 586 4.528 -23.249 15.880 1.00122.14 C ATOM 37 O LEU A 586 3.345 -22.871 15.869 1.00125.34 O ATOM 38 CB LEU A 586 6.047 -23.369 13.846 1.00118.84 C ATOM 39 CG LEU A 586 5.860 -22.910 12.392 1.00113.07 C ATOM 40 CD1 LEU A 586 6.772 -21.744 12.036 1.00105.24 C ATOM 41 CD2 LEU A 586 6.143 -24.080 11.459 1.00115.15 C ATOM 42 H LEU A 586 7.546 -22.799 15.891 1.00 0.00 H ATOM 43 N HIS A 587 4.969 -24.283 16.615 1.00124.48 N ATOM 44 CA HIS A 587 4.065 -25.257 17.266 1.00127.50 C ATOM 45 C HIS A 587 3.513 -24.817 18.619 1.00127.13 C ATOM 46 O HIS A 587 2.512 -25.361 19.067 1.00134.93 O ATOM 47 CB HIS A 587 4.672 -26.674 17.340 1.00126.16 C ATOM 48 CG HIS A 587 4.792 -27.353 16.013 1.00123.91 C ATOM 49 ND1 HIS A 587 4.169 -28.548 15.730 1.00126.41 N ATOM 50 CD2 HIS A 587 5.462 -27.003 14.890 1.00120.12 C ATOM 51 CE1 HIS A 587 4.450 -28.907 14.491 1.00124.43 C ATOM 52 NE2 HIS A 587 5.232 -27.985 13.959 1.00122.13 N ATOM 53 H HIS A 587 5.995 -24.405 16.732 1.00 0.00 H ATOM 54 N ASP A 588 4.166 -23.854 19.262 1.00120.63 N ATOM 55 CA ASP A 588 3.457 -22.922 20.139 1.00117.37 C ATOM 56 C ASP A 588 2.724 -21.962 19.169 1.00114.86 C ATOM 57 O ASP A 588 3.370 -21.436 18.280 1.00111.87 O ATOM 58 CB ASP A 588 4.447 -22.125 21.006 1.00113.22 C ATOM 59 CG ASP A 588 5.128 -22.962 22.092 1.00113.94 C ATOM 60 OD1 ASP A 588 4.790 -24.152 22.276 1.00114.93 O ATOM 61 OD2 ASP A 588 6.015 -22.403 22.777 1.00105.11 O ATOM 62 H ASP A 588 5.195 -23.762 19.140 1.00 0.00 H ATOM 63 N GLY A 589 1.403 -21.763 19.285 1.00114.87 N ATOM 64 CA GLY A 589 0.696 -20.682 18.560 1.00110.38 C ATOM 65 C GLY A 589 1.091 -19.335 19.148 1.00109.04 C ATOM 66 O GLY A 589 1.831 -19.311 20.127 1.00114.51 O ATOM 67 H GLY A 589 0.855 -22.391 19.907 1.00 0.00 H ATOM 68 N ILE A 590 0.598 -18.223 18.587 1.00104.26 N ATOM 69 CA ILE A 590 1.005 -16.879 19.029 1.00100.06 C ATOM 70 C ILE A 590 0.278 -16.508 20.316 1.00 99.86 C ATOM 71 O ILE A 590 -0.926 -16.270 20.315 1.00100.61 O ATOM 72 CB ILE A 590 0.730 -15.785 17.965 1.00 99.80 C ATOM 73 CG1 ILE A 590 1.506 -16.081 16.675 1.00100.31 C ATOM 74 CG2 ILE A 590 1.131 -14.402 18.483 1.00 96.66 C ATOM 75 CD1 ILE A 590 1.054 -15.268 15.477 1.00 97.74 C ATOM 76 H ILE A 590 -0.094 -18.312 17.815 1.00 0.00 H ATOM 77 N GLN A 591 1.020 -16.476 21.414 1.00102.31 N ATOM 78 CA GLN A 591 0.514 -15.981 22.695 1.00104.63 C ATOM 79 C GLN A 591 -0.175 -14.631 22.635 1.00 95.44 C ATOM 80 O GLN A 591 0.356 -13.723 22.004 1.00 83.47 O ATOM 81 CB GLN A 591 1.690 -15.707 23.605 1.00111.11 C ATOM 82 CG GLN A 591 2.246 -16.906 24.286 1.00117.06 C ATOM 83 CD GLN A 591 3.525 -16.573 25.046 1.00119.15 C ATOM 84 OE1 GLN A 591 4.367 -15.821 24.559 1.00116.91 O ATOM 85 NE2 GLN A 591 3.687 -17.167 26.227 1.00121.72 N ATOM 86 HE22 GLN A 591 2.947 -17.796 26.599 1.00 0.00 H ATOM 87 HE21 GLN A 591 4.554 -17.002 26.777 1.00 0.00 H ATOM 88 H GLN A 591 2.001 -16.816 21.363 1.00 0.00 H ATOM 89 N PRO A 592 -1.290 -14.469 23.376 1.00 94.59 N ATOM 90 CA PRO A 592 -1.721 -13.106 23.677 1.00 92.25 C ATOM 91 C PRO A 592 -0.711 -12.438 24.610 1.00 91.08 C ATOM 92 O PRO A 592 -0.125 -13.098 25.490 1.00 95.40 O ATOM 93 CB PRO A 592 -3.080 -13.284 24.370 1.00 96.60 C ATOM 94 CG PRO A 592 -3.342 -14.751 24.459 1.00 99.01 C ATOM 95 CD PRO A 592 -2.100 -15.487 24.071 1.00 98.14 C ATOM 96 N VAL A 593 -0.477 -11.151 24.395 1.00 88.07 N ATOM 97 CA VAL A 593 0.558 -10.441 25.179 1.00 87.34 C ATOM 98 C VAL A 593 0.280 -10.324 26.687 1.00 90.78 C ATOM 99 O VAL A 593 1.226 -10.262 27.454 1.00 91.58 O ATOM 100 CB VAL A 593 1.199 -9.192 24.513 1.00 84.26 C ATOM 101 CG1 VAL A 593 0.739 -8.984 23.082 1.00 83.41 C ATOM 102 CG2 VAL A 593 1.073 -7.916 25.300 1.00 82.87 C ATOM 103 H VAL A 593 -1.023 -10.639 23.673 1.00 0.00 H ATOM 104 N ALA A 594 -0.981 -10.377 27.109 1.00 96.18 N ATOM 105 CA ALA A 594 -1.311 -10.416 28.541 1.00102.39 C ATOM 106 C ALA A 594 -0.767 -11.671 29.259 1.00106.57 C ATOM 107 O ALA A 594 -0.366 -11.594 30.419 1.00103.57 O ATOM 108 CB ALA A 594 -2.820 -10.304 28.740 1.00106.23 C ATOM 109 H ALA A 594 -1.751 -10.391 26.410 1.00 0.00 H ATOM 110 N ALA A 595 -0.753 -12.812 28.561 1.00111.04 N ATOM 111 CA ALA A 595 -0.262 -14.093 29.114 1.00113.68 C ATOM 112 C ALA A 595 1.267 -14.183 29.300 1.00110.92 C ATOM 113 O ALA A 595 1.741 -15.070 30.013 1.00114.51 O ATOM 114 CB ALA A 595 -0.746 -15.259 28.254 1.00113.93 C ATOM 115 H ALA A 595 -1.104 -12.798 27.582 1.00 0.00 H ATOM 116 N ILE A 596 2.028 -13.296 28.654 1.00106.79 N ATOM 117 CA ILE A 596 3.494 -13.236 28.821 1.00104.02 C ATOM 118 C ILE A 596 3.826 -12.643 30.195 1.00105.55 C ATOM 119 O ILE A 596 4.704 -13.146 30.900 1.00106.65 O ATOM 120 CB ILE A 596 4.184 -12.400 27.709 1.00 96.34 C ATOM 121 CG1 ILE A 596 3.922 -13.013 26.327 1.00 94.02 C ATOM 122 CG2 ILE A 596 5.692 -12.323 27.943 1.00 94.92 C ATOM 123 CD1 ILE A 596 4.411 -12.181 25.158 1.00 88.23 C ATOM 124 H ILE A 596 1.570 -12.621 28.008 1.00 0.00 H ATOM 125 N ASP A 597 3.132 -11.555 30.529 1.00104.61 N ATOM 126 CA ASP A 597 3.209 -10.894 31.832 1.00105.88 C ATOM 127 C ASP A 597 2.069 -9.863 31.909 1.00108.80 C ATOM 128 O ASP A 597 1.782 -9.181 30.920 1.00103.93 O ATOM 129 CB ASP A 597 4.570 -10.200 32.014 1.00102.73 C ATOM 130 CG ASP A 597 4.832 -9.782 33.456 1.00102.80 C ATOM 131 OD1 ASP A 597 4.209 -8.800 33.924 1.00102.58 O ATOM 132 OD2 ASP A 597 5.671 -10.431 34.113 1.00100.44 O ATOM 133 H ASP A 597 2.493 -11.149 29.816 1.00 0.00 H ATOM 134 N SER A 598 1.430 -9.747 33.077 1.00114.04 N ATOM 135 CA SER A 598 0.329 -8.777 33.275 1.00112.27 C ATOM 136 C SER A 598 0.781 -7.314 33.095 1.00105.05 C ATOM 137 O SER A 598 -0.030 -6.461 32.728 1.00105.96 O ATOM 138 CB SER A 598 -0.374 -8.976 34.635 1.00116.27 C ATOM 139 OG SER A 598 -0.723 -10.336 34.839 1.00118.62 O ATOM 140 HG SER A 598 -1.171 -10.432 35.717 1.00 0.00 H ATOM 141 H SER A 598 1.715 -10.356 33.870 1.00 0.00 H ATOM 142 N ASN A 599 2.070 -7.045 33.328 1.00 96.42 N ATOM 143 CA ASN A 599 2.644 -5.699 33.184 1.00 89.53 C ATOM 144 C ASN A 599 3.391 -5.506 31.838 1.00 79.67 C ATOM 145 O ASN A 599 4.105 -4.524 31.678 1.00 77.93 O ATOM 146 CB ASN A 599 3.547 -5.374 34.411 1.00 91.18 C ATOM 147 CG ASN A 599 3.098 -4.130 35.182 1.00 95.84 C ATOM 148 OD1 ASN A 599 1.936 -4.004 35.576 1.00 96.30 O ATOM 149 ND2 ASN A 599 4.041 -3.217 35.438 1.00 97.76 N ATOM 150 HD22 ASN A 599 5.010 -3.359 35.089 1.00 0.00 H ATOM 151 HD21 ASN A 599 3.805 -2.365 35.986 1.00 0.00 H ATOM 152 H ASN A 599 2.694 -7.822 33.624 1.00 0.00 H ATOM 153 N PHE A 600 3.195 -6.397 30.859 1.00 71.23 N ATOM 154 CA PHE A 600 4.038 -6.424 29.648 1.00 64.90 C ATOM 155 C PHE A 600 4.006 -5.134 28.818 1.00 61.71 C ATOM 156 O PHE A 600 5.017 -4.773 28.216 1.00 57.30 O ATOM 157 CB PHE A 600 3.674 -7.617 28.760 1.00 64.79 C ATOM 158 CG PHE A 600 4.687 -7.923 27.682 1.00 62.04 C ATOM 159 CD1 PHE A 600 5.809 -8.702 27.957 1.00 61.05 C ATOM 160 CD2 PHE A 600 4.502 -7.470 26.386 1.00 61.02 C ATOM 161 CE1 PHE A 600 6.734 -9.007 26.963 1.00 57.38 C ATOM 162 CE2 PHE A 600 5.423 -7.771 25.385 1.00 57.99 C ATOM 163 CZ PHE A 600 6.539 -8.541 25.674 1.00 55.55 C ATOM 164 H PHE A 600 2.426 -7.091 30.954 1.00 0.00 H ATOM 165 N ALA A 601 2.865 -4.446 28.814 1.00 61.41 N ATOM 166 CA ALA A 601 2.681 -3.172 28.101 1.00 59.73 C ATOM 167 C ALA A 601 2.951 -1.922 28.950 1.00 59.47 C ATOM 168 O ALA A 601 2.651 -0.809 28.520 1.00 57.81 O ATOM 169 CB ALA A 601 1.265 -3.108 27.525 1.00 64.05 C ATOM 170 H ALA A 601 2.058 -4.831 29.345 1.00 0.00 H ATOM 171 N SER A 602 3.526 -2.093 30.137 1.00 62.35 N ATOM 172 CA SER A 602 3.845 -0.976 31.018 1.00 64.54 C ATOM 173 C SER A 602 5.283 -0.506 30.815 1.00 62.14 C ATOM 174 O SER A 602 6.197 -1.307 30.545 1.00 59.86 O ATOM 175 CB SER A 602 3.640 -1.386 32.478 1.00 69.86 C ATOM 176 OG SER A 602 3.888 -0.308 33.364 1.00 72.47 O ATOM 177 HG SER A 602 3.746 -0.609 34.296 1.00 0.00 H ATOM 178 H SER A 602 3.756 -3.058 30.448 1.00 0.00 H ATOM 179 N PHE A 603 5.485 0.800 30.971 1.00 61.97 N ATOM 180 CA PHE A 603 6.831 1.380 30.999 1.00 60.41 C ATOM 181 C PHE A 603 7.733 0.863 32.142 1.00 61.66 C ATOM 182 O PHE A 603 8.953 0.969 32.045 1.00 63.39 O ATOM 183 CB PHE A 603 6.757 2.909 31.091 1.00 60.85 C ATOM 184 CG PHE A 603 6.389 3.599 29.805 1.00 59.77 C ATOM 185 CD1 PHE A 603 7.049 3.306 28.610 1.00 57.32 C ATOM 186 CD2 PHE A 603 5.424 4.608 29.798 1.00 62.40 C ATOM 187 CE1 PHE A 603 6.727 3.981 27.436 1.00 56.84 C ATOM 188 CE2 PHE A 603 5.102 5.284 28.628 1.00 61.05 C ATOM 189 CZ PHE A 603 5.751 4.968 27.444 1.00 58.50 C ATOM 190 H PHE A 603 4.663 1.428 31.076 1.00 0.00 H ATOM 191 N THR A 604 7.150 0.331 33.216 1.00 65.87 N ATOM 192 CA THR A 604 7.926 -0.248 34.315 1.00 67.23 C ATOM 193 C THR A 604 8.460 -1.660 34.034 1.00 66.44 C ATOM 194 O THR A 604 9.312 -2.143 34.775 1.00 69.84 O ATOM 195 CB THR A 604 7.109 -0.299 35.628 1.00 71.08 C ATOM 196 OG1 THR A 604 5.917 -1.073 35.435 1.00 71.82 O ATOM 197 CG2 THR A 604 6.739 1.101 36.093 1.00 72.21 C ATOM 198 HG1 THR A 604 5.367 -0.658 34.724 1.00 0.00 H ATOM 199 H THR A 604 6.112 0.327 33.276 1.00 0.00 H ATOM 200 N TYR A 605 7.965 -2.324 32.991 1.00 64.48 N ATOM 201 CA TYR A 605 8.404 -3.683 32.668 1.00 62.87 C ATOM 202 C TYR A 605 9.818 -3.687 32.081 1.00 58.73 C ATOM 203 O TYR A 605 10.165 -2.850 31.250 1.00 57.90 O ATOM 204 CB TYR A 605 7.416 -4.337 31.707 1.00 61.59 C ATOM 205 CG TYR A 605 7.716 -5.771 31.327 1.00 61.48 C ATOM 206 CD1 TYR A 605 7.401 -6.830 32.183 1.00 64.05 C ATOM 207 CD2 TYR A 605 8.292 -6.074 30.089 1.00 58.63 C ATOM 208 CE1 TYR A 605 7.671 -8.147 31.820 1.00 64.73 C ATOM 209 CE2 TYR A 605 8.569 -7.379 29.716 1.00 58.71 C ATOM 210 CZ TYR A 605 8.257 -8.413 30.579 1.00 63.01 C ATOM 211 OH TYR A 605 8.554 -9.699 30.189 1.00 65.54 O ATOM 212 HH TYR A 605 8.277 -10.330 30.900 1.00 0.00 H ATOM 213 H TYR A 605 7.249 -1.866 32.391 1.00 0.00 H ATOM 214 N THR A 606 10.630 -4.633 32.546 1.00 58.17 N ATOM 215 CA THR A 606 12.003 -4.797 32.095 1.00 54.30 C ATOM 216 C THR A 606 12.034 -6.005 31.173 1.00 52.73 C ATOM 217 O THR A 606 11.943 -7.134 31.652 1.00 54.86 O ATOM 218 CB THR A 606 12.958 -5.039 33.279 1.00 54.78 C ATOM 219 OG1 THR A 606 12.448 -6.087 34.106 1.00 55.50 O ATOM 220 CG2 THR A 606 13.103 -3.783 34.121 1.00 56.38 C ATOM 221 HG1 THR A 606 12.369 -6.918 33.573 1.00 0.00 H ATOM 222 H THR A 606 10.265 -5.287 33.267 1.00 0.00 H ATOM 223 N PRO A 607 12.155 -5.778 29.851 1.00 50.67 N ATOM 224 CA PRO A 607 12.171 -6.901 28.909 1.00 49.24 C ATOM 225 C PRO A 607 13.350 -7.883 29.022 1.00 49.04 C ATOM 226 O PRO A 607 13.238 -9.002 28.535 1.00 49.32 O ATOM 227 CB PRO A 607 12.166 -6.217 27.534 1.00 46.87 C ATOM 228 CG PRO A 607 12.608 -4.823 27.772 1.00 45.17 C ATOM 229 CD PRO A 607 12.150 -4.478 29.149 1.00 48.15 C ATOM 230 N ARG A 608 14.449 -7.476 29.649 1.00 49.37 N ATOM 231 CA ARG A 608 15.567 -8.391 29.944 1.00 50.48 C ATOM 232 C ARG A 608 15.230 -9.459 30.991 1.00 52.63 C ATOM 233 O ARG A 608 15.928 -10.466 31.080 1.00 53.30 O ATOM 234 CB ARG A 608 16.815 -7.599 30.344 1.00 50.53 C ATOM 235 CG ARG A 608 17.378 -6.786 29.183 1.00 48.39 C ATOM 236 CD ARG A 608 18.230 -5.601 29.631 1.00 49.24 C ATOM 237 NE ARG A 608 18.875 -4.929 28.504 1.00 47.25 N ATOM 238 CZ ARG A 608 19.922 -5.402 27.830 1.00 46.38 C ATOM 239 NH1 ARG A 608 20.497 -6.554 28.166 1.00 49.36 N ATOM 240 NH2 ARG A 608 20.417 -4.700 26.818 1.00 46.85 N ATOM 241 HE ARG A 608 18.487 -4.011 28.206 1.00 0.00 H ATOM 242 HH12 ARG A 608 21.314 -6.905 27.626 1.00 0.00 H ATOM 243 HH11 ARG A 608 20.130 -7.104 28.969 1.00 0.00 H ATOM 244 HH22 ARG A 608 21.234 -5.061 26.285 1.00 0.00 H ATOM 245 HH21 ARG A 608 19.988 -3.789 26.558 1.00 0.00 H ATOM 246 H ARG A 608 14.523 -6.481 29.941 1.00 0.00 H ATOM 247 N SER A 609 14.153 -9.253 31.756 1.00 55.84 N ATOM 248 CA SER A 609 13.576 -10.293 32.629 1.00 59.43 C ATOM 249 C SER A 609 13.052 -11.521 31.896 1.00 60.65 C ATOM 250 O SER A 609 12.944 -12.594 32.499 1.00 65.27 O ATOM 251 CB SER A 609 12.393 -9.744 33.437 1.00 62.44 C ATOM 252 OG SER A 609 12.756 -8.595 34.160 1.00 62.34 O ATOM 253 HG SER A 609 13.061 -7.894 33.531 1.00 0.00 H ATOM 254 H SER A 609 13.701 -8.317 31.735 1.00 0.00 H ATOM 255 N LEU A 610 12.676 -11.364 30.631 1.00 57.43 N ATOM 256 CA LEU A 610 12.102 -12.467 29.868 1.00 58.34 C ATOM 257 C LEU A 610 13.233 -13.390 29.417 1.00 56.75 C ATOM 258 O LEU A 610 14.212 -12.909 28.847 1.00 55.41 O ATOM 259 CB LEU A 610 11.316 -11.930 28.659 1.00 56.64 C ATOM 260 CG LEU A 610 10.363 -12.898 27.953 1.00 58.47 C ATOM 261 CD1 LEU A 610 9.196 -13.313 28.850 1.00 61.01 C ATOM 262 CD2 LEU A 610 9.846 -12.273 26.662 1.00 56.52 C ATOM 263 H LEU A 610 12.793 -10.436 30.176 1.00 0.00 H ATOM 264 N PRO A 611 13.109 -14.711 29.668 1.00 59.58 N ATOM 265 CA PRO A 611 14.138 -15.634 29.182 1.00 60.15 C ATOM 266 C PRO A 611 14.365 -15.518 27.679 1.00 59.02 C ATOM 267 O PRO A 611 13.413 -15.295 26.929 1.00 58.15 O ATOM 268 CB PRO A 611 13.573 -17.019 29.538 1.00 64.43 C ATOM 269 CG PRO A 611 12.677 -16.777 30.702 1.00 65.97 C ATOM 270 CD PRO A 611 12.077 -15.417 30.460 1.00 64.05 C ATOM 271 N GLU A 612 15.617 -15.656 27.254 1.00 59.07 N ATOM 272 CA GLU A 612 15.992 -15.481 25.850 1.00 57.82 C ATOM 273 C GLU A 612 15.228 -16.422 24.911 1.00 59.67 C ATOM 274 O GLU A 612 14.863 -16.024 23.804 1.00 56.48 O ATOM 275 CB GLU A 612 17.507 -15.636 25.668 1.00 57.41 C ATOM 276 CG GLU A 612 17.985 -15.260 24.271 1.00 57.25 C ATOM 277 CD GLU A 612 19.436 -14.808 24.205 1.00 55.78 C ATOM 278 OE1 GLU A 612 20.262 -15.256 25.034 1.00 61.77 O ATOM 279 OE2 GLU A 612 19.752 -14.001 23.306 1.00 51.22 O ATOM 280 H GLU A 612 16.357 -15.897 27.944 1.00 0.00 H ATOM 281 N ASP A 613 14.956 -17.644 25.375 1.00 64.08 N ATOM 282 CA ASP A 613 14.139 -18.623 24.624 1.00 67.71 C ATOM 283 C ASP A 613 12.664 -18.255 24.387 1.00 65.70 C ATOM 284 O ASP A 613 12.024 -18.886 23.551 1.00 65.45 O ATOM 285 CB ASP A 613 14.190 -20.005 25.298 1.00 73.32 C ATOM 286 CG ASP A 613 15.437 -20.789 24.938 1.00 78.49 C ATOM 287 OD1 ASP A 613 16.279 -20.272 24.168 1.00 80.85 O ATOM 288 OD2 ASP A 613 15.574 -21.933 25.431 1.00 83.37 O ATOM 289 H ASP A 613 15.334 -17.920 26.304 1.00 0.00 H ATOM 290 N ASP A 614 12.128 -17.286 25.135 1.00 63.25 N ATOM 291 CA ASP A 614 10.762 -16.781 24.932 1.00 62.13 C ATOM 292 C ASP A 614 10.690 -15.472 24.136 1.00 57.05 C ATOM 293 O ASP A 614 9.590 -15.015 23.833 1.00 57.80 O ATOM 294 CB ASP A 614 10.063 -16.568 26.284 1.00 65.12 C ATOM 295 CG ASP A 614 9.923 -17.849 27.091 1.00 69.70 C ATOM 296 OD1 ASP A 614 10.014 -18.962 26.523 1.00 71.69 O ATOM 297 OD2 ASP A 614 9.709 -17.737 28.313 1.00 72.99 O ATOM 298 H ASP A 614 12.703 -16.870 25.895 1.00 0.00 H ATOM 299 N THR A 615 11.835 -14.879 23.785 1.00 51.81 N ATOM 300 CA THR A 615 11.843 -13.557 23.147 1.00 48.35 C ATOM 301 C THR A 615 11.299 -13.556 21.711 1.00 46.40 C ATOM 302 O THR A 615 10.686 -12.575 21.293 1.00 43.44 O ATOM 303 CB THR A 615 13.244 -12.892 23.146 1.00 45.44 C ATOM 304 OG1 THR A 615 14.201 -13.757 22.531 1.00 44.15 O ATOM 305 CG2 THR A 615 13.677 -12.551 24.555 1.00 46.46 C ATOM 306 HG1 THR A 615 14.246 -14.608 23.035 1.00 0.00 H ATOM 307 H THR A 615 12.737 -15.363 23.967 1.00 0.00 H ATOM 308 N SER A 616 11.529 -14.639 20.969 1.00 48.12 N ATOM 309 CA SER A 616 11.026 -14.759 19.597 1.00 49.02 C ATOM 310 C SER A 616 9.496 -14.797 19.564 1.00 52.27 C ATOM 311 O SER A 616 8.873 -14.123 18.744 1.00 51.48 O ATOM 312 CB SER A 616 11.598 -15.997 18.917 1.00 49.69 C ATOM 313 OG SER A 616 12.965 -15.804 18.645 1.00 51.03 O ATOM 314 HG SER A 616 13.330 -16.612 18.204 1.00 0.00 H ATOM 315 H SER A 616 12.081 -15.421 21.375 1.00 0.00 H ATOM 316 N MET A 617 8.906 -15.577 20.463 1.00 58.62 N ATOM 317 CA MET A 617 7.455 -15.605 20.621 1.00 62.44 C ATOM 318 C MET A 617 6.904 -14.240 21.032 1.00 56.17 C ATOM 319 O MET A 617 5.857 -13.832 20.534 1.00 55.85 O ATOM 320 CB MET A 617 7.028 -16.675 21.629 1.00 72.59 C ATOM 321 CG MET A 617 5.516 -16.866 21.718 1.00 86.99 C ATOM 322 SD MET A 617 4.738 -17.387 20.163 1.00104.15 S ATOM 323 CE MET A 617 5.167 -19.121 20.172 1.00105.89 C ATOM 324 H MET A 617 9.493 -16.184 21.070 1.00 0.00 H ATOM 325 N ALA A 618 7.609 -13.541 21.920 1.00 50.12 N ATOM 326 CA ALA A 618 7.184 -12.221 22.366 1.00 47.88 C ATOM 327 C ALA A 618 7.203 -11.188 21.231 1.00 45.24 C ATOM 328 O ALA A 618 6.337 -10.308 21.185 1.00 45.57 O ATOM 329 CB ALA A 618 8.040 -11.753 23.529 1.00 46.91 C ATOM 330 H ALA A 618 8.485 -13.948 22.305 1.00 0.00 H ATOM 331 N ILE A 619 8.174 -11.297 20.323 1.00 41.60 N ATOM 332 CA ILE A 619 8.183 -10.471 19.113 1.00 40.08 C ATOM 333 C ILE A 619 6.897 -10.685 18.315 1.00 39.55 C ATOM 334 O ILE A 619 6.221 -9.721 17.963 1.00 38.65 O ATOM 335 CB ILE A 619 9.428 -10.739 18.219 1.00 39.20 C ATOM 336 CG1 ILE A 619 10.695 -10.174 18.865 1.00 37.86 C ATOM 337 CG2 ILE A 619 9.254 -10.165 16.808 1.00 38.83 C ATOM 338 CD1 ILE A 619 10.786 -8.662 18.953 1.00 36.30 C ATOM 339 H ILE A 619 8.941 -11.983 20.477 1.00 0.00 H ATOM 340 N LEU A 620 6.541 -11.947 18.083 1.00 41.80 N ATOM 341 CA LEU A 620 5.312 -12.275 17.373 1.00 43.72 C ATOM 342 C LEU A 620 4.092 -11.739 18.106 1.00 44.76 C ATOM 343 O LEU A 620 3.209 -11.170 17.469 1.00 44.81 O ATOM 344 CB LEU A 620 5.173 -13.784 17.140 1.00 47.59 C ATOM 345 CG LEU A 620 6.239 -14.485 16.292 1.00 48.44 C ATOM 346 CD1 LEU A 620 5.872 -15.943 16.099 1.00 53.23 C ATOM 347 CD2 LEU A 620 6.417 -13.814 14.944 1.00 47.33 C ATOM 348 H LEU A 620 7.155 -12.717 18.417 1.00 0.00 H ATOM 349 N SER A 621 4.039 -11.915 19.430 1.00 46.20 N ATOM 350 CA SER A 621 2.924 -11.394 20.220 1.00 46.65 C ATOM 351 C SER A 621 2.788 -9.887 20.129 1.00 43.78 C ATOM 352 O SER A 621 1.685 -9.383 20.102 1.00 46.77 O ATOM 353 CB SER A 621 3.047 -11.777 21.679 1.00 48.50 C ATOM 354 OG SER A 621 3.045 -13.172 21.817 1.00 53.37 O ATOM 355 HG SER A 621 2.198 -13.537 21.457 1.00 0.00 H ATOM 356 H SER A 621 4.805 -12.432 19.907 1.00 0.00 H ATOM 357 N MET A 622 3.897 -9.173 20.096 1.00 41.04 N ATOM 358 CA MET A 622 3.850 -7.713 19.962 1.00 40.88 C ATOM 359 C MET A 622 3.334 -7.245 18.596 1.00 39.80 C ATOM 360 O MET A 622 2.507 -6.335 18.522 1.00 39.99 O ATOM 361 CB MET A 622 5.217 -7.087 20.274 1.00 38.98 C ATOM 362 CG MET A 622 5.530 -7.129 21.758 1.00 41.41 C ATOM 363 SD MET A 622 7.069 -6.313 22.170 1.00 39.80 S ATOM 364 CE MET A 622 8.266 -7.473 21.543 1.00 38.18 C ATOM 365 H MET A 622 4.817 -9.652 20.166 1.00 0.00 H ATOM 366 N LEU A 623 3.802 -7.881 17.530 1.00 39.29 N ATOM 367 CA LEU A 623 3.277 -7.614 16.191 1.00 40.83 C ATOM 368 C LEU A 623 1.791 -7.941 16.059 1.00 44.03 C ATOM 369 O LEU A 623 1.050 -7.200 15.407 1.00 44.93 O ATOM 370 CB LEU A 623 4.087 -8.365 15.133 1.00 40.18 C ATOM 371 CG LEU A 623 5.494 -7.791 14.931 1.00 38.17 C ATOM 372 CD1 LEU A 623 6.360 -8.767 14.163 1.00 37.25 C ATOM 373 CD2 LEU A 623 5.428 -6.438 14.223 1.00 36.93 C ATOM 374 H LEU A 623 4.559 -8.585 17.649 1.00 0.00 H ATOM 375 N GLN A 624 1.364 -9.032 16.693 1.00 47.71 N ATOM 376 CA GLN A 624 -0.045 -9.415 16.749 1.00 52.62 C ATOM 377 C GLN A 624 -0.874 -8.349 17.454 1.00 51.89 C ATOM 378 O GLN A 624 -1.927 -7.960 16.947 1.00 52.46 O ATOM 379 CB GLN A 624 -0.209 -10.777 17.459 1.00 60.06 C ATOM 380 CG GLN A 624 -1.613 -11.362 17.522 1.00 67.09 C ATOM 381 CD GLN A 624 -2.045 -11.811 16.166 1.00 75.91 C ATOM 382 OE1 GLN A 624 -2.690 -11.064 15.482 1.00 79.88 O ATOM 383 NE2 GLN A 624 -1.617 -13.010 15.741 1.00 81.75 N ATOM 384 HE22 GLN A 624 -1.061 -13.618 16.375 1.00 0.00 H ATOM 385 HE21 GLN A 624 -1.841 -13.331 14.777 1.00 0.00 H ATOM 386 H GLN A 624 2.064 -9.637 17.169 1.00 0.00 H ATOM 387 N ASP A 625 -0.399 -7.877 18.604 1.00 48.77 N ATOM 388 CA ASP A 625 -1.136 -6.917 19.425 1.00 49.22 C ATOM 389 C ASP A 625 -1.178 -5.507 18.828 1.00 46.87 C ATOM 390 O ASP A 625 -2.135 -4.780 19.059 1.00 49.37 O ATOM 391 CB ASP A 625 -0.544 -6.873 20.830 1.00 50.25 C ATOM 392 CG ASP A 625 -1.449 -6.169 21.838 1.00 53.14 C ATOM 393 OD1 ASP A 625 -2.609 -6.599 22.037 1.00 54.56 O ATOM 394 OD2 ASP A 625 -0.988 -5.171 22.428 1.00 53.42 O ATOM 395 H ASP A 625 0.532 -8.203 18.932 1.00 0.00 H ATOM 396 N MET A 626 -0.167 -5.139 18.050 1.00 44.03 N ATOM 397 CA MET A 626 -0.182 -3.889 17.275 1.00 44.74 C ATOM 398 C MET A 626 -0.959 -4.022 15.949 1.00 45.69 C ATOM 399 O MET A 626 -1.141 -3.045 15.216 1.00 44.80 O ATOM 400 CB MET A 626 1.247 -3.440 16.969 1.00 44.20 C ATOM 401 CG MET A 626 2.070 -3.081 18.200 1.00 44.79 C ATOM 402 SD MET A 626 3.720 -2.459 17.814 1.00 44.14 S ATOM 403 CE MET A 626 4.467 -3.983 17.295 1.00 41.18 C ATOM 404 H MET A 626 0.667 -5.758 17.986 1.00 0.00 H ATOM 405 N ASN A 627 -1.382 -5.247 15.645 1.00 46.40 N ATOM 406 CA ASN A 627 -2.213 -5.585 14.496 1.00 47.88 C ATOM 407 C ASN A 627 -1.538 -5.541 13.139 1.00 45.30 C ATOM 408 O ASN A 627 -2.239 -5.514 12.136 1.00 46.94 O ATOM 409 CB ASN A 627 -3.493 -4.734 14.431 1.00 49.92 C ATOM 410 CG ASN A 627 -4.639 -5.475 13.736 1.00 52.12 C ATOM 411 OD1 ASN A 627 -4.810 -6.691 13.899 1.00 54.14 O ATOM 412 ND2 ASN A 627 -5.414 -4.751 12.941 1.00 53.58 N ATOM 413 HD22 ASN A 627 -5.238 -3.732 12.830 1.00 0.00 H ATOM 414 HD21 ASN A 627 -6.198 -5.202 12.428 1.00 0.00 H ATOM 415 H ASN A 627 -1.098 -6.023 16.276 1.00 0.00 H ATOM 416 N PHE A 628 -0.208 -5.550 13.098 1.00 43.97 N ATOM 417 CA PHE A 628 0.512 -5.484 11.831 1.00 43.07 C ATOM 418 C PHE A 628 0.445 -6.750 11.015 1.00 43.59 C ATOM 419 O PHE A 628 0.566 -6.681 9.796 1.00 43.94 O ATOM 420 CB PHE A 628 1.971 -5.075 12.030 1.00 42.69 C ATOM 421 CG PHE A 628 2.139 -3.685 12.560 1.00 42.62 C ATOM 422 CD1 PHE A 628 1.367 -2.625 12.055 1.00 44.30 C ATOM 423 CD2 PHE A 628 3.071 -3.420 13.554 1.00 42.24 C ATOM 424 CE1 PHE A 628 1.507 -1.341 12.547 1.00 43.98 C ATOM 425 CE2 PHE A 628 3.212 -2.134 14.050 1.00 42.68 C ATOM 426 CZ PHE A 628 2.437 -1.097 13.537 1.00 44.25 C ATOM 427 H PHE A 628 0.329 -5.605 13.987 1.00 0.00 H ATOM 428 N ILE A 629 0.222 -7.894 11.659 1.00 45.80 N ATOM 429 CA ILE A 629 0.145 -9.167 10.942 1.00 46.14 C ATOM 430 C ILE A 629 -1.099 -9.192 10.059 1.00 49.07 C ATOM 431 O ILE A 629 -1.020 -9.595 8.894 1.00 50.40 O ATOM 432 CB ILE A 629 0.181 -10.382 11.895 1.00 46.43 C ATOM 433 CG1 ILE A 629 1.536 -10.443 12.630 1.00 45.66 C ATOM 434 CG2 ILE A 629 -0.061 -11.678 11.125 1.00 46.76 C ATOM 435 CD1 ILE A 629 1.592 -11.420 13.794 1.00 48.16 C ATOM 436 H ILE A 629 0.100 -7.882 12.692 1.00 0.00 H ATOM 437 N ASN A 630 -2.240 -8.791 10.624 1.00 52.25 N ATOM 438 CA ASN A 630 -3.497 -8.692 9.875 1.00 54.54 C ATOM 439 C ASN A 630 -3.542 -7.474 8.937 1.00 51.34 C ATOM 440 O ASN A 630 -4.004 -7.594 7.808 1.00 51.87 O ATOM 441 CB ASN A 630 -4.710 -8.659 10.825 1.00 59.63 C ATOM 442 CG ASN A 630 -4.917 -9.972 11.570 1.00 64.01 C ATOM 443 OD1 ASN A 630 -4.537 -11.051 11.097 1.00 67.85 O ATOM 444 ND2 ASN A 630 -5.544 -9.891 12.739 1.00 68.09 N ATOM 445 HD22 ASN A 630 -5.848 -8.965 13.103 1.00 0.00 H ATOM 446 HD21 ASN A 630 -5.731 -10.753 13.290 1.00 0.00 H ATOM 447 H ASN A 630 -2.237 -8.539 11.633 1.00 0.00 H ATOM 448 N ASN A 631 -3.058 -6.327 9.403 1.00 48.08 N ATOM 449 CA ASN A 631 -2.977 -5.111 8.592 1.00 47.48 C ATOM 450 C ASN A 631 -2.251 -5.348 7.269 1.00 46.56 C ATOM 451 O ASN A 631 -2.768 -5.003 6.221 1.00 45.71 O ATOM 452 CB ASN A 631 -2.263 -4.002 9.368 1.00 48.63 C ATOM 453 CG ASN A 631 -2.404 -2.621 8.731 1.00 50.80 C ATOM 454 OD1 ASN A 631 -2.722 -2.471 7.547 1.00 53.48 O ATOM 455 ND2 ASN A 631 -2.168 -1.593 9.538 1.00 50.59 N ATOM 456 HD22 ASN A 631 -1.902 -1.761 10.529 1.00 0.00 H ATOM 457 HD21 ASN A 631 -2.249 -0.620 9.178 1.00 0.00 H ATOM 458 H ASN A 631 -2.722 -6.292 10.387 1.00 0.00 H ATOM 459 N TYR A 632 -1.058 -5.941 7.330 1.00 45.78 N ATOM 460 CA TYR A 632 -0.217 -6.149 6.146 1.00 44.01 C ATOM 461 C TYR A 632 -0.257 -7.561 5.576 1.00 44.71 C ATOM 462 O TYR A 632 0.465 -7.847 4.626 1.00 45.15 O ATOM 463 CB TYR A 632 1.222 -5.714 6.445 1.00 42.06 C ATOM 464 CG TYR A 632 1.283 -4.241 6.672 1.00 41.46 C ATOM 465 CD1 TYR A 632 1.193 -3.351 5.600 1.00 42.49 C ATOM 466 CD2 TYR A 632 1.336 -3.719 7.968 1.00 42.54 C ATOM 467 CE1 TYR A 632 1.187 -1.975 5.811 1.00 43.07 C ATOM 468 CE2 TYR A 632 1.332 -2.348 8.191 1.00 43.57 C ATOM 469 CZ TYR A 632 1.261 -1.485 7.110 1.00 42.71 C ATOM 470 OH TYR A 632 1.234 -0.146 7.343 1.00 45.03 O ATOM 471 HH TYR A 632 1.183 0.337 6.480 1.00 0.00 H ATOM 472 H TYR A 632 -0.710 -6.269 8.254 1.00 0.00 H ATOM 473 N LYS A 633 -1.106 -8.421 6.141 1.00 46.60 N ATOM 474 CA LYS A 633 -1.300 -9.792 5.661 1.00 49.50 C ATOM 475 C LYS A 633 0.025 -10.533 5.576 1.00 47.14 C ATOM 476 O LYS A 633 0.379 -11.099 4.550 1.00 48.12 O ATOM 477 CB LYS A 633 -2.038 -9.796 4.312 1.00 51.79 C ATOM 478 CG LYS A 633 -3.363 -9.030 4.342 1.00 54.28 C ATOM 479 CD LYS A 633 -4.408 -9.704 5.222 1.00 58.27 C ATOM 480 CE LYS A 633 -5.753 -8.977 5.185 1.00 63.62 C ATOM 481 NZ LYS A 633 -5.630 -7.487 5.296 1.00 63.24 N ATOM 482 HZ1 LYS A 633 -5.169 -7.245 6.196 1.00 0.00 H ATOM 483 HZ2 LYS A 633 -5.059 -7.128 4.505 1.00 0.00 H ATOM 484 HZ3 LYS A 633 -6.577 -7.059 5.264 1.00 0.00 H ATOM 485 H LYS A 633 -1.658 -8.103 6.963 1.00 0.00 H ATOM 486 N ILE A 634 0.759 -10.508 6.679 1.00 46.71 N ATOM 487 CA ILE A 634 2.074 -11.130 6.735 1.00 44.18 C ATOM 488 C ILE A 634 1.831 -12.631 6.880 1.00 44.81 C ATOM 489 O ILE A 634 1.004 -13.047 7.690 1.00 44.28 O ATOM 490 CB ILE A 634 2.897 -10.647 7.937 1.00 44.82 C ATOM 491 CG1 ILE A 634 2.933 -9.100 8.055 1.00 44.35 C ATOM 492 CG2 ILE A 634 4.314 -11.216 7.864 1.00 43.53 C ATOM 493 CD1 ILE A 634 3.632 -8.372 6.926 1.00 43.77 C ATOM 494 H ILE A 634 0.386 -10.032 7.525 1.00 0.00 H ATOM 495 N ASP A 635 2.520 -13.431 6.075 1.00 45.19 N ATOM 496 CA ASP A 635 2.500 -14.884 6.219 1.00 48.00 C ATOM 497 C ASP A 635 3.195 -15.235 7.549 1.00 48.66 C ATOM 498 O ASP A 635 4.349 -14.849 7.766 1.00 46.34 O ATOM 499 CB ASP A 635 3.240 -15.527 5.040 1.00 50.15 C ATOM 500 CG ASP A 635 3.184 -17.046 5.062 1.00 53.33 C ATOM 501 OD1 ASP A 635 2.098 -17.595 4.814 1.00 56.58 O ATOM 502 OD2 ASP A 635 4.228 -17.691 5.318 1.00 54.74 O ATOM 503 H ASP A 635 3.093 -13.009 5.317 1.00 0.00 H ATOM 504 N CYS A 636 2.510 -15.958 8.433 1.00 50.75 N ATOM 505 CA CYS A 636 3.072 -16.261 9.759 1.00 52.77 C ATOM 506 C CYS A 636 4.351 -17.119 9.750 1.00 48.92 C ATOM 507 O CYS A 636 5.273 -16.821 10.502 1.00 46.63 O ATOM 508 CB CYS A 636 2.019 -16.865 10.701 1.00 59.59 C ATOM 509 SG CYS A 636 1.121 -15.602 11.639 1.00 67.19 S ATOM 510 H CYS A 636 1.565 -16.313 8.183 1.00 0.00 H ATOM 511 N PRO A 637 4.401 -18.184 8.923 1.00 48.46 N ATOM 512 CA PRO A 637 5.650 -18.936 8.806 1.00 48.38 C ATOM 513 C PRO A 637 6.836 -18.075 8.334 1.00 45.66 C ATOM 514 O PRO A 637 7.927 -18.157 8.906 1.00 45.60 O ATOM 515 CB PRO A 637 5.317 -20.024 7.781 1.00 51.67 C ATOM 516 CG PRO A 637 3.843 -20.234 7.892 1.00 53.51 C ATOM 517 CD PRO A 637 3.264 -18.899 8.303 1.00 51.51 C ATOM 518 N THR A 638 6.608 -17.243 7.325 1.00 43.02 N ATOM 519 CA THR A 638 7.616 -16.305 6.857 1.00 38.93 C ATOM 520 C THR A 638 8.071 -15.393 8.004 1.00 37.53 C ATOM 521 O THR A 638 9.282 -15.205 8.213 1.00 36.76 O ATOM 522 CB THR A 638 7.108 -15.464 5.655 1.00 37.05 C ATOM 523 OG1 THR A 638 6.659 -16.329 4.607 1.00 37.56 O ATOM 524 CG2 THR A 638 8.216 -14.572 5.098 1.00 35.49 C ATOM 525 HG1 THR A 638 5.921 -16.897 4.943 1.00 0.00 H ATOM 526 H THR A 638 5.680 -17.263 6.855 1.00 0.00 H ATOM 527 N LEU A 639 7.112 -14.853 8.752 1.00 36.82 N ATOM 528 CA LEU A 639 7.417 -13.995 9.898 1.00 35.61 C ATOM 529 C LEU A 639 8.181 -14.717 11.007 1.00 35.65 C ATOM 530 O LEU A 639 9.145 -14.172 11.540 1.00 34.68 O ATOM 531 CB LEU A 639 6.142 -13.400 10.470 1.00 36.16 C ATOM 532 CG LEU A 639 6.274 -12.408 11.620 1.00 35.58 C ATOM 533 CD1 LEU A 639 7.207 -11.243 11.302 1.00 33.66 C ATOM 534 CD2 LEU A 639 4.888 -11.913 11.964 1.00 36.98 C ATOM 535 H LEU A 639 6.118 -15.046 8.516 1.00 0.00 H ATOM 536 N ALA A 640 7.776 -15.940 11.335 1.00 37.80 N ATOM 537 CA ALA A 640 8.520 -16.759 12.308 1.00 38.58 C ATOM 538 C ALA A 640 9.975 -16.991 11.873 1.00 37.87 C ATOM 539 O ALA A 640 10.902 -16.772 12.652 1.00 37.66 O ATOM 540 CB ALA A 640 7.823 -18.092 12.537 1.00 40.74 C ATOM 541 H ALA A 640 6.916 -16.327 10.896 1.00 0.00 H ATOM 542 N ARG A 641 10.174 -17.403 10.623 1.00 38.72 N ATOM 543 CA ARG A 641 11.530 -17.574 10.088 1.00 38.98 C ATOM 544 C ARG A 641 12.311 -16.266 10.028 1.00 36.19 C ATOM 545 O ARG A 641 13.494 -16.254 10.328 1.00 38.93 O ATOM 546 CB ARG A 641 11.498 -18.215 8.708 1.00 40.61 C ATOM 547 CG ARG A 641 11.058 -19.661 8.720 1.00 43.37 C ATOM 548 CD ARG A 641 11.222 -20.260 7.334 1.00 45.59 C ATOM 549 NE ARG A 641 10.095 -19.862 6.514 1.00 46.99 N ATOM 550 CZ ARG A 641 9.062 -20.607 6.149 1.00 49.13 C ATOM 551 NH1 ARG A 641 8.963 -21.895 6.478 1.00 52.60 N ATOM 552 NH2 ARG A 641 8.126 -20.046 5.417 1.00 48.44 N ATOM 553 HE ARG A 641 10.098 -18.879 6.173 1.00 0.00 H ATOM 554 HH12 ARG A 641 8.136 -22.448 6.173 1.00 0.00 H ATOM 555 HH11 ARG A 641 9.712 -22.347 7.040 1.00 0.00 H ATOM 556 HH22 ARG A 641 7.301 -20.601 5.113 1.00 0.00 H ATOM 557 HH21 ARG A 641 8.210 -19.047 5.142 1.00 0.00 H ATOM 558 H ARG A 641 9.355 -17.607 10.015 1.00 0.00 H ATOM 559 N PHE A 642 11.663 -15.164 9.661 1.00 35.31 N ATOM 560 CA PHE A 642 12.335 -13.856 9.679 1.00 34.22 C ATOM 561 C PHE A 642 12.863 -13.513 11.066 1.00 35.90 C ATOM 562 O PHE A 642 14.021 -13.122 11.205 1.00 37.10 O ATOM 563 CB PHE A 642 11.398 -12.755 9.206 1.00 32.38 C ATOM 564 CG PHE A 642 11.961 -11.377 9.346 1.00 29.43 C ATOM 565 CD1 PHE A 642 12.864 -10.882 8.413 1.00 28.75 C ATOM 566 CD2 PHE A 642 11.585 -10.563 10.407 1.00 28.67 C ATOM 567 CE1 PHE A 642 13.407 -9.610 8.546 1.00 27.06 C ATOM 568 CE2 PHE A 642 12.114 -9.282 10.538 1.00 27.94 C ATOM 569 CZ PHE A 642 13.021 -8.803 9.602 1.00 26.84 C ATOM 570 H PHE A 642 10.670 -15.228 9.358 1.00 0.00 H ATOM 571 N CYS A 643 12.026 -13.685 12.088 1.00 38.82 N ATOM 572 CA CYS A 643 12.406 -13.368 13.472 1.00 40.48 C ATOM 573 C CYS A 643 13.563 -14.202 14.009 1.00 39.02 C ATOM 574 O CYS A 643 14.418 -13.686 14.728 1.00 36.24 O ATOM 575 CB CYS A 643 11.211 -13.511 14.410 1.00 45.41 C ATOM 576 SG CYS A 643 9.891 -12.328 14.035 1.00 53.76 S ATOM 577 H CYS A 643 11.073 -14.056 11.900 1.00 0.00 H ATOM 578 N LEU A 644 13.578 -15.485 13.667 1.00 41.08 N ATOM 579 CA LEU A 644 14.665 -16.378 14.078 1.00 42.79 C ATOM 580 C LEU A 644 15.968 -16.049 13.370 1.00 40.41 C ATOM 581 O LEU A 644 17.028 -16.126 13.982 1.00 41.85 O ATOM 582 CB LEU A 644 14.284 -17.851 13.870 1.00 46.99 C ATOM 583 CG LEU A 644 13.149 -18.324 14.793 1.00 50.51 C ATOM 584 CD1 LEU A 644 12.646 -19.694 14.362 1.00 52.94 C ATOM 585 CD2 LEU A 644 13.568 -18.358 16.264 1.00 51.77 C ATOM 586 H LEU A 644 12.799 -15.866 13.093 1.00 0.00 H ATOM 587 N MET A 645 15.890 -15.683 12.094 1.00 39.40 N ATOM 588 CA MET A 645 17.069 -15.232 11.365 1.00 40.93 C ATOM 589 C MET A 645 17.649 -13.933 11.921 1.00 35.81 C ATOM 590 O MET A 645 18.864 -13.787 11.988 1.00 35.15 O ATOM 591 CB MET A 645 16.764 -15.069 9.874 1.00 46.01 C ATOM 592 CG MET A 645 16.904 -16.356 9.092 1.00 54.68 C ATOM 593 SD MET A 645 18.629 -16.683 8.681 1.00 67.30 S ATOM 594 CE MET A 645 18.836 -15.545 7.311 1.00 61.73 C ATOM 595 H MET A 645 14.972 -15.719 11.607 1.00 0.00 H ATOM 596 N VAL A 646 16.792 -12.990 12.299 1.00 32.95 N ATOM 597 CA VAL A 646 17.253 -11.736 12.900 1.00 31.14 C ATOM 598 C VAL A 646 17.981 -12.014 14.209 1.00 32.23 C ATOM 599 O VAL A 646 19.105 -11.562 14.403 1.00 33.01 O ATOM 600 CB VAL A 646 16.100 -10.730 13.119 1.00 29.55 C ATOM 601 CG1 VAL A 646 16.542 -9.566 13.997 1.00 27.64 C ATOM 602 CG2 VAL A 646 15.605 -10.216 11.781 1.00 28.82 C ATOM 603 H VAL A 646 15.772 -13.146 12.165 1.00 0.00 H ATOM 604 N LYS A 647 17.344 -12.783 15.085 1.00 35.47 N ATOM 605 CA LYS A 647 17.955 -13.258 16.335 1.00 37.16 C ATOM 606 C LYS A 647 19.315 -13.916 16.092 1.00 36.27 C ATOM 607 O LYS A 647 20.300 -13.553 16.714 1.00 38.54 O ATOM 608 CB LYS A 647 17.001 -14.254 17.015 1.00 39.56 C ATOM 609 CG LYS A 647 17.488 -14.833 18.332 1.00 41.03 C ATOM 610 CD LYS A 647 16.329 -15.446 19.104 1.00 43.18 C ATOM 611 CE LYS A 647 16.805 -16.133 20.369 1.00 44.37 C ATOM 612 NZ LYS A 647 17.418 -17.451 20.061 1.00 46.39 N ATOM 613 HZ1 LYS A 647 16.714 -18.059 19.595 1.00 0.00 H ATOM 614 HZ2 LYS A 647 18.232 -17.314 19.429 1.00 0.00 H ATOM 615 HZ3 LYS A 647 17.735 -17.899 20.944 1.00 0.00 H ATOM 616 H LYS A 647 16.364 -13.063 14.876 1.00 0.00 H ATOM 617 N LYS A 648 19.346 -14.869 15.172 1.00 37.32 N ATOM 618 CA LYS A 648 20.564 -15.586 14.796 1.00 41.78 C ATOM 619 C LYS A 648 21.658 -14.636 14.273 1.00 39.49 C ATOM 620 O LYS A 648 22.839 -14.924 14.417 1.00 41.81 O ATOM 621 CB LYS A 648 20.217 -16.647 13.742 1.00 47.73 C ATOM 622 CG LYS A 648 21.330 -17.610 13.342 1.00 55.38 C ATOM 623 CD LYS A 648 20.928 -18.464 12.135 1.00 61.53 C ATOM 624 CE LYS A 648 19.942 -19.577 12.483 1.00 67.25 C ATOM 625 NZ LYS A 648 20.589 -20.735 13.168 1.00 73.39 N ATOM 626 HZ1 LYS A 648 21.318 -21.140 12.547 1.00 0.00 H ATOM 627 HZ2 LYS A 648 21.027 -20.411 14.054 1.00 0.00 H ATOM 628 HZ3 LYS A 648 19.871 -21.457 13.379 1.00 0.00 H ATOM 629 H LYS A 648 18.458 -15.120 14.692 1.00 0.00 H ATOM 630 N GLY A 649 21.264 -13.521 13.657 1.00 36.78 N ATOM 631 CA GLY A 649 22.214 -12.530 13.125 1.00 35.09 C ATOM 632 C GLY A 649 22.900 -11.611 14.129 1.00 33.98 C ATOM 633 O GLY A 649 23.751 -10.798 13.737 1.00 34.11 O ATOM 634 H GLY A 649 20.245 -13.344 13.548 1.00 0.00 H ATOM 635 N TYR A 650 22.525 -11.702 15.407 1.00 32.32 N ATOM 636 CA TYR A 650 23.263 -11.041 16.469 1.00 32.52 C ATOM 637 C TYR A 650 24.374 -11.963 16.994 1.00 33.87 C ATOM 638 O TYR A 650 24.190 -13.174 17.090 1.00 33.64 O ATOM 639 CB TYR A 650 22.327 -10.577 17.591 1.00 32.22 C ATOM 640 CG TYR A 650 21.574 -9.348 17.193 1.00 31.58 C ATOM 641 CD1 TYR A 650 20.387 -9.445 16.489 1.00 32.31 C ATOM 642 CD2 TYR A 650 22.078 -8.084 17.455 1.00 30.69 C ATOM 643 CE1 TYR A 650 19.707 -8.317 16.069 1.00 31.35 C ATOM 644 CE2 TYR A 650 21.409 -6.951 17.043 1.00 29.54 C ATOM 645 CZ TYR A 650 20.228 -7.069 16.337 1.00 29.83 C ATOM 646 OH TYR A 650 19.542 -5.946 15.927 1.00 29.48 O ATOM 647 HH TYR A 650 18.725 -6.220 15.439 1.00 0.00 H ATOM 648 H TYR A 650 21.682 -12.261 15.649 1.00 0.00 H ATOM 649 N ARG A 651 25.533 -11.368 17.283 1.00 34.26 N ATOM 650 CA ARG A 651 26.645 -12.053 17.953 1.00 37.23 C ATOM 651 C ARG A 651 26.449 -11.887 19.454 1.00 37.38 C ATOM 652 O ARG A 651 25.410 -11.368 19.879 1.00 36.67 O ATOM 653 CB ARG A 651 27.979 -11.454 17.504 1.00 37.05 C ATOM 654 CG ARG A 651 28.176 -11.506 16.003 1.00 37.11 C ATOM 655 CD ARG A 651 29.608 -11.141 15.646 1.00 38.50 C ATOM 656 NE ARG A 651 29.786 -11.098 14.204 1.00 40.47 N ATOM 657 CZ ARG A 651 30.962 -11.126 13.569 1.00 41.29 C ATOM 658 NH1 ARG A 651 32.108 -11.183 14.232 1.00 39.59 N ATOM 659 NH2 ARG A 651 30.976 -11.080 12.237 1.00 43.10 N ATOM 660 HE ARG A 651 28.928 -11.041 13.618 1.00 0.00 H ATOM 661 HH12 ARG A 651 33.009 -11.204 13.713 1.00 0.00 H ATOM 662 HH11 ARG A 651 32.107 -11.207 15.272 1.00 0.00 H ATOM 663 HH22 ARG A 651 31.881 -11.101 11.725 1.00 0.00 H ATOM 664 HH21 ARG A 651 30.082 -11.023 11.709 1.00 0.00 H ATOM 665 H ARG A 651 25.654 -10.369 17.020 1.00 0.00 H ATOM 666 N ASP A 652 27.439 -12.291 20.252 1.00 39.54 N ATOM 667 CA ASP A 652 27.328 -12.270 21.707 1.00 41.60 C ATOM 668 C ASP A 652 28.387 -11.395 22.402 1.00 38.89 C ATOM 669 O ASP A 652 28.982 -11.826 23.385 1.00 37.89 O ATOM 670 CB ASP A 652 27.407 -13.712 22.245 1.00 47.97 C ATOM 671 CG ASP A 652 26.438 -14.668 21.532 1.00 54.21 C ATOM 672 OD1 ASP A 652 25.226 -14.363 21.460 1.00 56.93 O ATOM 673 OD2 ASP A 652 26.886 -15.746 21.063 1.00 62.72 O ATOM 674 H ASP A 652 28.322 -12.633 19.822 1.00 0.00 H ATOM 675 N PRO A 653 28.597 -10.150 21.934 1.00 35.86 N ATOM 676 CA PRO A 653 29.384 -9.265 22.798 1.00 35.52 C ATOM 677 C PRO A 653 28.560 -8.888 24.049 1.00 35.17 C ATOM 678 O PRO A 653 27.387 -9.245 24.124 1.00 36.50 O ATOM 679 CB PRO A 653 29.651 -8.052 21.909 1.00 35.02 C ATOM 680 CG PRO A 653 28.458 -7.987 21.011 1.00 34.40 C ATOM 681 CD PRO A 653 28.050 -9.423 20.771 1.00 35.85 C ATOM 682 N PRO A 654 29.164 -8.198 25.020 1.00 34.94 N ATOM 683 CA PRO A 654 28.471 -7.975 26.288 1.00 36.14 C ATOM 684 C PRO A 654 27.156 -7.199 26.219 1.00 34.70 C ATOM 685 O PRO A 654 26.212 -7.558 26.923 1.00 33.75 O ATOM 686 CB PRO A 654 29.501 -7.201 27.104 1.00 36.73 C ATOM 687 CG PRO A 654 30.802 -7.775 26.646 1.00 37.72 C ATOM 688 CD PRO A 654 30.616 -7.949 25.157 1.00 37.27 C ATOM 689 N TYR A 655 27.101 -6.167 25.388 1.00 32.16 N ATOM 690 CA TYR A 655 25.901 -5.341 25.256 1.00 32.55 C ATOM 691 C TYR A 655 25.146 -5.515 23.944 1.00 31.88 C ATOM 692 O TYR A 655 23.938 -5.695 23.955 1.00 32.57 O ATOM 693 CB TYR A 655 26.265 -3.879 25.406 1.00 32.68 C ATOM 694 CG TYR A 655 25.064 -2.979 25.353 1.00 33.07 C ATOM 695 CD1 TYR A 655 24.153 -2.950 26.402 1.00 33.46 C ATOM 696 CD2 TYR A 655 24.824 -2.166 24.246 1.00 32.15 C ATOM 697 CE1 TYR A 655 23.041 -2.132 26.360 1.00 32.64 C ATOM 698 CE2 TYR A 655 23.728 -1.334 24.209 1.00 32.44 C ATOM 699 CZ TYR A 655 22.833 -1.327 25.276 1.00 33.33 C ATOM 700 OH TYR A 655 21.724 -0.503 25.258 1.00 34.39 O ATOM 701 HH TYR A 655 21.206 -0.631 26.092 1.00 0.00 H ATOM 702 H TYR A 655 27.937 -5.938 24.813 1.00 0.00 H ATOM 703 N HIS A 656 25.852 -5.449 22.819 1.00 31.55 N ATOM 704 CA HIS A 656 25.208 -5.402 21.496 1.00 31.52 C ATOM 705 C HIS A 656 24.892 -6.791 20.970 1.00 29.93 C ATOM 706 O HIS A 656 25.419 -7.223 19.943 1.00 30.08 O ATOM 707 CB HIS A 656 26.065 -4.610 20.494 1.00 30.76 C ATOM 708 CG HIS A 656 26.077 -3.137 20.750 1.00 31.53 C ATOM 709 ND1 HIS A 656 27.182 -2.465 21.226 1.00 33.36 N ATOM 710 CD2 HIS A 656 25.114 -2.204 20.596 1.00 32.44 C ATOM 711 CE1 HIS A 656 26.906 -1.177 21.333 1.00 32.98 C ATOM 712 NE2 HIS A 656 25.655 -0.992 20.957 1.00 33.97 N ATOM 713 H HIS A 656 26.890 -5.430 22.876 1.00 0.00 H ATOM 714 N ASN A 657 23.974 -7.445 21.673 1.00 29.25 N ATOM 715 CA ASN A 657 23.542 -8.826 21.400 1.00 30.39 C ATOM 716 C ASN A 657 22.019 -8.843 21.143 1.00 29.57 C ATOM 717 O ASN A 657 21.369 -7.785 21.151 1.00 27.85 O ATOM 718 CB ASN A 657 23.934 -9.751 22.565 1.00 31.84 C ATOM 719 CG ASN A 657 23.458 -9.235 23.911 1.00 32.05 C ATOM 720 OD1 ASN A 657 22.334 -8.730 24.051 1.00 31.70 O ATOM 721 ND2 ASN A 657 24.324 -9.310 24.898 1.00 33.63 N ATOM 722 HD22 ASN A 657 25.257 -9.741 24.740 1.00 0.00 H ATOM 723 HD21 ASN A 657 24.076 -8.938 25.837 1.00 0.00 H ATOM 724 H ASN A 657 23.530 -6.947 22.471 1.00 0.00 H ATOM 725 N TRP A 658 21.453 -10.027 20.932 1.00 30.00 N ATOM 726 CA TRP A 658 20.016 -10.134 20.663 1.00 30.15 C ATOM 727 C TRP A 658 19.174 -9.490 21.761 1.00 29.76 C ATOM 728 O TRP A 658 18.246 -8.760 21.451 1.00 27.61 O ATOM 729 CB TRP A 658 19.601 -11.592 20.419 1.00 32.37 C ATOM 730 CG TRP A 658 18.129 -11.780 20.386 1.00 34.59 C ATOM 731 CD1 TRP A 658 17.394 -12.568 21.221 1.00 38.09 C ATOM 732 CD2 TRP A 658 17.190 -11.135 19.512 1.00 33.12 C ATOM 733 NE1 TRP A 658 16.062 -12.469 20.914 1.00 38.59 N ATOM 734 CE2 TRP A 658 15.909 -11.587 19.875 1.00 35.61 C ATOM 735 CE3 TRP A 658 17.309 -10.205 18.468 1.00 32.52 C ATOM 736 CZ2 TRP A 658 14.755 -11.165 19.218 1.00 36.05 C ATOM 737 CZ3 TRP A 658 16.169 -9.777 17.818 1.00 31.99 C ATOM 738 CH2 TRP A 658 14.907 -10.251 18.192 1.00 34.65 C ATOM 739 HE1 TRP A 658 15.292 -12.980 21.391 1.00 0.00 H ATOM 740 H TRP A 658 22.036 -10.888 20.958 1.00 0.00 H ATOM 741 N MET A 659 19.506 -9.725 23.034 1.00 31.93 N ATOM 742 CA MET A 659 18.701 -9.172 24.147 1.00 34.00 C ATOM 743 C MET A 659 18.626 -7.632 24.123 1.00 33.12 C ATOM 744 O MET A 659 17.624 -7.053 24.559 1.00 34.15 O ATOM 745 CB MET A 659 19.181 -9.667 25.519 1.00 37.04 C ATOM 746 CG MET A 659 18.914 -11.141 25.798 1.00 40.37 C ATOM 747 SD MET A 659 17.186 -11.660 25.595 1.00 45.16 S ATOM 748 CE MET A 659 16.362 -10.655 26.834 1.00 44.74 C ATOM 749 H MET A 659 20.343 -10.305 23.246 1.00 0.00 H ATOM 750 N HIS A 660 19.655 -6.970 23.597 1.00 29.42 N ATOM 751 CA HIS A 660 19.573 -5.526 23.359 1.00 28.15 C ATOM 752 C HIS A 660 18.522 -5.201 22.286 1.00 27.94 C ATOM 753 O HIS A 660 17.623 -4.397 22.523 1.00 28.34 O ATOM 754 CB HIS A 660 20.921 -4.965 22.944 1.00 27.12 C ATOM 755 CG HIS A 660 20.860 -3.555 22.470 1.00 25.67 C ATOM 756 ND1 HIS A 660 20.348 -2.543 23.242 1.00 26.16 N ATOM 757 CD2 HIS A 660 21.250 -2.983 21.308 1.00 26.94 C ATOM 758 CE1 HIS A 660 20.433 -1.401 22.585 1.00 26.33 C ATOM 759 NE2 HIS A 660 20.955 -1.644 21.398 1.00 26.42 N ATOM 760 H HIS A 660 20.526 -7.483 23.353 1.00 0.00 H ATOM 761 N ALA A 661 18.637 -5.851 21.132 1.00 26.52 N ATOM 762 CA ALA A 661 17.678 -5.698 20.055 1.00 27.90 C ATOM 763 C ALA A 661 16.239 -5.994 20.497 1.00 29.68 C ATOM 764 O ALA A 661 15.323 -5.240 20.151 1.00 32.05 O ATOM 765 CB ALA A 661 18.055 -6.575 18.873 1.00 28.48 C ATOM 766 H ALA A 661 19.444 -6.493 20.997 1.00 0.00 H ATOM 767 N PHE A 662 16.038 -7.075 21.252 1.00 30.68 N ATOM 768 CA PHE A 662 14.719 -7.392 21.794 1.00 34.06 C ATOM 769 C PHE A 662 14.189 -6.297 22.729 1.00 35.52 C ATOM 770 O PHE A 662 13.015 -5.906 22.651 1.00 37.21 O ATOM 771 CB PHE A 662 14.736 -8.726 22.540 1.00 35.69 C ATOM 772 CG PHE A 662 13.432 -9.045 23.209 1.00 39.44 C ATOM 773 CD1 PHE A 662 12.337 -9.439 22.458 1.00 39.16 C ATOM 774 CD2 PHE A 662 13.284 -8.916 24.590 1.00 42.78 C ATOM 775 CE1 PHE A 662 11.127 -9.721 23.063 1.00 41.54 C ATOM 776 CE2 PHE A 662 12.075 -9.198 25.204 1.00 44.39 C ATOM 777 CZ PHE A 662 10.991 -9.602 24.436 1.00 44.66 C ATOM 778 H PHE A 662 16.838 -7.706 21.459 1.00 0.00 H ATOM 779 N SER A 663 15.042 -5.843 23.641 1.00 36.34 N ATOM 780 CA SER A 663 14.681 -4.765 24.576 1.00 37.40 C ATOM 781 C SER A 663 14.315 -3.451 23.862 1.00 35.48 C ATOM 782 O SER A 663 13.369 -2.782 24.255 1.00 35.55 O ATOM 783 CB SER A 663 15.747 -4.571 25.656 1.00 38.51 C ATOM 784 OG SER A 663 16.941 -3.994 25.155 1.00 40.17 O ATOM 785 HG SER A 663 17.322 -4.582 24.456 1.00 0.00 H ATOM 786 H SER A 663 15.992 -6.262 23.696 1.00 0.00 H ATOM 787 N VAL A 664 15.042 -3.120 22.799 1.00 33.58 N ATOM 788 CA VAL A 664 14.785 -1.921 21.996 1.00 32.66 C ATOM 789 C VAL A 664 13.450 -2.059 21.255 1.00 32.30 C ATOM 790 O VAL A 664 12.670 -1.122 21.229 1.00 31.15 O ATOM 791 CB VAL A 664 15.947 -1.657 21.011 1.00 32.96 C ATOM 792 CG1 VAL A 664 15.620 -0.566 19.994 1.00 33.37 C ATOM 793 CG2 VAL A 664 17.197 -1.260 21.777 1.00 31.29 C ATOM 794 H VAL A 664 15.830 -3.741 22.524 1.00 0.00 H ATOM 795 N SER A 665 13.190 -3.244 20.714 1.00 32.46 N ATOM 796 CA SER A 665 11.936 -3.557 20.029 1.00 33.36 C ATOM 797 C SER A 665 10.774 -3.504 20.986 1.00 35.73 C ATOM 798 O SER A 665 9.704 -2.976 20.648 1.00 37.64 O ATOM 799 CB SER A 665 11.991 -4.957 19.408 1.00 34.17 C ATOM 800 OG SER A 665 13.072 -5.069 18.496 1.00 32.34 O ATOM 801 HG SER A 665 13.923 -4.900 18.972 1.00 0.00 H ATOM 802 H SER A 665 13.915 -3.987 20.781 1.00 0.00 H ATOM 803 N HIS A 666 10.976 -4.040 22.187 1.00 36.34 N ATOM 804 CA HIS A 666 9.950 -3.982 23.209 1.00 37.51 C ATOM 805 C HIS A 666 9.589 -2.551 23.558 1.00 38.43 C ATOM 806 O HIS A 666 8.410 -2.243 23.772 1.00 40.10 O ATOM 807 CB HIS A 666 10.357 -4.728 24.467 1.00 38.67 C ATOM 808 CG HIS A 666 9.314 -4.677 25.534 1.00 40.98 C ATOM 809 ND1 HIS A 666 9.347 -3.757 26.559 1.00 42.13 N ATOM 810 CD2 HIS A 666 8.178 -5.390 25.701 1.00 41.69 C ATOM 811 CE1 HIS A 666 8.285 -3.924 27.326 1.00 43.76 C ATOM 812 NE2 HIS A 666 7.567 -4.915 26.832 1.00 44.27 N ATOM 813 H HIS A 666 11.882 -4.507 22.395 1.00 0.00 H ATOM 814 N PHE A 667 10.581 -1.666 23.612 1.00 36.11 N ATOM 815 CA PHE A 667 10.275 -0.264 23.924 1.00 37.17 C ATOM 816 C PHE A 667 9.449 0.402 22.821 1.00 36.17 C ATOM 817 O PHE A 667 8.576 1.206 23.106 1.00 39.28 O ATOM 818 CB PHE A 667 11.543 0.531 24.193 1.00 36.07 C ATOM 819 CG PHE A 667 11.297 1.829 24.899 1.00 36.12 C ATOM 820 CD1 PHE A 667 11.017 1.848 26.264 1.00 36.64 C ATOM 821 CD2 PHE A 667 11.366 3.033 24.205 1.00 35.29 C ATOM 822 CE1 PHE A 667 10.792 3.040 26.919 1.00 37.40 C ATOM 823 CE2 PHE A 667 11.144 4.230 24.859 1.00 36.26 C ATOM 824 CZ PHE A 667 10.855 4.232 26.218 1.00 37.90 C ATOM 825 H PHE A 667 11.562 -1.964 23.435 1.00 0.00 H ATOM 826 N CYS A 668 9.729 0.071 21.571 1.00 35.14 N ATOM 827 CA CYS A 668 8.929 0.562 20.453 1.00 36.56 C ATOM 828 C CYS A 668 7.450 0.179 20.613 1.00 37.22 C ATOM 829 O CYS A 668 6.546 1.014 20.446 1.00 37.90 O ATOM 830 CB CYS A 668 9.479 0.007 19.149 1.00 36.54 C ATOM 831 SG CYS A 668 8.597 0.578 17.711 1.00 41.37 S ATOM 832 H CYS A 668 10.538 -0.554 21.380 1.00 0.00 H ATOM 833 N TYR A 669 7.224 -1.083 20.962 1.00 36.55 N ATOM 834 CA TYR A 669 5.905 -1.570 21.330 1.00 37.24 C ATOM 835 C TYR A 669 5.276 -0.734 22.454 1.00 41.20 C ATOM 836 O TYR A 669 4.118 -0.308 22.341 1.00 43.77 O ATOM 837 CB TYR A 669 5.987 -3.043 21.721 1.00 36.19 C ATOM 838 CG TYR A 669 4.731 -3.593 22.324 1.00 38.75 C ATOM 839 CD1 TYR A 669 3.626 -3.842 21.533 1.00 38.80 C ATOM 840 CD2 TYR A 669 4.634 -3.845 23.695 1.00 40.53 C ATOM 841 CE1 TYR A 669 2.462 -4.341 22.074 1.00 42.51 C ATOM 842 CE2 TYR A 669 3.468 -4.340 24.253 1.00 43.37 C ATOM 843 CZ TYR A 669 2.384 -4.589 23.433 1.00 44.48 C ATOM 844 OH TYR A 669 1.213 -5.076 23.948 1.00 48.20 O ATOM 845 HH TYR A 669 0.555 -5.191 23.217 1.00 0.00 H ATOM 846 H TYR A 669 8.023 -1.749 20.972 1.00 0.00 H ATOM 847 N LEU A 670 6.035 -0.468 23.517 1.00 41.55 N ATOM 848 CA LEU A 670 5.537 0.361 24.624 1.00 43.85 C ATOM 849 C LEU A 670 5.134 1.763 24.167 1.00 44.77 C ATOM 850 O LEU A 670 4.107 2.284 24.601 1.00 47.85 O ATOM 851 CB LEU A 670 6.572 0.473 25.752 1.00 44.06 C ATOM 852 CG LEU A 670 6.925 -0.785 26.547 1.00 44.77 C ATOM 853 CD1 LEU A 670 7.918 -0.408 27.633 1.00 45.79 C ATOM 854 CD2 LEU A 670 5.695 -1.429 27.153 1.00 47.02 C ATOM 855 H LEU A 670 6.999 -0.855 23.564 1.00 0.00 H ATOM 856 N LEU A 671 5.939 2.372 23.304 1.00 42.66 N ATOM 857 CA LEU A 671 5.595 3.678 22.759 1.00 44.14 C ATOM 858 C LEU A 671 4.288 3.628 21.964 1.00 44.91 C ATOM 859 O LEU A 671 3.446 4.510 22.111 1.00 47.35 O ATOM 860 CB LEU A 671 6.721 4.219 21.881 1.00 42.94 C ATOM 861 CG LEU A 671 8.047 4.513 22.574 1.00 42.57 C ATOM 862 CD1 LEU A 671 9.017 5.033 21.540 1.00 41.87 C ATOM 863 CD2 LEU A 671 7.929 5.498 23.729 1.00 45.02 C ATOM 864 H LEU A 671 6.825 1.911 23.014 1.00 0.00 H ATOM 865 N TYR A 672 4.123 2.596 21.138 1.00 44.11 N ATOM 866 CA TYR A 672 2.851 2.349 20.440 1.00 45.58 C ATOM 867 C TYR A 672 1.673 2.280 21.409 1.00 48.13 C ATOM 868 O TYR A 672 0.673 2.962 21.227 1.00 50.94 O ATOM 869 CB TYR A 672 2.922 1.045 19.649 1.00 45.23 C ATOM 870 CG TYR A 672 1.655 0.690 18.918 1.00 47.41 C ATOM 871 CD1 TYR A 672 1.410 1.193 17.641 1.00 47.10 C ATOM 872 CD2 TYR A 672 0.683 -0.134 19.500 1.00 50.47 C ATOM 873 CE1 TYR A 672 0.246 0.882 16.956 1.00 48.91 C ATOM 874 CE2 TYR A 672 -0.491 -0.448 18.817 1.00 52.32 C ATOM 875 CZ TYR A 672 -0.692 0.059 17.543 1.00 51.09 C ATOM 876 OH TYR A 672 -1.832 -0.225 16.849 1.00 54.82 O ATOM 877 HH TYR A 672 -1.905 -1.204 16.724 1.00 0.00 H ATOM 878 H TYR A 672 4.918 1.944 20.981 1.00 0.00 H ATOM 879 N LYS A 673 1.824 1.469 22.451 1.00 49.80 N ATOM 880 CA LYS A 673 0.748 1.209 23.415 1.00 52.72 C ATOM 881 C LYS A 673 0.420 2.374 24.337 1.00 55.23 C ATOM 882 O LYS A 673 -0.726 2.526 24.730 1.00 56.18 O ATOM 883 CB LYS A 673 1.099 -0.006 24.286 1.00 53.25 C ATOM 884 CG LYS A 673 1.242 -1.318 23.523 1.00 51.29 C ATOM 885 CD LYS A 673 -0.067 -1.808 22.923 1.00 52.80 C ATOM 886 CE LYS A 673 -1.049 -2.258 23.988 1.00 56.29 C ATOM 887 NZ LYS A 673 -2.249 -2.875 23.378 1.00 57.51 N ATOM 888 HZ1 LYS A 673 -2.719 -2.181 22.762 1.00 0.00 H ATOM 889 HZ2 LYS A 673 -1.964 -3.702 22.816 1.00 0.00 H ATOM 890 HZ3 LYS A 673 -2.904 -3.174 24.129 1.00 0.00 H ATOM 891 H LYS A 673 2.742 1.000 22.589 1.00 0.00 H ATOM 892 N ASN A 674 1.427 3.171 24.697 1.00 55.95 N ATOM 893 CA ASN A 674 1.268 4.212 25.712 1.00 59.91 C ATOM 894 C ASN A 674 1.191 5.638 25.153 1.00 60.65 C ATOM 895 O ASN A 674 0.483 6.467 25.725 1.00 64.52 O ATOM 896 CB ASN A 674 2.399 4.108 26.749 1.00 59.69 C ATOM 897 CG ASN A 674 2.297 2.857 27.614 1.00 60.92 C ATOM 898 OD1 ASN A 674 1.606 2.852 28.628 1.00 65.20 O ATOM 899 ND2 ASN A 674 2.984 1.795 27.219 1.00 58.58 N ATOM 900 HD22 ASN A 674 3.558 1.840 26.353 1.00 0.00 H ATOM 901 HD21 ASN A 674 2.949 0.917 27.775 1.00 0.00 H ATOM 902 H ASN A 674 2.354 3.048 24.242 1.00 0.00 H ATOM 903 N LEU A 675 1.905 5.929 24.064 1.00 59.40 N ATOM 904 CA LEU A 675 1.882 7.267 23.456 1.00 62.12 C ATOM 905 C LEU A 675 0.902 7.437 22.295 1.00 66.43 C ATOM 906 O LEU A 675 0.803 8.543 21.750 1.00 71.55 O ATOM 907 CB LEU A 675 3.271 7.666 22.975 1.00 59.67 C ATOM 908 CG LEU A 675 4.413 7.548 23.981 1.00 60.70 C ATOM 909 CD1 LEU A 675 5.631 8.264 23.428 1.00 58.63 C ATOM 910 CD2 LEU A 675 4.046 8.109 25.353 1.00 63.66 C ATOM 911 H LEU A 675 2.494 5.188 23.633 1.00 0.00 H ATOM 912 N GLU A 676 0.188 6.373 21.916 1.00 66.86 N ATOM 913 CA GLU A 676 -0.790 6.431 20.825 1.00 70.91 C ATOM 914 C GLU A 676 -0.137 6.985 19.553 1.00 66.76 C ATOM 915 O GLU A 676 -0.489 8.075 19.064 1.00 66.76 O ATOM 916 CB GLU A 676 -2.013 7.268 21.221 1.00 79.24 C ATOM 917 CG GLU A 676 -2.683 6.839 22.519 1.00 86.00 C ATOM 918 CD GLU A 676 -3.310 8.013 23.252 1.00 95.21 C ATOM 919 OE1 GLU A 676 -4.140 8.717 22.635 1.00 98.57 O ATOM 920 OE2 GLU A 676 -2.963 8.238 24.434 1.00 98.61 O ATOM 921 H GLU A 676 0.331 5.471 22.413 1.00 0.00 H ATOM 922 N LEU A 677 0.826 6.222 19.034 1.00 59.22 N ATOM 923 CA LEU A 677 1.631 6.657 17.894 1.00 55.47 C ATOM 924 C LEU A 677 0.817 6.791 16.597 1.00 56.04 C ATOM 925 O LEU A 677 1.183 7.583 15.722 1.00 54.16 O ATOM 926 CB LEU A 677 2.827 5.718 17.673 1.00 52.85 C ATOM 927 CG LEU A 677 3.978 5.755 18.680 1.00 50.93 C ATOM 928 CD1 LEU A 677 5.038 4.762 18.259 1.00 49.03 C ATOM 929 CD2 LEU A 677 4.578 7.148 18.812 1.00 51.89 C ATOM 930 H LEU A 677 1.010 5.288 19.454 1.00 0.00 H ATOM 931 N THR A 678 -0.288 6.052 16.496 1.00 56.37 N ATOM 932 CA THR A 678 -1.177 6.139 15.336 1.00 58.38 C ATOM 933 C THR A 678 -1.824 7.524 15.127 1.00 60.95 C ATOM 934 O THR A 678 -2.286 7.812 14.033 1.00 59.39 O ATOM 935 CB THR A 678 -2.271 5.040 15.368 1.00 59.51 C ATOM 936 OG1 THR A 678 -2.962 5.071 16.621 1.00 60.08 O ATOM 937 CG2 THR A 678 -1.651 3.663 15.176 1.00 57.06 C ATOM 938 HG1 THR A 678 -3.657 4.366 16.631 1.00 0.00 H ATOM 939 H THR A 678 -0.526 5.393 17.265 1.00 0.00 H ATOM 940 N ASN A 679 -1.834 8.378 16.154 1.00 64.73 N ATOM 941 CA ASN A 679 -2.226 9.792 15.997 1.00 66.94 C ATOM 942 C ASN A 679 -1.153 10.701 15.363 1.00 64.00 C ATOM 943 O ASN A 679 -1.452 11.848 15.029 1.00 65.65 O ATOM 944 CB ASN A 679 -2.667 10.385 17.355 1.00 71.90 C ATOM 945 CG ASN A 679 -4.037 9.877 17.819 1.00 75.32 C ATOM 946 OD1 ASN A 679 -4.264 9.709 19.015 1.00 79.22 O ATOM 947 ND2 ASN A 679 -4.948 9.640 16.885 1.00 75.67 N ATOM 948 HD22 ASN A 679 -4.717 9.794 15.883 1.00 0.00 H ATOM 949 HD21 ASN A 679 -5.893 9.300 17.155 1.00 0.00 H ATOM 950 H ASN A 679 -1.556 8.035 17.096 1.00 0.00 H ATOM 951 N TYR A 680 0.079 10.208 15.221 1.00 61.52 N ATOM 952 CA TYR A 680 1.218 11.014 14.736 1.00 61.38 C ATOM 953 C TYR A 680 1.871 10.485 13.447 1.00 57.38 C ATOM 954 O TYR A 680 2.379 11.270 12.651 1.00 57.85 O ATOM 955 CB TYR A 680 2.295 11.114 15.834 1.00 63.86 C ATOM 956 CG TYR A 680 1.791 11.662 17.160 1.00 68.05 C ATOM 957 CD1 TYR A 680 1.079 10.849 18.049 1.00 70.41 C ATOM 958 CD2 TYR A 680 2.023 12.986 17.528 1.00 71.47 C ATOM 959 CE1 TYR A 680 0.603 11.344 19.260 1.00 74.17 C ATOM 960 CE2 TYR A 680 1.554 13.492 18.740 1.00 75.25 C ATOM 961 CZ TYR A 680 0.847 12.667 19.605 1.00 75.94 C ATOM 962 OH TYR A 680 0.389 13.147 20.811 1.00 76.84 O ATOM 963 HH TYR A 680 -0.089 12.426 21.292 1.00 0.00 H ATOM 964 H TYR A 680 0.245 9.210 15.463 1.00 0.00 H ATOM 965 N LEU A 681 1.897 9.165 13.273 1.00 52.60 N ATOM 966 CA LEU A 681 2.601 8.523 12.175 1.00 49.23 C ATOM 967 C LEU A 681 1.685 7.562 11.454 1.00 49.22 C ATOM 968 O LEU A 681 0.679 7.114 12.014 1.00 50.41 O ATOM 969 CB LEU A 681 3.782 7.723 12.709 1.00 46.89 C ATOM 970 CG LEU A 681 4.897 8.507 13.390 1.00 46.63 C ATOM 971 CD1 LEU A 681 5.848 7.549 14.106 1.00 43.68 C ATOM 972 CD2 LEU A 681 5.647 9.371 12.387 1.00 46.18 C ATOM 973 H LEU A 681 1.390 8.565 13.955 1.00 0.00 H ATOM 974 N GLU A 682 2.055 7.249 10.213 1.00 47.47 N ATOM 975 CA GLU A 682 1.349 6.268 9.394 1.00 48.13 C ATOM 976 C GLU A 682 1.638 4.866 9.936 1.00 45.02 C ATOM 977 O GLU A 682 2.671 4.652 10.577 1.00 42.89 O ATOM 978 CB GLU A 682 1.810 6.355 7.935 1.00 50.62 C ATOM 979 CG GLU A 682 1.606 7.708 7.245 1.00 55.22 C ATOM 980 CD GLU A 682 2.266 7.800 5.866 1.00 58.62 C ATOM 981 OE1 GLU A 682 3.201 7.027 5.560 1.00 62.71 O ATOM 982 OE2 GLU A 682 1.856 8.658 5.062 1.00 67.62 O ATOM 983 H GLU A 682 2.886 7.726 9.809 1.00 0.00 H ATOM 984 N ASP A 683 0.725 3.921 9.690 1.00 44.77 N ATOM 985 CA ASP A 683 0.923 2.521 10.111 1.00 43.78 C ATOM 986 C ASP A 683 2.198 1.898 9.530 1.00 40.99 C ATOM 987 O ASP A 683 2.903 1.165 10.223 1.00 40.01 O ATOM 988 CB ASP A 683 -0.270 1.644 9.725 1.00 46.12 C ATOM 989 CG ASP A 683 -1.498 1.865 10.617 1.00 50.05 C ATOM 990 OD1 ASP A 683 -1.370 2.375 11.765 1.00 50.64 O ATOM 991 OD2 ASP A 683 -2.599 1.472 10.161 1.00 52.06 O ATOM 992 H ASP A 683 -0.148 4.180 9.188 1.00 0.00 H ATOM 993 N ILE A 684 2.499 2.204 8.274 1.00 38.29 N ATOM 994 CA ILE A 684 3.704 1.674 7.653 1.00 36.66 C ATOM 995 C ILE A 684 4.997 2.248 8.278 1.00 35.31 C ATOM 996 O ILE A 684 5.999 1.545 8.355 1.00 31.74 O ATOM 997 CB ILE A 684 3.674 1.819 6.116 1.00 36.41 C ATOM 998 CG1 ILE A 684 4.706 0.874 5.505 1.00 37.18 C ATOM 999 CG2 ILE A 684 3.901 3.256 5.671 1.00 36.47 C ATOM 1000 CD1 ILE A 684 4.597 0.710 4.005 1.00 39.25 C ATOM 1001 H ILE A 684 1.869 2.827 7.729 1.00 0.00 H ATOM 1002 N GLU A 685 4.948 3.496 8.743 1.00 35.89 N ATOM 1003 CA GLU A 685 6.076 4.110 9.442 1.00 35.65 C ATOM 1004 C GLU A 685 6.310 3.457 10.786 1.00 34.65 C ATOM 1005 O GLU A 685 7.442 3.191 11.152 1.00 34.70 O ATOM 1006 CB GLU A 685 5.848 5.611 9.620 1.00 36.92 C ATOM 1007 CG GLU A 685 5.869 6.366 8.298 1.00 39.45 C ATOM 1008 CD GLU A 685 5.564 7.849 8.431 1.00 40.96 C ATOM 1009 OE1 GLU A 685 4.689 8.224 9.243 1.00 40.29 O ATOM 1010 OE2 GLU A 685 6.176 8.639 7.682 1.00 41.92 O ATOM 1011 H GLU A 685 4.080 4.051 8.604 1.00 0.00 H ATOM 1012 N ILE A 686 5.233 3.201 11.519 1.00 36.65 N ATOM 1013 CA ILE A 686 5.324 2.535 12.810 1.00 36.40 C ATOM 1014 C ILE A 686 5.796 1.096 12.635 1.00 34.46 C ATOM 1015 O ILE A 686 6.604 0.615 13.428 1.00 33.89 O ATOM 1016 CB ILE A 686 3.981 2.542 13.559 1.00 40.12 C ATOM 1017 CG1 ILE A 686 3.571 3.981 13.896 1.00 43.65 C ATOM 1018 CG2 ILE A 686 4.076 1.742 14.853 1.00 40.01 C ATOM 1019 CD1 ILE A 686 2.081 4.155 14.111 1.00 47.33 C ATOM 1020 H ILE A 686 4.299 3.484 11.161 1.00 0.00 H ATOM 1021 N PHE A 687 5.300 0.408 11.611 1.00 34.25 N ATOM 1022 CA PHE A 687 5.755 -0.960 11.336 1.00 34.04 C ATOM 1023 C PHE A 687 7.255 -0.990 11.006 1.00 32.37 C ATOM 1024 O PHE A 687 8.004 -1.799 11.549 1.00 30.58 O ATOM 1025 CB PHE A 687 4.914 -1.580 10.235 1.00 35.50 C ATOM 1026 CG PHE A 687 5.210 -3.039 9.956 1.00 36.47 C ATOM 1027 CD1 PHE A 687 5.439 -3.948 10.971 1.00 35.44 C ATOM 1028 CD2 PHE A 687 5.201 -3.506 8.652 1.00 37.31 C ATOM 1029 CE1 PHE A 687 5.691 -5.278 10.693 1.00 36.23 C ATOM 1030 CE2 PHE A 687 5.436 -4.841 8.373 1.00 38.53 C ATOM 1031 CZ PHE A 687 5.689 -5.730 9.395 1.00 37.07 C ATOM 1032 H PHE A 687 4.582 0.844 10.998 1.00 0.00 H ATOM 1033 N ALA A 688 7.677 -0.071 10.143 1.00 32.37 N ATOM 1034 CA ALA A 688 9.093 0.110 9.805 1.00 30.64 C ATOM 1035 C ALA A 688 9.967 0.381 11.018 1.00 30.44 C ATOM 1036 O ALA A 688 11.071 -0.145 11.091 1.00 31.55 O ATOM 1037 CB ALA A 688 9.260 1.236 8.790 1.00 30.83 C ATOM 1038 H ALA A 688 6.974 0.546 9.688 1.00 0.00 H ATOM 1039 N LEU A 689 9.484 1.186 11.959 1.00 29.87 N ATOM 1040 CA LEU A 689 10.243 1.482 13.176 1.00 31.02 C ATOM 1041 C LEU A 689 10.486 0.219 14.008 1.00 30.75 C ATOM 1042 O LEU A 689 11.585 0.000 14.485 1.00 26.54 O ATOM 1043 CB LEU A 689 9.509 2.512 14.033 1.00 33.41 C ATOM 1044 CG LEU A 689 10.132 2.911 15.376 1.00 34.70 C ATOM 1045 CD1 LEU A 689 11.494 3.553 15.186 1.00 33.55 C ATOM 1046 CD2 LEU A 689 9.195 3.857 16.119 1.00 37.14 C ATOM 1047 H LEU A 689 8.546 1.615 11.828 1.00 0.00 H ATOM 1048 N PHE A 690 9.446 -0.597 14.179 1.00 30.47 N ATOM 1049 CA PHE A 690 9.557 -1.823 14.955 1.00 30.30 C ATOM 1050 C PHE A 690 10.488 -2.847 14.317 1.00 29.00 C ATOM 1051 O PHE A 690 11.305 -3.460 15.003 1.00 29.17 O ATOM 1052 CB PHE A 690 8.180 -2.444 15.167 1.00 31.98 C ATOM 1053 CG PHE A 690 8.203 -3.639 16.066 1.00 32.10 C ATOM 1054 CD1 PHE A 690 8.084 -3.484 17.436 1.00 32.32 C ATOM 1055 CD2 PHE A 690 8.402 -4.912 15.543 1.00 31.76 C ATOM 1056 CE1 PHE A 690 8.119 -4.578 18.267 1.00 33.73 C ATOM 1057 CE2 PHE A 690 8.439 -6.015 16.371 1.00 33.02 C ATOM 1058 CZ PHE A 690 8.288 -5.850 17.736 1.00 34.25 C ATOM 1059 H PHE A 690 8.532 -0.351 13.747 1.00 0.00 H ATOM 1060 N ILE A 691 10.372 -3.043 13.010 1.00 29.23 N ATOM 1061 CA ILE A 691 11.289 -3.957 12.295 1.00 28.64 C ATOM 1062 C ILE A 691 12.714 -3.428 12.342 1.00 29.06 C ATOM 1063 O ILE A 691 13.659 -4.205 12.491 1.00 29.46 O ATOM 1064 CB ILE A 691 10.872 -4.182 10.833 1.00 27.94 C ATOM 1065 CG1 ILE A 691 9.499 -4.887 10.768 1.00 29.00 C ATOM 1066 CG2 ILE A 691 11.914 -5.000 10.074 1.00 28.16 C ATOM 1067 CD1 ILE A 691 9.422 -6.250 11.439 1.00 28.63 C ATOM 1068 H ILE A 691 9.626 -2.547 12.481 1.00 0.00 H ATOM 1069 N SER A 692 12.860 -2.110 12.224 1.00 28.76 N ATOM 1070 CA SER A 692 14.163 -1.484 12.338 1.00 28.41 C ATOM 1071 C SER A 692 14.763 -1.725 13.710 1.00 29.12 C ATOM 1072 O SER A 692 15.932 -2.087 13.794 1.00 32.79 O ATOM 1073 CB SER A 692 14.087 0.010 12.023 1.00 29.00 C ATOM 1074 OG SER A 692 13.698 0.186 10.667 1.00 30.52 O ATOM 1075 HG SER A 692 12.811 -0.229 10.523 1.00 0.00 H ATOM 1076 H SER A 692 12.024 -1.518 12.047 1.00 0.00 H ATOM 1077 N CYS A 693 13.971 -1.570 14.774 1.00 28.91 N ATOM 1078 CA CYS A 693 14.422 -1.879 16.139 1.00 28.51 C ATOM 1079 C CYS A 693 15.002 -3.295 16.269 1.00 27.93 C ATOM 1080 O CYS A 693 16.054 -3.483 16.884 1.00 26.41 O ATOM 1081 CB CYS A 693 13.296 -1.663 17.157 1.00 30.27 C ATOM 1082 SG CYS A 693 12.886 0.080 17.454 1.00 30.98 S ATOM 1083 H CYS A 693 13.002 -1.219 14.632 1.00 0.00 H ATOM 1084 N MET A 694 14.346 -4.273 15.662 1.00 27.16 N ATOM 1085 CA MET A 694 14.844 -5.647 15.689 1.00 29.44 C ATOM 1086 C MET A 694 16.172 -5.799 14.971 1.00 27.68 C ATOM 1087 O MET A 694 17.007 -6.602 15.376 1.00 27.03 O ATOM 1088 CB MET A 694 13.859 -6.613 15.022 1.00 31.85 C ATOM 1089 CG MET A 694 12.506 -6.774 15.696 1.00 33.48 C ATOM 1090 SD MET A 694 11.432 -7.802 14.661 1.00 34.95 S ATOM 1091 CE MET A 694 12.315 -9.361 14.673 1.00 34.57 C ATOM 1092 H MET A 694 13.462 -4.060 15.158 1.00 0.00 H ATOM 1093 N CYS A 695 16.334 -5.056 13.880 1.00 28.13 N ATOM 1094 CA CYS A 695 17.481 -5.198 12.966 1.00 28.33 C ATOM 1095 C CYS A 695 18.640 -4.202 13.189 1.00 25.80 C ATOM 1096 O CYS A 695 19.698 -4.365 12.594 1.00 27.39 O ATOM 1097 CB CYS A 695 16.989 -5.049 11.513 1.00 27.95 C ATOM 1098 SG CYS A 695 15.822 -6.327 10.956 1.00 31.37 S ATOM 1099 H CYS A 695 15.614 -4.338 13.661 1.00 0.00 H ATOM 1100 N HIS A 696 18.456 -3.189 14.019 1.00 24.31 N ATOM 1101 CA HIS A 696 19.314 -2.002 13.941 1.00 26.28 C ATOM 1102 C HIS A 696 20.764 -2.165 14.370 1.00 26.36 C ATOM 1103 O HIS A 696 21.549 -1.269 14.081 1.00 28.99 O ATOM 1104 CB HIS A 696 18.730 -0.833 14.740 1.00 27.79 C ATOM 1105 CG HIS A 696 18.957 -0.951 16.208 1.00 28.19 C ATOM 1106 ND1 HIS A 696 18.237 -1.819 16.996 1.00 30.19 N ATOM 1107 CD2 HIS A 696 19.837 -0.335 17.028 1.00 27.03 C ATOM 1108 CE1 HIS A 696 18.657 -1.731 18.240 1.00 28.93 C ATOM 1109 NE2 HIS A 696 19.630 -0.843 18.283 1.00 28.41 N ATOM 1110 H HIS A 696 17.699 -3.234 14.731 1.00 0.00 H ATOM 1111 N ASP A 697 21.103 -3.248 15.078 1.00 25.76 N ATOM 1112 CA ASP A 697 22.484 -3.554 15.452 1.00 24.65 C ATOM 1113 C ASP A 697 22.932 -4.928 14.921 1.00 26.16 C ATOM 1114 O ASP A 697 23.828 -5.545 15.490 1.00 27.39 O ATOM 1115 CB ASP A 697 22.646 -3.508 16.984 1.00 23.47 C ATOM 1116 CG ASP A 697 22.934 -2.121 17.524 1.00 22.52 C ATOM 1117 OD1 ASP A 697 23.570 -1.292 16.837 1.00 22.10 O ATOM 1118 OD2 ASP A 697 22.513 -1.847 18.672 1.00 22.40 O ATOM 1119 H ASP A 697 20.351 -3.902 15.376 1.00 0.00 H ATOM 1120 N LEU A 698 22.347 -5.407 13.825 1.00 26.44 N ATOM 1121 CA LEU A 698 22.689 -6.746 13.303 1.00 26.67 C ATOM 1122 C LEU A 698 24.176 -6.918 13.066 1.00 28.07 C ATOM 1123 O LEU A 698 24.809 -6.066 12.440 1.00 29.77 O ATOM 1124 CB LEU A 698 21.928 -7.057 12.002 1.00 28.09 C ATOM 1125 CG LEU A 698 20.481 -7.538 12.182 1.00 27.06 C ATOM 1126 CD1 LEU A 698 19.668 -7.348 10.904 1.00 29.08 C ATOM 1127 CD2 LEU A 698 20.452 -8.987 12.629 1.00 27.10 C ATOM 1128 H LEU A 698 21.638 -4.830 13.329 1.00 0.00 H ATOM 1129 N ASP A 699 24.717 -8.034 13.559 1.00 30.97 N ATOM 1130 CA ASP A 699 26.118 -8.423 13.371 1.00 32.76 C ATOM 1131 C ASP A 699 27.103 -7.438 14.015 1.00 33.33 C ATOM 1132 O ASP A 699 28.231 -7.295 13.543 1.00 34.06 O ATOM 1133 CB ASP A 699 26.422 -8.629 11.880 1.00 34.95 C ATOM 1134 CG ASP A 699 27.696 -9.441 11.630 1.00 38.62 C ATOM 1135 OD1 ASP A 699 27.924 -10.445 12.309 1.00 39.54 O ATOM 1136 OD2 ASP A 699 28.483 -9.058 10.733 1.00 41.03 O ATOM 1137 H ASP A 699 24.106 -8.668 14.112 1.00 0.00 H ATOM 1138 N HIS A 700 26.679 -6.786 15.108 1.00 32.14 N ATOM 1139 CA HIS A 700 27.548 -5.876 15.874 1.00 32.66 C ATOM 1140 C HIS A 700 28.670 -6.705 16.508 1.00 35.73 C ATOM 1141 O HIS A 700 28.416 -7.833 16.943 1.00 38.92 O ATOM 1142 CB HIS A 700 26.747 -5.149 16.971 1.00 31.00 C ATOM 1143 CG HIS A 700 27.293 -3.807 17.358 1.00 30.36 C ATOM 1144 ND1 HIS A 700 28.353 -3.651 18.219 1.00 32.30 N ATOM 1145 CD2 HIS A 700 26.931 -2.559 16.990 1.00 30.53 C ATOM 1146 CE1 HIS A 700 28.611 -2.366 18.377 1.00 31.80 C ATOM 1147 NE2 HIS A 700 27.759 -1.680 17.641 1.00 30.34 N ATOM 1148 H HIS A 700 25.699 -6.928 15.427 1.00 0.00 H ATOM 1149 N ARG A 701 29.891 -6.158 16.547 1.00 37.03 N ATOM 1150 CA ARG A 701 31.080 -6.878 17.075 1.00 39.89 C ATOM 1151 C ARG A 701 31.604 -6.326 18.401 1.00 38.66 C ATOM 1152 O ARG A 701 32.707 -6.662 18.820 1.00 48.42 O ATOM 1153 CB ARG A 701 32.219 -6.835 16.046 1.00 41.88 C ATOM 1154 CG ARG A 701 31.919 -7.565 14.741 1.00 41.82 C ATOM 1155 CD ARG A 701 31.353 -6.635 13.682 1.00 40.93 C ATOM 1156 NE ARG A 701 30.913 -7.402 12.510 1.00 43.57 N ATOM 1157 CZ ARG A 701 31.699 -7.813 11.513 1.00 41.07 C ATOM 1158 NH1 ARG A 701 32.990 -7.520 11.492 1.00 43.87 N ATOM 1159 NH2 ARG A 701 31.185 -8.504 10.515 1.00 39.36 N ATOM 1160 HE ARG A 701 29.904 -7.646 12.452 1.00 0.00 H ATOM 1161 HH12 ARG A 701 33.585 -7.850 10.706 1.00 0.00 H ATOM 1162 HH11 ARG A 701 33.409 -6.960 12.262 1.00 0.00 H ATOM 1163 HH22 ARG A 701 31.795 -8.826 9.737 1.00 0.00 H ATOM 1164 HH21 ARG A 701 30.169 -8.728 10.506 1.00 0.00 H ATOM 1165 H ARG A 701 30.013 -5.188 16.193 1.00 0.00 H ATOM 1166 N GLY A 702 30.783 -5.568 19.110 1.00 36.91 N ATOM 1167 CA GLY A 702 31.223 -4.765 20.268 1.00 36.62 C ATOM 1168 C GLY A 702 32.195 -3.609 20.049 1.00 35.07 C ATOM 1169 O GLY A 702 32.863 -3.164 20.989 1.00 33.94 O ATOM 1170 H GLY A 702 29.780 -5.536 18.838 1.00 0.00 H ATOM 1171 N THR A 703 32.301 -3.145 18.808 1.00 34.43 N ATOM 1172 CA THR A 703 33.229 -2.070 18.435 1.00 34.55 C ATOM 1173 C THR A 703 32.511 -0.968 17.647 1.00 33.38 C ATOM 1174 O THR A 703 31.507 -1.239 16.978 1.00 33.52 O ATOM 1175 CB THR A 703 34.426 -2.620 17.619 1.00 36.21 C ATOM 1176 OG1 THR A 703 33.962 -3.310 16.458 1.00 36.09 O ATOM 1177 CG2 THR A 703 35.263 -3.585 18.457 1.00 36.44 C ATOM 1178 HG1 THR A 703 34.738 -3.655 15.948 1.00 0.00 H ATOM 1179 H THR A 703 31.700 -3.562 18.069 1.00 0.00 H ATOM 1180 N ASN A 704 33.013 0.262 17.745 1.00 31.31 N ATOM 1181 CA ASN A 704 32.348 1.430 17.173 1.00 32.64 C ATOM 1182 C ASN A 704 32.848 1.760 15.754 1.00 34.15 C ATOM 1183 O ASN A 704 33.651 1.019 15.191 1.00 37.84 O ATOM 1184 CB ASN A 704 32.415 2.637 18.146 1.00 32.94 C ATOM 1185 CG ASN A 704 33.765 3.331 18.184 1.00 34.18 C ATOM 1186 OD1 ASN A 704 34.726 2.919 17.544 1.00 37.78 O ATOM 1187 ND2 ASN A 704 33.838 4.397 18.959 1.00 35.88 N ATOM 1188 HD22 ASN A 704 33.000 4.715 19.486 1.00 0.00 H ATOM 1189 HD21 ASN A 704 34.734 4.919 19.042 1.00 0.00 H ATOM 1190 H ASN A 704 33.913 0.396 18.248 1.00 0.00 H ATOM 1191 N ASN A 705 32.336 2.846 15.176 1.00 33.04 N ATOM 1192 CA ASN A 705 32.608 3.193 13.775 1.00 33.40 C ATOM 1193 C ASN A 705 34.062 3.494 13.492 1.00 35.25 C ATOM 1194 O ASN A 705 34.612 3.041 12.474 1.00 35.93 O ATOM 1195 CB ASN A 705 31.729 4.362 13.319 1.00 33.77 C ATOM 1196 CG ASN A 705 30.280 3.939 13.085 1.00 33.27 C ATOM 1197 OD1 ASN A 705 29.997 2.763 12.886 1.00 34.39 O ATOM 1198 ND2 ASN A 705 29.367 4.891 13.098 1.00 32.02 N ATOM 1199 HD22 ASN A 705 29.647 5.878 13.270 1.00 0.00 H ATOM 1200 HD21 ASN A 705 28.367 4.655 12.936 1.00 0.00 H ATOM 1201 H ASN A 705 31.722 3.470 15.737 1.00 0.00 H ATOM 1202 N SER A 706 34.681 4.280 14.365 1.00 34.97 N ATOM 1203 CA SER A 706 36.083 4.612 14.181 1.00 38.11 C ATOM 1204 C SER A 706 36.995 3.382 14.342 1.00 36.67 C ATOM 1205 O SER A 706 38.015 3.301 13.664 1.00 38.02 O ATOM 1206 CB SER A 706 36.524 5.772 15.088 1.00 39.40 C ATOM 1207 OG SER A 706 36.190 5.521 16.422 1.00 42.37 O ATOM 1208 HG SER A 706 36.484 6.281 16.983 1.00 0.00 H ATOM 1209 H SER A 706 34.161 4.659 15.182 1.00 0.00 H ATOM 1210 N PHE A 707 36.623 2.424 15.194 1.00 34.51 N ATOM 1211 CA PHE A 707 37.412 1.197 15.296 1.00 35.29 C ATOM 1212 C PHE A 707 37.494 0.419 13.984 1.00 34.68 C ATOM 1213 O PHE A 707 38.501 -0.219 13.736 1.00 36.09 O ATOM 1214 CB PHE A 707 36.906 0.243 16.374 1.00 34.05 C ATOM 1215 CG PHE A 707 37.784 -0.965 16.541 1.00 36.18 C ATOM 1216 CD1 PHE A 707 39.017 -0.860 17.203 1.00 38.17 C ATOM 1217 CD2 PHE A 707 37.427 -2.193 15.982 1.00 37.30 C ATOM 1218 CE1 PHE A 707 39.840 -1.960 17.343 1.00 38.90 C ATOM 1219 CE2 PHE A 707 38.260 -3.305 16.114 1.00 37.24 C ATOM 1220 CZ PHE A 707 39.458 -3.185 16.800 1.00 39.64 C ATOM 1221 H PHE A 707 35.775 2.550 15.783 1.00 0.00 H ATOM 1222 N GLN A 708 36.445 0.462 13.172 1.00 32.84 N ATOM 1223 CA GLN A 708 36.433 -0.238 11.880 1.00 33.59 C ATOM 1224 C GLN A 708 37.446 0.362 10.962 1.00 36.20 C ATOM 1225 O GLN A 708 38.156 -0.356 10.240 1.00 37.06 O ATOM 1226 CB GLN A 708 35.057 -0.152 11.187 1.00 32.66 C ATOM 1227 CG GLN A 708 33.889 -0.701 11.985 1.00 30.14 C ATOM 1228 CD GLN A 708 34.139 -2.096 12.527 1.00 29.49 C ATOM 1229 OE1 GLN A 708 34.525 -3.011 11.785 1.00 29.80 O ATOM 1230 NE2 GLN A 708 33.901 -2.273 13.820 1.00 28.33 N ATOM 1231 HE22 GLN A 708 33.578 -1.475 14.403 1.00 0.00 H ATOM 1232 HE21 GLN A 708 34.037 -3.210 14.250 1.00 0.00 H ATOM 1233 H GLN A 708 35.607 1.007 13.459 1.00 0.00 H ATOM 1234 N VAL A 709 37.514 1.691 10.995 1.00 38.02 N ATOM 1235 CA VAL A 709 38.474 2.431 10.183 1.00 42.18 C ATOM 1236 C VAL A 709 39.901 2.216 10.696 1.00 43.11 C ATOM 1237 O VAL A 709 40.813 1.941 9.911 1.00 47.08 O ATOM 1238 CB VAL A 709 38.121 3.935 10.110 1.00 43.53 C ATOM 1239 CG1 VAL A 709 39.130 4.687 9.238 1.00 47.44 C ATOM 1240 CG2 VAL A 709 36.702 4.128 9.580 1.00 42.20 C ATOM 1241 H VAL A 709 36.866 2.216 11.616 1.00 0.00 H ATOM 1242 N ALA A 710 40.099 2.329 12.002 1.00 42.85 N ATOM 1243 CA ALA A 710 41.429 2.099 12.587 1.00 44.73 C ATOM 1244 C ALA A 710 41.879 0.654 12.356 1.00 45.81 C ATOM 1245 O ALA A 710 43.010 0.428 11.935 1.00 48.85 O ATOM 1246 CB ALA A 710 41.443 2.447 14.070 1.00 43.55 C ATOM 1247 H ALA A 710 39.303 2.584 12.621 1.00 0.00 H ATOM 1248 N SER A 711 40.993 -0.316 12.592 1.00 44.57 N ATOM 1249 CA SER A 711 41.326 -1.737 12.384 1.00 46.09 C ATOM 1250 C SER A 711 41.396 -2.165 10.899 1.00 49.12 C ATOM 1251 O SER A 711 41.829 -3.277 10.620 1.00 52.18 O ATOM 1252 CB SER A 711 40.372 -2.653 13.169 1.00 43.72 C ATOM 1253 OG SER A 711 39.039 -2.602 12.683 1.00 41.67 O ATOM 1254 HG SER A 711 38.698 -1.675 12.755 1.00 0.00 H ATOM 1255 H SER A 711 40.043 -0.063 12.931 1.00 0.00 H ATOM 1256 N LYS A 712 40.989 -1.291 9.968 1.00 49.79 N ATOM 1257 CA LYS A 712 40.961 -1.569 8.523 1.00 52.19 C ATOM 1258 C LYS A 712 40.197 -2.850 8.214 1.00 51.65 C ATOM 1259 O LYS A 712 40.661 -3.712 7.464 1.00 55.56 O ATOM 1260 CB LYS A 712 42.364 -1.606 7.933 1.00 56.33 C ATOM 1261 CG LYS A 712 43.148 -0.342 8.198 1.00 60.97 C ATOM 1262 CD LYS A 712 44.583 -0.480 7.724 1.00 66.85 C ATOM 1263 CE LYS A 712 45.468 0.641 8.255 1.00 71.03 C ATOM 1264 NZ LYS A 712 45.324 1.895 7.464 1.00 74.40 N ATOM 1265 HZ1 LYS A 712 45.591 1.713 6.476 1.00 0.00 H ATOM 1266 HZ2 LYS A 712 44.336 2.217 7.503 1.00 0.00 H ATOM 1267 HZ3 LYS A 712 45.945 2.628 7.863 1.00 0.00 H ATOM 1268 H LYS A 712 40.672 -0.354 10.288 1.00 0.00 H ATOM 1269 N SER A 713 39.027 -2.967 8.834 1.00 48.32 N ATOM 1270 CA SER A 713 38.165 -4.124 8.673 1.00 46.47 C ATOM 1271 C SER A 713 37.466 -4.065 7.313 1.00 46.57 C ATOM 1272 O SER A 713 37.466 -3.033 6.640 1.00 47.00 O ATOM 1273 CB SER A 713 37.125 -4.174 9.802 1.00 43.73 C ATOM 1274 OG SER A 713 36.128 -3.174 9.633 1.00 42.06 O ATOM 1275 HG SER A 713 35.475 -3.232 10.374 1.00 0.00 H ATOM 1276 H SER A 713 38.716 -2.197 9.461 1.00 0.00 H ATOM 1277 N VAL A 714 36.866 -5.186 6.933 1.00 45.12 N ATOM 1278 CA VAL A 714 36.123 -5.293 5.690 1.00 45.59 C ATOM 1279 C VAL A 714 34.950 -4.307 5.664 1.00 42.49 C ATOM 1280 O VAL A 714 34.656 -3.738 4.619 1.00 44.46 O ATOM 1281 CB VAL A 714 35.656 -6.750 5.447 1.00 48.06 C ATOM 1282 CG1 VAL A 714 34.699 -6.854 4.253 1.00 49.46 C ATOM 1283 CG2 VAL A 714 36.876 -7.649 5.225 1.00 51.32 C ATOM 1284 H VAL A 714 36.930 -6.021 7.550 1.00 0.00 H ATOM 1285 N LEU A 715 34.322 -4.059 6.809 1.00 38.35 N ATOM 1286 CA LEU A 715 33.228 -3.100 6.866 1.00 37.07 C ATOM 1287 C LEU A 715 33.679 -1.671 6.517 1.00 37.85 C ATOM 1288 O LEU A 715 32.939 -0.932 5.874 1.00 39.61 O ATOM 1289 CB LEU A 715 32.545 -3.142 8.230 1.00 34.51 C ATOM 1290 CG LEU A 715 32.079 -4.529 8.698 1.00 34.10 C ATOM 1291 CD1 LEU A 715 31.319 -4.413 10.012 1.00 32.74 C ATOM 1292 CD2 LEU A 715 31.240 -5.232 7.642 1.00 35.16 C ATOM 1293 H LEU A 715 34.616 -4.556 7.674 1.00 0.00 H ATOM 1294 N ALA A 716 34.880 -1.289 6.937 1.00 37.46 N ATOM 1295 CA ALA A 716 35.443 0.032 6.622 1.00 38.25 C ATOM 1296 C ALA A 716 35.755 0.174 5.137 1.00 40.26 C ATOM 1297 O ALA A 716 35.470 1.198 4.526 1.00 39.27 O ATOM 1298 CB ALA A 716 36.698 0.283 7.445 1.00 38.93 C ATOM 1299 H ALA A 716 35.443 -1.949 7.510 1.00 0.00 H ATOM 1300 N ALA A 717 36.359 -0.862 4.570 1.00 42.15 N ATOM 1301 CA ALA A 717 36.613 -0.918 3.148 1.00 44.57 C ATOM 1302 C ALA A 717 35.329 -0.664 2.338 1.00 43.61 C ATOM 1303 O ALA A 717 35.329 0.145 1.429 1.00 45.67 O ATOM 1304 CB ALA A 717 37.225 -2.257 2.794 1.00 46.79 C ATOM 1305 H ALA A 717 36.659 -1.659 5.167 1.00 0.00 H ATOM 1306 N LEU A 718 34.234 -1.311 2.718 1.00 42.65 N ATOM 1307 CA LEU A 718 32.935 -1.158 2.036 1.00 42.38 C ATOM 1308 C LEU A 718 32.218 0.180 2.264 1.00 42.53 C ATOM 1309 O LEU A 718 31.617 0.717 1.331 1.00 43.90 O ATOM 1310 CB LEU A 718 31.980 -2.284 2.454 1.00 39.36 C ATOM 1311 CG LEU A 718 32.424 -3.702 2.109 1.00 40.75 C ATOM 1312 CD1 LEU A 718 31.453 -4.704 2.716 1.00 38.48 C ATOM 1313 CD2 LEU A 718 32.526 -3.888 0.605 1.00 43.60 C ATOM 1314 H LEU A 718 34.295 -1.954 3.533 1.00 0.00 H ATOM 1315 N TYR A 719 32.277 0.694 3.495 1.00 42.54 N ATOM 1316 CA TYR A 719 31.414 1.804 3.937 1.00 41.68 C ATOM 1317 C TYR A 719 32.104 3.084 4.449 1.00 43.75 C ATOM 1318 O TYR A 719 31.411 4.075 4.636 1.00 45.09 O ATOM 1319 CB TYR A 719 30.461 1.310 5.039 1.00 38.95 C ATOM 1320 CG TYR A 719 29.632 0.084 4.672 1.00 37.09 C ATOM 1321 CD1 TYR A 719 28.807 0.086 3.543 1.00 37.85 C ATOM 1322 CD2 TYR A 719 29.674 -1.073 5.450 1.00 35.20 C ATOM 1323 CE1 TYR A 719 28.060 -1.033 3.196 1.00 36.28 C ATOM 1324 CE2 TYR A 719 28.942 -2.198 5.108 1.00 34.88 C ATOM 1325 CZ TYR A 719 28.138 -2.169 3.980 1.00 35.82 C ATOM 1326 OH TYR A 719 27.414 -3.270 3.642 1.00 37.30 O ATOM 1327 HH TYR A 719 28.027 -4.031 3.484 1.00 0.00 H ATOM 1328 H TYR A 719 32.960 0.295 4.170 1.00 0.00 H ATOM 1329 N SER A 720 33.425 3.093 4.663 1.00 46.53 N ATOM 1330 CA SER A 720 34.109 4.240 5.324 1.00 49.83 C ATOM 1331 C SER A 720 34.039 5.587 4.601 1.00 52.68 C ATOM 1332 O SER A 720 33.996 6.626 5.257 1.00 54.70 O ATOM 1333 CB SER A 720 35.588 3.942 5.620 1.00 50.98 C ATOM 1334 OG SER A 720 36.319 3.746 4.423 1.00 53.81 O ATOM 1335 HG SER A 720 35.935 2.981 3.925 1.00 0.00 H ATOM 1336 H SER A 720 33.991 2.275 4.359 1.00 0.00 H ATOM 1337 N SER A 721 34.050 5.588 3.272 1.00 56.98 N ATOM 1338 CA SER A 721 33.879 6.840 2.517 1.00 62.88 C ATOM 1339 C SER A 721 32.455 7.439 2.611 1.00 62.82 C ATOM 1340 O SER A 721 32.250 8.594 2.244 1.00 65.03 O ATOM 1341 CB SER A 721 34.296 6.645 1.051 1.00 66.47 C ATOM 1342 OG SER A 721 33.683 5.491 0.495 1.00 67.42 O ATOM 1343 HG SER A 721 33.968 5.389 -0.448 1.00 0.00 H ATOM 1344 H SER A 721 34.181 4.693 2.759 1.00 0.00 H ATOM 1345 N GLU A 722 31.500 6.672 3.134 1.00 61.91 N ATOM 1346 CA GLU A 722 30.104 7.096 3.258 1.00 62.81 C ATOM 1347 C GLU A 722 29.667 7.488 4.704 1.00 57.84 C ATOM 1348 O GLU A 722 28.586 8.045 4.874 1.00 60.01 O ATOM 1349 CB GLU A 722 29.199 5.980 2.705 1.00 66.47 C ATOM 1350 CG GLU A 722 29.787 5.220 1.488 1.00 75.96 C ATOM 1351 CD GLU A 722 28.818 4.218 0.858 1.00 85.26 C ATOM 1352 OE1 GLU A 722 27.798 3.805 1.496 1.00 87.92 O ATOM 1353 OE2 GLU A 722 29.096 3.831 -0.299 1.00 88.70 O ATOM 1354 H GLU A 722 31.759 5.723 3.472 1.00 0.00 H ATOM 1355 N GLY A 723 30.488 7.223 5.728 1.00 52.58 N ATOM 1356 CA GLY A 723 30.129 7.513 7.146 1.00 48.44 C ATOM 1357 C GLY A 723 29.103 6.513 7.696 1.00 43.08 C ATOM 1358 O GLY A 723 28.547 5.753 6.927 1.00 41.88 O ATOM 1359 H GLY A 723 31.415 6.797 5.526 1.00 0.00 H ATOM 1360 N SER A 724 28.864 6.497 9.012 1.00 39.22 N ATOM 1361 CA SER A 724 27.980 5.519 9.658 1.00 36.42 C ATOM 1362 C SER A 724 28.239 4.071 9.215 1.00 34.34 C ATOM 1363 O SER A 724 27.318 3.370 8.777 1.00 31.53 O ATOM 1364 CB SER A 724 26.509 5.890 9.432 1.00 37.21 C ATOM 1365 OG SER A 724 26.251 7.219 9.846 1.00 41.62 O ATOM 1366 HG SER A 724 26.457 7.309 10.810 1.00 0.00 H ATOM 1367 H SER A 724 29.327 7.213 9.607 1.00 0.00 H ATOM 1368 N VAL A 725 29.488 3.638 9.363 1.00 31.85 N ATOM 1369 CA VAL A 725 29.948 2.350 8.860 1.00 32.45 C ATOM 1370 C VAL A 725 29.133 1.181 9.415 1.00 32.85 C ATOM 1371 O VAL A 725 28.627 0.358 8.641 1.00 31.38 O ATOM 1372 CB VAL A 725 31.451 2.126 9.149 1.00 33.65 C ATOM 1373 CG1 VAL A 725 31.868 0.673 8.908 1.00 34.31 C ATOM 1374 CG2 VAL A 725 32.291 3.063 8.287 1.00 36.30 C ATOM 1375 H VAL A 725 30.168 4.247 9.861 1.00 0.00 H ATOM 1376 N MET A 726 29.013 1.101 10.741 1.00 32.32 N ATOM 1377 CA MET A 726 28.281 -0.003 11.354 1.00 31.50 C ATOM 1378 C MET A 726 26.789 0.028 11.002 1.00 32.37 C ATOM 1379 O MET A 726 26.199 -1.015 10.753 1.00 30.06 O ATOM 1380 CB MET A 726 28.461 -0.042 12.867 1.00 30.52 C ATOM 1381 CG MET A 726 29.833 -0.498 13.335 1.00 34.27 C ATOM 1382 SD MET A 726 30.446 -2.007 12.546 1.00 36.72 S ATOM 1383 CE MET A 726 29.178 -3.185 12.986 1.00 38.15 C ATOM 1384 H MET A 726 29.444 1.831 11.343 1.00 0.00 H ATOM 1385 N GLU A 727 26.198 1.220 10.959 1.00 31.14 N ATOM 1386 CA GLU A 727 24.773 1.347 10.723 1.00 30.35 C ATOM 1387 C GLU A 727 24.406 0.926 9.294 1.00 31.48 C ATOM 1388 O GLU A 727 23.373 0.292 9.078 1.00 32.47 O ATOM 1389 CB GLU A 727 24.289 2.757 11.065 1.00 29.69 C ATOM 1390 CG GLU A 727 24.286 3.052 12.564 1.00 28.99 C ATOM 1391 CD GLU A 727 25.652 3.369 13.174 1.00 30.05 C ATOM 1392 OE1 GLU A 727 26.599 3.748 12.438 1.00 29.23 O ATOM 1393 OE2 GLU A 727 25.777 3.258 14.418 1.00 30.53 O ATOM 1394 H GLU A 727 26.770 2.078 11.097 1.00 0.00 H ATOM 1395 N ARG A 728 25.272 1.242 8.339 1.00 33.20 N ATOM 1396 CA ARG A 728 25.126 0.746 6.962 1.00 34.91 C ATOM 1397 C ARG A 728 25.247 -0.779 6.861 1.00 33.30 C ATOM 1398 O ARG A 728 24.546 -1.412 6.076 1.00 33.74 O ATOM 1399 CB ARG A 728 26.134 1.424 6.037 1.00 38.30 C ATOM 1400 CG ARG A 728 25.790 2.886 5.823 1.00 42.87 C ATOM 1401 CD ARG A 728 26.678 3.656 4.855 1.00 50.91 C ATOM 1402 NE ARG A 728 25.861 4.666 4.169 1.00 57.13 N ATOM 1403 CZ ARG A 728 25.656 5.920 4.572 1.00 60.56 C ATOM 1404 NH1 ARG A 728 26.235 6.411 5.672 1.00 61.08 N ATOM 1405 NH2 ARG A 728 24.866 6.705 3.848 1.00 65.08 N ATOM 1406 HE ARG A 728 25.398 4.375 3.284 1.00 0.00 H ATOM 1407 HH12 ARG A 728 26.055 7.394 5.960 1.00 0.00 H ATOM 1408 HH11 ARG A 728 26.866 5.810 6.240 1.00 0.00 H ATOM 1409 HH22 ARG A 728 24.694 7.686 4.146 1.00 0.00 H ATOM 1410 HH21 ARG A 728 24.420 6.338 2.983 1.00 0.00 H ATOM 1411 H ARG A 728 26.077 1.858 8.571 1.00 0.00 H ATOM 1412 N HIS A 729 26.151 -1.356 7.634 1.00 30.65 N ATOM 1413 CA HIS A 729 26.280 -2.797 7.706 1.00 30.07 C ATOM 1414 C HIS A 729 25.027 -3.417 8.301 1.00 28.58 C ATOM 1415 O HIS A 729 24.534 -4.415 7.795 1.00 28.26 O ATOM 1416 CB HIS A 729 27.514 -3.177 8.532 1.00 31.80 C ATOM 1417 CG HIS A 729 27.715 -4.655 8.679 1.00 32.73 C ATOM 1418 ND1 HIS A 729 27.903 -5.492 7.598 1.00 33.73 N ATOM 1419 CD2 HIS A 729 27.781 -5.439 9.781 1.00 32.12 C ATOM 1420 CE1 HIS A 729 28.078 -6.727 8.027 1.00 33.90 C ATOM 1421 NE2 HIS A 729 28.000 -6.722 9.348 1.00 33.29 N ATOM 1422 H HIS A 729 26.785 -0.761 8.204 1.00 0.00 H ATOM 1423 N HIS A 730 24.502 -2.826 9.365 1.00 28.12 N ATOM 1424 CA HIS A 730 23.307 -3.364 10.016 1.00 28.08 C ATOM 1425 C HIS A 730 22.152 -3.450 9.002 1.00 29.55 C ATOM 1426 O HIS A 730 21.477 -4.472 8.905 1.00 28.61 O ATOM 1427 CB HIS A 730 22.885 -2.490 11.211 1.00 28.18 C ATOM 1428 CG HIS A 730 23.923 -2.379 12.293 1.00 27.45 C ATOM 1429 ND1 HIS A 730 24.721 -3.434 12.670 1.00 26.83 N ATOM 1430 CD2 HIS A 730 24.293 -1.331 13.066 1.00 26.51 C ATOM 1431 CE1 HIS A 730 25.537 -3.043 13.635 1.00 28.60 C ATOM 1432 NE2 HIS A 730 25.297 -1.770 13.892 1.00 28.03 N ATOM 1433 H HIS A 730 24.947 -1.966 9.743 1.00 0.00 H ATOM 1434 N PHE A 731 21.950 -2.359 8.260 1.00 28.08 N ATOM 1435 CA PHE A 731 20.949 -2.297 7.215 1.00 27.56 C ATOM 1436 C PHE A 731 21.202 -3.340 6.125 1.00 28.15 C ATOM 1437 O PHE A 731 20.277 -4.038 5.723 1.00 29.46 O ATOM 1438 CB PHE A 731 20.879 -0.892 6.603 1.00 28.70 C ATOM 1439 CG PHE A 731 19.921 -0.792 5.452 1.00 30.88 C ATOM 1440 CD1 PHE A 731 18.542 -0.868 5.671 1.00 31.26 C ATOM 1441 CD2 PHE A 731 20.387 -0.676 4.140 1.00 32.20 C ATOM 1442 CE1 PHE A 731 17.659 -0.806 4.602 1.00 32.36 C ATOM 1443 CE2 PHE A 731 19.503 -0.606 3.072 1.00 32.98 C ATOM 1444 CZ PHE A 731 18.141 -0.671 3.305 1.00 32.77 C ATOM 1445 H PHE A 731 22.536 -1.519 8.440 1.00 0.00 H ATOM 1446 N ALA A 732 22.435 -3.448 5.648 1.00 27.72 N ATOM 1447 CA ALA A 732 22.792 -4.468 4.636 1.00 30.17 C ATOM 1448 C ALA A 732 22.533 -5.897 5.113 1.00 30.07 C ATOM 1449 O ALA A 732 22.131 -6.741 4.324 1.00 31.10 O ATOM 1450 CB ALA A 732 24.251 -4.335 4.206 1.00 30.34 C ATOM 1451 H ALA A 732 23.170 -2.799 5.994 1.00 0.00 H ATOM 1452 N GLN A 733 22.752 -6.153 6.401 1.00 30.63 N ATOM 1453 CA GLN A 733 22.442 -7.455 6.991 1.00 31.21 C ATOM 1454 C GLN A 733 20.932 -7.703 6.999 1.00 31.28 C ATOM 1455 O GLN A 733 20.487 -8.812 6.690 1.00 33.96 O ATOM 1456 CB GLN A 733 23.018 -7.583 8.402 1.00 30.19 C ATOM 1457 CG GLN A 733 24.541 -7.559 8.461 1.00 31.76 C ATOM 1458 CD GLN A 733 25.188 -8.804 7.894 1.00 33.51 C ATOM 1459 OE1 GLN A 733 25.597 -8.823 6.734 1.00 36.26 O ATOM 1460 NE2 GLN A 733 25.266 -9.850 8.697 1.00 33.59 N ATOM 1461 HE22 GLN A 733 24.906 -9.786 9.671 1.00 0.00 H ATOM 1462 HE21 GLN A 733 25.687 -10.737 8.355 1.00 0.00 H ATOM 1463 H GLN A 733 23.154 -5.407 7.004 1.00 0.00 H ATOM 1464 N ALA A 734 20.149 -6.676 7.321 1.00 29.61 N ATOM 1465 CA ALA A 734 18.693 -6.785 7.294 1.00 28.68 C ATOM 1466 C ALA A 734 18.192 -7.114 5.891 1.00 29.68 C ATOM 1467 O ALA A 734 17.345 -7.986 5.722 1.00 29.85 O ATOM 1468 CB ALA A 734 18.043 -5.502 7.811 1.00 28.50 C ATOM 1469 H ALA A 734 20.585 -5.774 7.599 1.00 0.00 H ATOM 1470 N ILE A 735 18.737 -6.417 4.894 1.00 31.07 N ATOM 1471 CA ILE A 735 18.435 -6.674 3.480 1.00 32.65 C ATOM 1472 C ILE A 735 18.786 -8.109 3.090 1.00 33.78 C ATOM 1473 O ILE A 735 18.005 -8.765 2.416 1.00 36.05 O ATOM 1474 CB ILE A 735 19.167 -5.670 2.551 1.00 34.23 C ATOM 1475 CG1 ILE A 735 18.630 -4.245 2.747 1.00 35.04 C ATOM 1476 CG2 ILE A 735 19.031 -6.047 1.080 1.00 38.31 C ATOM 1477 CD1 ILE A 735 17.153 -4.060 2.516 1.00 35.15 C ATOM 1478 H ILE A 735 19.407 -5.657 5.128 1.00 0.00 H ATOM 1479 N ALA A 736 19.949 -8.593 3.507 1.00 34.39 N ATOM 1480 CA ALA A 736 20.364 -9.969 3.189 1.00 36.97 C ATOM 1481 C ALA A 736 19.413 -11.014 3.812 1.00 37.68 C ATOM 1482 O ALA A 736 19.152 -12.058 3.195 1.00 39.72 O ATOM 1483 CB ALA A 736 21.806 -10.220 3.615 1.00 35.89 C ATOM 1484 H ALA A 736 20.580 -7.988 4.070 1.00 0.00 H ATOM 1485 N ILE A 737 18.905 -10.730 5.016 1.00 35.04 N ATOM 1486 CA ILE A 737 17.916 -11.608 5.654 1.00 35.39 C ATOM 1487 C ILE A 737 16.614 -11.635 4.859 1.00 35.30 C ATOM 1488 O ILE A 737 16.079 -12.711 4.614 1.00 36.90 O ATOM 1489 CB ILE A 737 17.637 -11.212 7.127 1.00 35.47 C ATOM 1490 CG1 ILE A 737 18.868 -11.527 7.993 1.00 36.66 C ATOM 1491 CG2 ILE A 737 16.418 -11.957 7.669 1.00 35.08 C ATOM 1492 CD1 ILE A 737 18.856 -10.884 9.362 1.00 37.40 C ATOM 1493 H ILE A 737 19.217 -9.870 5.510 1.00 0.00 H ATOM 1494 N LEU A 738 16.116 -10.467 4.457 1.00 33.50 N ATOM 1495 CA LEU A 738 14.899 -10.394 3.647 1.00 35.52 C ATOM 1496 C LEU A 738 15.005 -11.160 2.337 1.00 38.06 C ATOM 1497 O LEU A 738 14.033 -11.731 1.900 1.00 39.97 O ATOM 1498 CB LEU A 738 14.488 -8.942 3.366 1.00 34.74 C ATOM 1499 CG LEU A 738 13.990 -8.171 4.589 1.00 34.07 C ATOM 1500 CD1 LEU A 738 13.955 -6.673 4.304 1.00 34.67 C ATOM 1501 CD2 LEU A 738 12.626 -8.648 5.050 1.00 33.91 C ATOM 1502 H LEU A 738 16.602 -9.588 4.724 1.00 0.00 H ATOM 1503 N ASN A 739 16.183 -11.175 1.725 1.00 41.41 N ATOM 1504 CA ASN A 739 16.395 -11.875 0.458 1.00 44.80 C ATOM 1505 C ASN A 739 16.900 -13.308 0.628 1.00 44.56 C ATOM 1506 O ASN A 739 17.299 -13.942 -0.346 1.00 44.29 O ATOM 1507 CB ASN A 739 17.312 -11.039 -0.442 1.00 48.73 C ATOM 1508 CG ASN A 739 16.617 -9.777 -0.929 1.00 51.26 C ATOM 1509 OD1 ASN A 739 15.815 -9.826 -1.859 1.00 55.68 O ATOM 1510 ND2 ASN A 739 16.904 -8.642 -0.294 1.00 52.07 N ATOM 1511 HD22 ASN A 739 17.589 -8.643 0.489 1.00 0.00 H ATOM 1512 HD21 ASN A 739 16.443 -7.755 -0.581 1.00 0.00 H ATOM 1513 H ASN A 739 16.982 -10.672 2.161 1.00 0.00 H ATOM 1514 N THR A 740 16.876 -13.809 1.864 1.00 41.89 N ATOM 1515 CA THR A 740 17.027 -15.231 2.125 1.00 43.00 C ATOM 1516 C THR A 740 15.672 -15.913 1.875 1.00 44.68 C ATOM 1517 O THR A 740 14.616 -15.351 2.211 1.00 43.17 O ATOM 1518 CB THR A 740 17.460 -15.495 3.574 1.00 41.14 C ATOM 1519 OG1 THR A 740 18.534 -14.617 3.916 1.00 40.23 O ATOM 1520 CG2 THR A 740 17.896 -16.940 3.753 1.00 42.37 C ATOM 1521 HG1 THR A 740 18.233 -13.678 3.826 1.00 0.00 H ATOM 1522 H THR A 740 16.745 -13.161 2.667 1.00 0.00 H ATOM 1523 N HIS A 741 15.717 -17.111 1.284 1.00 46.53 N ATOM 1524 CA HIS A 741 14.519 -17.889 0.962 1.00 47.51 C ATOM 1525 C HIS A 741 13.656 -18.137 2.196 1.00 45.16 C ATOM 1526 O HIS A 741 14.133 -18.636 3.206 1.00 45.25 O ATOM 1527 CB HIS A 741 14.899 -19.232 0.340 1.00 51.86 C ATOM 1528 CG HIS A 741 13.732 -20.151 0.119 1.00 56.80 C ATOM 1529 ND1 HIS A 741 12.782 -19.929 -0.858 1.00 56.83 N ATOM 1530 CD2 HIS A 741 13.384 -21.314 0.725 1.00 59.30 C ATOM 1531 CE1 HIS A 741 11.897 -20.913 -0.841 1.00 59.63 C ATOM 1532 NE2 HIS A 741 12.245 -21.772 0.103 1.00 61.64 N ATOM 1533 H HIS A 741 16.647 -17.509 1.041 1.00 0.00 H ATOM 1534 N GLY A 742 12.386 -17.764 2.097 1.00 44.57 N ATOM 1535 CA GLY A 742 11.420 -17.983 3.157 1.00 43.40 C ATOM 1536 C GLY A 742 11.405 -16.926 4.243 1.00 40.71 C ATOM 1537 O GLY A 742 10.681 -17.082 5.217 1.00 39.41 O ATOM 1538 H GLY A 742 12.070 -17.296 1.224 1.00 0.00 H ATOM 1539 N CYS A 743 12.178 -15.851 4.089 1.00 39.21 N ATOM 1540 CA CYS A 743 12.275 -14.824 5.132 1.00 38.13 C ATOM 1541 C CYS A 743 11.764 -13.456 4.722 1.00 36.77 C ATOM 1542 O CYS A 743 11.802 -12.522 5.545 1.00 34.66 O ATOM 1543 CB CYS A 743 13.717 -14.715 5.619 1.00 39.18 C ATOM 1544 SG CYS A 743 14.284 -16.189 6.478 1.00 40.64 S ATOM 1545 H CYS A 743 12.724 -15.738 3.211 1.00 0.00 H ATOM 1546 N ASN A 744 11.248 -13.317 3.491 1.00 36.87 N ATOM 1547 CA ASN A 744 10.827 -12.002 3.023 1.00 36.30 C ATOM 1548 C ASN A 744 9.419 -11.682 3.465 1.00 34.87 C ATOM 1549 O ASN A 744 8.454 -11.965 2.763 1.00 33.29 O ATOM 1550 CB ASN A 744 10.946 -11.838 1.508 1.00 40.07 C ATOM 1551 CG ASN A 744 10.947 -10.365 1.092 1.00 42.19 C ATOM 1552 OD1 ASN A 744 10.507 -9.489 1.846 1.00 42.19 O ATOM 1553 ND2 ASN A 744 11.509 -10.082 -0.067 1.00 45.21 N ATOM 1554 HD22 ASN A 744 11.867 -10.848 -0.672 1.00 0.00 H ATOM 1555 HD21 ASN A 744 11.595 -9.093 -0.376 1.00 0.00 H ATOM 1556 H ASN A 744 11.149 -14.146 2.872 1.00 0.00 H ATOM 1557 N ILE A 745 9.321 -11.057 4.629 1.00 33.21 N ATOM 1558 CA ILE A 745 8.027 -10.665 5.173 1.00 33.80 C ATOM 1559 C ILE A 745 7.286 -9.621 4.332 1.00 34.24 C ATOM 1560 O ILE A 745 6.103 -9.434 4.529 1.00 35.99 O ATOM 1561 CB ILE A 745 8.127 -10.208 6.651 1.00 32.17 C ATOM 1562 CG1 ILE A 745 9.143 -9.078 6.843 1.00 30.86 C ATOM 1563 CG2 ILE A 745 8.476 -11.405 7.534 1.00 33.42 C ATOM 1564 CD1 ILE A 745 9.035 -8.379 8.175 1.00 29.47 C ATOM 1565 H ILE A 745 10.185 -10.842 5.166 1.00 0.00 H ATOM 1566 N PHE A 746 7.980 -8.947 3.418 1.00 36.40 N ATOM 1567 CA PHE A 746 7.366 -7.968 2.539 1.00 39.20 C ATOM 1568 C PHE A 746 7.157 -8.459 1.106 1.00 41.18 C ATOM 1569 O PHE A 746 6.840 -7.647 0.253 1.00 40.33 O ATOM 1570 CB PHE A 746 8.207 -6.680 2.476 1.00 40.05 C ATOM 1571 CG PHE A 746 8.671 -6.174 3.804 1.00 39.16 C ATOM 1572 CD1 PHE A 746 7.777 -6.001 4.848 1.00 39.82 C ATOM 1573 CD2 PHE A 746 10.007 -5.827 3.996 1.00 37.98 C ATOM 1574 CE1 PHE A 746 8.212 -5.518 6.077 1.00 39.26 C ATOM 1575 CE2 PHE A 746 10.445 -5.352 5.219 1.00 36.99 C ATOM 1576 CZ PHE A 746 9.548 -5.200 6.261 1.00 38.04 C ATOM 1577 H PHE A 746 9.000 -9.128 3.330 1.00 0.00 H ATOM 1578 N ASP A 747 7.314 -9.755 0.820 1.00 45.48 N ATOM 1579 CA ASP A 747 7.257 -10.236 -0.576 1.00 47.89 C ATOM 1580 C ASP A 747 5.862 -10.169 -1.206 1.00 49.57 C ATOM 1581 O ASP A 747 5.745 -10.355 -2.407 1.00 52.37 O ATOM 1582 CB ASP A 747 7.901 -11.635 -0.772 1.00 50.80 C ATOM 1583 CG ASP A 747 7.190 -12.761 -0.008 1.00 52.01 C ATOM 1584 OD1 ASP A 747 6.172 -12.513 0.684 1.00 53.65 O ATOM 1585 OD2 ASP A 747 7.689 -13.905 -0.087 1.00 50.40 O ATOM 1586 H ASP A 747 7.478 -10.434 1.590 1.00 0.00 H ATOM 1587 N HIS A 748 4.842 -9.885 -0.393 1.00 50.31 N ATOM 1588 CA HIS A 748 3.469 -9.636 -0.833 1.00 52.60 C ATOM 1589 C HIS A 748 3.083 -8.119 -0.819 1.00 47.44 C ATOM 1590 O HIS A 748 1.975 -7.761 -1.235 1.00 48.28 O ATOM 1591 CB HIS A 748 2.476 -10.480 -0.017 1.00 58.73 C ATOM 1592 CG HIS A 748 2.535 -11.947 -0.337 1.00 70.33 C ATOM 1593 ND1 HIS A 748 1.962 -12.485 -1.472 1.00 77.26 N ATOM 1594 CD2 HIS A 748 3.115 -12.985 0.316 1.00 76.54 C ATOM 1595 CE1 HIS A 748 2.182 -13.787 -1.504 1.00 80.85 C ATOM 1596 NE2 HIS A 748 2.880 -14.116 -0.431 1.00 82.22 N ATOM 1597 H HIS A 748 5.038 -9.837 0.627 1.00 0.00 H ATOM 1598 N PHE A 749 3.998 -7.239 -0.402 1.00 40.51 N ATOM 1599 CA PHE A 749 3.791 -5.792 -0.467 1.00 39.34 C ATOM 1600 C PHE A 749 3.708 -5.272 -1.896 1.00 40.08 C ATOM 1601 O PHE A 749 4.329 -5.814 -2.813 1.00 40.67 O ATOM 1602 CB PHE A 749 4.923 -5.018 0.242 1.00 38.07 C ATOM 1603 CG PHE A 749 4.733 -4.853 1.720 1.00 37.81 C ATOM 1604 CD1 PHE A 749 4.052 -5.796 2.473 1.00 39.03 C ATOM 1605 CD2 PHE A 749 5.253 -3.737 2.367 1.00 37.02 C ATOM 1606 CE1 PHE A 749 3.886 -5.618 3.826 1.00 38.56 C ATOM 1607 CE2 PHE A 749 5.073 -3.552 3.728 1.00 36.72 C ATOM 1608 CZ PHE A 749 4.403 -4.502 4.464 1.00 36.64 C ATOM 1609 H PHE A 749 4.894 -7.597 -0.015 1.00 0.00 H ATOM 1610 N SER A 750 2.950 -4.194 -2.078 1.00 39.80 N ATOM 1611 CA SER A 750 2.974 -3.480 -3.341 1.00 40.70 C ATOM 1612 C SER A 750 4.388 -2.967 -3.613 1.00 40.15 C ATOM 1613 O SER A 750 5.203 -2.827 -2.703 1.00 39.79 O ATOM 1614 CB SER A 750 1.970 -2.319 -3.350 1.00 40.90 C ATOM 1615 OG SER A 750 2.430 -1.227 -2.587 1.00 39.13 O ATOM 1616 HG SER A 750 1.759 -0.500 -2.616 1.00 0.00 H ATOM 1617 H SER A 750 2.335 -3.860 -1.309 1.00 0.00 H ATOM 1618 N ARG A 751 4.656 -2.669 -4.873 1.00 42.67 N ATOM 1619 CA ARG A 751 5.932 -2.097 -5.289 1.00 44.72 C ATOM 1620 C ARG A 751 6.162 -0.765 -4.549 1.00 42.42 C ATOM 1621 O ARG A 751 7.267 -0.504 -4.088 1.00 40.44 O ATOM 1622 CB ARG A 751 5.954 -1.914 -6.818 1.00 49.90 C ATOM 1623 CG ARG A 751 7.261 -2.238 -7.514 1.00 53.94 C ATOM 1624 CD ARG A 751 7.148 -1.959 -9.028 1.00 59.42 C ATOM 1625 NE ARG A 751 6.436 -0.727 -9.389 1.00 63.17 N ATOM 1626 CZ ARG A 751 6.120 -0.383 -10.640 1.00 70.40 C ATOM 1627 NH1 ARG A 751 6.468 -1.155 -11.669 1.00 77.26 N ATOM 1628 NH2 ARG A 751 5.451 0.746 -10.871 1.00 68.94 N ATOM 1629 HE ARG A 751 6.160 -0.081 -8.622 1.00 0.00 H ATOM 1630 HH12 ARG A 751 6.215 -0.875 -12.638 1.00 0.00 H ATOM 1631 HH11 ARG A 751 6.992 -2.038 -11.503 1.00 0.00 H ATOM 1632 HH22 ARG A 751 5.205 1.014 -11.845 1.00 0.00 H ATOM 1633 HH21 ARG A 751 5.175 1.359 -10.077 1.00 0.00 H ATOM 1634 H ARG A 751 3.930 -2.849 -5.595 1.00 0.00 H ATOM 1635 N LYS A 752 5.120 0.064 -4.448 1.00 42.85 N ATOM 1636 CA LYS A 752 5.177 1.325 -3.694 1.00 43.44 C ATOM 1637 C LYS A 752 5.539 1.082 -2.226 1.00 42.31 C ATOM 1638 O LYS A 752 6.456 1.718 -1.695 1.00 38.32 O ATOM 1639 CB LYS A 752 3.840 2.088 -3.756 1.00 46.38 C ATOM 1640 CG LYS A 752 4.000 3.565 -4.019 1.00 50.14 C ATOM 1641 CD LYS A 752 2.679 4.297 -4.124 1.00 54.47 C ATOM 1642 CE LYS A 752 2.311 5.088 -2.868 1.00 54.33 C ATOM 1643 NZ LYS A 752 1.469 4.355 -1.889 1.00 55.17 N ATOM 1644 HZ1 LYS A 752 0.574 4.079 -2.341 1.00 0.00 H ATOM 1645 HZ2 LYS A 752 1.973 3.504 -1.569 1.00 0.00 H ATOM 1646 HZ3 LYS A 752 1.272 4.970 -1.074 1.00 0.00 H ATOM 1647 H LYS A 752 4.231 -0.193 -4.923 1.00 0.00 H ATOM 1648 N ASP A 753 4.823 0.158 -1.586 1.00 42.71 N ATOM 1649 CA ASP A 753 5.006 -0.088 -0.147 1.00 43.95 C ATOM 1650 C ASP A 753 6.318 -0.808 0.181 1.00 42.96 C ATOM 1651 O ASP A 753 6.924 -0.537 1.224 1.00 40.27 O ATOM 1652 CB ASP A 753 3.812 -0.859 0.451 1.00 45.97 C ATOM 1653 CG ASP A 753 2.547 0.007 0.628 1.00 49.23 C ATOM 1654 OD1 ASP A 753 2.583 1.244 0.389 1.00 52.03 O ATOM 1655 OD2 ASP A 753 1.492 -0.567 0.990 1.00 53.68 O ATOM 1656 H ASP A 753 4.122 -0.400 -2.114 1.00 0.00 H ATOM 1657 N TYR A 754 6.759 -1.714 -0.698 1.00 44.08 N ATOM 1658 CA TYR A 754 8.048 -2.399 -0.524 1.00 43.73 C ATOM 1659 C TYR A 754 9.171 -1.378 -0.485 1.00 41.08 C ATOM 1660 O TYR A 754 10.030 -1.428 0.387 1.00 41.22 O ATOM 1661 CB TYR A 754 8.297 -3.409 -1.653 1.00 47.78 C ATOM 1662 CG TYR A 754 9.515 -4.285 -1.442 1.00 51.39 C ATOM 1663 CD1 TYR A 754 9.497 -5.283 -0.474 1.00 55.98 C ATOM 1664 CD2 TYR A 754 10.683 -4.128 -2.202 1.00 54.50 C ATOM 1665 CE1 TYR A 754 10.596 -6.105 -0.259 1.00 59.47 C ATOM 1666 CE2 TYR A 754 11.799 -4.949 -1.985 1.00 56.30 C ATOM 1667 CZ TYR A 754 11.738 -5.942 -1.015 1.00 59.37 C ATOM 1668 OH TYR A 754 12.785 -6.798 -0.739 1.00 71.11 O ATOM 1669 HH TYR A 754 12.520 -7.420 -0.016 1.00 0.00 H ATOM 1670 H TYR A 754 6.174 -1.940 -1.528 1.00 0.00 H ATOM 1671 N GLN A 755 9.150 -0.469 -1.452 1.00 42.43 N ATOM 1672 CA GLN A 755 10.147 0.597 -1.574 1.00 44.97 C ATOM 1673 C GLN A 755 10.153 1.522 -0.368 1.00 41.92 C ATOM 1674 O GLN A 755 11.210 1.832 0.171 1.00 40.29 O ATOM 1675 CB GLN A 755 9.890 1.419 -2.853 1.00 49.21 C ATOM 1676 CG GLN A 755 10.924 2.511 -3.155 1.00 52.77 C ATOM 1677 CD GLN A 755 12.323 1.949 -3.312 1.00 53.50 C ATOM 1678 OE1 GLN A 755 12.571 1.108 -4.176 1.00 56.91 O ATOM 1679 NE2 GLN A 755 13.234 2.371 -2.446 1.00 54.75 N ATOM 1680 HE22 GLN A 755 12.982 3.083 -1.732 1.00 0.00 H ATOM 1681 HE21 GLN A 755 14.201 1.990 -2.481 1.00 0.00 H ATOM 1682 H GLN A 755 8.388 -0.516 -2.158 1.00 0.00 H ATOM 1683 N ARG A 756 8.969 1.969 0.027 1.00 41.14 N ATOM 1684 CA ARG A 756 8.806 2.824 1.191 1.00 41.85 C ATOM 1685 C ARG A 756 9.391 2.153 2.453 1.00 41.00 C ATOM 1686 O ARG A 756 10.107 2.781 3.223 1.00 36.13 O ATOM 1687 CB ARG A 756 7.323 3.134 1.374 1.00 42.58 C ATOM 1688 CG ARG A 756 6.972 4.028 2.548 1.00 45.01 C ATOM 1689 CD ARG A 756 6.820 5.490 2.167 1.00 48.34 C ATOM 1690 NE ARG A 756 6.075 6.207 3.203 1.00 51.35 N ATOM 1691 CZ ARG A 756 6.590 7.010 4.137 1.00 53.31 C ATOM 1692 NH1 ARG A 756 7.890 7.299 4.198 1.00 51.90 N ATOM 1693 NH2 ARG A 756 5.767 7.565 5.026 1.00 58.07 N ATOM 1694 HE ARG A 756 5.043 6.078 3.212 1.00 0.00 H ATOM 1695 HH12 ARG A 756 8.248 7.930 4.943 1.00 0.00 H ATOM 1696 HH11 ARG A 756 8.546 6.894 3.500 1.00 0.00 H ATOM 1697 HH22 ARG A 756 6.145 8.194 5.763 1.00 0.00 H ATOM 1698 HH21 ARG A 756 4.747 7.369 4.983 1.00 0.00 H ATOM 1699 H ARG A 756 8.125 1.698 -0.517 1.00 0.00 H ATOM 1700 N MET A 757 9.086 0.872 2.624 1.00 41.83 N ATOM 1701 CA MET A 757 9.548 0.090 3.763 1.00 40.04 C ATOM 1702 C MET A 757 11.067 0.042 3.819 1.00 39.18 C ATOM 1703 O MET A 757 11.660 0.266 4.881 1.00 37.73 O ATOM 1704 CB MET A 757 8.971 -1.324 3.660 1.00 41.83 C ATOM 1705 CG MET A 757 9.244 -2.243 4.825 1.00 42.89 C ATOM 1706 SD MET A 757 8.783 -1.616 6.454 1.00 45.38 S ATOM 1707 CE MET A 757 7.080 -1.255 6.205 1.00 42.97 C ATOM 1708 H MET A 757 8.489 0.405 1.911 1.00 0.00 H ATOM 1709 N LEU A 758 11.691 -0.247 2.681 1.00 37.36 N ATOM 1710 CA LEU A 758 13.155 -0.236 2.585 1.00 39.74 C ATOM 1711 C LEU A 758 13.771 1.138 2.853 1.00 36.02 C ATOM 1712 O LEU A 758 14.766 1.215 3.539 1.00 33.99 O ATOM 1713 CB LEU A 758 13.642 -0.784 1.233 1.00 42.79 C ATOM 1714 CG LEU A 758 14.092 -2.261 1.190 1.00 46.42 C ATOM 1715 CD1 LEU A 758 13.227 -3.233 1.989 1.00 45.51 C ATOM 1716 CD2 LEU A 758 14.178 -2.703 -0.271 1.00 51.08 C ATOM 1717 H LEU A 758 11.128 -0.486 1.840 1.00 0.00 H ATOM 1718 N ASP A 759 13.179 2.204 2.331 1.00 35.92 N ATOM 1719 CA ASP A 759 13.666 3.564 2.602 1.00 37.44 C ATOM 1720 C ASP A 759 13.525 3.946 4.057 1.00 36.69 C ATOM 1721 O ASP A 759 14.383 4.654 4.592 1.00 36.34 O ATOM 1722 CB ASP A 759 12.924 4.612 1.768 1.00 39.84 C ATOM 1723 CG ASP A 759 13.285 4.566 0.287 1.00 41.78 C ATOM 1724 OD1 ASP A 759 14.367 4.028 -0.064 1.00 44.43 O ATOM 1725 OD2 ASP A 759 12.475 5.072 -0.526 1.00 43.36 O ATOM 1726 H ASP A 759 12.351 2.074 1.715 1.00 0.00 H ATOM 1727 N LEU A 760 12.441 3.490 4.689 1.00 34.95 N ATOM 1728 CA LEU A 760 12.215 3.757 6.106 1.00 33.72 C ATOM 1729 C LEU A 760 13.233 3.027 6.968 1.00 33.66 C ATOM 1730 O LEU A 760 13.872 3.641 7.829 1.00 33.87 O ATOM 1731 CB LEU A 760 10.797 3.396 6.535 1.00 33.41 C ATOM 1732 CG LEU A 760 9.722 4.376 6.058 1.00 35.27 C ATOM 1733 CD1 LEU A 760 8.353 3.708 6.070 1.00 36.56 C ATOM 1734 CD2 LEU A 760 9.709 5.653 6.887 1.00 35.51 C ATOM 1735 H LEU A 760 11.741 2.932 4.159 1.00 0.00 H ATOM 1736 N MET A 761 13.411 1.731 6.724 1.00 33.56 N ATOM 1737 CA MET A 761 14.398 0.945 7.483 1.00 33.25 C ATOM 1738 C MET A 761 15.802 1.517 7.380 1.00 33.60 C ATOM 1739 O MET A 761 16.482 1.643 8.400 1.00 34.29 O ATOM 1740 CB MET A 761 14.407 -0.511 7.057 1.00 32.55 C ATOM 1741 CG MET A 761 13.186 -1.265 7.536 1.00 33.97 C ATOM 1742 SD MET A 761 13.141 -2.913 6.804 1.00 36.94 S ATOM 1743 CE MET A 761 14.560 -3.670 7.575 1.00 36.11 C ATOM 1744 H MET A 761 12.844 1.266 5.986 1.00 0.00 H ATOM 1745 N ARG A 762 16.209 1.898 6.172 1.00 34.28 N ATOM 1746 CA ARG A 762 17.502 2.536 5.976 1.00 36.90 C ATOM 1747 C ARG A 762 17.612 3.846 6.779 1.00 36.75 C ATOM 1748 O ARG A 762 18.547 3.996 7.562 1.00 35.67 O ATOM 1749 CB ARG A 762 17.775 2.797 4.499 1.00 40.45 C ATOM 1750 CG ARG A 762 19.214 3.167 4.205 1.00 45.11 C ATOM 1751 CD ARG A 762 19.374 3.996 2.921 1.00 50.43 C ATOM 1752 NE ARG A 762 19.066 3.210 1.728 1.00 58.95 N ATOM 1753 CZ ARG A 762 18.041 3.381 0.884 1.00 65.82 C ATOM 1754 NH1 ARG A 762 17.144 4.363 1.020 1.00 67.36 N ATOM 1755 NH2 ARG A 762 17.931 2.546 -0.152 1.00 70.78 N ATOM 1756 HE ARG A 762 19.717 2.429 1.510 1.00 0.00 H ATOM 1757 HH12 ARG A 762 16.365 4.454 0.337 1.00 0.00 H ATOM 1758 HH11 ARG A 762 17.225 5.036 1.809 1.00 0.00 H ATOM 1759 HH22 ARG A 762 17.146 2.653 -0.825 1.00 0.00 H ATOM 1760 HH21 ARG A 762 18.631 1.788 -0.286 1.00 0.00 H ATOM 1761 H ARG A 762 15.591 1.737 5.351 1.00 0.00 H ATOM 1762 N ASP A 763 16.649 4.757 6.622 1.00 36.00 N ATOM 1763 CA ASP A 763 16.665 6.039 7.353 1.00 37.53 C ATOM 1764 C ASP A 763 16.655 5.895 8.875 1.00 33.86 C ATOM 1765 O ASP A 763 17.374 6.602 9.594 1.00 32.51 O ATOM 1766 CB ASP A 763 15.491 6.912 6.930 1.00 43.29 C ATOM 1767 CG ASP A 763 15.577 7.342 5.468 1.00 51.07 C ATOM 1768 OD1 ASP A 763 16.600 7.010 4.813 1.00 56.03 O ATOM 1769 OD2 ASP A 763 14.617 7.994 4.982 1.00 53.40 O ATOM 1770 H ASP A 763 15.866 4.558 5.967 1.00 0.00 H ATOM 1771 N ILE A 764 15.857 4.955 9.355 1.00 31.86 N ATOM 1772 CA ILE A 764 15.703 4.719 10.788 1.00 31.42 C ATOM 1773 C ILE A 764 16.965 4.076 11.380 1.00 30.81 C ATOM 1774 O ILE A 764 17.433 4.509 12.446 1.00 30.82 O ATOM 1775 CB ILE A 764 14.434 3.890 11.068 1.00 30.49 C ATOM 1776 CG1 ILE A 764 13.197 4.732 10.731 1.00 31.49 C ATOM 1777 CG2 ILE A 764 14.371 3.444 12.519 1.00 30.99 C ATOM 1778 CD1 ILE A 764 11.938 3.924 10.522 1.00 31.30 C ATOM 1779 H ILE A 764 15.321 4.364 8.689 1.00 0.00 H ATOM 1780 N ILE A 765 17.523 3.075 10.696 1.00 29.01 N ATOM 1781 CA ILE A 765 18.750 2.443 11.161 1.00 28.02 C ATOM 1782 C ILE A 765 19.913 3.430 11.129 1.00 28.21 C ATOM 1783 O ILE A 765 20.680 3.484 12.082 1.00 27.59 O ATOM 1784 CB ILE A 765 19.060 1.152 10.390 1.00 27.73 C ATOM 1785 CG1 ILE A 765 18.026 0.084 10.771 1.00 26.46 C ATOM 1786 CG2 ILE A 765 20.467 0.640 10.705 1.00 27.64 C ATOM 1787 CD1 ILE A 765 18.109 -1.190 9.962 1.00 26.17 C ATOM 1788 H ILE A 765 17.075 2.742 9.819 1.00 0.00 H ATOM 1789 N LEU A 766 20.033 4.236 10.073 1.00 29.53 N ATOM 1790 CA LEU A 766 21.076 5.269 10.023 1.00 29.29 C ATOM 1791 C LEU A 766 20.943 6.304 11.131 1.00 30.32 C ATOM 1792 O LEU A 766 21.939 6.839 11.605 1.00 32.66 O ATOM 1793 CB LEU A 766 21.108 5.973 8.677 1.00 31.58 C ATOM 1794 CG LEU A 766 21.640 5.171 7.491 1.00 34.96 C ATOM 1795 CD1 LEU A 766 21.574 5.999 6.217 1.00 35.53 C ATOM 1796 CD2 LEU A 766 23.063 4.695 7.723 1.00 36.69 C ATOM 1797 H LEU A 766 19.378 4.131 9.272 1.00 0.00 H ATOM 1798 N ALA A 767 19.723 6.545 11.595 1.00 31.65 N ATOM 1799 CA ALA A 767 19.484 7.452 12.727 1.00 32.55 C ATOM 1800 C ALA A 767 20.000 6.971 14.093 1.00 31.31 C ATOM 1801 O ALA A 767 20.045 7.768 15.046 1.00 34.10 O ATOM 1802 CB ALA A 767 18.000 7.804 12.827 1.00 32.53 C ATOM 1803 H ALA A 767 18.911 6.078 11.144 1.00 0.00 H ATOM 1804 N THR A 768 20.383 5.696 14.202 1.00 30.45 N ATOM 1805 CA THR A 768 21.017 5.177 15.423 1.00 30.59 C ATOM 1806 C THR A 768 22.506 5.537 15.595 1.00 31.01 C ATOM 1807 O THR A 768 23.082 5.262 16.645 1.00 36.17 O ATOM 1808 CB THR A 768 20.889 3.649 15.541 1.00 28.89 C ATOM 1809 OG1 THR A 768 21.541 3.011 14.437 1.00 26.53 O ATOM 1810 CG2 THR A 768 19.447 3.245 15.591 1.00 28.11 C ATOM 1811 HG1 THR A 768 21.451 2.029 14.525 1.00 0.00 H ATOM 1812 H THR A 768 20.228 5.052 13.400 1.00 0.00 H ATOM 1813 N ASP A 769 23.126 6.132 14.583 1.00 32.57 N ATOM 1814 CA ASP A 769 24.467 6.702 14.715 1.00 33.57 C ATOM 1815 C ASP A 769 24.353 8.014 15.509 1.00 34.13 C ATOM 1816 O ASP A 769 23.634 8.927 15.091 1.00 34.49 O ATOM 1817 CB ASP A 769 25.078 6.957 13.314 1.00 34.88 C ATOM 1818 CG ASP A 769 26.519 7.503 13.362 1.00 37.00 C ATOM 1819 OD1 ASP A 769 27.044 7.742 14.487 1.00 38.12 O ATOM 1820 OD2 ASP A 769 27.100 7.735 12.268 1.00 37.29 O ATOM 1821 H ASP A 769 22.642 6.195 13.665 1.00 0.00 H ATOM 1822 N LEU A 770 25.065 8.121 16.634 1.00 33.66 N ATOM 1823 CA LEU A 770 25.069 9.366 17.423 1.00 34.57 C ATOM 1824 C LEU A 770 25.422 10.618 16.600 1.00 36.65 C ATOM 1825 O LEU A 770 24.844 11.694 16.818 1.00 37.82 O ATOM 1826 CB LEU A 770 26.032 9.249 18.594 1.00 33.90 C ATOM 1827 CG LEU A 770 26.224 10.464 19.512 1.00 35.71 C ATOM 1828 CD1 LEU A 770 24.907 10.968 20.093 1.00 35.19 C ATOM 1829 CD2 LEU A 770 27.210 10.053 20.605 1.00 34.40 C ATOM 1830 H LEU A 770 25.628 7.309 16.960 1.00 0.00 H ATOM 1831 N ALA A 771 26.341 10.469 15.649 1.00 35.74 N ATOM 1832 CA ALA A 771 26.679 11.552 14.733 1.00 40.55 C ATOM 1833 C ALA A 771 25.454 12.089 13.957 1.00 43.67 C ATOM 1834 O ALA A 771 25.329 13.303 13.756 1.00 46.42 O ATOM 1835 CB ALA A 771 27.747 11.095 13.752 1.00 41.55 C ATOM 1836 H ALA A 771 26.831 9.556 15.557 1.00 0.00 H ATOM 1837 N HIS A 772 24.567 11.183 13.518 1.00 41.93 N ATOM 1838 CA HIS A 772 23.312 11.571 12.870 1.00 42.11 C ATOM 1839 C HIS A 772 22.428 12.400 13.821 1.00 39.64 C ATOM 1840 O HIS A 772 21.985 13.494 13.471 1.00 42.07 O ATOM 1841 CB HIS A 772 22.550 10.338 12.371 1.00 41.30 C ATOM 1842 CG HIS A 772 21.334 10.665 11.567 1.00 45.91 C ATOM 1843 ND1 HIS A 772 20.115 10.950 12.147 1.00 47.14 N ATOM 1844 CD2 HIS A 772 21.146 10.751 10.228 1.00 50.25 C ATOM 1845 CE1 HIS A 772 19.228 11.196 11.199 1.00 51.57 C ATOM 1846 NE2 HIS A 772 19.827 11.082 10.026 1.00 52.77 N ATOM 1847 H HIS A 772 24.777 10.172 13.642 1.00 0.00 H ATOM 1848 N HIS A 773 22.196 11.867 15.014 1.00 35.59 N ATOM 1849 CA HIS A 773 21.386 12.525 16.031 1.00 35.89 C ATOM 1850 C HIS A 773 21.871 13.937 16.344 1.00 38.28 C ATOM 1851 O HIS A 773 21.063 14.872 16.447 1.00 38.72 O ATOM 1852 CB HIS A 773 21.340 11.673 17.305 1.00 35.34 C ATOM 1853 CG HIS A 773 20.777 12.394 18.486 1.00 38.66 C ATOM 1854 ND1 HIS A 773 19.431 12.650 18.631 1.00 40.50 N ATOM 1855 CD2 HIS A 773 21.384 12.944 19.564 1.00 40.02 C ATOM 1856 CE1 HIS A 773 19.232 13.323 19.754 1.00 44.17 C ATOM 1857 NE2 HIS A 773 20.402 13.518 20.336 1.00 42.66 N ATOM 1858 H HIS A 773 22.611 10.939 15.233 1.00 0.00 H ATOM 1859 N LEU A 774 23.184 14.103 16.484 1.00 38.38 N ATOM 1860 CA LEU A 774 23.740 15.434 16.746 1.00 42.23 C ATOM 1861 C LEU A 774 23.575 16.405 15.577 1.00 44.76 C ATOM 1862 O LEU A 774 23.402 17.598 15.810 1.00 47.14 O ATOM 1863 CB LEU A 774 25.204 15.346 17.161 1.00 42.77 C ATOM 1864 CG LEU A 774 25.403 14.587 18.475 1.00 41.57 C ATOM 1865 CD1 LEU A 774 26.824 14.047 18.533 1.00 43.35 C ATOM 1866 CD2 LEU A 774 25.076 15.435 19.697 1.00 42.14 C ATOM 1867 H LEU A 774 23.820 13.283 16.407 1.00 0.00 H ATOM 1868 N ARG A 775 23.608 15.909 14.338 1.00 46.37 N ATOM 1869 CA ARG A 775 23.320 16.757 13.167 1.00 51.29 C ATOM 1870 C ARG A 775 21.886 17.301 13.184 1.00 50.06 C ATOM 1871 O ARG A 775 21.668 18.482 12.905 1.00 53.39 O ATOM 1872 CB ARG A 775 23.562 16.020 11.831 1.00 55.14 C ATOM 1873 CG ARG A 775 24.991 16.075 11.306 1.00 58.54 C ATOM 1874 CD ARG A 775 25.064 15.684 9.831 1.00 61.83 C ATOM 1875 NE ARG A 775 24.626 14.304 9.576 1.00 61.58 N ATOM 1876 CZ ARG A 775 25.332 13.193 9.838 1.00 60.74 C ATOM 1877 NH1 ARG A 775 26.547 13.247 10.388 1.00 61.45 N ATOM 1878 NH2 ARG A 775 24.806 11.996 9.552 1.00 59.71 N ATOM 1879 HE ARG A 775 23.684 14.177 9.154 1.00 0.00 H ATOM 1880 HH12 ARG A 775 27.071 12.369 10.580 1.00 0.00 H ATOM 1881 HH11 ARG A 775 26.970 14.167 10.625 1.00 0.00 H ATOM 1882 HH22 ARG A 775 25.346 11.130 9.752 1.00 0.00 H ATOM 1883 HH21 ARG A 775 23.858 11.932 9.130 1.00 0.00 H ATOM 1884 H ARG A 775 23.841 14.905 14.196 1.00 0.00 H ATOM 1885 N ILE A 776 20.928 16.426 13.491 1.00 47.06 N ATOM 1886 CA ILE A 776 19.486 16.758 13.448 1.00 47.18 C ATOM 1887 C ILE A 776 18.923 17.377 14.734 1.00 47.69 C ATOM 1888 O ILE A 776 17.762 17.755 14.766 1.00 50.32 O ATOM 1889 CB ILE A 776 18.604 15.526 13.060 1.00 44.24 C ATOM 1890 CG1 ILE A 776 18.677 14.389 14.101 1.00 39.90 C ATOM 1891 CG2 ILE A 776 18.987 15.001 11.683 1.00 43.73 C ATOM 1892 CD1 ILE A 776 17.494 13.446 14.050 1.00 38.92 C ATOM 1893 H ILE A 776 21.207 15.465 13.774 1.00 0.00 H ATOM 1894 N PHE A 777 19.732 17.462 15.785 1.00 47.57 N ATOM 1895 CA PHE A 777 19.256 17.892 17.104 1.00 48.54 C ATOM 1896 C PHE A 777 18.579 19.260 17.069 1.00 52.15 C ATOM 1897 O PHE A 777 17.541 19.453 17.704 1.00 52.38 O ATOM 1898 CB PHE A 777 20.419 17.907 18.123 1.00 47.06 C ATOM 1899 CG PHE A 777 19.979 18.131 19.545 1.00 46.21 C ATOM 1900 CD1 PHE A 777 19.449 17.086 20.290 1.00 44.18 C ATOM 1901 CD2 PHE A 777 20.098 19.384 20.142 1.00 49.24 C ATOM 1902 CE1 PHE A 777 19.035 17.286 21.592 1.00 44.91 C ATOM 1903 CE2 PHE A 777 19.691 19.592 21.456 1.00 49.93 C ATOM 1904 CZ PHE A 777 19.156 18.538 22.178 1.00 48.13 C ATOM 1905 H PHE A 777 20.736 17.216 15.668 1.00 0.00 H ATOM 1906 N LYS A 778 19.186 20.204 16.353 1.00 56.64 N ATOM 1907 CA LYS A 778 18.604 21.543 16.174 1.00 60.93 C ATOM 1908 C LYS A 778 17.208 21.459 15.534 1.00 60.58 C ATOM 1909 O LYS A 778 16.292 22.179 15.939 1.00 61.69 O ATOM 1910 CB LYS A 778 19.511 22.442 15.320 1.00 64.97 C ATOM 1911 CG LYS A 778 20.576 23.210 16.099 1.00 68.72 C ATOM 1912 CD LYS A 778 21.297 24.208 15.183 1.00 73.03 C ATOM 1913 CE LYS A 778 21.941 25.416 15.843 1.00 77.61 C ATOM 1914 NZ LYS A 778 23.118 25.043 16.664 1.00 76.56 N ATOM 1915 HZ1 LYS A 778 22.822 24.384 17.412 1.00 0.00 H ATOM 1916 HZ2 LYS A 778 23.830 24.586 16.059 1.00 0.00 H ATOM 1917 HZ3 LYS A 778 23.524 25.898 17.094 1.00 0.00 H ATOM 1918 H LYS A 778 20.100 19.988 15.906 1.00 0.00 H ATOM 1919 N ASP A 779 17.054 20.573 14.552 1.00 58.53 N ATOM 1920 CA ASP A 779 15.755 20.367 13.895 1.00 59.26 C ATOM 1921 C ASP A 779 14.713 19.748 14.838 1.00 55.90 C ATOM 1922 O ASP A 779 13.545 20.136 14.807 1.00 58.54 O ATOM 1923 CB ASP A 779 15.905 19.520 12.624 1.00 58.51 C ATOM 1924 CG ASP A 779 16.818 20.169 11.584 1.00 61.73 C ATOM 1925 OD1 ASP A 779 16.724 21.408 11.381 1.00 65.00 O ATOM 1926 OD2 ASP A 779 17.623 19.433 10.960 1.00 62.11 O ATOM 1927 H ASP A 779 17.873 20.013 14.242 1.00 0.00 H ATOM 1928 N LEU A 780 15.141 18.804 15.673 1.00 51.87 N ATOM 1929 CA LEU A 780 14.250 18.184 16.656 1.00 51.01 C ATOM 1930 C LEU A 780 13.715 19.181 17.683 1.00 53.16 C ATOM 1931 O LEU A 780 12.534 19.146 18.012 1.00 53.26 O ATOM 1932 CB LEU A 780 14.949 17.044 17.382 1.00 48.00 C ATOM 1933 CG LEU A 780 15.326 15.823 16.548 1.00 46.16 C ATOM 1934 CD1 LEU A 780 16.285 14.929 17.304 1.00 42.83 C ATOM 1935 CD2 LEU A 780 14.086 15.041 16.143 1.00 45.87 C ATOM 1936 H LEU A 780 16.134 18.499 15.626 1.00 0.00 H ATOM 1937 N GLN A 781 14.576 20.087 18.143 1.00 55.98 N ATOM 1938 CA GLN A 781 14.177 21.164 19.067 1.00 59.49 C ATOM 1939 C GLN A 781 13.168 22.141 18.463 1.00 63.09 C ATOM 1940 O GLN A 781 12.197 22.516 19.117 1.00 63.71 O ATOM 1941 CB GLN A 781 15.391 21.964 19.522 1.00 61.15 C ATOM 1942 CG GLN A 781 16.312 21.237 20.477 1.00 59.91 C ATOM 1943 CD GLN A 781 17.514 22.094 20.846 1.00 62.86 C ATOM 1944 OE1 GLN A 781 18.249 22.556 19.970 1.00 64.39 O ATOM 1945 NE2 GLN A 781 17.697 22.346 22.136 1.00 64.35 N ATOM 1946 HE22 GLN A 781 17.053 21.936 22.842 1.00 0.00 H ATOM 1947 HE21 GLN A 781 18.484 22.954 22.441 1.00 0.00 H ATOM 1948 H GLN A 781 15.569 20.032 17.838 1.00 0.00 H ATOM 1949 N LYS A 782 13.434 22.564 17.227 1.00 66.33 N ATOM 1950 CA LYS A 782 12.506 23.377 16.450 1.00 70.67 C ATOM 1951 C LYS A 782 11.126 22.734 16.458 1.00 67.67 C ATOM 1952 O LYS A 782 10.141 23.379 16.826 1.00 69.11 O ATOM 1953 CB LYS A 782 12.983 23.511 14.998 1.00 75.67 C ATOM 1954 CG LYS A 782 12.747 24.880 14.381 1.00 85.77 C ATOM 1955 CD LYS A 782 12.910 24.772 12.835 1.00 89.10 C ATOM 1956 CE LYS A 782 14.300 25.236 12.417 1.00 93.06 C ATOM 1957 NZ LYS A 782 14.424 26.721 12.467 1.00 99.39 N ATOM 1958 HZ1 LYS A 782 13.728 27.148 11.822 1.00 0.00 H ATOM 1959 HZ2 LYS A 782 14.247 27.050 13.438 1.00 0.00 H ATOM 1960 HZ3 LYS A 782 15.383 26.998 12.176 1.00 0.00 H ATOM 1961 H LYS A 782 14.344 22.302 16.798 1.00 0.00 H ATOM 1962 N MET A 783 11.080 21.465 16.046 1.00 64.39 N ATOM 1963 CA MET A 783 9.833 20.683 15.961 1.00 64.93 C ATOM 1964 C MET A 783 9.102 20.585 17.299 1.00 67.40 C ATOM 1965 O MET A 783 7.879 20.710 17.339 1.00 69.94 O ATOM 1966 CB MET A 783 10.105 19.267 15.428 1.00 59.32 C ATOM 1967 CG MET A 783 8.848 18.423 15.220 1.00 57.28 C ATOM 1968 SD MET A 783 9.146 16.815 14.460 1.00 52.27 S ATOM 1969 CE MET A 783 9.874 15.917 15.814 1.00 49.51 C ATOM 1970 H MET A 783 11.971 21.004 15.771 1.00 0.00 H ATOM 1971 N ALA A 784 9.845 20.391 18.384 1.00 67.66 N ATOM 1972 CA ALA A 784 9.250 20.283 19.719 1.00 70.46 C ATOM 1973 C ALA A 784 8.587 21.580 20.206 1.00 77.32 C ATOM 1974 O ALA A 784 7.505 21.545 20.798 1.00 80.31 O ATOM 1975 CB ALA A 784 10.290 19.830 20.718 1.00 69.07 C ATOM 1976 H ALA A 784 10.877 20.314 18.283 1.00 0.00 H ATOM 1977 N GLU A 785 9.211 22.721 19.916 1.00 82.39 N ATOM 1978 CA GLU A 785 8.703 24.012 20.377 1.00 87.55 C ATOM 1979 C GLU A 785 7.524 24.508 19.547 1.00 83.24 C ATOM 1980 O GLU A 785 6.525 24.931 20.119 1.00 85.28 O ATOM 1981 CB GLU A 785 9.831 25.038 20.446 1.00 96.82 C ATOM 1982 CG GLU A 785 10.855 24.619 21.493 1.00107.44 C ATOM 1983 CD GLU A 785 12.004 25.590 21.667 1.00121.15 C ATOM 1984 OE1 GLU A 785 11.723 26.782 21.937 1.00134.89 O ATOM 1985 OE2 GLU A 785 13.184 25.155 21.547 1.00123.96 O ATOM 1986 H GLU A 785 10.081 22.692 19.347 1.00 0.00 H ATOM 1987 N VAL A 786 7.629 24.465 18.216 1.00 77.74 N ATOM 1988 CA VAL A 786 6.489 24.843 17.344 1.00 78.25 C ATOM 1989 C VAL A 786 5.312 23.853 17.455 1.00 76.33 C ATOM 1990 O VAL A 786 4.160 24.234 17.264 1.00 79.87 O ATOM 1991 CB VAL A 786 6.871 25.036 15.840 1.00 76.71 C ATOM 1992 CG1 VAL A 786 7.973 26.077 15.682 1.00 77.69 C ATOM 1993 CG2 VAL A 786 7.242 23.719 15.164 1.00 71.22 C ATOM 1994 H VAL A 786 8.525 24.162 17.783 1.00 0.00 H ATOM 1995 N GLY A 787 5.618 22.589 17.732 1.00 71.93 N ATOM 1996 CA GLY A 787 4.620 21.538 17.892 1.00 70.24 C ATOM 1997 C GLY A 787 4.623 20.615 16.685 1.00 66.85 C ATOM 1998 O GLY A 787 4.845 21.060 15.543 1.00 68.76 O ATOM 1999 H GLY A 787 6.621 22.337 17.840 1.00 0.00 H ATOM 2000 N TYR A 788 4.293 19.350 16.917 1.00 63.76 N ATOM 2001 CA TYR A 788 4.209 18.363 15.829 1.00 62.08 C ATOM 2002 C TYR A 788 3.043 18.638 14.882 1.00 63.93 C ATOM 2003 O TYR A 788 1.961 19.023 15.300 1.00 67.86 O ATOM 2004 CB TYR A 788 4.088 16.947 16.395 1.00 59.87 C ATOM 2005 CG TYR A 788 4.204 15.844 15.359 1.00 57.30 C ATOM 2006 CD1 TYR A 788 5.452 15.400 14.915 1.00 53.91 C ATOM 2007 CD2 TYR A 788 3.065 15.242 14.823 1.00 57.48 C ATOM 2008 CE1 TYR A 788 5.562 14.390 13.973 1.00 50.72 C ATOM 2009 CE2 TYR A 788 3.164 14.229 13.878 1.00 55.46 C ATOM 2010 CZ TYR A 788 4.418 13.806 13.461 1.00 52.95 C ATOM 2011 OH TYR A 788 4.511 12.822 12.523 1.00 51.15 O ATOM 2012 HH TYR A 788 4.074 12.001 12.863 1.00 0.00 H ATOM 2013 H TYR A 788 4.089 19.049 17.891 1.00 0.00 H ATOM 2014 N ASP A 789 3.292 18.414 13.601 1.00 64.51 N ATOM 2015 CA ASP A 789 2.367 18.730 12.521 1.00 68.27 C ATOM 2016 C ASP A 789 2.251 17.456 11.703 1.00 65.99 C ATOM 2017 O ASP A 789 3.186 17.091 10.990 1.00 65.82 O ATOM 2018 CB ASP A 789 2.906 19.887 11.669 1.00 70.99 C ATOM 2019 CG ASP A 789 1.941 20.328 10.569 1.00 73.32 C ATOM 2020 OD1 ASP A 789 0.934 19.639 10.284 1.00 73.47 O ATOM 2021 OD2 ASP A 789 2.210 21.380 9.959 1.00 76.43 O ATOM 2022 H ASP A 789 4.206 17.985 13.350 1.00 0.00 H ATOM 2023 N ARG A 790 1.115 16.771 11.834 1.00 67.14 N ATOM 2024 CA ARG A 790 0.900 15.481 11.170 1.00 65.90 C ATOM 2025 C ARG A 790 0.950 15.567 9.636 1.00 65.09 C ATOM 2026 O ARG A 790 1.248 14.573 8.984 1.00 61.31 O ATOM 2027 CB ARG A 790 -0.421 14.853 11.618 1.00 69.38 C ATOM 2028 CG ARG A 790 -0.445 13.340 11.492 1.00 69.46 C ATOM 2029 CD ARG A 790 -1.857 12.791 11.610 1.00 74.97 C ATOM 2030 NE ARG A 790 -1.934 11.380 12.007 1.00 77.41 N ATOM 2031 CZ ARG A 790 -1.489 10.306 11.333 1.00 78.77 C ATOM 2032 NH1 ARG A 790 -0.862 10.388 10.146 1.00 77.61 N ATOM 2033 NH2 ARG A 790 -1.671 9.102 11.881 1.00 76.94 N ATOM 2034 HE ARG A 790 -2.389 11.188 12.922 1.00 0.00 H ATOM 2035 HH12 ARG A 790 -0.538 9.523 9.668 1.00 0.00 H ATOM 2036 HH11 ARG A 790 -0.701 11.316 9.706 1.00 0.00 H ATOM 2037 HH22 ARG A 790 -1.339 8.250 11.386 1.00 0.00 H ATOM 2038 HH21 ARG A 790 -2.145 9.016 12.803 1.00 0.00 H ATOM 2039 H ARG A 790 0.356 17.164 12.427 1.00 0.00 H ATOM 2040 N ASN A 791 0.683 16.748 9.076 1.00 68.39 N ATOM 2041 CA ASN A 791 0.763 16.986 7.626 1.00 70.98 C ATOM 2042 C ASN A 791 2.155 17.372 7.090 1.00 71.82 C ATOM 2043 O ASN A 791 2.321 17.513 5.877 1.00 74.44 O ATOM 2044 CB ASN A 791 -0.252 18.062 7.222 1.00 76.39 C ATOM 2045 CG ASN A 791 -1.681 17.666 7.556 1.00 78.68 C ATOM 2046 OD1 ASN A 791 -2.064 16.504 7.408 1.00 77.75 O ATOM 2047 ND2 ASN A 791 -2.472 18.625 8.027 1.00 84.59 N ATOM 2048 HD22 ASN A 791 -2.108 19.593 8.136 1.00 0.00 H ATOM 2049 HD21 ASN A 791 -3.455 18.407 8.287 1.00 0.00 H ATOM 2050 H ASN A 791 0.405 17.538 9.693 1.00 0.00 H ATOM 2051 N ASN A 792 3.147 17.534 7.971 1.00 70.34 N ATOM 2052 CA ASN A 792 4.520 17.871 7.576 1.00 69.03 C ATOM 2053 C ASN A 792 5.344 16.581 7.480 1.00 66.25 C ATOM 2054 O ASN A 792 5.592 15.936 8.496 1.00 62.79 O ATOM 2055 CB ASN A 792 5.115 18.832 8.617 1.00 71.28 C ATOM 2056 CG ASN A 792 6.484 19.374 8.228 1.00 70.66 C ATOM 2057 OD1 ASN A 792 7.246 18.745 7.500 1.00 66.58 O ATOM 2058 ND2 ASN A 792 6.797 20.557 8.724 1.00 75.39 N ATOM 2059 HD22 ASN A 792 6.123 21.058 9.337 1.00 0.00 H ATOM 2060 HD21 ASN A 792 7.717 20.987 8.501 1.00 0.00 H ATOM 2061 H ASN A 792 2.936 17.416 8.983 1.00 0.00 H ATOM 2062 N LYS A 793 5.763 16.208 6.269 1.00 66.59 N ATOM 2063 CA LYS A 793 6.500 14.941 6.048 1.00 64.34 C ATOM 2064 C LYS A 793 7.931 14.960 6.613 1.00 62.02 C ATOM 2065 O LYS A 793 8.467 13.915 6.979 1.00 52.96 O ATOM 2066 CB LYS A 793 6.500 14.556 4.564 1.00 66.03 C ATOM 2067 CG LYS A 793 5.090 14.324 4.036 1.00 72.55 C ATOM 2068 CD LYS A 793 5.031 13.461 2.785 1.00 73.48 C ATOM 2069 CE LYS A 793 3.581 13.111 2.470 1.00 74.60 C ATOM 2070 NZ LYS A 793 3.432 12.385 1.182 1.00 74.79 N ATOM 2071 HZ1 LYS A 793 3.792 12.978 0.407 1.00 0.00 H ATOM 2072 HZ2 LYS A 793 3.973 11.498 1.221 1.00 0.00 H ATOM 2073 HZ3 LYS A 793 2.427 12.173 1.019 1.00 0.00 H ATOM 2074 H LYS A 793 5.566 16.825 5.455 1.00 0.00 H ATOM 2075 N GLN A 794 8.523 16.154 6.687 1.00 65.85 N ATOM 2076 CA GLN A 794 9.777 16.355 7.428 1.00 66.41 C ATOM 2077 C GLN A 794 9.644 16.033 8.916 1.00 58.40 C ATOM 2078 O GLN A 794 10.534 15.396 9.474 1.00 53.41 O ATOM 2079 CB GLN A 794 10.369 17.763 7.217 1.00 75.02 C ATOM 2080 CG GLN A 794 11.886 17.790 7.007 1.00 82.09 C ATOM 2081 CD GLN A 794 12.489 16.711 6.091 1.00 86.46 C ATOM 2082 OE1 GLN A 794 11.906 16.249 5.086 1.00 89.80 O ATOM 2083 NE2 GLN A 794 13.687 16.292 6.465 1.00 86.18 N ATOM 2084 HE22 GLN A 794 14.141 16.700 7.307 1.00 0.00 H ATOM 2085 HE21 GLN A 794 14.175 15.555 5.917 1.00 0.00 H ATOM 2086 H GLN A 794 8.085 16.966 6.207 1.00 0.00 H ATOM 2087 N HIS A 795 8.530 16.433 9.527 1.00 55.38 N ATOM 2088 CA HIS A 795 8.249 16.103 10.919 1.00 53.92 C ATOM 2089 C HIS A 795 8.108 14.606 11.169 1.00 52.26 C ATOM 2090 O HIS A 795 8.567 14.127 12.210 1.00 50.16 O ATOM 2091 CB HIS A 795 7.028 16.868 11.444 1.00 57.47 C ATOM 2092 CG HIS A 795 7.309 18.310 11.768 1.00 62.44 C ATOM 2093 ND1 HIS A 795 6.364 19.147 12.317 1.00 66.01 N ATOM 2094 CD2 HIS A 795 8.440 19.049 11.659 1.00 63.24 C ATOM 2095 CE1 HIS A 795 6.887 20.345 12.504 1.00 68.87 C ATOM 2096 NE2 HIS A 795 8.147 20.312 12.110 1.00 67.12 N ATOM 2097 H HIS A 795 7.839 16.999 8.994 1.00 0.00 H ATOM 2098 N HIS A 796 7.514 13.865 10.230 1.00 50.50 N ATOM 2099 CA HIS A 796 7.459 12.397 10.326 1.00 49.38 C ATOM 2100 C HIS A 796 8.864 11.798 10.368 1.00 47.84 C ATOM 2101 O HIS A 796 9.144 10.955 11.232 1.00 46.95 O ATOM 2102 CB HIS A 796 6.690 11.763 9.152 1.00 50.39 C ATOM 2103 CG HIS A 796 5.202 11.928 9.226 1.00 52.33 C ATOM 2104 ND1 HIS A 796 4.338 10.857 9.307 1.00 51.67 N ATOM 2105 CD2 HIS A 796 4.425 13.035 9.213 1.00 55.00 C ATOM 2106 CE1 HIS A 796 3.096 11.297 9.357 1.00 53.72 C ATOM 2107 NE2 HIS A 796 3.121 12.616 9.300 1.00 56.00 N ATOM 2108 H HIS A 796 7.080 14.337 9.411 1.00 0.00 H ATOM 2109 N ARG A 797 9.732 12.245 9.452 1.00 49.60 N ATOM 2110 CA ARG A 797 11.137 11.779 9.388 1.00 50.61 C ATOM 2111 C ARG A 797 11.861 12.038 10.705 1.00 46.37 C ATOM 2112 O ARG A 797 12.491 11.143 11.264 1.00 41.91 O ATOM 2113 CB ARG A 797 11.952 12.452 8.250 1.00 58.92 C ATOM 2114 CG ARG A 797 12.276 11.529 7.076 1.00 70.90 C ATOM 2115 CD ARG A 797 13.401 12.061 6.195 1.00 82.03 C ATOM 2116 NE ARG A 797 12.991 13.180 5.336 1.00 93.91 N ATOM 2117 CZ ARG A 797 12.304 13.064 4.194 1.00 97.50 C ATOM 2118 NH1 ARG A 797 11.841 11.886 3.769 1.00 99.84 N ATOM 2119 NH2 ARG A 797 12.031 14.160 3.488 1.00 97.61 N ATOM 2120 HE ARG A 797 13.256 14.139 5.640 1.00 0.00 H ATOM 2121 HH12 ARG A 797 11.310 11.827 2.877 1.00 0.00 H ATOM 2122 HH11 ARG A 797 12.011 11.027 4.330 1.00 0.00 H ATOM 2123 HH22 ARG A 797 11.498 14.086 2.598 1.00 0.00 H ATOM 2124 HH21 ARG A 797 12.351 15.090 3.827 1.00 0.00 H ATOM 2125 H ARG A 797 9.407 12.948 8.757 1.00 0.00 H ATOM 2126 N LEU A 798 11.762 13.275 11.186 1.00 44.60 N ATOM 2127 CA LEU A 798 12.391 13.676 12.432 1.00 42.09 C ATOM 2128 C LEU A 798 11.854 12.907 13.625 1.00 40.23 C ATOM 2129 O LEU A 798 12.637 12.497 14.486 1.00 38.80 O ATOM 2130 CB LEU A 798 12.252 15.182 12.668 1.00 43.85 C ATOM 2131 CG LEU A 798 13.032 16.063 11.693 1.00 46.04 C ATOM 2132 CD1 LEU A 798 12.639 17.528 11.880 1.00 49.39 C ATOM 2133 CD2 LEU A 798 14.533 15.895 11.842 1.00 45.46 C ATOM 2134 H LEU A 798 11.215 13.979 10.651 1.00 0.00 H ATOM 2135 N LEU A 799 10.540 12.695 13.677 1.00 41.04 N ATOM 2136 CA LEU A 799 9.939 11.945 14.778 1.00 40.73 C ATOM 2137 C LEU A 799 10.405 10.488 14.795 1.00 39.36 C ATOM 2138 O LEU A 799 10.687 9.953 15.865 1.00 39.19 O ATOM 2139 CB LEU A 799 8.412 12.024 14.764 1.00 41.40 C ATOM 2140 CG LEU A 799 7.704 11.310 15.929 1.00 41.88 C ATOM 2141 CD1 LEU A 799 8.154 11.828 17.287 1.00 43.72 C ATOM 2142 CD2 LEU A 799 6.200 11.428 15.810 1.00 43.91 C ATOM 2143 H LEU A 799 9.931 13.070 12.921 1.00 0.00 H ATOM 2144 N LEU A 800 10.501 9.863 13.627 1.00 38.48 N ATOM 2145 CA LEU A 800 11.014 8.495 13.533 1.00 36.95 C ATOM 2146 C LEU A 800 12.461 8.373 14.043 1.00 36.97 C ATOM 2147 O LEU A 800 12.790 7.383 14.698 1.00 36.10 O ATOM 2148 CB LEU A 800 10.902 7.956 12.095 1.00 35.67 C ATOM 2149 CG LEU A 800 9.481 7.613 11.621 1.00 36.93 C ATOM 2150 CD1 LEU A 800 9.435 7.466 10.106 1.00 36.89 C ATOM 2151 CD2 LEU A 800 8.959 6.345 12.283 1.00 36.74 C ATOM 2152 H LEU A 800 10.205 10.356 12.760 1.00 0.00 H ATOM 2153 N CYS A 801 13.311 9.360 13.741 1.00 35.80 N ATOM 2154 CA CYS A 801 14.685 9.382 14.257 1.00 35.82 C ATOM 2155 C CYS A 801 14.710 9.518 15.778 1.00 35.97 C ATOM 2156 O CYS A 801 15.359 8.733 16.454 1.00 35.07 O ATOM 2157 CB CYS A 801 15.492 10.511 13.629 1.00 37.24 C ATOM 2158 SG CYS A 801 15.617 10.359 11.838 1.00 39.36 S ATOM 2159 H CYS A 801 12.990 10.133 13.124 1.00 0.00 H ATOM 2160 N LEU A 802 13.954 10.485 16.300 1.00 37.52 N ATOM 2161 CA LEU A 802 13.802 10.669 17.737 1.00 38.84 C ATOM 2162 C LEU A 802 13.307 9.406 18.453 1.00 37.57 C ATOM 2163 O LEU A 802 13.892 8.991 19.456 1.00 34.88 O ATOM 2164 CB LEU A 802 12.868 11.841 18.053 1.00 41.41 C ATOM 2165 CG LEU A 802 12.553 12.104 19.530 1.00 44.66 C ATOM 2166 CD1 LEU A 802 13.828 12.271 20.341 1.00 44.90 C ATOM 2167 CD2 LEU A 802 11.669 13.334 19.695 1.00 48.41 C ATOM 2168 H LEU A 802 13.454 11.132 15.657 1.00 0.00 H ATOM 2169 N LEU A 803 12.246 8.796 17.933 1.00 37.43 N ATOM 2170 CA LEU A 803 11.704 7.574 18.534 1.00 36.77 C ATOM 2171 C LEU A 803 12.699 6.423 18.491 1.00 35.35 C ATOM 2172 O LEU A 803 12.832 5.685 19.479 1.00 35.05 O ATOM 2173 CB LEU A 803 10.378 7.166 17.875 1.00 37.35 C ATOM 2174 CG LEU A 803 9.205 8.142 18.056 1.00 39.12 C ATOM 2175 CD1 LEU A 803 8.105 7.812 17.058 1.00 39.41 C ATOM 2176 CD2 LEU A 803 8.659 8.140 19.477 1.00 40.40 C ATOM 2177 H LEU A 803 11.793 9.193 17.085 1.00 0.00 H ATOM 2178 N MET A 804 13.412 6.276 17.371 1.00 34.27 N ATOM 2179 CA MET A 804 14.439 5.232 17.261 1.00 34.07 C ATOM 2180 C MET A 804 15.531 5.412 18.324 1.00 34.19 C ATOM 2181 O MET A 804 15.892 4.454 19.003 1.00 33.42 O ATOM 2182 CB MET A 804 15.065 5.205 15.864 1.00 33.13 C ATOM 2183 CG MET A 804 16.081 4.089 15.636 1.00 31.33 C ATOM 2184 SD MET A 804 15.447 2.396 15.747 1.00 32.43 S ATOM 2185 CE MET A 804 16.224 1.770 17.227 1.00 32.81 C ATOM 2186 H MET A 804 13.237 6.910 16.565 1.00 0.00 H ATOM 2187 N THR A 805 16.036 6.634 18.482 1.00 34.12 N ATOM 2188 CA THR A 805 17.057 6.881 19.501 1.00 33.90 C ATOM 2189 C THR A 805 16.490 6.678 20.902 1.00 35.09 C ATOM 2190 O THR A 805 17.192 6.168 21.767 1.00 35.78 O ATOM 2191 CB THR A 805 17.704 8.270 19.391 1.00 34.52 C ATOM 2192 OG1 THR A 805 16.711 9.286 19.495 1.00 36.20 O ATOM 2193 CG2 THR A 805 18.451 8.415 18.084 1.00 33.47 C ATOM 2194 HG1 THR A 805 16.051 9.177 18.765 1.00 0.00 H ATOM 2195 H THR A 805 15.704 7.414 17.880 1.00 0.00 H ATOM 2196 N SER A 806 15.218 7.037 21.106 1.00 35.44 N ATOM 2197 CA SER A 806 14.521 6.812 22.381 1.00 35.43 C ATOM 2198 C SER A 806 14.465 5.310 22.699 1.00 35.54 C ATOM 2199 O SER A 806 14.628 4.904 23.850 1.00 39.41 O ATOM 2200 CB SER A 806 13.091 7.428 22.376 1.00 37.46 C ATOM 2201 OG SER A 806 13.289 8.781 22.748 1.00 38.72 O ATOM 2202 HG SER A 806 12.416 9.248 22.768 1.00 0.00 H ATOM 2203 H SER A 806 14.700 7.495 20.329 1.00 0.00 H ATOM 2204 N CYS A 807 14.240 4.490 21.679 1.00 34.87 N ATOM 2205 CA CYS A 807 14.219 3.037 21.848 1.00 34.29 C ATOM 2206 C CYS A 807 15.611 2.479 22.131 1.00 32.88 C ATOM 2207 O CYS A 807 15.771 1.603 22.977 1.00 31.48 O ATOM 2208 CB CYS A 807 13.610 2.353 20.614 1.00 33.91 C ATOM 2209 SG CYS A 807 11.856 2.715 20.325 1.00 35.02 S ATOM 2210 H CYS A 807 14.074 4.892 20.734 1.00 0.00 H ATOM 2211 N ASP A 808 16.608 3.023 21.441 1.00 33.08 N ATOM 2212 CA ASP A 808 17.979 2.557 21.542 1.00 31.72 C ATOM 2213 C ASP A 808 18.533 2.792 22.955 1.00 32.53 C ATOM 2214 O ASP A 808 19.296 1.957 23.451 1.00 29.82 O ATOM 2215 CB ASP A 808 18.867 3.242 20.480 1.00 32.67 C ATOM 2216 CG ASP A 808 19.998 2.350 19.958 1.00 31.39 C ATOM 2217 OD1 ASP A 808 20.176 1.204 20.435 1.00 32.63 O ATOM 2218 OD2 ASP A 808 20.706 2.806 19.035 1.00 32.43 O ATOM 2219 H ASP A 808 16.397 3.816 20.802 1.00 0.00 H ATOM 2220 N LEU A 809 18.143 3.911 23.585 1.00 31.49 N ATOM 2221 CA LEU A 809 18.599 4.260 24.932 1.00 32.92 C ATOM 2222 C LEU A 809 17.601 3.910 26.037 1.00 33.93 C ATOM 2223 O LEU A 809 17.790 4.336 27.176 1.00 33.95 O ATOM 2224 CB LEU A 809 18.939 5.757 25.009 1.00 34.10 C ATOM 2225 CG LEU A 809 19.920 6.313 23.977 1.00 34.33 C ATOM 2226 CD1 LEU A 809 20.218 7.773 24.282 1.00 37.84 C ATOM 2227 CD2 LEU A 809 21.215 5.522 23.934 1.00 33.36 C ATOM 2228 H LEU A 809 17.490 4.557 23.097 1.00 0.00 H ATOM 2229 N SER A 810 16.592 3.089 25.725 1.00 33.99 N ATOM 2230 CA SER A 810 15.493 2.798 26.654 1.00 36.14 C ATOM 2231 C SER A 810 15.880 2.159 28.002 1.00 38.67 C ATOM 2232 O SER A 810 15.118 2.269 28.973 1.00 40.70 O ATOM 2233 CB SER A 810 14.421 1.945 25.966 1.00 35.33 C ATOM 2234 OG SER A 810 14.953 0.763 25.414 1.00 34.21 O ATOM 2235 HG SER A 810 15.641 0.995 24.741 1.00 0.00 H ATOM 2236 H SER A 810 16.586 2.639 24.787 1.00 0.00 H ATOM 2237 N ASP A 811 17.042 1.511 28.072 1.00 37.98 N ATOM 2238 CA ASP A 811 17.542 0.969 29.349 1.00 43.15 C ATOM 2239 C ASP A 811 17.696 2.046 30.427 1.00 43.77 C ATOM 2240 O ASP A 811 17.548 1.760 31.612 1.00 45.59 O ATOM 2241 CB ASP A 811 18.880 0.248 29.166 1.00 42.63 C ATOM 2242 CG ASP A 811 18.786 -0.945 28.223 1.00 45.90 C ATOM 2243 OD1 ASP A 811 17.823 -1.737 28.328 1.00 49.79 O ATOM 2244 OD2 ASP A 811 19.701 -1.100 27.383 1.00 44.56 O ATOM 2245 H ASP A 811 17.608 1.385 27.209 1.00 0.00 H ATOM 2246 N GLN A 812 17.947 3.285 30.003 1.00 43.46 N ATOM 2247 CA GLN A 812 18.008 4.437 30.917 1.00 43.21 C ATOM 2248 C GLN A 812 16.668 4.821 31.571 1.00 44.03 C ATOM 2249 O GLN A 812 16.667 5.580 32.547 1.00 44.77 O ATOM 2250 CB GLN A 812 18.594 5.674 30.201 1.00 41.58 C ATOM 2251 CG GLN A 812 19.961 5.494 29.542 1.00 40.51 C ATOM 2252 CD GLN A 812 20.963 4.752 30.417 1.00 42.03 C ATOM 2253 OE1 GLN A 812 21.172 5.115 31.583 1.00 48.12 O ATOM 2254 NE2 GLN A 812 21.552 3.685 29.886 1.00 40.04 N ATOM 2255 HE22 GLN A 812 21.349 3.414 28.903 1.00 0.00 H ATOM 2256 HE21 GLN A 812 22.216 3.121 30.454 1.00 0.00 H ATOM 2257 H GLN A 812 18.106 3.443 28.987 1.00 0.00 H ATOM 2258 N THR A 813 15.550 4.312 31.042 1.00 42.93 N ATOM 2259 CA THR A 813 14.206 4.629 31.552 1.00 47.00 C ATOM 2260 C THR A 813 13.674 3.620 32.588 1.00 50.94 C ATOM 2261 O THR A 813 12.581 3.822 33.127 1.00 54.62 O ATOM 2262 CB THR A 813 13.169 4.697 30.406 1.00 45.42 C ATOM 2263 OG1 THR A 813 12.963 3.385 29.878 1.00 42.32 O ATOM 2264 CG2 THR A 813 13.633 5.640 29.288 1.00 44.00 C ATOM 2265 HG1 THR A 813 13.820 3.032 29.530 1.00 0.00 H ATOM 2266 H THR A 813 15.634 3.663 30.234 1.00 0.00 H ATOM 2267 N LYS A 814 14.422 2.544 32.849 1.00 48.83 N ATOM 2268 CA LYS A 814 14.017 1.515 33.808 1.00 50.59 C ATOM 2269 C LYS A 814 14.578 1.867 35.189 1.00 53.69 C ATOM 2270 O LYS A 814 14.941 3.022 35.420 1.00 57.33 O ATOM 2271 CB LYS A 814 14.507 0.150 33.333 1.00 49.39 C ATOM 2272 CG LYS A 814 14.198 -0.173 31.876 1.00 47.86 C ATOM 2273 CD LYS A 814 12.712 -0.023 31.545 1.00 49.70 C ATOM 2274 CE LYS A 814 12.398 -0.528 30.145 1.00 48.61 C ATOM 2275 NZ LYS A 814 10.929 -0.580 29.919 1.00 51.44 N ATOM 2276 HZ1 LYS A 814 10.495 -1.222 30.613 1.00 0.00 H ATOM 2277 HZ2 LYS A 814 10.528 0.373 30.030 1.00 0.00 H ATOM 2278 HZ3 LYS A 814 10.740 -0.927 28.957 1.00 0.00 H ATOM 2279 H LYS A 814 15.328 2.433 32.351 1.00 0.00 H ATOM 2280 N GLY A 815 14.604 0.912 36.122 1.00 55.51 N ATOM 2281 CA GLY A 815 15.145 1.148 37.466 1.00 56.72 C ATOM 2282 C GLY A 815 16.667 1.168 37.505 1.00 55.22 C ATOM 2283 O GLY A 815 17.330 0.829 36.530 1.00 53.73 O ATOM 2284 H GLY A 815 14.229 -0.030 35.889 1.00 0.00 H ATOM 2285 N TRP A 816 17.214 1.559 38.653 1.00 57.31 N ATOM 2286 CA TRP A 816 18.664 1.591 38.887 1.00 55.13 C ATOM 2287 C TRP A 816 19.394 0.277 38.543 1.00 53.94 C ATOM 2288 O TRP A 816 20.487 0.288 37.980 1.00 47.57 O ATOM 2289 CB TRP A 816 18.943 1.967 40.349 1.00 57.79 C ATOM 2290 CG TRP A 816 20.365 1.780 40.712 1.00 57.43 C ATOM 2291 CD1 TRP A 816 20.889 0.836 41.550 1.00 58.88 C ATOM 2292 CD2 TRP A 816 21.465 2.519 40.195 1.00 54.26 C ATOM 2293 NE1 TRP A 816 22.252 0.960 41.600 1.00 58.11 N ATOM 2294 CE2 TRP A 816 22.632 1.988 40.776 1.00 55.81 C ATOM 2295 CE3 TRP A 816 21.574 3.602 39.310 1.00 52.45 C ATOM 2296 CZ2 TRP A 816 23.899 2.496 40.497 1.00 54.92 C ATOM 2297 CZ3 TRP A 816 22.831 4.107 39.030 1.00 52.09 C ATOM 2298 CH2 TRP A 816 23.979 3.551 39.623 1.00 53.27 C ATOM 2299 HE1 TRP A 816 22.893 0.371 42.169 1.00 0.00 H ATOM 2300 H TRP A 816 16.583 1.857 39.424 1.00 0.00 H ATOM 2301 N LYS A 817 18.782 -0.847 38.904 1.00 58.19 N ATOM 2302 CA LYS A 817 19.341 -2.181 38.636 1.00 60.76 C ATOM 2303 C LYS A 817 19.649 -2.428 37.158 1.00 56.69 C ATOM 2304 O LYS A 817 20.641 -3.075 36.834 1.00 54.11 O ATOM 2305 CB LYS A 817 18.368 -3.237 39.116 1.00 68.02 C ATOM 2306 CG LYS A 817 18.916 -4.639 39.238 1.00 73.40 C ATOM 2307 CD LYS A 817 17.787 -5.556 39.682 1.00 80.58 C ATOM 2308 CE LYS A 817 18.209 -7.017 39.750 1.00 84.61 C ATOM 2309 NZ LYS A 817 17.149 -7.860 40.385 1.00 87.23 N ATOM 2310 HZ1 LYS A 817 16.971 -7.521 41.352 1.00 0.00 H ATOM 2311 HZ2 LYS A 817 16.274 -7.793 39.827 1.00 0.00 H ATOM 2312 HZ3 LYS A 817 17.467 -8.850 40.416 1.00 0.00 H ATOM 2313 H LYS A 817 17.869 -0.780 39.397 1.00 0.00 H ATOM 2314 N THR A 818 18.787 -1.914 36.279 1.00 53.50 N ATOM 2315 CA THR A 818 18.976 -2.031 34.848 1.00 50.24 C ATOM 2316 C THR A 818 20.103 -1.095 34.350 1.00 47.73 C ATOM 2317 O THR A 818 20.962 -1.545 33.597 1.00 43.80 O ATOM 2318 CB THR A 818 17.639 -1.796 34.070 1.00 51.16 C ATOM 2319 OG1 THR A 818 16.686 -2.815 34.409 1.00 53.00 O ATOM 2320 CG2 THR A 818 17.843 -1.837 32.554 1.00 48.52 C ATOM 2321 HG1 THR A 818 16.506 -2.786 35.382 1.00 0.00 H ATOM 2322 H THR A 818 17.949 -1.411 36.634 1.00 0.00 H ATOM 2323 N THR A 819 20.090 0.187 34.734 1.00 47.30 N ATOM 2324 CA THR A 819 21.106 1.139 34.247 1.00 47.28 C ATOM 2325 C THR A 819 22.516 0.746 34.678 1.00 46.91 C ATOM 2326 O THR A 819 23.446 0.819 33.878 1.00 47.09 O ATOM 2327 CB THR A 819 20.856 2.594 34.699 1.00 50.02 C ATOM 2328 OG1 THR A 819 20.594 2.639 36.105 1.00 53.85 O ATOM 2329 CG2 THR A 819 19.687 3.153 33.988 1.00 52.30 C ATOM 2330 HG1 THR A 819 19.792 2.095 36.308 1.00 0.00 H ATOM 2331 H THR A 819 19.351 0.518 35.387 1.00 0.00 H ATOM 2332 N ARG A 820 22.646 0.316 35.927 1.00 47.99 N ATOM 2333 CA ARG A 820 23.910 -0.184 36.477 1.00 49.54 C ATOM 2334 C ARG A 820 24.468 -1.374 35.679 1.00 45.21 C ATOM 2335 O ARG A 820 25.636 -1.375 35.305 1.00 41.85 O ATOM 2336 CB ARG A 820 23.709 -0.590 37.941 1.00 54.18 C ATOM 2337 CG ARG A 820 24.987 -0.822 38.734 1.00 57.40 C ATOM 2338 CD ARG A 820 24.793 -1.881 39.806 1.00 63.08 C ATOM 2339 NE ARG A 820 24.669 -3.204 39.189 1.00 66.34 N ATOM 2340 CZ ARG A 820 23.659 -4.067 39.353 1.00 72.43 C ATOM 2341 NH1 ARG A 820 22.630 -3.819 40.176 1.00 75.84 N ATOM 2342 NH2 ARG A 820 23.690 -5.228 38.697 1.00 70.82 N ATOM 2343 HE ARG A 820 25.443 -3.502 38.561 1.00 0.00 H ATOM 2344 HH12 ARG A 820 21.864 -4.516 40.276 1.00 0.00 H ATOM 2345 HH11 ARG A 820 22.598 -2.930 40.715 1.00 0.00 H ATOM 2346 HH22 ARG A 820 22.914 -5.911 38.812 1.00 0.00 H ATOM 2347 HH21 ARG A 820 24.490 -5.450 38.071 1.00 0.00 H ATOM 2348 H ARG A 820 21.810 0.335 36.546 1.00 0.00 H ATOM 2349 N LYS A 821 23.622 -2.365 35.415 1.00 44.60 N ATOM 2350 CA LYS A 821 24.021 -3.549 34.661 1.00 46.02 C ATOM 2351 C LYS A 821 24.364 -3.211 33.199 1.00 42.72 C ATOM 2352 O LYS A 821 25.379 -3.660 32.681 1.00 40.26 O ATOM 2353 CB LYS A 821 22.923 -4.620 34.728 1.00 50.17 C ATOM 2354 CG LYS A 821 23.202 -5.915 33.962 1.00 52.99 C ATOM 2355 CD LYS A 821 24.449 -6.628 34.470 1.00 56.86 C ATOM 2356 CE LYS A 821 24.667 -7.938 33.729 1.00 58.65 C ATOM 2357 NZ LYS A 821 25.909 -8.613 34.199 1.00 60.70 N ATOM 2358 HZ1 LYS A 821 26.725 -7.992 34.029 1.00 0.00 H ATOM 2359 HZ2 LYS A 821 25.830 -8.813 35.217 1.00 0.00 H ATOM 2360 HZ3 LYS A 821 26.036 -9.504 33.679 1.00 0.00 H ATOM 2361 H LYS A 821 22.643 -2.294 35.757 1.00 0.00 H ATOM 2362 N ILE A 822 23.533 -2.397 32.559 1.00 40.35 N ATOM 2363 CA ILE A 822 23.789 -1.966 31.190 1.00 39.98 C ATOM 2364 C ILE A 822 25.064 -1.136 31.091 1.00 40.74 C ATOM 2365 O ILE A 822 25.831 -1.315 30.143 1.00 40.43 O ATOM 2366 CB ILE A 822 22.545 -1.262 30.567 1.00 40.97 C ATOM 2367 CG1 ILE A 822 21.640 -2.321 29.926 1.00 39.73 C ATOM 2368 CG2 ILE A 822 22.916 -0.236 29.492 1.00 40.86 C ATOM 2369 CD1 ILE A 822 21.223 -3.478 30.819 1.00 41.75 C ATOM 2370 H ILE A 822 22.679 -2.059 33.046 1.00 0.00 H ATOM 2371 N ALA A 823 25.292 -0.247 32.057 1.00 40.34 N ATOM 2372 CA ALA A 823 26.543 0.503 32.114 1.00 39.58 C ATOM 2373 C ALA A 823 27.739 -0.450 32.161 1.00 38.63 C ATOM 2374 O ALA A 823 28.658 -0.324 31.378 1.00 37.05 O ATOM 2375 CB ALA A 823 26.555 1.441 33.312 1.00 41.86 C ATOM 2376 H ALA A 823 24.566 -0.085 32.783 1.00 0.00 H ATOM 2377 N GLU A 824 27.682 -1.433 33.042 1.00 39.59 N ATOM 2378 CA GLU A 824 28.726 -2.456 33.146 1.00 40.43 C ATOM 2379 C GLU A 824 29.023 -3.125 31.802 1.00 39.56 C ATOM 2380 O GLU A 824 30.193 -3.278 31.425 1.00 40.12 O ATOM 2381 CB GLU A 824 28.319 -3.504 34.184 1.00 43.75 C ATOM 2382 CG GLU A 824 29.268 -4.677 34.348 1.00 48.05 C ATOM 2383 CD GLU A 824 28.632 -5.811 35.122 1.00 52.80 C ATOM 2384 OE1 GLU A 824 28.301 -6.839 34.482 1.00 55.31 O ATOM 2385 OE2 GLU A 824 28.430 -5.659 36.355 1.00 54.33 O ATOM 2386 H GLU A 824 26.866 -1.483 33.685 1.00 0.00 H ATOM 2387 N LEU A 825 27.972 -3.500 31.075 1.00 37.85 N ATOM 2388 CA LEU A 825 28.147 -4.186 29.790 1.00 36.22 C ATOM 2389 C LEU A 825 28.754 -3.259 28.750 1.00 35.02 C ATOM 2390 O LEU A 825 29.621 -3.663 27.991 1.00 34.40 O ATOM 2391 CB LEU A 825 26.822 -4.765 29.292 1.00 35.88 C ATOM 2392 CG LEU A 825 26.134 -5.788 30.212 1.00 37.73 C ATOM 2393 CD1 LEU A 825 24.749 -6.124 29.672 1.00 36.88 C ATOM 2394 CD2 LEU A 825 26.977 -7.042 30.416 1.00 39.07 C ATOM 2395 H LEU A 825 27.012 -3.303 31.424 1.00 0.00 H ATOM 2396 N ILE A 826 28.301 -2.009 28.735 1.00 36.54 N ATOM 2397 CA ILE A 826 28.818 -0.983 27.813 1.00 36.00 C ATOM 2398 C ILE A 826 30.319 -0.759 28.019 1.00 32.94 C ATOM 2399 O ILE A 826 31.087 -0.790 27.061 1.00 29.27 O ATOM 2400 CB ILE A 826 28.050 0.359 27.989 1.00 37.97 C ATOM 2401 CG1 ILE A 826 26.626 0.242 27.428 1.00 39.51 C ATOM 2402 CG2 ILE A 826 28.774 1.538 27.336 1.00 38.26 C ATOM 2403 CD1 ILE A 826 26.517 0.342 25.924 1.00 40.53 C ATOM 2404 H ILE A 826 27.549 -1.744 29.403 1.00 0.00 H ATOM 2405 N TYR A 827 30.726 -0.526 29.269 1.00 34.30 N ATOM 2406 CA TYR A 827 32.140 -0.268 29.573 1.00 35.51 C ATOM 2407 C TYR A 827 33.012 -1.493 29.283 1.00 36.55 C ATOM 2408 O TYR A 827 34.130 -1.349 28.803 1.00 40.56 O ATOM 2409 CB TYR A 827 32.320 0.290 30.993 1.00 35.72 C ATOM 2410 CG TYR A 827 31.722 1.672 31.102 1.00 35.17 C ATOM 2411 CD1 TYR A 827 32.265 2.740 30.402 1.00 34.87 C ATOM 2412 CD2 TYR A 827 30.601 1.911 31.872 1.00 35.89 C ATOM 2413 CE1 TYR A 827 31.715 4.008 30.469 1.00 35.68 C ATOM 2414 CE2 TYR A 827 30.037 3.175 31.938 1.00 37.49 C ATOM 2415 CZ TYR A 827 30.595 4.220 31.222 1.00 36.29 C ATOM 2416 OH TYR A 827 30.052 5.482 31.294 1.00 37.66 O ATOM 2417 HH TYR A 827 29.114 5.455 30.979 1.00 0.00 H ATOM 2418 H TYR A 827 30.030 -0.527 30.041 1.00 0.00 H ATOM 2419 N LYS A 828 32.485 -2.688 29.529 1.00 38.43 N ATOM 2420 CA LYS A 828 33.163 -3.931 29.120 1.00 40.96 C ATOM 2421 C LYS A 828 33.505 -3.929 27.632 1.00 37.92 C ATOM 2422 O LYS A 828 34.623 -4.265 27.249 1.00 37.58 O ATOM 2423 CB LYS A 828 32.275 -5.140 29.377 1.00 46.08 C ATOM 2424 CG LYS A 828 32.949 -6.275 30.111 1.00 54.43 C ATOM 2425 CD LYS A 828 32.004 -7.442 30.326 1.00 63.57 C ATOM 2426 CE LYS A 828 32.670 -8.604 31.042 1.00 71.78 C ATOM 2427 NZ LYS A 828 31.937 -9.892 30.898 1.00 75.79 N ATOM 2428 HZ1 LYS A 828 30.980 -9.791 31.292 1.00 0.00 H ATOM 2429 HZ2 LYS A 828 31.873 -10.143 29.891 1.00 0.00 H ATOM 2430 HZ3 LYS A 828 32.447 -10.639 31.411 1.00 0.00 H ATOM 2431 H LYS A 828 31.571 -2.747 30.022 1.00 0.00 H ATOM 2432 N GLU A 829 32.522 -3.583 26.798 1.00 33.79 N ATOM 2433 CA GLU A 829 32.746 -3.459 25.358 1.00 33.16 C ATOM 2434 C GLU A 829 33.780 -2.371 25.029 1.00 33.01 C ATOM 2435 O GLU A 829 34.678 -2.605 24.239 1.00 32.27 O ATOM 2436 CB GLU A 829 31.433 -3.159 24.588 1.00 31.86 C ATOM 2437 CG GLU A 829 30.610 -4.398 24.285 1.00 33.47 C ATOM 2438 CD GLU A 829 29.440 -4.174 23.335 1.00 33.67 C ATOM 2439 OE1 GLU A 829 29.368 -3.121 22.654 1.00 34.88 O ATOM 2440 OE2 GLU A 829 28.583 -5.083 23.267 1.00 32.68 O ATOM 2441 H GLU A 829 31.573 -3.397 27.182 1.00 0.00 H ATOM 2442 N PHE A 830 33.614 -1.186 25.619 1.00 33.27 N ATOM 2443 CA PHE A 830 34.485 -0.032 25.354 1.00 34.44 C ATOM 2444 C PHE A 830 35.942 -0.323 25.687 1.00 35.87 C ATOM 2445 O PHE A 830 36.838 0.017 24.900 1.00 36.09 O ATOM 2446 CB PHE A 830 34.032 1.190 26.167 1.00 36.30 C ATOM 2447 CG PHE A 830 32.788 1.888 25.647 1.00 37.07 C ATOM 2448 CD1 PHE A 830 32.030 1.393 24.566 1.00 36.35 C ATOM 2449 CD2 PHE A 830 32.348 3.052 26.276 1.00 38.18 C ATOM 2450 CE1 PHE A 830 30.904 2.066 24.130 1.00 35.67 C ATOM 2451 CE2 PHE A 830 31.195 3.709 25.845 1.00 36.94 C ATOM 2452 CZ PHE A 830 30.487 3.225 24.768 1.00 35.35 C ATOM 2453 H PHE A 830 32.833 -1.074 26.297 1.00 0.00 H ATOM 2454 N PHE A 831 36.172 -0.988 26.823 1.00 35.95 N ATOM 2455 CA PHE A 831 37.538 -1.271 27.285 1.00 36.96 C ATOM 2456 C PHE A 831 38.187 -2.411 26.512 1.00 37.31 C ATOM 2457 O PHE A 831 39.397 -2.387 26.324 1.00 37.58 O ATOM 2458 CB PHE A 831 37.596 -1.527 28.789 1.00 36.70 C ATOM 2459 CG PHE A 831 37.015 -0.411 29.630 1.00 36.49 C ATOM 2460 CD1 PHE A 831 37.032 0.918 29.207 1.00 35.74 C ATOM 2461 CD2 PHE A 831 36.462 -0.693 30.874 1.00 36.74 C ATOM 2462 CE1 PHE A 831 36.485 1.921 29.990 1.00 35.04 C ATOM 2463 CE2 PHE A 831 35.926 0.317 31.663 1.00 35.87 C ATOM 2464 CZ PHE A 831 35.931 1.622 31.217 1.00 35.08 C ATOM 2465 H PHE A 831 35.365 -1.313 27.394 1.00 0.00 H ATOM 2466 N SER A 832 37.392 -3.372 26.029 1.00 36.61 N ATOM 2467 CA SER A 832 37.892 -4.362 25.056 1.00 38.47 C ATOM 2468 C SER A 832 38.386 -3.707 23.774 1.00 37.90 C ATOM 2469 O SER A 832 39.457 -4.049 23.271 1.00 39.37 O ATOM 2470 CB SER A 832 36.820 -5.374 24.678 1.00 38.22 C ATOM 2471 OG SER A 832 36.712 -6.325 25.693 1.00 43.41 O ATOM 2472 HG SER A 832 36.463 -5.876 26.539 1.00 0.00 H ATOM 2473 H SER A 832 36.403 -3.422 26.345 1.00 0.00 H ATOM 2474 N GLN A 833 37.594 -2.776 23.253 1.00 36.92 N ATOM 2475 CA GLN A 833 37.985 -2.036 22.059 1.00 37.73 C ATOM 2476 C GLN A 833 39.297 -1.263 22.325 1.00 38.88 C ATOM 2477 O GLN A 833 40.229 -1.320 21.517 1.00 40.72 O ATOM 2478 CB GLN A 833 36.877 -1.082 21.601 1.00 33.52 C ATOM 2479 CG GLN A 833 37.269 -0.332 20.336 1.00 33.26 C ATOM 2480 CD GLN A 833 36.225 0.660 19.856 1.00 30.89 C ATOM 2481 OE1 GLN A 833 35.030 0.385 19.883 1.00 27.57 O ATOM 2482 NE2 GLN A 833 36.683 1.813 19.394 1.00 30.52 N ATOM 2483 HE22 GLN A 833 37.706 2.003 19.391 1.00 0.00 H ATOM 2484 HE21 GLN A 833 36.020 2.529 19.034 1.00 0.00 H ATOM 2485 H GLN A 833 36.680 -2.572 23.704 1.00 0.00 H ATOM 2486 N GLY A 834 39.336 -0.553 23.452 1.00 39.17 N ATOM 2487 CA GLY A 834 40.523 0.190 23.882 1.00 41.11 C ATOM 2488 C GLY A 834 41.767 -0.662 24.012 1.00 42.85 C ATOM 2489 O GLY A 834 42.839 -0.236 23.592 1.00 43.74 O ATOM 2490 H GLY A 834 38.487 -0.525 24.052 1.00 0.00 H ATOM 2491 N ASP A 835 41.615 -1.870 24.560 1.00 43.44 N ATOM 2492 CA ASP A 835 42.723 -2.841 24.618 1.00 47.51 C ATOM 2493 C ASP A 835 43.219 -3.202 23.211 1.00 47.89 C ATOM 2494 O ASP A 835 44.420 -3.215 22.957 1.00 48.91 O ATOM 2495 CB ASP A 835 42.302 -4.126 25.357 1.00 48.79 C ATOM 2496 CG ASP A 835 42.069 -3.914 26.861 1.00 48.64 C ATOM 2497 OD1 ASP A 835 42.245 -2.782 27.375 1.00 46.36 O ATOM 2498 OD2 ASP A 835 41.680 -4.901 27.532 1.00 49.20 O ATOM 2499 H ASP A 835 40.690 -2.133 24.957 1.00 0.00 H ATOM 2500 N LEU A 836 42.287 -3.479 22.301 1.00 47.35 N ATOM 2501 CA LEU A 836 42.642 -3.771 20.914 1.00 49.29 C ATOM 2502 C LEU A 836 43.349 -2.598 20.229 1.00 51.10 C ATOM 2503 O LEU A 836 44.276 -2.826 19.450 1.00 49.54 O ATOM 2504 CB LEU A 836 41.422 -4.242 20.093 1.00 48.08 C ATOM 2505 CG LEU A 836 40.792 -5.565 20.521 1.00 49.10 C ATOM 2506 CD1 LEU A 836 39.558 -5.911 19.694 1.00 47.32 C ATOM 2507 CD2 LEU A 836 41.799 -6.707 20.501 1.00 51.12 C ATOM 2508 H LEU A 836 41.286 -3.488 22.583 1.00 0.00 H ATOM 2509 N GLU A 837 42.920 -1.365 20.516 1.00 50.25 N ATOM 2510 CA GLU A 837 43.544 -0.162 19.925 1.00 52.90 C ATOM 2511 C GLU A 837 44.968 0.085 20.427 1.00 52.85 C ATOM 2512 O GLU A 837 45.827 0.509 19.658 1.00 52.19 O ATOM 2513 CB GLU A 837 42.661 1.075 20.121 1.00 53.43 C ATOM 2514 CG GLU A 837 41.485 1.088 19.150 1.00 57.76 C ATOM 2515 CD GLU A 837 40.481 2.206 19.384 1.00 59.11 C ATOM 2516 OE1 GLU A 837 40.250 2.595 20.550 1.00 57.04 O ATOM 2517 OE2 GLU A 837 39.891 2.670 18.373 1.00 69.09 O ATOM 2518 H GLU A 837 42.124 -1.248 21.175 1.00 0.00 H ATOM 2519 N LYS A 838 45.216 -0.216 21.699 1.00 54.77 N ATOM 2520 CA LYS A 838 46.570 -0.171 22.272 1.00 56.26 C ATOM 2521 C LYS A 838 47.495 -1.206 21.641 1.00 57.95 C ATOM 2522 O LYS A 838 48.639 -0.891 21.312 1.00 61.87 O ATOM 2523 CB LYS A 838 46.534 -0.377 23.786 1.00 56.69 C ATOM 2524 CG LYS A 838 45.954 0.793 24.565 1.00 55.00 C ATOM 2525 CD LYS A 838 46.058 0.540 26.059 1.00 56.74 C ATOM 2526 CE LYS A 838 45.152 1.456 26.856 1.00 55.92 C ATOM 2527 NZ LYS A 838 45.130 1.069 28.292 1.00 57.03 N ATOM 2528 HZ1 LYS A 838 44.780 0.094 28.382 1.00 0.00 H ATOM 2529 HZ2 LYS A 838 46.092 1.131 28.681 1.00 0.00 H ATOM 2530 HZ3 LYS A 838 44.502 1.713 28.814 1.00 0.00 H ATOM 2531 H LYS A 838 44.423 -0.494 22.311 1.00 0.00 H ATOM 2532 N ALA A 839 46.992 -2.424 21.452 1.00 56.88 N ATOM 2533 CA ALA A 839 47.745 -3.493 20.778 1.00 59.95 C ATOM 2534 C ALA A 839 48.162 -3.166 19.324 1.00 63.28 C ATOM 2535 O ALA A 839 49.182 -3.682 18.856 1.00 70.01 O ATOM 2536 CB ALA A 839 46.960 -4.803 20.827 1.00 57.92 C ATOM 2537 H ALA A 839 46.031 -2.627 21.794 1.00 0.00 H ATOM 2538 N MET A 840 47.400 -2.315 18.624 1.00 62.64 N ATOM 2539 CA MET A 840 47.747 -1.880 17.257 1.00 66.93 C ATOM 2540 C MET A 840 48.641 -0.634 17.232 1.00 67.92 C ATOM 2541 O MET A 840 48.982 -0.162 16.153 1.00 67.88 O ATOM 2542 CB MET A 840 46.522 -1.514 16.413 1.00 69.92 C ATOM 2543 CG MET A 840 45.400 -2.494 16.236 1.00 71.11 C ATOM 2544 SD MET A 840 43.845 -1.676 15.782 1.00 73.85 S ATOM 2545 CE MET A 840 44.492 -0.641 14.479 1.00 76.10 C ATOM 2546 H MET A 840 46.531 -1.947 19.061 1.00 0.00 H ATOM 2547 N GLY A 841 48.989 -0.089 18.399 1.00 69.66 N ATOM 2548 CA GLY A 841 49.847 1.093 18.496 1.00 73.71 C ATOM 2549 C GLY A 841 49.113 2.421 18.553 1.00 74.07 C ATOM 2550 O GLY A 841 49.744 3.464 18.695 1.00 73.40 O ATOM 2551 H GLY A 841 48.636 -0.522 19.276 1.00 0.00 H ATOM 2552 N ASN A 842 47.787 2.388 18.443 1.00 75.46 N ATOM 2553 CA ASN A 842 46.976 3.601 18.466 1.00 76.98 C ATOM 2554 C ASN A 842 46.658 3.994 19.899 1.00 76.67 C ATOM 2555 O ASN A 842 46.858 3.217 20.838 1.00 75.08 O ATOM 2556 CB ASN A 842 45.682 3.409 17.664 1.00 75.49 C ATOM 2557 CG ASN A 842 45.944 3.045 16.212 1.00 80.31 C ATOM 2558 OD1 ASN A 842 47.055 3.227 15.698 1.00 88.38 O ATOM 2559 ND2 ASN A 842 44.928 2.513 15.543 1.00 80.31 N ATOM 2560 HD22 ASN A 842 44.010 2.377 16.013 1.00 0.00 H ATOM 2561 HD21 ASN A 842 45.050 2.232 14.549 1.00 0.00 H ATOM 2562 H ASN A 842 47.314 1.468 18.337 1.00 0.00 H ATOM 2563 N ARG A 843 46.158 5.214 20.038 1.00 79.38 N ATOM 2564 CA ARG A 843 45.844 5.816 21.327 1.00 82.10 C ATOM 2565 C ARG A 843 44.320 5.918 21.448 1.00 74.32 C ATOM 2566 O ARG A 843 43.715 6.731 20.751 1.00 67.82 O ATOM 2567 CB ARG A 843 46.496 7.198 21.389 1.00 92.75 C ATOM 2568 CG ARG A 843 46.194 8.023 22.628 1.00 97.17 C ATOM 2569 CD ARG A 843 46.961 9.336 22.577 1.00103.21 C ATOM 2570 NE ARG A 843 46.493 10.273 23.597 1.00106.23 N ATOM 2571 CZ ARG A 843 46.785 10.211 24.898 1.00109.81 C ATOM 2572 NH1 ARG A 843 47.566 9.245 25.388 1.00112.69 N ATOM 2573 NH2 ARG A 843 46.287 11.129 25.726 1.00108.61 N ATOM 2574 HE ARG A 843 45.881 11.053 23.283 1.00 0.00 H ATOM 2575 HH12 ARG A 843 47.781 9.216 26.405 1.00 0.00 H ATOM 2576 HH11 ARG A 843 47.960 8.522 24.752 1.00 0.00 H ATOM 2577 HH22 ARG A 843 46.509 11.089 26.741 1.00 0.00 H ATOM 2578 HH21 ARG A 843 45.676 11.886 25.357 1.00 0.00 H ATOM 2579 H ARG A 843 45.980 5.772 19.179 1.00 0.00 H ATOM 2580 N PRO A 844 43.694 5.085 22.316 1.00 69.47 N ATOM 2581 CA PRO A 844 42.230 5.073 22.397 1.00 64.86 C ATOM 2582 C PRO A 844 41.686 6.326 23.070 1.00 64.41 C ATOM 2583 O PRO A 844 42.425 7.007 23.787 1.00 67.32 O ATOM 2584 CB PRO A 844 41.924 3.822 23.233 1.00 62.08 C ATOM 2585 CG PRO A 844 43.150 3.564 24.027 1.00 64.80 C ATOM 2586 CD PRO A 844 44.308 4.116 23.250 1.00 69.07 C ATOM 2587 N MET A 845 40.409 6.620 22.830 1.00 62.58 N ATOM 2588 CA MET A 845 39.716 7.724 23.501 1.00 65.21 C ATOM 2589 C MET A 845 39.700 7.445 24.993 1.00 62.84 C ATOM 2590 O MET A 845 39.778 6.291 25.412 1.00 61.91 O ATOM 2591 CB MET A 845 38.260 7.828 23.061 1.00 69.26 C ATOM 2592 CG MET A 845 37.988 8.096 21.590 1.00 76.92 C ATOM 2593 SD MET A 845 36.365 7.422 21.127 1.00 86.61 S ATOM 2594 CE MET A 845 35.261 8.496 22.042 1.00 81.45 C ATOM 2595 H MET A 845 39.884 6.045 22.141 1.00 0.00 H ATOM 2596 N GLU A 846 39.605 8.501 25.793 1.00 67.50 N ATOM 2597 CA GLU A 846 39.633 8.371 27.257 1.00 71.33 C ATOM 2598 C GLU A 846 38.589 7.357 27.729 1.00 63.26 C ATOM 2599 O GLU A 846 38.902 6.484 28.540 1.00 61.62 O ATOM 2600 CB GLU A 846 39.438 9.739 27.933 1.00 77.16 C ATOM 2601 CG GLU A 846 39.295 9.685 29.451 1.00 82.25 C ATOM 2602 CD GLU A 846 39.644 10.999 30.133 1.00 91.26 C ATOM 2603 OE1 GLU A 846 38.726 11.656 30.672 1.00 92.30 O ATOM 2604 OE2 GLU A 846 40.840 11.372 30.125 1.00 94.42 O ATOM 2605 H GLU A 846 39.508 9.447 25.372 1.00 0.00 H ATOM 2606 N MET A 847 37.385 7.444 27.176 1.00 55.17 N ATOM 2607 CA MET A 847 36.300 6.535 27.555 1.00 51.02 C ATOM 2608 C MET A 847 36.483 5.082 27.152 1.00 45.92 C ATOM 2609 O MET A 847 35.781 4.222 27.659 1.00 41.51 O ATOM 2610 CB MET A 847 34.935 7.049 27.068 1.00 53.28 C ATOM 2611 CG MET A 847 34.742 7.198 25.568 1.00 57.82 C ATOM 2612 SD MET A 847 33.014 7.589 25.161 1.00 59.37 S ATOM 2613 CE MET A 847 32.517 6.125 24.261 1.00 56.68 C ATOM 2614 H MET A 847 37.208 8.174 26.457 1.00 0.00 H ATOM 2615 N MET A 848 37.393 4.808 26.226 1.00 46.15 N ATOM 2616 CA MET A 848 37.731 3.433 25.841 1.00 46.56 C ATOM 2617 C MET A 848 38.922 2.881 26.643 1.00 44.22 C ATOM 2618 O MET A 848 39.218 1.693 26.556 1.00 41.13 O ATOM 2619 CB MET A 848 38.072 3.375 24.342 1.00 49.25 C ATOM 2620 CG MET A 848 37.023 3.939 23.394 1.00 51.84 C ATOM 2621 SD MET A 848 35.719 2.761 23.103 1.00 54.70 S ATOM 2622 CE MET A 848 34.602 3.680 22.048 1.00 52.87 C ATOM 2623 H MET A 848 37.884 5.596 25.757 1.00 0.00 H ATOM 2624 N ASP A 849 39.624 3.744 27.378 1.00 45.26 N ATOM 2625 CA ASP A 849 40.882 3.385 28.046 1.00 47.23 C ATOM 2626 C ASP A 849 40.583 3.004 29.484 1.00 45.65 C ATOM 2627 O ASP A 849 40.265 3.861 30.299 1.00 44.53 O ATOM 2628 CB ASP A 849 41.861 4.574 27.989 1.00 49.46 C ATOM 2629 CG ASP A 849 43.307 4.188 28.330 1.00 53.71 C ATOM 2630 OD1 ASP A 849 43.547 3.167 29.026 1.00 55.88 O ATOM 2631 OD2 ASP A 849 44.221 4.913 27.871 1.00 55.82 O ATOM 2632 H ASP A 849 39.265 4.714 27.483 1.00 0.00 H ATOM 2633 N ARG A 850 40.717 1.723 29.809 1.00 45.36 N ATOM 2634 CA ARG A 850 40.418 1.257 31.166 1.00 46.35 C ATOM 2635 C ARG A 850 41.339 1.843 32.256 1.00 50.02 C ATOM 2636 O ARG A 850 40.992 1.760 33.430 1.00 50.47 O ATOM 2637 CB ARG A 850 40.417 -0.279 31.246 1.00 46.29 C ATOM 2638 CG ARG A 850 41.777 -0.943 31.083 1.00 47.16 C ATOM 2639 CD ARG A 850 41.724 -2.435 31.369 1.00 47.51 C ATOM 2640 NE ARG A 850 41.088 -3.219 30.293 1.00 45.55 N ATOM 2641 CZ ARG A 850 39.856 -3.739 30.313 1.00 42.03 C ATOM 2642 NH1 ARG A 850 39.026 -3.554 31.328 1.00 41.32 N ATOM 2643 NH2 ARG A 850 39.436 -4.451 29.282 1.00 40.69 N ATOM 2644 HE ARG A 850 41.653 -3.383 29.435 1.00 0.00 H ATOM 2645 HH12 ARG A 850 38.075 -3.975 31.306 1.00 0.00 H ATOM 2646 HH11 ARG A 850 39.325 -2.987 32.147 1.00 0.00 H ATOM 2647 HH22 ARG A 850 38.480 -4.860 29.287 1.00 0.00 H ATOM 2648 HH21 ARG A 850 40.062 -4.603 28.465 1.00 0.00 H ATOM 2649 H ARG A 850 41.038 1.042 29.091 1.00 0.00 H ATOM 2650 N GLU A 851 42.500 2.393 31.876 1.00 51.91 N ATOM 2651 CA GLU A 851 43.418 3.037 32.831 1.00 56.37 C ATOM 2652 C GLU A 851 43.111 4.520 33.050 1.00 55.55 C ATOM 2653 O GLU A 851 43.646 5.106 33.970 1.00 60.48 O ATOM 2654 CB GLU A 851 44.895 2.917 32.390 1.00 59.51 C ATOM 2655 CG GLU A 851 45.391 1.583 31.829 1.00 61.98 C ATOM 2656 CD GLU A 851 45.230 0.401 32.776 1.00 64.30 C ATOM 2657 OE1 GLU A 851 45.052 0.598 33.996 1.00 64.66 O ATOM 2658 OE2 GLU A 851 45.287 -0.746 32.286 1.00 65.29 O ATOM 2659 H GLU A 851 42.763 2.364 30.870 1.00 0.00 H ATOM 2660 N LYS A 852 42.294 5.135 32.195 1.00 57.99 N ATOM 2661 CA LYS A 852 41.950 6.573 32.314 1.00 59.12 C ATOM 2662 C LYS A 852 40.464 6.887 32.511 1.00 56.40 C ATOM 2663 O LYS A 852 40.130 7.917 33.105 1.00 53.50 O ATOM 2664 CB LYS A 852 42.460 7.321 31.087 1.00 63.36 C ATOM 2665 CG LYS A 852 43.971 7.358 31.026 1.00 70.59 C ATOM 2666 CD LYS A 852 44.467 7.965 29.732 1.00 76.98 C ATOM 2667 CE LYS A 852 45.975 8.159 29.792 1.00 80.45 C ATOM 2668 NZ LYS A 852 46.500 8.667 28.497 1.00 83.73 N ATOM 2669 HZ1 LYS A 852 46.281 7.984 27.744 1.00 0.00 H ATOM 2670 HZ2 LYS A 852 46.054 9.581 28.278 1.00 0.00 H ATOM 2671 HZ3 LYS A 852 47.530 8.790 28.566 1.00 0.00 H ATOM 2672 H LYS A 852 41.882 4.585 31.414 1.00 0.00 H ATOM 2673 N ALA A 853 39.585 6.027 31.989 1.00 52.37 N ATOM 2674 CA ALA A 853 38.144 6.218 32.114 1.00 50.41 C ATOM 2675 C ALA A 853 37.732 6.223 33.588 1.00 48.20 C ATOM 2676 O ALA A 853 38.065 5.303 34.331 1.00 47.53 O ATOM 2677 CB ALA A 853 37.385 5.124 31.368 1.00 47.29 C ATOM 2678 H ALA A 853 39.939 5.194 31.477 1.00 0.00 H ATOM 2679 N TYR A 854 37.041 7.282 33.989 1.00 44.90 N ATOM 2680 CA TYR A 854 36.434 7.381 35.302 1.00 45.02 C ATOM 2681 C TYR A 854 34.940 7.306 35.054 1.00 43.06 C ATOM 2682 O TYR A 854 34.339 8.253 34.541 1.00 41.47 O ATOM 2683 CB TYR A 854 36.830 8.693 35.972 1.00 46.83 C ATOM 2684 CG TYR A 854 36.243 8.915 37.350 1.00 49.58 C ATOM 2685 CD1 TYR A 854 36.417 7.977 38.371 1.00 50.94 C ATOM 2686 CD2 TYR A 854 35.553 10.092 37.655 1.00 51.20 C ATOM 2687 CE1 TYR A 854 35.901 8.200 39.644 1.00 52.69 C ATOM 2688 CE2 TYR A 854 35.042 10.322 38.924 1.00 53.10 C ATOM 2689 CZ TYR A 854 35.217 9.368 39.908 1.00 54.39 C ATOM 2690 OH TYR A 854 34.725 9.594 41.164 1.00 61.15 O ATOM 2691 HH TYR A 854 34.934 8.819 41.743 1.00 0.00 H ATOM 2692 H TYR A 854 36.929 8.079 33.330 1.00 0.00 H ATOM 2693 N ILE A 855 34.355 6.164 35.407 1.00 41.95 N ATOM 2694 CA ILE A 855 32.989 5.816 35.010 1.00 41.26 C ATOM 2695 C ILE A 855 31.912 6.823 35.452 1.00 41.64 C ATOM 2696 O ILE A 855 31.080 7.180 34.645 1.00 41.69 O ATOM 2697 CB ILE A 855 32.650 4.356 35.399 1.00 41.15 C ATOM 2698 CG1 ILE A 855 33.315 3.405 34.398 1.00 40.25 C ATOM 2699 CG2 ILE A 855 31.147 4.106 35.415 1.00 41.76 C ATOM 2700 CD1 ILE A 855 33.220 1.931 34.738 1.00 41.58 C ATOM 2701 H ILE A 855 34.891 5.490 35.990 1.00 0.00 H ATOM 2702 N PRO A 856 31.925 7.283 36.709 1.00 44.69 N ATOM 2703 CA PRO A 856 30.910 8.267 37.106 1.00 47.02 C ATOM 2704 C PRO A 856 30.843 9.548 36.252 1.00 48.42 C ATOM 2705 O PRO A 856 29.759 9.974 35.886 1.00 48.53 O ATOM 2706 CB PRO A 856 31.303 8.601 38.540 1.00 48.87 C ATOM 2707 CG PRO A 856 31.895 7.331 39.037 1.00 48.82 C ATOM 2708 CD PRO A 856 32.689 6.803 37.875 1.00 46.79 C ATOM 2709 N GLU A 857 31.995 10.119 35.914 1.00 50.66 N ATOM 2710 CA GLU A 857 32.074 11.307 35.046 1.00 53.28 C ATOM 2711 C GLU A 857 31.512 11.018 33.637 1.00 48.63 C ATOM 2712 O GLU A 857 30.746 11.800 33.088 1.00 46.67 O ATOM 2713 CB GLU A 857 33.533 11.785 34.952 1.00 58.94 C ATOM 2714 CG GLU A 857 33.749 13.273 34.699 1.00 65.59 C ATOM 2715 CD GLU A 857 35.238 13.639 34.727 1.00 71.32 C ATOM 2716 OE1 GLU A 857 35.996 13.083 33.896 1.00 73.82 O ATOM 2717 OE2 GLU A 857 35.659 14.472 35.572 1.00 75.31 O ATOM 2718 H GLU A 857 32.879 9.709 36.278 1.00 0.00 H ATOM 2719 N LEU A 858 31.903 9.884 33.069 1.00 45.55 N ATOM 2720 CA LEU A 858 31.442 9.480 31.749 1.00 42.61 C ATOM 2721 C LEU A 858 29.960 9.168 31.699 1.00 41.15 C ATOM 2722 O LEU A 858 29.308 9.564 30.739 1.00 40.97 O ATOM 2723 CB LEU A 858 32.237 8.288 31.233 1.00 41.99 C ATOM 2724 CG LEU A 858 33.731 8.561 31.030 1.00 44.36 C ATOM 2725 CD1 LEU A 858 34.458 7.244 30.798 1.00 44.26 C ATOM 2726 CD2 LEU A 858 33.978 9.530 29.879 1.00 44.72 C ATOM 2727 H LEU A 858 32.560 9.264 33.584 1.00 0.00 H ATOM 2728 N GLN A 859 29.435 8.452 32.703 1.00 40.59 N ATOM 2729 CA GLN A 859 27.987 8.151 32.763 1.00 40.39 C ATOM 2730 C GLN A 859 27.173 9.411 32.904 1.00 40.19 C ATOM 2731 O GLN A 859 26.191 9.583 32.212 1.00 41.38 O ATOM 2732 CB GLN A 859 27.600 7.247 33.946 1.00 41.36 C ATOM 2733 CG GLN A 859 27.669 5.760 33.709 1.00 41.33 C ATOM 2734 CD GLN A 859 26.878 5.295 32.516 1.00 40.97 C ATOM 2735 OE1 GLN A 859 27.448 5.013 31.471 1.00 39.30 O ATOM 2736 NE2 GLN A 859 25.565 5.219 32.653 1.00 45.62 N ATOM 2737 HE22 GLN A 859 25.122 5.468 33.560 1.00 0.00 H ATOM 2738 HE21 GLN A 859 24.976 4.910 31.854 1.00 0.00 H ATOM 2739 H GLN A 859 30.059 8.100 33.457 1.00 0.00 H ATOM 2740 N ILE A 860 27.576 10.271 33.827 1.00 41.69 N ATOM 2741 CA ILE A 860 26.874 11.525 34.073 1.00 42.80 C ATOM 2742 C ILE A 860 26.885 12.417 32.829 1.00 41.30 C ATOM 2743 O ILE A 860 25.873 13.015 32.514 1.00 42.34 O ATOM 2744 CB ILE A 860 27.416 12.244 35.341 1.00 44.68 C ATOM 2745 CG1 ILE A 860 26.978 11.469 36.597 1.00 45.90 C ATOM 2746 CG2 ILE A 860 26.922 13.688 35.429 1.00 46.25 C ATOM 2747 CD1 ILE A 860 27.700 11.860 37.877 1.00 47.00 C ATOM 2748 H ILE A 860 28.419 10.045 34.393 1.00 0.00 H ATOM 2749 N SER A 861 28.005 12.471 32.114 1.00 40.97 N ATOM 2750 CA SER A 861 28.069 13.187 30.835 1.00 42.77 C ATOM 2751 C SER A 861 27.124 12.592 29.793 1.00 40.06 C ATOM 2752 O SER A 861 26.314 13.302 29.210 1.00 40.57 O ATOM 2753 CB SER A 861 29.475 13.231 30.255 1.00 43.20 C ATOM 2754 OG SER A 861 30.151 14.367 30.766 1.00 50.71 O ATOM 2755 HG SER A 861 31.067 14.401 30.392 1.00 0.00 H ATOM 2756 H SER A 861 28.857 11.993 32.471 1.00 0.00 H ATOM 2757 N PHE A 862 27.231 11.290 29.589 1.00 37.51 N ATOM 2758 CA PHE A 862 26.351 10.595 28.693 1.00 37.22 C ATOM 2759 C PHE A 862 24.904 10.917 29.039 1.00 40.18 C ATOM 2760 O PHE A 862 24.118 11.224 28.158 1.00 39.38 O ATOM 2761 CB PHE A 862 26.582 9.085 28.738 1.00 35.68 C ATOM 2762 CG PHE A 862 25.477 8.303 28.095 1.00 35.16 C ATOM 2763 CD1 PHE A 862 25.344 8.283 26.712 1.00 35.48 C ATOM 2764 CD2 PHE A 862 24.529 7.637 28.875 1.00 35.02 C ATOM 2765 CE1 PHE A 862 24.300 7.583 26.111 1.00 35.00 C ATOM 2766 CE2 PHE A 862 23.498 6.928 28.288 1.00 34.43 C ATOM 2767 CZ PHE A 862 23.380 6.900 26.907 1.00 34.47 C ATOM 2768 H PHE A 862 27.970 10.757 30.090 1.00 0.00 H ATOM 2769 N MET A 863 24.553 10.868 30.317 1.00 43.47 N ATOM 2770 CA MET A 863 23.167 11.091 30.707 1.00 47.49 C ATOM 2771 C MET A 863 22.705 12.544 30.613 1.00 47.19 C ATOM 2772 O MET A 863 21.611 12.778 30.131 1.00 48.31 O ATOM 2773 CB MET A 863 22.885 10.459 32.068 1.00 52.71 C ATOM 2774 CG MET A 863 23.015 8.949 31.944 1.00 57.36 C ATOM 2775 SD MET A 863 22.471 8.036 33.371 1.00 69.73 S ATOM 2776 CE MET A 863 20.725 7.969 33.012 1.00 64.99 C ATOM 2777 H MET A 863 25.270 10.670 31.044 1.00 0.00 H ATOM 2778 N GLU A 864 23.516 13.504 31.051 1.00 48.43 N ATOM 2779 CA GLU A 864 23.159 14.929 30.920 1.00 48.93 C ATOM 2780 C GLU A 864 23.104 15.400 29.470 1.00 45.32 C ATOM 2781 O GLU A 864 22.267 16.217 29.134 1.00 45.28 O ATOM 2782 CB GLU A 864 24.133 15.844 31.680 1.00 54.01 C ATOM 2783 CG GLU A 864 23.971 15.882 33.192 1.00 60.01 C ATOM 2784 CD GLU A 864 24.746 17.019 33.866 1.00 65.45 C ATOM 2785 OE1 GLU A 864 24.259 17.552 34.886 1.00 68.51 O ATOM 2786 OE2 GLU A 864 25.842 17.380 33.384 1.00 66.65 O ATOM 2787 H GLU A 864 24.420 13.244 31.495 1.00 0.00 H ATOM 2788 N HIS A 865 24.019 14.915 28.631 1.00 41.68 N ATOM 2789 CA HIS A 865 24.248 15.494 27.300 1.00 41.32 C ATOM 2790 C HIS A 865 23.662 14.732 26.119 1.00 41.50 C ATOM 2791 O HIS A 865 23.469 15.317 25.054 1.00 42.23 O ATOM 2792 CB HIS A 865 25.738 15.703 27.081 1.00 39.97 C ATOM 2793 CG HIS A 865 26.361 16.635 28.076 1.00 40.63 C ATOM 2794 ND1 HIS A 865 26.243 18.002 27.997 1.00 42.35 N ATOM 2795 CD2 HIS A 865 27.102 16.390 29.182 1.00 40.40 C ATOM 2796 CE1 HIS A 865 26.892 18.561 29.005 1.00 43.86 C ATOM 2797 NE2 HIS A 865 27.425 17.604 29.735 1.00 42.75 N ATOM 2798 H HIS A 865 24.591 14.099 28.929 1.00 0.00 H ATOM 2799 N ILE A 866 23.360 13.446 26.314 1.00 41.78 N ATOM 2800 CA ILE A 866 22.824 12.579 25.265 1.00 40.52 C ATOM 2801 C ILE A 866 21.417 12.064 25.662 1.00 41.30 C ATOM 2802 O ILE A 866 20.422 12.406 25.010 1.00 43.26 O ATOM 2803 CB ILE A 866 23.811 11.414 24.938 1.00 40.27 C ATOM 2804 CG1 ILE A 866 25.143 11.910 24.320 1.00 41.38 C ATOM 2805 CG2 ILE A 866 23.176 10.392 24.007 1.00 40.04 C ATOM 2806 CD1 ILE A 866 24.970 12.886 23.163 1.00 45.35 C ATOM 2807 H ILE A 866 23.514 13.040 27.259 1.00 0.00 H ATOM 2808 N ALA A 867 21.328 11.266 26.725 1.00 40.34 N ATOM 2809 CA ALA A 867 20.067 10.618 27.121 1.00 40.30 C ATOM 2810 C ALA A 867 18.956 11.586 27.563 1.00 41.31 C ATOM 2811 O ALA A 867 17.884 11.571 27.000 1.00 41.00 O ATOM 2812 CB ALA A 867 20.316 9.592 28.216 1.00 41.34 C ATOM 2813 H ALA A 867 22.180 11.095 27.296 1.00 0.00 H ATOM 2814 N MET A 868 19.217 12.426 28.558 1.00 43.52 N ATOM 2815 CA MET A 868 18.180 13.319 29.072 1.00 45.83 C ATOM 2816 C MET A 868 17.569 14.254 28.021 1.00 47.10 C ATOM 2817 O MET A 868 16.365 14.441 28.040 1.00 49.44 O ATOM 2818 CB MET A 868 18.655 14.121 30.292 1.00 48.61 C ATOM 2819 CG MET A 868 18.703 13.290 31.562 1.00 49.71 C ATOM 2820 SD MET A 868 19.499 14.109 32.946 1.00 53.24 S ATOM 2821 CE MET A 868 18.466 15.560 33.195 1.00 56.06 C ATOM 2822 H MET A 868 20.169 12.449 28.976 1.00 0.00 H ATOM 2823 N PRO A 869 18.375 14.855 27.118 1.00 46.25 N ATOM 2824 CA PRO A 869 17.740 15.705 26.093 1.00 46.01 C ATOM 2825 C PRO A 869 16.870 14.932 25.115 1.00 45.34 C ATOM 2826 O PRO A 869 15.881 15.471 24.636 1.00 48.77 O ATOM 2827 CB PRO A 869 18.931 16.366 25.384 1.00 45.30 C ATOM 2828 CG PRO A 869 19.997 16.391 26.419 1.00 45.72 C ATOM 2829 CD PRO A 869 19.825 15.095 27.177 1.00 44.84 C ATOM 2830 N ILE A 870 17.232 13.689 24.811 1.00 43.26 N ATOM 2831 CA ILE A 870 16.372 12.824 24.000 1.00 41.52 C ATOM 2832 C ILE A 870 14.995 12.666 24.664 1.00 43.85 C ATOM 2833 O ILE A 870 13.978 12.887 24.015 1.00 43.74 O ATOM 2834 CB ILE A 870 17.056 11.476 23.668 1.00 38.77 C ATOM 2835 CG1 ILE A 870 18.033 11.691 22.508 1.00 38.79 C ATOM 2836 CG2 ILE A 870 16.055 10.390 23.294 1.00 37.95 C ATOM 2837 CD1 ILE A 870 19.090 10.614 22.357 1.00 36.78 C ATOM 2838 H ILE A 870 18.143 13.324 25.156 1.00 0.00 H ATOM 2839 N TYR A 871 14.960 12.319 25.949 1.00 44.27 N ATOM 2840 CA TYR A 871 13.677 12.116 26.636 1.00 44.86 C ATOM 2841 C TYR A 871 12.944 13.402 27.004 1.00 47.66 C ATOM 2842 O TYR A 871 11.730 13.383 27.174 1.00 46.03 O ATOM 2843 CB TYR A 871 13.846 11.179 27.835 1.00 44.60 C ATOM 2844 CG TYR A 871 14.221 9.801 27.358 1.00 41.39 C ATOM 2845 CD1 TYR A 871 13.255 8.935 26.857 1.00 41.55 C ATOM 2846 CD2 TYR A 871 15.549 9.395 27.333 1.00 39.04 C ATOM 2847 CE1 TYR A 871 13.600 7.681 26.375 1.00 40.95 C ATOM 2848 CE2 TYR A 871 15.906 8.148 26.873 1.00 38.80 C ATOM 2849 CZ TYR A 871 14.930 7.295 26.386 1.00 39.98 C ATOM 2850 OH TYR A 871 15.297 6.059 25.929 1.00 41.91 O ATOM 2851 HH TYR A 871 14.494 5.572 25.617 1.00 0.00 H ATOM 2852 H TYR A 871 15.850 12.190 26.472 1.00 0.00 H ATOM 2853 N LYS A 872 13.685 14.500 27.130 1.00 49.75 N ATOM 2854 CA LYS A 872 13.101 15.834 27.269 1.00 54.02 C ATOM 2855 C LYS A 872 12.351 16.187 25.992 1.00 54.71 C ATOM 2856 O LYS A 872 11.244 16.717 26.068 1.00 55.70 O ATOM 2857 CB LYS A 872 14.180 16.894 27.566 1.00 57.26 C ATOM 2858 CG LYS A 872 13.752 18.361 27.454 1.00 62.14 C ATOM 2859 CD LYS A 872 13.116 18.906 28.728 1.00 67.44 C ATOM 2860 CE LYS A 872 14.168 19.323 29.754 1.00 69.80 C ATOM 2861 NZ LYS A 872 13.651 20.327 30.731 1.00 75.66 N ATOM 2862 HZ1 LYS A 872 13.346 21.180 30.221 1.00 0.00 H ATOM 2863 HZ2 LYS A 872 12.843 19.923 31.247 1.00 0.00 H ATOM 2864 HZ3 LYS A 872 14.405 20.575 31.403 1.00 0.00 H ATOM 2865 H LYS A 872 14.721 14.406 27.130 1.00 0.00 H ATOM 2866 N LEU A 873 12.965 15.929 24.835 1.00 51.60 N ATOM 2867 CA LEU A 873 12.307 16.166 23.549 1.00 51.75 C ATOM 2868 C LEU A 873 11.075 15.277 23.386 1.00 52.35 C ATOM 2869 O LEU A 873 10.023 15.746 22.955 1.00 53.44 O ATOM 2870 CB LEU A 873 13.265 15.960 22.371 1.00 49.15 C ATOM 2871 CG LEU A 873 14.333 17.032 22.155 1.00 49.40 C ATOM 2872 CD1 LEU A 873 15.346 16.543 21.139 1.00 47.91 C ATOM 2873 CD2 LEU A 873 13.729 18.340 21.697 1.00 53.07 C ATOM 2874 H LEU A 873 13.934 15.551 24.848 1.00 0.00 H ATOM 2875 N LEU A 874 11.200 14.008 23.764 1.00 50.38 N ATOM 2876 CA LEU A 874 10.060 13.094 23.751 1.00 50.31 C ATOM 2877 C LEU A 874 8.907 13.585 24.649 1.00 53.95 C ATOM 2878 O LEU A 874 7.748 13.510 24.266 1.00 53.88 O ATOM 2879 CB LEU A 874 10.499 11.687 24.156 1.00 47.89 C ATOM 2880 CG LEU A 874 9.557 10.547 23.781 1.00 46.50 C ATOM 2881 CD1 LEU A 874 9.572 10.307 22.282 1.00 45.50 C ATOM 2882 CD2 LEU A 874 9.944 9.281 24.524 1.00 45.14 C ATOM 2883 H LEU A 874 12.129 13.659 24.075 1.00 0.00 H ATOM 2884 N GLN A 875 9.244 14.090 25.834 1.00 56.20 N ATOM 2885 CA GLN A 875 8.280 14.687 26.767 1.00 60.81 C ATOM 2886 C GLN A 875 7.557 15.918 26.177 1.00 62.18 C ATOM 2887 O GLN A 875 6.345 16.058 26.323 1.00 62.04 O ATOM 2888 CB GLN A 875 9.006 15.067 28.065 1.00 64.53 C ATOM 2889 CG GLN A 875 8.171 15.720 29.158 1.00 71.14 C ATOM 2890 CD GLN A 875 9.051 16.270 30.261 1.00 75.31 C ATOM 2891 OE1 GLN A 875 9.702 17.296 30.082 1.00 81.24 O ATOM 2892 NE2 GLN A 875 9.097 15.585 31.395 1.00 76.13 N ATOM 2893 HE22 GLN A 875 8.529 14.721 31.504 1.00 0.00 H ATOM 2894 HE21 GLN A 875 9.701 15.912 32.176 1.00 0.00 H ATOM 2895 H GLN A 875 10.245 14.060 26.114 1.00 0.00 H ATOM 2896 N ASP A 876 8.314 16.794 25.520 1.00 62.12 N ATOM 2897 CA ASP A 876 7.772 18.007 24.903 1.00 66.39 C ATOM 2898 C ASP A 876 6.740 17.697 23.807 1.00 66.02 C ATOM 2899 O ASP A 876 5.795 18.456 23.619 1.00 67.41 O ATOM 2900 CB ASP A 876 8.902 18.879 24.314 1.00 68.13 C ATOM 2901 CG ASP A 876 9.832 19.494 25.384 1.00 70.49 C ATOM 2902 OD1 ASP A 876 9.382 19.829 26.508 1.00 72.66 O ATOM 2903 OD2 ASP A 876 11.038 19.655 25.071 1.00 70.96 O ATOM 2904 H ASP A 876 9.334 16.609 25.441 1.00 0.00 H ATOM 2905 N LEU A 877 6.948 16.596 23.084 1.00 64.06 N ATOM 2906 CA LEU A 877 6.030 16.137 22.038 1.00 63.44 C ATOM 2907 C LEU A 877 4.867 15.307 22.587 1.00 64.44 C ATOM 2908 O LEU A 877 3.737 15.466 22.127 1.00 67.56 O ATOM 2909 CB LEU A 877 6.794 15.329 20.975 1.00 60.24 C ATOM 2910 CG LEU A 877 7.828 16.140 20.186 1.00 60.75 C ATOM 2911 CD1 LEU A 877 8.841 15.234 19.524 1.00 59.08 C ATOM 2912 CD2 LEU A 877 7.159 17.027 19.153 1.00 63.47 C ATOM 2913 H LEU A 877 7.804 16.036 23.272 1.00 0.00 H ATOM 2914 N PHE A 878 5.156 14.406 23.528 1.00 64.27 N ATOM 2915 CA PHE A 878 4.153 13.539 24.166 1.00 65.53 C ATOM 2916 C PHE A 878 4.175 13.721 25.685 1.00 68.75 C ATOM 2917 O PHE A 878 5.082 13.224 26.350 1.00 66.18 O ATOM 2918 CB PHE A 878 4.430 12.067 23.864 1.00 62.24 C ATOM 2919 CG PHE A 878 4.705 11.777 22.424 1.00 61.84 C ATOM 2920 CD1 PHE A 878 5.986 11.921 21.912 1.00 60.37 C ATOM 2921 CD2 PHE A 878 3.703 11.313 21.589 1.00 62.81 C ATOM 2922 CE1 PHE A 878 6.265 11.632 20.589 1.00 59.54 C ATOM 2923 CE2 PHE A 878 3.973 11.021 20.263 1.00 62.46 C ATOM 2924 CZ PHE A 878 5.255 11.179 19.760 1.00 60.40 C ATOM 2925 H PHE A 878 6.147 14.311 23.828 1.00 0.00 H ATOM 2926 N PRO A 879 3.173 14.418 26.251 1.00 75.24 N ATOM 2927 CA PRO A 879 3.117 14.580 27.715 1.00 78.33 C ATOM 2928 C PRO A 879 3.115 13.282 28.553 1.00 77.19 C ATOM 2929 O PRO A 879 3.636 13.278 29.667 1.00 77.56 O ATOM 2930 CB PRO A 879 1.818 15.371 27.921 1.00 82.88 C ATOM 2931 CG PRO A 879 1.686 16.176 26.673 1.00 82.33 C ATOM 2932 CD PRO A 879 2.178 15.274 25.574 1.00 78.08 C ATOM 2933 N LYS A 880 2.571 12.195 28.006 1.00 76.81 N ATOM 2934 CA LYS A 880 2.577 10.879 28.679 1.00 76.31 C ATOM 2935 C LYS A 880 3.966 10.209 28.783 1.00 68.93 C ATOM 2936 O LYS A 880 4.106 9.206 29.482 1.00 67.52 O ATOM 2937 CB LYS A 880 1.612 9.916 27.973 1.00 79.43 C ATOM 2938 CG LYS A 880 0.180 10.404 27.957 1.00 85.42 C ATOM 2939 CD LYS A 880 -0.805 9.312 27.584 1.00 88.28 C ATOM 2940 CE LYS A 880 -2.222 9.877 27.611 1.00 94.85 C ATOM 2941 NZ LYS A 880 -3.264 8.827 27.475 1.00 95.85 N ATOM 2942 HZ1 LYS A 880 -3.137 8.330 26.571 1.00 0.00 H ATOM 2943 HZ2 LYS A 880 -3.177 8.150 28.260 1.00 0.00 H ATOM 2944 HZ3 LYS A 880 -4.205 9.269 27.500 1.00 0.00 H ATOM 2945 H LYS A 880 2.125 12.276 27.070 1.00 0.00 H ATOM 2946 N ALA A 881 4.963 10.748 28.074 1.00 63.27 N ATOM 2947 CA ALA A 881 6.373 10.340 28.219 1.00 59.88 C ATOM 2948 C ALA A 881 7.122 11.098 29.325 1.00 60.58 C ATOM 2949 O ALA A 881 8.335 10.965 29.438 1.00 59.63 O ATOM 2950 CB ALA A 881 7.106 10.503 26.887 1.00 55.00 C ATOM 2951 H ALA A 881 4.733 11.493 27.385 1.00 0.00 H ATOM 2952 N ALA A 882 6.417 11.891 30.130 1.00 64.09 N ATOM 2953 CA ALA A 882 7.042 12.605 31.235 1.00 66.38 C ATOM 2954 C ALA A 882 7.679 11.665 32.258 1.00 66.66 C ATOM 2955 O ALA A 882 8.753 11.963 32.777 1.00 67.50 O ATOM 2956 CB ALA A 882 6.039 13.535 31.915 1.00 70.53 C ATOM 2957 H ALA A 882 5.396 12.003 29.966 1.00 0.00 H ATOM 2958 N GLU A 883 7.024 10.539 32.541 1.00 67.70 N ATOM 2959 CA GLU A 883 7.578 9.529 33.456 1.00 68.44 C ATOM 2960 C GLU A 883 8.892 8.896 32.945 1.00 64.58 C ATOM 2961 O GLU A 883 9.711 8.448 33.751 1.00 64.03 O ATOM 2962 CB GLU A 883 6.542 8.442 33.801 1.00 71.73 C ATOM 2963 CG GLU A 883 6.125 7.520 32.654 1.00 71.40 C ATOM 2964 CD GLU A 883 5.216 6.384 33.114 1.00 74.84 C ATOM 2965 OE1 GLU A 883 5.703 5.478 33.824 1.00 74.37 O ATOM 2966 OE2 GLU A 883 4.014 6.388 32.758 1.00 77.93 O ATOM 2967 H GLU A 883 6.096 10.370 32.103 1.00 0.00 H ATOM 2968 N LEU A 884 9.094 8.880 31.623 1.00 60.25 N ATOM 2969 CA LEU A 884 10.344 8.393 31.034 1.00 56.14 C ATOM 2970 C LEU A 884 11.499 9.336 31.314 1.00 55.71 C ATOM 2971 O LEU A 884 12.537 8.910 31.801 1.00 52.18 O ATOM 2972 CB LEU A 884 10.209 8.215 29.528 1.00 54.53 C ATOM 2973 CG LEU A 884 9.112 7.253 29.066 1.00 55.10 C ATOM 2974 CD1 LEU A 884 9.052 7.262 27.552 1.00 51.90 C ATOM 2975 CD2 LEU A 884 9.357 5.851 29.600 1.00 53.99 C ATOM 2976 H LEU A 884 8.341 9.224 30.994 1.00 0.00 H ATOM 2977 N TYR A 885 11.302 10.619 31.020 1.00 56.73 N ATOM 2978 CA TYR A 885 12.291 11.641 31.328 1.00 56.18 C ATOM 2979 C TYR A 885 12.620 11.689 32.823 1.00 60.42 C ATOM 2980 O TYR A 885 13.783 11.824 33.190 1.00 60.56 O ATOM 2981 CB TYR A 885 11.828 13.018 30.849 1.00 56.55 C ATOM 2982 CG TYR A 885 12.766 14.119 31.242 1.00 56.79 C ATOM 2983 CD1 TYR A 885 13.933 14.336 30.527 1.00 54.06 C ATOM 2984 CD2 TYR A 885 12.509 14.932 32.359 1.00 60.55 C ATOM 2985 CE1 TYR A 885 14.808 15.345 30.886 1.00 56.22 C ATOM 2986 CE2 TYR A 885 13.386 15.940 32.737 1.00 61.28 C ATOM 2987 CZ TYR A 885 14.535 16.142 31.993 1.00 59.72 C ATOM 2988 OH TYR A 885 15.426 17.129 32.339 1.00 61.97 O ATOM 2989 HH TYR A 885 16.182 17.128 31.700 1.00 0.00 H ATOM 2990 H TYR A 885 10.414 10.900 30.556 1.00 0.00 H ATOM 2991 N GLU A 886 11.607 11.596 33.677 1.00 66.09 N ATOM 2992 CA GLU A 886 11.821 11.640 35.136 1.00 71.85 C ATOM 2993 C GLU A 886 12.598 10.431 35.670 1.00 70.19 C ATOM 2994 O GLU A 886 13.314 10.559 36.657 1.00 72.24 O ATOM 2995 CB GLU A 886 10.497 11.814 35.891 1.00 77.39 C ATOM 2996 CG GLU A 886 9.904 13.217 35.759 1.00 84.02 C ATOM 2997 CD GLU A 886 8.380 13.240 35.818 1.00 92.84 C ATOM 2998 OE1 GLU A 886 7.786 12.433 36.570 1.00 99.58 O ATOM 2999 OE2 GLU A 886 7.764 14.080 35.121 1.00 97.64 O ATOM 3000 H GLU A 886 10.640 11.490 33.309 1.00 0.00 H ATOM 3001 N ARG A 887 12.476 9.277 35.016 1.00 68.18 N ATOM 3002 CA ARG A 887 13.229 8.088 35.427 1.00 66.39 C ATOM 3003 C ARG A 887 14.692 8.205 35.013 1.00 61.25 C ATOM 3004 O ARG A 887 15.580 7.801 35.769 1.00 61.92 O ATOM 3005 CB ARG A 887 12.616 6.796 34.871 1.00 68.53 C ATOM 3006 CG ARG A 887 12.253 5.790 35.955 1.00 75.88 C ATOM 3007 CD ARG A 887 11.168 4.834 35.521 1.00 79.87 C ATOM 3008 NE ARG A 887 10.128 4.815 36.557 1.00 92.07 N ATOM 3009 CZ ARG A 887 10.098 3.944 37.580 1.00 97.00 C ATOM 3010 NH1 ARG A 887 9.096 4.030 38.456 1.00 97.01 N ATOM 3011 NH2 ARG A 887 11.047 2.997 37.760 1.00 95.58 N ATOM 3012 HE ARG A 887 9.366 5.520 36.495 1.00 0.00 H ATOM 3013 HH12 ARG A 887 9.048 3.369 39.257 1.00 0.00 H ATOM 3014 HH11 ARG A 887 8.363 4.758 38.338 1.00 0.00 H ATOM 3015 HH22 ARG A 887 10.983 2.344 38.567 1.00 0.00 H ATOM 3016 HH21 ARG A 887 11.840 2.922 37.092 1.00 0.00 H ATOM 3017 H ARG A 887 11.835 9.218 34.199 1.00 0.00 H ATOM 3018 N VAL A 888 14.937 8.773 33.833 1.00 55.22 N ATOM 3019 CA VAL A 888 16.301 8.992 33.349 1.00 52.29 C ATOM 3020 C VAL A 888 17.014 9.997 34.248 1.00 52.83 C ATOM 3021 O VAL A 888 18.161 9.781 34.617 1.00 52.47 O ATOM 3022 CB VAL A 888 16.341 9.465 31.876 1.00 49.97 C ATOM 3023 CG1 VAL A 888 17.766 9.748 31.428 1.00 47.27 C ATOM 3024 CG2 VAL A 888 15.743 8.410 30.952 1.00 48.73 C ATOM 3025 H VAL A 888 14.136 9.069 33.239 1.00 0.00 H ATOM 3026 N ALA A 889 16.326 11.083 34.594 1.00 54.31 N ATOM 3027 CA ALA A 889 16.848 12.089 35.518 1.00 56.34 C ATOM 3028 C ALA A 889 17.119 11.509 36.900 1.00 57.38 C ATOM 3029 O ALA A 889 18.123 11.846 37.520 1.00 56.52 O ATOM 3030 CB ALA A 889 15.886 13.271 35.633 1.00 59.87 C ATOM 3031 H ALA A 889 15.378 11.222 34.190 1.00 0.00 H ATOM 3032 N SER A 890 16.206 10.675 37.390 1.00 58.54 N ATOM 3033 CA SER A 890 16.401 10.008 38.686 1.00 61.71 C ATOM 3034 C SER A 890 17.584 9.035 38.619 1.00 59.81 C ATOM 3035 O SER A 890 18.349 8.960 39.565 1.00 61.23 O ATOM 3036 CB SER A 890 15.133 9.341 39.215 1.00 64.12 C ATOM 3037 OG SER A 890 15.092 7.986 38.868 1.00 64.74 O ATOM 3038 HG SER A 890 15.108 7.898 37.882 1.00 0.00 H ATOM 3039 H SER A 890 15.338 10.491 36.847 1.00 0.00 H ATOM 3040 N ASN A 891 17.732 8.312 37.510 1.00 56.48 N ATOM 3041 CA ASN A 891 18.893 7.441 37.317 1.00 55.97 C ATOM 3042 C ASN A 891 20.200 8.224 37.255 1.00 56.77 C ATOM 3043 O ASN A 891 21.209 7.757 37.773 1.00 56.64 O ATOM 3044 CB ASN A 891 18.752 6.560 36.071 1.00 53.17 C ATOM 3045 CG ASN A 891 17.875 5.346 36.315 1.00 53.82 C ATOM 3046 OD1 ASN A 891 17.842 4.794 37.420 1.00 55.09 O ATOM 3047 ND2 ASN A 891 17.170 4.913 35.279 1.00 52.70 N ATOM 3048 HD22 ASN A 891 17.228 5.409 34.367 1.00 0.00 H ATOM 3049 HD21 ASN A 891 16.559 4.078 35.379 1.00 0.00 H ATOM 3050 H ASN A 891 17.008 8.367 36.766 1.00 0.00 H ATOM 3051 N ARG A 892 20.176 9.415 36.668 1.00 57.28 N ATOM 3052 CA ARG A 892 21.333 10.299 36.714 1.00 59.50 C ATOM 3053 C ARG A 892 21.681 10.807 38.120 1.00 59.98 C ATOM 3054 O ARG A 892 22.847 10.904 38.465 1.00 61.18 O ATOM 3055 CB ARG A 892 21.134 11.498 35.813 1.00 62.10 C ATOM 3056 CG ARG A 892 22.457 12.153 35.533 1.00 65.18 C ATOM 3057 CD ARG A 892 22.337 13.370 34.712 1.00 69.48 C ATOM 3058 NE ARG A 892 21.453 14.357 35.252 1.00 75.23 N ATOM 3059 CZ ARG A 892 21.708 15.077 36.327 1.00 75.37 C ATOM 3060 NH1 ARG A 892 22.838 14.904 37.017 1.00 76.03 N ATOM 3061 NH2 ARG A 892 20.812 15.973 36.710 1.00 78.77 N ATOM 3062 HE ARG A 892 20.549 14.517 34.764 1.00 0.00 H ATOM 3063 HH12 ARG A 892 23.024 15.480 37.863 1.00 0.00 H ATOM 3064 HH11 ARG A 892 23.532 14.193 36.709 1.00 0.00 H ATOM 3065 HH22 ARG A 892 20.987 16.555 37.554 1.00 0.00 H ATOM 3066 HH21 ARG A 892 19.934 16.095 36.167 1.00 0.00 H ATOM 3067 H ARG A 892 19.317 9.722 36.167 1.00 0.00 H ATOM 3068 N GLU A 893 20.673 11.166 38.908 1.00 63.92 N ATOM 3069 CA GLU A 893 20.866 11.530 40.321 1.00 67.49 C ATOM 3070 C GLU A 893 21.514 10.364 41.085 1.00 64.82 C ATOM 3071 O GLU A 893 22.381 10.585 41.937 1.00 63.81 O ATOM 3072 CB GLU A 893 19.533 11.928 40.999 1.00 74.52 C ATOM 3073 CG GLU A 893 18.921 13.319 40.615 1.00 80.39 C ATOM 3074 CD GLU A 893 18.961 14.287 41.796 1.00 90.26 C ATOM 3075 OE1 GLU A 893 18.034 15.131 41.919 1.00 93.93 O ATOM 3076 OE2 GLU A 893 19.899 14.181 42.628 1.00 96.04 O ATOM 3077 H GLU A 893 19.712 11.191 38.511 1.00 0.00 H ATOM 3078 N HIS A 894 21.102 9.132 40.766 1.00 61.09 N ATOM 3079 CA HIS A 894 21.645 7.934 41.419 1.00 60.95 C ATOM 3080 C HIS A 894 23.128 7.716 41.104 1.00 57.15 C ATOM 3081 O HIS A 894 23.884 7.314 41.990 1.00 58.36 O ATOM 3082 CB HIS A 894 20.840 6.669 41.073 1.00 61.20 C ATOM 3083 CG HIS A 894 20.907 5.612 42.132 1.00 65.64 C ATOM 3084 ND1 HIS A 894 19.808 5.229 42.868 1.00 70.64 N ATOM 3085 CD2 HIS A 894 21.949 4.888 42.612 1.00 66.86 C ATOM 3086 CE1 HIS A 894 20.166 4.310 43.751 1.00 72.56 C ATOM 3087 NE2 HIS A 894 21.460 4.087 43.617 1.00 70.53 N ATOM 3088 H HIS A 894 20.374 9.019 40.032 1.00 0.00 H ATOM 3089 N TRP A 895 23.535 7.990 39.862 1.00 52.42 N ATOM 3090 CA TRP A 895 24.955 7.954 39.472 1.00 49.19 C ATOM 3091 C TRP A 895 25.789 8.958 40.249 1.00 52.13 C ATOM 3092 O TRP A 895 26.906 8.639 40.646 1.00 50.51 O ATOM 3093 CB TRP A 895 25.146 8.169 37.962 1.00 45.55 C ATOM 3094 CG TRP A 895 24.879 6.941 37.176 1.00 41.93 C ATOM 3095 CD1 TRP A 895 23.806 6.697 36.392 1.00 41.80 C ATOM 3096 CD2 TRP A 895 25.684 5.765 37.127 1.00 40.22 C ATOM 3097 NE1 TRP A 895 23.893 5.450 35.837 1.00 39.61 N ATOM 3098 CE2 TRP A 895 25.036 4.851 36.282 1.00 38.97 C ATOM 3099 CE3 TRP A 895 26.899 5.400 37.701 1.00 40.60 C ATOM 3100 CZ2 TRP A 895 25.562 3.590 35.997 1.00 37.60 C ATOM 3101 CZ3 TRP A 895 27.414 4.155 37.421 1.00 39.12 C ATOM 3102 CH2 TRP A 895 26.745 3.262 36.576 1.00 37.00 C ATOM 3103 HE1 TRP A 895 23.202 5.028 35.184 1.00 0.00 H ATOM 3104 H TRP A 895 22.824 8.238 39.144 1.00 0.00 H ATOM 3105 N THR A 896 25.245 10.151 40.489 1.00 55.37 N ATOM 3106 CA THR A 896 25.909 11.135 41.361 1.00 59.32 C ATOM 3107 C THR A 896 26.043 10.635 42.815 1.00 62.93 C ATOM 3108 O THR A 896 27.108 10.795 43.413 1.00 64.68 O ATOM 3109 CB THR A 896 25.213 12.518 41.290 1.00 62.22 C ATOM 3110 OG1 THR A 896 25.529 13.119 40.034 1.00 63.25 O ATOM 3111 CG2 THR A 896 25.658 13.472 42.409 1.00 64.56 C ATOM 3112 HG1 THR A 896 25.091 14.005 39.974 1.00 0.00 H ATOM 3113 H THR A 896 24.333 10.392 40.051 1.00 0.00 H ATOM 3114 N LYS A 897 24.991 10.024 43.369 1.00 65.05 N ATOM 3115 CA LYS A 897 25.014 9.531 44.766 1.00 68.84 C ATOM 3116 C LYS A 897 26.066 8.448 45.008 1.00 65.59 C ATOM 3117 O LYS A 897 26.708 8.446 46.039 1.00 67.17 O ATOM 3118 CB LYS A 897 23.635 9.029 45.208 1.00 74.42 C ATOM 3119 CG LYS A 897 22.665 10.155 45.542 1.00 82.59 C ATOM 3120 CD LYS A 897 21.188 9.750 45.476 1.00 88.87 C ATOM 3121 CE LYS A 897 20.311 10.974 45.428 1.00 92.90 C ATOM 3122 NZ LYS A 897 18.867 10.663 45.295 1.00 95.09 N ATOM 3123 HZ1 LYS A 897 18.708 10.131 44.416 1.00 0.00 H ATOM 3124 HZ2 LYS A 897 18.560 10.091 46.108 1.00 0.00 H ATOM 3125 HZ3 LYS A 897 18.324 11.549 45.268 1.00 0.00 H ATOM 3126 H LYS A 897 24.130 9.891 42.802 1.00 0.00 H ATOM 3127 N VAL A 898 26.244 7.545 44.050 1.00 62.23 N ATOM 3128 CA VAL A 898 27.219 6.457 44.189 1.00 60.10 C ATOM 3129 C VAL A 898 28.637 6.782 43.676 1.00 59.04 C ATOM 3130 O VAL A 898 29.515 5.919 43.756 1.00 55.94 O ATOM 3131 CB VAL A 898 26.720 5.121 43.563 1.00 56.70 C ATOM 3132 CG1 VAL A 898 25.375 4.725 44.154 1.00 59.02 C ATOM 3133 CG2 VAL A 898 26.669 5.172 42.049 1.00 53.25 C ATOM 3134 H VAL A 898 25.678 7.611 43.180 1.00 0.00 H ATOM 3135 N SER A 899 28.854 7.988 43.138 1.00 59.11 N ATOM 3136 CA SER A 899 30.177 8.405 42.629 1.00 59.66 C ATOM 3137 C SER A 899 31.299 8.154 43.641 1.00 60.82 C ATOM 3138 O SER A 899 32.338 7.604 43.285 1.00 59.29 O ATOM 3139 CB SER A 899 30.171 9.887 42.222 1.00 60.08 C ATOM 3140 OG SER A 899 29.458 10.084 41.008 1.00 61.13 O ATOM 3141 HG SER A 899 28.522 9.784 41.124 1.00 0.00 H ATOM 3142 H SER A 899 28.061 8.658 43.076 1.00 0.00 H ATOM 3143 N HIS A 900 31.048 8.527 44.897 1.00 63.03 N ATOM 3144 CA HIS A 900 32.016 8.369 45.996 1.00 65.45 C ATOM 3145 C HIS A 900 32.570 6.940 46.151 1.00 65.04 C ATOM 3146 O HIS A 900 33.692 6.769 46.618 1.00 63.46 O ATOM 3147 CB HIS A 900 31.419 8.859 47.336 1.00 67.88 C ATOM 3148 CG HIS A 900 30.407 7.927 47.933 1.00 69.56 C ATOM 3149 ND1 HIS A 900 29.062 8.001 47.643 1.00 69.83 N ATOM 3150 CD2 HIS A 900 30.546 6.891 48.795 1.00 71.52 C ATOM 3151 CE1 HIS A 900 28.416 7.056 48.303 1.00 70.91 C ATOM 3152 NE2 HIS A 900 29.293 6.369 49.009 1.00 72.37 N ATOM 3153 H HIS A 900 30.123 8.951 45.111 1.00 0.00 H ATOM 3154 N LYS A 901 31.802 5.932 45.734 1.00 63.40 N ATOM 3155 CA LYS A 901 32.220 4.524 45.843 1.00 62.58 C ATOM 3156 C LYS A 901 33.339 4.104 44.893 1.00 57.69 C ATOM 3157 O LYS A 901 33.919 3.049 45.080 1.00 57.72 O ATOM 3158 CB LYS A 901 31.012 3.595 45.681 1.00 64.60 C ATOM 3159 CG LYS A 901 30.005 3.779 46.811 1.00 70.08 C ATOM 3160 CD LYS A 901 28.832 2.826 46.718 1.00 71.37 C ATOM 3161 CE LYS A 901 28.029 2.861 48.009 1.00 77.20 C ATOM 3162 NZ LYS A 901 26.864 1.939 47.957 1.00 79.23 N ATOM 3163 HZ1 LYS A 901 26.238 2.217 47.174 1.00 0.00 H ATOM 3164 HZ2 LYS A 901 27.200 0.966 47.806 1.00 0.00 H ATOM 3165 HZ3 LYS A 901 26.342 1.991 48.855 1.00 0.00 H ATOM 3166 H LYS A 901 30.874 6.148 45.317 1.00 0.00 H ATOM 3167 N PHE A 902 33.658 4.927 43.894 1.00 53.93 N ATOM 3168 CA PHE A 902 34.829 4.685 43.049 1.00 51.81 C ATOM 3169 C PHE A 902 36.162 5.139 43.696 1.00 53.60 C ATOM 3170 O PHE A 902 37.204 5.056 43.052 1.00 54.86 O ATOM 3171 CB PHE A 902 34.629 5.308 41.655 1.00 48.61 C ATOM 3172 CG PHE A 902 33.663 4.544 40.790 1.00 46.64 C ATOM 3173 CD1 PHE A 902 32.293 4.677 40.971 1.00 46.90 C ATOM 3174 CD2 PHE A 902 34.121 3.694 39.788 1.00 44.97 C ATOM 3175 CE1 PHE A 902 31.398 3.986 40.165 1.00 45.01 C ATOM 3176 CE2 PHE A 902 33.237 2.995 38.984 1.00 43.01 C ATOM 3177 CZ PHE A 902 31.870 3.139 39.174 1.00 43.31 C ATOM 3178 H PHE A 902 33.062 5.759 43.711 1.00 0.00 H ATOM 3179 N THR A 903 36.132 5.653 44.929 1.00 55.38 N ATOM 3180 CA THR A 903 37.342 5.922 45.690 1.00 57.79 C ATOM 3181 C THR A 903 37.675 4.741 46.620 1.00 57.87 C ATOM 3182 O THR A 903 36.901 4.414 47.508 1.00 58.86 O ATOM 3183 CB THR A 903 37.251 7.247 46.486 1.00 61.92 C ATOM 3184 OG1 THR A 903 35.982 7.372 47.130 1.00 65.53 O ATOM 3185 CG2 THR A 903 37.434 8.428 45.532 1.00 59.94 C ATOM 3186 HG1 THR A 903 35.265 7.361 46.448 1.00 0.00 H ATOM 3187 H THR A 903 35.210 5.868 45.360 1.00 0.00 H ATOM 3188 N ILE A 904 38.835 4.123 46.396 1.00 55.72 N ATOM 3189 CA ILE A 904 39.260 2.918 47.115 1.00 56.65 C ATOM 3190 C ILE A 904 39.457 3.225 48.608 1.00 58.85 C ATOM 3191 O ILE A 904 40.307 4.028 48.974 1.00 58.92 O ATOM 3192 CB ILE A 904 40.571 2.329 46.521 1.00 56.16 C ATOM 3193 CG1 ILE A 904 40.328 1.794 45.099 1.00 53.57 C ATOM 3194 CG2 ILE A 904 41.121 1.213 47.402 1.00 58.31 C ATOM 3195 CD1 ILE A 904 41.578 1.631 44.250 1.00 52.77 C ATOM 3196 H ILE A 904 39.472 4.516 45.674 1.00 0.00 H ATOM 3197 N ARG A 905 38.640 2.591 49.440 1.00 60.29 N ATOM 3198 CA ARG A 905 38.764 2.640 50.888 1.00 64.05 C ATOM 3199 C ARG A 905 39.444 1.353 51.314 1.00 65.25 C ATOM 3200 O ARG A 905 39.240 0.309 50.697 1.00 64.12 O ATOM 3201 CB ARG A 905 37.395 2.775 51.567 1.00 66.48 C ATOM 3202 CG ARG A 905 37.113 4.146 52.155 1.00 68.94 C ATOM 3203 CD ARG A 905 36.690 5.164 51.113 1.00 67.82 C ATOM 3204 NE ARG A 905 36.589 6.507 51.700 1.00 71.63 N ATOM 3205 CZ ARG A 905 35.882 7.529 51.202 1.00 72.94 C ATOM 3206 NH1 ARG A 905 35.154 7.415 50.075 1.00 71.92 N ATOM 3207 NH2 ARG A 905 35.905 8.697 51.842 1.00 75.93 N ATOM 3208 HE ARG A 905 37.114 6.679 52.581 1.00 0.00 H ATOM 3209 HH12 ARG A 905 34.617 8.231 49.718 1.00 0.00 H ATOM 3210 HH11 ARG A 905 35.129 6.511 49.562 1.00 0.00 H ATOM 3211 HH22 ARG A 905 35.363 9.504 51.472 1.00 0.00 H ATOM 3212 HH21 ARG A 905 36.465 8.802 52.712 1.00 0.00 H ATOM 3213 H ARG A 905 37.867 2.027 49.033 1.00 0.00 H ATOM 3214 N GLY A 906 40.274 1.440 52.352 1.00 67.48 N ATOM 3215 CA GLY A 906 41.095 0.325 52.774 1.00 68.81 C ATOM 3216 C GLY A 906 42.088 -0.049 51.696 1.00 66.70 C ATOM 3217 O GLY A 906 42.532 0.803 50.920 1.00 63.96 O ATOM 3218 H GLY A 906 40.334 2.337 52.875 1.00 0.00 H ATOM 3219 N LEU A 907 42.424 -1.333 51.649 1.00 68.22 N ATOM 3220 CA LEU A 907 43.269 -1.891 50.595 1.00 67.68 C ATOM 3221 C LEU A 907 42.387 -2.366 49.468 1.00 66.30 C ATOM 3222 O LEU A 907 41.232 -2.695 49.708 1.00 67.19 O ATOM 3223 CB LEU A 907 44.083 -3.075 51.130 1.00 70.03 C ATOM 3224 CG LEU A 907 45.178 -2.711 52.132 1.00 72.42 C ATOM 3225 CD1 LEU A 907 45.715 -3.934 52.864 1.00 75.83 C ATOM 3226 CD2 LEU A 907 46.303 -1.971 51.429 1.00 70.95 C ATOM 3227 H LEU A 907 42.071 -1.968 52.393 1.00 0.00 H ATOM 3228 N PRO A 908 42.920 -2.420 48.229 1.00 66.54 N ATOM 3229 CA PRO A 908 42.138 -3.037 47.145 1.00 65.69 C ATOM 3230 C PRO A 908 41.836 -4.513 47.428 1.00 70.72 C ATOM 3231 O PRO A 908 42.488 -5.115 48.294 1.00 73.82 O ATOM 3232 CB PRO A 908 43.046 -2.902 45.911 1.00 63.36 C ATOM 3233 CG PRO A 908 44.158 -1.990 46.283 1.00 63.65 C ATOM 3234 CD PRO A 908 44.248 -1.962 47.780 1.00 66.07 C ATOM 3235 N SER A 909 40.875 -5.094 46.706 1.00 72.46 N ATOM 3236 CA SER A 909 40.498 -6.520 46.880 1.00 76.86 C ATOM 3237 C SER A 909 41.702 -7.467 46.729 1.00 79.93 C ATOM 3238 O SER A 909 41.808 -8.473 47.442 1.00 81.28 O ATOM 3239 CB SER A 909 39.387 -6.902 45.897 1.00 74.67 C ATOM 3240 OG SER A 909 39.544 -6.202 44.675 1.00 71.51 O ATOM 3241 HG SER A 909 38.819 -6.460 44.052 1.00 0.00 H ATOM 3242 H SER A 909 40.371 -4.527 45.995 1.00 0.00 H ATOM 3243 N ASN A 910 42.584 -7.114 45.789 1.00 81.06 N ATOM 3244 CA ASN A 910 43.986 -7.585 45.699 1.00 85.02 C ATOM 3245 C ASN A 910 44.675 -7.861 47.042 1.00 82.78 C ATOM 3246 O ASN A 910 45.415 -8.842 47.199 1.00 83.64 O ATOM 3247 CB ASN A 910 44.812 -6.473 44.968 1.00 91.32 C ATOM 3248 CG ASN A 910 44.988 -6.729 43.486 1.00100.56 C ATOM 3249 OD1 ASN A 910 44.390 -7.638 42.913 1.00114.65 O ATOM 3250 ND2 ASN A 910 45.802 -5.893 42.840 1.00107.18 N ATOM 3251 HD22 ASN A 910 46.290 -5.136 43.361 1.00 0.00 H ATOM 3252 HD21 ASN A 910 45.949 -5.998 41.816 1.00 0.00 H ATOM 3253 H ASN A 910 42.258 -6.451 45.057 1.00 0.00 H ATOM 3254 N ASN A 911 44.444 -6.954 47.988 1.00 81.12 N ATOM 3255 CA ASN A 911 45.034 -6.969 49.331 1.00 82.52 C ATOM 3256 C ASN A 911 46.516 -6.577 49.253 1.00 80.52 C ATOM 3257 O ASN A 911 47.339 -7.025 50.042 1.00 82.16 O ATOM 3258 CB ASN A 911 44.815 -8.330 50.020 1.00 85.91 C ATOM 3259 CG ASN A 911 44.632 -8.204 51.520 1.00 89.20 C ATOM 3260 OD1 ASN A 911 43.878 -7.354 51.993 1.00 89.11 O ATOM 3261 ND2 ASN A 911 45.289 -9.073 52.275 1.00 93.87 N ATOM 3262 HD22 ASN A 911 45.917 -9.775 51.834 1.00 0.00 H ATOM 3263 HD21 ASN A 911 45.177 -9.053 53.309 1.00 0.00 H ATOM 3264 H ASN A 911 43.795 -6.175 47.757 1.00 0.00 H ATOM 3265 N SER A 912 46.816 -5.692 48.302 1.00 76.87 N ATOM 3266 CA SER A 912 48.181 -5.351 47.892 1.00 77.66 C ATOM 3267 C SER A 912 48.270 -3.884 47.461 1.00 74.05 C ATOM 3268 O SER A 912 47.311 -3.336 46.933 1.00 71.31 O ATOM 3269 CB SER A 912 48.597 -6.242 46.717 1.00 77.21 C ATOM 3270 OG SER A 912 49.892 -5.916 46.242 1.00 78.70 O ATOM 3271 HG SER A 912 50.124 -6.511 45.486 1.00 0.00 H ATOM 3272 H SER A 912 46.030 -5.212 47.819 1.00 0.00 H ATOM 3273 N LEU A 913 49.424 -3.259 47.691 1.00 74.44 N ATOM 3274 CA LEU A 913 49.679 -1.893 47.223 1.00 72.30 C ATOM 3275 C LEU A 913 50.605 -1.834 45.993 1.00 72.06 C ATOM 3276 O LEU A 913 51.081 -0.754 45.642 1.00 72.39 O ATOM 3277 CB LEU A 913 50.241 -1.029 48.373 1.00 72.93 C ATOM 3278 CG LEU A 913 49.278 -0.577 49.475 1.00 72.71 C ATOM 3279 CD1 LEU A 913 50.038 0.248 50.489 1.00 75.26 C ATOM 3280 CD2 LEU A 913 48.097 0.227 48.936 1.00 70.47 C ATOM 3281 H LEU A 913 50.169 -3.756 48.220 1.00 0.00 H ATOM 3282 N ASP A 914 50.816 -2.965 45.312 1.00 73.16 N ATOM 3283 CA ASP A 914 51.735 -3.032 44.153 1.00 73.94 C ATOM 3284 C ASP A 914 51.368 -2.084 43.013 1.00 70.45 C ATOM 3285 O ASP A 914 52.246 -1.601 42.298 1.00 70.29 O ATOM 3286 CB ASP A 914 51.840 -4.468 43.605 1.00 75.94 C ATOM 3287 CG ASP A 914 52.713 -5.382 44.473 1.00 80.96 C ATOM 3288 OD1 ASP A 914 53.332 -4.928 45.472 1.00 83.47 O ATOM 3289 OD2 ASP A 914 52.783 -6.582 44.142 1.00 83.37 O ATOM 3290 H ASP A 914 50.317 -3.828 45.607 1.00 0.00 H ATOM 3291 N PHE A 915 50.075 -1.806 42.866 1.00 68.12 N ATOM 3292 CA PHE A 915 49.576 -0.891 41.828 1.00 65.54 C ATOM 3293 C PHE A 915 50.075 0.574 41.881 1.00 65.91 C ATOM 3294 O PHE A 915 49.788 1.324 40.957 1.00 65.57 O ATOM 3295 CB PHE A 915 48.024 -0.949 41.746 1.00 62.62 C ATOM 3296 CG PHE A 915 47.305 -0.096 42.765 1.00 62.49 C ATOM 3297 CD1 PHE A 915 47.386 -0.377 44.134 1.00 65.08 C ATOM 3298 CD2 PHE A 915 46.532 0.989 42.359 1.00 59.84 C ATOM 3299 CE1 PHE A 915 46.723 0.415 45.067 1.00 65.22 C ATOM 3300 CE2 PHE A 915 45.866 1.780 43.286 1.00 60.62 C ATOM 3301 CZ PHE A 915 45.965 1.497 44.643 1.00 63.34 C ATOM 3302 H PHE A 915 49.391 -2.253 43.510 1.00 0.00 H ATOM 3303 N LEU A 916 50.797 0.989 42.927 1.00 67.05 N ATOM 3304 CA LEU A 916 51.350 2.355 42.990 1.00 67.41 C ATOM 3305 C LEU A 916 52.669 2.498 42.202 1.00 68.12 C ATOM 3306 O LEU A 916 53.647 1.783 42.432 1.00 70.24 O ATOM 3307 CB LEU A 916 51.524 2.801 44.457 1.00 69.01 C ATOM 3308 CG LEU A 916 50.286 2.721 45.374 1.00 67.98 C ATOM 3309 CD1 LEU A 916 50.627 3.101 46.800 1.00 70.69 C ATOM 3310 CD2 LEU A 916 49.147 3.597 44.882 1.00 66.31 C ATOM 3311 H LEU A 916 50.973 0.333 43.715 1.00 0.00 H TER 3312 LEU A 916 HETATM 3313 ZN ZN A 1 21.335 -0.380 19.639 1.00 31.15 ZN HETATM 3314 MG MG A 2 23.845 0.699 17.013 1.00 31.49 MG HETATM 3315 O HOH 3 22.592 0.948 15.243 1.00 22.03 O HETATM 3316 O HOH 4 19.110 -2.791 25.544 1.00 44.22 O HETATM 3317 O HOH 5 27.826 -5.438 4.929 1.00 34.72 O HETATM 3318 O HOH 6 24.397 2.698 16.576 1.00 19.97 O HETATM 3319 O HOH 7 25.498 -9.771 28.183 1.00 33.67 O HETATM 3320 O HOH 8 15.351 -2.511 28.981 1.00 41.57 O HETATM 3321 O HOH 9 22.017 1.400 23.360 1.00 34.91 O HETATM 3322 O HOH 10 19.528 1.286 26.115 1.00 33.05 O HETATM 3323 O HOH 11 35.472 -5.370 15.555 1.00 36.71 O HETATM 3324 O HOH 12 -0.122 0.920 5.249 1.00 38.51 O HETATM 3325 O HOH 13 22.343 -6.589 25.971 1.00 34.64 O HETATM 3326 O HOH 14 21.350 3.062 27.241 1.00 32.13 O HETATM 3327 O HOH 15 23.914 -0.211 3.710 1.00 31.90 O HETATM 3328 O HOH 16 21.568 -14.387 19.020 1.00 33.48 O HETATM 3329 O HOH 17 18.304 9.108 8.835 1.00 35.42 O HETATM 3330 O HOH 18 44.559 -5.400 18.466 1.00 39.29 O HETATM 3331 O HOH 19 22.970 -12.472 20.591 1.00 31.01 O HETATM 3332 O HOH 20 25.709 -8.601 17.427 1.00 26.48 O HETATM 3333 O HOH 21 21.016 -14.417 10.338 1.00 36.35 O HETATM 3334 O HOH 22 13.781 -1.453 26.671 1.00 38.34 O HETATM 3335 O HOH 23 -2.591 -0.017 6.199 1.00 30.93 O HETATM 3336 O HOH 24 25.587 0.345 15.781 1.00 29.40 O HETATM 3337 O HOH 25 15.275 -1.951 36.686 1.00 39.45 O HETATM 3338 O HOH 26 30.992 -3.683 15.666 1.00 29.06 O HETATM 3339 O HOH 27 28.167 1.101 17.907 1.00 40.67 O HETATM 3340 O HOH 28 3.930 -9.521 2.725 1.00 46.78 O HETATM 3341 O HOH 29 11.037 -1.578 27.243 1.00 39.47 O HETATM 3342 O HOH 30 33.353 -0.502 22.039 1.00 37.96 O HETATM 3343 O HOH 31 26.097 -12.658 12.448 1.00 39.21 O HETATM 3344 O HOH 32 41.333 -0.065 27.588 1.00 30.18 O HETATM 3345 O HOH 33 25.760 -7.364 4.250 1.00 35.79 O HETATM 3346 O HOH 34 15.087 -4.833 30.680 1.00 38.65 O HETATM 3347 O HOH 35 23.165 0.512 20.962 1.00 37.68 O HETATM 3348 O HOH 36 25.396 0.703 18.605 1.00 26.26 O HETATM 3349 O HOH 37 1.049 -3.422 0.583 1.00 43.36 O HETATM 3350 O HOH 38 26.201 5.712 17.897 1.00 41.49 O HETATM 3351 O HOH 39 41.293 -0.829 34.822 1.00 40.41 O HETATM 3352 O HOH 40 30.205 4.614 16.268 1.00 30.95 O HETATM 3353 O HOH 41 35.650 -7.107 18.719 1.00 50.29 O HETATM 3354 O HOH 42 22.239 -11.232 7.296 1.00 32.63 O HETATM 3355 O HOH 43 21.320 -12.906 1.141 1.00 43.21 O HETATM 3356 O HOH 44 0.414 3.468 6.244 1.00 26.71 O HETATM 3357 O HOH 45 -1.525 4.828 7.597 1.00 31.83 O HETATM 3358 O HOH 46 0.352 -5.635 2.216 1.00 32.54 O HETATM 3359 O HOH 47 28.817 11.015 26.524 1.00 40.30 O HETATM 3360 O HOH 48 30.496 -0.108 21.178 1.00 42.96 O HETATM 3361 O HOH 49 28.594 13.784 26.365 1.00 42.95 O HETATM 3362 O HOH 50 32.283 -8.573 6.924 1.00 52.30 O HETATM 3363 O HOH 51 30.376 -7.805 4.306 1.00 38.78 O HETATM 3364 O HOH 52 63.156 -3.062 52.091 1.00 42.28 O HETATM 3365 O HOH 53 38.546 -3.285 59.247 1.00 43.52 O HETATM 3366 O HOH 54 35.890 4.243 36.987 1.00 30.42 O HETATM 3367 O HOH 55 42.350 3.667 50.974 1.00 34.81 O HETATM 3368 O HOH 56 63.647 0.694 48.966 1.00 38.37 O HETATM 3369 O HOH 57 62.914 1.691 45.641 1.00 43.44 O HETATM 3370 O HOH 58 60.447 -4.233 51.941 1.00 40.76 O HETATM 3371 N1 UNN A 59 26.963 5.367 25.619 1.00 -0.31 N HETATM 3372 C5 UNN A 59 28.008 6.198 25.706 1.00 0.00 C HETATM 3373 C9 UNN A 59 28.629 6.489 26.899 1.00 0.09 C HETATM 3374 C4 UNN A 59 28.131 5.886 28.041 1.00 -0.01 C HETATM 3375 C7 UNN A 59 27.051 5.035 27.946 1.00 0.11 C HETATM 3376 C11 UNN A 59 26.469 4.782 26.722 1.00 0.16 C HETATM 3377 N3 UNN A 59 25.365 3.893 26.665 1.00 -0.18 N HETATM 3378 C13 UNN A 59 24.695 3.560 25.495 1.00 0.29 C HETATM 3379 N4 UNN A 59 25.379 3.751 24.328 1.00 -0.25 N HETATM 3380 C18 UNN A 59 24.860 3.279 23.082 1.00 0.09 C HETATM 3381 C6 UNN A 59 24.401 4.387 22.197 1.00 -0.03 C HETATM 3382 C1 UNN A 59 23.656 4.062 21.076 1.00 -0.07 C HETATM 3383 C2 UNN A 59 23.210 5.040 20.215 1.00 -0.04 C HETATM 3384 C8 UNN A 59 23.509 6.359 20.484 1.00 0.13 C HETATM 3385 C10 UNN A 59 24.251 6.691 21.591 1.00 0.15 C HETATM 3386 C3 UNN A 59 24.693 5.713 22.457 1.00 -0.03 C HETATM 3387 H10 UNN A 59 25.266 5.982 23.337 1.00 0.05 H HETATM 3388 F1 UNN A 59 24.548 7.974 21.830 1.00 -0.19 F HETATM 3389 O4 UNN A 59 23.100 7.344 19.607 1.00 -0.23 O HETATM 3390 C19 UNN A 59 21.857 7.928 19.945 1.00 0.54 C HETATM 3391 F2 UNN A 59 21.781 8.388 21.214 1.00 -0.14 F HETATM 3392 F3 UNN A 59 20.890 7.013 19.725 1.00 -0.14 F HETATM 3393 F4 UNN A 59 21.723 9.015 19.148 1.00 -0.14 F HETATM 3394 H9 UNN A 59 22.631 4.776 19.337 1.00 0.05 H HETATM 3395 H8 UNN A 59 23.421 3.023 20.873 1.00 0.05 H HETATM 3396 C17 UNN A 59 25.947 2.467 22.407 1.00 0.08 C HETATM 3397 O5 UNN A 59 27.061 3.303 22.113 1.00 -0.38 O HETATM 3398 C16 UNN A 59 28.108 2.526 21.539 1.00 0.04 C HETATM 3399 H13 UNN A 59 28.966 3.176 21.314 1.00 0.05 H HETATM 3400 H14 UNN A 59 27.750 2.057 20.611 1.00 0.05 H HETATM 3401 H15 UNN A 59 28.417 1.745 22.249 1.00 0.05 H HETATM 3402 H6 UNN A 59 25.556 2.038 21.473 1.00 0.06 H HETATM 3403 H7 UNN A 59 26.266 1.655 23.078 1.00 0.06 H HETATM 3404 H16 UNN A 59 23.999 2.626 23.285 1.00 0.07 H HETATM 3405 H18 UNN A 59 26.257 4.229 24.345 1.00 0.19 H HETATM 3406 O2 UNN A 59 23.558 3.121 25.481 1.00 -0.39 O HETATM 3407 C14 UNN A 59 24.702 3.569 27.917 1.00 0.15 C HETATM 3408 C12 UNN A 59 25.404 3.750 29.227 1.00 0.23 C HETATM 3409 N2 UNN A 59 26.588 4.432 29.118 1.00 -0.23 N HETATM 3410 H17 UNN A 59 27.161 4.503 29.935 1.00 0.22 H HETATM 3411 O1 UNN A 59 24.941 3.317 30.277 1.00 -0.38 O HETATM 3412 H11 UNN A 59 24.420 2.507 27.857 1.00 0.08 H HETATM 3413 H12 UNN A 59 23.794 4.188 27.960 1.00 0.08 H HETATM 3414 H1 UNN A 59 28.588 6.082 29.004 1.00 0.05 H HETATM 3415 O3 UNN A 59 29.700 7.375 26.855 1.00 -0.33 O HETATM 3416 C15 UNN A 59 30.589 7.209 27.954 1.00 0.06 C HETATM 3417 H3 UNN A 59 31.414 7.931 27.870 1.00 0.06 H HETATM 3418 H4 UNN A 59 30.994 6.186 27.946 1.00 0.06 H HETATM 3419 H5 UNN A 59 30.045 7.381 28.895 1.00 0.06 H HETATM 3420 H2 UNN A 59 28.381 6.661 24.799 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 759 757 758 3313 CONECT 1109 1107 1108 3313 CONECT 1117 1116 3314 CONECT 1118 1116 3313 CONECT 2217 2216 3313 CONECT 3313 759 1109 1118 2217 CONECT 3314 1117 CONECT 3371 3372 3376 CONECT 3372 3371 3373 3420 CONECT 3373 3372 3374 3415 CONECT 3374 3373 3375 3414 CONECT 3375 3374 3376 3409 CONECT 3376 3371 3375 3377 CONECT 3377 3376 3378 3407 CONECT 3378 3377 3379 3406 CONECT 3379 3378 3380 3405 CONECT 3380 3379 3381 3396 3404 CONECT 3381 3380 3382 3386 CONECT 3382 3381 3383 3395 CONECT 3383 3382 3384 3394 CONECT 3384 3383 3385 3389 CONECT 3385 3384 3386 3388 CONECT 3386 3381 3385 3387 CONECT 3387 3386 CONECT 3388 3385 CONECT 3389 3384 3390 CONECT 3390 3389 3391 3392 3393 CONECT 3391 3390 CONECT 3392 3390 CONECT 3393 3390 CONECT 3394 3383 CONECT 3395 3382 CONECT 3396 3380 3397 3402 3403 CONECT 3397 3396 3398 CONECT 3398 3397 3399 3400 3401 CONECT 3399 3398 CONECT 3400 3398 CONECT 3401 3398 CONECT 3402 3396 CONECT 3403 3396 CONECT 3404 3380 CONECT 3405 3379 CONECT 3406 3378 CONECT 3407 3377 3408 3412 3413 CONECT 3408 3407 3409 3411 CONECT 3409 3375 3408 3410 CONECT 3410 3409 CONECT 3411 3408 CONECT 3412 3407 CONECT 3413 3407 CONECT 3414 3374 CONECT 3415 3373 3416 CONECT 3416 3415 3417 3418 3419 CONECT 3417 3416 CONECT 3418 3416 CONECT 3419 3416 CONECT 3420 3372 MASTER 0 0 0 0 0 0 0 0 3419 1 61 26 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5vp0
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3itu
RCSB PDB
PDBbind
345aa, >3ITU_1|Chains... at 98%
4d08
RCSB PDB
PDBbind
353aa, >4D08_1|Chains... at 96%
4d09
RCSB PDB
PDBbind
353aa, >4D09_1|Chains... at 96%
4htx
RCSB PDB
PDBbind
342aa, >4HTX_1|Chains... at 100%
4jib
RCSB PDB
PDBbind
345aa, >4JIB_1|Chains... at 98%
5tz3
RCSB PDB
PDBbind
344aa, >5TZ3_1|Chains... at 99%
5tza
RCSB PDB
PDBbind
344aa, >5TZA_1|Chains... at 99%
5tzc
RCSB PDB
PDBbind
344aa, >5TZC_1|Chains... at 99%
5tzh
RCSB PDB
PDBbind
344aa, >5TZH_1|Chains... at 99%
5tzw
RCSB PDB
PDBbind
344aa, >5TZW_1|Chains... at 99%
5tzx
RCSB PDB
PDBbind
344aa, >5TZX_1|Chains... at 99%
5tzz
RCSB PDB
PDBbind
344aa, >5TZZ_1|Chains... at 99%
5u00
RCSB PDB
PDBbind
344aa, >5U00_1|Chains... at 99%
5u7d
RCSB PDB
PDBbind
345aa, >5U7D_1|Chains... at 98%
5u7i
RCSB PDB
PDBbind
345aa, >5U7I_1|Chains... at 98%
5u7j
RCSB PDB
PDBbind
345aa, >5U7J_1|Chains... at 98%
5u7k
RCSB PDB
PDBbind
345aa, >5U7K_1|Chains... at 98%
5u7l
RCSB PDB
PDBbind
345aa, >5U7L_1|Chains... at 98%
5vp1
RCSB PDB
PDBbind
345aa, >5VP1_1|Chains... at 99%
5xkm
RCSB PDB
PDBbind
345aa, >5XKM_1|Chains... at 99%
6b96
RCSB PDB
PDBbind
373aa, >6B96_1|Chains... *
6b97
RCSB PDB
PDBbind
373aa, >6B97_1|Chains... at 100%
6b98
RCSB PDB
PDBbind
373aa, >6B98_1|Chains... at 100%
6c7d
RCSB PDB
PDBbind
342aa, >6C7D_1|Chains... at 99%
6c7e
RCSB PDB
PDBbind
342aa, >6C7E_1|Chains... at 99%
6c7f
RCSB PDB
PDBbind
342aa, >6C7F_1|Chains... at 99%
6c7g
RCSB PDB
PDBbind
342aa, >6C7G_1|Chains... at 99%
6c7i
RCSB PDB
PDBbind
342aa, >6C7I_1|Chains... at 99%
6c7j
RCSB PDB
PDBbind
342aa, >6C7J_1|Chains... at 99%
6cyb
RCSB PDB
PDBbind
373aa, >6CYB_1|Chains... at 100%
6cyc
RCSB PDB
PDBbind
373aa, >6CYC_1|Chains... at 100%
6cyd
RCSB PDB
PDBbind
373aa, >6CYD_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5vp0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Phosphodiesterase 2A
Ligand Name
9GJ
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
IC50=0.61nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 7677-7702
Ligand Properties
Formula
C
1
9
H
1
8
F
4
N
4
O
5
Molecular Weight
458.364
Exact Mass
458.121
No. of atoms
50
No. of bonds
52
Polar Surface Area
102.02
LOGP Value
1.99 (
Computed with XLOGP3
)
3.58 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 3
Canonical SMILES
COC[C@H](c1ccc(c(c1)F)OC(F)(F)F)NC(=O)N1CC(=O)Nc2c1ncc(c2)OC
InChI String
InChI=1S/C19H18F4N4O5/c1-30-9-14(10-3-4-15(12(20)5-10)32-19(21,22)23)26-18(29)27-8-16(28)25-13-6-11(31-2)7-24-17(13)27/h3-7,14H,8-9H2,1-2H3,(H,25,28)(H,26,29)/t14-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O00408
Entrez Gene ID
NCBI Entrez Gene ID:
5138
ASD
Information of known allosteric effects of PDB entries
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