Browse entries in the PDBbind-CN Database
HEADER 5NKD_COMPLEX COMPND 5NKD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 34 ALA VAL LEU LYS PHE THR THR GLU ILE HIS PRO SER CYS SEQRES 2 A 34 VAL THR ARG GLN LYS VAL ILE GLY ALA GLY GLU PHE GLY SEQRES 3 A 34 GLU VAL TYR LYS GLY MET LEU LYS SEQRES 1 A 133 GLU VAL PRO VAL ALA ILE LYS THR LEU LYS ALA GLY TYR SEQRES 2 A 133 THR GLU LYS GLN ARG VAL ASP PHE LEU GLY GLU ALA GLY SEQRES 3 A 133 ILE MET GLY GLN PHE SER HIS HIS ASN ILE ILE ARG LEU SEQRES 4 A 133 GLU GLY VAL ILE SER LYS TYR LYS PRO MET MET ILE ILE SEQRES 5 A 133 THR GLU TYR MET GLU ASN GLY ALA LEU ASP LYS PHE LEU SEQRES 6 A 133 ARG GLU LYS ASP GLY GLU PHE SER VAL LEU GLN LEU VAL SEQRES 7 A 133 GLY MET LEU ARG GLY ILE ALA ALA GLY MET LYS TYR LEU SEQRES 8 A 133 ALA ASN MET ASN TYR VAL HIS ARG ASP LEU ALA ALA ARG SEQRES 9 A 133 ASN ILE LEU VAL ASN SER ASN LEU VAL CYS LYS VAL SER SEQRES 10 A 133 ASP PHE GLY LEU SER ARG VAL LEU GLU ASP ASP PRO GLU SEQRES 11 A 133 ALA THR TYR SEQRES 1 A 120 GLY LYS ILE PRO ILE ARG TRP THR ALA PRO GLU ALA ILE SEQRES 2 A 120 SER TYR ARG LYS PHE THR SER ALA SER ASP VAL TRP SER SEQRES 3 A 120 PHE GLY ILE VAL MET TRP GLU VAL MET THR TYR GLY GLU SEQRES 4 A 120 ARG PRO TYR TRP GLU LEU SER ASN HIS GLU VAL MET LYS SEQRES 5 A 120 ALA ILE ASN ASP GLY PHE ARG LEU PRO THR PRO MET ASP SEQRES 6 A 120 CYS PRO SER ALA ILE TYR GLN LEU MET MET GLN CYS TRP SEQRES 7 A 120 GLN GLN GLU ARG ALA ARG ARG PRO LYS PHE ALA ASP ILE SEQRES 8 A 120 VAL SER ILE LEU ASP LYS LEU ILE ARG ALA PRO ASP SER SEQRES 9 A 120 LEU LYS THR LEU ALA ASP PHE ASP PRO ARG VAL SER ILE SEQRES 10 A 120 ARG LEU PRO HET UNN A 519 56 ATOM 1 N ALA A 600 -109.746 -26.419 15.432 1.00 57.26 N ATOM 2 CA ALA A 600 -110.716 -25.452 14.932 1.00 59.12 C ATOM 3 C ALA A 600 -110.104 -24.075 14.689 1.00 56.24 C ATOM 4 O ALA A 600 -110.734 -23.247 14.036 1.00 69.63 O ATOM 5 CB ALA A 600 -112.000 -25.331 15.779 1.00 59.35 C ATOM 6 HN3 ALA A 600 -109.354 -26.080 16.334 1.00 0.00 H ATOM 7 HN2 ALA A 600 -108.979 -26.529 14.739 1.00 0.00 H ATOM 8 HN1 ALA A 600 -110.216 -27.335 15.579 1.00 0.00 H ATOM 9 N VAL A 601 -108.922 -23.786 15.217 1.00 52.91 N ATOM 10 CA VAL A 601 -108.121 -22.712 14.653 1.00 54.85 C ATOM 11 C VAL A 601 -107.313 -23.255 13.475 1.00 51.20 C ATOM 12 O VAL A 601 -107.041 -22.525 12.513 1.00 51.31 O ATOM 13 CB VAL A 601 -107.242 -22.043 15.737 1.00 55.44 C ATOM 14 CG1 VAL A 601 -105.935 -22.804 15.953 1.00 48.68 C ATOM 15 CG2 VAL A 601 -106.987 -20.564 15.430 1.00 45.55 C ATOM 16 H VAL A 601 -108.569 -24.326 16.032 1.00 0.00 H ATOM 17 N LEU A 602 -107.001 -24.555 13.497 1.00 41.62 N ATOM 18 CA LEU A 602 -106.221 -25.181 12.436 1.00 42.91 C ATOM 19 C LEU A 602 -107.059 -25.551 11.213 1.00 43.34 C ATOM 20 O LEU A 602 -106.503 -25.701 10.121 1.00 42.15 O ATOM 21 CB LEU A 602 -105.511 -26.431 12.977 1.00 52.97 C ATOM 22 CG LEU A 602 -104.227 -26.304 13.814 1.00 51.36 C ATOM 23 CD1 LEU A 602 -103.759 -27.697 14.257 1.00 41.76 C ATOM 24 CD2 LEU A 602 -103.108 -25.567 13.060 1.00 33.06 C ATOM 25 H LEU A 602 -107.325 -25.138 14.295 1.00 0.00 H ATOM 26 N LYS A 603 -108.380 -25.705 11.353 1.00 40.29 N ATOM 27 CA LYS A 603 -109.158 -26.065 10.172 1.00 48.13 C ATOM 28 C LYS A 603 -109.311 -24.912 9.191 1.00 47.76 C ATOM 29 O LYS A 603 -109.857 -25.112 8.101 1.00 45.41 O ATOM 30 CB LYS A 603 -110.498 -26.711 10.538 1.00 56.35 C ATOM 31 CG LYS A 603 -110.366 -28.188 10.886 1.00 58.52 C ATOM 32 CD LYS A 603 -111.700 -28.919 10.800 1.00 58.94 C ATOM 33 CE LYS A 603 -112.408 -28.945 12.154 1.00 50.85 C ATOM 34 NZ LYS A 603 -111.456 -28.948 13.312 1.00 56.93 N ATOM 35 HZ1 LYS A 603 -110.847 -29.789 13.257 1.00 0.00 H ATOM 36 HZ2 LYS A 603 -110.868 -28.091 13.278 1.00 0.00 H ATOM 37 HZ3 LYS A 603 -111.994 -28.966 14.202 1.00 0.00 H ATOM 38 H LYS A 603 -108.839 -25.572 12.276 1.00 0.00 H ATOM 39 N PHE A 604 -108.842 -23.718 9.551 1.00 47.95 N ATOM 40 CA PHE A 604 -108.658 -22.664 8.565 1.00 42.34 C ATOM 41 C PHE A 604 -107.418 -22.911 7.714 1.00 51.53 C ATOM 42 O PHE A 604 -107.379 -22.499 6.549 1.00 53.07 O ATOM 43 CB PHE A 604 -108.546 -21.314 9.269 1.00 41.70 C ATOM 44 CG PHE A 604 -109.777 -20.929 10.058 1.00 50.44 C ATOM 45 CD1 PHE A 604 -110.901 -20.442 9.419 1.00 46.19 C ATOM 46 CD2 PHE A 604 -109.796 -21.029 11.441 1.00 54.52 C ATOM 47 CE1 PHE A 604 -112.029 -20.073 10.149 1.00 54.70 C ATOM 48 CE2 PHE A 604 -110.922 -20.659 12.173 1.00 45.22 C ATOM 49 CZ PHE A 604 -112.031 -20.182 11.530 1.00 45.22 C ATOM 50 H PHE A 604 -108.605 -23.537 10.547 1.00 0.00 H ATOM 51 N THR A 605 -106.412 -23.591 8.266 1.00 46.79 N ATOM 52 CA THR A 605 -105.146 -23.784 7.577 1.00 42.15 C ATOM 53 C THR A 605 -105.244 -24.913 6.555 1.00 34.25 C ATOM 54 O THR A 605 -105.937 -25.911 6.758 1.00 42.33 O ATOM 55 CB THR A 605 -104.028 -24.110 8.580 1.00 32.94 C ATOM 56 OG1 THR A 605 -104.100 -25.492 8.946 1.00 48.00 O ATOM 57 CG2 THR A 605 -104.158 -23.264 9.858 1.00 37.13 C ATOM 58 HG1 THR A 605 -104.980 -25.677 9.361 1.00 0.00 H ATOM 59 H THR A 605 -106.537 -23.995 9.216 1.00 0.00 H ATOM 60 N THR A 606 -104.513 -24.756 5.460 1.00 30.64 N ATOM 61 CA THR A 606 -104.432 -25.780 4.432 1.00 26.87 C ATOM 62 C THR A 606 -103.450 -26.865 4.847 1.00 31.89 C ATOM 63 O THR A 606 -102.365 -26.574 5.361 1.00 27.74 O ATOM 64 CB THR A 606 -103.936 -25.131 3.146 1.00 30.12 C ATOM 65 OG1 THR A 606 -104.864 -24.119 2.738 1.00 40.64 O ATOM 66 CG2 THR A 606 -103.764 -26.166 2.040 1.00 35.10 C ATOM 67 HG1 THR A 606 -104.937 -23.434 3.449 1.00 0.00 H ATOM 68 H THR A 606 -103.981 -23.872 5.333 1.00 0.00 H ATOM 69 N GLU A 607 -103.834 -28.122 4.642 1.00 26.79 N ATOM 70 CA GLU A 607 -102.942 -29.236 4.907 1.00 19.18 C ATOM 71 C GLU A 607 -102.208 -29.526 3.611 1.00 26.86 C ATOM 72 O GLU A 607 -102.835 -29.745 2.569 1.00 28.11 O ATOM 73 CB GLU A 607 -103.716 -30.454 5.420 1.00 21.18 C ATOM 74 CG GLU A 607 -102.848 -31.679 5.728 1.00 28.03 C ATOM 75 CD GLU A 607 -102.084 -31.617 7.048 1.00 24.57 C ATOM 76 OE1 GLU A 607 -102.487 -30.885 7.992 1.00 28.86 O ATOM 77 OE2 GLU A 607 -101.063 -32.341 7.145 1.00 23.72 O ATOM 78 H GLU A 607 -104.792 -28.310 4.285 1.00 0.00 H ATOM 79 N ILE A 608 -100.905 -29.456 3.648 1.00 20.73 N ATOM 80 CA ILE A 608 -100.114 -29.606 2.443 1.00 21.66 C ATOM 81 C ILE A 608 -99.489 -30.983 2.469 1.00 21.39 C ATOM 82 O ILE A 608 -99.056 -31.462 3.527 1.00 20.97 O ATOM 83 CB ILE A 608 -99.023 -28.525 2.370 1.00 25.26 C ATOM 84 CG1 ILE A 608 -99.690 -27.144 2.316 1.00 28.05 C ATOM 85 CG2 ILE A 608 -98.094 -28.798 1.190 1.00 23.72 C ATOM 86 CD1 ILE A 608 -98.716 -25.976 2.411 1.00 26.53 C ATOM 87 H ILE A 608 -100.427 -29.290 4.557 1.00 0.00 H ATOM 88 N HIS A 609 -99.447 -31.609 1.339 1.00 23.19 N ATOM 89 CA HIS A 609 -98.846 -32.926 1.329 1.00 20.87 C ATOM 90 C HIS A 609 -97.325 -32.819 1.210 1.00 22.77 C ATOM 91 O HIS A 609 -96.816 -32.000 0.442 1.00 25.56 O ATOM 92 CB HIS A 609 -99.380 -33.719 0.120 1.00 21.07 C ATOM 93 CG HIS A 609 -98.995 -35.168 0.158 1.00 24.21 C ATOM 94 ND1 HIS A 609 -97.815 -35.651 -0.383 1.00 20.98 N ATOM 95 CD2 HIS A 609 -99.613 -36.224 0.734 1.00 19.51 C ATOM 96 CE1 HIS A 609 -97.740 -36.957 -0.157 1.00 20.32 C ATOM 97 NE2 HIS A 609 -98.819 -37.325 0.518 1.00 20.61 N ATOM 98 H HIS A 609 -99.830 -31.183 0.471 1.00 0.00 H ATOM 99 N PRO A 610 -96.575 -33.662 1.926 1.00 23.50 N ATOM 100 CA PRO A 610 -95.108 -33.605 1.850 1.00 21.18 C ATOM 101 C PRO A 610 -94.499 -33.652 0.447 1.00 25.32 C ATOM 102 O PRO A 610 -93.419 -33.082 0.251 1.00 30.87 O ATOM 103 CB PRO A 610 -94.671 -34.820 2.688 1.00 26.53 C ATOM 104 CG PRO A 610 -95.746 -35.047 3.613 1.00 26.51 C ATOM 105 CD PRO A 610 -97.021 -34.647 2.923 1.00 23.91 C ATOM 106 N SER A 611 -95.131 -34.314 -0.535 1.00 33.50 N ATOM 107 CA SER A 611 -94.524 -34.362 -1.860 1.00 32.99 C ATOM 108 C SER A 611 -94.613 -33.037 -2.598 1.00 34.61 C ATOM 109 O SER A 611 -93.992 -32.894 -3.653 1.00 37.62 O ATOM 110 CB SER A 611 -95.187 -35.422 -2.731 1.00 25.21 C ATOM 111 OG SER A 611 -96.558 -35.155 -2.810 1.00 26.53 O ATOM 112 HG SER A 611 -96.950 -35.176 -1.901 1.00 0.00 H ATOM 113 H SER A 611 -96.040 -34.786 -0.354 1.00 0.00 H ATOM 114 N CYS A 612 -95.389 -32.087 -2.093 1.00 27.03 N ATOM 115 CA CYS A 612 -95.430 -30.746 -2.666 1.00 27.01 C ATOM 116 C CYS A 612 -94.299 -29.839 -2.188 1.00 36.71 C ATOM 117 O CYS A 612 -94.136 -28.742 -2.736 1.00 31.68 O ATOM 118 CB CYS A 612 -96.763 -30.104 -2.312 1.00 35.51 C ATOM 119 SG CYS A 612 -98.126 -31.013 -2.982 1.00 36.34 S ATOM 120 H CYS A 612 -95.983 -32.304 -1.268 1.00 0.00 H ATOM 121 N VAL A 613 -93.514 -30.277 -1.208 1.00 25.70 N ATOM 122 CA VAL A 613 -92.593 -29.421 -0.469 1.00 27.53 C ATOM 123 C VAL A 613 -91.170 -29.937 -0.642 1.00 31.59 C ATOM 124 O VAL A 613 -90.896 -31.115 -0.387 1.00 38.87 O ATOM 125 CB VAL A 613 -93.002 -29.365 1.017 1.00 24.53 C ATOM 126 CG1 VAL A 613 -92.013 -28.524 1.803 1.00 28.18 C ATOM 127 CG2 VAL A 613 -94.375 -28.768 1.131 1.00 29.96 C ATOM 128 H VAL A 613 -93.559 -31.285 -0.955 1.00 0.00 H ATOM 129 N THR A 614 -90.267 -29.063 -1.101 1.00 27.10 N ATOM 130 CA THR A 614 -88.840 -29.361 -1.148 1.00 31.58 C ATOM 131 C THR A 614 -88.122 -28.368 -0.261 1.00 30.15 C ATOM 132 O THR A 614 -88.249 -27.162 -0.470 1.00 32.33 O ATOM 133 CB THR A 614 -88.307 -29.231 -2.569 1.00 28.35 C ATOM 134 OG1 THR A 614 -89.027 -30.132 -3.406 1.00 37.71 O ATOM 135 CG2 THR A 614 -86.840 -29.618 -2.609 1.00 38.41 C ATOM 136 HG1 THR A 614 -89.990 -29.903 -3.383 1.00 0.00 H ATOM 137 H THR A 614 -90.595 -28.135 -1.437 1.00 0.00 H ATOM 138 N ARG A 615 -87.381 -28.872 0.725 1.00 24.13 N ATOM 139 CA ARG A 615 -86.486 -28.049 1.520 1.00 26.64 C ATOM 140 C ARG A 615 -85.166 -27.966 0.774 1.00 35.69 C ATOM 141 O ARG A 615 -84.708 -28.966 0.220 1.00 33.60 O ATOM 142 CB ARG A 615 -86.270 -28.691 2.893 1.00 26.18 C ATOM 143 CG ARG A 615 -87.486 -28.589 3.843 1.00 25.63 C ATOM 144 CD ARG A 615 -87.294 -29.430 5.089 1.00 36.04 C ATOM 145 NE ARG A 615 -87.746 -30.797 4.877 1.00 35.30 N ATOM 146 CZ ARG A 615 -87.433 -31.817 5.665 1.00 38.72 C ATOM 147 NH1 ARG A 615 -86.645 -31.629 6.713 1.00 40.79 N ATOM 148 NH2 ARG A 615 -87.911 -33.027 5.403 1.00 38.86 N ATOM 149 HE ARG A 615 -88.354 -30.986 4.055 1.00 0.00 H ATOM 150 HH12 ARG A 615 -86.400 -32.430 7.330 1.00 0.00 H ATOM 151 HH11 ARG A 615 -86.271 -30.681 6.919 1.00 0.00 H ATOM 152 HH22 ARG A 615 -87.666 -33.828 6.020 1.00 0.00 H ATOM 153 HH21 ARG A 615 -88.530 -33.175 4.581 1.00 0.00 H ATOM 154 H ARG A 615 -87.446 -29.889 0.933 1.00 0.00 H ATOM 155 N GLN A 616 -84.567 -26.772 0.729 1.00 31.60 N ATOM 156 CA GLN A 616 -83.344 -26.594 -0.056 1.00 29.89 C ATOM 157 C GLN A 616 -82.168 -26.041 0.729 1.00 39.12 C ATOM 158 O GLN A 616 -81.029 -26.465 0.504 1.00 42.02 O ATOM 159 CB GLN A 616 -83.630 -25.684 -1.239 1.00 30.91 C ATOM 160 CG GLN A 616 -84.778 -26.190 -2.101 1.00 33.94 C ATOM 161 CD GLN A 616 -85.135 -25.225 -3.195 1.00 36.94 C ATOM 162 OE1 GLN A 616 -85.612 -24.118 -2.933 1.00 37.25 O ATOM 163 NE2 GLN A 616 -84.877 -25.622 -4.441 1.00 44.94 N ATOM 164 HE22 GLN A 616 -84.474 -26.565 -4.613 1.00 0.00 H ATOM 165 HE21 GLN A 616 -85.078 -24.988 -5.241 1.00 0.00 H ATOM 166 H GLN A 616 -84.970 -25.969 1.252 1.00 0.00 H ATOM 167 N LYS A 617 -82.400 -25.106 1.621 1.00 33.37 N ATOM 168 CA LYS A 617 -81.323 -24.559 2.375 1.00 35.74 C ATOM 169 C LYS A 617 -81.738 -24.146 3.762 1.00 36.07 C ATOM 170 O LYS A 617 -82.792 -23.637 3.904 1.00 26.69 O ATOM 171 CB LYS A 617 -80.793 -23.349 1.614 1.00 30.38 C ATOM 172 CG LYS A 617 -79.953 -22.445 2.444 1.00 38.06 C ATOM 173 CD LYS A 617 -79.175 -21.466 1.634 1.00 42.77 C ATOM 174 CE LYS A 617 -78.678 -20.449 2.633 1.00 44.54 C ATOM 175 NZ LYS A 617 -77.275 -20.038 2.567 1.00 46.47 N ATOM 176 HZ1 LYS A 617 -76.665 -20.869 2.705 1.00 0.00 H ATOM 177 HZ2 LYS A 617 -77.082 -19.615 1.637 1.00 0.00 H ATOM 178 HZ3 LYS A 617 -77.084 -19.339 3.313 1.00 0.00 H ATOM 179 H LYS A 617 -83.370 -24.765 1.777 1.00 0.00 H ATOM 180 N VAL A 618 -80.909 -24.366 4.760 1.00 31.63 N ATOM 181 CA VAL A 618 -81.188 -23.971 6.137 1.00 22.22 C ATOM 182 C VAL A 618 -80.978 -22.476 6.295 1.00 33.43 C ATOM 183 O VAL A 618 -79.918 -21.951 5.951 1.00 34.14 O ATOM 184 CB VAL A 618 -80.281 -24.736 7.106 1.00 28.86 C ATOM 185 CG1 VAL A 618 -80.449 -24.194 8.536 1.00 34.18 C ATOM 186 CG2 VAL A 618 -80.603 -26.203 7.058 1.00 23.94 C ATOM 187 H VAL A 618 -80.009 -24.846 4.557 1.00 0.00 H ATOM 188 N ILE A 619 -81.980 -21.788 6.847 1.00 23.77 N ATOM 189 CA ILE A 619 -81.914 -20.345 7.061 1.00 25.25 C ATOM 190 C ILE A 619 -82.196 -19.968 8.503 1.00 35.50 C ATOM 191 O ILE A 619 -82.164 -18.786 8.850 1.00 31.72 O ATOM 192 CB ILE A 619 -82.842 -19.577 6.101 1.00 23.98 C ATOM 193 CG1 ILE A 619 -84.313 -19.896 6.399 1.00 20.39 C ATOM 194 CG2 ILE A 619 -82.533 -19.974 4.677 1.00 26.58 C ATOM 195 CD1 ILE A 619 -85.275 -19.202 5.480 1.00 21.46 C ATOM 196 H ILE A 619 -82.839 -22.298 7.135 1.00 0.00 H ATOM 197 N GLY A 620 -82.456 -20.947 9.349 1.00 25.66 N ATOM 198 CA GLY A 620 -82.636 -20.728 10.757 1.00 25.04 C ATOM 199 C GLY A 620 -82.582 -22.079 11.419 1.00 31.41 C ATOM 200 O GLY A 620 -82.804 -23.112 10.776 1.00 28.70 O ATOM 201 H GLY A 620 -82.534 -21.917 8.981 1.00 0.00 H ATOM 202 N ALA A 621 -82.277 -22.069 12.706 1.00 31.99 N ATOM 203 CA ALA A 621 -82.152 -23.363 13.346 1.00 40.03 C ATOM 204 C ALA A 621 -82.288 -23.188 14.845 1.00 44.77 C ATOM 205 O ALA A 621 -82.076 -22.095 15.380 1.00 39.65 O ATOM 206 CB ALA A 621 -80.840 -24.069 12.962 1.00 40.29 C ATOM 207 H ALA A 621 -82.135 -21.182 13.230 1.00 0.00 H ATOM 208 N GLY A 622 -82.692 -24.273 15.496 1.00 38.05 N ATOM 209 CA GLY A 622 -82.805 -24.356 16.934 1.00 37.29 C ATOM 210 C GLY A 622 -82.634 -25.800 17.347 1.00 39.31 C ATOM 211 O GLY A 622 -82.304 -26.647 16.511 1.00 34.34 O ATOM 212 H GLY A 622 -82.942 -25.114 14.937 1.00 0.00 H ATOM 213 N GLU A 623 -82.871 -26.102 18.624 1.00 48.66 N ATOM 214 CA GLU A 623 -82.692 -27.470 19.098 1.00 45.70 C ATOM 215 C GLU A 623 -83.784 -28.409 18.595 1.00 41.39 C ATOM 216 O GLU A 623 -83.528 -29.603 18.410 1.00 36.90 O ATOM 217 CB GLU A 623 -82.652 -27.488 20.623 1.00 53.39 C ATOM 218 CG GLU A 623 -81.681 -26.484 21.214 1.00 63.18 C ATOM 219 CD GLU A 623 -80.275 -27.031 21.319 1.00 63.76 C ATOM 220 OE1 GLU A 623 -79.374 -26.264 21.717 1.00 67.68 O ATOM 221 OE2 GLU A 623 -80.075 -28.229 21.009 1.00 67.96 O ATOM 222 H GLU A 623 -83.184 -25.361 19.283 1.00 0.00 H ATOM 223 N PHE A 624 -84.992 -27.901 18.353 1.00 38.78 N ATOM 224 CA PHE A 624 -86.150 -28.751 18.089 1.00 40.29 C ATOM 225 C PHE A 624 -86.611 -28.719 16.640 1.00 40.62 C ATOM 226 O PHE A 624 -87.649 -29.305 16.311 1.00 30.60 O ATOM 227 CB PHE A 624 -87.292 -28.391 19.032 1.00 32.99 C ATOM 228 CG PHE A 624 -86.896 -28.457 20.465 1.00 48.45 C ATOM 229 CD1 PHE A 624 -86.511 -29.671 21.025 1.00 36.78 C ATOM 230 CD2 PHE A 624 -86.871 -27.309 21.246 1.00 45.62 C ATOM 231 CE1 PHE A 624 -86.123 -29.742 22.349 1.00 42.98 C ATOM 232 CE2 PHE A 624 -86.485 -27.370 22.568 1.00 49.27 C ATOM 233 CZ PHE A 624 -86.106 -28.589 23.121 1.00 46.88 C ATOM 234 H PHE A 624 -85.114 -26.868 18.352 1.00 0.00 H ATOM 235 N GLY A 625 -85.870 -28.055 15.777 1.00 31.09 N ATOM 236 CA GLY A 625 -86.180 -28.043 14.366 1.00 26.27 C ATOM 237 C GLY A 625 -85.401 -26.915 13.734 1.00 32.19 C ATOM 238 O GLY A 625 -84.617 -26.230 14.393 1.00 29.47 O ATOM 239 H GLY A 625 -85.042 -27.527 16.119 1.00 0.00 H ATOM 240 N GLU A 626 -85.625 -26.734 12.437 1.00 22.66 N ATOM 241 CA GLU A 626 -84.982 -25.632 11.746 1.00 22.62 C ATOM 242 C GLU A 626 -85.933 -24.981 10.742 1.00 24.75 C ATOM 243 O GLU A 626 -87.069 -25.412 10.537 1.00 19.06 O ATOM 244 CB GLU A 626 -83.604 -26.018 11.191 1.00 31.16 C ATOM 245 CG GLU A 626 -83.567 -27.204 10.311 1.00 40.93 C ATOM 246 CD GLU A 626 -83.594 -28.541 11.058 1.00 35.82 C ATOM 247 OE1 GLU A 626 -83.195 -28.628 12.247 1.00 38.00 O ATOM 248 OE2 GLU A 626 -84.059 -29.510 10.429 1.00 35.29 O ATOM 249 H GLU A 626 -86.257 -27.378 11.920 1.00 0.00 H ATOM 250 N VAL A 627 -85.489 -23.882 10.158 1.00 20.44 N ATOM 251 CA VAL A 627 -86.249 -23.183 9.128 1.00 18.52 C ATOM 252 C VAL A 627 -85.459 -23.315 7.848 1.00 21.34 C ATOM 253 O VAL A 627 -84.234 -23.140 7.865 1.00 19.06 O ATOM 254 CB VAL A 627 -86.408 -21.686 9.481 1.00 19.98 C ATOM 255 CG1 VAL A 627 -87.293 -20.937 8.450 1.00 20.14 C ATOM 256 CG2 VAL A 627 -86.900 -21.515 10.914 1.00 21.38 C ATOM 257 H VAL A 627 -84.564 -23.502 10.443 1.00 0.00 H ATOM 258 N TYR A 628 -86.158 -23.545 6.738 1.00 17.88 N ATOM 259 CA TYR A 628 -85.541 -23.712 5.429 1.00 20.06 C ATOM 260 C TYR A 628 -86.165 -22.762 4.422 1.00 18.44 C ATOM 261 O TYR A 628 -87.364 -22.471 4.484 1.00 19.72 O ATOM 262 CB TYR A 628 -85.810 -25.127 4.877 1.00 21.33 C ATOM 263 CG TYR A 628 -85.320 -26.260 5.772 1.00 21.51 C ATOM 264 CD1 TYR A 628 -84.090 -26.857 5.547 1.00 26.99 C ATOM 265 CD2 TYR A 628 -86.101 -26.738 6.825 1.00 25.90 C ATOM 266 CE1 TYR A 628 -83.637 -27.890 6.343 1.00 29.36 C ATOM 267 CE2 TYR A 628 -85.660 -27.780 7.617 1.00 26.68 C ATOM 268 CZ TYR A 628 -84.419 -28.350 7.367 1.00 36.42 C ATOM 269 OH TYR A 628 -83.950 -29.379 8.142 1.00 37.90 O ATOM 270 HH TYR A 628 -83.882 -29.078 9.083 1.00 0.00 H ATOM 271 H TYR A 628 -87.194 -23.608 6.809 1.00 0.00 H ATOM 272 N LYS A 629 -85.350 -22.305 3.465 1.00 20.24 N ATOM 273 CA LYS A 629 -85.887 -21.869 2.189 1.00 17.34 C ATOM 274 C LYS A 629 -86.186 -23.120 1.380 1.00 26.36 C ATOM 275 O LYS A 629 -85.384 -24.065 1.359 1.00 28.20 O ATOM 276 CB LYS A 629 -84.872 -21.018 1.412 1.00 20.38 C ATOM 277 CG LYS A 629 -85.438 -20.328 0.156 1.00 23.96 C ATOM 278 CD LYS A 629 -85.370 -21.195 -1.098 1.00 29.99 C ATOM 279 CE LYS A 629 -86.010 -20.542 -2.312 1.00 35.08 C ATOM 280 NZ LYS A 629 -85.851 -21.457 -3.488 1.00 44.01 N ATOM 281 HZ1 LYS A 629 -84.839 -21.619 -3.665 1.00 0.00 H ATOM 282 HZ2 LYS A 629 -86.318 -22.364 -3.286 1.00 0.00 H ATOM 283 HZ3 LYS A 629 -86.285 -21.021 -4.326 1.00 0.00 H ATOM 284 H LYS A 629 -84.325 -22.262 3.636 1.00 0.00 H ATOM 285 N GLY A 630 -87.325 -23.115 0.712 1.00 24.41 N ATOM 286 CA GLY A 630 -87.700 -24.209 -0.154 1.00 26.35 C ATOM 287 C GLY A 630 -88.630 -23.801 -1.272 1.00 21.57 C ATOM 288 O GLY A 630 -88.851 -22.610 -1.548 1.00 19.63 O ATOM 289 H GLY A 630 -87.968 -22.304 0.812 1.00 0.00 H ATOM 290 N MET A 631 -89.201 -24.808 -1.936 1.00 22.29 N ATOM 291 CA MET A 631 -90.175 -24.588 -2.998 1.00 27.47 C ATOM 292 C MET A 631 -91.445 -25.365 -2.674 1.00 22.48 C ATOM 293 O MET A 631 -91.389 -26.436 -2.056 1.00 26.54 O ATOM 294 CB MET A 631 -89.608 -25.045 -4.335 1.00 32.79 C ATOM 295 CG MET A 631 -88.294 -24.379 -4.718 1.00 35.36 C ATOM 296 SD MET A 631 -88.505 -22.615 -5.040 1.00 37.17 S ATOM 297 CE MET A 631 -89.877 -22.651 -6.179 1.00 37.69 C ATOM 298 H MET A 631 -88.942 -25.784 -1.687 1.00 0.00 H ATOM 299 N LEU A 632 -92.583 -24.777 -3.021 1.00 21.79 N ATOM 300 CA LEU A 632 -93.908 -25.357 -2.818 1.00 21.82 C ATOM 301 C LEU A 632 -94.608 -25.535 -4.165 1.00 36.32 C ATOM 302 O LEU A 632 -94.567 -24.642 -5.017 1.00 30.27 O ATOM 303 CB LEU A 632 -94.804 -24.444 -1.956 1.00 23.30 C ATOM 304 CG LEU A 632 -96.253 -24.906 -1.770 1.00 28.39 C ATOM 305 CD1 LEU A 632 -96.298 -26.228 -1.007 1.00 28.06 C ATOM 306 CD2 LEU A 632 -97.104 -23.844 -1.077 1.00 24.87 C ATOM 307 H LEU A 632 -92.528 -23.840 -3.468 1.00 0.00 H ATOM 308 N LYS A 633 -95.277 -26.680 -4.337 1.00 33.34 N ATOM 309 CA LYS A 633 -96.146 -26.939 -5.494 1.00 44.03 C ATOM 310 C LYS A 633 -97.509 -26.290 -5.355 1.00 48.60 C ATOM 311 O LYS A 633 -98.522 -26.939 -5.619 1.00 47.60 O ATOM 312 CB LYS A 633 -96.399 -28.433 -5.668 1.00 45.57 C ATOM 313 CG LYS A 633 -95.167 -29.254 -5.889 1.00 47.91 C ATOM 314 CD LYS A 633 -94.157 -28.526 -6.751 1.00 50.26 C ATOM 315 CE LYS A 633 -93.038 -29.474 -7.122 1.00 53.45 C ATOM 316 NZ LYS A 633 -92.667 -30.317 -5.951 1.00 57.87 N ATOM 317 HZ1 LYS A 633 -92.351 -29.705 -5.171 1.00 0.00 H ATOM 318 HZ2 LYS A 633 -93.494 -30.869 -5.647 1.00 0.00 H ATOM 319 HZ3 LYS A 633 -91.898 -30.963 -6.220 1.00 0.00 H ATOM 320 H LYS A 633 -95.178 -27.424 -3.617 1.00 0.00 H TER 321 LYS A 633 ATOM 322 N GLU A 640 -94.609 -23.496 -9.363 1.00 41.81 N ATOM 323 CA GLU A 640 -93.792 -23.714 -8.168 1.00 48.07 C ATOM 324 C GLU A 640 -93.385 -22.364 -7.580 1.00 44.22 C ATOM 325 O GLU A 640 -93.182 -21.406 -8.323 1.00 47.90 O ATOM 326 CB GLU A 640 -92.552 -24.519 -8.524 1.00 52.60 C ATOM 327 CG GLU A 640 -92.054 -25.407 -7.410 1.00 46.07 C ATOM 328 CD GLU A 640 -90.656 -25.930 -7.681 1.00 59.67 C ATOM 329 OE1 GLU A 640 -89.959 -25.349 -8.547 1.00 51.16 O ATOM 330 OE2 GLU A 640 -90.263 -26.925 -7.028 1.00 67.48 O ATOM 331 HN3 GLU A 640 -94.058 -22.962 -10.065 1.00 0.00 H ATOM 332 HN2 GLU A 640 -95.461 -22.957 -9.106 1.00 0.00 H ATOM 333 HN1 GLU A 640 -94.887 -24.415 -9.764 1.00 0.00 H ATOM 334 N VAL A 641 -93.261 -22.282 -6.259 1.00 36.62 N ATOM 335 CA VAL A 641 -93.162 -20.983 -5.585 1.00 30.29 C ATOM 336 C VAL A 641 -92.199 -21.093 -4.405 1.00 32.01 C ATOM 337 O VAL A 641 -92.219 -22.099 -3.686 1.00 27.72 O ATOM 338 CB VAL A 641 -94.563 -20.488 -5.171 1.00 29.19 C ATOM 339 CG1 VAL A 641 -95.047 -21.189 -3.932 1.00 30.67 C ATOM 340 CG2 VAL A 641 -94.584 -18.991 -4.963 1.00 40.06 C ATOM 341 H VAL A 641 -93.234 -23.154 -5.693 1.00 0.00 H ATOM 342 N PRO A 642 -91.292 -20.132 -4.203 1.00 28.60 N ATOM 343 CA PRO A 642 -90.443 -20.183 -3.009 1.00 22.67 C ATOM 344 C PRO A 642 -91.282 -20.021 -1.758 1.00 17.76 C ATOM 345 O PRO A 642 -92.271 -19.278 -1.741 1.00 22.58 O ATOM 346 CB PRO A 642 -89.498 -18.985 -3.196 1.00 28.54 C ATOM 347 CG PRO A 642 -90.226 -18.087 -4.124 1.00 35.71 C ATOM 348 CD PRO A 642 -90.919 -19.005 -5.080 1.00 26.49 C ATOM 349 N VAL A 643 -90.865 -20.726 -0.696 1.00 20.21 N ATOM 350 CA VAL A 643 -91.559 -20.695 0.584 1.00 20.95 C ATOM 351 C VAL A 643 -90.515 -20.829 1.675 1.00 17.31 C ATOM 352 O VAL A 643 -89.372 -21.236 1.439 1.00 18.42 O ATOM 353 CB VAL A 643 -92.585 -21.850 0.747 1.00 20.32 C ATOM 354 CG1 VAL A 643 -93.826 -21.647 -0.104 1.00 21.93 C ATOM 355 CG2 VAL A 643 -91.933 -23.183 0.424 1.00 18.57 C ATOM 356 H VAL A 643 -90.014 -21.317 -0.790 1.00 0.00 H ATOM 357 N ALA A 644 -90.905 -20.446 2.884 1.00 15.90 N ATOM 358 CA ALA A 644 -90.142 -20.793 4.069 1.00 13.74 C ATOM 359 C ALA A 644 -90.831 -21.939 4.777 1.00 16.00 C ATOM 360 O ALA A 644 -92.064 -21.994 4.841 1.00 15.37 O ATOM 361 CB ALA A 644 -90.024 -19.604 5.041 1.00 16.10 C ATOM 362 H ALA A 644 -91.775 -19.886 2.985 1.00 0.00 H ATOM 363 N ILE A 645 -90.016 -22.812 5.364 1.00 13.84 N ATOM 364 CA ILE A 645 -90.459 -24.079 5.911 1.00 13.48 C ATOM 365 C ILE A 645 -89.857 -24.261 7.313 1.00 15.49 C ATOM 366 O ILE A 645 -88.636 -24.358 7.462 1.00 16.46 O ATOM 367 CB ILE A 645 -89.921 -25.140 4.939 1.00 17.27 C ATOM 368 CG1 ILE A 645 -90.583 -25.022 3.574 1.00 19.13 C ATOM 369 CG2 ILE A 645 -90.109 -26.406 5.421 1.00 23.77 C ATOM 370 CD1 ILE A 645 -89.729 -25.564 2.427 1.00 25.13 C ATOM 371 H ILE A 645 -89.006 -22.572 5.434 1.00 0.00 H ATOM 372 N LYS A 646 -90.708 -24.330 8.341 1.00 12.94 N ATOM 373 CA LYS A 646 -90.235 -24.513 9.714 1.00 13.02 C ATOM 374 C LYS A 646 -90.641 -25.905 10.175 1.00 17.96 C ATOM 375 O LYS A 646 -91.807 -26.261 10.038 1.00 17.54 O ATOM 376 CB LYS A 646 -90.809 -23.476 10.680 1.00 16.36 C ATOM 377 CG LYS A 646 -90.295 -23.635 12.114 1.00 16.48 C ATOM 378 CD LYS A 646 -91.055 -22.676 13.110 1.00 25.06 C ATOM 379 CE LYS A 646 -90.725 -21.227 12.871 1.00 32.92 C ATOM 380 NZ LYS A 646 -91.303 -20.274 13.914 1.00 26.65 N ATOM 381 HZ1 LYS A 646 -92.340 -20.355 13.919 1.00 0.00 H ATOM 382 HZ2 LYS A 646 -90.930 -20.522 14.853 1.00 0.00 H ATOM 383 HZ3 LYS A 646 -91.031 -19.298 13.678 1.00 0.00 H ATOM 384 H LYS A 646 -91.729 -24.252 8.161 1.00 0.00 H ATOM 385 N THR A 647 -89.693 -26.688 10.698 1.00 16.63 N ATOM 386 CA THR A 647 -89.994 -28.057 11.121 1.00 18.25 C ATOM 387 C THR A 647 -89.982 -28.203 12.640 1.00 18.07 C ATOM 388 O THR A 647 -89.413 -27.388 13.385 1.00 21.23 O ATOM 389 CB THR A 647 -89.006 -29.061 10.536 1.00 20.87 C ATOM 390 OG1 THR A 647 -87.711 -28.798 11.086 1.00 19.77 O ATOM 391 CG2 THR A 647 -88.930 -28.934 9.033 1.00 20.33 C ATOM 392 HG1 THR A 647 -87.059 -29.443 10.714 1.00 0.00 H ATOM 393 H THR A 647 -88.727 -26.319 10.806 1.00 0.00 H ATOM 394 N LEU A 648 -90.624 -29.282 13.088 1.00 19.95 N ATOM 395 CA LEU A 648 -90.627 -29.699 14.481 1.00 20.44 C ATOM 396 C LEU A 648 -90.248 -31.171 14.537 1.00 23.47 C ATOM 397 O LEU A 648 -90.955 -32.012 13.980 1.00 26.41 O ATOM 398 CB LEU A 648 -92.016 -29.511 15.094 1.00 18.71 C ATOM 399 CG LEU A 648 -92.108 -29.847 16.573 1.00 22.41 C ATOM 400 CD1 LEU A 648 -91.241 -28.911 17.401 1.00 25.06 C ATOM 401 CD2 LEU A 648 -93.575 -29.782 17.010 1.00 23.38 C ATOM 402 H LEU A 648 -91.153 -29.858 12.402 1.00 0.00 H ATOM 403 N LYS A 649 -89.155 -31.476 15.230 1.00 29.75 N ATOM 404 CA LYS A 649 -88.542 -32.800 15.202 1.00 36.44 C ATOM 405 C LYS A 649 -89.260 -33.790 16.123 1.00 33.78 C ATOM 406 O LYS A 649 -89.833 -33.427 17.158 1.00 24.92 O ATOM 407 CB LYS A 649 -87.069 -32.710 15.605 1.00 37.36 C ATOM 408 CG LYS A 649 -86.235 -31.803 14.700 1.00 48.45 C ATOM 409 CD LYS A 649 -84.935 -32.474 14.255 1.00 47.42 C ATOM 410 CE LYS A 649 -84.029 -32.791 15.450 1.00 54.89 C ATOM 411 NZ LYS A 649 -83.084 -31.692 15.847 1.00 48.49 N ATOM 412 HZ1 LYS A 649 -82.455 -31.472 15.048 1.00 0.00 H ATOM 413 HZ2 LYS A 649 -83.629 -30.844 16.105 1.00 0.00 H ATOM 414 HZ3 LYS A 649 -82.517 -32.002 16.662 1.00 0.00 H ATOM 415 H LYS A 649 -88.718 -30.738 15.818 1.00 0.00 H ATOM 416 N ALA A 650 -89.164 -35.068 15.750 1.00 35.95 N ATOM 417 CA ALA A 650 -89.787 -36.148 16.503 1.00 28.58 C ATOM 418 C ALA A 650 -89.353 -36.142 17.964 1.00 30.44 C ATOM 419 O ALA A 650 -88.219 -35.787 18.305 1.00 32.32 O ATOM 420 CB ALA A 650 -89.434 -37.491 15.864 1.00 36.71 C ATOM 421 H ALA A 650 -88.625 -35.301 14.891 1.00 0.00 H ATOM 422 N GLY A 651 -90.266 -36.566 18.833 1.00 24.09 N ATOM 423 CA GLY A 651 -90.024 -36.503 20.260 1.00 24.81 C ATOM 424 C GLY A 651 -90.576 -35.262 20.906 1.00 23.29 C ATOM 425 O GLY A 651 -90.450 -35.097 22.122 1.00 22.27 O ATOM 426 H GLY A 651 -91.167 -36.949 18.483 1.00 0.00 H ATOM 427 N TYR A 652 -91.167 -34.366 20.122 1.00 21.55 N ATOM 428 CA TYR A 652 -91.690 -33.145 20.693 1.00 19.77 C ATOM 429 C TYR A 652 -92.747 -33.469 21.741 1.00 17.81 C ATOM 430 O TYR A 652 -93.443 -34.486 21.665 1.00 17.00 O ATOM 431 CB TYR A 652 -92.285 -32.260 19.582 1.00 17.81 C ATOM 432 CG TYR A 652 -93.345 -32.923 18.712 1.00 14.37 C ATOM 433 CD1 TYR A 652 -94.649 -33.032 19.153 1.00 19.02 C ATOM 434 CD2 TYR A 652 -93.037 -33.410 17.437 1.00 16.27 C ATOM 435 CE1 TYR A 652 -95.625 -33.633 18.380 1.00 20.11 C ATOM 436 CE2 TYR A 652 -94.021 -33.986 16.639 1.00 19.01 C ATOM 437 CZ TYR A 652 -95.307 -34.102 17.122 1.00 19.13 C ATOM 438 OH TYR A 652 -96.279 -34.706 16.357 1.00 24.01 O ATOM 439 HH TYR A 652 -97.136 -34.704 16.853 1.00 0.00 H ATOM 440 H TYR A 652 -91.253 -34.543 19.101 1.00 0.00 H ATOM 441 N THR A 653 -92.855 -32.591 22.723 1.00 14.97 N ATOM 442 CA THR A 653 -93.820 -32.709 23.800 1.00 17.98 C ATOM 443 C THR A 653 -95.197 -32.197 23.362 1.00 16.01 C ATOM 444 O THR A 653 -95.358 -31.574 22.302 1.00 16.45 O ATOM 445 CB THR A 653 -93.355 -31.939 25.027 1.00 19.50 C ATOM 446 OG1 THR A 653 -93.336 -30.528 24.724 1.00 22.03 O ATOM 447 CG2 THR A 653 -91.960 -32.371 25.443 1.00 24.74 C ATOM 448 HG1 THR A 653 -93.034 -30.025 25.521 1.00 0.00 H ATOM 449 H THR A 653 -92.214 -31.772 22.724 1.00 0.00 H ATOM 450 N GLU A 654 -96.199 -32.500 24.186 1.00 18.32 N ATOM 451 CA GLU A 654 -97.515 -31.928 23.977 1.00 17.31 C ATOM 452 C GLU A 654 -97.460 -30.404 23.930 1.00 22.57 C ATOM 453 O GLU A 654 -98.040 -29.781 23.025 1.00 18.41 O ATOM 454 CB GLU A 654 -98.448 -32.408 25.083 1.00 17.91 C ATOM 455 CG GLU A 654 -99.840 -31.850 24.932 1.00 21.92 C ATOM 456 CD GLU A 654 -100.772 -32.345 26.016 1.00 40.15 C ATOM 457 OE1 GLU A 654 -100.303 -33.113 26.879 1.00 41.63 O ATOM 458 OE2 GLU A 654 -101.967 -31.975 26.011 1.00 38.34 O ATOM 459 H GLU A 654 -96.037 -33.149 24.982 1.00 0.00 H ATOM 460 N LYS A 655 -96.766 -29.795 24.900 1.00 22.36 N ATOM 461 CA LYS A 655 -96.624 -28.339 24.933 1.00 20.36 C ATOM 462 C LYS A 655 -95.951 -27.824 23.666 1.00 23.00 C ATOM 463 O LYS A 655 -96.384 -26.822 23.085 1.00 20.37 O ATOM 464 CB LYS A 655 -95.812 -27.944 26.163 1.00 26.09 C ATOM 465 CG LYS A 655 -95.733 -26.432 26.421 1.00 30.91 C ATOM 466 CD LYS A 655 -94.497 -26.093 27.259 1.00 35.92 C ATOM 467 CE LYS A 655 -94.488 -24.619 27.633 1.00 53.55 C ATOM 468 NZ LYS A 655 -94.757 -23.761 26.441 1.00 46.72 N ATOM 469 HZ1 LYS A 655 -94.023 -23.927 25.723 1.00 0.00 H ATOM 470 HZ2 LYS A 655 -95.690 -23.999 26.047 1.00 0.00 H ATOM 471 HZ3 LYS A 655 -94.745 -22.761 26.726 1.00 0.00 H ATOM 472 H LYS A 655 -96.319 -30.368 25.644 1.00 0.00 H ATOM 473 N GLN A 656 -94.891 -28.497 23.214 1.00 20.64 N ATOM 474 CA GLN A 656 -94.228 -28.077 21.981 1.00 20.10 C ATOM 475 C GLN A 656 -95.171 -28.165 20.783 1.00 19.05 C ATOM 476 O GLN A 656 -95.215 -27.255 19.945 1.00 16.69 O ATOM 477 CB GLN A 656 -92.981 -28.920 21.739 1.00 21.34 C ATOM 478 CG GLN A 656 -91.837 -28.578 22.646 1.00 20.81 C ATOM 479 CD GLN A 656 -90.650 -29.464 22.413 1.00 28.83 C ATOM 480 OE1 GLN A 656 -90.760 -30.669 22.492 1.00 27.15 O ATOM 481 NE2 GLN A 656 -89.497 -28.867 22.102 1.00 26.51 N ATOM 482 HE22 GLN A 656 -89.447 -27.830 22.045 1.00 0.00 H ATOM 483 HE21 GLN A 656 -88.649 -29.439 21.917 1.00 0.00 H ATOM 484 H GLN A 656 -94.536 -29.321 23.740 1.00 0.00 H ATOM 485 N ARG A 657 -95.923 -29.264 20.658 1.00 19.52 N ATOM 486 CA ARG A 657 -96.879 -29.374 19.550 1.00 16.27 C ATOM 487 C ARG A 657 -97.927 -28.263 19.602 1.00 21.10 C ATOM 488 O ARG A 657 -98.252 -27.649 18.570 1.00 19.69 O ATOM 489 CB ARG A 657 -97.551 -30.749 19.573 1.00 18.66 C ATOM 490 CG ARG A 657 -98.582 -30.912 18.474 1.00 16.78 C ATOM 491 CD ARG A 657 -99.999 -30.722 19.002 1.00 20.68 C ATOM 492 NE ARG A 657 -100.362 -31.772 19.965 1.00 18.85 N ATOM 493 CZ ARG A 657 -101.508 -31.824 20.627 1.00 27.33 C ATOM 494 NH1 ARG A 657 -102.424 -30.869 20.454 1.00 24.27 N ATOM 495 NH2 ARG A 657 -101.721 -32.814 21.485 1.00 24.86 N ATOM 496 HE ARG A 657 -99.669 -32.528 20.139 1.00 0.00 H ATOM 497 HH12 ARG A 657 -103.324 -30.911 20.974 1.00 0.00 H ATOM 498 HH11 ARG A 657 -102.238 -30.083 19.799 1.00 0.00 H ATOM 499 HH22 ARG A 657 -102.618 -32.864 22.010 1.00 0.00 H ATOM 500 HH21 ARG A 657 -100.991 -33.540 21.633 1.00 0.00 H ATOM 501 H ARG A 657 -95.830 -30.039 21.345 1.00 0.00 H ATOM 502 N VAL A 658 -98.443 -27.972 20.800 1.00 18.16 N ATOM 503 CA VAL A 658 -99.457 -26.928 20.941 1.00 24.24 C ATOM 504 C VAL A 658 -98.867 -25.563 20.592 1.00 22.36 C ATOM 505 O VAL A 658 -99.481 -24.766 19.869 1.00 21.05 O ATOM 506 CB VAL A 658 -100.056 -26.952 22.360 1.00 19.67 C ATOM 507 CG1 VAL A 658 -100.960 -25.722 22.585 1.00 19.31 C ATOM 508 CG2 VAL A 658 -100.848 -28.230 22.565 1.00 22.25 C ATOM 509 H VAL A 658 -98.120 -28.493 21.640 1.00 0.00 H ATOM 510 N ASP A 659 -97.665 -25.275 21.091 1.00 20.69 N ATOM 511 CA ASP A 659 -97.008 -24.004 20.754 1.00 20.71 C ATOM 512 C ASP A 659 -96.727 -23.888 19.258 1.00 23.43 C ATOM 513 O ASP A 659 -96.954 -22.831 18.654 1.00 20.73 O ATOM 514 CB ASP A 659 -95.696 -23.850 21.526 1.00 24.20 C ATOM 515 CG ASP A 659 -95.909 -23.680 23.032 1.00 28.94 C ATOM 516 OD1 ASP A 659 -97.050 -23.390 23.448 1.00 33.14 O ATOM 517 OD2 ASP A 659 -94.920 -23.851 23.786 1.00 38.22 O ATOM 518 H ASP A 659 -97.190 -25.952 21.721 1.00 0.00 H ATOM 519 N PHE A 660 -96.223 -24.963 18.643 1.00 19.13 N ATOM 520 CA PHE A 660 -95.797 -24.920 17.248 1.00 22.40 C ATOM 521 C PHE A 660 -96.983 -24.771 16.318 1.00 26.09 C ATOM 522 O PHE A 660 -97.020 -23.867 15.476 1.00 24.49 O ATOM 523 CB PHE A 660 -95.033 -26.208 16.930 1.00 21.32 C ATOM 524 CG PHE A 660 -94.606 -26.371 15.488 1.00 16.99 C ATOM 525 CD1 PHE A 660 -93.456 -25.776 15.006 1.00 18.37 C ATOM 526 CD2 PHE A 660 -95.287 -27.249 14.651 1.00 18.11 C ATOM 527 CE1 PHE A 660 -93.048 -25.989 13.690 1.00 19.47 C ATOM 528 CE2 PHE A 660 -94.884 -27.456 13.326 1.00 18.53 C ATOM 529 CZ PHE A 660 -93.748 -26.840 12.861 1.00 19.76 C ATOM 530 H PHE A 660 -96.132 -25.853 19.173 1.00 0.00 H ATOM 531 N LEU A 661 -97.967 -25.653 16.446 1.00 21.66 N ATOM 532 CA LEU A 661 -99.154 -25.526 15.623 1.00 19.73 C ATOM 533 C LEU A 661 -99.982 -24.312 16.012 1.00 22.62 C ATOM 534 O LEU A 661 -100.765 -23.824 15.192 1.00 27.15 O ATOM 535 CB LEU A 661 -99.975 -26.827 15.673 1.00 22.78 C ATOM 536 CG LEU A 661 -99.385 -28.124 15.088 1.00 19.85 C ATOM 537 CD1 LEU A 661 -100.355 -29.276 15.204 1.00 22.83 C ATOM 538 CD2 LEU A 661 -99.059 -27.917 13.633 1.00 24.44 C ATOM 539 H LEU A 661 -97.887 -26.430 17.132 1.00 0.00 H ATOM 540 N GLY A 662 -99.833 -23.825 17.243 1.00 19.67 N ATOM 541 CA GLY A 662 -100.520 -22.602 17.640 1.00 19.99 C ATOM 542 C GLY A 662 -99.983 -21.385 16.920 1.00 22.47 C ATOM 543 O GLY A 662 -100.742 -20.459 16.627 1.00 22.03 O ATOM 544 H GLY A 662 -99.223 -24.320 17.925 1.00 0.00 H ATOM 545 N GLU A 663 -98.680 -21.359 16.611 1.00 19.36 N ATOM 546 CA GLU A 663 -98.183 -20.260 15.784 1.00 16.21 C ATOM 547 C GLU A 663 -98.888 -20.254 14.436 1.00 21.19 C ATOM 548 O GLU A 663 -99.338 -19.201 13.953 1.00 20.61 O ATOM 549 CB GLU A 663 -96.647 -20.315 15.595 1.00 17.20 C ATOM 550 CG GLU A 663 -96.131 -19.132 14.711 1.00 22.92 C ATOM 551 CD GLU A 663 -94.604 -18.959 14.648 1.00 28.78 C ATOM 552 OE1 GLU A 663 -93.887 -19.966 14.746 1.00 23.45 O ATOM 553 OE2 GLU A 663 -94.128 -17.796 14.452 1.00 25.95 O ATOM 554 H GLU A 663 -98.037 -22.102 16.951 1.00 0.00 H ATOM 555 N ALA A 664 -99.062 -21.428 13.828 1.00 17.36 N ATOM 556 CA ALA A 664 -99.719 -21.458 12.526 1.00 15.55 C ATOM 557 C ALA A 664 -101.200 -21.120 12.660 1.00 17.67 C ATOM 558 O ALA A 664 -101.755 -20.400 11.821 1.00 19.00 O ATOM 559 CB ALA A 664 -99.561 -22.848 11.896 1.00 15.46 C ATOM 560 H ALA A 664 -98.735 -22.308 14.275 1.00 0.00 H ATOM 561 N GLY A 665 -101.827 -21.631 13.712 1.00 16.86 N ATOM 562 CA GLY A 665 -103.210 -21.291 13.996 1.00 20.81 C ATOM 563 C GLY A 665 -103.432 -19.792 14.130 1.00 22.21 C ATOM 564 O GLY A 665 -104.380 -19.248 13.571 1.00 20.91 O ATOM 565 H GLY A 665 -101.320 -22.285 14.343 1.00 0.00 H ATOM 566 N ILE A 666 -102.542 -19.110 14.847 1.00 17.36 N ATOM 567 CA ILE A 666 -102.642 -17.656 15.002 1.00 18.15 C ATOM 568 C ILE A 666 -102.429 -16.955 13.662 1.00 17.95 C ATOM 569 O ILE A 666 -103.247 -16.121 13.242 1.00 22.54 O ATOM 570 CB ILE A 666 -101.660 -17.167 16.087 1.00 17.97 C ATOM 571 CG1 ILE A 666 -102.150 -17.549 17.493 1.00 23.77 C ATOM 572 CG2 ILE A 666 -101.444 -15.639 15.953 1.00 19.38 C ATOM 573 CD1 ILE A 666 -101.043 -17.568 18.564 1.00 24.37 C ATOM 574 H ILE A 666 -101.760 -19.619 15.306 1.00 0.00 H ATOM 575 N MET A 667 -101.348 -17.305 12.946 1.00 17.94 N ATOM 576 CA MET A 667 -101.080 -16.672 11.652 1.00 19.35 C ATOM 577 C MET A 667 -102.212 -16.888 10.660 1.00 19.82 C ATOM 578 O MET A 667 -102.485 -16.017 9.823 1.00 17.35 O ATOM 579 CB MET A 667 -99.774 -17.225 11.081 1.00 21.95 C ATOM 580 CG MET A 667 -98.588 -16.891 11.933 1.00 29.33 C ATOM 581 SD MET A 667 -97.097 -17.662 11.255 1.00 31.94 S ATOM 582 CE MET A 667 -97.382 -17.366 9.502 1.00 18.06 C ATOM 583 H MET A 667 -100.698 -18.029 13.312 1.00 0.00 H ATOM 584 N GLY A 668 -102.892 -18.034 10.728 1.00 16.91 N ATOM 585 CA GLY A 668 -103.949 -18.274 9.759 1.00 21.16 C ATOM 586 C GLY A 668 -105.203 -17.449 10.002 1.00 21.28 C ATOM 587 O GLY A 668 -106.078 -17.392 9.126 1.00 24.00 O ATOM 588 H GLY A 668 -102.671 -18.740 11.458 1.00 0.00 H ATOM 589 N GLN A 669 -105.317 -16.842 11.175 1.00 15.18 N ATOM 590 CA GLN A 669 -106.414 -15.920 11.462 1.00 17.65 C ATOM 591 C GLN A 669 -106.216 -14.553 10.840 1.00 16.27 C ATOM 592 O GLN A 669 -107.151 -13.762 10.877 1.00 18.13 O ATOM 593 CB GLN A 669 -106.644 -15.745 12.971 1.00 24.08 C ATOM 594 CG GLN A 669 -107.072 -17.033 13.676 1.00 25.53 C ATOM 595 CD GLN A 669 -108.414 -17.567 13.195 1.00 36.97 C ATOM 596 OE1 GLN A 669 -108.492 -18.309 12.211 1.00 41.45 O ATOM 597 NE2 GLN A 669 -109.483 -17.188 13.890 1.00 40.74 N ATOM 598 HE22 GLN A 669 -109.373 -16.562 14.713 1.00 0.00 H ATOM 599 HE21 GLN A 669 -110.429 -17.518 13.610 1.00 0.00 H ATOM 600 H GLN A 669 -104.606 -17.027 11.911 1.00 0.00 H ATOM 601 N PHE A 670 -105.048 -14.274 10.261 1.00 13.83 N ATOM 602 CA PHE A 670 -104.723 -12.932 9.810 1.00 16.11 C ATOM 603 C PHE A 670 -104.618 -12.874 8.288 1.00 18.59 C ATOM 604 O PHE A 670 -104.133 -13.815 7.647 1.00 20.86 O ATOM 605 CB PHE A 670 -103.373 -12.512 10.396 1.00 11.71 C ATOM 606 CG PHE A 670 -103.323 -12.459 11.926 1.00 13.35 C ATOM 607 CD1 PHE A 670 -104.454 -12.086 12.682 1.00 14.23 C ATOM 608 CD2 PHE A 670 -102.180 -12.795 12.603 1.00 15.92 C ATOM 609 CE1 PHE A 670 -104.387 -12.033 14.082 1.00 14.00 C ATOM 610 CE2 PHE A 670 -102.140 -12.733 14.002 1.00 13.24 C ATOM 611 CZ PHE A 670 -103.245 -12.367 14.730 1.00 16.57 C ATOM 612 H PHE A 670 -104.352 -15.036 10.129 1.00 0.00 H ATOM 613 N SER A 671 -105.001 -11.728 7.723 1.00 11.52 N ATOM 614 CA SER A 671 -104.847 -11.449 6.295 1.00 13.21 C ATOM 615 C SER A 671 -104.502 -9.969 6.110 1.00 9.71 C ATOM 616 O SER A 671 -105.405 -9.142 5.957 1.00 14.96 O ATOM 617 CB SER A 671 -106.115 -11.827 5.559 1.00 16.93 C ATOM 618 OG SER A 671 -105.936 -11.667 4.172 1.00 23.06 O ATOM 619 HG SER A 671 -105.197 -12.250 3.866 1.00 0.00 H ATOM 620 H SER A 671 -105.430 -10.998 8.327 1.00 0.00 H ATOM 621 N HIS A 672 -103.211 -9.658 6.086 1.00 11.18 N ATOM 622 CA HIS A 672 -102.788 -8.269 5.989 1.00 8.59 C ATOM 623 C HIS A 672 -101.430 -8.221 5.291 1.00 11.66 C ATOM 624 O HIS A 672 -100.584 -9.074 5.521 1.00 10.87 O ATOM 625 CB HIS A 672 -102.638 -7.678 7.380 1.00 9.54 C ATOM 626 CG HIS A 672 -102.448 -6.195 7.365 1.00 10.26 C ATOM 627 ND1 HIS A 672 -101.206 -5.613 7.184 1.00 10.77 N ATOM 628 CD2 HIS A 672 -103.338 -5.194 7.529 1.00 11.54 C ATOM 629 CE1 HIS A 672 -101.351 -4.304 7.175 1.00 10.56 C ATOM 630 NE2 HIS A 672 -102.628 -4.026 7.435 1.00 10.82 N ATOM 631 H HIS A 672 -102.497 -10.413 6.137 1.00 0.00 H ATOM 632 N HIS A 673 -101.232 -7.196 4.449 1.00 10.09 N ATOM 633 CA HIS A 673 -100.017 -7.035 3.640 1.00 11.79 C ATOM 634 C HIS A 673 -98.768 -7.056 4.511 1.00 10.31 C ATOM 635 O HIS A 673 -97.710 -7.528 4.068 1.00 11.58 O ATOM 636 CB HIS A 673 -100.141 -5.698 2.907 1.00 14.34 C ATOM 637 CG HIS A 673 -98.972 -5.302 2.061 1.00 14.28 C ATOM 638 ND1 HIS A 673 -98.412 -6.109 1.090 1.00 16.62 N ATOM 639 CD2 HIS A 673 -98.312 -4.126 1.998 1.00 15.54 C ATOM 640 CE1 HIS A 673 -97.440 -5.449 0.480 1.00 15.61 C ATOM 641 NE2 HIS A 673 -97.366 -4.244 1.013 1.00 18.47 N ATOM 642 H HIS A 673 -101.979 -6.477 4.365 1.00 0.00 H ATOM 643 N ASN A 674 -98.874 -6.587 5.763 1.00 8.97 N ATOM 644 CA ASN A 674 -97.722 -6.459 6.642 1.00 8.81 C ATOM 645 C ASN A 674 -97.629 -7.528 7.721 1.00 8.05 C ATOM 646 O ASN A 674 -96.895 -7.338 8.735 1.00 8.23 O ATOM 647 CB ASN A 674 -97.630 -5.045 7.220 1.00 9.35 C ATOM 648 CG ASN A 674 -97.484 -4.000 6.121 1.00 8.90 C ATOM 649 OD1 ASN A 674 -98.457 -3.322 5.792 1.00 11.26 O ATOM 650 ND2 ASN A 674 -96.251 -3.894 5.514 1.00 8.71 N ATOM 651 HD22 ASN A 674 -95.462 -4.492 5.832 1.00 0.00 H ATOM 652 HD21 ASN A 674 -96.110 -3.216 4.738 1.00 0.00 H ATOM 653 H ASN A 674 -99.811 -6.306 6.117 1.00 0.00 H ATOM 654 N ILE A 675 -98.281 -8.668 7.509 1.00 7.99 N ATOM 655 CA ILE A 675 -98.204 -9.794 8.437 1.00 9.72 C ATOM 656 C ILE A 675 -97.828 -10.999 7.596 1.00 10.04 C ATOM 657 O ILE A 675 -98.417 -11.233 6.541 1.00 11.97 O ATOM 658 CB ILE A 675 -99.555 -10.043 9.154 1.00 10.14 C ATOM 659 CG1 ILE A 675 -99.987 -8.804 9.952 1.00 12.15 C ATOM 660 CG2 ILE A 675 -99.438 -11.285 10.055 1.00 9.67 C ATOM 661 CD1 ILE A 675 -99.072 -8.412 11.083 1.00 11.46 C ATOM 662 H ILE A 675 -98.865 -8.761 6.654 1.00 0.00 H ATOM 663 N ILE A 676 -96.843 -11.780 8.066 1.00 10.43 N ATOM 664 CA ILE A 676 -96.395 -12.936 7.272 1.00 11.31 C ATOM 665 C ILE A 676 -97.571 -13.845 6.948 1.00 13.97 C ATOM 666 O ILE A 676 -98.364 -14.187 7.828 1.00 14.17 O ATOM 667 CB ILE A 676 -95.353 -13.705 8.087 1.00 12.58 C ATOM 668 CG1 ILE A 676 -94.098 -12.896 8.195 1.00 19.27 C ATOM 669 CG2 ILE A 676 -95.020 -15.021 7.366 1.00 16.77 C ATOM 670 CD1 ILE A 676 -93.400 -12.745 6.872 1.00 19.97 C ATOM 671 H ILE A 676 -96.400 -11.570 8.983 1.00 0.00 H ATOM 672 N ARG A 677 -97.650 -14.282 5.684 1.00 12.99 N ATOM 673 CA ARG A 677 -98.774 -15.082 5.194 1.00 18.42 C ATOM 674 C ARG A 677 -98.475 -16.566 5.352 1.00 15.05 C ATOM 675 O ARG A 677 -97.397 -17.032 4.979 1.00 15.13 O ATOM 676 CB ARG A 677 -98.968 -14.806 3.711 1.00 17.91 C ATOM 677 CG ARG A 677 -100.028 -15.690 3.071 1.00 19.33 C ATOM 678 CD ARG A 677 -100.071 -15.551 1.529 1.00 26.68 C ATOM 679 NE ARG A 677 -99.273 -14.430 1.046 1.00 37.14 N ATOM 680 CZ ARG A 677 -98.190 -14.553 0.282 1.00 49.74 C ATOM 681 NH1 ARG A 677 -97.795 -15.762 -0.116 1.00 49.10 N ATOM 682 NH2 ARG A 677 -97.505 -13.468 -0.101 1.00 40.35 N ATOM 683 HE ARG A 677 -99.570 -13.471 1.316 1.00 0.00 H ATOM 684 HH12 ARG A 677 -96.949 -15.862 -0.713 1.00 0.00 H ATOM 685 HH11 ARG A 677 -98.332 -16.605 0.170 1.00 0.00 H ATOM 686 HH22 ARG A 677 -96.660 -13.571 -0.698 1.00 0.00 H ATOM 687 HH21 ARG A 677 -97.818 -12.523 0.198 1.00 0.00 H ATOM 688 H ARG A 677 -96.882 -14.043 5.024 1.00 0.00 H ATOM 689 N LEU A 678 -99.453 -17.305 5.886 1.00 13.68 N ATOM 690 CA LEU A 678 -99.365 -18.755 6.055 1.00 17.61 C ATOM 691 C LEU A 678 -99.813 -19.417 4.762 1.00 17.51 C ATOM 692 O LEU A 678 -100.883 -19.091 4.238 1.00 22.69 O ATOM 693 CB LEU A 678 -100.310 -19.160 7.183 1.00 16.49 C ATOM 694 CG LEU A 678 -100.371 -20.669 7.508 1.00 16.25 C ATOM 695 CD1 LEU A 678 -99.035 -21.153 8.074 1.00 19.92 C ATOM 696 CD2 LEU A 678 -101.500 -20.951 8.468 1.00 18.07 C ATOM 697 H LEU A 678 -100.321 -16.824 6.197 1.00 0.00 H ATOM 698 N GLU A 679 -98.993 -20.313 4.233 1.00 20.39 N ATOM 699 CA GLU A 679 -99.397 -21.141 3.101 1.00 18.64 C ATOM 700 C GLU A 679 -100.095 -22.405 3.574 1.00 19.39 C ATOM 701 O GLU A 679 -101.088 -22.820 2.976 1.00 21.47 O ATOM 702 CB GLU A 679 -98.204 -21.505 2.208 1.00 22.03 C ATOM 703 CG GLU A 679 -97.561 -20.283 1.550 1.00 26.74 C ATOM 704 CD GLU A 679 -98.420 -19.685 0.435 1.00 44.95 C ATOM 705 OE1 GLU A 679 -99.044 -20.467 -0.316 1.00 37.33 O ATOM 706 OE2 GLU A 679 -98.468 -18.440 0.306 1.00 44.33 O ATOM 707 H GLU A 679 -98.040 -20.429 4.633 1.00 0.00 H ATOM 708 N GLY A 680 -99.582 -23.048 4.613 1.00 21.60 N ATOM 709 CA GLY A 680 -100.232 -24.248 5.093 1.00 20.90 C ATOM 710 C GLY A 680 -99.377 -24.935 6.128 1.00 23.09 C ATOM 711 O GLY A 680 -98.360 -24.402 6.575 1.00 18.58 O ATOM 712 H GLY A 680 -98.722 -22.694 5.078 1.00 0.00 H ATOM 713 N VAL A 681 -99.801 -26.144 6.491 1.00 19.32 N ATOM 714 CA VAL A 681 -99.117 -26.932 7.506 1.00 18.15 C ATOM 715 C VAL A 681 -99.017 -28.366 7.008 1.00 24.78 C ATOM 716 O VAL A 681 -99.815 -28.817 6.181 1.00 21.47 O ATOM 717 CB VAL A 681 -99.814 -26.889 8.894 1.00 23.42 C ATOM 718 CG1 VAL A 681 -99.928 -25.451 9.429 1.00 19.94 C ATOM 719 CG2 VAL A 681 -101.161 -27.527 8.826 1.00 19.56 C ATOM 720 H VAL A 681 -100.648 -26.538 6.035 1.00 0.00 H ATOM 721 N ILE A 682 -97.997 -29.063 7.479 1.00 18.80 N ATOM 722 CA ILE A 682 -97.926 -30.521 7.382 1.00 16.50 C ATOM 723 C ILE A 682 -98.019 -31.024 8.804 1.00 21.50 C ATOM 724 O ILE A 682 -97.087 -30.855 9.602 1.00 20.11 O ATOM 725 CB ILE A 682 -96.640 -30.989 6.697 1.00 19.71 C ATOM 726 CG1 ILE A 682 -96.508 -30.318 5.343 1.00 23.41 C ATOM 727 CG2 ILE A 682 -96.605 -32.532 6.616 1.00 25.84 C ATOM 728 CD1 ILE A 682 -95.481 -30.947 4.464 1.00 29.30 C ATOM 729 H ILE A 682 -97.214 -28.554 7.937 1.00 0.00 H ATOM 730 N SER A 683 -99.176 -31.576 9.161 1.00 21.37 N ATOM 731 CA SER A 683 -99.335 -32.132 10.486 1.00 22.84 C ATOM 732 C SER A 683 -99.662 -33.614 10.479 1.00 26.58 C ATOM 733 O SER A 683 -99.405 -34.279 11.482 1.00 28.84 O ATOM 734 CB SER A 683 -100.452 -31.404 11.247 1.00 27.07 C ATOM 735 OG SER A 683 -101.657 -31.510 10.528 1.00 29.20 O ATOM 736 HG SER A 683 -101.544 -31.099 9.634 1.00 0.00 H ATOM 737 H SER A 683 -99.967 -31.607 8.486 1.00 0.00 H ATOM 738 N LYS A 684 -100.211 -34.150 9.383 1.00 27.10 N ATOM 739 CA LYS A 684 -100.520 -35.582 9.306 1.00 21.94 C ATOM 740 C LYS A 684 -99.306 -36.434 8.972 1.00 30.41 C ATOM 741 O LYS A 684 -99.413 -37.668 8.915 1.00 35.23 O ATOM 742 CB LYS A 684 -101.595 -35.867 8.255 1.00 34.93 C ATOM 743 CG LYS A 684 -102.961 -35.315 8.585 1.00 43.36 C ATOM 744 CD LYS A 684 -103.984 -35.610 7.488 1.00 47.91 C ATOM 745 CE LYS A 684 -105.347 -35.051 7.890 1.00 47.41 C ATOM 746 NZ LYS A 684 -106.437 -35.245 6.903 1.00 49.74 N ATOM 747 HZ1 LYS A 684 -106.181 -34.778 6.010 1.00 0.00 H ATOM 748 HZ2 LYS A 684 -106.575 -36.262 6.737 1.00 0.00 H ATOM 749 HZ3 LYS A 684 -107.316 -34.830 7.273 1.00 0.00 H ATOM 750 H LYS A 684 -100.423 -33.539 8.569 1.00 0.00 H ATOM 751 N TYR A 685 -98.175 -35.821 8.708 1.00 26.84 N ATOM 752 CA TYR A 685 -96.942 -36.538 8.495 1.00 24.77 C ATOM 753 C TYR A 685 -95.872 -35.894 9.362 1.00 30.80 C ATOM 754 O TYR A 685 -96.035 -34.767 9.843 1.00 28.24 O ATOM 755 CB TYR A 685 -96.535 -36.485 7.042 1.00 23.02 C ATOM 756 CG TYR A 685 -97.535 -37.057 6.065 1.00 21.54 C ATOM 757 CD1 TYR A 685 -97.551 -38.431 5.771 1.00 25.98 C ATOM 758 CD2 TYR A 685 -98.442 -36.243 5.406 1.00 26.98 C ATOM 759 CE1 TYR A 685 -98.438 -38.956 4.860 1.00 23.55 C ATOM 760 CE2 TYR A 685 -99.328 -36.759 4.478 1.00 23.52 C ATOM 761 CZ TYR A 685 -99.326 -38.121 4.212 1.00 25.41 C ATOM 762 OH TYR A 685 -100.223 -38.636 3.302 1.00 32.84 O ATOM 763 HH TYR A 685 -100.091 -39.614 3.228 1.00 0.00 H ATOM 764 H TYR A 685 -98.168 -34.783 8.651 1.00 0.00 H ATOM 765 N LYS A 686 -94.784 -36.632 9.576 1.00 23.73 N ATOM 766 CA LYS A 686 -93.702 -36.170 10.428 1.00 21.85 C ATOM 767 C LYS A 686 -92.428 -36.139 9.599 1.00 24.21 C ATOM 768 O LYS A 686 -92.201 -37.025 8.784 1.00 35.45 O ATOM 769 CB LYS A 686 -93.537 -37.087 11.647 1.00 27.23 C ATOM 770 CG LYS A 686 -94.829 -37.390 12.391 1.00 27.66 C ATOM 771 CD LYS A 686 -95.467 -36.109 12.915 1.00 25.33 C ATOM 772 CE LYS A 686 -96.834 -36.382 13.503 1.00 33.98 C ATOM 773 NZ LYS A 686 -96.745 -37.586 14.376 1.00 43.53 N ATOM 774 HZ1 LYS A 686 -96.434 -38.401 13.810 1.00 0.00 H ATOM 775 HZ2 LYS A 686 -96.060 -37.410 15.138 1.00 0.00 H ATOM 776 HZ3 LYS A 686 -97.680 -37.785 14.787 1.00 0.00 H ATOM 777 H LYS A 686 -94.707 -37.564 9.121 1.00 0.00 H ATOM 778 N PRO A 687 -91.583 -35.108 9.786 1.00 25.80 N ATOM 779 CA PRO A 687 -91.715 -34.024 10.761 1.00 23.80 C ATOM 780 C PRO A 687 -92.808 -33.051 10.371 1.00 18.65 C ATOM 781 O PRO A 687 -93.093 -32.854 9.189 1.00 22.60 O ATOM 782 CB PRO A 687 -90.346 -33.333 10.725 1.00 27.42 C ATOM 783 CG PRO A 687 -89.649 -33.811 9.501 1.00 26.84 C ATOM 784 CD PRO A 687 -90.484 -34.867 8.836 1.00 23.42 C ATOM 785 N MET A 688 -93.446 -32.497 11.385 1.00 18.39 N ATOM 786 CA MET A 688 -94.468 -31.506 11.128 1.00 18.45 C ATOM 787 C MET A 688 -93.823 -30.232 10.631 1.00 18.60 C ATOM 788 O MET A 688 -92.662 -29.930 10.927 1.00 17.11 O ATOM 789 CB MET A 688 -95.261 -31.198 12.391 1.00 19.99 C ATOM 790 CG MET A 688 -96.099 -32.381 12.834 1.00 24.75 C ATOM 791 SD MET A 688 -97.495 -31.885 13.807 1.00 26.37 S ATOM 792 CE MET A 688 -96.703 -31.232 15.260 1.00 21.50 C ATOM 793 H MET A 688 -93.216 -32.771 12.361 1.00 0.00 H ATOM 794 N MET A 689 -94.562 -29.529 9.794 1.00 16.28 N ATOM 795 CA MET A 689 -94.084 -28.353 9.169 1.00 16.50 C ATOM 796 C MET A 689 -95.065 -27.200 9.089 1.00 15.78 C ATOM 797 O MET A 689 -96.239 -27.385 9.015 1.00 17.65 O ATOM 798 CB MET A 689 -93.658 -28.686 7.749 1.00 22.30 C ATOM 799 CG MET A 689 -92.531 -29.675 7.665 1.00 32.46 C ATOM 800 SD MET A 689 -91.816 -29.938 6.040 1.00 26.15 S ATOM 801 CE MET A 689 -93.198 -29.533 5.104 1.00 50.43 C ATOM 802 H MET A 689 -95.529 -29.850 9.586 1.00 0.00 H ATOM 803 N ILE A 690 -94.532 -25.987 9.185 1.00 16.88 N ATOM 804 CA ILE A 690 -95.330 -24.794 8.880 1.00 14.72 C ATOM 805 C ILE A 690 -94.685 -24.137 7.677 1.00 16.83 C ATOM 806 O ILE A 690 -93.460 -23.950 7.662 1.00 16.95 O ATOM 807 CB ILE A 690 -95.342 -23.795 10.054 1.00 15.06 C ATOM 808 CG1 ILE A 690 -95.939 -24.421 11.310 1.00 16.95 C ATOM 809 CG2 ILE A 690 -96.178 -22.546 9.704 1.00 14.18 C ATOM 810 CD1 ILE A 690 -95.619 -23.624 12.560 1.00 18.97 C ATOM 811 H ILE A 690 -93.540 -25.882 9.479 1.00 0.00 H ATOM 812 N ILE A 691 -95.500 -23.772 6.688 1.00 15.27 N ATOM 813 CA ILE A 691 -95.032 -23.248 5.414 1.00 17.56 C ATOM 814 C ILE A 691 -95.599 -21.847 5.257 1.00 16.87 C ATOM 815 O ILE A 691 -96.811 -21.643 5.421 1.00 16.18 O ATOM 816 CB ILE A 691 -95.486 -24.159 4.259 1.00 18.94 C ATOM 817 CG1 ILE A 691 -94.867 -25.536 4.481 1.00 24.96 C ATOM 818 CG2 ILE A 691 -95.022 -23.607 2.901 1.00 17.50 C ATOM 819 CD1 ILE A 691 -95.817 -26.663 4.248 1.00 32.31 C ATOM 820 H ILE A 691 -96.525 -23.867 6.835 1.00 0.00 H ATOM 821 N THR A 692 -94.732 -20.885 4.947 1.00 13.99 N ATOM 822 CA THR A 692 -95.140 -19.495 4.785 1.00 14.48 C ATOM 823 C THR A 692 -94.547 -18.918 3.519 1.00 14.26 C ATOM 824 O THR A 692 -93.657 -19.498 2.882 1.00 14.98 O ATOM 825 CB THR A 692 -94.714 -18.572 5.952 1.00 12.89 C ATOM 826 OG1 THR A 692 -93.284 -18.355 5.902 1.00 12.90 O ATOM 827 CG2 THR A 692 -95.117 -19.154 7.281 1.00 11.81 C ATOM 828 HG1 THR A 692 -93.046 -17.929 5.041 1.00 0.00 H ATOM 829 H THR A 692 -93.731 -21.134 4.816 1.00 0.00 H ATOM 830 N GLU A 693 -94.993 -17.714 3.188 1.00 16.04 N ATOM 831 CA GLU A 693 -94.272 -17.004 2.137 1.00 15.30 C ATOM 832 C GLU A 693 -92.798 -16.857 2.509 1.00 14.57 C ATOM 833 O GLU A 693 -92.424 -16.866 3.683 1.00 14.96 O ATOM 834 CB GLU A 693 -94.893 -15.626 1.892 1.00 17.61 C ATOM 835 CG GLU A 693 -94.772 -14.688 3.077 1.00 16.61 C ATOM 836 CD GLU A 693 -95.450 -13.339 2.827 1.00 19.21 C ATOM 837 OE1 GLU A 693 -95.294 -12.759 1.736 1.00 24.04 O ATOM 838 OE2 GLU A 693 -96.181 -12.882 3.724 1.00 15.12 O ATOM 839 H GLU A 693 -95.821 -17.294 3.657 1.00 0.00 H ATOM 840 N TYR A 694 -91.949 -16.735 1.505 1.00 14.07 N ATOM 841 CA TYR A 694 -90.508 -16.608 1.693 1.00 11.48 C ATOM 842 C TYR A 694 -90.116 -15.149 1.563 1.00 14.02 C ATOM 843 O TYR A 694 -90.345 -14.538 0.517 1.00 17.90 O ATOM 844 CB TYR A 694 -89.762 -17.429 0.648 1.00 16.58 C ATOM 845 CG TYR A 694 -88.311 -17.247 0.781 1.00 13.09 C ATOM 846 CD1 TYR A 694 -87.652 -17.653 1.946 1.00 15.94 C ATOM 847 CD2 TYR A 694 -87.569 -16.612 -0.208 1.00 19.07 C ATOM 848 CE1 TYR A 694 -86.308 -17.448 2.097 1.00 15.74 C ATOM 849 CE2 TYR A 694 -86.211 -16.424 -0.077 1.00 16.82 C ATOM 850 CZ TYR A 694 -85.584 -16.851 1.095 1.00 17.13 C ATOM 851 OH TYR A 694 -84.234 -16.688 1.280 1.00 22.19 O ATOM 852 HH TYR A 694 -84.010 -15.724 1.239 1.00 0.00 H ATOM 853 H TYR A 694 -92.325 -16.729 0.535 1.00 0.00 H ATOM 854 N MET A 695 -89.557 -14.581 2.629 1.00 9.95 N ATOM 855 CA MET A 695 -89.132 -13.184 2.626 1.00 11.20 C ATOM 856 C MET A 695 -87.651 -13.158 2.220 1.00 10.32 C ATOM 857 O MET A 695 -86.791 -13.615 2.971 1.00 11.83 O ATOM 858 CB MET A 695 -89.372 -12.577 4.011 1.00 11.29 C ATOM 859 CG MET A 695 -90.861 -12.695 4.402 1.00 10.83 C ATOM 860 SD MET A 695 -91.920 -11.605 3.496 1.00 12.52 S ATOM 861 CE MET A 695 -91.451 -10.024 4.257 1.00 9.66 C ATOM 862 H MET A 695 -89.419 -15.149 3.489 1.00 0.00 H ATOM 863 N GLU A 696 -87.355 -12.589 1.048 1.00 10.63 N ATOM 864 CA GLU A 696 -86.060 -12.811 0.426 1.00 12.41 C ATOM 865 C GLU A 696 -84.913 -12.102 1.154 1.00 10.86 C ATOM 866 O GLU A 696 -83.764 -12.498 0.955 1.00 17.34 O ATOM 867 CB GLU A 696 -86.141 -12.317 -1.037 1.00 14.93 C ATOM 868 CG GLU A 696 -87.162 -13.050 -1.935 1.00 15.14 C ATOM 869 CD GLU A 696 -88.528 -12.372 -1.973 1.00 20.83 C ATOM 870 OE1 GLU A 696 -88.891 -11.563 -1.100 1.00 13.61 O ATOM 871 OE2 GLU A 696 -89.261 -12.643 -2.943 1.00 22.91 O ATOM 872 H GLU A 696 -88.056 -11.983 0.577 1.00 0.00 H ATOM 873 N ASN A 697 -85.189 -11.073 1.952 1.00 11.47 N ATOM 874 CA ASN A 697 -84.148 -10.309 2.610 1.00 10.63 C ATOM 875 C ASN A 697 -84.000 -10.576 4.092 1.00 8.82 C ATOM 876 O ASN A 697 -83.129 -9.963 4.734 1.00 10.00 O ATOM 877 CB ASN A 697 -84.329 -8.813 2.352 1.00 9.06 C ATOM 878 CG ASN A 697 -84.024 -8.458 0.870 1.00 13.47 C ATOM 879 OD1 ASN A 697 -82.926 -8.737 0.362 1.00 14.69 O ATOM 880 ND2 ASN A 697 -84.990 -7.874 0.197 1.00 13.14 N ATOM 881 HD22 ASN A 697 -85.894 -7.659 0.665 1.00 0.00 H ATOM 882 HD21 ASN A 697 -84.851 -7.626 -0.803 1.00 0.00 H ATOM 883 H ASN A 697 -86.183 -10.809 2.108 1.00 0.00 H ATOM 884 N GLY A 698 -84.779 -11.510 4.627 1.00 9.08 N ATOM 885 CA GLY A 698 -84.517 -11.999 5.976 1.00 10.31 C ATOM 886 C GLY A 698 -84.916 -11.004 7.034 1.00 8.86 C ATOM 887 O GLY A 698 -85.774 -10.164 6.837 1.00 9.49 O ATOM 888 H GLY A 698 -85.578 -11.893 4.082 1.00 0.00 H ATOM 889 N ALA A 699 -84.268 -11.136 8.189 1.00 9.99 N ATOM 890 CA ALA A 699 -84.651 -10.359 9.349 1.00 8.44 C ATOM 891 C ALA A 699 -84.168 -8.931 9.173 1.00 7.77 C ATOM 892 O ALA A 699 -83.031 -8.683 8.745 1.00 8.15 O ATOM 893 CB ALA A 699 -84.033 -10.943 10.630 1.00 13.79 C ATOM 894 H ALA A 699 -83.476 -11.806 8.259 1.00 0.00 H ATOM 895 N LEU A 700 -85.043 -7.990 9.567 1.00 8.96 N ATOM 896 CA LEU A 700 -84.777 -6.575 9.369 1.00 7.38 C ATOM 897 C LEU A 700 -83.538 -6.099 10.128 1.00 9.41 C ATOM 898 O LEU A 700 -82.800 -5.244 9.620 1.00 10.13 O ATOM 899 CB LEU A 700 -85.975 -5.782 9.890 1.00 10.50 C ATOM 900 CG LEU A 700 -85.866 -4.278 9.935 1.00 8.76 C ATOM 901 CD1 LEU A 700 -85.686 -3.731 8.516 1.00 10.12 C ATOM 902 CD2 LEU A 700 -87.123 -3.698 10.508 1.00 9.30 C ATOM 903 H LEU A 700 -85.931 -8.281 10.024 1.00 0.00 H ATOM 904 N ASP A 701 -83.289 -6.591 11.342 1.00 8.78 N ATOM 905 CA ASP A 701 -82.115 -6.095 12.064 1.00 9.32 C ATOM 906 C ASP A 701 -80.811 -6.431 11.345 1.00 9.03 C ATOM 907 O ASP A 701 -79.952 -5.562 11.144 1.00 9.97 O ATOM 908 CB ASP A 701 -82.083 -6.614 13.515 1.00 10.33 C ATOM 909 CG ASP A 701 -81.989 -8.126 13.634 1.00 11.60 C ATOM 910 OD1 ASP A 701 -82.439 -8.875 12.763 1.00 13.67 O ATOM 911 OD2 ASP A 701 -81.413 -8.553 14.669 1.00 15.37 O ATOM 912 H ASP A 701 -83.912 -7.308 11.765 1.00 0.00 H ATOM 913 N LYS A 702 -80.668 -7.673 10.912 1.00 8.72 N ATOM 914 CA LYS A 702 -79.444 -8.062 10.216 1.00 10.48 C ATOM 915 C LYS A 702 -79.374 -7.402 8.844 1.00 8.16 C ATOM 916 O LYS A 702 -78.282 -7.036 8.383 1.00 9.31 O ATOM 917 CB LYS A 702 -79.441 -9.585 10.072 1.00 12.16 C ATOM 918 CG LYS A 702 -78.142 -10.174 9.612 1.00 18.21 C ATOM 919 CD LYS A 702 -78.146 -11.680 9.887 1.00 20.54 C ATOM 920 CE LYS A 702 -76.855 -12.364 9.387 1.00 27.32 C ATOM 921 NZ LYS A 702 -76.784 -12.283 7.900 1.00 33.20 N ATOM 922 HZ1 LYS A 702 -77.610 -12.763 7.488 1.00 0.00 H ATOM 923 HZ2 LYS A 702 -76.780 -11.285 7.608 1.00 0.00 H ATOM 924 HZ3 LYS A 702 -75.913 -12.745 7.570 1.00 0.00 H ATOM 925 H LYS A 702 -81.424 -8.370 11.067 1.00 0.00 H ATOM 926 N PHE A 703 -80.507 -7.295 8.174 1.00 8.87 N ATOM 927 CA PHE A 703 -80.581 -6.628 6.882 1.00 9.34 C ATOM 928 C PHE A 703 -80.048 -5.203 6.959 1.00 11.05 C ATOM 929 O PHE A 703 -79.143 -4.822 6.182 1.00 10.04 O ATOM 930 CB PHE A 703 -82.060 -6.635 6.461 1.00 9.00 C ATOM 931 CG PHE A 703 -82.352 -5.892 5.174 1.00 7.99 C ATOM 932 CD1 PHE A 703 -81.952 -6.386 3.921 1.00 11.49 C ATOM 933 CD2 PHE A 703 -83.025 -4.688 5.225 1.00 10.45 C ATOM 934 CE1 PHE A 703 -82.270 -5.645 2.751 1.00 13.02 C ATOM 935 CE2 PHE A 703 -83.366 -3.992 4.060 1.00 11.31 C ATOM 936 CZ PHE A 703 -82.998 -4.497 2.826 1.00 11.91 C ATOM 937 H PHE A 703 -81.374 -7.700 8.582 1.00 0.00 H ATOM 938 N LEU A 704 -80.525 -4.430 7.934 1.00 8.98 N ATOM 939 CA LEU A 704 -80.081 -3.050 8.048 1.00 10.42 C ATOM 940 C LEU A 704 -78.588 -2.965 8.336 1.00 8.98 C ATOM 941 O LEU A 704 -77.892 -2.081 7.804 1.00 9.56 O ATOM 942 CB LEU A 704 -80.818 -2.363 9.169 1.00 12.66 C ATOM 943 CG LEU A 704 -82.329 -2.188 9.054 1.00 16.82 C ATOM 944 CD1 LEU A 704 -82.901 -1.915 10.484 1.00 18.01 C ATOM 945 CD2 LEU A 704 -82.595 -1.090 8.140 1.00 23.07 C ATOM 946 H LEU A 704 -81.214 -4.813 8.612 1.00 0.00 H ATOM 947 N ARG A 705 -78.084 -3.865 9.187 1.00 7.29 N ATOM 948 CA ARG A 705 -76.678 -3.782 9.559 1.00 8.53 C ATOM 949 C ARG A 705 -75.778 -4.152 8.387 1.00 10.87 C ATOM 950 O ARG A 705 -74.609 -3.702 8.338 1.00 13.13 O ATOM 951 CB ARG A 705 -76.441 -4.760 10.710 1.00 9.78 C ATOM 952 CG ARG A 705 -77.125 -4.332 12.064 1.00 9.52 C ATOM 953 CD ARG A 705 -77.132 -5.487 13.072 1.00 8.77 C ATOM 954 NE ARG A 705 -78.037 -5.077 14.159 1.00 9.29 N ATOM 955 CZ ARG A 705 -78.683 -5.943 14.927 1.00 8.67 C ATOM 956 NH1 ARG A 705 -79.532 -5.510 15.871 1.00 10.32 N ATOM 957 NH2 ARG A 705 -78.461 -7.252 14.747 1.00 9.81 N ATOM 958 HE ARG A 705 -78.176 -4.061 14.332 1.00 0.00 H ATOM 959 HH12 ARG A 705 -80.036 -6.194 16.471 1.00 0.00 H ATOM 960 HH11 ARG A 705 -79.686 -4.490 16.003 1.00 0.00 H ATOM 961 HH22 ARG A 705 -78.957 -7.950 15.338 1.00 0.00 H ATOM 962 HH21 ARG A 705 -77.793 -7.570 14.016 1.00 0.00 H ATOM 963 H ARG A 705 -78.689 -4.615 9.579 1.00 0.00 H ATOM 964 N GLU A 706 -76.262 -4.979 7.481 1.00 9.67 N ATOM 965 CA GLU A 706 -75.548 -5.372 6.268 1.00 10.93 C ATOM 966 C GLU A 706 -75.717 -4.379 5.136 1.00 14.67 C ATOM 967 O GLU A 706 -74.964 -4.446 4.163 1.00 19.35 O ATOM 968 CB GLU A 706 -75.986 -6.790 5.872 1.00 11.11 C ATOM 969 CG GLU A 706 -75.590 -7.771 7.009 1.00 12.32 C ATOM 970 CD GLU A 706 -75.916 -9.195 6.803 1.00 15.46 C ATOM 971 OE1 GLU A 706 -76.482 -9.544 5.753 1.00 19.36 O ATOM 972 OE2 GLU A 706 -75.580 -9.962 7.712 1.00 17.78 O ATOM 973 H GLU A 706 -77.210 -5.376 7.639 1.00 0.00 H ATOM 974 N LYS A 707 -76.620 -3.425 5.269 1.00 12.18 N ATOM 975 CA LYS A 707 -76.931 -2.470 4.205 1.00 14.43 C ATOM 976 C LYS A 707 -76.784 -1.034 4.700 1.00 12.22 C ATOM 977 O LYS A 707 -77.525 -0.158 4.283 1.00 13.22 O ATOM 978 CB LYS A 707 -78.342 -2.684 3.656 1.00 16.46 C ATOM 979 CG LYS A 707 -78.681 -4.099 3.183 1.00 15.51 C ATOM 980 CD LYS A 707 -78.002 -4.477 1.948 1.00 19.75 C ATOM 981 CE LYS A 707 -78.155 -5.988 1.801 1.00 21.29 C ATOM 982 NZ LYS A 707 -77.942 -6.360 0.394 1.00 26.04 N ATOM 983 HZ1 LYS A 707 -78.645 -5.877 -0.201 1.00 0.00 H ATOM 984 HZ2 LYS A 707 -76.985 -6.075 0.102 1.00 0.00 H ATOM 985 HZ3 LYS A 707 -78.045 -7.390 0.289 1.00 0.00 H ATOM 986 H LYS A 707 -77.133 -3.349 6.170 1.00 0.00 H ATOM 987 N ASP A 708 -75.833 -0.804 5.612 1.00 12.90 N ATOM 988 CA ASP A 708 -75.738 0.457 6.333 1.00 12.46 C ATOM 989 C ASP A 708 -75.576 1.601 5.336 1.00 14.73 C ATOM 990 O ASP A 708 -74.701 1.570 4.471 1.00 15.37 O ATOM 991 CB ASP A 708 -74.536 0.375 7.289 1.00 14.84 C ATOM 992 CG ASP A 708 -74.515 1.477 8.334 1.00 22.11 C ATOM 993 OD1 ASP A 708 -75.350 2.387 8.288 1.00 22.51 O ATOM 994 OD2 ASP A 708 -73.603 1.446 9.173 1.00 25.72 O ATOM 995 H ASP A 708 -75.138 -1.551 5.813 1.00 0.00 H ATOM 996 N GLY A 709 -76.438 2.592 5.437 1.00 12.53 N ATOM 997 CA GLY A 709 -76.382 3.773 4.603 1.00 13.89 C ATOM 998 C GLY A 709 -76.943 3.626 3.198 1.00 14.58 C ATOM 999 O GLY A 709 -76.853 4.583 2.421 1.00 19.53 O ATOM 1000 H GLY A 709 -77.193 2.522 6.149 1.00 0.00 H ATOM 1001 N GLU A 710 -77.509 2.480 2.841 1.00 12.82 N ATOM 1002 CA GLU A 710 -77.870 2.203 1.444 1.00 11.15 C ATOM 1003 C GLU A 710 -79.258 2.664 1.039 1.00 12.97 C ATOM 1004 O GLU A 710 -79.589 2.575 -0.157 1.00 16.77 O ATOM 1005 CB GLU A 710 -77.679 0.704 1.126 1.00 14.67 C ATOM 1006 CG GLU A 710 -76.194 0.270 1.175 1.00 16.16 C ATOM 1007 CD GLU A 710 -75.953 -1.185 0.852 1.00 17.50 C ATOM 1008 OE1 GLU A 710 -76.763 -1.784 0.120 1.00 20.41 O ATOM 1009 OE2 GLU A 710 -74.987 -1.763 1.397 1.00 22.84 O ATOM 1010 H GLU A 710 -77.702 1.761 3.567 1.00 0.00 H ATOM 1011 N PHE A 711 -80.059 3.181 1.954 1.00 11.89 N ATOM 1012 CA PHE A 711 -81.449 3.529 1.662 1.00 11.61 C ATOM 1013 C PHE A 711 -81.703 5.011 1.860 1.00 14.83 C ATOM 1014 O PHE A 711 -81.018 5.675 2.636 1.00 19.19 O ATOM 1015 CB PHE A 711 -82.429 2.723 2.515 1.00 13.19 C ATOM 1016 CG PHE A 711 -82.250 1.273 2.341 1.00 11.47 C ATOM 1017 CD1 PHE A 711 -82.346 0.722 1.081 1.00 21.06 C ATOM 1018 CD2 PHE A 711 -81.916 0.465 3.383 1.00 13.29 C ATOM 1019 CE1 PHE A 711 -82.132 -0.617 0.894 1.00 20.88 C ATOM 1020 CE2 PHE A 711 -81.703 -0.872 3.189 1.00 16.23 C ATOM 1021 CZ PHE A 711 -81.828 -1.411 1.950 1.00 20.52 C ATOM 1022 H PHE A 711 -79.689 3.346 2.912 1.00 0.00 H ATOM 1023 N SER A 712 -82.693 5.526 1.151 1.00 12.89 N ATOM 1024 CA SER A 712 -83.106 6.884 1.413 1.00 13.53 C ATOM 1025 C SER A 712 -83.900 6.973 2.733 1.00 16.00 C ATOM 1026 O SER A 712 -84.451 5.999 3.240 1.00 13.45 O ATOM 1027 CB SER A 712 -83.941 7.423 0.251 1.00 14.96 C ATOM 1028 OG SER A 712 -85.210 6.810 0.267 1.00 15.94 O ATOM 1029 HG SER A 712 -85.753 7.157 -0.485 1.00 0.00 H ATOM 1030 H SER A 712 -83.166 4.962 0.417 1.00 0.00 H ATOM 1031 N VAL A 713 -83.944 8.181 3.292 1.00 14.84 N ATOM 1032 CA VAL A 713 -84.773 8.404 4.474 1.00 18.91 C ATOM 1033 C VAL A 713 -86.236 8.061 4.193 1.00 15.31 C ATOM 1034 O VAL A 713 -86.929 7.457 5.027 1.00 13.49 O ATOM 1035 CB VAL A 713 -84.568 9.832 5.007 1.00 21.85 C ATOM 1036 CG1 VAL A 713 -85.570 10.102 6.057 1.00 20.67 C ATOM 1037 CG2 VAL A 713 -83.185 9.975 5.625 1.00 23.26 C ATOM 1038 H VAL A 713 -83.390 8.963 2.888 1.00 0.00 H ATOM 1039 N LEU A 714 -86.713 8.359 2.982 1.00 13.67 N ATOM 1040 CA LEU A 714 -88.081 8.012 2.620 1.00 13.16 C ATOM 1041 C LEU A 714 -88.311 6.494 2.629 1.00 9.90 C ATOM 1042 O LEU A 714 -89.379 6.018 3.069 1.00 12.26 O ATOM 1043 CB LEU A 714 -88.380 8.631 1.246 1.00 15.45 C ATOM 1044 CG LEU A 714 -89.808 8.453 0.856 1.00 17.67 C ATOM 1045 CD1 LEU A 714 -90.742 9.225 1.780 1.00 16.75 C ATOM 1046 CD2 LEU A 714 -89.998 8.928 -0.586 1.00 26.37 C ATOM 1047 H LEU A 714 -86.103 8.842 2.292 1.00 0.00 H ATOM 1048 N GLN A 715 -87.346 5.715 2.106 1.00 9.30 N ATOM 1049 CA GLN A 715 -87.459 4.261 2.169 1.00 9.22 C ATOM 1050 C GLN A 715 -87.512 3.788 3.611 1.00 12.17 C ATOM 1051 O GLN A 715 -88.314 2.918 3.943 1.00 10.76 O ATOM 1052 CB GLN A 715 -86.274 3.615 1.449 1.00 11.95 C ATOM 1053 CG GLN A 715 -86.421 3.696 -0.087 1.00 11.65 C ATOM 1054 CD GLN A 715 -85.166 3.231 -0.807 1.00 17.18 C ATOM 1055 OE1 GLN A 715 -84.034 3.631 -0.491 1.00 14.24 O ATOM 1056 NE2 GLN A 715 -85.364 2.408 -1.824 1.00 15.75 N ATOM 1057 HE22 GLN A 715 -86.327 2.094 -2.059 1.00 0.00 H ATOM 1058 HE21 GLN A 715 -84.556 2.075 -2.388 1.00 0.00 H ATOM 1059 H GLN A 715 -86.516 6.151 1.655 1.00 0.00 H ATOM 1060 N LEU A 716 -86.621 4.300 4.465 1.00 9.88 N ATOM 1061 CA LEU A 716 -86.663 3.888 5.868 1.00 9.52 C ATOM 1062 C LEU A 716 -88.026 4.198 6.500 1.00 8.81 C ATOM 1063 O LEU A 716 -88.590 3.362 7.231 1.00 9.20 O ATOM 1064 CB LEU A 716 -85.552 4.562 6.658 1.00 10.72 C ATOM 1065 CG LEU A 716 -84.142 4.201 6.204 1.00 9.27 C ATOM 1066 CD1 LEU A 716 -83.107 5.100 6.953 1.00 13.54 C ATOM 1067 CD2 LEU A 716 -83.888 2.714 6.483 1.00 13.69 C ATOM 1068 H LEU A 716 -85.908 4.982 4.137 1.00 0.00 H ATOM 1069 N VAL A 717 -88.545 5.410 6.283 1.00 10.73 N ATOM 1070 CA VAL A 717 -89.850 5.730 6.846 1.00 9.43 C ATOM 1071 C VAL A 717 -90.954 4.831 6.293 1.00 8.83 C ATOM 1072 O VAL A 717 -91.916 4.490 7.003 1.00 9.03 O ATOM 1073 CB VAL A 717 -90.143 7.246 6.687 1.00 8.30 C ATOM 1074 CG1 VAL A 717 -91.606 7.622 7.181 1.00 10.29 C ATOM 1075 CG2 VAL A 717 -89.084 7.987 7.457 1.00 12.06 C ATOM 1076 H VAL A 717 -88.025 6.114 5.721 1.00 0.00 H ATOM 1077 N GLY A 718 -90.873 4.479 5.000 1.00 9.38 N ATOM 1078 CA GLY A 718 -91.858 3.586 4.401 1.00 10.71 C ATOM 1079 C GLY A 718 -91.829 2.217 5.066 1.00 10.16 C ATOM 1080 O GLY A 718 -92.873 1.605 5.296 1.00 11.96 O ATOM 1081 H GLY A 718 -90.096 4.849 4.416 1.00 0.00 H ATOM 1082 N MET A 719 -90.651 1.760 5.457 1.00 10.06 N ATOM 1083 CA MET A 719 -90.569 0.490 6.181 1.00 9.43 C ATOM 1084 C MET A 719 -91.286 0.611 7.523 1.00 10.40 C ATOM 1085 O MET A 719 -91.984 -0.311 7.960 1.00 10.51 O ATOM 1086 CB MET A 719 -89.109 0.111 6.464 1.00 12.01 C ATOM 1087 CG MET A 719 -88.335 -0.085 5.211 1.00 13.79 C ATOM 1088 SD MET A 719 -86.551 -0.266 5.565 1.00 28.84 S ATOM 1089 CE MET A 719 -86.561 -2.022 5.386 1.00 22.42 C ATOM 1090 H MET A 719 -89.787 2.300 5.251 1.00 0.00 H ATOM 1091 N LEU A 720 -91.127 1.756 8.198 1.00 9.07 N ATOM 1092 CA LEU A 720 -91.793 1.950 9.486 1.00 8.78 C ATOM 1093 C LEU A 720 -93.298 2.021 9.324 1.00 9.53 C ATOM 1094 O LEU A 720 -94.035 1.532 10.185 1.00 8.89 O ATOM 1095 CB LEU A 720 -91.264 3.199 10.165 1.00 11.26 C ATOM 1096 CG LEU A 720 -89.817 2.994 10.660 1.00 10.71 C ATOM 1097 CD1 LEU A 720 -89.339 4.362 11.167 1.00 15.18 C ATOM 1098 CD2 LEU A 720 -89.675 1.981 11.759 1.00 12.35 C ATOM 1099 H LEU A 720 -90.528 2.510 7.805 1.00 0.00 H ATOM 1100 N ARG A 721 -93.770 2.655 8.251 1.00 8.48 N ATOM 1101 CA ARG A 721 -95.205 2.692 7.984 1.00 9.75 C ATOM 1102 C ARG A 721 -95.759 1.279 7.862 1.00 9.18 C ATOM 1103 O ARG A 721 -96.788 0.946 8.464 1.00 10.00 O ATOM 1104 CB ARG A 721 -95.440 3.480 6.695 1.00 8.66 C ATOM 1105 CG ARG A 721 -96.868 3.866 6.490 1.00 11.25 C ATOM 1106 CD ARG A 721 -97.666 2.814 5.772 1.00 13.78 C ATOM 1107 NE ARG A 721 -99.039 3.302 5.653 1.00 20.05 N ATOM 1108 CZ ARG A 721 -100.103 2.575 5.338 1.00 14.45 C ATOM 1109 NH1 ARG A 721 -99.981 1.281 5.077 1.00 18.04 N ATOM 1110 NH2 ARG A 721 -101.290 3.178 5.272 1.00 13.35 N ATOM 1111 HE ARG A 721 -99.196 4.314 5.832 1.00 0.00 H ATOM 1112 HH12 ARG A 721 -100.821 0.719 4.831 1.00 0.00 H ATOM 1113 HH11 ARG A 721 -99.046 0.828 5.118 1.00 0.00 H ATOM 1114 HH22 ARG A 721 -102.139 2.630 5.027 1.00 0.00 H ATOM 1115 HH21 ARG A 721 -101.367 4.197 5.465 1.00 0.00 H ATOM 1116 H ARG A 721 -93.111 3.127 7.599 1.00 0.00 H ATOM 1117 N GLY A 722 -95.075 0.429 7.113 1.00 8.49 N ATOM 1118 CA GLY A 722 -95.556 -0.936 6.917 1.00 7.74 C ATOM 1119 C GLY A 722 -95.590 -1.692 8.224 1.00 8.34 C ATOM 1120 O GLY A 722 -96.602 -2.344 8.546 1.00 8.37 O ATOM 1121 H GLY A 722 -94.190 0.735 6.661 1.00 0.00 H ATOM 1122 N ILE A 723 -94.529 -1.556 9.039 1.00 7.82 N ATOM 1123 CA ILE A 723 -94.554 -2.216 10.343 1.00 9.68 C ATOM 1124 C ILE A 723 -95.702 -1.700 11.207 1.00 9.20 C ATOM 1125 O ILE A 723 -96.414 -2.486 11.844 1.00 8.36 O ATOM 1126 CB ILE A 723 -93.211 -2.043 11.046 1.00 7.12 C ATOM 1127 CG1 ILE A 723 -92.064 -2.688 10.244 1.00 11.41 C ATOM 1128 CG2 ILE A 723 -93.280 -2.644 12.491 1.00 7.68 C ATOM 1129 CD1 ILE A 723 -90.661 -2.066 10.543 1.00 9.34 C ATOM 1130 H ILE A 723 -93.706 -0.992 8.747 1.00 0.00 H ATOM 1131 N ALA A 724 -95.922 -0.386 11.228 1.00 8.81 N ATOM 1132 CA ALA A 724 -97.008 0.171 12.010 1.00 8.35 C ATOM 1133 C ALA A 724 -98.356 -0.301 11.522 1.00 6.60 C ATOM 1134 O ALA A 724 -99.284 -0.503 12.332 1.00 7.24 O ATOM 1135 CB ALA A 724 -96.989 1.698 11.892 1.00 9.00 C ATOM 1136 H ALA A 724 -95.308 0.247 10.677 1.00 0.00 H ATOM 1137 N ALA A 725 -98.515 -0.431 10.179 1.00 7.32 N ATOM 1138 CA ALA A 725 -99.786 -0.914 9.651 1.00 9.69 C ATOM 1139 C ALA A 725 -100.053 -2.354 10.097 1.00 6.04 C ATOM 1140 O ALA A 725 -101.188 -2.697 10.491 1.00 7.51 O ATOM 1141 CB ALA A 725 -99.815 -0.793 8.129 1.00 9.92 C ATOM 1142 H ALA A 725 -97.737 -0.188 9.533 1.00 0.00 H ATOM 1143 N GLY A 726 -99.024 -3.204 10.016 1.00 7.22 N ATOM 1144 CA GLY A 726 -99.196 -4.561 10.535 1.00 8.63 C ATOM 1145 C GLY A 726 -99.554 -4.561 12.015 1.00 7.60 C ATOM 1146 O GLY A 726 -100.410 -5.336 12.448 1.00 8.18 O ATOM 1147 H GLY A 726 -98.121 -2.907 9.593 1.00 0.00 H ATOM 1148 N MET A 727 -98.869 -3.732 12.816 1.00 7.15 N ATOM 1149 CA MET A 727 -99.141 -3.665 14.241 1.00 7.31 C ATOM 1150 C MET A 727 -100.513 -3.107 14.531 1.00 7.95 C ATOM 1151 O MET A 727 -101.157 -3.568 15.472 1.00 7.06 O ATOM 1152 CB MET A 727 -98.087 -2.836 14.958 1.00 8.50 C ATOM 1153 CG MET A 727 -96.743 -3.551 15.000 1.00 6.18 C ATOM 1154 SD MET A 727 -96.779 -5.160 15.755 1.00 9.27 S ATOM 1155 CE MET A 727 -97.595 -4.821 17.311 1.00 9.38 C ATOM 1156 H MET A 727 -98.129 -3.125 12.409 1.00 0.00 H ATOM 1157 N LYS A 728 -101.001 -2.142 13.741 1.00 6.74 N ATOM 1158 CA LYS A 728 -102.358 -1.658 14.013 1.00 7.23 C ATOM 1159 C LYS A 728 -103.349 -2.782 13.806 1.00 6.55 C ATOM 1160 O LYS A 728 -104.312 -2.936 14.564 1.00 9.10 O ATOM 1161 CB LYS A 728 -102.671 -0.466 13.087 1.00 9.36 C ATOM 1162 CG LYS A 728 -104.097 0.099 13.287 1.00 9.21 C ATOM 1163 CD LYS A 728 -104.422 1.156 12.189 1.00 10.48 C ATOM 1164 CE LYS A 728 -105.792 1.714 12.513 1.00 11.93 C ATOM 1165 NZ LYS A 728 -106.207 2.679 11.427 1.00 14.38 N ATOM 1166 HZ1 LYS A 728 -105.518 3.456 11.373 1.00 0.00 H ATOM 1167 HZ2 LYS A 728 -106.240 2.180 10.515 1.00 0.00 H ATOM 1168 HZ3 LYS A 728 -107.148 3.063 11.648 1.00 0.00 H ATOM 1169 H LYS A 728 -100.436 -1.749 12.961 1.00 0.00 H ATOM 1170 N TYR A 729 -103.120 -3.562 12.742 1.00 7.84 N ATOM 1171 CA TYR A 729 -103.992 -4.686 12.449 1.00 7.14 C ATOM 1172 C TYR A 729 -103.966 -5.685 13.592 1.00 8.66 C ATOM 1173 O TYR A 729 -105.031 -6.095 14.090 1.00 7.84 O ATOM 1174 CB TYR A 729 -103.557 -5.311 11.127 1.00 8.18 C ATOM 1175 CG TYR A 729 -104.331 -6.548 10.755 1.00 8.31 C ATOM 1176 CD1 TYR A 729 -105.586 -6.435 10.167 1.00 10.26 C ATOM 1177 CD2 TYR A 729 -103.795 -7.834 10.962 1.00 9.42 C ATOM 1178 CE1 TYR A 729 -106.304 -7.592 9.816 1.00 9.43 C ATOM 1179 CE2 TYR A 729 -104.514 -8.980 10.606 1.00 10.00 C ATOM 1180 CZ TYR A 729 -105.725 -8.834 10.063 1.00 9.46 C ATOM 1181 OH TYR A 729 -106.443 -9.932 9.653 1.00 12.30 O ATOM 1182 HH TYR A 729 -107.310 -9.637 9.278 1.00 0.00 H ATOM 1183 H TYR A 729 -102.311 -3.361 12.120 1.00 0.00 H ATOM 1184 N LEU A 730 -102.785 -6.097 14.042 1.00 8.07 N ATOM 1185 CA LEU A 730 -102.715 -7.031 15.166 1.00 8.05 C ATOM 1186 C LEU A 730 -103.438 -6.475 16.382 1.00 6.45 C ATOM 1187 O LEU A 730 -104.213 -7.194 17.034 1.00 8.84 O ATOM 1188 CB LEU A 730 -101.255 -7.331 15.522 1.00 7.27 C ATOM 1189 CG LEU A 730 -100.500 -8.078 14.417 1.00 8.35 C ATOM 1190 CD1 LEU A 730 -99.055 -8.280 14.908 1.00 8.68 C ATOM 1191 CD2 LEU A 730 -101.106 -9.454 14.173 1.00 10.78 C ATOM 1192 H LEU A 730 -101.910 -5.755 13.595 1.00 0.00 H ATOM 1193 N ALA A 731 -103.197 -5.193 16.712 1.00 7.52 N ATOM 1194 CA ALA A 731 -103.793 -4.604 17.907 1.00 7.17 C ATOM 1195 C ALA A 731 -105.321 -4.594 17.790 1.00 7.63 C ATOM 1196 O ALA A 731 -106.034 -5.009 18.715 1.00 9.83 O ATOM 1197 CB ALA A 731 -103.270 -3.179 18.090 1.00 9.39 C ATOM 1198 H ALA A 731 -102.578 -4.615 16.108 1.00 0.00 H ATOM 1199 N ASN A 732 -105.813 -4.279 16.611 1.00 9.38 N ATOM 1200 CA ASN A 732 -107.252 -4.226 16.451 1.00 9.46 C ATOM 1201 C ASN A 732 -107.870 -5.606 16.391 1.00 8.84 C ATOM 1202 O ASN A 732 -109.064 -5.733 16.718 1.00 9.43 O ATOM 1203 CB ASN A 732 -107.596 -3.305 15.288 1.00 10.21 C ATOM 1204 CG ASN A 732 -107.408 -1.850 15.652 1.00 11.03 C ATOM 1205 OD1 ASN A 732 -107.482 -1.480 16.841 1.00 13.28 O ATOM 1206 ND2 ASN A 732 -107.247 -1.027 14.661 1.00 13.41 N ATOM 1207 HD22 ASN A 732 -107.192 -1.389 13.688 1.00 0.00 H ATOM 1208 HD21 ASN A 732 -107.173 -0.005 14.840 1.00 0.00 H ATOM 1209 H ASN A 732 -105.182 -4.072 15.811 1.00 0.00 H ATOM 1210 N MET A 733 -107.076 -6.620 16.024 1.00 7.53 N ATOM 1211 CA MET A 733 -107.472 -8.025 16.088 1.00 10.67 C ATOM 1212 C MET A 733 -107.294 -8.609 17.475 1.00 13.32 C ATOM 1213 O MET A 733 -107.501 -9.836 17.632 1.00 12.42 O ATOM 1214 CB MET A 733 -106.683 -8.860 15.057 1.00 9.24 C ATOM 1215 CG MET A 733 -106.993 -8.420 13.642 1.00 8.20 C ATOM 1216 SD MET A 733 -108.637 -8.904 13.043 1.00 11.83 S ATOM 1217 CE MET A 733 -108.519 -10.706 12.929 1.00 13.47 C ATOM 1218 H MET A 733 -106.123 -6.395 15.673 1.00 0.00 H ATOM 1219 N ASN A 734 -106.926 -7.776 18.452 1.00 11.55 N ATOM 1220 CA ASN A 734 -106.818 -8.198 19.865 1.00 11.01 C ATOM 1221 C ASN A 734 -105.652 -9.138 20.060 1.00 12.85 C ATOM 1222 O ASN A 734 -105.712 -10.066 20.879 1.00 11.73 O ATOM 1223 CB ASN A 734 -108.135 -8.786 20.405 1.00 15.65 C ATOM 1224 CG ASN A 734 -108.207 -8.728 21.923 1.00 13.81 C ATOM 1225 OD1 ASN A 734 -107.595 -7.869 22.545 1.00 21.94 O ATOM 1226 ND2 ASN A 734 -108.942 -9.656 22.510 1.00 25.87 N ATOM 1227 HD22 ASN A 734 -109.442 -10.364 21.935 1.00 0.00 H ATOM 1228 HD21 ASN A 734 -109.020 -9.679 23.547 1.00 0.00 H ATOM 1229 H ASN A 734 -106.706 -6.789 18.209 1.00 0.00 H ATOM 1230 N TYR A 735 -104.552 -8.858 19.354 1.00 8.99 N ATOM 1231 CA TYR A 735 -103.350 -9.662 19.462 1.00 10.11 C ATOM 1232 C TYR A 735 -102.247 -8.745 19.948 1.00 9.94 C ATOM 1233 O TYR A 735 -101.893 -7.780 19.263 1.00 11.82 O ATOM 1234 CB TYR A 735 -102.949 -10.296 18.131 1.00 12.62 C ATOM 1235 CG TYR A 735 -101.752 -11.196 18.277 1.00 12.47 C ATOM 1236 CD1 TYR A 735 -101.911 -12.501 18.741 1.00 13.86 C ATOM 1237 CD2 TYR A 735 -100.442 -10.752 18.010 1.00 12.68 C ATOM 1238 CE1 TYR A 735 -100.809 -13.352 18.915 1.00 12.80 C ATOM 1239 CE2 TYR A 735 -99.343 -11.596 18.196 1.00 10.13 C ATOM 1240 CZ TYR A 735 -99.539 -12.885 18.634 1.00 12.40 C ATOM 1241 OH TYR A 735 -98.400 -13.683 18.793 1.00 14.81 O ATOM 1242 HH TYR A 735 -97.796 -13.265 19.457 1.00 0.00 H ATOM 1243 H TYR A 735 -104.558 -8.042 18.710 1.00 0.00 H ATOM 1244 N VAL A 736 -101.713 -9.047 21.123 1.00 10.10 N ATOM 1245 CA VAL A 736 -100.557 -8.322 21.651 1.00 7.59 C ATOM 1246 C VAL A 736 -99.292 -9.107 21.308 1.00 12.07 C ATOM 1247 O VAL A 736 -99.196 -10.295 21.620 1.00 11.52 O ATOM 1248 CB VAL A 736 -100.705 -8.199 23.179 1.00 9.03 C ATOM 1249 CG1 VAL A 736 -99.493 -7.485 23.829 1.00 10.76 C ATOM 1250 CG2 VAL A 736 -102.027 -7.485 23.568 1.00 12.41 C ATOM 1251 H VAL A 736 -102.126 -9.819 21.684 1.00 0.00 H ATOM 1252 N HIS A 737 -98.316 -8.450 20.690 1.00 9.92 N ATOM 1253 CA HIS A 737 -97.192 -9.192 20.161 1.00 9.48 C ATOM 1254 C HIS A 737 -96.218 -9.602 21.275 1.00 10.15 C ATOM 1255 O HIS A 737 -95.768 -10.750 21.335 1.00 10.30 O ATOM 1256 CB HIS A 737 -96.476 -8.318 19.136 1.00 10.62 C ATOM 1257 CG HIS A 737 -95.458 -9.055 18.352 1.00 9.28 C ATOM 1258 ND1 HIS A 737 -94.254 -9.407 18.890 1.00 9.38 N ATOM 1259 CD2 HIS A 737 -95.487 -9.593 17.106 1.00 10.92 C ATOM 1260 CE1 HIS A 737 -93.542 -10.091 18.005 1.00 12.30 C ATOM 1261 NE2 HIS A 737 -94.274 -10.214 16.907 1.00 13.02 N ATOM 1262 H HIS A 737 -98.360 -7.416 20.588 1.00 0.00 H ATOM 1263 N ARG A 738 -95.896 -8.662 22.172 1.00 8.10 N ATOM 1264 CA ARG A 738 -95.011 -8.826 23.328 1.00 9.70 C ATOM 1265 C ARG A 738 -93.537 -8.831 22.995 1.00 10.61 C ATOM 1266 O ARG A 738 -92.712 -8.667 23.904 1.00 12.97 O ATOM 1267 CB ARG A 738 -95.291 -10.075 24.193 1.00 9.85 C ATOM 1268 CG ARG A 738 -96.690 -10.055 24.843 1.00 11.55 C ATOM 1269 CD ARG A 738 -97.303 -11.478 24.940 1.00 26.18 C ATOM 1270 NE ARG A 738 -97.791 -11.771 23.594 1.00 30.20 N ATOM 1271 CZ ARG A 738 -97.773 -12.953 23.004 1.00 20.28 C ATOM 1272 NH1 ARG A 738 -97.332 -14.024 23.642 1.00 27.41 N ATOM 1273 NH2 ARG A 738 -98.182 -13.058 21.761 1.00 21.27 N ATOM 1274 HE ARG A 738 -98.188 -10.978 23.052 1.00 0.00 H ATOM 1275 HH12 ARG A 738 -97.324 -14.948 23.164 1.00 0.00 H ATOM 1276 HH11 ARG A 738 -96.993 -13.943 24.622 1.00 0.00 H ATOM 1277 HH22 ARG A 738 -98.172 -13.984 21.287 1.00 0.00 H ATOM 1278 HH21 ARG A 738 -98.516 -12.216 21.251 1.00 0.00 H ATOM 1279 H ARG A 738 -96.316 -7.721 22.034 1.00 0.00 H ATOM 1280 N ASP A 739 -93.181 -9.036 21.716 1.00 9.40 N ATOM 1281 CA ASP A 739 -91.769 -9.173 21.370 1.00 9.72 C ATOM 1282 C ASP A 739 -91.474 -8.427 20.086 1.00 11.26 C ATOM 1283 O ASP A 739 -90.735 -8.902 19.221 1.00 12.26 O ATOM 1284 CB ASP A 739 -91.388 -10.650 21.266 1.00 13.48 C ATOM 1285 CG ASP A 739 -89.862 -10.877 21.315 1.00 17.59 C ATOM 1286 OD1 ASP A 739 -89.089 -9.999 21.756 1.00 17.85 O ATOM 1287 OD2 ASP A 739 -89.440 -11.963 20.885 1.00 18.82 O ATOM 1288 H ASP A 739 -93.908 -9.097 20.975 1.00 0.00 H ATOM 1289 N LEU A 740 -91.975 -7.213 19.970 1.00 9.11 N ATOM 1290 CA LEU A 740 -91.778 -6.454 18.744 1.00 9.32 C ATOM 1291 C LEU A 740 -90.377 -5.845 18.763 1.00 8.88 C ATOM 1292 O LEU A 740 -90.002 -5.164 19.716 1.00 10.34 O ATOM 1293 CB LEU A 740 -92.848 -5.353 18.668 1.00 10.31 C ATOM 1294 CG LEU A 740 -92.753 -4.389 17.462 1.00 9.09 C ATOM 1295 CD1 LEU A 740 -92.758 -5.140 16.136 1.00 10.69 C ATOM 1296 CD2 LEU A 740 -93.739 -3.282 17.497 1.00 10.18 C ATOM 1297 H LEU A 740 -92.513 -6.797 20.757 1.00 0.00 H ATOM 1298 N ALA A 741 -89.608 -6.086 17.709 1.00 9.08 N ATOM 1299 CA ALA A 741 -88.187 -5.738 17.620 1.00 8.47 C ATOM 1300 C ALA A 741 -87.831 -5.978 16.166 1.00 9.04 C ATOM 1301 O ALA A 741 -88.457 -6.782 15.482 1.00 8.08 O ATOM 1302 CB ALA A 741 -87.342 -6.627 18.556 1.00 8.26 C ATOM 1303 H ALA A 741 -90.044 -6.554 16.889 1.00 0.00 H ATOM 1304 N ALA A 742 -86.769 -5.301 15.689 1.00 8.48 N ATOM 1305 CA ALA A 742 -86.403 -5.470 14.281 1.00 7.89 C ATOM 1306 C ALA A 742 -86.028 -6.914 13.960 1.00 9.54 C ATOM 1307 O ALA A 742 -86.272 -7.378 12.834 1.00 10.15 O ATOM 1308 CB ALA A 742 -85.238 -4.554 13.912 1.00 11.69 C ATOM 1309 H ALA A 742 -86.220 -4.671 16.308 1.00 0.00 H ATOM 1310 N ARG A 743 -85.521 -7.673 14.935 1.00 8.51 N ATOM 1311 CA ARG A 743 -85.192 -9.079 14.735 1.00 9.44 C ATOM 1312 C ARG A 743 -86.421 -9.922 14.447 1.00 9.06 C ATOM 1313 O ARG A 743 -86.260 -11.016 13.882 1.00 12.60 O ATOM 1314 CB ARG A 743 -84.436 -9.638 15.958 1.00 11.22 C ATOM 1315 CG ARG A 743 -85.252 -9.717 17.214 1.00 11.60 C ATOM 1316 CD ARG A 743 -84.403 -10.252 18.383 1.00 15.48 C ATOM 1317 NE ARG A 743 -85.237 -10.132 19.570 1.00 19.01 N ATOM 1318 CZ ARG A 743 -85.351 -9.001 20.247 1.00 17.81 C ATOM 1319 NH1 ARG A 743 -84.608 -7.948 19.885 1.00 19.26 N ATOM 1320 NH2 ARG A 743 -86.129 -8.949 21.322 1.00 22.69 N ATOM 1321 HE ARG A 743 -85.763 -10.967 19.898 1.00 0.00 H ATOM 1322 HH12 ARG A 743 -84.686 -7.052 20.407 1.00 0.00 H ATOM 1323 HH11 ARG A 743 -83.952 -8.026 19.081 1.00 0.00 H ATOM 1324 HH22 ARG A 743 -86.220 -8.061 21.856 1.00 0.00 H ATOM 1325 HH21 ARG A 743 -86.647 -9.796 21.630 1.00 0.00 H ATOM 1326 H ARG A 743 -85.355 -7.246 15.869 1.00 0.00 H ATOM 1327 N ASN A 744 -87.628 -9.440 14.773 1.00 8.73 N ATOM 1328 CA ASN A 744 -88.869 -10.156 14.498 1.00 9.81 C ATOM 1329 C ASN A 744 -89.680 -9.588 13.323 1.00 9.45 C ATOM 1330 O ASN A 744 -90.887 -9.869 13.202 1.00 12.94 O ATOM 1331 CB ASN A 744 -89.708 -10.240 15.764 1.00 11.80 C ATOM 1332 CG ASN A 744 -89.085 -11.176 16.780 1.00 15.74 C ATOM 1333 OD1 ASN A 744 -88.520 -12.228 16.397 1.00 16.29 O ATOM 1334 ND2 ASN A 744 -89.119 -10.798 18.074 1.00 16.32 N ATOM 1335 HD22 ASN A 744 -89.600 -9.917 18.346 1.00 0.00 H ATOM 1336 HD21 ASN A 744 -88.665 -11.388 18.800 1.00 0.00 H ATOM 1337 H ASN A 744 -87.683 -8.514 15.243 1.00 0.00 H ATOM 1338 N ILE A 745 -89.044 -8.798 12.474 1.00 8.52 N ATOM 1339 CA ILE A 745 -89.618 -8.262 11.252 1.00 8.65 C ATOM 1340 C ILE A 745 -88.845 -8.854 10.095 1.00 7.94 C ATOM 1341 O ILE A 745 -87.606 -8.959 10.150 1.00 8.67 O ATOM 1342 CB ILE A 745 -89.487 -6.724 11.235 1.00 9.07 C ATOM 1343 CG1 ILE A 745 -90.168 -6.060 12.441 1.00 12.63 C ATOM 1344 CG2 ILE A 745 -90.090 -6.112 9.939 1.00 9.84 C ATOM 1345 CD1 ILE A 745 -91.595 -6.313 12.552 1.00 13.44 C ATOM 1346 H ILE A 745 -88.061 -8.542 12.698 1.00 0.00 H ATOM 1347 N LEU A 746 -89.578 -9.234 9.031 1.00 7.42 N ATOM 1348 CA LEU A 746 -88.949 -9.856 7.890 1.00 7.44 C ATOM 1349 C LEU A 746 -89.139 -8.922 6.709 1.00 9.05 C ATOM 1350 O LEU A 746 -90.114 -8.161 6.664 1.00 9.07 O ATOM 1351 CB LEU A 746 -89.527 -11.246 7.591 1.00 9.10 C ATOM 1352 CG LEU A 746 -89.227 -12.342 8.618 1.00 9.50 C ATOM 1353 CD1 LEU A 746 -90.135 -13.560 8.377 1.00 10.73 C ATOM 1354 CD2 LEU A 746 -87.735 -12.757 8.474 1.00 13.45 C ATOM 1355 H LEU A 746 -90.606 -9.078 9.031 1.00 0.00 H ATOM 1356 N VAL A 747 -88.194 -8.969 5.756 1.00 9.39 N ATOM 1357 CA VAL A 747 -88.186 -8.000 4.655 1.00 9.46 C ATOM 1358 C VAL A 747 -88.199 -8.761 3.336 1.00 9.34 C ATOM 1359 O VAL A 747 -87.389 -9.685 3.158 1.00 10.17 O ATOM 1360 CB VAL A 747 -86.942 -7.108 4.733 1.00 10.08 C ATOM 1361 CG1 VAL A 747 -86.975 -6.058 3.630 1.00 11.56 C ATOM 1362 CG2 VAL A 747 -86.926 -6.399 6.097 1.00 10.11 C ATOM 1363 H VAL A 747 -87.458 -9.702 5.799 1.00 0.00 H ATOM 1364 N ASN A 748 -89.071 -8.336 2.389 1.00 7.96 N ATOM 1365 CA ASN A 748 -89.088 -9.015 1.088 1.00 8.82 C ATOM 1366 C ASN A 748 -88.395 -8.166 0.018 1.00 12.60 C ATOM 1367 O ASN A 748 -87.852 -7.081 0.285 1.00 10.82 O ATOM 1368 CB ASN A 748 -90.508 -9.490 0.695 1.00 7.70 C ATOM 1369 CG ASN A 748 -91.414 -8.355 0.267 1.00 11.01 C ATOM 1370 OD1 ASN A 748 -91.001 -7.215 0.045 1.00 11.01 O ATOM 1371 ND2 ASN A 748 -92.708 -8.657 0.156 1.00 13.37 N ATOM 1372 HD22 ASN A 748 -93.034 -9.626 0.348 1.00 0.00 H ATOM 1373 HD21 ASN A 748 -93.391 -7.924 -0.123 1.00 0.00 H ATOM 1374 H ASN A 748 -89.716 -7.543 2.581 1.00 0.00 H ATOM 1375 N SER A 749 -88.409 -8.682 -1.213 1.00 10.51 N ATOM 1376 CA SER A 749 -87.697 -8.020 -2.330 1.00 13.46 C ATOM 1377 C SER A 749 -88.393 -6.762 -2.848 1.00 12.05 C ATOM 1378 O SER A 749 -87.854 -6.108 -3.743 1.00 15.43 O ATOM 1379 CB SER A 749 -87.550 -9.035 -3.466 1.00 14.85 C ATOM 1380 OG SER A 749 -88.828 -9.429 -3.955 1.00 17.48 O ATOM 1381 HG SER A 749 -89.309 -8.634 -4.295 1.00 0.00 H ATOM 1382 H SER A 749 -88.929 -9.565 -1.391 1.00 0.00 H ATOM 1383 N ASN A 750 -89.583 -6.390 -2.322 1.00 10.43 N ATOM 1384 CA ASN A 750 -90.198 -5.088 -2.539 1.00 14.15 C ATOM 1385 C ASN A 750 -89.920 -4.142 -1.376 1.00 14.99 C ATOM 1386 O ASN A 750 -90.517 -3.074 -1.300 1.00 13.30 O ATOM 1387 CB ASN A 750 -91.711 -5.274 -2.759 1.00 14.90 C ATOM 1388 CG ASN A 750 -92.053 -5.713 -4.200 1.00 22.09 C ATOM 1389 OD1 ASN A 750 -91.321 -5.400 -5.132 1.00 25.51 O ATOM 1390 ND2 ASN A 750 -93.170 -6.420 -4.373 1.00 19.83 N ATOM 1391 HD22 ASN A 750 -93.763 -6.664 -3.554 1.00 0.00 H ATOM 1392 HD21 ASN A 750 -93.448 -6.727 -5.327 1.00 0.00 H ATOM 1393 H ASN A 750 -90.089 -7.076 -1.726 1.00 0.00 H ATOM 1394 N LEU A 751 -89.038 -4.528 -0.455 1.00 11.51 N ATOM 1395 CA LEU A 751 -88.738 -3.754 0.736 1.00 11.40 C ATOM 1396 C LEU A 751 -89.920 -3.700 1.708 1.00 10.49 C ATOM 1397 O LEU A 751 -89.918 -2.871 2.625 1.00 12.60 O ATOM 1398 CB LEU A 751 -88.168 -2.354 0.418 1.00 9.78 C ATOM 1399 CG LEU A 751 -87.227 -1.786 1.493 1.00 10.30 C ATOM 1400 CD1 LEU A 751 -85.919 -2.558 1.666 1.00 9.51 C ATOM 1401 CD2 LEU A 751 -86.939 -0.318 1.128 1.00 12.45 C ATOM 1402 H LEU A 751 -88.539 -5.430 -0.596 1.00 0.00 H ATOM 1403 N VAL A 752 -90.913 -4.590 1.551 1.00 10.84 N ATOM 1404 CA VAL A 752 -92.058 -4.645 2.457 1.00 10.04 C ATOM 1405 C VAL A 752 -91.632 -5.355 3.725 1.00 7.93 C ATOM 1406 O VAL A 752 -91.013 -6.439 3.685 1.00 9.75 O ATOM 1407 CB VAL A 752 -93.226 -5.386 1.813 1.00 9.50 C ATOM 1408 CG1 VAL A 752 -94.406 -5.427 2.796 1.00 10.37 C ATOM 1409 CG2 VAL A 752 -93.652 -4.696 0.510 1.00 15.55 C ATOM 1410 H VAL A 752 -90.866 -5.262 0.759 1.00 0.00 H ATOM 1411 N CYS A 753 -91.920 -4.732 4.853 1.00 8.96 N ATOM 1412 CA CYS A 753 -91.621 -5.272 6.154 1.00 6.87 C ATOM 1413 C CYS A 753 -92.878 -5.906 6.732 1.00 8.86 C ATOM 1414 O CYS A 753 -93.962 -5.333 6.634 1.00 10.71 O ATOM 1415 CB CYS A 753 -91.191 -4.127 7.061 1.00 9.52 C ATOM 1416 SG CYS A 753 -89.560 -3.518 6.603 1.00 13.13 S ATOM 1417 H CYS A 753 -92.387 -3.804 4.799 1.00 0.00 H ATOM 1418 N LYS A 754 -92.747 -7.121 7.246 1.00 8.05 N ATOM 1419 CA LYS A 754 -93.890 -7.862 7.764 1.00 6.92 C ATOM 1420 C LYS A 754 -93.562 -8.322 9.186 1.00 7.88 C ATOM 1421 O LYS A 754 -92.461 -8.814 9.450 1.00 10.53 O ATOM 1422 CB LYS A 754 -94.212 -9.061 6.861 1.00 8.36 C ATOM 1423 CG LYS A 754 -94.561 -8.620 5.425 1.00 9.09 C ATOM 1424 CD LYS A 754 -95.148 -9.729 4.642 1.00 12.76 C ATOM 1425 CE LYS A 754 -95.230 -9.266 3.185 1.00 14.07 C ATOM 1426 NZ LYS A 754 -96.326 -10.005 2.519 1.00 13.89 N ATOM 1427 HZ1 LYS A 754 -96.128 -11.025 2.557 1.00 0.00 H ATOM 1428 HZ2 LYS A 754 -97.223 -9.806 3.006 1.00 0.00 H ATOM 1429 HZ3 LYS A 754 -96.395 -9.701 1.527 1.00 0.00 H ATOM 1430 H LYS A 754 -91.803 -7.557 7.280 1.00 0.00 H ATOM 1431 N VAL A 755 -94.561 -8.204 10.075 1.00 8.16 N ATOM 1432 CA VAL A 755 -94.394 -8.669 11.443 1.00 8.19 C ATOM 1433 C VAL A 755 -94.407 -10.184 11.471 1.00 11.05 C ATOM 1434 O VAL A 755 -95.200 -10.829 10.767 1.00 9.61 O ATOM 1435 CB VAL A 755 -95.527 -8.080 12.293 1.00 8.46 C ATOM 1436 CG1 VAL A 755 -95.337 -8.511 13.759 1.00 9.67 C ATOM 1437 CG2 VAL A 755 -95.562 -6.551 12.197 1.00 10.26 C ATOM 1438 H VAL A 755 -95.463 -7.776 9.783 1.00 0.00 H ATOM 1439 N SER A 756 -93.492 -10.767 12.257 1.00 11.84 N ATOM 1440 CA SER A 756 -93.425 -12.219 12.372 1.00 9.95 C ATOM 1441 C SER A 756 -93.280 -12.554 13.835 1.00 11.14 C ATOM 1442 O SER A 756 -93.274 -11.664 14.686 1.00 14.62 O ATOM 1443 CB SER A 756 -92.336 -12.825 11.514 1.00 17.39 C ATOM 1444 OG SER A 756 -91.093 -12.307 11.846 1.00 26.45 O ATOM 1445 HG SER A 756 -91.098 -11.327 11.707 1.00 0.00 H ATOM 1446 H SER A 756 -92.822 -10.177 12.791 1.00 0.00 H ATOM 1447 N ASP A 757 -93.137 -13.858 14.107 1.00 16.23 N ATOM 1448 CA ASP A 757 -92.938 -14.395 15.449 1.00 14.77 C ATOM 1449 C ASP A 757 -94.210 -14.365 16.299 1.00 17.51 C ATOM 1450 O ASP A 757 -94.348 -13.511 17.177 1.00 21.09 O ATOM 1451 CB ASP A 757 -91.806 -13.646 16.138 1.00 17.23 C ATOM 1452 CG ASP A 757 -91.378 -14.307 17.440 1.00 30.61 C ATOM 1453 OD1 ASP A 757 -91.671 -15.511 17.648 1.00 27.27 O ATOM 1454 OD2 ASP A 757 -90.739 -13.614 18.242 1.00 32.03 O ATOM 1455 H ASP A 757 -93.170 -14.529 13.313 1.00 0.00 H ATOM 1456 N PHE A 758 -95.111 -15.329 16.072 1.00 17.36 N ATOM 1457 CA PHE A 758 -96.432 -15.381 16.674 1.00 14.44 C ATOM 1458 C PHE A 758 -96.546 -16.569 17.616 1.00 19.49 C ATOM 1459 O PHE A 758 -95.848 -17.579 17.476 1.00 21.76 O ATOM 1460 CB PHE A 758 -97.518 -15.447 15.583 1.00 15.13 C ATOM 1461 CG PHE A 758 -97.558 -14.210 14.715 1.00 17.96 C ATOM 1462 CD1 PHE A 758 -98.108 -13.054 15.187 1.00 22.20 C ATOM 1463 CD2 PHE A 758 -96.965 -14.206 13.463 1.00 21.22 C ATOM 1464 CE1 PHE A 758 -98.109 -11.892 14.405 1.00 20.06 C ATOM 1465 CE2 PHE A 758 -96.963 -13.083 12.696 1.00 19.54 C ATOM 1466 CZ PHE A 758 -97.526 -11.912 13.173 1.00 18.00 C ATOM 1467 H PHE A 758 -94.847 -16.094 15.419 1.00 0.00 H ATOM 1468 N GLY A 759 -97.417 -16.435 18.582 1.00 20.78 N ATOM 1469 CA GLY A 759 -97.676 -17.544 19.477 1.00 24.97 C ATOM 1470 C GLY A 759 -97.985 -17.036 20.863 1.00 26.37 C ATOM 1471 O GLY A 759 -98.093 -15.844 21.102 1.00 22.77 O ATOM 1472 H GLY A 759 -97.922 -15.535 18.707 1.00 0.00 H ATOM 1473 N LEU A 760 -98.128 -17.984 21.783 1.00 25.03 N ATOM 1474 CA LEU A 760 -98.332 -17.632 23.184 1.00 26.80 C ATOM 1475 C LEU A 760 -96.987 -17.646 23.930 1.00 26.80 C ATOM 1476 O LEU A 760 -96.114 -16.827 23.646 1.00 28.13 O ATOM 1477 CB LEU A 760 -99.387 -18.568 23.798 1.00 33.08 C ATOM 1478 CG LEU A 760 -100.694 -18.613 22.988 1.00 29.35 C ATOM 1479 CD1 LEU A 760 -101.618 -19.675 23.522 1.00 31.10 C ATOM 1480 CD2 LEU A 760 -101.400 -17.256 23.015 1.00 26.45 C ATOM 1481 H LEU A 760 -98.094 -18.985 21.502 1.00 0.00 H ATOM 1482 N SER A 761 -96.785 -18.581 24.862 1.00 26.20 N ATOM 1483 CA SER A 761 -95.562 -18.582 25.657 1.00 27.01 C ATOM 1484 C SER A 761 -94.303 -18.781 24.812 1.00 31.91 C ATOM 1485 O SER A 761 -93.224 -18.333 25.221 1.00 34.71 O ATOM 1486 CB SER A 761 -95.654 -19.630 26.772 1.00 34.05 C ATOM 1487 OG SER A 761 -95.985 -20.892 26.228 1.00 43.08 O ATOM 1488 HG SER A 761 -96.858 -20.832 25.766 1.00 0.00 H ATOM 1489 H SER A 761 -97.505 -19.314 25.022 1.00 0.00 H ATOM 1490 N ARG A 762 -94.422 -19.391 23.628 1.00 23.53 N ATOM 1491 CA ARG A 762 -93.239 -19.679 22.818 1.00 26.74 C ATOM 1492 C ARG A 762 -92.504 -18.409 22.389 1.00 30.08 C ATOM 1493 O ARG A 762 -91.288 -18.447 22.162 1.00 31.41 O ATOM 1494 CB ARG A 762 -93.621 -20.506 21.584 1.00 31.96 C ATOM 1495 CG ARG A 762 -94.507 -19.748 20.572 1.00 30.15 C ATOM 1496 CD ARG A 762 -94.329 -20.272 19.142 1.00 30.00 C ATOM 1497 NE ARG A 762 -92.937 -20.100 18.709 1.00 34.92 N ATOM 1498 CZ ARG A 762 -92.426 -18.970 18.216 1.00 39.07 C ATOM 1499 NH1 ARG A 762 -93.187 -17.875 18.080 1.00 26.39 N ATOM 1500 NH2 ARG A 762 -91.137 -18.927 17.875 1.00 36.25 N ATOM 1501 HE ARG A 762 -92.302 -20.919 18.793 1.00 0.00 H ATOM 1502 HH12 ARG A 762 -92.776 -17.001 17.694 1.00 0.00 H ATOM 1503 HH11 ARG A 762 -94.188 -17.900 18.360 1.00 0.00 H ATOM 1504 HH22 ARG A 762 -90.730 -18.051 17.490 1.00 0.00 H ATOM 1505 HH21 ARG A 762 -90.539 -19.770 17.994 1.00 0.00 H ATOM 1506 H ARG A 762 -95.364 -19.663 23.280 1.00 0.00 H ATOM 1507 N VAL A 763 -93.215 -17.282 22.280 1.00 29.23 N ATOM 1508 CA VAL A 763 -92.611 -16.062 21.734 1.00 28.36 C ATOM 1509 C VAL A 763 -91.448 -15.596 22.611 1.00 28.10 C ATOM 1510 O VAL A 763 -90.321 -15.401 22.132 1.00 29.11 O ATOM 1511 CB VAL A 763 -93.676 -14.966 21.559 1.00 22.73 C ATOM 1512 CG1 VAL A 763 -93.045 -13.669 21.107 1.00 24.82 C ATOM 1513 CG2 VAL A 763 -94.781 -15.429 20.559 1.00 25.93 C ATOM 1514 H VAL A 763 -94.209 -17.270 22.586 1.00 0.00 H ATOM 1515 N LEU A 764 -91.711 -15.385 23.905 1.00 20.45 N ATOM 1516 CA LEU A 764 -90.652 -14.913 24.793 1.00 22.67 C ATOM 1517 C LEU A 764 -89.693 -16.033 25.196 1.00 29.38 C ATOM 1518 O LEU A 764 -88.510 -15.773 25.464 1.00 32.19 O ATOM 1519 CB LEU A 764 -91.253 -14.201 26.014 1.00 21.49 C ATOM 1520 CG LEU A 764 -91.873 -12.829 25.708 1.00 25.52 C ATOM 1521 CD1 LEU A 764 -92.377 -12.132 26.961 1.00 34.21 C ATOM 1522 CD2 LEU A 764 -90.893 -11.942 24.996 1.00 23.64 C ATOM 1523 H LEU A 764 -92.667 -15.556 24.278 1.00 0.00 H ATOM 1524 N GLU A 765 -90.180 -17.275 25.226 1.00 31.28 N ATOM 1525 CA GLU A 765 -89.330 -18.391 25.632 1.00 31.54 C ATOM 1526 C GLU A 765 -88.260 -18.688 24.587 1.00 34.09 C ATOM 1527 O GLU A 765 -87.126 -19.036 24.935 1.00 34.62 O ATOM 1528 CB GLU A 765 -90.197 -19.622 25.902 1.00 37.04 C ATOM 1529 CG GLU A 765 -89.437 -20.826 26.442 1.00 49.34 C ATOM 1530 CD GLU A 765 -90.363 -21.813 27.121 1.00 62.22 C ATOM 1531 OE1 GLU A 765 -91.554 -21.875 26.727 1.00 59.99 O ATOM 1532 OE2 GLU A 765 -89.907 -22.517 28.051 1.00 60.86 O ATOM 1533 H GLU A 765 -91.170 -17.449 24.959 1.00 0.00 H ATOM 1534 N ASP A 766 -88.592 -18.548 23.303 1.00 30.08 N ATOM 1535 CA ASP A 766 -87.655 -18.911 22.244 1.00 30.60 C ATOM 1536 C ASP A 766 -86.686 -17.790 21.886 1.00 33.14 C ATOM 1537 O ASP A 766 -85.703 -18.049 21.176 1.00 30.22 O ATOM 1538 CB ASP A 766 -88.398 -19.316 20.965 1.00 32.68 C ATOM 1539 CG ASP A 766 -89.242 -20.571 21.139 1.00 48.32 C ATOM 1540 OD1 ASP A 766 -89.157 -21.229 22.207 1.00 39.96 O ATOM 1541 OD2 ASP A 766 -89.984 -20.896 20.185 1.00 37.51 O ATOM 1542 H ASP A 766 -89.530 -18.176 23.053 1.00 0.00 H ATOM 1543 N ASP A 767 -86.955 -16.553 22.324 1.00 27.63 N ATOM 1544 CA ASP A 767 -86.133 -15.413 21.918 1.00 27.28 C ATOM 1545 C ASP A 767 -84.922 -15.312 22.836 1.00 25.21 C ATOM 1546 O ASP A 767 -85.093 -15.077 24.038 1.00 25.68 O ATOM 1547 CB ASP A 767 -86.937 -14.101 21.966 1.00 24.81 C ATOM 1548 CG ASP A 767 -86.213 -12.943 21.248 1.00 33.10 C ATOM 1549 OD1 ASP A 767 -84.963 -13.013 21.141 1.00 25.78 O ATOM 1550 OD2 ASP A 767 -86.880 -11.982 20.772 1.00 25.10 O ATOM 1551 H ASP A 767 -87.761 -16.401 22.963 1.00 0.00 H ATOM 1552 N PRO A 768 -83.695 -15.479 22.325 1.00 30.80 N ATOM 1553 CA PRO A 768 -82.509 -15.352 23.200 1.00 31.03 C ATOM 1554 C PRO A 768 -82.370 -13.976 23.844 1.00 42.00 C ATOM 1555 O PRO A 768 -81.801 -13.864 24.949 1.00 32.65 O ATOM 1556 CB PRO A 768 -81.340 -15.657 22.249 1.00 39.15 C ATOM 1557 CG PRO A 768 -81.858 -15.324 20.899 1.00 38.82 C ATOM 1558 CD PRO A 768 -83.318 -15.694 20.915 1.00 42.58 C ATOM 1559 N GLU A 769 -82.895 -12.921 23.194 1.00 23.00 N ATOM 1560 CA GLU A 769 -82.834 -11.577 23.775 1.00 24.28 C ATOM 1561 C GLU A 769 -83.660 -11.447 25.047 1.00 33.88 C ATOM 1562 O GLU A 769 -83.455 -10.491 25.805 1.00 28.11 O ATOM 1563 CB GLU A 769 -83.285 -10.515 22.759 1.00 20.27 C ATOM 1564 CG GLU A 769 -82.358 -10.357 21.537 1.00 29.52 C ATOM 1565 CD GLU A 769 -81.071 -9.585 21.843 1.00 26.83 C ATOM 1566 OE1 GLU A 769 -80.878 -9.163 22.999 1.00 25.90 O ATOM 1567 OE2 GLU A 769 -80.250 -9.400 20.917 1.00 25.19 O ATOM 1568 H GLU A 769 -83.349 -13.061 22.269 1.00 0.00 H ATOM 1569 N ALA A 770 -84.591 -12.370 25.296 1.00 27.80 N ATOM 1570 CA ALA A 770 -85.454 -12.308 26.473 1.00 24.56 C ATOM 1571 C ALA A 770 -84.763 -13.009 27.642 1.00 42.91 C ATOM 1572 O ALA A 770 -84.421 -14.196 27.554 1.00 36.91 O ATOM 1573 CB ALA A 770 -86.827 -12.919 26.173 1.00 35.17 C ATOM 1574 H ALA A 770 -84.706 -13.160 24.630 1.00 0.00 H ATOM 1575 N THR A 771 -84.547 -12.272 28.729 1.00 33.02 N ATOM 1576 CA THR A 771 -83.711 -12.740 29.827 1.00 33.79 C ATOM 1577 C THR A 771 -84.534 -12.885 31.099 1.00 39.31 C ATOM 1578 O THR A 771 -85.543 -12.201 31.288 1.00 33.45 O ATOM 1579 CB THR A 771 -82.542 -11.773 30.090 1.00 31.17 C ATOM 1580 OG1 THR A 771 -83.035 -10.430 30.141 1.00 35.93 O ATOM 1581 CG2 THR A 771 -81.493 -11.876 28.991 1.00 36.63 C ATOM 1582 HG1 THR A 771 -83.463 -10.204 29.277 1.00 0.00 H ATOM 1583 H THR A 771 -84.989 -11.333 28.797 1.00 0.00 H ATOM 1584 N TYR A 772 -84.080 -13.779 31.975 1.00 42.05 N ATOM 1585 CA TYR A 772 -84.752 -14.017 33.247 1.00 48.56 C ATOM 1586 C TYR A 772 -84.583 -12.840 34.200 1.00 52.56 C ATOM 1587 O TYR A 772 -85.574 -12.288 34.677 1.00 46.54 O ATOM 1588 CB TYR A 772 -84.255 -15.322 33.881 1.00 40.97 C ATOM 1589 CG TYR A 772 -84.602 -16.528 33.048 1.00 48.51 C ATOM 1590 CD1 TYR A 772 -85.917 -16.990 32.969 1.00 55.08 C ATOM 1591 CD2 TYR A 772 -83.629 -17.192 32.317 1.00 56.78 C ATOM 1592 CE1 TYR A 772 -86.247 -18.092 32.188 1.00 51.69 C ATOM 1593 CE2 TYR A 772 -83.948 -18.294 31.530 1.00 57.92 C ATOM 1594 CZ TYR A 772 -85.257 -18.740 31.471 1.00 57.20 C ATOM 1595 OH TYR A 772 -85.569 -19.837 30.693 1.00 68.34 O ATOM 1596 HH TYR A 772 -86.539 -20.023 30.761 1.00 0.00 H ATOM 1597 H TYR A 772 -83.223 -14.322 31.746 1.00 0.00 H TER 1598 TYR A 772 ATOM 1599 N GLY A 777 -89.906 -13.389 35.497 1.00 56.66 N ATOM 1600 CA GLY A 777 -90.242 -13.559 34.093 1.00 50.32 C ATOM 1601 C GLY A 777 -89.049 -13.605 33.148 1.00 51.70 C ATOM 1602 O GLY A 777 -87.901 -13.501 33.582 1.00 57.50 O ATOM 1603 HN3 GLY A 777 -89.390 -12.495 35.623 1.00 0.00 H ATOM 1604 HN2 GLY A 777 -89.309 -14.182 35.808 1.00 0.00 H ATOM 1605 HN1 GLY A 777 -90.779 -13.369 36.061 1.00 0.00 H ATOM 1606 N LYS A 778 -89.335 -13.779 31.855 1.00 45.37 N ATOM 1607 CA LYS A 778 -88.342 -13.780 30.785 1.00 30.46 C ATOM 1608 C LYS A 778 -88.783 -12.735 29.773 1.00 37.08 C ATOM 1609 O LYS A 778 -89.866 -12.862 29.180 1.00 31.62 O ATOM 1610 CB LYS A 778 -88.274 -15.159 30.125 1.00 28.09 C ATOM 1611 CG LYS A 778 -87.192 -15.370 29.086 1.00 39.72 C ATOM 1612 CD LYS A 778 -87.347 -16.788 28.515 1.00 44.01 C ATOM 1613 CE LYS A 778 -86.144 -17.251 27.720 1.00 42.49 C ATOM 1614 NZ LYS A 778 -86.007 -16.520 26.438 1.00 39.63 N ATOM 1615 HZ1 LYS A 778 -86.857 -16.675 25.859 1.00 0.00 H ATOM 1616 HZ2 LYS A 778 -85.897 -15.504 26.630 1.00 0.00 H ATOM 1617 HZ3 LYS A 778 -85.171 -16.870 25.928 1.00 0.00 H ATOM 1618 H LYS A 778 -90.331 -13.923 31.593 1.00 0.00 H ATOM 1619 N ILE A 779 -87.956 -11.707 29.588 1.00 28.77 N ATOM 1620 CA ILE A 779 -88.345 -10.491 28.863 1.00 26.98 C ATOM 1621 C ILE A 779 -87.156 -9.917 28.090 1.00 18.10 C ATOM 1622 O ILE A 779 -86.063 -9.832 28.663 1.00 23.13 O ATOM 1623 CB ILE A 779 -88.837 -9.444 29.872 1.00 29.09 C ATOM 1624 CG1 ILE A 779 -90.161 -9.847 30.502 1.00 33.61 C ATOM 1625 CG2 ILE A 779 -88.982 -8.057 29.251 1.00 24.21 C ATOM 1626 CD1 ILE A 779 -90.552 -8.826 31.523 1.00 32.87 C ATOM 1627 H ILE A 779 -86.992 -11.769 29.974 1.00 0.00 H ATOM 1628 N PRO A 780 -87.334 -9.450 26.802 1.00 20.49 N ATOM 1629 CA PRO A 780 -86.280 -8.686 26.087 1.00 19.87 C ATOM 1630 C PRO A 780 -86.287 -7.252 26.604 1.00 17.14 C ATOM 1631 O PRO A 780 -86.993 -6.370 26.074 1.00 15.25 O ATOM 1632 CB PRO A 780 -86.765 -8.752 24.625 1.00 18.06 C ATOM 1633 CG PRO A 780 -88.273 -8.810 24.744 1.00 26.76 C ATOM 1634 CD PRO A 780 -88.615 -9.457 26.068 1.00 22.01 C ATOM 1635 N ILE A 781 -85.548 -7.037 27.698 1.00 15.83 N ATOM 1636 CA ILE A 781 -85.783 -5.881 28.557 1.00 12.26 C ATOM 1637 C ILE A 781 -85.751 -4.580 27.764 1.00 11.67 C ATOM 1638 O ILE A 781 -86.632 -3.725 27.917 1.00 12.92 O ATOM 1639 CB ILE A 781 -84.759 -5.862 29.717 1.00 12.87 C ATOM 1640 CG1 ILE A 781 -85.055 -6.964 30.723 1.00 18.61 C ATOM 1641 CG2 ILE A 781 -84.694 -4.507 30.403 1.00 14.28 C ATOM 1642 CD1 ILE A 781 -86.352 -6.771 31.422 1.00 20.56 C ATOM 1643 H ILE A 781 -84.791 -7.707 27.941 1.00 0.00 H ATOM 1644 N ARG A 782 -84.734 -4.379 26.943 1.00 11.16 N ATOM 1645 CA ARG A 782 -84.563 -3.022 26.414 1.00 9.43 C ATOM 1646 C ARG A 782 -85.506 -2.702 25.238 1.00 9.89 C ATOM 1647 O ARG A 782 -85.531 -1.565 24.736 1.00 10.18 O ATOM 1648 CB ARG A 782 -83.102 -2.753 26.052 1.00 15.94 C ATOM 1649 CG ARG A 782 -82.614 -3.606 24.900 1.00 12.25 C ATOM 1650 CD ARG A 782 -81.071 -3.580 24.830 1.00 12.01 C ATOM 1651 NE ARG A 782 -80.487 -4.128 26.056 1.00 16.07 N ATOM 1652 CZ ARG A 782 -79.390 -3.676 26.656 1.00 13.88 C ATOM 1653 NH1 ARG A 782 -78.998 -4.230 27.792 1.00 17.39 N ATOM 1654 NH2 ARG A 782 -78.668 -2.702 26.132 1.00 14.30 N ATOM 1655 HE ARG A 782 -80.971 -4.938 26.494 1.00 0.00 H ATOM 1656 HH12 ARG A 782 -78.142 -3.885 28.270 1.00 0.00 H ATOM 1657 HH11 ARG A 782 -79.546 -5.011 28.206 1.00 0.00 H ATOM 1658 HH22 ARG A 782 -77.814 -2.367 26.622 1.00 0.00 H ATOM 1659 HH21 ARG A 782 -78.954 -2.270 25.230 1.00 0.00 H ATOM 1660 H ARG A 782 -84.084 -5.149 26.684 1.00 0.00 H ATOM 1661 N TRP A 783 -86.316 -3.659 24.812 1.00 9.36 N ATOM 1662 CA TRP A 783 -87.403 -3.359 23.876 1.00 8.64 C ATOM 1663 C TRP A 783 -88.744 -3.227 24.594 1.00 11.95 C ATOM 1664 O TRP A 783 -89.750 -2.942 23.947 1.00 12.04 O ATOM 1665 CB TRP A 783 -87.534 -4.481 22.841 1.00 10.58 C ATOM 1666 CG TRP A 783 -86.559 -4.371 21.769 1.00 10.12 C ATOM 1667 CD1 TRP A 783 -86.783 -3.789 20.544 1.00 11.95 C ATOM 1668 CD2 TRP A 783 -85.182 -4.838 21.759 1.00 12.83 C ATOM 1669 NE1 TRP A 783 -85.639 -3.870 19.800 1.00 9.69 N ATOM 1670 CE2 TRP A 783 -84.654 -4.502 20.502 1.00 10.04 C ATOM 1671 CE3 TRP A 783 -84.373 -5.533 22.671 1.00 13.22 C ATOM 1672 CZ2 TRP A 783 -83.352 -4.796 20.131 1.00 13.78 C ATOM 1673 CZ3 TRP A 783 -83.051 -5.818 22.295 1.00 17.48 C ATOM 1674 CH2 TRP A 783 -82.567 -5.458 21.023 1.00 12.19 C ATOM 1675 HE1 TRP A 783 -85.534 -3.501 18.833 1.00 0.00 H ATOM 1676 H TRP A 783 -86.179 -4.635 25.145 1.00 0.00 H ATOM 1677 N THR A 784 -88.796 -3.481 25.904 1.00 9.36 N ATOM 1678 CA THR A 784 -90.070 -3.666 26.595 1.00 9.68 C ATOM 1679 C THR A 784 -90.463 -2.446 27.421 1.00 9.52 C ATOM 1680 O THR A 784 -89.621 -1.825 28.079 1.00 9.84 O ATOM 1681 CB THR A 784 -89.930 -4.890 27.510 1.00 11.39 C ATOM 1682 OG1 THR A 784 -89.644 -6.023 26.702 1.00 10.29 O ATOM 1683 CG2 THR A 784 -91.251 -5.206 28.275 1.00 11.07 C ATOM 1684 HG1 THR A 784 -90.383 -6.163 26.059 1.00 0.00 H ATOM 1685 H THR A 784 -87.910 -3.549 26.444 1.00 0.00 H ATOM 1686 N ALA A 785 -91.781 -2.128 27.432 1.00 7.60 N ATOM 1687 CA ALA A 785 -92.269 -0.963 28.144 1.00 8.18 C ATOM 1688 C ALA A 785 -92.114 -1.147 29.654 1.00 8.41 C ATOM 1689 O ALA A 785 -92.177 -2.278 30.158 1.00 10.06 O ATOM 1690 CB ALA A 785 -93.751 -0.754 27.794 1.00 9.80 C ATOM 1691 H ALA A 785 -92.455 -2.732 26.920 1.00 0.00 H ATOM 1692 N PRO A 786 -91.998 -0.046 30.394 1.00 9.56 N ATOM 1693 CA PRO A 786 -91.820 -0.158 31.855 1.00 10.27 C ATOM 1694 C PRO A 786 -92.902 -0.979 32.541 1.00 9.99 C ATOM 1695 O PRO A 786 -92.568 -1.781 33.413 1.00 12.04 O ATOM 1696 CB PRO A 786 -91.802 1.290 32.358 1.00 13.25 C ATOM 1697 CG PRO A 786 -91.481 2.087 31.150 1.00 13.94 C ATOM 1698 CD PRO A 786 -91.826 1.325 29.897 1.00 9.39 C ATOM 1699 N GLU A 787 -94.182 -0.780 32.196 1.00 9.97 N ATOM 1700 CA GLU A 787 -95.221 -1.477 32.946 1.00 10.79 C ATOM 1701 C GLU A 787 -95.194 -2.968 32.657 1.00 11.02 C ATOM 1702 O GLU A 787 -95.627 -3.777 33.489 1.00 10.85 O ATOM 1703 CB GLU A 787 -96.603 -0.904 32.632 1.00 10.48 C ATOM 1704 CG GLU A 787 -97.105 -1.148 31.163 1.00 9.09 C ATOM 1705 CD GLU A 787 -96.614 -0.150 30.130 1.00 9.42 C ATOM 1706 OE1 GLU A 787 -95.753 0.730 30.424 1.00 10.73 O ATOM 1707 OE2 GLU A 787 -97.104 -0.250 28.957 1.00 11.18 O ATOM 1708 H GLU A 787 -94.429 -0.143 31.412 1.00 0.00 H ATOM 1709 N ALA A 788 -94.701 -3.374 31.470 1.00 9.03 N ATOM 1710 CA ALA A 788 -94.600 -4.793 31.208 1.00 9.30 C ATOM 1711 C ALA A 788 -93.457 -5.411 32.024 1.00 10.80 C ATOM 1712 O ALA A 788 -93.572 -6.561 32.510 1.00 13.48 O ATOM 1713 CB ALA A 788 -94.471 -5.070 29.693 1.00 11.82 C ATOM 1714 H ALA A 788 -94.399 -2.680 30.756 1.00 0.00 H ATOM 1715 N ILE A 789 -92.346 -4.678 32.183 1.00 9.23 N ATOM 1716 CA ILE A 789 -91.263 -5.165 33.034 1.00 11.16 C ATOM 1717 C ILE A 789 -91.697 -5.186 34.493 1.00 13.86 C ATOM 1718 O ILE A 789 -91.518 -6.187 35.200 1.00 15.46 O ATOM 1719 CB ILE A 789 -90.042 -4.262 32.848 1.00 13.51 C ATOM 1720 CG1 ILE A 789 -89.510 -4.401 31.418 1.00 15.34 C ATOM 1721 CG2 ILE A 789 -88.983 -4.640 33.860 1.00 15.05 C ATOM 1722 CD1 ILE A 789 -88.438 -3.358 31.108 1.00 13.55 C ATOM 1723 H ILE A 789 -92.255 -3.762 31.700 1.00 0.00 H ATOM 1724 N SER A 790 -92.237 -4.066 34.986 1.00 14.18 N ATOM 1725 CA SER A 790 -92.519 -3.946 36.417 1.00 13.17 C ATOM 1726 C SER A 790 -93.610 -4.918 36.850 1.00 12.78 C ATOM 1727 O SER A 790 -93.446 -5.671 37.823 1.00 11.70 O ATOM 1728 CB SER A 790 -92.979 -2.526 36.763 1.00 13.86 C ATOM 1729 OG SER A 790 -92.009 -1.523 36.523 1.00 12.77 O ATOM 1730 HG SER A 790 -91.766 -1.523 35.563 1.00 0.00 H ATOM 1731 H SER A 790 -92.458 -3.275 34.348 1.00 0.00 H ATOM 1732 N TYR A 791 -94.751 -4.903 36.159 1.00 12.99 N ATOM 1733 CA TYR A 791 -95.898 -5.641 36.690 1.00 10.18 C ATOM 1734 C TYR A 791 -96.572 -6.524 35.648 1.00 10.58 C ATOM 1735 O TYR A 791 -97.704 -6.961 35.835 1.00 10.33 O ATOM 1736 CB TYR A 791 -96.873 -4.764 37.449 1.00 13.04 C ATOM 1737 CG TYR A 791 -97.559 -3.654 36.712 1.00 11.64 C ATOM 1738 CD1 TYR A 791 -98.863 -3.826 36.254 1.00 12.61 C ATOM 1739 CD2 TYR A 791 -96.997 -2.411 36.591 1.00 13.44 C ATOM 1740 CE1 TYR A 791 -99.563 -2.768 35.632 1.00 16.42 C ATOM 1741 CE2 TYR A 791 -97.658 -1.373 35.942 1.00 14.42 C ATOM 1742 CZ TYR A 791 -98.950 -1.552 35.491 1.00 16.52 C ATOM 1743 OH TYR A 791 -99.683 -0.547 34.897 1.00 18.12 O ATOM 1744 HH TYR A 791 -100.578 -0.893 34.653 1.00 0.00 H ATOM 1745 H TYR A 791 -94.824 -4.379 35.264 1.00 0.00 H ATOM 1746 N ARG A 792 -95.845 -6.886 34.608 1.00 8.42 N ATOM 1747 CA ARG A 792 -96.264 -7.893 33.641 1.00 11.58 C ATOM 1748 C ARG A 792 -97.464 -7.450 32.822 1.00 9.04 C ATOM 1749 O ARG A 792 -98.227 -8.299 32.340 1.00 13.08 O ATOM 1750 CB ARG A 792 -96.558 -9.253 34.297 1.00 11.90 C ATOM 1751 CG ARG A 792 -95.476 -9.674 35.260 1.00 14.49 C ATOM 1752 CD ARG A 792 -95.859 -11.026 35.914 1.00 18.72 C ATOM 1753 NE ARG A 792 -94.944 -11.374 36.992 1.00 23.26 N ATOM 1754 CZ ARG A 792 -93.840 -12.084 36.809 1.00 28.65 C ATOM 1755 NH1 ARG A 792 -93.514 -12.501 35.595 1.00 29.22 N ATOM 1756 NH2 ARG A 792 -93.067 -12.372 37.842 1.00 26.94 N ATOM 1757 HE ARG A 792 -95.168 -11.049 37.954 1.00 0.00 H ATOM 1758 HH12 ARG A 792 -92.648 -13.058 35.452 1.00 0.00 H ATOM 1759 HH11 ARG A 792 -94.124 -12.271 34.785 1.00 0.00 H ATOM 1760 HH22 ARG A 792 -92.200 -12.929 37.703 1.00 0.00 H ATOM 1761 HH21 ARG A 792 -93.326 -12.042 38.793 1.00 0.00 H ATOM 1762 H ARG A 792 -94.922 -6.427 34.471 1.00 0.00 H ATOM 1763 N LYS A 793 -97.675 -6.137 32.656 1.00 9.08 N ATOM 1764 CA LYS A 793 -98.836 -5.640 31.884 1.00 10.82 C ATOM 1765 C LYS A 793 -98.433 -5.468 30.419 1.00 11.80 C ATOM 1766 O LYS A 793 -97.819 -4.461 30.045 1.00 11.83 O ATOM 1767 CB LYS A 793 -99.314 -4.311 32.444 1.00 13.34 C ATOM 1768 CG LYS A 793 -100.605 -3.838 31.763 1.00 15.79 C ATOM 1769 CD LYS A 793 -101.066 -2.536 32.318 1.00 21.77 C ATOM 1770 CE LYS A 793 -102.281 -2.087 31.526 1.00 22.97 C ATOM 1771 NZ LYS A 793 -103.401 -3.053 31.637 1.00 26.22 N ATOM 1772 HZ1 LYS A 793 -103.097 -3.978 31.272 1.00 0.00 H ATOM 1773 HZ2 LYS A 793 -103.678 -3.147 32.635 1.00 0.00 H ATOM 1774 HZ3 LYS A 793 -104.210 -2.709 31.082 1.00 0.00 H ATOM 1775 H LYS A 793 -97.012 -5.456 33.077 1.00 0.00 H ATOM 1776 N PHE A 794 -98.722 -6.469 29.608 1.00 11.00 N ATOM 1777 CA PHE A 794 -98.427 -6.427 28.174 1.00 8.73 C ATOM 1778 C PHE A 794 -99.703 -6.106 27.425 1.00 9.72 C ATOM 1779 O PHE A 794 -100.693 -6.840 27.537 1.00 12.02 O ATOM 1780 CB PHE A 794 -97.940 -7.799 27.742 1.00 10.31 C ATOM 1781 CG PHE A 794 -96.527 -8.099 28.151 1.00 12.07 C ATOM 1782 CD1 PHE A 794 -95.451 -7.775 27.304 1.00 11.55 C ATOM 1783 CD2 PHE A 794 -96.287 -8.705 29.355 1.00 15.59 C ATOM 1784 CE1 PHE A 794 -94.150 -8.096 27.666 1.00 14.57 C ATOM 1785 CE2 PHE A 794 -94.987 -9.000 29.744 1.00 13.02 C ATOM 1786 CZ PHE A 794 -93.924 -8.713 28.874 1.00 12.83 C ATOM 1787 H PHE A 794 -99.176 -7.318 30.002 1.00 0.00 H ATOM 1788 N THR A 795 -99.676 -5.018 26.653 1.00 9.08 N ATOM 1789 CA THR A 795 -100.852 -4.585 25.913 1.00 8.92 C ATOM 1790 C THR A 795 -100.378 -4.026 24.574 1.00 9.52 C ATOM 1791 O THR A 795 -99.173 -3.907 24.332 1.00 8.73 O ATOM 1792 CB THR A 795 -101.581 -3.431 26.633 1.00 12.03 C ATOM 1793 OG1 THR A 795 -100.768 -2.271 26.635 1.00 10.56 O ATOM 1794 CG2 THR A 795 -101.981 -3.817 28.058 1.00 12.30 C ATOM 1795 HG1 THR A 795 -99.919 -2.465 27.106 1.00 0.00 H ATOM 1796 H THR A 795 -98.796 -4.468 26.579 1.00 0.00 H ATOM 1797 N SER A 796 -101.309 -3.647 23.700 1.00 10.03 N ATOM 1798 CA SER A 796 -100.930 -2.916 22.506 1.00 9.92 C ATOM 1799 C SER A 796 -100.191 -1.641 22.817 1.00 8.41 C ATOM 1800 O SER A 796 -99.315 -1.251 22.012 1.00 9.63 O ATOM 1801 CB SER A 796 -102.149 -2.676 21.638 1.00 10.21 C ATOM 1802 OG SER A 796 -102.625 -3.974 21.234 1.00 15.17 O ATOM 1803 HG SER A 796 -101.915 -4.441 20.726 1.00 0.00 H ATOM 1804 H SER A 796 -102.309 -3.875 23.874 1.00 0.00 H ATOM 1805 N ALA A 797 -100.375 -1.073 24.027 1.00 9.58 N ATOM 1806 CA ALA A 797 -99.634 0.136 24.340 1.00 10.22 C ATOM 1807 C ALA A 797 -98.181 -0.171 24.716 1.00 7.18 C ATOM 1808 O ALA A 797 -97.302 0.680 24.505 1.00 9.00 O ATOM 1809 CB ALA A 797 -100.328 0.894 25.480 1.00 9.68 C ATOM 1810 H ALA A 797 -101.031 -1.490 24.718 1.00 0.00 H ATOM 1811 N SER A 798 -97.903 -1.363 25.282 1.00 8.34 N ATOM 1812 CA SER A 798 -96.517 -1.712 25.471 1.00 10.43 C ATOM 1813 C SER A 798 -95.880 -2.120 24.146 1.00 8.06 C ATOM 1814 O SER A 798 -94.696 -1.850 23.922 1.00 8.32 O ATOM 1815 CB SER A 798 -96.387 -2.775 26.577 1.00 10.78 C ATOM 1816 OG SER A 798 -97.088 -3.998 26.283 1.00 10.11 O ATOM 1817 HG SER A 798 -96.728 -4.391 25.449 1.00 0.00 H ATOM 1818 H SER A 798 -98.664 -2.010 25.573 1.00 0.00 H ATOM 1819 N ASP A 799 -96.682 -2.634 23.191 1.00 7.44 N ATOM 1820 CA ASP A 799 -96.158 -2.837 21.852 1.00 10.31 C ATOM 1821 C ASP A 799 -95.847 -1.499 21.174 1.00 7.93 C ATOM 1822 O ASP A 799 -94.868 -1.445 20.423 1.00 8.34 O ATOM 1823 CB ASP A 799 -97.147 -3.596 20.959 1.00 9.01 C ATOM 1824 CG ASP A 799 -97.257 -5.073 21.244 1.00 9.38 C ATOM 1825 OD1 ASP A 799 -96.389 -5.684 21.893 1.00 9.56 O ATOM 1826 OD2 ASP A 799 -98.255 -5.628 20.725 1.00 9.78 O ATOM 1827 H ASP A 799 -97.667 -2.883 23.412 1.00 0.00 H ATOM 1828 N VAL A 800 -96.592 -0.421 21.459 1.00 6.75 N ATOM 1829 CA VAL A 800 -96.203 0.897 20.933 1.00 6.83 C ATOM 1830 C VAL A 800 -94.831 1.331 21.437 1.00 7.58 C ATOM 1831 O VAL A 800 -94.037 1.885 20.669 1.00 7.15 O ATOM 1832 CB VAL A 800 -97.280 1.920 21.270 1.00 8.78 C ATOM 1833 CG1 VAL A 800 -96.753 3.329 21.011 1.00 7.76 C ATOM 1834 CG2 VAL A 800 -98.534 1.680 20.375 1.00 8.98 C ATOM 1835 H VAL A 800 -97.442 -0.516 22.050 1.00 0.00 H ATOM 1836 N TRP A 801 -94.543 1.135 22.739 1.00 7.53 N ATOM 1837 CA TRP A 801 -93.189 1.418 23.219 1.00 6.95 C ATOM 1838 C TRP A 801 -92.159 0.665 22.403 1.00 6.28 C ATOM 1839 O TRP A 801 -91.145 1.243 21.952 1.00 7.28 O ATOM 1840 CB TRP A 801 -93.137 0.980 24.689 1.00 8.48 C ATOM 1841 CG TRP A 801 -91.761 1.240 25.306 1.00 9.78 C ATOM 1842 CD1 TRP A 801 -90.621 0.536 25.081 1.00 8.22 C ATOM 1843 CD2 TRP A 801 -91.428 2.252 26.296 1.00 8.78 C ATOM 1844 NE1 TRP A 801 -89.565 1.089 25.801 1.00 9.01 N ATOM 1845 CE2 TRP A 801 -90.030 2.140 26.540 1.00 9.67 C ATOM 1846 CE3 TRP A 801 -92.159 3.250 26.954 1.00 7.76 C ATOM 1847 CZ2 TRP A 801 -89.356 2.959 27.475 1.00 10.00 C ATOM 1848 CZ3 TRP A 801 -91.481 4.062 27.873 1.00 10.89 C ATOM 1849 CH2 TRP A 801 -90.092 3.929 28.081 1.00 10.50 C ATOM 1850 HE1 TRP A 801 -88.580 0.755 25.780 1.00 0.00 H ATOM 1851 H TRP A 801 -95.273 0.788 23.394 1.00 0.00 H ATOM 1852 N SER A 802 -92.380 -0.645 22.243 1.00 8.00 N ATOM 1853 CA SER A 802 -91.488 -1.443 21.436 1.00 7.49 C ATOM 1854 C SER A 802 -91.364 -0.897 20.021 1.00 8.08 C ATOM 1855 O SER A 802 -90.275 -0.879 19.444 1.00 7.73 O ATOM 1856 CB SER A 802 -91.991 -2.874 21.355 1.00 7.53 C ATOM 1857 OG SER A 802 -92.091 -3.397 22.677 1.00 9.53 O ATOM 1858 HG SER A 802 -91.200 -3.377 23.107 1.00 0.00 H ATOM 1859 H SER A 802 -93.199 -1.091 22.703 1.00 0.00 H ATOM 1860 N PHE A 803 -92.471 -0.441 19.445 1.00 8.61 N ATOM 1861 CA PHE A 803 -92.382 0.128 18.117 1.00 9.45 C ATOM 1862 C PHE A 803 -91.499 1.369 18.091 1.00 6.79 C ATOM 1863 O PHE A 803 -90.758 1.574 17.107 1.00 7.97 O ATOM 1864 CB PHE A 803 -93.795 0.454 17.611 1.00 9.46 C ATOM 1865 CG PHE A 803 -93.785 1.059 16.232 1.00 7.56 C ATOM 1866 CD1 PHE A 803 -93.648 0.243 15.108 1.00 11.02 C ATOM 1867 CD2 PHE A 803 -93.799 2.428 16.083 1.00 9.62 C ATOM 1868 CE1 PHE A 803 -93.594 0.843 13.810 1.00 9.37 C ATOM 1869 CE2 PHE A 803 -93.746 3.001 14.798 1.00 6.92 C ATOM 1870 CZ PHE A 803 -93.643 2.206 13.682 1.00 7.25 C ATOM 1871 H PHE A 803 -93.385 -0.492 19.939 1.00 0.00 H ATOM 1872 N GLY A 804 -91.584 2.221 19.130 1.00 7.39 N ATOM 1873 CA GLY A 804 -90.623 3.318 19.241 1.00 7.03 C ATOM 1874 C GLY A 804 -89.191 2.835 19.148 1.00 6.20 C ATOM 1875 O GLY A 804 -88.348 3.467 18.510 1.00 7.25 O ATOM 1876 H GLY A 804 -92.327 2.100 19.848 1.00 0.00 H ATOM 1877 N ILE A 805 -88.873 1.749 19.857 1.00 8.16 N ATOM 1878 CA ILE A 805 -87.512 1.193 19.767 1.00 6.64 C ATOM 1879 C ILE A 805 -87.212 0.728 18.346 1.00 9.88 C ATOM 1880 O ILE A 805 -86.101 0.937 17.848 1.00 9.55 O ATOM 1881 CB ILE A 805 -87.325 0.045 20.787 1.00 6.73 C ATOM 1882 CG1 ILE A 805 -87.642 0.562 22.213 1.00 8.16 C ATOM 1883 CG2 ILE A 805 -85.870 -0.462 20.718 1.00 7.14 C ATOM 1884 CD1 ILE A 805 -86.645 1.648 22.742 1.00 8.85 C ATOM 1885 H ILE A 805 -89.582 1.298 20.469 1.00 0.00 H ATOM 1886 N VAL A 806 -88.176 0.073 17.696 1.00 8.77 N ATOM 1887 CA VAL A 806 -87.963 -0.351 16.301 1.00 7.78 C ATOM 1888 C VAL A 806 -87.724 0.844 15.405 1.00 8.33 C ATOM 1889 O VAL A 806 -86.845 0.799 14.516 1.00 8.32 O ATOM 1890 CB VAL A 806 -89.151 -1.172 15.813 1.00 8.27 C ATOM 1891 CG1 VAL A 806 -88.992 -1.514 14.323 1.00 10.45 C ATOM 1892 CG2 VAL A 806 -89.221 -2.468 16.644 1.00 9.24 C ATOM 1893 H VAL A 806 -89.076 -0.138 18.173 1.00 0.00 H ATOM 1894 N MET A 807 -88.458 1.952 15.623 1.00 7.24 N ATOM 1895 CA MET A 807 -88.165 3.172 14.843 1.00 7.62 C ATOM 1896 C MET A 807 -86.673 3.542 14.946 1.00 7.15 C ATOM 1897 O MET A 807 -86.031 3.903 13.965 1.00 9.25 O ATOM 1898 CB MET A 807 -89.045 4.363 15.256 1.00 8.74 C ATOM 1899 CG MET A 807 -90.525 4.125 15.043 1.00 10.59 C ATOM 1900 SD MET A 807 -91.449 5.537 15.624 1.00 11.47 S ATOM 1901 CE MET A 807 -90.929 6.833 14.503 1.00 12.88 C ATOM 1902 H MET A 807 -89.220 1.949 16.330 1.00 0.00 H ATOM 1903 N TRP A 808 -86.139 3.540 16.163 1.00 6.93 N ATOM 1904 CA TRP A 808 -84.752 3.894 16.403 1.00 7.49 C ATOM 1905 C TRP A 808 -83.828 2.866 15.771 1.00 7.65 C ATOM 1906 O TRP A 808 -82.820 3.227 15.171 1.00 9.05 O ATOM 1907 CB TRP A 808 -84.574 4.013 17.925 1.00 7.15 C ATOM 1908 CG TRP A 808 -83.267 4.641 18.357 1.00 7.10 C ATOM 1909 CD1 TRP A 808 -83.029 5.977 18.599 1.00 8.23 C ATOM 1910 CD2 TRP A 808 -82.041 3.968 18.617 1.00 8.92 C ATOM 1911 NE1 TRP A 808 -81.708 6.160 18.984 1.00 8.91 N ATOM 1912 CE2 TRP A 808 -81.106 4.930 19.024 1.00 9.00 C ATOM 1913 CE3 TRP A 808 -81.648 2.631 18.564 1.00 7.67 C ATOM 1914 CZ2 TRP A 808 -79.811 4.609 19.346 1.00 10.44 C ATOM 1915 CZ3 TRP A 808 -80.372 2.307 18.949 1.00 10.63 C ATOM 1916 CH2 TRP A 808 -79.463 3.309 19.316 1.00 11.88 C ATOM 1917 HE1 TRP A 808 -81.255 7.070 19.203 1.00 0.00 H ATOM 1918 H TRP A 808 -86.736 3.275 16.972 1.00 0.00 H ATOM 1919 N GLU A 809 -84.152 1.581 15.868 1.00 8.50 N ATOM 1920 CA GLU A 809 -83.309 0.589 15.172 1.00 8.09 C ATOM 1921 C GLU A 809 -83.292 0.853 13.668 1.00 10.30 C ATOM 1922 O GLU A 809 -82.245 0.719 13.024 1.00 8.85 O ATOM 1923 CB GLU A 809 -83.813 -0.849 15.404 1.00 10.46 C ATOM 1924 CG GLU A 809 -83.759 -1.378 16.822 1.00 9.14 C ATOM 1925 CD GLU A 809 -84.267 -2.801 16.909 1.00 8.44 C ATOM 1926 OE1 GLU A 809 -83.415 -3.716 16.820 1.00 10.01 O ATOM 1927 OE2 GLU A 809 -85.525 -3.003 17.022 1.00 9.83 O ATOM 1928 H GLU A 809 -84.980 1.281 16.421 1.00 0.00 H ATOM 1929 N VAL A 810 -84.434 1.185 13.079 1.00 8.19 N ATOM 1930 CA VAL A 810 -84.472 1.380 11.614 1.00 10.57 C ATOM 1931 C VAL A 810 -83.657 2.612 11.237 1.00 7.88 C ATOM 1932 O VAL A 810 -82.785 2.559 10.358 1.00 8.40 O ATOM 1933 CB VAL A 810 -85.910 1.472 11.084 1.00 6.89 C ATOM 1934 CG1 VAL A 810 -85.886 2.008 9.627 1.00 8.19 C ATOM 1935 CG2 VAL A 810 -86.577 0.099 11.189 1.00 7.89 C ATOM 1936 H VAL A 810 -85.298 1.307 13.645 1.00 0.00 H ATOM 1937 N MET A 811 -83.888 3.719 11.944 1.00 9.73 N ATOM 1938 CA MET A 811 -83.240 4.945 11.524 1.00 7.11 C ATOM 1939 C MET A 811 -81.725 4.919 11.767 1.00 10.77 C ATOM 1940 O MET A 811 -81.026 5.748 11.186 1.00 15.14 O ATOM 1941 CB MET A 811 -83.880 6.181 12.209 1.00 8.66 C ATOM 1942 CG MET A 811 -85.388 6.361 11.967 1.00 8.88 C ATOM 1943 SD MET A 811 -85.828 6.240 10.240 1.00 11.88 S ATOM 1944 CE MET A 811 -85.136 7.728 9.581 1.00 14.20 C ATOM 1945 H MET A 811 -84.515 3.703 12.773 1.00 0.00 H ATOM 1946 N THR A 812 -81.233 4.071 12.678 1.00 9.52 N ATOM 1947 CA THR A 812 -79.802 3.898 12.951 1.00 9.76 C ATOM 1948 C THR A 812 -79.176 2.746 12.164 1.00 10.00 C ATOM 1949 O THR A 812 -78.011 2.430 12.389 1.00 11.65 O ATOM 1950 CB THR A 812 -79.567 3.615 14.435 1.00 9.20 C ATOM 1951 OG1 THR A 812 -80.173 2.362 14.806 1.00 9.33 O ATOM 1952 CG2 THR A 812 -79.974 4.759 15.378 1.00 9.05 C ATOM 1953 HG1 THR A 812 -81.147 2.404 14.634 1.00 0.00 H ATOM 1954 H THR A 812 -81.907 3.499 13.226 1.00 0.00 H ATOM 1955 N TYR A 813 -79.913 2.087 11.264 1.00 9.19 N ATOM 1956 CA TYR A 813 -79.376 0.934 10.543 1.00 11.71 C ATOM 1957 C TYR A 813 -78.981 -0.190 11.492 1.00 11.84 C ATOM 1958 O TYR A 813 -77.997 -0.916 11.283 1.00 11.29 O ATOM 1959 CB TYR A 813 -78.261 1.289 9.552 1.00 11.56 C ATOM 1960 CG TYR A 813 -78.761 2.007 8.302 1.00 10.85 C ATOM 1961 CD1 TYR A 813 -79.205 1.284 7.214 1.00 13.07 C ATOM 1962 CD2 TYR A 813 -78.803 3.382 8.259 1.00 13.81 C ATOM 1963 CE1 TYR A 813 -79.607 1.891 6.073 1.00 15.92 C ATOM 1964 CE2 TYR A 813 -79.234 4.042 7.104 1.00 13.83 C ATOM 1965 CZ TYR A 813 -79.635 3.269 6.035 1.00 13.20 C ATOM 1966 OH TYR A 813 -80.050 3.926 4.890 1.00 16.29 O ATOM 1967 HH TYR A 813 -79.310 4.486 4.545 1.00 0.00 H ATOM 1968 H TYR A 813 -80.886 2.400 11.073 1.00 0.00 H ATOM 1969 N GLY A 814 -79.822 -0.416 12.497 1.00 9.02 N ATOM 1970 CA GLY A 814 -79.633 -1.589 13.357 1.00 10.93 C ATOM 1971 C GLY A 814 -78.644 -1.425 14.488 1.00 11.74 C ATOM 1972 O GLY A 814 -78.047 -2.405 14.954 1.00 9.62 O ATOM 1973 H GLY A 814 -80.612 0.237 12.673 1.00 0.00 H ATOM 1974 N GLU A 815 -78.459 -0.212 14.986 1.00 9.42 N ATOM 1975 CA GLU A 815 -77.703 -0.055 16.215 1.00 10.15 C ATOM 1976 C GLU A 815 -78.442 -0.755 17.350 1.00 10.55 C ATOM 1977 O GLU A 815 -79.688 -0.819 17.384 1.00 9.74 O ATOM 1978 CB GLU A 815 -77.627 1.446 16.498 1.00 11.41 C ATOM 1979 CG GLU A 815 -76.612 1.884 17.455 1.00 18.15 C ATOM 1980 CD GLU A 815 -75.171 1.995 16.859 1.00 17.25 C ATOM 1981 OE1 GLU A 815 -74.914 1.748 15.669 1.00 15.40 O ATOM 1982 OE2 GLU A 815 -74.290 2.297 17.641 1.00 22.60 O ATOM 1983 H GLU A 815 -78.852 0.620 14.501 1.00 0.00 H ATOM 1984 N ARG A 816 -77.680 -1.275 18.298 1.00 10.50 N ATOM 1985 CA ARG A 816 -78.270 -1.959 19.442 1.00 12.37 C ATOM 1986 C ARG A 816 -78.795 -0.935 20.452 1.00 12.72 C ATOM 1987 O ARG A 816 -78.041 -0.053 20.869 1.00 11.67 O ATOM 1988 CB ARG A 816 -77.246 -2.872 20.084 1.00 16.60 C ATOM 1989 CG ARG A 816 -77.829 -3.698 21.203 1.00 13.57 C ATOM 1990 CD ARG A 816 -76.817 -4.778 21.710 1.00 10.00 C ATOM 1991 NE ARG A 816 -77.454 -5.521 22.790 1.00 12.81 N ATOM 1992 CZ ARG A 816 -78.296 -6.528 22.604 1.00 14.38 C ATOM 1993 NH1 ARG A 816 -78.586 -6.938 21.369 1.00 9.80 N ATOM 1994 NH2 ARG A 816 -78.846 -7.127 23.656 1.00 18.31 N ATOM 1995 HE ARG A 816 -77.234 -5.244 23.768 1.00 0.00 H ATOM 1996 HH12 ARG A 816 -79.247 -7.728 21.225 1.00 0.00 H ATOM 1997 HH11 ARG A 816 -78.151 -6.468 20.549 1.00 0.00 H ATOM 1998 HH22 ARG A 816 -79.507 -7.918 23.517 1.00 0.00 H ATOM 1999 HH21 ARG A 816 -78.615 -6.805 24.617 1.00 0.00 H ATOM 2000 H ARG A 816 -76.646 -1.195 18.226 1.00 0.00 H ATOM 2001 N PRO A 817 -80.075 -0.983 20.818 1.00 11.00 N ATOM 2002 CA PRO A 817 -80.627 0.026 21.727 1.00 9.89 C ATOM 2003 C PRO A 817 -79.838 0.064 23.031 1.00 8.94 C ATOM 2004 O PRO A 817 -79.550 -0.972 23.627 1.00 9.85 O ATOM 2005 CB PRO A 817 -82.060 -0.470 21.969 1.00 11.07 C ATOM 2006 CG PRO A 817 -82.418 -1.298 20.752 1.00 13.30 C ATOM 2007 CD PRO A 817 -81.098 -1.876 20.237 1.00 12.50 C ATOM 2008 N TYR A 818 -79.443 1.279 23.420 1.00 9.77 N ATOM 2009 CA TYR A 818 -78.802 1.558 24.697 1.00 8.23 C ATOM 2010 C TYR A 818 -77.364 1.062 24.710 1.00 12.88 C ATOM 2011 O TYR A 818 -76.710 1.079 25.768 1.00 13.92 O ATOM 2012 CB TYR A 818 -79.545 1.053 25.937 1.00 11.25 C ATOM 2013 CG TYR A 818 -80.993 1.526 25.936 1.00 8.97 C ATOM 2014 CD1 TYR A 818 -81.369 2.759 26.458 1.00 9.73 C ATOM 2015 CD2 TYR A 818 -81.973 0.711 25.370 1.00 8.54 C ATOM 2016 CE1 TYR A 818 -82.701 3.153 26.448 1.00 9.84 C ATOM 2017 CE2 TYR A 818 -83.306 1.110 25.341 1.00 10.14 C ATOM 2018 CZ TYR A 818 -83.654 2.354 25.844 1.00 9.08 C ATOM 2019 OH TYR A 818 -84.973 2.693 25.836 1.00 10.97 O ATOM 2020 HH TYR A 818 -85.484 2.040 26.378 1.00 0.00 H ATOM 2021 H TYR A 818 -79.603 2.075 22.770 1.00 0.00 H ATOM 2022 N TRP A 819 -76.858 0.585 23.592 1.00 10.75 N ATOM 2023 CA TRP A 819 -75.430 0.190 23.452 1.00 12.88 C ATOM 2024 C TRP A 819 -75.078 -0.807 24.543 1.00 16.16 C ATOM 2025 O TRP A 819 -75.785 -1.817 24.707 1.00 15.45 O ATOM 2026 CB TRP A 819 -74.554 1.440 23.411 1.00 11.45 C ATOM 2027 CG TRP A 819 -74.866 2.251 22.257 1.00 14.11 C ATOM 2028 CD1 TRP A 819 -74.458 2.010 20.997 1.00 22.22 C ATOM 2029 CD2 TRP A 819 -75.641 3.454 22.221 1.00 18.68 C ATOM 2030 NE1 TRP A 819 -74.936 2.978 20.159 1.00 20.06 N ATOM 2031 CE2 TRP A 819 -75.672 3.878 20.884 1.00 20.04 C ATOM 2032 CE3 TRP A 819 -76.326 4.194 23.184 1.00 17.67 C ATOM 2033 CZ2 TRP A 819 -76.332 5.035 20.477 1.00 20.48 C ATOM 2034 CZ3 TRP A 819 -76.981 5.362 22.780 1.00 15.48 C ATOM 2035 CH2 TRP A 819 -77.004 5.753 21.446 1.00 21.48 C ATOM 2036 HE1 TRP A 819 -74.768 3.024 19.134 1.00 0.00 H ATOM 2037 H TRP A 819 -77.485 0.479 22.769 1.00 0.00 H ATOM 2038 N GLU A 820 -73.995 -0.585 25.281 1.00 11.60 N ATOM 2039 CA GLU A 820 -73.517 -1.581 26.206 1.00 12.84 C ATOM 2040 C GLU A 820 -74.077 -1.430 27.604 1.00 14.74 C ATOM 2041 O GLU A 820 -73.619 -2.142 28.500 1.00 16.33 O ATOM 2042 CB GLU A 820 -71.977 -1.561 26.254 1.00 17.18 C ATOM 2043 CG GLU A 820 -71.392 -0.458 27.118 1.00 19.38 C ATOM 2044 CD GLU A 820 -71.294 0.924 26.475 1.00 18.79 C ATOM 2045 OE1 GLU A 820 -71.764 1.166 25.320 1.00 16.64 O ATOM 2046 OE2 GLU A 820 -70.708 1.801 27.170 1.00 19.83 O ATOM 2047 H GLU A 820 -73.487 0.318 25.190 1.00 0.00 H ATOM 2048 N LEU A 821 -75.072 -0.560 27.833 1.00 13.76 N ATOM 2049 CA LEU A 821 -75.719 -0.542 29.150 1.00 13.57 C ATOM 2050 C LEU A 821 -76.266 -1.925 29.449 1.00 15.06 C ATOM 2051 O LEU A 821 -76.836 -2.584 28.570 1.00 16.41 O ATOM 2052 CB LEU A 821 -76.894 0.441 29.134 1.00 14.88 C ATOM 2053 CG LEU A 821 -76.563 1.914 29.056 1.00 13.34 C ATOM 2054 CD1 LEU A 821 -77.830 2.724 29.357 1.00 17.47 C ATOM 2055 CD2 LEU A 821 -75.459 2.256 30.043 1.00 20.86 C ATOM 2056 H LEU A 821 -75.381 0.094 27.086 1.00 0.00 H ATOM 2057 N SER A 822 -76.131 -2.362 30.698 1.00 13.40 N ATOM 2058 CA SER A 822 -76.747 -3.606 31.133 1.00 12.03 C ATOM 2059 C SER A 822 -78.263 -3.422 31.247 1.00 11.40 C ATOM 2060 O SER A 822 -78.761 -2.303 31.284 1.00 11.26 O ATOM 2061 CB SER A 822 -76.269 -3.930 32.563 1.00 12.58 C ATOM 2062 OG SER A 822 -76.770 -3.037 33.562 1.00 15.52 O ATOM 2063 HG SER A 822 -76.422 -3.307 34.449 1.00 0.00 H ATOM 2064 H SER A 822 -75.575 -1.804 31.376 1.00 0.00 H ATOM 2065 N ASN A 823 -78.970 -4.539 31.360 1.00 11.94 N ATOM 2066 CA ASN A 823 -80.433 -4.448 31.498 1.00 14.10 C ATOM 2067 C ASN A 823 -80.834 -3.588 32.689 1.00 13.24 C ATOM 2068 O ASN A 823 -81.766 -2.778 32.596 1.00 12.17 O ATOM 2069 CB ASN A 823 -81.074 -5.827 31.630 1.00 16.14 C ATOM 2070 CG ASN A 823 -81.074 -6.606 30.361 1.00 15.84 C ATOM 2071 OD1 ASN A 823 -81.069 -6.049 29.259 1.00 16.31 O ATOM 2072 ND2 ASN A 823 -81.098 -7.910 30.494 1.00 20.14 N ATOM 2073 HD22 ASN A 823 -81.101 -8.336 31.443 1.00 0.00 H ATOM 2074 HD21 ASN A 823 -81.114 -8.519 29.651 1.00 0.00 H ATOM 2075 H ASN A 823 -78.498 -5.465 31.351 1.00 0.00 H ATOM 2076 N HIS A 824 -80.136 -3.720 33.825 1.00 15.07 N ATOM 2077 CA HIS A 824 -80.517 -2.911 34.977 1.00 15.24 C ATOM 2078 C HIS A 824 -80.190 -1.443 34.769 1.00 12.72 C ATOM 2079 O HIS A 824 -80.947 -0.561 35.199 1.00 15.59 O ATOM 2080 CB HIS A 824 -79.900 -3.468 36.260 1.00 15.71 C ATOM 2081 CG HIS A 824 -80.687 -4.596 36.829 1.00 14.24 C ATOM 2082 ND1 HIS A 824 -80.567 -5.892 36.372 1.00 21.57 N ATOM 2083 CD2 HIS A 824 -81.671 -4.610 37.756 1.00 11.52 C ATOM 2084 CE1 HIS A 824 -81.406 -6.668 37.037 1.00 14.43 C ATOM 2085 NE2 HIS A 824 -82.088 -5.913 37.881 1.00 18.94 N ATOM 2086 H HIS A 824 -79.339 -4.386 33.884 1.00 0.00 H ATOM 2087 N GLU A 825 -79.054 -1.152 34.140 1.00 12.94 N ATOM 2088 CA GLU A 825 -78.757 0.230 33.767 1.00 14.24 C ATOM 2089 C GLU A 825 -79.799 0.825 32.806 1.00 12.76 C ATOM 2090 O GLU A 825 -80.143 2.006 32.917 1.00 12.11 O ATOM 2091 CB GLU A 825 -77.374 0.292 33.128 1.00 12.88 C ATOM 2092 CG GLU A 825 -76.264 0.091 34.177 1.00 19.80 C ATOM 2093 CD GLU A 825 -74.874 -0.077 33.553 1.00 22.10 C ATOM 2094 OE1 GLU A 825 -74.735 -0.519 32.406 1.00 14.15 O ATOM 2095 OE2 GLU A 825 -73.877 0.221 34.252 1.00 40.06 O ATOM 2096 H GLU A 825 -78.377 -1.908 33.914 1.00 0.00 H ATOM 2097 N VAL A 826 -80.318 0.022 31.880 1.00 12.98 N ATOM 2098 CA VAL A 826 -81.377 0.530 30.988 1.00 10.69 C ATOM 2099 C VAL A 826 -82.620 0.855 31.798 1.00 12.55 C ATOM 2100 O VAL A 826 -83.212 1.944 31.685 1.00 12.66 O ATOM 2101 CB VAL A 826 -81.673 -0.510 29.891 1.00 11.16 C ATOM 2102 CG1 VAL A 826 -82.891 -0.078 29.093 1.00 11.18 C ATOM 2103 CG2 VAL A 826 -80.471 -0.652 28.889 1.00 10.77 C ATOM 2104 H VAL A 826 -79.979 -0.957 31.786 1.00 0.00 H ATOM 2105 N MET A 827 -83.009 -0.073 32.685 1.00 11.05 N ATOM 2106 CA MET A 827 -84.237 0.146 33.459 1.00 9.47 C ATOM 2107 C MET A 827 -84.118 1.355 34.362 1.00 10.13 C ATOM 2108 O MET A 827 -85.039 2.179 34.456 1.00 13.04 O ATOM 2109 CB MET A 827 -84.552 -1.115 34.238 1.00 11.46 C ATOM 2110 CG MET A 827 -84.936 -2.270 33.344 1.00 11.56 C ATOM 2111 SD MET A 827 -85.510 -3.670 34.299 1.00 20.46 S ATOM 2112 CE MET A 827 -83.963 -4.345 34.824 1.00 17.22 C ATOM 2113 H MET A 827 -82.447 -0.937 32.823 1.00 0.00 H ATOM 2114 N LYS A 828 -82.954 1.513 35.002 1.00 11.70 N ATOM 2115 CA LYS A 828 -82.705 2.689 35.808 1.00 13.53 C ATOM 2116 C LYS A 828 -82.694 3.965 34.978 1.00 14.36 C ATOM 2117 O LYS A 828 -83.227 4.988 35.410 1.00 12.79 O ATOM 2118 CB LYS A 828 -81.363 2.451 36.519 1.00 15.22 C ATOM 2119 CG LYS A 828 -80.880 3.619 37.398 1.00 18.19 C ATOM 2120 CD LYS A 828 -81.836 3.944 38.532 1.00 26.44 C ATOM 2121 CE LYS A 828 -81.149 4.886 39.557 1.00 22.01 C ATOM 2122 NZ LYS A 828 -82.190 5.392 40.483 1.00 35.75 N ATOM 2123 HZ1 LYS A 828 -82.910 5.912 39.942 1.00 0.00 H ATOM 2124 HZ2 LYS A 828 -82.635 4.590 40.973 1.00 0.00 H ATOM 2125 HZ3 LYS A 828 -81.753 6.027 41.181 1.00 0.00 H ATOM 2126 H LYS A 828 -82.219 0.782 34.919 1.00 0.00 H ATOM 2127 N ALA A 829 -82.082 3.939 33.785 1.00 12.26 N ATOM 2128 CA ALA A 829 -82.055 5.150 32.976 1.00 12.03 C ATOM 2129 C ALA A 829 -83.457 5.585 32.602 1.00 12.32 C ATOM 2130 O ALA A 829 -83.816 6.772 32.725 1.00 12.41 O ATOM 2131 CB ALA A 829 -81.239 4.899 31.714 1.00 14.02 C ATOM 2132 H ALA A 829 -81.633 3.066 33.442 1.00 0.00 H ATOM 2133 N ILE A 830 -84.267 4.616 32.141 1.00 11.38 N ATOM 2134 CA ILE A 830 -85.637 4.903 31.718 1.00 11.21 C ATOM 2135 C ILE A 830 -86.436 5.457 32.892 1.00 15.08 C ATOM 2136 O ILE A 830 -87.196 6.416 32.757 1.00 15.91 O ATOM 2137 CB ILE A 830 -86.284 3.607 31.172 1.00 10.31 C ATOM 2138 CG1 ILE A 830 -85.670 3.218 29.820 1.00 9.09 C ATOM 2139 CG2 ILE A 830 -87.809 3.774 31.051 1.00 15.73 C ATOM 2140 CD1 ILE A 830 -85.832 4.311 28.767 1.00 11.75 C ATOM 2141 H ILE A 830 -83.911 3.640 32.084 1.00 0.00 H ATOM 2142 N ASN A 831 -86.315 4.834 34.051 1.00 15.27 N ATOM 2143 CA ASN A 831 -87.117 5.312 35.185 1.00 14.44 C ATOM 2144 C ASN A 831 -86.668 6.681 35.648 1.00 18.97 C ATOM 2145 O ASN A 831 -87.475 7.438 36.187 1.00 17.70 O ATOM 2146 CB ASN A 831 -87.054 4.280 36.298 1.00 16.58 C ATOM 2147 CG ASN A 831 -87.762 3.004 35.901 1.00 20.99 C ATOM 2148 OD1 ASN A 831 -88.502 2.965 34.897 1.00 33.97 O ATOM 2149 ND2 ASN A 831 -87.610 1.974 36.719 1.00 25.85 N ATOM 2150 HD22 ASN A 831 -86.982 2.053 37.544 1.00 0.00 H ATOM 2151 HD21 ASN A 831 -88.119 1.086 36.537 1.00 0.00 H ATOM 2152 H ASN A 831 -85.669 4.026 34.158 1.00 0.00 H ATOM 2153 N ASP A 832 -85.396 7.035 35.413 1.00 13.88 N ATOM 2154 CA ASP A 832 -84.951 8.379 35.726 1.00 17.87 C ATOM 2155 C ASP A 832 -85.282 9.385 34.633 1.00 15.52 C ATOM 2156 O ASP A 832 -84.990 10.574 34.816 1.00 22.17 O ATOM 2157 CB ASP A 832 -83.450 8.374 36.016 1.00 17.36 C ATOM 2158 CG ASP A 832 -83.112 7.715 37.374 1.00 23.91 C ATOM 2159 OD1 ASP A 832 -84.041 7.429 38.166 1.00 29.26 O ATOM 2160 OD2 ASP A 832 -81.932 7.475 37.587 1.00 29.88 O ATOM 2161 H ASP A 832 -84.730 6.347 35.007 1.00 0.00 H ATOM 2162 N GLY A 833 -85.892 8.951 33.509 1.00 16.02 N ATOM 2163 CA GLY A 833 -86.364 9.841 32.460 1.00 16.38 C ATOM 2164 C GLY A 833 -85.445 9.984 31.260 1.00 13.33 C ATOM 2165 O GLY A 833 -85.789 10.720 30.310 1.00 18.34 O ATOM 2166 H GLY A 833 -86.031 7.928 33.387 1.00 0.00 H ATOM 2167 N PHE A 834 -84.319 9.277 31.249 1.00 11.38 N ATOM 2168 CA PHE A 834 -83.481 9.257 30.054 1.00 13.91 C ATOM 2169 C PHE A 834 -84.164 8.470 28.935 1.00 13.30 C ATOM 2170 O PHE A 834 -84.908 7.528 29.176 1.00 12.50 O ATOM 2171 CB PHE A 834 -82.126 8.654 30.397 1.00 13.13 C ATOM 2172 CG PHE A 834 -81.340 9.503 31.382 1.00 17.68 C ATOM 2173 CD1 PHE A 834 -80.630 10.604 30.940 1.00 25.93 C ATOM 2174 CD2 PHE A 834 -81.366 9.225 32.731 1.00 25.33 C ATOM 2175 CE1 PHE A 834 -79.934 11.407 31.825 1.00 26.45 C ATOM 2176 CE2 PHE A 834 -80.678 10.031 33.624 1.00 23.05 C ATOM 2177 CZ PHE A 834 -79.969 11.121 33.164 1.00 26.42 C ATOM 2178 H PHE A 834 -84.035 8.738 32.092 1.00 0.00 H ATOM 2179 N ARG A 835 -83.901 8.889 27.703 1.00 11.58 N ATOM 2180 CA ARG A 835 -84.402 8.212 26.499 1.00 9.01 C ATOM 2181 C ARG A 835 -83.284 8.155 25.466 1.00 10.83 C ATOM 2182 O ARG A 835 -82.304 8.900 25.546 1.00 15.02 O ATOM 2183 CB ARG A 835 -85.612 8.958 25.918 1.00 11.18 C ATOM 2184 CG ARG A 835 -86.862 8.988 26.872 1.00 10.10 C ATOM 2185 CD ARG A 835 -87.359 7.603 27.121 1.00 11.73 C ATOM 2186 NE ARG A 835 -88.629 7.569 27.851 1.00 12.87 N ATOM 2187 CZ ARG A 835 -88.726 7.412 29.176 1.00 12.25 C ATOM 2188 NH1 ARG A 835 -87.643 7.383 29.938 1.00 12.36 N ATOM 2189 NH2 ARG A 835 -89.936 7.336 29.762 1.00 13.62 N ATOM 2190 HE ARG A 835 -89.509 7.673 27.306 1.00 0.00 H ATOM 2191 HH12 ARG A 835 -87.734 7.260 30.967 1.00 0.00 H ATOM 2192 HH11 ARG A 835 -86.702 7.483 29.508 1.00 0.00 H ATOM 2193 HH22 ARG A 835 -90.008 7.214 30.792 1.00 0.00 H ATOM 2194 HH21 ARG A 835 -90.798 7.399 29.184 1.00 0.00 H ATOM 2195 H ARG A 835 -83.312 9.738 27.584 1.00 0.00 H ATOM 2196 N LEU A 836 -83.453 7.275 24.478 1.00 10.03 N ATOM 2197 CA LEU A 836 -82.448 7.140 23.432 1.00 11.28 C ATOM 2198 C LEU A 836 -82.290 8.462 22.683 1.00 10.46 C ATOM 2199 O LEU A 836 -83.268 9.188 22.487 1.00 11.80 O ATOM 2200 CB LEU A 836 -82.901 6.043 22.464 1.00 10.58 C ATOM 2201 CG LEU A 836 -82.830 4.603 23.014 1.00 9.75 C ATOM 2202 CD1 LEU A 836 -83.607 3.567 22.129 1.00 11.97 C ATOM 2203 CD2 LEU A 836 -81.334 4.226 23.134 1.00 16.24 C ATOM 2204 H LEU A 836 -84.307 6.682 24.454 1.00 0.00 H ATOM 2205 N PRO A 837 -81.073 8.809 22.266 1.00 10.81 N ATOM 2206 CA PRO A 837 -80.827 10.095 21.609 1.00 10.15 C ATOM 2207 C PRO A 837 -81.168 9.972 20.140 1.00 11.03 C ATOM 2208 O PRO A 837 -81.376 8.897 19.603 1.00 12.60 O ATOM 2209 CB PRO A 837 -79.316 10.252 21.764 1.00 15.27 C ATOM 2210 CG PRO A 837 -78.827 8.815 21.712 1.00 13.27 C ATOM 2211 CD PRO A 837 -79.860 8.022 22.496 1.00 14.04 C ATOM 2212 N THR A 838 -81.185 11.115 19.490 1.00 10.84 N ATOM 2213 CA THR A 838 -81.567 11.163 18.090 1.00 11.68 C ATOM 2214 C THR A 838 -80.606 10.330 17.246 1.00 13.24 C ATOM 2215 O THR A 838 -79.380 10.441 17.427 1.00 15.69 O ATOM 2216 CB THR A 838 -81.538 12.619 17.619 1.00 18.12 C ATOM 2217 OG1 THR A 838 -80.191 13.033 17.380 1.00 25.67 O ATOM 2218 CG2 THR A 838 -82.131 13.519 18.682 1.00 11.75 C ATOM 2219 HG1 THR A 838 -80.186 13.975 17.076 1.00 0.00 H ATOM 2220 H THR A 838 -80.923 11.992 19.983 1.00 0.00 H ATOM 2221 N PRO A 839 -81.103 9.499 16.323 1.00 13.29 N ATOM 2222 CA PRO A 839 -80.203 8.918 15.318 1.00 13.99 C ATOM 2223 C PRO A 839 -79.579 10.014 14.472 1.00 13.93 C ATOM 2224 O PRO A 839 -80.115 11.125 14.363 1.00 14.13 O ATOM 2225 CB PRO A 839 -81.155 8.075 14.456 1.00 13.52 C ATOM 2226 CG PRO A 839 -82.277 7.686 15.440 1.00 14.14 C ATOM 2227 CD PRO A 839 -82.482 8.979 16.226 1.00 9.92 C ATOM 2228 N MET A 840 -78.466 9.663 13.814 1.00 14.10 N ATOM 2229 CA MET A 840 -77.882 10.539 12.803 1.00 15.96 C ATOM 2230 C MET A 840 -78.852 10.686 11.623 1.00 12.58 C ATOM 2231 O MET A 840 -79.474 9.715 11.195 1.00 15.65 O ATOM 2232 CB MET A 840 -76.542 9.943 12.286 1.00 16.45 C ATOM 2233 CG MET A 840 -75.447 9.864 13.290 1.00 23.16 C ATOM 2234 SD MET A 840 -73.965 9.123 12.513 1.00 27.89 S ATOM 2235 CE MET A 840 -72.937 8.705 13.942 1.00 23.62 C ATOM 2236 H MET A 840 -78.011 8.752 14.027 1.00 0.00 H ATOM 2237 N ASP A 841 -78.960 11.898 11.088 1.00 18.37 N ATOM 2238 CA ASP A 841 -79.718 12.152 9.862 1.00 19.03 C ATOM 2239 C ASP A 841 -81.182 11.735 9.968 1.00 18.59 C ATOM 2240 O ASP A 841 -81.764 11.201 9.020 1.00 26.43 O ATOM 2241 CB ASP A 841 -79.033 11.555 8.631 1.00 26.09 C ATOM 2242 CG ASP A 841 -77.687 12.225 8.340 1.00 33.19 C ATOM 2243 OD1 ASP A 841 -77.413 13.336 8.876 1.00 37.63 O ATOM 2244 OD2 ASP A 841 -76.908 11.655 7.556 1.00 49.70 O ATOM 2245 H ASP A 841 -78.488 12.696 11.559 1.00 0.00 H ATOM 2246 N CYS A 842 -81.792 11.997 11.140 1.00 13.54 N ATOM 2247 CA CYS A 842 -83.152 11.561 11.433 1.00 14.27 C ATOM 2248 C CYS A 842 -84.108 12.727 11.292 1.00 14.41 C ATOM 2249 O CYS A 842 -83.903 13.755 11.936 1.00 13.87 O ATOM 2250 CB CYS A 842 -83.218 11.032 12.864 1.00 13.68 C ATOM 2251 SG CYS A 842 -84.833 10.310 13.301 1.00 14.23 S ATOM 2252 H CYS A 842 -81.272 12.532 11.865 1.00 0.00 H ATOM 2253 N PRO A 843 -85.178 12.585 10.526 1.00 11.00 N ATOM 2254 CA PRO A 843 -86.202 13.628 10.479 1.00 11.00 C ATOM 2255 C PRO A 843 -86.740 13.960 11.867 1.00 15.65 C ATOM 2256 O PRO A 843 -87.029 13.088 12.684 1.00 10.65 O ATOM 2257 CB PRO A 843 -87.287 13.008 9.579 1.00 10.65 C ATOM 2258 CG PRO A 843 -86.506 12.005 8.759 1.00 13.04 C ATOM 2259 CD PRO A 843 -85.540 11.413 9.729 1.00 11.52 C ATOM 2260 N SER A 844 -86.856 15.255 12.129 1.00 11.57 N ATOM 2261 CA SER A 844 -87.393 15.739 13.384 1.00 11.24 C ATOM 2262 C SER A 844 -88.747 15.107 13.711 1.00 12.82 C ATOM 2263 O SER A 844 -88.967 14.665 14.834 1.00 11.90 O ATOM 2264 CB SER A 844 -87.537 17.263 13.267 1.00 15.60 C ATOM 2265 OG SER A 844 -88.208 17.749 14.406 1.00 17.95 O ATOM 2266 HG SER A 844 -88.304 18.732 14.337 1.00 0.00 H ATOM 2267 H SER A 844 -86.552 15.944 11.411 1.00 0.00 H ATOM 2268 N ALA A 845 -89.652 15.028 12.734 1.00 13.27 N ATOM 2269 CA ALA A 845 -90.974 14.440 12.991 1.00 9.96 C ATOM 2270 C ALA A 845 -90.860 12.978 13.429 1.00 9.78 C ATOM 2271 O ALA A 845 -91.636 12.525 14.267 1.00 10.07 O ATOM 2272 CB ALA A 845 -91.828 14.527 11.726 1.00 13.79 C ATOM 2273 H ALA A 845 -89.421 15.385 11.785 1.00 0.00 H ATOM 2274 N ILE A 846 -89.895 12.232 12.865 1.00 11.40 N ATOM 2275 CA ILE A 846 -89.674 10.825 13.219 1.00 11.23 C ATOM 2276 C ILE A 846 -89.131 10.683 14.641 1.00 11.02 C ATOM 2277 O ILE A 846 -89.616 9.849 15.443 1.00 10.83 O ATOM 2278 CB ILE A 846 -88.766 10.181 12.161 1.00 11.13 C ATOM 2279 CG1 ILE A 846 -89.481 10.150 10.799 1.00 10.04 C ATOM 2280 CG2 ILE A 846 -88.347 8.745 12.552 1.00 12.77 C ATOM 2281 CD1 ILE A 846 -90.717 9.246 10.765 1.00 13.14 C ATOM 2282 H ILE A 846 -89.280 12.669 12.149 1.00 0.00 H ATOM 2283 N TYR A 847 -88.150 11.525 15.017 1.00 11.31 N ATOM 2284 CA TYR A 847 -87.675 11.488 16.401 1.00 11.25 C ATOM 2285 C TYR A 847 -88.772 11.920 17.371 1.00 10.75 C ATOM 2286 O TYR A 847 -88.951 11.297 18.428 1.00 11.44 O ATOM 2287 CB TYR A 847 -86.432 12.362 16.555 1.00 10.20 C ATOM 2288 CG TYR A 847 -85.809 12.182 17.934 1.00 10.27 C ATOM 2289 CD1 TYR A 847 -85.336 10.949 18.305 1.00 11.56 C ATOM 2290 CD2 TYR A 847 -85.723 13.236 18.831 1.00 17.82 C ATOM 2291 CE1 TYR A 847 -84.779 10.739 19.561 1.00 12.26 C ATOM 2292 CE2 TYR A 847 -85.159 13.044 20.083 1.00 14.77 C ATOM 2293 CZ TYR A 847 -84.679 11.789 20.436 1.00 13.85 C ATOM 2294 OH TYR A 847 -84.091 11.618 21.722 1.00 13.86 O ATOM 2295 HH TYR A 847 -83.799 10.678 21.828 1.00 0.00 H ATOM 2296 H TYR A 847 -87.736 12.192 14.334 1.00 0.00 H ATOM 2297 N GLN A 848 -89.534 12.955 17.032 1.00 8.42 N ATOM 2298 CA GLN A 848 -90.648 13.333 17.903 1.00 10.08 C ATOM 2299 C GLN A 848 -91.614 12.181 18.111 1.00 9.59 C ATOM 2300 O GLN A 848 -92.026 11.901 19.238 1.00 12.62 O ATOM 2301 CB GLN A 848 -91.417 14.503 17.310 1.00 11.58 C ATOM 2302 CG GLN A 848 -90.631 15.835 17.323 1.00 15.46 C ATOM 2303 CD GLN A 848 -91.403 16.921 16.613 1.00 17.86 C ATOM 2304 OE1 GLN A 848 -92.562 17.141 16.909 1.00 24.15 O ATOM 2305 NE2 GLN A 848 -90.778 17.587 15.666 1.00 18.35 N ATOM 2306 HE22 GLN A 848 -89.786 17.368 15.444 1.00 0.00 H ATOM 2307 HE21 GLN A 848 -91.276 18.333 15.139 1.00 0.00 H ATOM 2308 H GLN A 848 -89.341 13.489 16.160 1.00 0.00 H ATOM 2309 N LEU A 849 -91.935 11.459 17.037 1.00 9.19 N ATOM 2310 CA LEU A 849 -92.883 10.345 17.153 1.00 12.85 C ATOM 2311 C LEU A 849 -92.322 9.210 18.025 1.00 14.28 C ATOM 2312 O LEU A 849 -93.034 8.669 18.886 1.00 10.11 O ATOM 2313 CB LEU A 849 -93.261 9.852 15.767 1.00 10.40 C ATOM 2314 CG LEU A 849 -94.245 8.684 15.686 1.00 10.60 C ATOM 2315 CD1 LEU A 849 -95.548 9.030 16.391 1.00 11.33 C ATOM 2316 CD2 LEU A 849 -94.474 8.354 14.205 1.00 14.70 C ATOM 2317 H LEU A 849 -91.512 11.686 16.114 1.00 0.00 H ATOM 2318 N MET A 850 -91.065 8.820 17.818 1.00 9.81 N ATOM 2319 CA MET A 850 -90.543 7.755 18.660 1.00 9.66 C ATOM 2320 C MET A 850 -90.488 8.178 20.121 1.00 9.18 C ATOM 2321 O MET A 850 -90.761 7.363 20.998 1.00 9.84 O ATOM 2322 CB MET A 850 -89.239 7.156 18.120 1.00 15.77 C ATOM 2323 CG MET A 850 -88.049 8.046 18.187 1.00 13.91 C ATOM 2324 SD MET A 850 -86.474 7.323 17.592 1.00 10.86 S ATOM 2325 CE MET A 850 -86.592 7.437 15.831 1.00 11.82 C ATOM 2326 H MET A 850 -90.478 9.261 17.081 1.00 0.00 H ATOM 2327 N MET A 851 -90.198 9.454 20.399 1.00 11.99 N ATOM 2328 CA MET A 851 -90.172 9.910 21.788 1.00 13.48 C ATOM 2329 C MET A 851 -91.542 9.808 22.441 1.00 10.42 C ATOM 2330 O MET A 851 -91.640 9.428 23.625 1.00 12.61 O ATOM 2331 CB MET A 851 -89.653 11.348 21.874 1.00 14.79 C ATOM 2332 CG MET A 851 -88.182 11.417 21.636 1.00 11.68 C ATOM 2333 SD MET A 851 -87.223 10.935 23.115 1.00 21.01 S ATOM 2334 CE MET A 851 -87.528 12.353 24.151 1.00 25.25 C ATOM 2335 H MET A 851 -89.991 10.121 19.628 1.00 0.00 H ATOM 2336 N GLN A 852 -92.615 10.081 21.685 1.00 11.41 N ATOM 2337 CA GLN A 852 -93.945 9.932 22.277 1.00 10.31 C ATOM 2338 C GLN A 852 -94.312 8.475 22.520 1.00 12.13 C ATOM 2339 O GLN A 852 -95.131 8.186 23.395 1.00 11.06 O ATOM 2340 CB GLN A 852 -94.974 10.641 21.403 1.00 15.05 C ATOM 2341 CG GLN A 852 -94.738 12.143 21.552 1.00 18.66 C ATOM 2342 CD GLN A 852 -95.497 13.013 20.575 1.00 42.43 C ATOM 2343 OE1 GLN A 852 -96.702 13.211 20.718 1.00 49.92 O ATOM 2344 NE2 GLN A 852 -94.780 13.600 19.621 1.00 37.18 N ATOM 2345 HE22 GLN A 852 -93.762 13.402 19.539 1.00 0.00 H ATOM 2346 HE21 GLN A 852 -95.237 14.257 18.957 1.00 0.00 H ATOM 2347 H GLN A 852 -92.505 10.392 20.699 1.00 0.00 H ATOM 2348 N CYS A 853 -93.708 7.545 21.752 1.00 10.33 N ATOM 2349 CA CYS A 853 -93.904 6.124 22.008 1.00 12.05 C ATOM 2350 C CYS A 853 -93.321 5.718 23.343 1.00 11.99 C ATOM 2351 O CYS A 853 -93.769 4.725 23.899 1.00 9.74 O ATOM 2352 CB CYS A 853 -93.269 5.255 20.934 1.00 9.05 C ATOM 2353 SG CYS A 853 -94.066 5.381 19.319 1.00 11.56 S ATOM 2354 H CYS A 853 -93.095 7.846 20.968 1.00 0.00 H ATOM 2355 N TRP A 854 -92.373 6.505 23.873 1.00 10.60 N ATOM 2356 CA TRP A 854 -91.661 6.177 25.105 1.00 9.31 C ATOM 2357 C TRP A 854 -92.157 7.005 26.272 1.00 8.94 C ATOM 2358 O TRP A 854 -91.421 7.191 27.264 1.00 10.64 O ATOM 2359 CB TRP A 854 -90.167 6.384 24.916 1.00 9.24 C ATOM 2360 CG TRP A 854 -89.582 5.596 23.807 1.00 7.58 C ATOM 2361 CD1 TRP A 854 -89.953 4.355 23.364 1.00 8.76 C ATOM 2362 CD2 TRP A 854 -88.463 5.995 23.013 1.00 8.61 C ATOM 2363 NE1 TRP A 854 -89.135 3.974 22.316 1.00 8.44 N ATOM 2364 CE2 TRP A 854 -88.251 4.985 22.035 1.00 7.87 C ATOM 2365 CE3 TRP A 854 -87.700 7.148 22.962 1.00 9.71 C ATOM 2366 CZ2 TRP A 854 -87.224 5.088 21.060 1.00 8.11 C ATOM 2367 CZ3 TRP A 854 -86.682 7.259 22.034 1.00 10.26 C ATOM 2368 CH2 TRP A 854 -86.455 6.241 21.091 1.00 9.41 C ATOM 2369 HE1 TRP A 854 -89.183 3.062 21.818 1.00 0.00 H ATOM 2370 H TRP A 854 -92.134 7.391 23.383 1.00 0.00 H ATOM 2371 N GLN A 855 -93.409 7.448 26.239 1.00 11.86 N ATOM 2372 CA GLN A 855 -93.954 8.091 27.432 1.00 11.10 C ATOM 2373 C GLN A 855 -94.131 7.064 28.528 1.00 15.55 C ATOM 2374 O GLN A 855 -94.615 5.959 28.281 1.00 14.11 O ATOM 2375 CB GLN A 855 -95.328 8.697 27.132 1.00 14.08 C ATOM 2376 CG GLN A 855 -95.243 9.932 26.260 1.00 16.11 C ATOM 2377 CD GLN A 855 -95.198 11.216 27.069 1.00 26.34 C ATOM 2378 OE1 GLN A 855 -94.905 11.211 28.256 1.00 36.38 O ATOM 2379 NE2 GLN A 855 -95.531 12.326 26.418 1.00 40.64 N ATOM 2380 HE22 GLN A 855 -95.773 12.283 25.407 1.00 0.00 H ATOM 2381 HE21 GLN A 855 -95.549 13.237 26.919 1.00 0.00 H ATOM 2382 H GLN A 855 -93.989 7.339 25.382 1.00 0.00 H ATOM 2383 N GLN A 856 -93.730 7.417 29.745 1.00 12.23 N ATOM 2384 CA GLN A 856 -93.852 6.507 30.879 1.00 11.54 C ATOM 2385 C GLN A 856 -95.313 6.153 31.137 1.00 13.27 C ATOM 2386 O GLN A 856 -95.641 5.015 31.473 1.00 16.69 O ATOM 2387 CB GLN A 856 -93.231 7.126 32.133 1.00 16.44 C ATOM 2388 CG GLN A 856 -92.997 6.136 33.263 1.00 26.54 C ATOM 2389 CD GLN A 856 -91.630 5.484 33.192 1.00 25.26 C ATOM 2390 OE1 GLN A 856 -90.826 5.795 32.314 1.00 39.27 O ATOM 2391 NE2 GLN A 856 -91.361 4.573 34.120 1.00 33.11 N ATOM 2392 HE22 GLN A 856 -92.072 4.342 34.843 1.00 0.00 H ATOM 2393 HE21 GLN A 856 -90.440 4.091 34.123 1.00 0.00 H ATOM 2394 H GLN A 856 -93.321 8.362 29.892 1.00 0.00 H ATOM 2395 N GLU A 857 -96.183 7.143 30.975 1.00 14.25 N ATOM 2396 CA GLU A 857 -97.611 6.970 31.178 1.00 14.33 C ATOM 2397 C GLU A 857 -98.228 6.373 29.908 1.00 17.42 C ATOM 2398 O GLU A 857 -98.283 7.021 28.858 1.00 14.37 O ATOM 2399 CB GLU A 857 -98.254 8.304 31.530 1.00 15.17 C ATOM 2400 CG GLU A 857 -99.714 8.135 31.923 1.00 21.88 C ATOM 2401 CD GLU A 857 -100.375 9.454 32.339 1.00 34.45 C ATOM 2402 OE1 GLU A 857 -99.658 10.464 32.514 1.00 30.19 O ATOM 2403 OE2 GLU A 857 -101.619 9.467 32.503 1.00 35.80 O ATOM 2404 H GLU A 857 -95.828 8.079 30.692 1.00 0.00 H ATOM 2405 N ARG A 858 -98.709 5.139 30.026 1.00 17.71 N ATOM 2406 CA ARG A 858 -99.224 4.392 28.889 1.00 19.74 C ATOM 2407 C ARG A 858 -100.242 5.204 28.110 1.00 17.45 C ATOM 2408 O ARG A 858 -100.252 5.197 26.869 1.00 19.31 O ATOM 2409 CB ARG A 858 -99.912 3.154 29.469 1.00 24.34 C ATOM 2410 CG ARG A 858 -99.684 1.879 28.776 1.00 22.77 C ATOM 2411 CD ARG A 858 -100.644 0.807 29.265 1.00 17.37 C ATOM 2412 NE ARG A 858 -101.049 0.945 30.658 1.00 22.90 N ATOM 2413 CZ ARG A 858 -102.300 1.181 31.053 1.00 36.43 C ATOM 2414 NH1 ARG A 858 -102.563 1.273 32.353 1.00 37.05 N ATOM 2415 NH2 ARG A 858 -103.286 1.326 30.153 1.00 27.38 N ATOM 2416 HE ARG A 858 -100.316 0.854 31.390 1.00 0.00 H ATOM 2417 HH12 ARG A 858 -103.535 1.457 32.675 1.00 0.00 H ATOM 2418 HH11 ARG A 858 -101.797 1.161 33.048 1.00 0.00 H ATOM 2419 HH22 ARG A 858 -104.259 1.510 30.472 1.00 0.00 H ATOM 2420 HH21 ARG A 858 -103.077 1.254 29.137 1.00 0.00 H ATOM 2421 H ARG A 858 -98.717 4.692 30.965 1.00 0.00 H ATOM 2422 N ALA A 859 -101.112 5.945 28.823 1.00 19.78 N ATOM 2423 CA ALA A 859 -102.203 6.642 28.168 1.00 22.75 C ATOM 2424 C ALA A 859 -101.734 7.778 27.281 1.00 21.37 C ATOM 2425 O ALA A 859 -102.490 8.211 26.401 1.00 21.43 O ATOM 2426 CB ALA A 859 -103.195 7.201 29.191 1.00 28.04 C ATOM 2427 H ALA A 859 -101.000 6.018 29.854 1.00 0.00 H ATOM 2428 N ARG A 860 -100.523 8.297 27.499 1.00 16.42 N ATOM 2429 CA ARG A 860 -100.028 9.396 26.694 1.00 16.49 C ATOM 2430 C ARG A 860 -99.382 8.936 25.402 1.00 13.29 C ATOM 2431 O ARG A 860 -99.022 9.777 24.576 1.00 20.03 O ATOM 2432 CB ARG A 860 -99.022 10.229 27.510 1.00 20.76 C ATOM 2433 CG ARG A 860 -99.757 11.004 28.633 1.00 23.85 C ATOM 2434 CD ARG A 860 -98.817 11.927 29.424 1.00 20.47 C ATOM 2435 NE ARG A 860 -98.065 12.844 28.576 1.00 40.45 N ATOM 2436 CZ ARG A 860 -97.259 13.792 29.050 1.00 50.85 C ATOM 2437 NH1 ARG A 860 -97.109 13.935 30.365 1.00 43.26 N ATOM 2438 NH2 ARG A 860 -96.604 14.595 28.221 1.00 41.37 N ATOM 2439 HE ARG A 860 -98.163 12.753 27.545 1.00 0.00 H ATOM 2440 HH12 ARG A 860 -96.480 14.674 30.739 1.00 0.00 H ATOM 2441 HH11 ARG A 860 -97.620 13.308 31.018 1.00 0.00 H ATOM 2442 HH22 ARG A 860 -95.976 15.333 28.599 1.00 0.00 H ATOM 2443 HH21 ARG A 860 -96.718 14.486 27.193 1.00 0.00 H ATOM 2444 H ARG A 860 -99.927 7.907 28.257 1.00 0.00 H ATOM 2445 N ARG A 861 -99.163 7.616 25.238 1.00 11.15 N ATOM 2446 CA ARG A 861 -98.546 7.159 23.996 1.00 11.96 C ATOM 2447 C ARG A 861 -99.550 7.193 22.839 1.00 12.15 C ATOM 2448 O ARG A 861 -100.752 6.958 23.031 1.00 12.77 O ATOM 2449 CB ARG A 861 -98.096 5.690 24.148 1.00 11.20 C ATOM 2450 CG ARG A 861 -97.003 5.502 25.227 1.00 11.65 C ATOM 2451 CD ARG A 861 -96.661 4.031 25.446 1.00 11.27 C ATOM 2452 NE ARG A 861 -95.987 3.979 26.777 1.00 9.70 N ATOM 2453 CZ ARG A 861 -95.954 2.905 27.569 1.00 10.77 C ATOM 2454 NH1 ARG A 861 -96.451 1.739 27.152 1.00 9.50 N ATOM 2455 NH2 ARG A 861 -95.476 3.002 28.802 1.00 10.92 N ATOM 2456 HE ARG A 861 -95.509 4.840 27.111 1.00 0.00 H ATOM 2457 HH12 ARG A 861 -96.421 0.908 27.776 1.00 0.00 H ATOM 2458 HH11 ARG A 861 -96.869 1.661 26.203 1.00 0.00 H ATOM 2459 HH22 ARG A 861 -95.451 2.164 29.417 1.00 0.00 H ATOM 2460 HH21 ARG A 861 -95.126 3.916 29.154 1.00 0.00 H ATOM 2461 H ARG A 861 -99.428 6.938 25.980 1.00 0.00 H ATOM 2462 N PRO A 862 -99.062 7.421 21.632 1.00 10.43 N ATOM 2463 CA PRO A 862 -99.947 7.294 20.472 1.00 10.42 C ATOM 2464 C PRO A 862 -100.453 5.860 20.396 1.00 14.08 C ATOM 2465 O PRO A 862 -99.810 4.926 20.853 1.00 12.06 O ATOM 2466 CB PRO A 862 -99.060 7.619 19.276 1.00 14.04 C ATOM 2467 CG PRO A 862 -97.698 7.381 19.729 1.00 13.77 C ATOM 2468 CD PRO A 862 -97.657 7.581 21.235 1.00 13.96 C ATOM 2469 N LYS A 863 -101.638 5.693 19.807 1.00 9.59 N ATOM 2470 CA LYS A 863 -102.032 4.351 19.389 1.00 8.84 C ATOM 2471 C LYS A 863 -101.418 4.080 18.031 1.00 9.34 C ATOM 2472 O LYS A 863 -100.969 4.986 17.328 1.00 10.59 O ATOM 2473 CB LYS A 863 -103.562 4.254 19.251 1.00 10.35 C ATOM 2474 CG LYS A 863 -104.315 4.675 20.567 1.00 13.54 C ATOM 2475 CD LYS A 863 -103.936 3.955 21.832 1.00 18.35 C ATOM 2476 CE LYS A 863 -104.827 4.478 22.963 1.00 18.51 C ATOM 2477 NZ LYS A 863 -104.407 3.901 24.280 1.00 22.07 N ATOM 2478 HZ1 LYS A 863 -104.484 2.865 24.243 1.00 0.00 H ATOM 2479 HZ2 LYS A 863 -103.422 4.170 24.477 1.00 0.00 H ATOM 2480 HZ3 LYS A 863 -105.025 4.269 25.031 1.00 0.00 H ATOM 2481 H LYS A 863 -102.270 6.504 19.648 1.00 0.00 H ATOM 2482 N PHE A 864 -101.400 2.799 17.644 1.00 9.01 N ATOM 2483 CA PHE A 864 -100.953 2.491 16.293 1.00 7.15 C ATOM 2484 C PHE A 864 -101.740 3.226 15.213 1.00 10.63 C ATOM 2485 O PHE A 864 -101.162 3.621 14.181 1.00 9.25 O ATOM 2486 CB PHE A 864 -100.893 0.980 16.004 1.00 10.66 C ATOM 2487 CG PHE A 864 -99.733 0.297 16.674 1.00 7.60 C ATOM 2488 CD1 PHE A 864 -98.414 0.556 16.234 1.00 8.51 C ATOM 2489 CD2 PHE A 864 -99.926 -0.586 17.744 1.00 8.08 C ATOM 2490 CE1 PHE A 864 -97.298 -0.048 16.903 1.00 6.59 C ATOM 2491 CE2 PHE A 864 -98.838 -1.197 18.376 1.00 8.97 C ATOM 2492 CZ PHE A 864 -97.519 -0.924 17.963 1.00 6.07 C ATOM 2493 H PHE A 864 -101.698 2.042 18.292 1.00 0.00 H ATOM 2494 N ALA A 865 -103.044 3.470 15.439 1.00 9.19 N ATOM 2495 CA ALA A 865 -103.782 4.243 14.452 1.00 8.52 C ATOM 2496 C ALA A 865 -103.162 5.623 14.258 1.00 9.57 C ATOM 2497 O ALA A 865 -103.147 6.151 13.140 1.00 11.89 O ATOM 2498 CB ALA A 865 -105.249 4.343 14.884 1.00 10.12 C ATOM 2499 H ALA A 865 -103.512 3.115 16.297 1.00 0.00 H ATOM 2500 N ASP A 866 -102.718 6.246 15.345 1.00 9.45 N ATOM 2501 CA ASP A 866 -102.109 7.571 15.241 1.00 10.01 C ATOM 2502 C ASP A 866 -100.769 7.489 14.544 1.00 9.99 C ATOM 2503 O ASP A 866 -100.440 8.332 13.707 1.00 12.29 O ATOM 2504 CB ASP A 866 -101.872 8.155 16.626 1.00 9.95 C ATOM 2505 CG ASP A 866 -103.126 8.272 17.412 1.00 14.60 C ATOM 2506 OD1 ASP A 866 -104.066 8.878 16.885 1.00 20.82 O ATOM 2507 OD2 ASP A 866 -103.154 7.804 18.575 1.00 15.43 O ATOM 2508 H ASP A 866 -102.804 5.788 16.275 1.00 0.00 H ATOM 2509 N ILE A 867 -99.997 6.462 14.870 1.00 10.60 N ATOM 2510 CA ILE A 867 -98.687 6.262 14.237 1.00 8.30 C ATOM 2511 C ILE A 867 -98.813 6.080 12.718 1.00 9.33 C ATOM 2512 O ILE A 867 -98.120 6.749 11.944 1.00 10.62 O ATOM 2513 CB ILE A 867 -97.961 5.067 14.875 1.00 8.49 C ATOM 2514 CG1 ILE A 867 -97.560 5.437 16.306 1.00 11.44 C ATOM 2515 CG2 ILE A 867 -96.750 4.691 14.044 1.00 10.35 C ATOM 2516 CD1 ILE A 867 -97.218 4.200 17.194 1.00 9.83 C ATOM 2517 H ILE A 867 -100.325 5.785 15.588 1.00 0.00 H ATOM 2518 N VAL A 868 -99.716 5.192 12.265 1.00 10.82 N ATOM 2519 CA VAL A 868 -99.929 4.962 10.835 1.00 12.06 C ATOM 2520 C VAL A 868 -100.352 6.249 10.137 1.00 9.06 C ATOM 2521 O VAL A 868 -99.866 6.583 9.045 1.00 11.17 O ATOM 2522 CB VAL A 868 -101.012 3.874 10.662 1.00 12.50 C ATOM 2523 CG1 VAL A 868 -101.519 3.850 9.212 1.00 13.97 C ATOM 2524 CG2 VAL A 868 -100.477 2.510 10.981 1.00 12.06 C ATOM 2525 H VAL A 868 -100.280 4.652 12.952 1.00 0.00 H ATOM 2526 N SER A 869 -101.243 7.011 10.782 1.00 11.14 N ATOM 2527 CA SER A 869 -101.722 8.251 10.176 1.00 12.02 C ATOM 2528 C SER A 869 -100.567 9.240 9.976 1.00 10.44 C ATOM 2529 O SER A 869 -100.393 9.816 8.892 1.00 13.68 O ATOM 2530 CB SER A 869 -102.823 8.836 11.042 1.00 14.35 C ATOM 2531 OG SER A 869 -103.221 10.105 10.486 1.00 18.37 O ATOM 2532 HG SER A 869 -103.553 9.970 9.563 1.00 0.00 H ATOM 2533 H SER A 869 -101.595 6.720 11.716 1.00 0.00 H ATOM 2534 N ILE A 870 -99.786 9.469 11.030 1.00 12.19 N ATOM 2535 CA ILE A 870 -98.652 10.397 10.979 1.00 11.48 C ATOM 2536 C ILE A 870 -97.648 9.968 9.933 1.00 9.90 C ATOM 2537 O ILE A 870 -97.171 10.775 9.122 1.00 12.47 O ATOM 2538 CB ILE A 870 -98.007 10.473 12.378 1.00 12.56 C ATOM 2539 CG1 ILE A 870 -98.917 11.229 13.311 1.00 13.67 C ATOM 2540 CG2 ILE A 870 -96.645 11.160 12.325 1.00 14.76 C ATOM 2541 CD1 ILE A 870 -98.485 11.152 14.688 1.00 18.69 C ATOM 2542 H ILE A 870 -99.988 8.972 11.921 1.00 0.00 H ATOM 2543 N LEU A 871 -97.274 8.685 9.934 1.00 11.56 N ATOM 2544 CA LEU A 871 -96.287 8.218 8.981 1.00 12.03 C ATOM 2545 C LEU A 871 -96.818 8.353 7.559 1.00 10.00 C ATOM 2546 O LEU A 871 -96.081 8.783 6.658 1.00 12.63 O ATOM 2547 CB LEU A 871 -95.873 6.764 9.288 1.00 9.97 C ATOM 2548 CG LEU A 871 -95.096 6.623 10.617 1.00 9.09 C ATOM 2549 CD1 LEU A 871 -94.894 5.114 10.876 1.00 10.83 C ATOM 2550 CD2 LEU A 871 -93.760 7.315 10.544 1.00 12.89 C ATOM 2551 H LEU A 871 -97.691 8.022 10.618 1.00 0.00 H ATOM 2552 N ASP A 872 -98.116 8.061 7.360 1.00 11.56 N ATOM 2553 CA ASP A 872 -98.691 8.199 6.013 1.00 9.90 C ATOM 2554 C ASP A 872 -98.647 9.644 5.527 1.00 13.06 C ATOM 2555 O ASP A 872 -98.269 9.909 4.380 1.00 13.94 O ATOM 2556 CB ASP A 872 -100.103 7.686 6.026 1.00 12.96 C ATOM 2557 CG ASP A 872 -100.636 7.495 4.624 1.00 19.30 C ATOM 2558 OD1 ASP A 872 -99.962 6.821 3.812 1.00 24.59 O ATOM 2559 OD2 ASP A 872 -101.704 8.068 4.337 1.00 24.95 O ATOM 2560 H ASP A 872 -98.708 7.740 8.152 1.00 0.00 H ATOM 2561 N LYS A 873 -98.920 10.585 6.396 1.00 13.27 N ATOM 2562 CA LYS A 873 -98.886 11.994 6.037 1.00 13.13 C ATOM 2563 C LYS A 873 -97.475 12.458 5.719 1.00 15.18 C ATOM 2564 O LYS A 873 -97.266 13.186 4.827 1.00 14.60 O ATOM 2565 CB LYS A 873 -99.426 12.825 7.163 1.00 12.40 C ATOM 2566 CG LYS A 873 -100.931 12.675 7.277 1.00 17.64 C ATOM 2567 CD LYS A 873 -101.411 13.326 8.545 1.00 21.81 C ATOM 2568 CE LYS A 873 -102.832 13.788 8.474 1.00 29.71 C ATOM 2569 NZ LYS A 873 -103.786 12.837 9.007 1.00 47.65 N ATOM 2570 HZ1 LYS A 873 -103.724 11.948 8.471 1.00 0.00 H ATOM 2571 HZ2 LYS A 873 -103.570 12.656 10.008 1.00 0.00 H ATOM 2572 HZ3 LYS A 873 -104.746 13.227 8.923 1.00 0.00 H ATOM 2573 H LYS A 873 -99.168 10.317 7.370 1.00 0.00 H ATOM 2574 N LEU A 874 -96.512 12.024 6.498 1.00 11.06 N ATOM 2575 CA LEU A 874 -95.132 12.414 6.224 1.00 14.76 C ATOM 2576 C LEU A 874 -94.656 11.866 4.891 1.00 15.36 C ATOM 2577 O LEU A 874 -93.951 12.548 4.134 1.00 16.55 O ATOM 2578 CB LEU A 874 -94.231 11.933 7.374 1.00 11.71 C ATOM 2579 CG LEU A 874 -94.486 12.546 8.742 1.00 11.88 C ATOM 2580 CD1 LEU A 874 -93.757 11.724 9.789 1.00 12.53 C ATOM 2581 CD2 LEU A 874 -93.989 13.994 8.834 1.00 14.23 C ATOM 2582 H LEU A 874 -96.731 11.406 7.305 1.00 0.00 H ATOM 2583 N ILE A 875 -95.020 10.621 4.580 1.00 14.21 N ATOM 2584 CA ILE A 875 -94.596 10.001 3.330 1.00 14.09 C ATOM 2585 C ILE A 875 -95.234 10.704 2.141 1.00 18.83 C ATOM 2586 O ILE A 875 -94.590 10.905 1.103 1.00 17.23 O ATOM 2587 CB ILE A 875 -94.924 8.492 3.347 1.00 14.08 C ATOM 2588 CG1 ILE A 875 -94.001 7.779 4.331 1.00 15.54 C ATOM 2589 CG2 ILE A 875 -94.830 7.865 1.902 1.00 16.47 C ATOM 2590 CD1 ILE A 875 -94.424 6.360 4.544 1.00 13.64 C ATOM 2591 H ILE A 875 -95.617 10.083 5.241 1.00 0.00 H ATOM 2592 N ARG A 876 -96.485 11.111 2.270 1.00 16.05 N ATOM 2593 CA ARG A 876 -97.227 11.754 1.202 1.00 15.32 C ATOM 2594 C ARG A 876 -96.793 13.196 0.993 1.00 22.17 C ATOM 2595 O ARG A 876 -97.043 13.725 -0.007 1.00 21.38 O ATOM 2596 CB ARG A 876 -98.719 11.626 1.430 1.00 14.10 C ATOM 2597 CG ARG A 876 -99.188 10.177 1.239 1.00 17.39 C ATOM 2598 CD ARG A 876 -100.543 9.839 1.874 1.00 42.39 C ATOM 2599 NE ARG A 876 -101.650 10.339 1.105 1.00 42.86 N ATOM 2600 CZ ARG A 876 -102.910 10.089 1.430 1.00 43.53 C ATOM 2601 NH1 ARG A 876 -103.188 9.344 2.485 1.00 37.67 N ATOM 2602 NH2 ARG A 876 -103.903 10.549 0.699 1.00 37.56 N ATOM 2603 HE ARG A 876 -101.455 10.918 0.263 1.00 0.00 H ATOM 2604 HH12 ARG A 876 -104.178 9.149 2.738 1.00 0.00 H ATOM 2605 HH11 ARG A 876 -102.417 8.952 3.063 1.00 0.00 H ATOM 2606 HH22 ARG A 876 -104.886 10.343 0.969 1.00 0.00 H ATOM 2607 HH21 ARG A 876 -103.705 11.118 -0.148 1.00 0.00 H ATOM 2608 H ARG A 876 -96.961 10.963 3.183 1.00 0.00 H ATOM 2609 N ALA A 877 -96.173 13.791 1.980 1.00 15.87 N ATOM 2610 CA ALA A 877 -95.534 15.098 1.821 1.00 14.93 C ATOM 2611 C ALA A 877 -94.044 14.959 2.134 1.00 18.74 C ATOM 2612 O ALA A 877 -93.585 15.419 3.179 1.00 18.17 O ATOM 2613 CB ALA A 877 -96.212 16.097 2.759 1.00 18.03 C ATOM 2614 H ALA A 877 -96.133 13.320 2.907 1.00 0.00 H ATOM 2615 N PRO A 878 -93.268 14.308 1.264 1.00 18.66 N ATOM 2616 CA PRO A 878 -91.942 13.820 1.683 1.00 22.97 C ATOM 2617 C PRO A 878 -90.943 14.910 2.015 1.00 28.19 C ATOM 2618 O PRO A 878 -89.921 14.609 2.661 1.00 20.03 O ATOM 2619 CB PRO A 878 -91.486 12.965 0.489 1.00 26.73 C ATOM 2620 CG PRO A 878 -92.327 13.455 -0.629 1.00 24.92 C ATOM 2621 CD PRO A 878 -93.629 13.756 -0.045 1.00 19.83 C ATOM 2622 N ASP A 879 -91.197 16.157 1.599 1.00 21.95 N ATOM 2623 CA ASP A 879 -90.322 17.256 2.015 1.00 24.22 C ATOM 2624 C ASP A 879 -90.357 17.468 3.520 1.00 29.01 C ATOM 2625 O ASP A 879 -89.387 17.993 4.088 1.00 24.91 O ATOM 2626 CB ASP A 879 -90.674 18.555 1.275 1.00 27.52 C ATOM 2627 CG ASP A 879 -90.346 18.490 -0.190 1.00 36.66 C ATOM 2628 OD1 ASP A 879 -89.637 17.537 -0.601 1.00 35.66 O ATOM 2629 OD2 ASP A 879 -90.797 19.390 -0.936 1.00 43.64 O ATOM 2630 H ASP A 879 -92.013 16.345 0.982 1.00 0.00 H ATOM 2631 N SER A 880 -91.444 17.055 4.175 1.00 25.42 N ATOM 2632 CA SER A 880 -91.521 17.133 5.628 1.00 21.37 C ATOM 2633 C SER A 880 -90.396 16.351 6.272 1.00 18.84 C ATOM 2634 O SER A 880 -90.021 16.648 7.411 1.00 22.72 O ATOM 2635 CB SER A 880 -92.855 16.598 6.134 1.00 20.51 C ATOM 2636 OG SER A 880 -92.969 15.215 5.845 1.00 22.08 O ATOM 2637 HG SER A 880 -92.915 15.078 4.866 1.00 0.00 H ATOM 2638 H SER A 880 -92.249 16.671 3.640 1.00 0.00 H ATOM 2639 N LEU A 881 -89.857 15.342 5.578 1.00 18.03 N ATOM 2640 CA LEU A 881 -88.769 14.557 6.155 1.00 18.22 C ATOM 2641 C LEU A 881 -87.406 15.198 5.976 1.00 22.24 C ATOM 2642 O LEU A 881 -86.422 14.631 6.451 1.00 18.81 O ATOM 2643 CB LEU A 881 -88.742 13.148 5.551 1.00 19.48 C ATOM 2644 CG LEU A 881 -90.076 12.469 5.824 1.00 19.93 C ATOM 2645 CD1 LEU A 881 -90.248 11.268 4.911 1.00 22.91 C ATOM 2646 CD2 LEU A 881 -90.244 12.071 7.268 1.00 14.49 C ATOM 2647 H LEU A 881 -90.213 15.117 4.627 1.00 0.00 H ATOM 2648 N LYS A 882 -87.306 16.344 5.289 1.00 20.07 N ATOM 2649 CA LYS A 882 -85.987 16.935 5.108 1.00 22.72 C ATOM 2650 C LYS A 882 -85.520 17.758 6.301 1.00 17.56 C ATOM 2651 O LYS A 882 -84.326 18.058 6.395 1.00 19.49 O ATOM 2652 CB LYS A 882 -85.996 17.839 3.889 1.00 18.76 C ATOM 2653 CG LYS A 882 -86.182 17.085 2.573 1.00 24.33 C ATOM 2654 CD LYS A 882 -86.202 18.084 1.410 1.00 38.10 C ATOM 2655 CE LYS A 882 -86.361 17.405 0.056 1.00 50.21 C ATOM 2656 NZ LYS A 882 -86.403 18.389 -1.066 1.00 51.04 N ATOM 2657 HZ1 LYS A 882 -87.208 19.033 -0.930 1.00 0.00 H ATOM 2658 HZ2 LYS A 882 -85.518 18.935 -1.080 1.00 0.00 H ATOM 2659 HZ3 LYS A 882 -86.512 17.881 -1.967 1.00 0.00 H ATOM 2660 H LYS A 882 -88.152 16.802 4.893 1.00 0.00 H ATOM 2661 N THR A 883 -86.419 18.130 7.197 1.00 16.90 N ATOM 2662 CA THR A 883 -86.063 18.831 8.430 1.00 19.98 C ATOM 2663 C THR A 883 -85.570 17.815 9.458 1.00 15.79 C ATOM 2664 O THR A 883 -86.348 16.974 9.905 1.00 17.23 O ATOM 2665 CB THR A 883 -87.309 19.566 8.926 1.00 21.07 C ATOM 2666 OG1 THR A 883 -87.702 20.576 7.960 1.00 21.67 O ATOM 2667 CG2 THR A 883 -87.032 20.204 10.236 1.00 23.15 C ATOM 2668 HG1 THR A 883 -88.509 21.048 8.287 1.00 0.00 H ATOM 2669 H THR A 883 -87.421 17.915 7.017 1.00 0.00 H ATOM 2670 N LEU A 884 -84.290 17.895 9.838 1.00 16.29 N ATOM 2671 CA LEU A 884 -83.650 16.877 10.676 1.00 17.75 C ATOM 2672 C LEU A 884 -83.568 17.318 12.125 1.00 14.43 C ATOM 2673 O LEU A 884 -83.305 18.488 12.426 1.00 17.01 O ATOM 2674 CB LEU A 884 -82.238 16.540 10.175 1.00 16.04 C ATOM 2675 CG LEU A 884 -82.144 16.111 8.711 1.00 21.34 C ATOM 2676 CD1 LEU A 884 -80.720 15.866 8.315 1.00 23.34 C ATOM 2677 CD2 LEU A 884 -82.985 14.837 8.459 1.00 22.94 C ATOM 2678 H LEU A 884 -83.727 18.712 9.527 1.00 0.00 H ATOM 2679 N ALA A 885 -83.783 16.381 13.036 1.00 14.65 N ATOM 2680 CA ALA A 885 -83.443 16.654 14.418 1.00 12.97 C ATOM 2681 C ALA A 885 -81.935 16.804 14.560 1.00 13.16 C ATOM 2682 O ALA A 885 -81.158 16.065 13.952 1.00 14.90 O ATOM 2683 CB ALA A 885 -83.880 15.487 15.286 1.00 13.43 C ATOM 2684 H ALA A 885 -84.190 15.463 12.764 1.00 0.00 H ATOM 2685 N ASP A 886 -81.531 17.716 15.447 1.00 13.64 N ATOM 2686 CA ASP A 886 -80.119 17.877 15.772 1.00 15.82 C ATOM 2687 C ASP A 886 -79.560 16.581 16.337 1.00 19.86 C ATOM 2688 O ASP A 886 -80.199 15.932 17.163 1.00 22.05 O ATOM 2689 CB ASP A 886 -80.015 18.945 16.853 1.00 17.95 C ATOM 2690 CG ASP A 886 -78.582 19.337 17.162 1.00 19.14 C ATOM 2691 OD1 ASP A 886 -77.818 19.436 16.177 1.00 18.78 O ATOM 2692 OD2 ASP A 886 -78.243 19.579 18.346 1.00 21.16 O ATOM 2693 H ASP A 886 -82.235 18.322 15.914 1.00 0.00 H ATOM 2694 N PHE A 887 -78.356 16.229 15.896 1.00 18.34 N ATOM 2695 CA PHE A 887 -77.625 15.060 16.363 1.00 23.49 C ATOM 2696 C PHE A 887 -76.514 15.540 17.297 1.00 24.75 C ATOM 2697 O PHE A 887 -75.736 16.416 16.915 1.00 27.88 O ATOM 2698 CB PHE A 887 -77.035 14.325 15.144 1.00 19.61 C ATOM 2699 CG PHE A 887 -76.115 13.192 15.515 1.00 21.09 C ATOM 2700 CD1 PHE A 887 -76.627 12.032 16.060 1.00 23.81 C ATOM 2701 CD2 PHE A 887 -74.723 13.315 15.356 1.00 21.69 C ATOM 2702 CE1 PHE A 887 -75.805 11.003 16.436 1.00 30.08 C ATOM 2703 CE2 PHE A 887 -73.878 12.271 15.713 1.00 28.04 C ATOM 2704 CZ PHE A 887 -74.411 11.121 16.253 1.00 32.17 C ATOM 2705 H PHE A 887 -77.908 16.826 15.172 1.00 0.00 H ATOM 2706 N ASP A 888 -76.468 14.988 18.530 1.00 28.02 N ATOM 2707 CA ASP A 888 -75.461 15.290 19.554 1.00 38.87 C ATOM 2708 C ASP A 888 -74.160 14.543 19.284 1.00 25.11 C ATOM 2709 O ASP A 888 -74.054 13.362 19.635 1.00 31.56 O ATOM 2710 CB ASP A 888 -75.952 14.815 20.925 1.00 37.70 C ATOM 2711 CG ASP A 888 -74.973 15.115 22.040 1.00 50.70 C ATOM 2712 OD1 ASP A 888 -74.731 16.307 22.329 1.00 56.22 O ATOM 2713 OD2 ASP A 888 -74.438 14.152 22.626 1.00 60.51 O ATOM 2714 H ASP A 888 -77.204 14.295 18.772 1.00 0.00 H ATOM 2715 N PRO A 889 -73.145 15.177 18.708 1.00 35.00 N ATOM 2716 CA PRO A 889 -71.936 14.428 18.343 1.00 40.14 C ATOM 2717 C PRO A 889 -71.215 13.955 19.588 1.00 40.40 C ATOM 2718 O PRO A 889 -71.114 14.678 20.581 1.00 41.28 O ATOM 2719 CB PRO A 889 -71.090 15.461 17.595 1.00 41.13 C ATOM 2720 CG PRO A 889 -71.459 16.738 18.248 1.00 43.43 C ATOM 2721 CD PRO A 889 -72.942 16.628 18.581 1.00 42.34 C ATOM 2722 N ARG A 890 -70.732 12.722 19.541 1.00 41.26 N ATOM 2723 CA ARG A 890 -70.009 12.124 20.621 1.00 34.08 C ATOM 2724 C ARG A 890 -68.484 12.400 20.509 1.00 45.46 C ATOM 2725 O ARG A 890 -67.803 12.367 21.474 1.00 55.58 O ATOM 2726 CB ARG A 890 -70.366 10.648 20.764 1.00 39.74 C ATOM 2727 CG ARG A 890 -71.764 10.349 20.257 1.00 46.85 C ATOM 2728 CD ARG A 890 -72.039 8.858 20.077 1.00 48.58 C ATOM 2729 NE ARG A 890 -73.471 8.824 20.021 1.00 56.28 N ATOM 2730 CZ ARG A 890 -74.232 8.420 19.022 1.00 49.20 C ATOM 2731 NH1 ARG A 890 -73.744 7.812 17.938 1.00 48.11 N ATOM 2732 NH2 ARG A 890 -75.531 8.573 19.181 1.00 42.85 N ATOM 2733 HE ARG A 890 -73.970 9.158 20.870 1.00 0.00 H ATOM 2734 HH12 ARG A 890 -74.386 7.512 17.177 1.00 0.00 H ATOM 2735 HH11 ARG A 890 -72.722 7.638 17.855 1.00 0.00 H ATOM 2736 HH22 ARG A 890 -76.186 8.274 18.430 1.00 0.00 H ATOM 2737 HH21 ARG A 890 -75.902 8.992 20.058 1.00 0.00 H ATOM 2738 H ARG A 890 -70.886 12.162 18.678 1.00 0.00 H ATOM 2739 N VAL A 891 -67.981 12.673 19.326 1.00 45.91 N ATOM 2740 CA VAL A 891 -66.590 13.039 19.101 1.00 47.98 C ATOM 2741 C VAL A 891 -66.542 14.410 18.442 1.00 49.69 C ATOM 2742 O VAL A 891 -67.272 14.668 17.476 1.00 41.87 O ATOM 2743 CB VAL A 891 -65.851 11.988 18.253 1.00 43.40 C ATOM 2744 CG1 VAL A 891 -64.639 12.604 17.570 1.00 47.85 C ATOM 2745 CG2 VAL A 891 -65.388 10.882 19.131 1.00 44.06 C ATOM 2746 H VAL A 891 -68.614 12.625 18.502 1.00 0.00 H ATOM 2747 N SER A 892 -65.690 15.283 18.978 1.00 45.44 N ATOM 2748 CA SER A 892 -65.376 16.565 18.368 1.00 46.71 C ATOM 2749 C SER A 892 -64.087 16.412 17.573 1.00 44.37 C ATOM 2750 O SER A 892 -63.074 15.932 18.105 1.00 46.63 O ATOM 2751 CB SER A 892 -65.157 17.632 19.441 1.00 60.36 C ATOM 2752 OG SER A 892 -63.989 17.351 20.203 1.00 59.83 O ATOM 2753 HG SER A 892 -63.201 17.334 19.603 1.00 0.00 H ATOM 2754 H SER A 892 -65.227 15.036 19.876 1.00 0.00 H ATOM 2755 N ILE A 893 -64.126 16.812 16.306 1.00 30.04 N ATOM 2756 CA ILE A 893 -62.936 16.896 15.465 1.00 31.24 C ATOM 2757 C ILE A 893 -62.774 18.350 15.041 1.00 41.38 C ATOM 2758 O ILE A 893 -63.710 18.947 14.498 1.00 33.90 O ATOM 2759 CB ILE A 893 -63.044 15.985 14.226 1.00 30.75 C ATOM 2760 CG1 ILE A 893 -63.217 14.519 14.627 1.00 32.94 C ATOM 2761 CG2 ILE A 893 -61.796 16.132 13.376 1.00 36.05 C ATOM 2762 CD1 ILE A 893 -61.967 13.872 15.223 1.00 30.44 C ATOM 2763 H ILE A 893 -65.044 17.077 15.896 1.00 0.00 H ATOM 2764 N ARG A 894 -61.589 18.910 15.268 1.00 27.77 N ATOM 2765 CA ARG A 894 -61.284 20.289 14.915 1.00 38.11 C ATOM 2766 C ARG A 894 -60.065 20.310 14.004 1.00 42.01 C ATOM 2767 O ARG A 894 -59.154 19.500 14.166 1.00 32.91 O ATOM 2768 CB ARG A 894 -60.914 21.084 16.165 1.00 45.60 C ATOM 2769 CG ARG A 894 -61.697 20.754 17.393 1.00 41.29 C ATOM 2770 CD ARG A 894 -61.067 21.407 18.612 1.00 59.93 C ATOM 2771 NE ARG A 894 -59.884 20.691 19.075 1.00 64.76 N ATOM 2772 CZ ARG A 894 -59.923 19.635 19.880 1.00 55.16 C ATOM 2773 NH1 ARG A 894 -61.089 19.184 20.288 1.00 59.48 N ATOM 2774 NH2 ARG A 894 -58.800 19.027 20.265 1.00 47.47 N ATOM 2775 HE ARG A 894 -58.953 21.028 18.756 1.00 0.00 H ATOM 2776 HH12 ARG A 894 -61.135 18.358 20.918 1.00 0.00 H ATOM 2777 HH11 ARG A 894 -61.965 19.653 19.980 1.00 0.00 H ATOM 2778 HH22 ARG A 894 -58.846 18.201 20.896 1.00 0.00 H ATOM 2779 HH21 ARG A 894 -57.879 19.379 19.935 1.00 0.00 H ATOM 2780 H ARG A 894 -60.847 18.337 15.718 1.00 0.00 H ATOM 2781 N LEU A 895 -60.044 21.250 13.052 1.00 36.41 N ATOM 2782 CA LEU A 895 -58.914 21.442 12.166 1.00 40.26 C ATOM 2783 C LEU A 895 -58.699 22.950 12.092 1.00 50.47 C ATOM 2784 O LEU A 895 -59.677 23.701 11.958 1.00 37.86 O ATOM 2785 CB LEU A 895 -59.204 20.900 10.761 1.00 44.34 C ATOM 2786 CG LEU A 895 -59.807 19.513 10.545 1.00 48.63 C ATOM 2787 CD1 LEU A 895 -60.378 19.402 9.145 1.00 47.18 C ATOM 2788 CD2 LEU A 895 -58.729 18.479 10.760 1.00 50.02 C ATOM 2789 H LEU A 895 -60.873 21.868 12.944 1.00 0.00 H ATOM 2790 N PRO A 896 -57.451 23.432 12.193 1.00 50.21 N ATOM 2791 CA PRO A 896 -57.208 24.862 11.942 1.00 49.19 C ATOM 2792 C PRO A 896 -57.476 25.269 10.492 1.00 46.33 C ATOM 2793 O PRO A 896 -57.597 24.392 9.635 1.00 45.43 O ATOM 2794 CB PRO A 896 -55.721 25.032 12.269 1.00 52.36 C ATOM 2795 CG PRO A 896 -55.164 23.626 12.385 1.00 51.69 C ATOM 2796 CD PRO A 896 -56.297 22.778 12.829 1.00 35.95 C TER 2797 PRO A 896 HETATM 2798 O HOH 1 -85.333 5.942 39.180 1.00 39.76 O HETATM 2799 O HOH 2 -80.925 -9.548 18.811 1.00 19.99 O HETATM 2800 O HOH 3 -83.847 -6.405 39.165 1.00 35.27 O HETATM 2801 O HOH 4 -85.817 -30.871 10.719 1.00 37.13 O HETATM 2802 O HOH 5 -77.555 8.054 18.251 1.00 28.72 O HETATM 2803 O HOH 6 -107.385 -0.515 18.923 1.00 30.51 O HETATM 2804 O HOH 7 -83.313 -8.966 28.318 1.00 25.80 O HETATM 2805 O HOH 8 -88.821 1.019 33.609 1.00 22.29 O HETATM 2806 O HOH 9 -71.343 4.087 27.386 1.00 36.84 O HETATM 2807 O HOH 10 -93.970 -22.202 15.585 1.00 32.56 O HETATM 2808 O HOH 11 -98.509 -1.320 4.414 1.00 27.88 O HETATM 2809 O HOH 12 -89.661 7.868 32.848 1.00 32.70 O HETATM 2810 O HOH 13 -80.486 -8.502 0.735 1.00 30.82 O HETATM 2811 O HOH 14 -72.658 -0.933 31.091 1.00 25.76 O HETATM 2812 O HOH 15 -98.488 -20.801 25.937 1.00 45.15 O HETATM 2813 O HOH 16 -75.344 4.457 9.737 1.00 33.69 O HETATM 2814 O HOH 17 -91.352 -28.651 -4.572 1.00 41.40 O HETATM 2815 O HOH 18 -77.544 14.354 11.200 1.00 33.64 O HETATM 2816 O HOH 19 -89.953 7.201 36.703 1.00 39.61 O HETATM 2817 O HOH 20 -89.067 -25.686 15.249 1.00 37.25 O HETATM 2818 O HOH 21 -104.855 2.240 32.918 1.00 43.96 O HETATM 2819 O HOH 22 -83.653 -13.315 18.967 1.00 40.65 O HETATM 2820 O HOH 23 -106.162 -20.241 11.758 1.00 29.94 O HETATM 2821 O HOH 24 -75.047 17.349 14.631 1.00 42.06 O HETATM 2822 O HOH 25 -88.594 -14.153 14.707 1.00 30.38 O HETATM 2823 O HOH 26 -92.664 -24.988 23.327 1.00 37.40 O HETATM 2824 O HOH 27 -78.502 18.520 20.672 1.00 32.27 O HETATM 2825 O HOH 28 -80.991 -3.095 16.215 1.00 16.21 O HETATM 2826 O HOH 29 -92.408 -28.952 26.560 1.00 30.40 O HETATM 2827 O HOH 30 -96.118 2.668 32.474 1.00 27.50 O HETATM 2828 O HOH 31 -96.846 -20.942 22.601 1.00 34.50 O HETATM 2829 O HOH 32 -75.773 -3.713 35.873 1.00 23.45 O HETATM 2830 O HOH 33 -90.059 9.905 25.644 1.00 26.81 O HETATM 2831 O HOH 34 -99.965 -33.551 4.806 1.00 27.91 O HETATM 2832 O HOH 35 -88.017 13.057 1.757 1.00 32.37 O HETATM 2833 O HOH 36 -75.666 -14.428 6.898 1.00 40.02 O HETATM 2834 O HOH 37 -73.371 -0.436 3.420 1.00 32.68 O HETATM 2835 O HOH 38 -79.846 6.551 4.914 1.00 24.31 O HETATM 2836 O HOH 39 -87.376 -11.777 11.616 1.00 29.80 O HETATM 2837 O HOH 40 -104.150 -13.417 3.320 1.00 36.71 O HETATM 2838 O HOH 41 -95.807 -5.564 24.580 1.00 11.71 O HETATM 2839 O HOH 42 -98.454 10.880 22.234 1.00 38.74 O HETATM 2840 O HOH 43 -82.380 -6.135 26.957 1.00 16.57 O HETATM 2841 O HOH 44 -79.157 1.204 -2.386 1.00 24.19 O HETATM 2842 O HOH 45 -75.702 3.263 13.394 1.00 17.05 O HETATM 2843 O HOH 46 -93.935 -11.594 40.232 1.00 28.86 O HETATM 2844 O HOH 47 -102.323 -0.699 35.228 1.00 27.37 O HETATM 2845 O HOH 48 -101.752 0.946 21.641 1.00 13.61 O HETATM 2846 O HOH 49 -96.060 -12.442 19.108 1.00 15.03 O HETATM 2847 O HOH 50 -82.307 17.091 4.939 1.00 31.94 O HETATM 2848 O HOH 51 -100.810 -5.174 19.685 1.00 11.53 O HETATM 2849 O HOH 52 -78.700 7.061 11.226 1.00 23.64 O HETATM 2850 O HOH 53 -89.377 -15.776 19.661 1.00 28.55 O HETATM 2851 O HOH 54 -93.002 -16.763 -1.209 1.00 22.57 O HETATM 2852 O HOH 55 -76.894 -12.233 5.227 1.00 43.78 O HETATM 2853 O HOH 56 -83.996 -6.318 17.055 1.00 10.67 O HETATM 2854 O HOH 57 -93.250 20.216 -1.627 1.00 44.13 O HETATM 2855 O HOH 58 -92.904 -9.085 33.124 1.00 28.12 O HETATM 2856 O HOH 59 -86.307 -12.106 37.252 1.00 47.01 O HETATM 2857 O HOH 60 -94.972 1.677 3.624 1.00 21.39 O HETATM 2858 O HOH 61 -104.896 9.717 8.420 1.00 37.36 O HETATM 2859 O HOH 62 -95.607 9.974 30.539 1.00 17.72 O HETATM 2860 O HOH 63 -103.006 -22.526 5.470 1.00 35.14 O HETATM 2861 O HOH 64 -99.383 1.182 32.764 1.00 19.56 O HETATM 2862 O HOH 65 -91.369 -0.604 2.808 1.00 15.54 O HETATM 2863 O HOH 66 -99.006 -2.210 28.681 1.00 13.01 O HETATM 2864 O HOH 67 -103.172 -7.847 27.150 1.00 39.42 O HETATM 2865 O HOH 68 -86.584 7.153 -2.037 1.00 23.24 O HETATM 2866 O HOH 69 -83.198 -14.780 -0.382 1.00 23.00 O HETATM 2867 O HOH 70 -86.643 0.572 26.019 1.00 10.57 O HETATM 2868 O HOH 71 -88.706 -15.047 -4.054 1.00 35.92 O HETATM 2869 O HOH 72 -81.068 19.862 11.764 1.00 24.53 O HETATM 2870 O HOH 73 -101.056 -14.246 8.143 1.00 20.01 O HETATM 2871 O HOH 74 -73.305 -2.609 10.462 1.00 18.01 O HETATM 2872 O HOH 75 -104.581 4.963 11.154 1.00 13.10 O HETATM 2873 O HOH 76 -87.146 -0.688 28.180 1.00 18.11 O HETATM 2874 O HOH 77 -80.560 13.571 13.027 1.00 17.78 O HETATM 2875 O HOH 78 -94.236 -15.287 24.940 1.00 30.57 O HETATM 2876 O HOH 79 -86.576 -13.716 17.612 1.00 32.74 O HETATM 2877 O HOH 80 -93.568 9.754 -1.159 1.00 31.19 O HETATM 2878 O HOH 81 -84.363 13.598 4.972 1.00 29.65 O HETATM 2879 O HOH 82 -76.322 -1.830 38.467 1.00 38.31 O HETATM 2880 O HOH 83 -81.388 -7.338 17.128 1.00 16.05 O HETATM 2881 O HOH 84 -93.390 -11.527 0.192 1.00 21.42 O HETATM 2882 O HOH 85 -88.449 11.161 29.797 1.00 37.45 O HETATM 2883 O HOH 86 -75.891 -4.320 -0.501 1.00 24.69 O HETATM 2884 O HOH 87 -91.542 -6.153 24.702 1.00 17.29 O HETATM 2885 O HOH 88 -99.326 14.723 3.818 1.00 30.51 O HETATM 2886 O HOH 89 -103.571 -1.728 9.470 1.00 16.51 O HETATM 2887 O HOH 90 -77.735 7.006 13.547 1.00 20.64 O HETATM 2888 O HOH 91 -75.276 -0.868 11.818 1.00 22.55 O HETATM 2889 O HOH 92 -93.616 -5.817 21.972 1.00 11.01 O HETATM 2890 O HOH 93 -89.896 -18.541 12.036 1.00 27.29 O HETATM 2891 O HOH 94 -101.818 4.913 24.590 1.00 17.44 O HETATM 2892 O HOH 95 -84.159 -12.835 13.748 1.00 19.82 O HETATM 2893 O HOH 96 -89.989 1.732 2.059 1.00 14.07 O HETATM 2894 O HOH 97 -89.012 16.033 9.939 1.00 16.17 O HETATM 2895 O HOH 98 -77.599 -6.967 31.242 1.00 27.17 O HETATM 2896 O HOH 99 -97.075 -14.464 26.386 1.00 37.58 O HETATM 2897 O HOH 100 -82.353 4.820 -2.377 1.00 25.83 O HETATM 2898 O HOH 101 -89.607 -8.022 -6.240 1.00 34.75 O HETATM 2899 O HOH 102 -73.215 -2.549 6.208 1.00 22.49 O HETATM 2900 O HOH 103 -98.699 -10.823 3.778 1.00 18.43 O HETATM 2901 O HOH 104 -75.871 -4.615 24.947 1.00 32.71 O HETATM 2902 O HOH 105 -72.611 7.846 22.515 1.00 37.53 O HETATM 2903 O HOH 106 -78.551 3.847 34.332 1.00 22.11 O HETATM 2904 O HOH 107 -100.617 3.076 22.816 1.00 11.69 O HETATM 2905 O HOH 108 -81.390 -10.255 6.935 1.00 20.72 O HETATM 2906 O HOH 109 -103.222 12.046 12.537 1.00 35.06 O HETATM 2907 O HOH 110 -71.142 -0.015 22.831 1.00 20.82 O HETATM 2908 O HOH 111 -80.082 15.748 19.981 1.00 38.50 O HETATM 2909 O HOH 112 -96.454 -9.266 -0.211 1.00 31.39 O HETATM 2910 O HOH 113 -103.943 -4.460 24.405 1.00 16.71 O HETATM 2911 O HOH 114 -105.161 -5.260 21.415 1.00 29.43 O HETATM 2912 O HOH 115 -102.697 -11.228 22.682 1.00 20.39 O HETATM 2913 O HOH 116 -90.706 -15.266 -2.224 1.00 32.56 O HETATM 2914 O HOH 117 -103.427 -5.515 3.707 1.00 20.01 O HETATM 2915 O HOH 118 -103.280 11.345 15.661 1.00 39.92 O HETATM 2916 O HOH 119 -87.669 -16.406 10.958 1.00 30.55 O HETATM 2917 O HOH 120 -99.685 -41.370 2.626 1.00 37.78 O HETATM 2918 O HOH 121 -102.108 -18.303 1.768 1.00 39.82 O HETATM 2919 O HOH 122 -77.133 18.045 13.758 1.00 28.38 O HETATM 2920 O HOH 123 -88.892 -7.132 21.838 1.00 29.97 O HETATM 2921 O HOH 124 -109.610 -13.904 12.367 1.00 23.79 O HETATM 2922 O HOH 125 -103.994 -2.125 34.297 1.00 32.99 O HETATM 2923 O HOH 126 -81.965 -11.672 13.293 1.00 24.70 O HETATM 2924 O HOH 127 -100.937 -28.277 -6.460 1.00 47.37 O HETATM 2925 O HOH 128 -88.907 -14.173 12.119 1.00 37.10 O HETATM 2926 O HOH 129 -100.475 -30.511 -1.131 1.00 35.43 O HETATM 2927 O HOH 130 -87.501 -31.727 1.172 1.00 40.45 O HETATM 2928 O HOH 131 -106.961 -8.810 3.536 1.00 38.34 O HETATM 2929 O HOH 132 -106.457 -28.715 3.559 1.00 35.11 O HETATM 2930 O HOH 133 -102.135 -16.233 6.174 1.00 26.51 O HETATM 2931 O HOH 134 -81.611 7.756 9.172 1.00 30.02 O HETATM 2932 O HOH 135 -92.286 9.913 30.087 1.00 21.28 O HETATM 2933 O HOH 136 -105.748 -6.569 4.655 1.00 29.17 O HETATM 2934 O HOH 137 -98.093 -20.724 20.298 1.00 27.46 O HETATM 2935 O HOH 138 -93.528 -34.350 6.736 1.00 30.40 O HETATM 2936 O HOH 139 -82.804 20.065 8.597 1.00 28.16 O HETATM 2937 O HOH 140 -93.292 -4.016 25.266 1.00 10.45 O HETATM 2938 O HOH 141 -86.544 -33.833 8.614 1.00 46.96 O HETATM 2939 O HOH 142 -99.595 -8.706 0.496 1.00 30.28 O HETATM 2940 O HOH 143 -93.500 17.132 0.100 1.00 24.48 O HETATM 2941 O HOH 144 -78.829 -9.454 17.164 1.00 23.04 O HETATM 2942 O HOH 145 -100.520 -8.690 30.574 1.00 25.75 O HETATM 2943 O HOH 146 -96.337 -40.476 14.536 1.00 29.70 O HETATM 2944 O HOH 147 -95.886 -31.007 27.415 1.00 26.39 O HETATM 2945 O HOH 148 -85.655 5.387 24.892 1.00 10.30 O HETATM 2946 O HOH 149 -82.542 -13.395 8.904 1.00 30.22 O HETATM 2947 O HOH 150 -91.386 -17.029 13.749 1.00 36.74 O HETATM 2948 O HOH 151 -93.489 -36.731 19.761 1.00 30.54 O HETATM 2949 O HOH 152 -101.280 -11.943 6.380 1.00 15.83 O HETATM 2950 O HOH 153 -79.364 -9.225 5.156 1.00 35.25 O HETATM 2951 O HOH 154 -77.933 12.371 19.177 1.00 21.36 O HETATM 2952 O HOH 155 -73.640 -4.274 0.591 1.00 43.62 O HETATM 2953 O HOH 156 -109.827 -10.851 16.104 1.00 30.45 O HETATM 2954 O HOH 157 -93.180 -2.060 4.588 1.00 15.44 O HETATM 2955 O HOH 158 -95.959 5.345 -0.808 1.00 40.77 O HETATM 2956 O HOH 159 -88.787 -31.111 18.722 1.00 41.97 O HETATM 2957 O HOH 160 -78.281 -6.080 34.461 1.00 20.21 O HETATM 2958 O HOH 161 -102.900 -28.482 18.723 1.00 33.58 O HETATM 2959 O HOH 162 -98.886 3.888 32.734 1.00 32.94 O HETATM 2960 O HOH 163 -89.653 -15.968 15.487 1.00 43.11 O HETATM 2961 O HOH 164 -82.469 10.352 1.842 1.00 27.25 O HETATM 2962 O HOH 165 -104.497 -21.496 4.145 1.00 46.91 O HETATM 2963 O HOH 166 -88.879 -12.631 38.225 1.00 52.01 O HETATM 2964 O HOH 167 -80.365 13.483 21.177 1.00 26.22 O HETATM 2965 O HOH 168 -75.966 6.206 16.669 1.00 45.75 O HETATM 2966 O HOH 169 -97.729 6.838 0.009 1.00 32.27 O HETATM 2967 O HOH 170 -76.223 11.277 20.363 1.00 31.75 O HETATM 2968 O HOH 171 -82.375 11.524 27.645 1.00 24.35 O HETATM 2969 O HOH 172 -103.669 -1.277 6.634 1.00 25.93 O HETATM 2970 O HOH 173 -89.324 -0.894 35.217 1.00 27.10 O HETATM 2971 O HOH 174 -102.599 -36.927 2.419 1.00 31.45 O HETATM 2972 O HOH 175 -92.903 -37.381 17.515 1.00 30.83 O HETATM 2973 O HOH 176 -78.762 16.879 12.212 1.00 24.10 O HETATM 2974 O HOH 177 -88.326 1.932 -2.527 1.00 23.75 O HETATM 2975 O HOH 178 -95.076 -39.600 8.780 1.00 31.81 O HETATM 2976 O HOH 179 -101.619 5.404 31.821 1.00 24.39 O HETATM 2977 O HOH 180 -85.623 10.595 1.150 1.00 21.96 O HETATM 2978 O HOH 181 -94.758 -7.306 -1.869 1.00 22.03 O HETATM 2979 O HOH 182 -105.114 -10.184 23.918 1.00 30.81 O HETATM 2980 O HOH 183 -82.742 1.712 -3.325 1.00 23.41 O HETATM 2981 O HOH 184 -98.017 -35.092 27.604 1.00 29.45 O HETATM 2982 O HOH 185 -104.101 -15.128 4.819 1.00 33.42 O HETATM 2983 O HOH 186 -91.633 -10.615 -2.952 1.00 38.43 O HETATM 2984 O HOH 187 -79.615 -11.032 14.063 1.00 30.01 O HETATM 2985 O HOH 188 -106.503 -2.113 19.815 1.00 23.89 O HETATM 2986 O HOH 189 -70.709 0.696 8.154 1.00 28.42 O HETATM 2987 O HOH 190 -76.068 11.448 23.177 1.00 34.07 O HETATM 2988 O HOH 191 -110.159 -11.662 20.279 1.00 48.11 O HETATM 2989 O HOH 192 -88.018 8.157 39.301 1.00 35.28 O HETATM 2990 O HOH 193 -104.803 -28.983 9.239 1.00 41.84 O HETATM 2991 O HOH 194 -95.820 -1.678 3.155 1.00 12.67 O HETATM 2992 O HOH 195 -93.754 -6.521 -7.595 1.00 30.12 O HETATM 2993 O HOH 196 -102.476 -25.620 18.835 1.00 36.41 O HETATM 2994 O HOH 197 -79.740 -12.235 6.449 1.00 37.13 O HETATM 2995 O HOH 198 -89.421 -36.212 12.593 1.00 30.02 O HETATM 2996 O HOH 199 -74.617 -1.446 37.119 1.00 35.81 O HETATM 2997 O HOH 200 -73.408 -3.600 22.990 1.00 35.27 O HETATM 2998 O HOH 201 -100.458 -21.827 21.427 1.00 35.86 O HETATM 2999 O HOH 202 -90.375 10.603 28.228 1.00 34.70 O HETATM 3000 O HOH 203 -87.893 0.044 30.547 1.00 30.40 O HETATM 3001 O HOH 204 -98.782 -15.721 26.518 1.00 36.07 O HETATM 3002 O HOH 205 -79.624 6.479 34.930 1.00 33.45 O HETATM 3003 O HOH 206 -85.209 -17.090 10.060 1.00 36.62 O HETATM 3004 O HOH 207 -78.472 6.075 -0.569 1.00 47.04 O HETATM 3005 O HOH 208 -93.743 -39.823 6.832 1.00 43.65 O HETATM 3006 O HOH 209 -79.470 6.856 26.912 1.00 35.46 O HETATM 3007 O HOH 210 -86.458 -11.815 -5.635 1.00 37.69 O HETATM 3008 O HOH 211 -82.095 -21.564 -2.977 1.00 54.65 O HETATM 3009 O HOH 212 -73.162 -1.522 21.620 1.00 20.92 O HETATM 3010 O HOH 213 -97.890 5.685 34.550 1.00 30.93 O HETATM 3011 O HOH 214 -102.069 -12.827 4.044 1.00 30.75 O HETATM 3012 O HOH 215 -96.701 3.030 -1.809 1.00 38.15 O HETATM 3013 O HOH 216 -77.687 7.700 8.253 1.00 35.64 O HETATM 3014 O HOH 217 -110.121 -13.345 14.778 1.00 37.62 O HETATM 3015 O HOH 218 -91.295 15.623 -3.735 1.00 44.34 O HETATM 3016 O HOH 219 -102.016 -34.368 3.105 1.00 31.63 O HETATM 3017 O HOH 220 -104.660 -6.199 26.357 1.00 33.52 O HETATM 3018 O HOH 221 -91.020 -26.508 25.233 1.00 36.28 O HETATM 3019 O HOH 222 -79.881 7.964 7.011 1.00 32.25 O HETATM 3020 O HOH 223 -106.708 -28.402 1.354 1.00 49.15 O HETATM 3021 O HOH 224 -87.292 -18.551 13.482 1.00 38.07 O HETATM 3022 O HOH 225 -97.438 -14.661 35.366 1.00 34.21 O HETATM 3023 O HOH 226 -75.836 5.902 14.398 1.00 34.74 O HETATM 3024 O HOH 227 -97.294 9.623 -2.238 1.00 28.86 O HETATM 3025 O HOH 228 -104.936 5.817 8.458 1.00 41.25 O HETATM 3026 O HOH 229 -85.677 12.817 2.359 1.00 36.50 O HETATM 3027 O HOH 230 -86.714 -16.380 -3.999 1.00 36.74 O HETATM 3028 O HOH 231 -81.437 12.455 2.455 1.00 37.39 O HETATM 3029 OAW UNN A 232 -79.283 -17.778 -0.740 1.00 -0.57 O HETATM 3030 CAV UNN A 232 -78.476 -17.723 0.222 1.00 0.04 C HETATM 3031 OAX UNN A 232 -77.468 -18.453 0.375 1.00 -0.57 O HETATM 3032 CAU UNN A 232 -78.736 -16.671 1.319 1.00 0.00 C HETATM 3033 CAT UNN A 232 -80.209 -16.265 1.299 1.00 -0.01 C HETATM 3034 CAY UNN A 232 -80.449 -15.037 2.186 1.00 0.04 C HETATM 3035 NAQ UNN A 232 -81.380 -15.529 3.243 1.00 -0.27 N HETATM 3036 CAR UNN A 232 -81.152 -16.975 3.367 1.00 0.03 C HETATM 3037 CAS UNN A 232 -81.071 -17.362 1.914 1.00 -0.03 C HETATM 3038 H6 UNN A 232 -80.596 -18.347 1.796 1.00 0.03 H HETATM 3039 H7 UNN A 232 -82.071 -17.379 1.456 1.00 0.03 H HETATM 3040 H8 UNN A 232 -80.215 -17.195 3.899 1.00 0.05 H HETATM 3041 H9 UNN A 232 -81.989 -17.477 3.875 1.00 0.05 H HETATM 3042 CAP UNN A 232 -82.209 -14.664 3.848 1.00 0.20 C HETATM 3043 OAZ UNN A 232 -82.143 -13.466 3.538 1.00 -0.38 O HETATM 3044 CAO UNN A 232 -83.120 -15.034 4.860 1.00 0.04 C HETATM 3045 CBA UNN A 232 -84.500 -15.117 4.580 1.00 -0.02 C HETATM 3046 CAK UNN A 232 -85.461 -15.418 5.547 1.00 0.07 C HETATM 3047 CAL UNN A 232 -85.009 -15.598 6.856 1.00 -0.03 C HETATM 3048 CAM UNN A 232 -83.639 -15.520 7.139 1.00 -0.07 C HETATM 3049 CAN UNN A 232 -82.693 -15.226 6.167 1.00 -0.05 C HETATM 3050 H11 UNN A 232 -81.643 -15.148 6.423 1.00 0.06 H HETATM 3051 H12 UNN A 232 -83.305 -15.696 8.155 1.00 0.06 H HETATM 3052 H13 UNN A 232 -85.717 -15.798 7.652 1.00 0.06 H HETATM 3053 NAJ UNN A 232 -86.753 -15.462 5.128 1.00 -0.23 N HETATM 3054 CAI UNN A 232 -87.799 -15.953 5.835 1.00 0.21 C HETATM 3055 SBB UNN A 232 -87.819 -16.728 7.334 1.00 0.03 S HETATM 3056 CAF UNN A 232 -89.523 -16.953 7.321 1.00 0.11 C HETATM 3057 CAG UNN A 232 -90.004 -16.443 6.164 1.00 -0.01 C HETATM 3058 NAH UNN A 232 -89.059 -15.888 5.357 1.00 -0.30 N HETATM 3059 H15 UNN A 232 -91.060 -16.474 5.900 1.00 0.06 H HETATM 3060 CAE UNN A 232 -90.175 -17.600 8.334 1.00 0.23 C HETATM 3061 OBC UNN A 232 -89.561 -17.852 9.366 1.00 -0.39 O HETATM 3062 NAD UNN A 232 -91.469 -17.994 8.185 1.00 -0.24 N HETATM 3063 CAC UNN A 232 -92.121 -18.658 9.206 1.00 0.08 C HETATM 3064 CAB UNN A 232 -92.625 -17.946 10.288 1.00 0.05 C HETATM 3065 CL1 UNN A 232 -92.397 -16.222 10.363 1.00 -0.09 CL HETATM 3066 CBH UNN A 232 -93.313 -18.599 11.315 1.00 -0.07 C HETATM 3067 CBG UNN A 232 -93.494 -19.981 11.238 1.00 -0.08 C HETATM 3068 CBF UNN A 232 -93.006 -20.697 10.145 1.00 -0.07 C HETATM 3069 CBD UNN A 232 -92.317 -20.040 9.132 1.00 -0.02 C HETATM 3070 CBE UNN A 232 -91.840 -20.783 8.046 1.00 -0.04 C HETATM 3071 H20 UNN A 232 -91.323 -20.114 7.343 1.00 0.04 H HETATM 3072 H21 UNN A 232 -92.684 -21.270 7.536 1.00 0.04 H HETATM 3073 H22 UNN A 232 -91.138 -21.549 8.406 1.00 0.04 H HETATM 3074 H19 UNN A 232 -93.164 -21.768 10.085 1.00 0.05 H HETATM 3075 H18 UNN A 232 -94.017 -20.501 12.033 1.00 0.05 H HETATM 3076 H17 UNN A 232 -93.700 -18.040 12.159 1.00 0.05 H HETATM 3077 H16 UNN A 232 -91.951 -17.802 7.330 1.00 0.22 H HETATM 3078 H14 UNN A 232 -86.955 -15.089 4.189 1.00 0.22 H HETATM 3079 H10 UNN A 232 -84.831 -14.938 3.563 1.00 0.06 H HETATM 3080 H4 UNN A 232 -80.909 -14.222 1.609 1.00 0.05 H HETATM 3081 H5 UNN A 232 -79.506 -14.685 2.629 1.00 0.05 H HETATM 3082 H3 UNN A 232 -80.519 -16.061 0.264 1.00 0.03 H HETATM 3083 H1 UNN A 232 -78.110 -15.786 1.134 1.00 0.04 H HETATM 3084 H2 UNN A 232 -78.487 -17.097 2.302 1.00 0.04 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 322 323 331 332 333 CONECT 331 322 CONECT 332 322 CONECT 333 322 CONECT 1599 1600 1603 1604 1605 CONECT 1603 1599 CONECT 1604 1599 CONECT 1605 1599 CONECT 3029 3030 CONECT 3030 3029 3031 3032 CONECT 3031 3030 CONECT 3032 3030 3033 3083 3084 CONECT 3033 3032 3034 3037 3082 CONECT 3034 3033 3035 3080 3081 CONECT 3035 3034 3036 3042 CONECT 3036 3035 3037 3040 3041 CONECT 3037 3033 3036 3038 3039 CONECT 3038 3037 CONECT 3039 3037 CONECT 3040 3036 CONECT 3041 3036 CONECT 3042 3035 3043 3044 CONECT 3043 3042 CONECT 3044 3042 3045 3049 CONECT 3045 3044 3046 3079 CONECT 3046 3045 3047 3053 CONECT 3047 3046 3048 3052 CONECT 3048 3047 3049 3051 CONECT 3049 3044 3048 3050 CONECT 3050 3049 CONECT 3051 3048 CONECT 3052 3047 CONECT 3053 3046 3054 3078 CONECT 3054 3053 3055 3058 CONECT 3055 3054 3056 CONECT 3056 3055 3057 3060 CONECT 3057 3056 3058 3059 CONECT 3058 3054 3057 CONECT 3059 3057 CONECT 3060 3056 3061 3062 CONECT 3061 3060 CONECT 3062 3060 3063 3077 CONECT 3063 3062 3064 3069 CONECT 3064 3063 3065 3066 CONECT 3065 3064 CONECT 3066 3064 3067 3076 CONECT 3067 3066 3068 3075 CONECT 3068 3067 3069 3074 CONECT 3069 3063 3068 3070 CONECT 3070 3069 3071 3072 3073 CONECT 3071 3070 CONECT 3072 3070 CONECT 3073 3070 CONECT 3074 3068 CONECT 3075 3067 CONECT 3076 3066 CONECT 3077 3062 CONECT 3078 3053 CONECT 3079 3045 CONECT 3080 3034 CONECT 3081 3034 CONECT 3082 3033 CONECT 3083 3032 CONECT 3084 3032 MASTER 0 0 0 0 0 0 0 0 3081 3 68 24 END
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Related entries of code: 5nkd
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
5i9x
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PDBbind
306aa, >5I9X_1|Chain... *
5i9y
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PDBbind
306aa, >5I9Y_1|Chain... at 100%
5i9z
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PDBbind
306aa, >5I9Z_1|Chain... at 100%
5ia0
RCSB PDB
PDBbind
306aa, >5IA0_1|Chains... at 100%
5ia1
RCSB PDB
PDBbind
306aa, >5IA1_1|Chain... at 100%
5ia2
RCSB PDB
PDBbind
306aa, >5IA2_1|Chain... at 100%
5ia3
RCSB PDB
PDBbind
306aa, >5IA3_1|Chain... at 100%
5ia4
RCSB PDB
PDBbind
306aa, >5IA4_1|Chain... at 100%
5ia5
RCSB PDB
PDBbind
306aa, >5IA5_1|Chain... at 100%
5njz
RCSB PDB
PDBbind
306aa, >5NJZ_1|Chain... at 100%
5nk2
RCSB PDB
PDBbind
306aa, >5NK2_1|Chain... at 100%
5nk3
RCSB PDB
PDBbind
306aa, >5NK3_1|Chain... at 100%
5nk4
RCSB PDB
PDBbind
306aa, >5NK4_1|Chain... at 100%
5nk6
RCSB PDB
PDBbind
306aa, >5NK6_1|Chain... at 100%
5nk7
RCSB PDB
PDBbind
306aa, >5NK7_1|Chain... at 100%
5nk8
RCSB PDB
PDBbind
306aa, >5NK8_1|Chain... at 100%
5nk9
RCSB PDB
PDBbind
306aa, >5NK9_1|Chain... at 100%
5nka
RCSB PDB
PDBbind
306aa, >5NKA_1|Chain... at 100%
5nkb
RCSB PDB
PDBbind
306aa, >5NKB_1|Chain... at 100%
5nkc
RCSB PDB
PDBbind
306aa, >5NKC_1|Chain... at 100%
5nkg
RCSB PDB
PDBbind
306aa, >5NKG_1|Chain... at 100%
5nkh
RCSB PDB
PDBbind
306aa, >5NKH_1|Chain... at 100%
5nki
RCSB PDB
PDBbind
306aa, >5NKI_1|Chain... at 100%
6fnf
RCSB PDB
PDBbind
306aa, >6FNF_1|Chain... at 100%
6fng
RCSB PDB
PDBbind
306aa, >6FNG_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5nkd
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Ephrin type-A receptor 2
Ligand Name
91K
EC.Number
E.C.2.7.10.1
Resolution
1.41(Å)
Affinity (Kd/Ki/IC50)
Kd=26nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) ChemMedChem Vol. 12: pp. 999-1011
Ligand Properties
Formula
C
2
4
H
2
3
ClN
4
O
4
S
Molecular Weight
498.982
Exact Mass
498.113
No. of atoms
57
No. of bonds
60
Polar Surface Area
139.87
LOGP Value
5.78 (
Computed with XLOGP3
)
5.12 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
OC(=O)C[C@H]1CCN(C1)C(=O)c1cccc(c1)Nc1ncc(s1)C(=O)Nc1c(C)cccc1Cl
InChI String
InChI=1S/C24H23ClN4O4S/c1-14-4-2-7-18(25)21(14)28-22(32)19-12-26-24(34-19)27-17-6-3-5-16(11-17)23(33)29-9-8-15(13-29)10-20(30)31/h2-7,11-12,15H,8-10,13H2,1H3,(H,26,27)(H,28,32)(H,30,31)/t15-/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):
P29317
Entrez Gene ID
NCBI Entrez Gene ID:
1969
ASD
Information of known allosteric effects of PDB entries
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