Browse entries in the PDBbind-CN Database
HEADER 5IA1_COMPLEX COMPND 5IA1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 29 THR THR GLU ILE HIS PRO SER CYS VAL THR ARG GLN LYS SEQRES 2 A 29 VAL ILE GLY ALA GLY GLU PHE GLY GLU VAL TYR LYS GLY SEQRES 3 A 29 MET LEU LYS SEQRES 1 A 122 GLU VAL PRO VAL ALA ILE LYS THR LEU LYS ALA GLY TYR SEQRES 2 A 122 THR GLU LYS GLN ARG VAL ASP PHE LEU GLY GLU ALA GLY SEQRES 3 A 122 ILE MET GLY GLN PHE SER HIS HIS ASN ILE ILE ARG LEU SEQRES 4 A 122 GLU GLY VAL ILE SER LYS TYR LYS PRO MET MET ILE ILE SEQRES 5 A 122 THR GLU TYR MET GLU ASN GLY ALA LEU ASP LYS PHE LEU SEQRES 6 A 122 ARG GLU LYS ASP GLY GLU PHE SER VAL LEU GLN LEU VAL SEQRES 7 A 122 GLY MET LEU ARG GLY ILE ALA ALA GLY MET LYS TYR LEU SEQRES 8 A 122 ALA ASN MET ASN TYR VAL HIS ARG ASP LEU ALA ALA ARG SEQRES 9 A 122 ASN ILE LEU VAL ASN SER ASN LEU VAL CYS LYS VAL SER SEQRES 10 A 122 ASP PHE GLY LEU SER SEQRES 1 A 110 ILE PRO ILE ARG TRP THR ALA PRO GLU ALA ILE SER TYR SEQRES 2 A 110 ARG LYS PHE THR SER ALA SER ASP VAL TRP SER PHE GLY SEQRES 3 A 110 ILE VAL MET TRP GLU VAL MET THR TYR GLY GLU ARG PRO SEQRES 4 A 110 TYR TRP GLU LEU SER ASN HIS GLU VAL MET LYS ALA ILE SEQRES 5 A 110 ASN ASP GLY PHE ARG LEU PRO THR PRO MET ASP CYS PRO SEQRES 6 A 110 SER ALA ILE TYR GLN LEU MET MET GLN CYS TRP GLN GLN SEQRES 7 A 110 GLU ARG ALA ARG ARG PRO LYS PHE ALA ASP ILE VAL SER SEQRES 8 A 110 ILE LEU ASP LYS LEU ILE ARG ALA PRO ASP SER LEU LYS SEQRES 9 A 110 THR LEU ALA ASP PHE ASP HET ZZL A 398 48 ATOM 1 N THR A 605 -106.711 -23.440 8.204 1.00 55.03 N ATOM 2 CA THR A 605 -105.382 -23.239 7.619 1.00 54.15 C ATOM 3 C THR A 605 -105.169 -24.172 6.439 1.00 52.11 C ATOM 4 O THR A 605 -105.462 -25.367 6.538 1.00 56.49 O ATOM 5 CB THR A 605 -104.249 -23.490 8.634 1.00 48.35 C ATOM 6 OG1 THR A 605 -104.369 -22.589 9.736 1.00 54.87 O ATOM 7 CG2 THR A 605 -102.897 -23.276 7.971 1.00 48.87 C ATOM 8 HG1 THR A 605 -103.637 -22.759 10.381 1.00 0.00 H ATOM 9 HN3 THR A 605 -106.799 -24.423 8.531 1.00 0.00 H ATOM 10 HN2 THR A 605 -107.438 -23.246 7.486 1.00 0.00 H ATOM 11 HN1 THR A 605 -106.836 -22.793 9.008 1.00 0.00 H ATOM 12 N THR A 606 -104.660 -23.637 5.328 1.00 45.48 N ATOM 13 CA THR A 606 -104.361 -24.482 4.184 1.00 43.73 C ATOM 14 C THR A 606 -103.386 -25.577 4.599 1.00 46.69 C ATOM 15 O THR A 606 -102.328 -25.304 5.180 1.00 39.66 O ATOM 16 CB THR A 606 -103.791 -23.654 3.031 1.00 44.21 C ATOM 17 OG1 THR A 606 -104.747 -22.667 2.640 1.00 50.88 O ATOM 18 CG2 THR A 606 -103.506 -24.534 1.837 1.00 39.41 C ATOM 19 HG1 THR A 606 -104.379 -22.130 1.894 1.00 0.00 H ATOM 20 H THR A 606 -104.477 -22.614 5.280 1.00 0.00 H ATOM 21 N GLU A 607 -103.778 -26.821 4.347 1.00 46.58 N ATOM 22 CA GLU A 607 -102.919 -27.969 4.571 1.00 43.37 C ATOM 23 C GLU A 607 -102.163 -28.238 3.278 1.00 45.33 C ATOM 24 O GLU A 607 -102.769 -28.342 2.205 1.00 43.93 O ATOM 25 CB GLU A 607 -103.742 -29.185 5.000 1.00 44.29 C ATOM 26 CG GLU A 607 -102.925 -30.420 5.359 1.00 41.74 C ATOM 27 CD GLU A 607 -102.334 -30.381 6.761 1.00 43.44 C ATOM 28 OE1 GLU A 607 -102.715 -29.502 7.580 1.00 38.53 O ATOM 29 OE2 GLU A 607 -101.477 -31.249 7.039 1.00 41.96 O ATOM 30 H GLU A 607 -104.736 -26.978 3.975 1.00 0.00 H ATOM 31 N ILE A 608 -100.842 -28.305 3.373 1.00 40.67 N ATOM 32 CA ILE A 608 -99.975 -28.473 2.216 1.00 44.24 C ATOM 33 C ILE A 608 -99.475 -29.909 2.204 1.00 42.49 C ATOM 34 O ILE A 608 -99.067 -30.439 3.244 1.00 36.26 O ATOM 35 CB ILE A 608 -98.811 -27.463 2.238 1.00 38.71 C ATOM 36 CG1 ILE A 608 -99.351 -26.035 2.077 1.00 40.26 C ATOM 37 CG2 ILE A 608 -97.801 -27.773 1.138 1.00 40.66 C ATOM 38 CD1 ILE A 608 -98.296 -24.936 2.274 1.00 39.11 C ATOM 39 H ILE A 608 -100.407 -28.234 4.315 1.00 0.00 H ATOM 40 N HIS A 609 -99.532 -30.549 1.027 1.00 38.96 N ATOM 41 CA HIS A 609 -99.010 -31.907 0.933 1.00 40.53 C ATOM 42 C HIS A 609 -97.487 -31.880 0.858 1.00 40.34 C ATOM 43 O HIS A 609 -96.919 -31.054 0.135 1.00 40.71 O ATOM 44 CB HIS A 609 -99.568 -32.630 -0.296 1.00 39.39 C ATOM 45 CG HIS A 609 -99.344 -34.109 -0.265 1.00 39.65 C ATOM 46 ND1 HIS A 609 -98.262 -34.712 -0.873 1.00 40.52 N ATOM 47 CD2 HIS A 609 -100.043 -35.103 0.336 1.00 40.21 C ATOM 48 CE1 HIS A 609 -98.313 -36.016 -0.660 1.00 42.70 C ATOM 49 NE2 HIS A 609 -99.385 -36.279 0.068 1.00 40.85 N ATOM 50 H HIS A 609 -99.943 -30.083 0.193 1.00 0.00 H ATOM 51 N PRO A 610 -96.809 -32.786 1.571 1.00 39.52 N ATOM 52 CA PRO A 610 -95.332 -32.756 1.596 1.00 40.88 C ATOM 53 C PRO A 610 -94.677 -32.925 0.234 1.00 41.17 C ATOM 54 O PRO A 610 -93.517 -32.520 0.068 1.00 41.83 O ATOM 55 CB PRO A 610 -94.969 -33.922 2.530 1.00 37.72 C ATOM 56 CG PRO A 610 -96.186 -34.146 3.359 1.00 43.36 C ATOM 57 CD PRO A 610 -97.361 -33.809 2.475 1.00 37.43 C ATOM 58 N SER A 611 -95.371 -33.519 -0.741 1.00 39.45 N ATOM 59 CA SER A 611 -94.799 -33.644 -2.078 1.00 40.52 C ATOM 60 C SER A 611 -94.629 -32.284 -2.744 1.00 41.62 C ATOM 61 O SER A 611 -93.780 -32.133 -3.627 1.00 42.57 O ATOM 62 CB SER A 611 -95.672 -34.560 -2.951 1.00 42.50 C ATOM 63 OG SER A 611 -97.010 -34.079 -3.047 1.00 41.41 O ATOM 64 HG SER A 611 -97.410 -34.037 -2.142 1.00 0.00 H ATOM 65 H SER A 611 -96.322 -33.893 -0.547 1.00 0.00 H ATOM 66 N CYS A 612 -95.417 -31.288 -2.342 1.00 37.98 N ATOM 67 CA CYS A 612 -95.300 -29.950 -2.909 1.00 41.68 C ATOM 68 C CYS A 612 -94.209 -29.111 -2.256 1.00 45.16 C ATOM 69 O CYS A 612 -94.004 -27.966 -2.679 1.00 43.62 O ATOM 70 CB CYS A 612 -96.635 -29.212 -2.791 1.00 46.28 C ATOM 71 SG CYS A 612 -98.066 -30.164 -3.346 1.00 51.24 S ATOM 72 H CYS A 612 -96.131 -31.469 -1.608 1.00 0.00 H ATOM 73 N VAL A 613 -93.511 -29.652 -1.255 1.00 41.09 N ATOM 74 CA VAL A 613 -92.525 -28.924 -0.465 1.00 41.78 C ATOM 75 C VAL A 613 -91.153 -29.543 -0.694 1.00 42.15 C ATOM 76 O VAL A 613 -91.017 -30.770 -0.753 1.00 42.89 O ATOM 77 CB VAL A 613 -92.887 -28.950 1.038 1.00 44.03 C ATOM 78 CG1 VAL A 613 -91.821 -28.233 1.878 1.00 43.23 C ATOM 79 CG2 VAL A 613 -94.251 -28.351 1.268 1.00 39.21 C ATOM 80 H VAL A 613 -93.680 -30.652 -1.025 1.00 0.00 H ATOM 81 N THR A 614 -90.133 -28.693 -0.812 1.00 45.51 N ATOM 82 CA THR A 614 -88.752 -29.150 -0.953 1.00 45.27 C ATOM 83 C THR A 614 -87.864 -28.283 -0.070 1.00 44.11 C ATOM 84 O THR A 614 -87.700 -27.092 -0.350 1.00 41.10 O ATOM 85 CB THR A 614 -88.283 -29.077 -2.407 1.00 42.09 C ATOM 86 OG1 THR A 614 -89.345 -29.483 -3.278 1.00 48.00 O ATOM 87 CG2 THR A 614 -87.083 -29.984 -2.615 1.00 45.11 C ATOM 88 HG1 THR A 614 -89.037 -29.434 -4.217 1.00 0.00 H ATOM 89 H THR A 614 -90.326 -27.671 -0.803 1.00 0.00 H ATOM 90 N ARG A 615 -87.293 -28.874 0.984 1.00 44.80 N ATOM 91 CA ARG A 615 -86.271 -28.204 1.780 1.00 39.83 C ATOM 92 C ARG A 615 -84.957 -28.209 1.015 1.00 47.45 C ATOM 93 O ARG A 615 -84.564 -29.236 0.453 1.00 48.01 O ATOM 94 CB ARG A 615 -86.084 -28.892 3.134 1.00 43.30 C ATOM 95 CG ARG A 615 -87.166 -28.591 4.177 1.00 47.77 C ATOM 96 CD ARG A 615 -87.049 -29.536 5.365 1.00 46.65 C ATOM 97 NE ARG A 615 -86.387 -30.773 4.962 1.00 55.50 N ATOM 98 CZ ARG A 615 -86.520 -31.944 5.575 1.00 57.66 C ATOM 99 NH1 ARG A 615 -87.307 -32.058 6.640 1.00 55.71 N ATOM 100 NH2 ARG A 615 -85.870 -33.007 5.110 1.00 59.49 N ATOM 101 HE ARG A 615 -85.763 -30.735 4.131 1.00 0.00 H ATOM 102 HH12 ARG A 615 -87.408 -32.977 7.116 1.00 0.00 H ATOM 103 HH11 ARG A 615 -87.822 -31.228 6.997 1.00 0.00 H ATOM 104 HH22 ARG A 615 -85.970 -33.927 5.585 1.00 0.00 H ATOM 105 HH21 ARG A 615 -85.262 -32.919 4.271 1.00 0.00 H ATOM 106 H ARG A 615 -87.585 -29.838 1.244 1.00 0.00 H ATOM 107 N GLN A 616 -84.272 -27.065 1.005 1.00 45.62 N ATOM 108 CA GLN A 616 -83.049 -26.886 0.235 1.00 45.73 C ATOM 109 C GLN A 616 -81.829 -26.530 1.072 1.00 47.86 C ATOM 110 O GLN A 616 -80.712 -26.902 0.693 1.00 49.01 O ATOM 111 CB GLN A 616 -83.251 -25.795 -0.825 1.00 44.45 C ATOM 112 CG GLN A 616 -84.243 -26.171 -1.898 1.00 48.61 C ATOM 113 CD GLN A 616 -84.592 -25.003 -2.800 1.00 52.18 C ATOM 114 OE1 GLN A 616 -84.738 -23.873 -2.336 1.00 53.60 O ATOM 115 NE2 GLN A 616 -84.723 -25.269 -4.100 1.00 49.13 N ATOM 116 HE22 GLN A 616 -84.590 -26.240 -4.448 1.00 0.00 H ATOM 117 HE21 GLN A 616 -84.958 -24.505 -4.766 1.00 0.00 H ATOM 118 H GLN A 616 -84.626 -26.267 1.571 1.00 0.00 H ATOM 119 N LYS A 617 -82.001 -25.820 2.187 1.00 44.09 N ATOM 120 CA LYS A 617 -80.870 -25.411 3.009 1.00 44.61 C ATOM 121 C LYS A 617 -81.377 -24.993 4.378 1.00 45.75 C ATOM 122 O LYS A 617 -82.377 -24.278 4.474 1.00 45.82 O ATOM 123 CB LYS A 617 -80.100 -24.250 2.368 1.00 46.20 C ATOM 124 CG LYS A 617 -78.967 -23.729 3.239 1.00 55.79 C ATOM 125 CD LYS A 617 -78.682 -22.252 3.000 1.00 54.34 C ATOM 126 CE LYS A 617 -77.557 -21.760 3.911 1.00 58.84 C ATOM 127 NZ LYS A 617 -76.358 -22.664 3.867 1.00 58.66 N ATOM 128 HZ1 LYS A 617 -76.633 -23.618 4.177 1.00 0.00 H ATOM 129 HZ2 LYS A 617 -75.993 -22.706 2.894 1.00 0.00 H ATOM 130 HZ3 LYS A 617 -75.621 -22.292 4.499 1.00 0.00 H ATOM 131 H LYS A 617 -82.963 -25.552 2.476 1.00 0.00 H ATOM 132 N VAL A 618 -80.677 -25.436 5.426 1.00 45.57 N ATOM 133 CA VAL A 618 -80.930 -24.945 6.777 1.00 41.91 C ATOM 134 C VAL A 618 -80.519 -23.484 6.861 1.00 46.36 C ATOM 135 O VAL A 618 -79.405 -23.115 6.470 1.00 50.78 O ATOM 136 CB VAL A 618 -80.160 -25.781 7.810 1.00 44.99 C ATOM 137 CG1 VAL A 618 -80.224 -25.123 9.176 1.00 47.32 C ATOM 138 CG2 VAL A 618 -80.698 -27.192 7.878 1.00 49.85 C ATOM 139 H VAL A 618 -79.934 -26.148 5.276 1.00 0.00 H ATOM 140 N ILE A 619 -81.409 -22.638 7.378 1.00 42.63 N ATOM 141 CA ILE A 619 -81.095 -21.226 7.544 1.00 42.73 C ATOM 142 C ILE A 619 -81.259 -20.747 8.975 1.00 43.63 C ATOM 143 O ILE A 619 -81.136 -19.544 9.223 1.00 41.93 O ATOM 144 CB ILE A 619 -81.924 -20.342 6.587 1.00 39.03 C ATOM 145 CG1 ILE A 619 -83.423 -20.450 6.889 1.00 38.12 C ATOM 146 CG2 ILE A 619 -81.622 -20.702 5.131 1.00 45.07 C ATOM 147 CD1 ILE A 619 -84.306 -19.530 6.017 1.00 36.47 C ATOM 148 H ILE A 619 -82.343 -22.992 7.668 1.00 0.00 H ATOM 149 N GLY A 620 -81.536 -21.632 9.926 1.00 43.50 N ATOM 150 CA GLY A 620 -81.807 -21.176 11.279 1.00 47.12 C ATOM 151 C GLY A 620 -82.088 -22.328 12.222 1.00 51.76 C ATOM 152 O GLY A 620 -82.412 -23.444 11.801 1.00 51.37 O ATOM 153 H GLY A 620 -81.559 -22.648 9.703 1.00 0.00 H ATOM 154 N ALA A 621 -81.974 -22.021 13.519 1.00 57.08 N ATOM 155 CA ALA A 621 -82.176 -22.982 14.601 1.00 59.36 C ATOM 156 C ALA A 621 -83.597 -22.949 15.149 1.00 59.52 C ATOM 157 O ALA A 621 -84.170 -24.006 15.434 1.00 67.11 O ATOM 158 CB ALA A 621 -81.180 -22.722 15.733 1.00 58.92 C ATOM 159 H ALA A 621 -81.728 -21.043 13.772 1.00 0.00 H ATOM 160 N GLY A 622 -84.161 -21.757 15.340 1.00 57.53 N ATOM 161 CA GLY A 622 -85.589 -21.605 15.561 1.00 60.70 C ATOM 162 C GLY A 622 -86.158 -22.089 16.880 1.00 62.26 C ATOM 163 O GLY A 622 -85.537 -22.875 17.602 1.00 62.02 O ATOM 164 H GLY A 622 -83.560 -20.908 15.331 1.00 0.00 H ATOM 165 N GLU A 623 -87.374 -21.628 17.182 1.00 63.84 N ATOM 166 CA GLU A 623 -88.017 -21.958 18.449 1.00 66.78 C ATOM 167 C GLU A 623 -88.385 -23.438 18.533 1.00 67.51 C ATOM 168 O GLU A 623 -88.464 -23.993 19.637 1.00 66.85 O ATOM 169 CB GLU A 623 -89.263 -21.079 18.633 1.00 65.10 C ATOM 170 CG GLU A 623 -90.087 -21.339 19.896 1.00 64.83 C ATOM 171 CD GLU A 623 -91.242 -20.353 20.053 1.00 69.75 C ATOM 172 OE1 GLU A 623 -91.144 -19.227 19.515 1.00 71.48 O ATOM 173 OE2 GLU A 623 -92.252 -20.707 20.702 1.00 66.63 O ATOM 174 H GLU A 623 -87.873 -21.021 16.500 1.00 0.00 H ATOM 175 N PHE A 624 -88.587 -24.098 17.388 1.00 66.26 N ATOM 176 CA PHE A 624 -89.205 -25.421 17.350 1.00 61.10 C ATOM 177 C PHE A 624 -88.335 -26.484 16.688 1.00 58.12 C ATOM 178 O PHE A 624 -88.811 -27.603 16.454 1.00 56.71 O ATOM 179 CB PHE A 624 -90.553 -25.344 16.627 1.00 52.42 C ATOM 180 CG PHE A 624 -91.613 -24.612 17.399 1.00 58.62 C ATOM 181 CD1 PHE A 624 -92.113 -25.137 18.583 1.00 57.00 C ATOM 182 CD2 PHE A 624 -92.109 -23.397 16.945 1.00 59.43 C ATOM 183 CE1 PHE A 624 -93.092 -24.465 19.302 1.00 57.18 C ATOM 184 CE2 PHE A 624 -93.090 -22.719 17.656 1.00 57.26 C ATOM 185 CZ PHE A 624 -93.581 -23.254 18.837 1.00 58.53 C ATOM 186 H PHE A 624 -88.294 -23.654 16.494 1.00 0.00 H ATOM 187 N GLY A 625 -87.082 -26.185 16.404 1.00 58.87 N ATOM 188 CA GLY A 625 -86.286 -27.005 15.518 1.00 52.99 C ATOM 189 C GLY A 625 -85.934 -26.223 14.269 1.00 55.35 C ATOM 190 O GLY A 625 -86.242 -25.036 14.137 1.00 58.22 O ATOM 191 H GLY A 625 -86.655 -25.337 16.829 1.00 0.00 H ATOM 192 N GLU A 626 -85.308 -26.920 13.330 1.00 50.96 N ATOM 193 CA GLU A 626 -84.627 -26.230 12.247 1.00 51.62 C ATOM 194 C GLU A 626 -85.588 -25.388 11.409 1.00 46.52 C ATOM 195 O GLU A 626 -86.805 -25.604 11.380 1.00 45.57 O ATOM 196 CB GLU A 626 -83.888 -27.236 11.369 1.00 52.54 C ATOM 197 CG GLU A 626 -83.209 -28.357 12.161 1.00 58.63 C ATOM 198 CD GLU A 626 -82.017 -27.890 13.017 1.00 64.63 C ATOM 199 OE1 GLU A 626 -81.951 -26.699 13.369 1.00 68.46 O ATOM 200 OE2 GLU A 626 -81.150 -28.735 13.313 1.00 68.84 O ATOM 201 H GLU A 626 -85.304 -27.959 13.369 1.00 0.00 H ATOM 202 N VAL A 627 -85.013 -24.395 10.734 1.00 47.33 N ATOM 203 CA VAL A 627 -85.716 -23.564 9.767 1.00 43.35 C ATOM 204 C VAL A 627 -84.947 -23.639 8.460 1.00 40.80 C ATOM 205 O VAL A 627 -83.718 -23.516 8.455 1.00 39.96 O ATOM 206 CB VAL A 627 -85.837 -22.104 10.241 1.00 41.37 C ATOM 207 CG1 VAL A 627 -86.509 -21.247 9.170 1.00 39.46 C ATOM 208 CG2 VAL A 627 -86.597 -22.042 11.553 1.00 41.91 C ATOM 209 H VAL A 627 -84.006 -24.202 10.907 1.00 0.00 H ATOM 210 N TYR A 628 -85.664 -23.847 7.358 1.00 41.34 N ATOM 211 CA TYR A 628 -85.062 -24.012 6.045 1.00 37.28 C ATOM 212 C TYR A 628 -85.594 -22.960 5.089 1.00 40.03 C ATOM 213 O TYR A 628 -86.710 -22.455 5.250 1.00 38.43 O ATOM 214 CB TYR A 628 -85.367 -25.392 5.445 1.00 37.69 C ATOM 215 CG TYR A 628 -85.102 -26.566 6.360 1.00 43.21 C ATOM 216 CD1 TYR A 628 -83.998 -27.391 6.165 1.00 42.48 C ATOM 217 CD2 TYR A 628 -85.968 -26.859 7.411 1.00 42.91 C ATOM 218 CE1 TYR A 628 -83.764 -28.472 6.992 1.00 43.38 C ATOM 219 CE2 TYR A 628 -85.738 -27.924 8.247 1.00 46.21 C ATOM 220 CZ TYR A 628 -84.632 -28.728 8.037 1.00 48.38 C ATOM 221 OH TYR A 628 -84.407 -29.795 8.877 1.00 55.73 O ATOM 222 HH TYR A 628 -83.583 -30.267 8.596 1.00 0.00 H ATOM 223 H TYR A 628 -86.700 -23.893 7.440 1.00 0.00 H ATOM 224 N LYS A 629 -84.795 -22.649 4.079 1.00 37.71 N ATOM 225 CA LYS A 629 -85.351 -22.119 2.850 1.00 37.03 C ATOM 226 C LYS A 629 -85.669 -23.291 1.935 1.00 38.81 C ATOM 227 O LYS A 629 -85.014 -24.336 1.987 1.00 39.22 O ATOM 228 CB LYS A 629 -84.393 -21.155 2.147 1.00 42.72 C ATOM 229 CG LYS A 629 -84.996 -20.569 0.869 1.00 40.76 C ATOM 230 CD LYS A 629 -83.978 -19.845 0.029 1.00 42.45 C ATOM 231 CE LYS A 629 -84.544 -19.584 -1.345 1.00 45.75 C ATOM 232 NZ LYS A 629 -85.135 -20.825 -1.931 1.00 52.13 N ATOM 233 HZ1 LYS A 629 -84.398 -21.555 -2.008 1.00 0.00 H ATOM 234 HZ2 LYS A 629 -85.901 -21.167 -1.316 1.00 0.00 H ATOM 235 HZ3 LYS A 629 -85.516 -20.614 -2.875 1.00 0.00 H ATOM 236 H LYS A 629 -83.768 -22.785 4.168 1.00 0.00 H ATOM 237 N GLY A 630 -86.689 -23.120 1.110 1.00 39.15 N ATOM 238 CA GLY A 630 -87.053 -24.166 0.189 1.00 41.43 C ATOM 239 C GLY A 630 -87.978 -23.652 -0.888 1.00 43.51 C ATOM 240 O GLY A 630 -88.133 -22.443 -1.084 1.00 39.89 O ATOM 241 H GLY A 630 -87.228 -22.231 1.126 1.00 0.00 H ATOM 242 N MET A 631 -88.593 -24.599 -1.590 1.00 44.82 N ATOM 243 CA MET A 631 -89.452 -24.299 -2.719 1.00 44.29 C ATOM 244 C MET A 631 -90.814 -24.947 -2.524 1.00 45.16 C ATOM 245 O MET A 631 -90.941 -26.025 -1.931 1.00 42.11 O ATOM 246 CB MET A 631 -88.828 -24.770 -4.038 1.00 49.39 C ATOM 247 CG MET A 631 -87.535 -24.066 -4.360 1.00 47.21 C ATOM 248 SD MET A 631 -87.778 -22.318 -4.704 1.00 55.33 S ATOM 249 CE MET A 631 -87.894 -22.302 -6.488 1.00 55.90 C ATOM 250 H MET A 631 -88.453 -25.593 -1.319 1.00 0.00 H ATOM 251 N LEU A 632 -91.827 -24.260 -3.034 1.00 42.39 N ATOM 252 CA LEU A 632 -93.211 -24.673 -2.897 1.00 47.56 C ATOM 253 C LEU A 632 -93.894 -24.533 -4.244 1.00 48.24 C ATOM 254 O LEU A 632 -93.798 -23.472 -4.866 1.00 49.34 O ATOM 255 CB LEU A 632 -93.926 -23.815 -1.857 1.00 37.95 C ATOM 256 CG LEU A 632 -95.436 -24.008 -1.810 1.00 44.28 C ATOM 257 CD1 LEU A 632 -95.783 -25.349 -1.153 1.00 39.74 C ATOM 258 CD2 LEU A 632 -96.080 -22.842 -1.077 1.00 41.12 C ATOM 259 H LEU A 632 -91.620 -23.385 -3.556 1.00 0.00 H ATOM 260 N LYS A 633 -94.551 -25.606 -4.690 1.00 47.98 N ATOM 261 CA LYS A 633 -95.477 -25.615 -5.844 1.00 53.36 C ATOM 262 C LYS A 633 -95.457 -24.374 -6.754 1.00 56.72 C ATOM 263 O LYS A 633 -95.181 -24.456 -7.954 1.00 58.54 O ATOM 264 CB LYS A 633 -96.909 -25.822 -5.335 1.00 43.20 C ATOM 265 CG LYS A 633 -97.956 -25.068 -6.123 1.00 49.56 C ATOM 266 CD LYS A 633 -98.352 -25.812 -7.401 1.00 57.07 C ATOM 267 CE LYS A 633 -99.276 -24.955 -8.255 1.00 55.02 C ATOM 268 NZ LYS A 633 -100.414 -24.440 -7.438 1.00 59.09 N ATOM 269 HZ1 LYS A 633 -100.954 -25.242 -7.054 1.00 0.00 H ATOM 270 HZ2 LYS A 633 -100.044 -23.863 -6.656 1.00 0.00 H ATOM 271 HZ3 LYS A 633 -101.034 -23.858 -8.037 1.00 0.00 H ATOM 272 H LYS A 633 -94.401 -26.504 -4.188 1.00 0.00 H TER 273 LYS A 633 ATOM 274 N GLU A 640 -92.700 -22.669 -9.098 1.00 60.39 N ATOM 275 CA GLU A 640 -92.224 -22.788 -7.724 1.00 59.32 C ATOM 276 C GLU A 640 -92.063 -21.413 -7.083 1.00 59.42 C ATOM 277 O GLU A 640 -91.579 -20.477 -7.722 1.00 60.55 O ATOM 278 CB GLU A 640 -90.887 -23.536 -7.670 1.00 57.57 C ATOM 279 CG GLU A 640 -90.787 -24.755 -8.573 1.00 60.91 C ATOM 280 CD GLU A 640 -91.078 -26.050 -7.841 1.00 67.76 C ATOM 281 OE1 GLU A 640 -91.458 -27.039 -8.511 1.00 73.61 O ATOM 282 OE2 GLU A 640 -90.931 -26.078 -6.596 1.00 64.32 O ATOM 283 HN3 GLU A 640 -92.015 -22.118 -9.654 1.00 0.00 H ATOM 284 HN2 GLU A 640 -93.621 -22.187 -9.104 1.00 0.00 H ATOM 285 HN1 GLU A 640 -92.801 -23.618 -9.512 1.00 0.00 H ATOM 286 N VAL A 641 -92.464 -21.290 -5.828 1.00 51.12 N ATOM 287 CA VAL A 641 -92.248 -20.082 -5.034 1.00 50.17 C ATOM 288 C VAL A 641 -91.279 -20.422 -3.911 1.00 48.50 C ATOM 289 O VAL A 641 -91.424 -21.483 -3.283 1.00 43.82 O ATOM 290 CB VAL A 641 -93.568 -19.507 -4.476 1.00 49.32 C ATOM 291 CG1 VAL A 641 -94.509 -19.153 -5.620 1.00 50.77 C ATOM 292 CG2 VAL A 641 -94.252 -20.483 -3.534 1.00 47.93 C ATOM 293 H VAL A 641 -92.957 -22.092 -5.385 1.00 0.00 H ATOM 294 N PRO A 642 -90.264 -19.609 -3.654 1.00 47.44 N ATOM 295 CA PRO A 642 -89.369 -19.905 -2.534 1.00 46.20 C ATOM 296 C PRO A 642 -90.087 -19.639 -1.225 1.00 37.92 C ATOM 297 O PRO A 642 -90.949 -18.761 -1.128 1.00 40.79 O ATOM 298 CB PRO A 642 -88.192 -18.948 -2.749 1.00 44.56 C ATOM 299 CG PRO A 642 -88.785 -17.792 -3.477 1.00 42.24 C ATOM 300 CD PRO A 642 -89.906 -18.349 -4.333 1.00 46.64 C ATOM 301 N VAL A 643 -89.765 -20.442 -0.220 1.00 38.78 N ATOM 302 CA VAL A 643 -90.431 -20.340 1.072 1.00 35.43 C ATOM 303 C VAL A 643 -89.413 -20.541 2.180 1.00 34.16 C ATOM 304 O VAL A 643 -88.301 -21.019 1.960 1.00 34.65 O ATOM 305 CB VAL A 643 -91.580 -21.364 1.241 1.00 36.80 C ATOM 306 CG1 VAL A 643 -92.798 -20.979 0.389 1.00 35.63 C ATOM 307 CG2 VAL A 643 -91.078 -22.768 0.921 1.00 37.41 C ATOM 308 H VAL A 643 -89.023 -21.158 -0.357 1.00 0.00 H ATOM 309 N ALA A 644 -89.814 -20.149 3.383 1.00 33.95 N ATOM 310 CA ALA A 644 -89.166 -20.584 4.607 1.00 35.26 C ATOM 311 C ALA A 644 -90.019 -21.684 5.229 1.00 37.72 C ATOM 312 O ALA A 644 -91.251 -21.654 5.142 1.00 33.79 O ATOM 313 CB ALA A 644 -88.983 -19.423 5.586 1.00 32.98 C ATOM 314 H ALA A 644 -90.626 -19.503 3.452 1.00 0.00 H ATOM 315 N ILE A 645 -89.361 -22.669 5.830 1.00 33.31 N ATOM 316 CA ILE A 645 -90.031 -23.854 6.344 1.00 32.93 C ATOM 317 C ILE A 645 -89.571 -24.059 7.779 1.00 37.87 C ATOM 318 O ILE A 645 -88.393 -24.354 8.019 1.00 34.73 O ATOM 319 CB ILE A 645 -89.738 -25.094 5.489 1.00 37.50 C ATOM 320 CG1 ILE A 645 -90.160 -24.841 4.034 1.00 36.79 C ATOM 321 CG2 ILE A 645 -90.456 -26.308 6.059 1.00 36.19 C ATOM 322 CD1 ILE A 645 -89.249 -25.469 2.999 1.00 39.38 C ATOM 323 H ILE A 645 -88.330 -22.590 5.937 1.00 0.00 H ATOM 324 N LYS A 646 -90.489 -23.891 8.729 1.00 35.16 N ATOM 325 CA LYS A 646 -90.222 -24.124 10.144 1.00 37.13 C ATOM 326 C LYS A 646 -90.789 -25.479 10.545 1.00 36.08 C ATOM 327 O LYS A 646 -91.961 -25.771 10.276 1.00 32.63 O ATOM 328 CB LYS A 646 -90.833 -23.022 11.016 1.00 35.84 C ATOM 329 CG LYS A 646 -90.600 -21.600 10.500 1.00 39.80 C ATOM 330 CD LYS A 646 -91.183 -20.566 11.466 1.00 46.28 C ATOM 331 CE LYS A 646 -92.022 -19.523 10.735 1.00 46.07 C ATOM 332 NZ LYS A 646 -92.685 -18.553 11.668 1.00 48.44 N ATOM 333 HZ1 LYS A 646 -93.313 -19.071 12.315 1.00 0.00 H ATOM 334 HZ2 LYS A 646 -91.959 -18.050 12.217 1.00 0.00 H ATOM 335 HZ3 LYS A 646 -93.241 -17.868 11.117 1.00 0.00 H ATOM 336 H LYS A 646 -91.441 -23.579 8.449 1.00 0.00 H ATOM 337 N THR A 647 -89.957 -26.299 11.183 1.00 33.91 N ATOM 338 CA THR A 647 -90.324 -27.658 11.547 1.00 34.53 C ATOM 339 C THR A 647 -90.405 -27.825 13.060 1.00 42.79 C ATOM 340 O THR A 647 -89.764 -27.107 13.839 1.00 36.39 O ATOM 341 CB THR A 647 -89.326 -28.686 10.999 1.00 39.94 C ATOM 342 OG1 THR A 647 -88.077 -28.544 11.685 1.00 39.07 O ATOM 343 CG2 THR A 647 -89.117 -28.508 9.503 1.00 35.24 C ATOM 344 HG1 THR A 647 -87.725 -27.630 11.541 1.00 0.00 H ATOM 345 H THR A 647 -89.008 -25.954 11.431 1.00 0.00 H ATOM 346 N LEU A 648 -91.207 -28.809 13.455 1.00 39.92 N ATOM 347 CA LEU A 648 -91.394 -29.210 14.843 1.00 44.21 C ATOM 348 C LEU A 648 -90.914 -30.650 14.953 1.00 41.33 C ATOM 349 O LEU A 648 -91.619 -31.574 14.529 1.00 44.75 O ATOM 350 CB LEU A 648 -92.862 -29.077 15.254 1.00 39.07 C ATOM 351 CG LEU A 648 -93.202 -29.479 16.687 1.00 44.26 C ATOM 352 CD1 LEU A 648 -92.483 -28.573 17.686 1.00 42.71 C ATOM 353 CD2 LEU A 648 -94.711 -29.456 16.900 1.00 44.48 C ATOM 354 H LEU A 648 -91.736 -29.327 12.725 1.00 0.00 H ATOM 355 N LYS A 649 -89.719 -30.840 15.505 1.00 44.30 N ATOM 356 CA LYS A 649 -89.089 -32.153 15.475 1.00 48.84 C ATOM 357 C LYS A 649 -89.806 -33.135 16.405 1.00 43.17 C ATOM 358 O LYS A 649 -90.621 -32.755 17.256 1.00 37.42 O ATOM 359 CB LYS A 649 -87.603 -32.039 15.823 1.00 48.76 C ATOM 360 CG LYS A 649 -87.373 -31.496 17.237 1.00 59.13 C ATOM 361 CD LYS A 649 -85.866 -31.389 17.567 1.00 58.08 C ATOM 362 CE LYS A 649 -85.158 -30.313 16.738 1.00 62.71 C ATOM 363 NZ LYS A 649 -83.699 -30.183 17.033 1.00 59.32 N ATOM 364 HZ1 LYS A 649 -83.570 -29.935 18.035 1.00 0.00 H ATOM 365 HZ2 LYS A 649 -83.225 -31.087 16.834 1.00 0.00 H ATOM 366 HZ3 LYS A 649 -83.291 -29.437 16.434 1.00 0.00 H ATOM 367 H LYS A 649 -89.230 -30.044 15.962 1.00 0.00 H ATOM 368 N ALA A 650 -89.500 -34.419 16.214 1.00 39.99 N ATOM 369 CA ALA A 650 -90.263 -35.494 16.833 1.00 39.37 C ATOM 370 C ALA A 650 -90.078 -35.507 18.349 1.00 35.96 C ATOM 371 O ALA A 650 -89.083 -35.021 18.891 1.00 38.75 O ATOM 372 CB ALA A 650 -89.856 -36.844 16.248 1.00 40.55 C ATOM 373 H ALA A 650 -88.692 -34.660 15.605 1.00 0.00 H ATOM 374 N GLY A 651 -91.051 -36.088 19.034 1.00 34.14 N ATOM 375 CA GLY A 651 -91.057 -36.030 20.478 1.00 36.79 C ATOM 376 C GLY A 651 -91.495 -34.705 21.047 1.00 36.66 C ATOM 377 O GLY A 651 -91.344 -34.493 22.251 1.00 37.88 O ATOM 378 H GLY A 651 -91.813 -36.587 18.532 1.00 0.00 H ATOM 379 N TYR A 652 -92.032 -33.803 20.221 1.00 39.51 N ATOM 380 CA TYR A 652 -92.537 -32.531 20.723 1.00 38.65 C ATOM 381 C TYR A 652 -93.650 -32.749 21.745 1.00 39.18 C ATOM 382 O TYR A 652 -94.402 -33.727 21.689 1.00 35.54 O ATOM 383 CB TYR A 652 -93.057 -31.657 19.576 1.00 37.58 C ATOM 384 CG TYR A 652 -94.200 -32.278 18.802 1.00 38.93 C ATOM 385 CD1 TYR A 652 -95.515 -32.188 19.255 1.00 36.82 C ATOM 386 CD2 TYR A 652 -93.960 -32.954 17.612 1.00 37.94 C ATOM 387 CE1 TYR A 652 -96.550 -32.771 18.551 1.00 41.23 C ATOM 388 CE2 TYR A 652 -94.987 -33.532 16.900 1.00 39.84 C ATOM 389 CZ TYR A 652 -96.274 -33.438 17.366 1.00 37.12 C ATOM 390 OH TYR A 652 -97.280 -34.022 16.640 1.00 41.84 O ATOM 391 HH TYR A 652 -98.145 -33.872 17.097 1.00 0.00 H ATOM 392 H TYR A 652 -92.091 -34.011 19.204 1.00 0.00 H ATOM 393 N THR A 653 -93.764 -31.799 22.667 1.00 39.78 N ATOM 394 CA THR A 653 -94.716 -31.864 23.765 1.00 42.62 C ATOM 395 C THR A 653 -96.068 -31.282 23.354 1.00 44.78 C ATOM 396 O THR A 653 -96.221 -30.663 22.293 1.00 39.80 O ATOM 397 CB THR A 653 -94.166 -31.118 24.986 1.00 45.34 C ATOM 398 OG1 THR A 653 -94.262 -29.703 24.773 1.00 48.66 O ATOM 399 CG2 THR A 653 -92.701 -31.468 25.193 1.00 37.09 C ATOM 400 HG1 THR A 653 -93.906 -29.226 25.564 1.00 0.00 H ATOM 401 H THR A 653 -93.142 -30.968 22.600 1.00 0.00 H ATOM 402 N GLU A 654 -97.062 -31.492 24.222 1.00 44.66 N ATOM 403 CA GLU A 654 -98.391 -30.940 23.979 1.00 50.37 C ATOM 404 C GLU A 654 -98.340 -29.419 23.889 1.00 48.03 C ATOM 405 O GLU A 654 -98.907 -28.819 22.967 1.00 51.86 O ATOM 406 CB GLU A 654 -99.356 -31.389 25.080 1.00 49.69 C ATOM 407 CG GLU A 654 -100.814 -31.025 24.813 1.00 54.16 C ATOM 408 CD GLU A 654 -101.752 -31.397 25.965 1.00 60.44 C ATOM 409 OE1 GLU A 654 -102.710 -32.158 25.725 1.00 57.37 O ATOM 410 OE2 GLU A 654 -101.540 -30.923 27.106 1.00 60.12 O ATOM 411 H GLU A 654 -96.887 -32.054 25.079 1.00 0.00 H ATOM 412 N LYS A 655 -97.640 -28.797 24.806 1.00 49.10 N ATOM 413 CA LYS A 655 -97.441 -27.374 24.852 1.00 52.51 C ATOM 414 C LYS A 655 -96.781 -26.884 23.566 1.00 53.93 C ATOM 415 O LYS A 655 -97.202 -25.901 22.976 1.00 52.31 O ATOM 416 CB LYS A 655 -96.533 -27.081 26.032 1.00 53.48 C ATOM 417 CG LYS A 655 -96.476 -25.652 26.495 1.00 57.22 C ATOM 418 CD LYS A 655 -95.148 -25.371 27.181 1.00 61.66 C ATOM 419 CE LYS A 655 -94.999 -26.106 28.522 1.00 60.70 C ATOM 420 NZ LYS A 655 -96.173 -26.037 29.439 1.00 59.93 N ATOM 421 HZ1 LYS A 655 -96.370 -25.043 29.674 1.00 0.00 H ATOM 422 HZ2 LYS A 655 -97.002 -26.455 28.971 1.00 0.00 H ATOM 423 HZ3 LYS A 655 -95.963 -26.565 30.310 1.00 0.00 H ATOM 424 H LYS A 655 -97.198 -29.372 25.551 1.00 0.00 H ATOM 425 N GLN A 656 -95.738 -27.579 23.145 1.00 48.04 N ATOM 426 CA GLN A 656 -95.041 -27.230 21.911 1.00 46.56 C ATOM 427 C GLN A 656 -95.965 -27.321 20.706 1.00 47.54 C ATOM 428 O GLN A 656 -95.920 -26.466 19.816 1.00 47.62 O ATOM 429 CB GLN A 656 -93.834 -28.137 21.707 1.00 46.06 C ATOM 430 CG GLN A 656 -92.567 -27.644 22.342 1.00 45.04 C ATOM 431 CD GLN A 656 -91.458 -28.655 22.208 1.00 48.90 C ATOM 432 OE1 GLN A 656 -91.707 -29.860 22.175 1.00 46.51 O ATOM 433 NE2 GLN A 656 -90.223 -28.175 22.118 1.00 50.61 N ATOM 434 HE22 GLN A 656 -90.060 -27.148 22.151 1.00 0.00 H ATOM 435 HE21 GLN A 656 -89.418 -28.826 22.015 1.00 0.00 H ATOM 436 H GLN A 656 -95.407 -28.391 23.705 1.00 0.00 H ATOM 437 N ARG A 657 -96.796 -28.364 20.655 1.00 45.81 N ATOM 438 CA ARG A 657 -97.737 -28.514 19.553 1.00 47.23 C ATOM 439 C ARG A 657 -98.774 -27.398 19.557 1.00 49.17 C ATOM 440 O ARG A 657 -99.153 -26.882 18.498 1.00 45.05 O ATOM 441 CB ARG A 657 -98.416 -29.880 19.642 1.00 44.22 C ATOM 442 CG ARG A 657 -99.278 -30.222 18.444 1.00 45.98 C ATOM 443 CD ARG A 657 -100.745 -30.181 18.805 1.00 50.35 C ATOM 444 NE ARG A 657 -100.999 -30.852 20.079 1.00 56.62 N ATOM 445 CZ ARG A 657 -102.187 -31.309 20.466 1.00 58.14 C ATOM 446 NH1 ARG A 657 -102.316 -31.910 21.647 1.00 56.15 N ATOM 447 NH2 ARG A 657 -103.243 -31.180 19.669 1.00 63.55 N ATOM 448 HE ARG A 657 -100.196 -30.981 20.727 1.00 0.00 H ATOM 449 HH12 ARG A 657 -103.244 -32.267 21.950 1.00 0.00 H ATOM 450 HH11 ARG A 657 -101.488 -32.022 22.267 1.00 0.00 H ATOM 451 HH22 ARG A 657 -104.171 -31.538 19.973 1.00 0.00 H ATOM 452 HH21 ARG A 657 -103.141 -30.721 18.741 1.00 0.00 H ATOM 453 H ARG A 657 -96.772 -29.078 21.411 1.00 0.00 H ATOM 454 N VAL A 658 -99.253 -27.020 20.744 1.00 53.20 N ATOM 455 CA VAL A 658 -100.249 -25.958 20.845 1.00 48.88 C ATOM 456 C VAL A 658 -99.644 -24.616 20.450 1.00 47.58 C ATOM 457 O VAL A 658 -100.294 -23.802 19.785 1.00 50.46 O ATOM 458 CB VAL A 658 -100.843 -25.925 22.265 1.00 51.81 C ATOM 459 CG1 VAL A 658 -101.767 -24.726 22.425 1.00 49.36 C ATOM 460 CG2 VAL A 658 -101.592 -27.215 22.550 1.00 46.53 C ATOM 461 H VAL A 658 -98.912 -27.488 21.608 1.00 0.00 H ATOM 462 N ASP A 659 -98.391 -24.366 20.835 1.00 51.39 N ATOM 463 CA ASP A 659 -97.732 -23.129 20.430 1.00 51.90 C ATOM 464 C ASP A 659 -97.436 -23.124 18.933 1.00 53.87 C ATOM 465 O ASP A 659 -97.757 -22.160 18.230 1.00 55.21 O ATOM 466 CB ASP A 659 -96.455 -22.931 21.244 1.00 54.40 C ATOM 467 CG ASP A 659 -96.743 -22.557 22.691 1.00 58.96 C ATOM 468 OD1 ASP A 659 -97.891 -22.148 22.976 1.00 53.28 O ATOM 469 OD2 ASP A 659 -95.827 -22.659 23.536 1.00 55.97 O ATOM 470 H ASP A 659 -97.883 -25.055 21.425 1.00 0.00 H ATOM 471 N PHE A 660 -96.842 -24.208 18.428 1.00 52.78 N ATOM 472 CA PHE A 660 -96.470 -24.301 17.018 1.00 49.71 C ATOM 473 C PHE A 660 -97.679 -24.095 16.114 1.00 49.16 C ATOM 474 O PHE A 660 -97.698 -23.186 15.276 1.00 47.23 O ATOM 475 CB PHE A 660 -95.814 -25.661 16.766 1.00 47.62 C ATOM 476 CG PHE A 660 -95.278 -25.849 15.380 1.00 44.90 C ATOM 477 CD1 PHE A 660 -94.051 -25.312 15.015 1.00 44.87 C ATOM 478 CD2 PHE A 660 -95.974 -26.612 14.454 1.00 39.48 C ATOM 479 CE1 PHE A 660 -93.539 -25.511 13.734 1.00 42.95 C ATOM 480 CE2 PHE A 660 -95.465 -26.818 13.181 1.00 40.33 C ATOM 481 CZ PHE A 660 -94.251 -26.267 12.820 1.00 36.48 C ATOM 482 H PHE A 660 -96.638 -25.010 19.057 1.00 0.00 H ATOM 483 N LEU A 661 -98.709 -24.933 16.281 1.00 47.93 N ATOM 484 CA LEU A 661 -99.895 -24.830 15.438 1.00 46.07 C ATOM 485 C LEU A 661 -100.766 -23.652 15.839 1.00 47.59 C ATOM 486 O LEU A 661 -101.551 -23.157 15.022 1.00 46.93 O ATOM 487 CB LEU A 661 -100.712 -26.119 15.503 1.00 49.07 C ATOM 488 CG LEU A 661 -100.061 -27.407 15.006 1.00 43.15 C ATOM 489 CD1 LEU A 661 -101.079 -28.530 14.996 1.00 37.66 C ATOM 490 CD2 LEU A 661 -99.461 -27.203 13.627 1.00 42.66 C ATOM 491 H LEU A 661 -98.663 -25.665 17.019 1.00 0.00 H ATOM 492 N GLY A 662 -100.665 -23.208 17.089 1.00 49.14 N ATOM 493 CA GLY A 662 -101.363 -21.998 17.476 1.00 50.65 C ATOM 494 C GLY A 662 -100.803 -20.790 16.760 1.00 53.79 C ATOM 495 O GLY A 662 -101.547 -19.970 16.218 1.00 55.51 O ATOM 496 H GLY A 662 -100.089 -23.725 17.784 1.00 0.00 H ATOM 497 N GLU A 663 -99.475 -20.684 16.725 1.00 52.56 N ATOM 498 CA GLU A 663 -98.835 -19.624 15.960 1.00 52.41 C ATOM 499 C GLU A 663 -99.297 -19.639 14.510 1.00 52.74 C ATOM 500 O GLU A 663 -99.735 -18.614 13.974 1.00 52.96 O ATOM 501 CB GLU A 663 -97.321 -19.772 16.039 1.00 52.29 C ATOM 502 CG GLU A 663 -96.585 -18.633 15.398 1.00 55.80 C ATOM 503 CD GLU A 663 -95.153 -18.980 15.134 1.00 58.97 C ATOM 504 OE1 GLU A 663 -94.828 -19.294 13.969 1.00 59.12 O ATOM 505 OE2 GLU A 663 -94.359 -18.958 16.101 1.00 64.70 O ATOM 506 H GLU A 663 -98.890 -21.365 17.250 1.00 0.00 H ATOM 507 N ALA A 664 -99.226 -20.804 13.864 1.00 48.94 N ATOM 508 CA ALA A 664 -99.665 -20.907 12.475 1.00 46.51 C ATOM 509 C ALA A 664 -101.131 -20.534 12.326 1.00 49.93 C ATOM 510 O ALA A 664 -101.524 -19.914 11.330 1.00 48.02 O ATOM 511 CB ALA A 664 -99.430 -22.322 11.952 1.00 44.97 C ATOM 512 H ALA A 664 -98.856 -21.644 14.353 1.00 0.00 H ATOM 513 N GLY A 665 -101.954 -20.909 13.306 1.00 51.81 N ATOM 514 CA GLY A 665 -103.371 -20.598 13.235 1.00 52.65 C ATOM 515 C GLY A 665 -103.647 -19.108 13.194 1.00 52.37 C ATOM 516 O GLY A 665 -104.563 -18.658 12.501 1.00 56.40 O ATOM 517 H GLY A 665 -101.579 -21.427 14.126 1.00 0.00 H ATOM 518 N ILE A 666 -102.860 -18.316 13.923 1.00 53.12 N ATOM 519 CA ILE A 666 -103.126 -16.883 13.905 1.00 55.17 C ATOM 520 C ILE A 666 -102.563 -16.248 12.631 1.00 53.11 C ATOM 521 O ILE A 666 -103.215 -15.390 12.013 1.00 53.03 O ATOM 522 CB ILE A 666 -102.609 -16.206 15.195 1.00 51.44 C ATOM 523 CG1 ILE A 666 -101.105 -15.995 15.209 1.00 53.45 C ATOM 524 CG2 ILE A 666 -102.988 -16.997 16.446 1.00 52.96 C ATOM 525 CD1 ILE A 666 -100.708 -15.113 16.364 1.00 50.69 C ATOM 526 H ILE A 666 -102.080 -18.709 14.487 1.00 0.00 H ATOM 527 N MET A 667 -101.418 -16.703 12.189 1.00 48.95 N ATOM 528 CA MET A 667 -100.822 -16.158 11.014 1.00 48.62 C ATOM 529 C MET A 667 -101.654 -16.415 9.773 1.00 41.68 C ATOM 530 O MET A 667 -101.775 -15.553 8.971 1.00 41.67 O ATOM 531 CB MET A 667 -99.408 -16.696 10.841 1.00 48.12 C ATOM 532 CG MET A 667 -98.293 -15.964 11.571 1.00 55.19 C ATOM 533 SD MET A 667 -96.686 -16.719 11.188 1.00 67.22 S ATOM 534 CE MET A 667 -96.778 -16.744 9.409 1.00 49.43 C ATOM 535 H MET A 667 -100.938 -17.471 12.701 1.00 0.00 H ATOM 536 N GLY A 668 -102.229 -17.596 9.617 1.00 41.52 N ATOM 537 CA GLY A 668 -103.045 -17.875 8.448 1.00 46.86 C ATOM 538 C GLY A 668 -104.264 -16.987 8.375 1.00 46.00 C ATOM 539 O GLY A 668 -104.672 -16.556 7.290 1.00 49.97 O ATOM 540 H GLY A 668 -102.095 -18.333 10.339 1.00 0.00 H ATOM 541 N GLN A 669 -104.854 -16.683 9.530 1.00 43.89 N ATOM 542 CA GLN A 669 -106.028 -15.821 9.558 1.00 52.19 C ATOM 543 C GLN A 669 -105.670 -14.378 9.211 1.00 48.25 C ATOM 544 O GLN A 669 -106.423 -13.701 8.497 1.00 46.68 O ATOM 545 CB GLN A 669 -106.704 -15.901 10.928 1.00 53.87 C ATOM 546 CG GLN A 669 -107.287 -17.273 11.229 1.00 54.11 C ATOM 547 CD GLN A 669 -107.995 -17.322 12.572 1.00 64.58 C ATOM 548 OE1 GLN A 669 -107.970 -16.355 13.338 1.00 65.34 O ATOM 549 NE2 GLN A 669 -108.643 -18.448 12.858 1.00 64.38 N ATOM 550 HE22 GLN A 669 -108.637 -19.238 12.181 1.00 0.00 H ATOM 551 HE21 GLN A 669 -109.156 -18.539 13.758 1.00 0.00 H ATOM 552 H GLN A 669 -104.473 -17.064 10.419 1.00 0.00 H ATOM 553 N PHE A 670 -104.514 -13.904 9.684 1.00 43.65 N ATOM 554 CA PHE A 670 -104.082 -12.537 9.412 1.00 42.36 C ATOM 555 C PHE A 670 -103.871 -12.291 7.923 1.00 41.71 C ATOM 556 O PHE A 670 -103.391 -13.156 7.182 1.00 38.93 O ATOM 557 CB PHE A 670 -102.787 -12.227 10.150 1.00 38.91 C ATOM 558 CG PHE A 670 -102.944 -12.086 11.614 1.00 40.34 C ATOM 559 CD1 PHE A 670 -104.202 -12.055 12.197 1.00 41.50 C ATOM 560 CD2 PHE A 670 -101.829 -11.961 12.414 1.00 42.08 C ATOM 561 CE1 PHE A 670 -104.337 -11.920 13.557 1.00 41.57 C ATOM 562 CE2 PHE A 670 -101.959 -11.823 13.778 1.00 42.20 C ATOM 563 CZ PHE A 670 -103.214 -11.796 14.349 1.00 40.78 C ATOM 564 H PHE A 670 -103.908 -14.523 10.259 1.00 0.00 H ATOM 565 N SER A 671 -104.196 -11.076 7.494 1.00 40.87 N ATOM 566 CA SER A 671 -104.053 -10.719 6.086 1.00 40.50 C ATOM 567 C SER A 671 -103.668 -9.238 6.034 1.00 36.41 C ATOM 568 O SER A 671 -104.509 -8.348 5.855 1.00 34.29 O ATOM 569 CB SER A 671 -105.332 -11.007 5.301 1.00 38.44 C ATOM 570 OG SER A 671 -105.161 -10.719 3.928 1.00 45.97 O ATOM 571 HG SER A 671 -104.930 -9.763 3.819 1.00 0.00 H ATOM 572 H SER A 671 -104.556 -10.372 8.169 1.00 0.00 H ATOM 573 N HIS A 672 -102.370 -8.972 6.198 1.00 29.64 N ATOM 574 CA HIS A 672 -101.868 -7.607 6.150 1.00 25.02 C ATOM 575 C HIS A 672 -100.508 -7.564 5.466 1.00 24.67 C ATOM 576 O HIS A 672 -99.643 -8.405 5.725 1.00 28.62 O ATOM 577 CB HIS A 672 -101.763 -6.980 7.552 1.00 21.55 C ATOM 578 CG HIS A 672 -101.494 -5.506 7.523 1.00 24.48 C ATOM 579 ND1 HIS A 672 -100.245 -4.984 7.251 1.00 19.43 N ATOM 580 CD2 HIS A 672 -102.316 -4.441 7.704 1.00 25.69 C ATOM 581 CE1 HIS A 672 -100.307 -3.666 7.271 1.00 21.08 C ATOM 582 NE2 HIS A 672 -101.552 -3.309 7.540 1.00 24.63 N ATOM 583 H HIS A 672 -101.705 -9.755 6.363 1.00 0.00 H ATOM 584 N HIS A 673 -100.324 -6.541 4.629 1.00 22.56 N ATOM 585 CA HIS A 673 -99.108 -6.375 3.840 1.00 25.27 C ATOM 586 C HIS A 673 -97.839 -6.435 4.694 1.00 22.39 C ATOM 587 O HIS A 673 -96.806 -6.925 4.229 1.00 24.86 O ATOM 588 CB HIS A 673 -99.209 -5.050 3.071 1.00 25.76 C ATOM 589 CG HIS A 673 -97.993 -4.693 2.265 1.00 30.05 C ATOM 590 ND1 HIS A 673 -97.525 -5.468 1.223 1.00 28.66 N ATOM 591 CD2 HIS A 673 -97.164 -3.622 2.335 1.00 29.90 C ATOM 592 CE1 HIS A 673 -96.456 -4.897 0.695 1.00 26.93 C ATOM 593 NE2 HIS A 673 -96.220 -3.773 1.348 1.00 30.40 N ATOM 594 H HIS A 673 -101.079 -5.832 4.535 1.00 0.00 H ATOM 595 N ASN A 674 -97.894 -5.966 5.943 1.00 24.28 N ATOM 596 CA ASN A 674 -96.711 -5.879 6.795 1.00 20.33 C ATOM 597 C ASN A 674 -96.672 -6.950 7.885 1.00 22.91 C ATOM 598 O ASN A 674 -95.988 -6.775 8.906 1.00 19.65 O ATOM 599 CB ASN A 674 -96.626 -4.477 7.381 1.00 17.10 C ATOM 600 CG ASN A 674 -96.457 -3.439 6.297 1.00 20.84 C ATOM 601 OD1 ASN A 674 -97.407 -2.749 5.912 1.00 20.94 O ATOM 602 ND2 ASN A 674 -95.251 -3.371 5.745 1.00 20.01 N ATOM 603 HD22 ASN A 674 -94.481 -3.972 6.103 1.00 0.00 H ATOM 604 HD21 ASN A 674 -95.077 -2.717 4.955 1.00 0.00 H ATOM 605 H ASN A 674 -98.810 -5.652 6.322 1.00 0.00 H ATOM 606 N ILE A 675 -97.389 -8.054 7.681 1.00 23.12 N ATOM 607 CA ILE A 675 -97.310 -9.254 8.504 1.00 26.34 C ATOM 608 C ILE A 675 -96.874 -10.388 7.585 1.00 25.15 C ATOM 609 O ILE A 675 -97.371 -10.496 6.461 1.00 25.55 O ATOM 610 CB ILE A 675 -98.669 -9.592 9.164 1.00 26.81 C ATOM 611 CG1 ILE A 675 -99.213 -8.413 9.977 1.00 26.17 C ATOM 612 CG2 ILE A 675 -98.568 -10.849 10.027 1.00 28.89 C ATOM 613 CD1 ILE A 675 -98.319 -8.022 11.136 1.00 24.55 C ATOM 614 H ILE A 675 -98.051 -8.060 6.879 1.00 0.00 H ATOM 615 N ILE A 676 -95.962 -11.237 8.066 1.00 24.85 N ATOM 616 CA ILE A 676 -95.446 -12.327 7.239 1.00 23.88 C ATOM 617 C ILE A 676 -96.600 -13.176 6.721 1.00 30.38 C ATOM 618 O ILE A 676 -97.511 -13.550 7.469 1.00 31.36 O ATOM 619 CB ILE A 676 -94.429 -13.166 8.041 1.00 33.11 C ATOM 620 CG1 ILE A 676 -93.816 -14.289 7.200 1.00 34.40 C ATOM 621 CG2 ILE A 676 -95.055 -13.759 9.288 1.00 35.73 C ATOM 622 CD1 ILE A 676 -92.644 -13.860 6.379 1.00 34.46 C ATOM 623 H ILE A 676 -95.615 -11.122 9.040 1.00 0.00 H ATOM 624 N ARG A 677 -96.575 -13.479 5.460 1.00 29.81 N ATOM 625 CA ARG A 677 -97.583 -14.303 4.883 1.00 33.86 C ATOM 626 C ARG A 677 -97.345 -15.801 5.204 1.00 33.40 C ATOM 627 O ARG A 677 -96.266 -16.300 5.077 1.00 33.01 O ATOM 628 CB ARG A 677 -97.624 -14.036 3.365 1.00 38.56 C ATOM 629 CG ARG A 677 -98.392 -15.010 2.470 1.00 43.95 C ATOM 630 CD ARG A 677 -98.349 -14.636 0.983 1.00 51.72 C ATOM 631 NE ARG A 677 -96.975 -14.511 0.496 1.00 55.28 N ATOM 632 CZ ARG A 677 -96.578 -14.082 -0.709 1.00 51.42 C ATOM 633 NH1 ARG A 677 -97.454 -13.721 -1.643 1.00 56.34 N ATOM 634 NH2 ARG A 677 -95.278 -14.025 -0.994 1.00 59.30 N ATOM 635 HE ARG A 677 -96.223 -14.786 1.159 1.00 0.00 H ATOM 636 HH12 ARG A 677 -97.119 -13.391 -2.571 1.00 0.00 H ATOM 637 HH11 ARG A 677 -98.474 -13.768 -1.445 1.00 0.00 H ATOM 638 HH22 ARG A 677 -94.965 -13.693 -1.928 1.00 0.00 H ATOM 639 HH21 ARG A 677 -94.576 -14.313 -0.282 1.00 0.00 H ATOM 640 H ARG A 677 -95.807 -13.115 4.861 1.00 0.00 H ATOM 641 N LEU A 678 -98.380 -16.482 5.639 1.00 34.28 N ATOM 642 CA LEU A 678 -98.337 -17.923 5.825 1.00 37.20 C ATOM 643 C LEU A 678 -98.869 -18.590 4.562 1.00 36.95 C ATOM 644 O LEU A 678 -99.977 -18.283 4.119 1.00 39.37 O ATOM 645 CB LEU A 678 -99.151 -18.341 7.048 1.00 35.04 C ATOM 646 CG LEU A 678 -99.255 -19.848 7.169 1.00 40.30 C ATOM 647 CD1 LEU A 678 -98.041 -20.403 7.906 1.00 39.12 C ATOM 648 CD2 LEU A 678 -100.541 -20.243 7.858 1.00 41.65 C ATOM 649 H LEU A 678 -99.260 -15.973 5.858 1.00 0.00 H ATOM 650 N GLU A 679 -98.070 -19.475 3.965 1.00 36.65 N ATOM 651 CA GLU A 679 -98.542 -20.212 2.798 1.00 36.35 C ATOM 652 C GLU A 679 -99.387 -21.418 3.196 1.00 40.34 C ATOM 653 O GLU A 679 -100.266 -21.824 2.432 1.00 37.43 O ATOM 654 CB GLU A 679 -97.363 -20.663 1.931 1.00 37.44 C ATOM 655 CG GLU A 679 -96.333 -19.575 1.611 1.00 43.90 C ATOM 656 CD GLU A 679 -96.795 -18.585 0.548 1.00 45.59 C ATOM 657 OE1 GLU A 679 -97.854 -18.810 -0.068 1.00 50.74 O ATOM 658 OE2 GLU A 679 -96.084 -17.583 0.321 1.00 49.97 O ATOM 659 H GLU A 679 -97.111 -19.640 4.331 1.00 0.00 H ATOM 660 N GLY A 680 -99.160 -21.978 4.373 1.00 38.53 N ATOM 661 CA GLY A 680 -99.886 -23.152 4.818 1.00 37.79 C ATOM 662 C GLY A 680 -99.042 -23.955 5.789 1.00 37.41 C ATOM 663 O GLY A 680 -97.887 -23.634 6.061 1.00 33.11 O ATOM 664 H GLY A 680 -98.439 -21.564 4.998 1.00 0.00 H ATOM 665 N VAL A 681 -99.651 -25.021 6.313 1.00 38.73 N ATOM 666 CA VAL A 681 -99.007 -25.886 7.293 1.00 38.35 C ATOM 667 C VAL A 681 -99.020 -27.324 6.793 1.00 41.77 C ATOM 668 O VAL A 681 -99.860 -27.727 5.982 1.00 36.93 O ATOM 669 CB VAL A 681 -99.677 -25.806 8.681 1.00 38.94 C ATOM 670 CG1 VAL A 681 -99.607 -24.396 9.216 1.00 39.87 C ATOM 671 CG2 VAL A 681 -101.123 -26.283 8.600 1.00 41.00 C ATOM 672 H VAL A 681 -100.621 -25.242 6.011 1.00 0.00 H ATOM 673 N ILE A 682 -98.059 -28.099 7.288 1.00 37.83 N ATOM 674 CA ILE A 682 -98.100 -29.550 7.198 1.00 36.22 C ATOM 675 C ILE A 682 -98.303 -30.055 8.615 1.00 39.42 C ATOM 676 O ILE A 682 -97.404 -29.944 9.459 1.00 35.87 O ATOM 677 CB ILE A 682 -96.831 -30.139 6.573 1.00 35.38 C ATOM 678 CG1 ILE A 682 -96.604 -29.545 5.180 1.00 37.14 C ATOM 679 CG2 ILE A 682 -96.947 -31.649 6.527 1.00 33.31 C ATOM 680 CD1 ILE A 682 -95.662 -30.344 4.295 1.00 41.83 C ATOM 681 H ILE A 682 -97.247 -27.650 7.758 1.00 0.00 H ATOM 682 N SER A 683 -99.498 -30.566 8.892 1.00 41.11 N ATOM 683 CA SER A 683 -99.840 -31.111 10.198 1.00 42.52 C ATOM 684 C SER A 683 -100.160 -32.593 10.162 1.00 44.46 C ATOM 685 O SER A 683 -99.985 -33.274 11.176 1.00 44.36 O ATOM 686 CB SER A 683 -101.044 -30.361 10.793 1.00 42.68 C ATOM 687 OG SER A 683 -102.154 -30.384 9.908 1.00 43.05 O ATOM 688 HG SER A 683 -101.903 -29.951 9.054 1.00 0.00 H ATOM 689 H SER A 683 -100.220 -30.577 8.144 1.00 0.00 H ATOM 690 N LYS A 684 -100.630 -33.102 9.023 1.00 43.49 N ATOM 691 CA LYS A 684 -100.971 -34.515 8.921 1.00 46.83 C ATOM 692 C LYS A 684 -99.730 -35.392 8.958 1.00 43.41 C ATOM 693 O LYS A 684 -99.780 -36.518 9.462 1.00 48.01 O ATOM 694 CB LYS A 684 -101.772 -34.753 7.642 1.00 44.96 C ATOM 695 CG LYS A 684 -103.172 -34.107 7.616 1.00 49.70 C ATOM 696 CD LYS A 684 -103.922 -34.362 6.290 1.00 55.13 C ATOM 697 CE LYS A 684 -105.327 -33.746 6.257 1.00 55.78 C ATOM 698 NZ LYS A 684 -106.047 -33.974 4.958 1.00 55.73 N ATOM 699 HZ1 LYS A 684 -105.501 -33.550 4.181 1.00 0.00 H ATOM 700 HZ2 LYS A 684 -106.149 -34.996 4.794 1.00 0.00 H ATOM 701 HZ3 LYS A 684 -106.988 -33.533 5.003 1.00 0.00 H ATOM 702 H LYS A 684 -100.755 -32.483 8.197 1.00 0.00 H ATOM 703 N TYR A 685 -98.608 -34.891 8.460 1.00 40.96 N ATOM 704 CA TYR A 685 -97.369 -35.646 8.378 1.00 41.90 C ATOM 705 C TYR A 685 -96.334 -35.071 9.339 1.00 42.17 C ATOM 706 O TYR A 685 -96.428 -33.920 9.777 1.00 37.32 O ATOM 707 CB TYR A 685 -96.823 -35.639 6.946 1.00 36.12 C ATOM 708 CG TYR A 685 -97.807 -36.158 5.921 1.00 42.87 C ATOM 709 CD1 TYR A 685 -97.713 -37.456 5.439 1.00 44.49 C ATOM 710 CD2 TYR A 685 -98.827 -35.344 5.422 1.00 42.49 C ATOM 711 CE1 TYR A 685 -98.607 -37.936 4.492 1.00 43.85 C ATOM 712 CE2 TYR A 685 -99.728 -35.817 4.474 1.00 44.11 C ATOM 713 CZ TYR A 685 -99.615 -37.117 4.017 1.00 44.66 C ATOM 714 OH TYR A 685 -100.500 -37.606 3.077 1.00 46.41 O ATOM 715 HH TYR A 685 -100.440 -37.060 2.254 1.00 0.00 H ATOM 716 H TYR A 685 -98.615 -33.911 8.111 1.00 0.00 H ATOM 717 N LYS A 686 -95.339 -35.895 9.661 1.00 38.55 N ATOM 718 CA LYS A 686 -94.324 -35.543 10.639 1.00 36.94 C ATOM 719 C LYS A 686 -92.944 -35.630 9.999 1.00 40.10 C ATOM 720 O LYS A 686 -92.679 -36.544 9.218 1.00 38.23 O ATOM 721 CB LYS A 686 -94.403 -36.456 11.872 1.00 41.00 C ATOM 722 CG LYS A 686 -95.810 -36.612 12.457 1.00 44.13 C ATOM 723 CD LYS A 686 -96.448 -35.261 12.798 1.00 44.24 C ATOM 724 CE LYS A 686 -97.865 -35.423 13.365 1.00 44.47 C ATOM 725 NZ LYS A 686 -98.814 -36.064 12.399 1.00 45.47 N ATOM 726 HZ1 LYS A 686 -98.882 -35.479 11.542 1.00 0.00 H ATOM 727 HZ2 LYS A 686 -98.464 -37.011 12.148 1.00 0.00 H ATOM 728 HZ3 LYS A 686 -99.753 -36.146 12.839 1.00 0.00 H ATOM 729 H LYS A 686 -95.287 -36.824 9.196 1.00 0.00 H ATOM 730 N PRO A 687 -92.059 -34.669 10.317 1.00 37.11 N ATOM 731 CA PRO A 687 -92.288 -33.561 11.257 1.00 34.72 C ATOM 732 C PRO A 687 -93.256 -32.479 10.725 1.00 37.94 C ATOM 733 O PRO A 687 -93.298 -32.222 9.519 1.00 36.49 O ATOM 734 CB PRO A 687 -90.884 -32.985 11.446 1.00 34.98 C ATOM 735 CG PRO A 687 -90.213 -33.254 10.124 1.00 40.95 C ATOM 736 CD PRO A 687 -90.731 -34.591 9.681 1.00 32.45 C ATOM 737 N MET A 688 -94.029 -31.868 11.622 1.00 36.40 N ATOM 738 CA MET A 688 -94.942 -30.803 11.229 1.00 38.77 C ATOM 739 C MET A 688 -94.163 -29.589 10.733 1.00 35.65 C ATOM 740 O MET A 688 -93.025 -29.341 11.145 1.00 32.25 O ATOM 741 CB MET A 688 -95.837 -30.416 12.406 1.00 40.06 C ATOM 742 CG MET A 688 -96.461 -31.626 13.097 1.00 43.08 C ATOM 743 SD MET A 688 -98.135 -31.314 13.650 1.00 44.94 S ATOM 744 CE MET A 688 -97.795 -30.540 15.221 1.00 41.06 C ATOM 745 H MET A 688 -93.980 -32.156 12.620 1.00 0.00 H ATOM 746 N MET A 689 -94.790 -28.826 9.838 1.00 34.14 N ATOM 747 CA MET A 689 -94.101 -27.744 9.155 1.00 32.59 C ATOM 748 C MET A 689 -94.991 -26.515 9.047 1.00 32.87 C ATOM 749 O MET A 689 -96.183 -26.624 8.756 1.00 35.43 O ATOM 750 CB MET A 689 -93.643 -28.170 7.764 1.00 33.60 C ATOM 751 CG MET A 689 -92.632 -29.306 7.747 1.00 37.06 C ATOM 752 SD MET A 689 -91.979 -29.569 6.086 1.00 39.88 S ATOM 753 CE MET A 689 -90.817 -30.906 6.390 1.00 37.83 C ATOM 754 H MET A 689 -95.791 -29.008 9.624 1.00 0.00 H ATOM 755 N ILE A 690 -94.392 -25.349 9.271 1.00 33.31 N ATOM 756 CA ILE A 690 -95.011 -24.050 9.029 1.00 35.56 C ATOM 757 C ILE A 690 -94.311 -23.459 7.811 1.00 37.79 C ATOM 758 O ILE A 690 -93.084 -23.301 7.819 1.00 30.44 O ATOM 759 CB ILE A 690 -94.883 -23.127 10.257 1.00 35.19 C ATOM 760 CG1 ILE A 690 -95.799 -23.602 11.383 1.00 40.61 C ATOM 761 CG2 ILE A 690 -95.190 -21.672 9.901 1.00 34.27 C ATOM 762 CD1 ILE A 690 -95.605 -22.860 12.683 1.00 39.20 C ATOM 763 H ILE A 690 -93.421 -25.364 9.642 1.00 0.00 H ATOM 764 N ILE A 691 -95.073 -23.156 6.757 1.00 28.55 N ATOM 765 CA ILE A 691 -94.504 -22.709 5.482 1.00 31.87 C ATOM 766 C ILE A 691 -94.898 -21.255 5.251 1.00 34.39 C ATOM 767 O ILE A 691 -96.078 -20.952 5.053 1.00 34.49 O ATOM 768 CB ILE A 691 -94.959 -23.590 4.306 1.00 30.65 C ATOM 769 CG1 ILE A 691 -94.442 -25.019 4.480 1.00 33.46 C ATOM 770 CG2 ILE A 691 -94.442 -23.028 2.989 1.00 34.52 C ATOM 771 CD1 ILE A 691 -95.389 -26.072 3.971 1.00 35.87 C ATOM 772 H ILE A 691 -96.106 -23.240 6.844 1.00 0.00 H ATOM 773 N THR A 692 -93.910 -20.357 5.254 1.00 31.97 N ATOM 774 CA THR A 692 -94.154 -18.930 5.091 1.00 35.20 C ATOM 775 C THR A 692 -93.467 -18.421 3.832 1.00 33.14 C ATOM 776 O THR A 692 -92.592 -19.087 3.268 1.00 36.65 O ATOM 777 CB THR A 692 -93.652 -18.133 6.306 1.00 36.86 C ATOM 778 OG1 THR A 692 -92.218 -18.133 6.312 1.00 36.27 O ATOM 779 CG2 THR A 692 -94.182 -18.739 7.609 1.00 35.80 C ATOM 780 HG1 THR A 692 -91.886 -17.714 5.479 1.00 0.00 H ATOM 781 H THR A 692 -92.932 -20.688 5.377 1.00 0.00 H ATOM 782 N GLU A 693 -93.869 -17.225 3.396 1.00 32.34 N ATOM 783 CA GLU A 693 -93.173 -16.565 2.295 1.00 35.41 C ATOM 784 C GLU A 693 -91.712 -16.373 2.666 1.00 36.08 C ATOM 785 O GLU A 693 -91.374 -16.121 3.829 1.00 34.12 O ATOM 786 CB GLU A 693 -93.805 -15.201 1.959 1.00 36.19 C ATOM 787 CG GLU A 693 -93.706 -14.164 3.080 1.00 32.08 C ATOM 788 CD GLU A 693 -94.327 -12.809 2.733 1.00 32.07 C ATOM 789 OE1 GLU A 693 -94.160 -12.326 1.596 1.00 38.24 O ATOM 790 OE2 GLU A 693 -94.989 -12.219 3.609 1.00 28.69 O ATOM 791 H GLU A 693 -94.684 -16.760 3.844 1.00 0.00 H ATOM 792 N TYR A 694 -90.841 -16.534 1.681 1.00 31.88 N ATOM 793 CA TYR A 694 -89.427 -16.325 1.911 1.00 31.97 C ATOM 794 C TYR A 694 -89.134 -14.839 1.799 1.00 28.54 C ATOM 795 O TYR A 694 -89.644 -14.160 0.909 1.00 33.04 O ATOM 796 CB TYR A 694 -88.602 -17.138 0.909 1.00 38.85 C ATOM 797 CG TYR A 694 -87.116 -16.980 1.065 1.00 31.61 C ATOM 798 CD1 TYR A 694 -86.435 -17.573 2.115 1.00 33.21 C ATOM 799 CD2 TYR A 694 -86.389 -16.224 0.155 1.00 36.49 C ATOM 800 CE1 TYR A 694 -85.062 -17.418 2.258 1.00 36.02 C ATOM 801 CE2 TYR A 694 -85.026 -16.064 0.287 1.00 31.49 C ATOM 802 CZ TYR A 694 -84.364 -16.659 1.337 1.00 34.85 C ATOM 803 OH TYR A 694 -82.993 -16.493 1.448 1.00 34.14 O ATOM 804 HH TYR A 694 -82.667 -16.977 2.247 1.00 0.00 H ATOM 805 H TYR A 694 -91.175 -16.812 0.736 1.00 0.00 H ATOM 806 N MET A 695 -88.338 -14.329 2.723 1.00 26.46 N ATOM 807 CA MET A 695 -88.040 -12.904 2.788 1.00 28.63 C ATOM 808 C MET A 695 -86.574 -12.716 2.396 1.00 27.50 C ATOM 809 O MET A 695 -85.665 -13.089 3.145 1.00 24.80 O ATOM 810 CB MET A 695 -88.369 -12.349 4.176 1.00 28.17 C ATOM 811 CG MET A 695 -89.901 -12.309 4.481 1.00 22.88 C ATOM 812 SD MET A 695 -90.902 -11.101 3.531 1.00 24.84 S ATOM 813 CE MET A 695 -90.453 -9.558 4.355 1.00 24.92 C ATOM 814 H MET A 695 -87.911 -14.965 3.426 1.00 0.00 H ATOM 815 N GLU A 696 -86.357 -12.128 1.215 1.00 26.47 N ATOM 816 CA GLU A 696 -85.079 -12.268 0.528 1.00 30.16 C ATOM 817 C GLU A 696 -83.944 -11.591 1.282 1.00 27.97 C ATOM 818 O GLU A 696 -82.799 -12.057 1.223 1.00 28.46 O ATOM 819 CB GLU A 696 -85.197 -11.719 -0.898 1.00 29.55 C ATOM 820 CG GLU A 696 -86.362 -12.350 -1.688 1.00 35.01 C ATOM 821 CD GLU A 696 -87.732 -11.716 -1.384 1.00 35.83 C ATOM 822 OE1 GLU A 696 -88.739 -12.450 -1.316 1.00 49.73 O ATOM 823 OE2 GLU A 696 -87.822 -10.484 -1.232 1.00 31.01 O ATOM 824 H GLU A 696 -87.112 -11.561 0.779 1.00 0.00 H ATOM 825 N ASN A 697 -84.230 -10.524 2.019 1.00 20.50 N ATOM 826 CA ASN A 697 -83.167 -9.772 2.668 1.00 23.41 C ATOM 827 C ASN A 697 -83.003 -10.088 4.159 1.00 25.00 C ATOM 828 O ASN A 697 -82.122 -9.510 4.809 1.00 22.52 O ATOM 829 CB ASN A 697 -83.406 -8.286 2.428 1.00 23.24 C ATOM 830 CG ASN A 697 -83.127 -7.900 0.981 1.00 28.03 C ATOM 831 OD1 ASN A 697 -82.102 -8.284 0.426 1.00 27.38 O ATOM 832 ND2 ASN A 697 -84.039 -7.168 0.362 1.00 25.17 N ATOM 833 HD22 ASN A 697 -84.894 -6.864 0.870 1.00 0.00 H ATOM 834 HD21 ASN A 697 -83.901 -6.897 -0.633 1.00 0.00 H ATOM 835 H ASN A 697 -85.219 -10.224 2.133 1.00 0.00 H ATOM 836 N GLY A 698 -83.780 -11.025 4.703 1.00 20.54 N ATOM 837 CA GLY A 698 -83.519 -11.515 6.050 1.00 23.12 C ATOM 838 C GLY A 698 -83.978 -10.558 7.139 1.00 23.43 C ATOM 839 O GLY A 698 -84.853 -9.706 6.946 1.00 19.89 O ATOM 840 H GLY A 698 -84.580 -11.410 4.161 1.00 0.00 H ATOM 841 N ALA A 699 -83.359 -10.703 8.307 1.00 24.74 N ATOM 842 CA ALA A 699 -83.734 -9.910 9.473 1.00 25.91 C ATOM 843 C ALA A 699 -83.295 -8.456 9.320 1.00 22.64 C ATOM 844 O ALA A 699 -82.186 -8.174 8.864 1.00 19.43 O ATOM 845 CB ALA A 699 -83.113 -10.511 10.740 1.00 23.26 C ATOM 846 H ALA A 699 -82.590 -11.398 8.391 1.00 0.00 H ATOM 847 N LEU A 700 -84.159 -7.535 9.767 1.00 19.03 N ATOM 848 CA LEU A 700 -83.909 -6.105 9.591 1.00 18.58 C ATOM 849 C LEU A 700 -82.639 -5.633 10.305 1.00 20.65 C ATOM 850 O LEU A 700 -81.887 -4.826 9.748 1.00 20.15 O ATOM 851 CB LEU A 700 -85.116 -5.312 10.076 1.00 18.17 C ATOM 852 CG LEU A 700 -85.051 -3.785 10.033 1.00 21.52 C ATOM 853 CD1 LEU A 700 -84.843 -3.279 8.605 1.00 15.78 C ATOM 854 CD2 LEU A 700 -86.333 -3.165 10.657 1.00 15.47 C ATOM 855 H LEU A 700 -85.027 -7.844 10.250 1.00 0.00 H ATOM 856 N ASP A 701 -82.403 -6.072 11.554 1.00 18.55 N ATOM 857 CA ASP A 701 -81.211 -5.600 12.266 1.00 23.60 C ATOM 858 C ASP A 701 -79.934 -5.949 11.505 1.00 20.69 C ATOM 859 O ASP A 701 -79.057 -5.093 11.312 1.00 19.40 O ATOM 860 CB ASP A 701 -81.162 -6.159 13.701 1.00 21.67 C ATOM 861 CG ASP A 701 -81.087 -7.687 13.759 1.00 24.21 C ATOM 862 OD1 ASP A 701 -81.532 -8.386 12.815 1.00 24.97 O ATOM 863 OD2 ASP A 701 -80.595 -8.201 14.778 1.00 29.50 O ATOM 864 H ASP A 701 -83.058 -6.739 12.010 1.00 0.00 H ATOM 865 N LYS A 702 -79.824 -7.196 11.046 1.00 19.02 N ATOM 866 CA LYS A 702 -78.641 -7.635 10.306 1.00 20.69 C ATOM 867 C LYS A 702 -78.548 -6.938 8.956 1.00 24.23 C ATOM 868 O LYS A 702 -77.460 -6.519 8.531 1.00 21.71 O ATOM 869 CB LYS A 702 -78.690 -9.154 10.117 1.00 28.05 C ATOM 870 CG LYS A 702 -77.341 -9.811 9.791 1.00 35.86 C ATOM 871 CD LYS A 702 -77.505 -11.334 9.653 1.00 39.25 C ATOM 872 CE LYS A 702 -76.171 -12.072 9.630 1.00 37.54 C ATOM 873 NZ LYS A 702 -75.385 -11.806 8.390 1.00 41.13 N ATOM 874 HZ1 LYS A 702 -75.933 -12.113 7.561 1.00 0.00 H ATOM 875 HZ2 LYS A 702 -75.187 -10.788 8.318 1.00 0.00 H ATOM 876 HZ3 LYS A 702 -74.489 -12.333 8.429 1.00 0.00 H ATOM 877 H LYS A 702 -80.596 -7.871 11.218 1.00 0.00 H ATOM 878 N PHE A 703 -79.688 -6.809 8.276 1.00 21.36 N ATOM 879 CA PHE A 703 -79.773 -6.072 7.022 1.00 21.59 C ATOM 880 C PHE A 703 -79.179 -4.675 7.143 1.00 22.04 C ATOM 881 O PHE A 703 -78.301 -4.297 6.361 1.00 21.66 O ATOM 882 CB PHE A 703 -81.239 -6.012 6.583 1.00 20.32 C ATOM 883 CG PHE A 703 -81.459 -5.314 5.283 1.00 19.95 C ATOM 884 CD1 PHE A 703 -80.991 -5.868 4.092 1.00 20.38 C ATOM 885 CD2 PHE A 703 -82.170 -4.128 5.238 1.00 19.89 C ATOM 886 CE1 PHE A 703 -81.227 -5.233 2.860 1.00 26.27 C ATOM 887 CE2 PHE A 703 -82.420 -3.484 4.017 1.00 21.63 C ATOM 888 CZ PHE A 703 -81.938 -4.039 2.823 1.00 24.78 C ATOM 889 H PHE A 703 -80.549 -7.251 8.655 1.00 0.00 H ATOM 890 N LEU A 704 -79.658 -3.885 8.119 1.00 19.75 N ATOM 891 CA LEU A 704 -79.198 -2.501 8.258 1.00 22.08 C ATOM 892 C LEU A 704 -77.703 -2.433 8.566 1.00 23.63 C ATOM 893 O LEU A 704 -76.995 -1.564 8.045 1.00 21.94 O ATOM 894 CB LEU A 704 -79.976 -1.784 9.366 1.00 23.14 C ATOM 895 CG LEU A 704 -81.494 -1.569 9.225 1.00 28.15 C ATOM 896 CD1 LEU A 704 -82.123 -1.250 10.577 1.00 25.87 C ATOM 897 CD2 LEU A 704 -81.781 -0.462 8.239 1.00 28.46 C ATOM 898 H LEU A 704 -80.364 -4.261 8.784 1.00 0.00 H ATOM 899 N ARG A 705 -77.213 -3.327 9.430 1.00 20.54 N ATOM 900 CA ARG A 705 -75.808 -3.315 9.824 1.00 23.00 C ATOM 901 C ARG A 705 -74.875 -3.630 8.664 1.00 25.39 C ATOM 902 O ARG A 705 -73.707 -3.226 8.700 1.00 24.90 O ATOM 903 CB ARG A 705 -75.578 -4.304 10.972 1.00 22.61 C ATOM 904 CG ARG A 705 -76.278 -3.893 12.254 1.00 20.00 C ATOM 905 CD ARG A 705 -76.414 -5.071 13.233 1.00 23.28 C ATOM 906 NE ARG A 705 -77.275 -4.729 14.370 1.00 20.73 N ATOM 907 CZ ARG A 705 -77.838 -5.625 15.175 1.00 24.90 C ATOM 908 NH1 ARG A 705 -78.617 -5.227 16.176 1.00 20.22 N ATOM 909 NH2 ARG A 705 -77.626 -6.922 14.978 1.00 20.58 N ATOM 910 HE ARG A 705 -77.457 -3.722 14.558 1.00 0.00 H ATOM 911 HH12 ARG A 705 -79.056 -5.930 16.804 1.00 0.00 H ATOM 912 HH11 ARG A 705 -78.787 -4.213 16.331 1.00 0.00 H ATOM 913 HH22 ARG A 705 -78.067 -7.622 15.608 1.00 0.00 H ATOM 914 HH21 ARG A 705 -77.020 -7.237 14.194 1.00 0.00 H ATOM 915 H ARG A 705 -77.847 -4.047 9.831 1.00 0.00 H ATOM 916 N GLU A 706 -75.365 -4.316 7.630 1.00 24.27 N ATOM 917 CA GLU A 706 -74.582 -4.627 6.439 1.00 27.07 C ATOM 918 C GLU A 706 -74.761 -3.603 5.325 1.00 26.48 C ATOM 919 O GLU A 706 -74.103 -3.714 4.286 1.00 27.88 O ATOM 920 CB GLU A 706 -74.942 -6.032 5.942 1.00 26.38 C ATOM 921 CG GLU A 706 -74.570 -7.107 6.974 1.00 32.63 C ATOM 922 CD GLU A 706 -75.042 -8.509 6.613 1.00 35.98 C ATOM 923 OE1 GLU A 706 -75.620 -8.688 5.521 1.00 35.62 O ATOM 924 OE2 GLU A 706 -74.829 -9.436 7.426 1.00 35.79 O ATOM 925 H GLU A 706 -76.351 -4.644 7.675 1.00 0.00 H ATOM 926 N LYS A 707 -75.611 -2.599 5.525 1.00 26.30 N ATOM 927 CA LYS A 707 -75.940 -1.610 4.503 1.00 32.66 C ATOM 928 C LYS A 707 -75.816 -0.206 5.057 1.00 32.09 C ATOM 929 O LYS A 707 -76.588 0.675 4.675 1.00 32.69 O ATOM 930 CB LYS A 707 -77.362 -1.788 3.963 1.00 29.48 C ATOM 931 CG LYS A 707 -77.763 -3.174 3.566 1.00 32.08 C ATOM 932 CD LYS A 707 -77.195 -3.581 2.250 1.00 34.31 C ATOM 933 CE LYS A 707 -77.429 -5.060 2.062 1.00 32.40 C ATOM 934 NZ LYS A 707 -76.754 -5.539 0.843 1.00 36.33 N ATOM 935 HZ1 LYS A 707 -77.129 -5.030 0.018 1.00 0.00 H ATOM 936 HZ2 LYS A 707 -75.732 -5.366 0.924 1.00 0.00 H ATOM 937 HZ3 LYS A 707 -76.926 -6.558 0.731 1.00 0.00 H ATOM 938 H LYS A 707 -76.064 -2.515 6.457 1.00 0.00 H ATOM 939 N ASP A 708 -74.890 0.005 5.986 1.00 34.19 N ATOM 940 CA ASP A 708 -74.772 1.285 6.665 1.00 33.42 C ATOM 941 C ASP A 708 -74.726 2.431 5.668 1.00 34.92 C ATOM 942 O ASP A 708 -73.878 2.450 4.772 1.00 36.65 O ATOM 943 CB ASP A 708 -73.516 1.287 7.530 1.00 34.24 C ATOM 944 CG ASP A 708 -73.572 2.324 8.626 1.00 37.66 C ATOM 945 OD1 ASP A 708 -73.996 3.467 8.369 1.00 40.13 O ATOM 946 OD2 ASP A 708 -73.212 1.987 9.764 1.00 43.45 O ATOM 947 H ASP A 708 -74.234 -0.763 6.233 1.00 0.00 H ATOM 948 N GLY A 709 -75.670 3.363 5.806 1.00 33.62 N ATOM 949 CA GLY A 709 -75.683 4.573 5.009 1.00 31.39 C ATOM 950 C GLY A 709 -76.176 4.441 3.581 1.00 33.36 C ATOM 951 O GLY A 709 -76.116 5.427 2.838 1.00 34.10 O ATOM 952 H GLY A 709 -76.422 3.216 6.509 1.00 0.00 H ATOM 953 N GLU A 710 -76.689 3.279 3.169 1.00 30.83 N ATOM 954 CA GLU A 710 -77.019 3.083 1.757 1.00 36.98 C ATOM 955 C GLU A 710 -78.430 3.542 1.374 1.00 33.78 C ATOM 956 O GLU A 710 -78.737 3.602 0.181 1.00 34.54 O ATOM 957 CB GLU A 710 -76.841 1.607 1.361 1.00 34.73 C ATOM 958 CG GLU A 710 -75.393 1.097 1.499 1.00 35.27 C ATOM 959 CD GLU A 710 -75.243 -0.375 1.140 1.00 35.69 C ATOM 960 OE1 GLU A 710 -76.116 -0.915 0.420 1.00 38.06 O ATOM 961 OE2 GLU A 710 -74.250 -0.998 1.579 1.00 40.98 O ATOM 962 H GLU A 710 -76.854 2.513 3.852 1.00 0.00 H ATOM 963 N PHE A 711 -79.296 3.867 2.328 1.00 30.97 N ATOM 964 CA PHE A 711 -80.656 4.266 1.998 1.00 31.43 C ATOM 965 C PHE A 711 -80.851 5.754 2.244 1.00 32.71 C ATOM 966 O PHE A 711 -80.111 6.386 3.003 1.00 29.30 O ATOM 967 CB PHE A 711 -81.675 3.449 2.807 1.00 29.69 C ATOM 968 CG PHE A 711 -81.507 1.973 2.644 1.00 27.70 C ATOM 969 CD1 PHE A 711 -81.763 1.369 1.426 1.00 33.42 C ATOM 970 CD2 PHE A 711 -81.060 1.191 3.699 1.00 31.74 C ATOM 971 CE1 PHE A 711 -81.573 -0.003 1.256 1.00 34.57 C ATOM 972 CE2 PHE A 711 -80.873 -0.176 3.541 1.00 33.33 C ATOM 973 CZ PHE A 711 -81.130 -0.775 2.311 1.00 28.82 C ATOM 974 H PHE A 711 -78.998 3.836 3.324 1.00 0.00 H ATOM 975 N SER A 712 -81.861 6.308 1.582 1.00 26.21 N ATOM 976 CA SER A 712 -82.261 7.677 1.844 1.00 30.94 C ATOM 977 C SER A 712 -83.156 7.740 3.081 1.00 32.60 C ATOM 978 O SER A 712 -83.723 6.737 3.533 1.00 27.11 O ATOM 979 CB SER A 712 -83.005 8.268 0.646 1.00 32.27 C ATOM 980 OG SER A 712 -84.291 7.692 0.529 1.00 32.38 O ATOM 981 HG SER A 712 -84.758 8.085 -0.250 1.00 0.00 H ATOM 982 H SER A 712 -82.372 5.752 0.866 1.00 0.00 H ATOM 983 N VAL A 713 -83.273 8.947 3.636 1.00 31.42 N ATOM 984 CA VAL A 713 -84.124 9.114 4.808 1.00 32.25 C ATOM 985 C VAL A 713 -85.570 8.793 4.453 1.00 31.43 C ATOM 986 O VAL A 713 -86.319 8.261 5.282 1.00 31.90 O ATOM 987 CB VAL A 713 -83.960 10.536 5.390 1.00 31.89 C ATOM 988 CG1 VAL A 713 -84.577 10.614 6.765 1.00 33.45 C ATOM 989 CG2 VAL A 713 -82.496 10.886 5.494 1.00 37.79 C ATOM 990 H VAL A 713 -82.763 9.761 3.237 1.00 0.00 H ATOM 991 N LEU A 714 -85.977 9.063 3.212 1.00 26.30 N ATOM 992 CA LEU A 714 -87.328 8.709 2.799 1.00 27.61 C ATOM 993 C LEU A 714 -87.528 7.197 2.817 1.00 25.09 C ATOM 994 O LEU A 714 -88.564 6.708 3.287 1.00 23.24 O ATOM 995 CB LEU A 714 -87.618 9.289 1.414 1.00 29.76 C ATOM 996 CG LEU A 714 -88.989 9.002 0.816 1.00 31.67 C ATOM 997 CD1 LEU A 714 -90.094 9.490 1.747 1.00 31.58 C ATOM 998 CD2 LEU A 714 -89.121 9.670 -0.549 1.00 36.43 C ATOM 999 H LEU A 714 -85.331 9.525 2.541 1.00 0.00 H ATOM 1000 N GLN A 715 -86.543 6.437 2.317 1.00 24.84 N ATOM 1001 CA GLN A 715 -86.651 4.977 2.349 1.00 27.09 C ATOM 1002 C GLN A 715 -86.690 4.442 3.783 1.00 26.21 C ATOM 1003 O GLN A 715 -87.466 3.528 4.093 1.00 23.29 O ATOM 1004 CB GLN A 715 -85.493 4.354 1.588 1.00 30.77 C ATOM 1005 CG GLN A 715 -85.606 4.469 0.079 1.00 26.38 C ATOM 1006 CD GLN A 715 -84.351 3.989 -0.615 1.00 30.69 C ATOM 1007 OE1 GLN A 715 -83.244 4.430 -0.290 1.00 31.01 O ATOM 1008 NE2 GLN A 715 -84.509 3.081 -1.578 1.00 36.11 N ATOM 1009 HE22 GLN A 715 -85.461 2.738 -1.818 1.00 0.00 H ATOM 1010 HE21 GLN A 715 -83.680 2.716 -2.089 1.00 0.00 H ATOM 1011 H GLN A 715 -85.700 6.886 1.905 1.00 0.00 H ATOM 1012 N LEU A 716 -85.849 4.986 4.665 1.00 19.42 N ATOM 1013 CA LEU A 716 -85.861 4.560 6.067 1.00 24.13 C ATOM 1014 C LEU A 716 -87.228 4.785 6.714 1.00 24.53 C ATOM 1015 O LEU A 716 -87.738 3.915 7.436 1.00 19.90 O ATOM 1016 CB LEU A 716 -84.772 5.306 6.837 1.00 25.64 C ATOM 1017 CG LEU A 716 -83.327 4.910 6.494 1.00 27.14 C ATOM 1018 CD1 LEU A 716 -82.342 5.690 7.334 1.00 26.79 C ATOM 1019 CD2 LEU A 716 -83.112 3.399 6.650 1.00 25.03 C ATOM 1020 H LEU A 716 -85.179 5.719 4.355 1.00 0.00 H ATOM 1021 N VAL A 717 -87.828 5.951 6.469 1.00 22.29 N ATOM 1022 CA VAL A 717 -89.129 6.282 7.036 1.00 21.64 C ATOM 1023 C VAL A 717 -90.238 5.421 6.424 1.00 26.06 C ATOM 1024 O VAL A 717 -91.216 5.061 7.112 1.00 23.42 O ATOM 1025 CB VAL A 717 -89.382 7.792 6.850 1.00 27.24 C ATOM 1026 CG1 VAL A 717 -90.824 8.161 7.168 1.00 25.33 C ATOM 1027 CG2 VAL A 717 -88.427 8.588 7.734 1.00 23.90 C ATOM 1028 H VAL A 717 -87.354 6.644 5.856 1.00 0.00 H ATOM 1029 N GLY A 718 -90.107 5.069 5.144 1.00 22.12 N ATOM 1030 CA GLY A 718 -91.043 4.129 4.547 1.00 24.86 C ATOM 1031 C GLY A 718 -91.001 2.764 5.209 1.00 22.41 C ATOM 1032 O GLY A 718 -92.034 2.117 5.380 1.00 21.49 O ATOM 1033 H GLY A 718 -89.335 5.467 4.572 1.00 0.00 H ATOM 1034 N MET A 719 -89.803 2.294 5.567 1.00 20.38 N ATOM 1035 CA MET A 719 -89.696 1.019 6.273 1.00 23.70 C ATOM 1036 C MET A 719 -90.401 1.086 7.619 1.00 22.93 C ATOM 1037 O MET A 719 -91.125 0.156 8.005 1.00 23.07 O ATOM 1038 CB MET A 719 -88.222 0.640 6.467 1.00 22.57 C ATOM 1039 CG MET A 719 -87.422 0.511 5.148 1.00 28.45 C ATOM 1040 SD MET A 719 -85.646 0.290 5.433 1.00 33.48 S ATOM 1041 CE MET A 719 -85.587 -1.484 5.581 1.00 32.01 C ATOM 1042 H MET A 719 -88.945 2.837 5.343 1.00 0.00 H ATOM 1043 N LEU A 720 -90.204 2.187 8.343 1.00 21.98 N ATOM 1044 CA LEU A 720 -90.851 2.361 9.639 1.00 22.87 C ATOM 1045 C LEU A 720 -92.371 2.439 9.502 1.00 24.08 C ATOM 1046 O LEU A 720 -93.099 1.915 10.355 1.00 21.28 O ATOM 1047 CB LEU A 720 -90.293 3.611 10.316 1.00 19.32 C ATOM 1048 CG LEU A 720 -88.839 3.496 10.790 1.00 19.48 C ATOM 1049 CD1 LEU A 720 -88.413 4.821 11.421 1.00 22.84 C ATOM 1050 CD2 LEU A 720 -88.705 2.354 11.804 1.00 23.37 C ATOM 1051 H LEU A 720 -89.579 2.934 7.979 1.00 0.00 H ATOM 1052 N ARG A 721 -92.866 3.090 8.435 1.00 25.86 N ATOM 1053 CA ARG A 721 -94.311 3.160 8.200 1.00 26.49 C ATOM 1054 C ARG A 721 -94.904 1.769 8.064 1.00 24.83 C ATOM 1055 O ARG A 721 -95.949 1.462 8.649 1.00 21.70 O ATOM 1056 CB ARG A 721 -94.603 3.981 6.938 1.00 25.68 C ATOM 1057 CG ARG A 721 -96.066 4.455 6.780 1.00 28.79 C ATOM 1058 CD ARG A 721 -96.974 3.431 6.091 1.00 30.54 C ATOM 1059 NE ARG A 721 -98.333 3.946 5.878 1.00 35.61 N ATOM 1060 CZ ARG A 721 -99.405 3.191 5.643 1.00 32.11 C ATOM 1061 NH1 ARG A 721 -99.305 1.863 5.594 1.00 30.11 N ATOM 1062 NH2 ARG A 721 -100.585 3.760 5.459 1.00 26.00 N ATOM 1063 HE ARG A 721 -98.468 4.977 5.913 1.00 0.00 H ATOM 1064 HH12 ARG A 721 -100.149 1.284 5.410 1.00 0.00 H ATOM 1065 HH11 ARG A 721 -98.383 1.405 5.740 1.00 0.00 H ATOM 1066 HH22 ARG A 721 -101.423 3.172 5.275 1.00 0.00 H ATOM 1067 HH21 ARG A 721 -100.675 4.795 5.498 1.00 0.00 H ATOM 1068 H ARG A 721 -92.215 3.550 7.767 1.00 0.00 H ATOM 1069 N GLY A 722 -94.260 0.918 7.265 1.00 23.02 N ATOM 1070 CA GLY A 722 -94.746 -0.444 7.119 1.00 23.78 C ATOM 1071 C GLY A 722 -94.791 -1.198 8.439 1.00 22.38 C ATOM 1072 O GLY A 722 -95.760 -1.905 8.727 1.00 20.53 O ATOM 1073 H GLY A 722 -93.413 1.228 6.748 1.00 0.00 H ATOM 1074 N ILE A 723 -93.740 -1.065 9.257 1.00 20.79 N ATOM 1075 CA ILE A 723 -93.732 -1.743 10.556 1.00 21.30 C ATOM 1076 C ILE A 723 -94.861 -1.215 11.433 1.00 18.86 C ATOM 1077 O ILE A 723 -95.542 -1.981 12.122 1.00 19.52 O ATOM 1078 CB ILE A 723 -92.367 -1.579 11.248 1.00 22.17 C ATOM 1079 CG1 ILE A 723 -91.240 -2.187 10.407 1.00 22.00 C ATOM 1080 CG2 ILE A 723 -92.402 -2.184 12.665 1.00 18.00 C ATOM 1081 CD1 ILE A 723 -89.825 -1.857 10.982 1.00 16.86 C ATOM 1082 H ILE A 723 -92.929 -0.480 8.971 1.00 0.00 H ATOM 1083 N ALA A 724 -95.071 0.103 11.417 1.00 18.96 N ATOM 1084 CA ALA A 724 -96.143 0.715 12.197 1.00 23.97 C ATOM 1085 C ALA A 724 -97.514 0.219 11.745 1.00 22.16 C ATOM 1086 O ALA A 724 -98.386 -0.068 12.579 1.00 20.61 O ATOM 1087 CB ALA A 724 -96.048 2.239 12.084 1.00 21.10 C ATOM 1088 H ALA A 724 -94.457 0.708 10.835 1.00 0.00 H ATOM 1089 N ALA A 725 -97.715 0.098 10.426 1.00 18.82 N ATOM 1090 CA ALA A 725 -98.974 -0.421 9.901 1.00 20.46 C ATOM 1091 C ALA A 725 -99.204 -1.871 10.326 1.00 22.42 C ATOM 1092 O ALA A 725 -100.304 -2.229 10.761 1.00 21.52 O ATOM 1093 CB ALA A 725 -99.002 -0.287 8.371 1.00 20.77 C ATOM 1094 H ALA A 725 -96.962 0.378 9.766 1.00 0.00 H ATOM 1095 N GLY A 726 -98.167 -2.693 10.200 1.00 19.72 N ATOM 1096 CA GLY A 726 -98.255 -4.091 10.576 1.00 18.43 C ATOM 1097 C GLY A 726 -98.541 -4.234 12.057 1.00 23.02 C ATOM 1098 O GLY A 726 -99.349 -5.066 12.467 1.00 22.20 O ATOM 1099 H GLY A 726 -97.271 -2.325 9.823 1.00 0.00 H ATOM 1100 N MET A 727 -97.875 -3.412 12.861 1.00 22.03 N ATOM 1101 CA MET A 727 -98.062 -3.436 14.305 1.00 21.06 C ATOM 1102 C MET A 727 -99.479 -2.996 14.651 1.00 22.72 C ATOM 1103 O MET A 727 -100.096 -3.523 15.576 1.00 22.39 O ATOM 1104 CB MET A 727 -97.043 -2.527 14.995 1.00 21.80 C ATOM 1105 CG MET A 727 -95.722 -3.207 15.315 1.00 20.42 C ATOM 1106 SD MET A 727 -95.939 -4.809 16.112 1.00 21.70 S ATOM 1107 CE MET A 727 -96.870 -4.339 17.569 1.00 24.09 C ATOM 1108 H MET A 727 -97.203 -2.734 12.448 1.00 0.00 H ATOM 1109 N LYS A 728 -99.988 -2.026 13.898 1.00 22.68 N ATOM 1110 CA LYS A 728 -101.335 -1.516 14.115 1.00 22.92 C ATOM 1111 C LYS A 728 -102.353 -2.628 13.895 1.00 25.54 C ATOM 1112 O LYS A 728 -103.300 -2.780 14.668 1.00 23.43 O ATOM 1113 CB LYS A 728 -101.624 -0.343 13.178 1.00 23.08 C ATOM 1114 CG LYS A 728 -102.991 0.291 13.379 1.00 26.24 C ATOM 1115 CD LYS A 728 -103.567 0.789 12.064 1.00 34.47 C ATOM 1116 CE LYS A 728 -102.542 1.590 11.279 1.00 42.05 C ATOM 1117 NZ LYS A 728 -103.007 1.885 9.896 1.00 41.41 N ATOM 1118 HZ1 LYS A 728 -103.179 0.992 9.391 1.00 0.00 H ATOM 1119 HZ2 LYS A 728 -103.888 2.436 9.938 1.00 0.00 H ATOM 1120 HZ3 LYS A 728 -102.278 2.433 9.396 1.00 0.00 H ATOM 1121 H LYS A 728 -99.410 -1.621 13.134 1.00 0.00 H ATOM 1122 N TYR A 729 -102.150 -3.404 12.836 1.00 24.27 N ATOM 1123 CA TYR A 729 -103.044 -4.509 12.516 1.00 28.21 C ATOM 1124 C TYR A 729 -103.081 -5.497 13.674 1.00 27.87 C ATOM 1125 O TYR A 729 -104.139 -6.017 14.028 1.00 27.08 O ATOM 1126 CB TYR A 729 -102.593 -5.212 11.235 1.00 23.47 C ATOM 1127 CG TYR A 729 -103.488 -6.358 10.818 1.00 22.99 C ATOM 1128 CD1 TYR A 729 -104.728 -6.121 10.240 1.00 22.68 C ATOM 1129 CD2 TYR A 729 -103.092 -7.676 11.003 1.00 26.00 C ATOM 1130 CE1 TYR A 729 -105.549 -7.165 9.857 1.00 26.16 C ATOM 1131 CE2 TYR A 729 -103.906 -8.726 10.624 1.00 30.29 C ATOM 1132 CZ TYR A 729 -105.133 -8.465 10.051 1.00 33.00 C ATOM 1133 OH TYR A 729 -105.947 -9.508 9.672 1.00 27.83 O ATOM 1134 HH TYR A 729 -106.783 -9.148 9.282 1.00 0.00 H ATOM 1135 H TYR A 729 -101.333 -3.218 12.220 1.00 0.00 H ATOM 1136 N LEU A 730 -101.916 -5.748 14.263 1.00 24.45 N ATOM 1137 CA LEU A 730 -101.810 -6.670 15.393 1.00 26.04 C ATOM 1138 C LEU A 730 -102.523 -6.113 16.616 1.00 23.21 C ATOM 1139 O LEU A 730 -103.294 -6.819 17.278 1.00 25.19 O ATOM 1140 CB LEU A 730 -100.330 -6.942 15.711 1.00 24.68 C ATOM 1141 CG LEU A 730 -99.517 -7.748 14.697 1.00 26.51 C ATOM 1142 CD1 LEU A 730 -98.090 -7.954 15.193 1.00 31.82 C ATOM 1143 CD2 LEU A 730 -100.175 -9.093 14.421 1.00 32.29 C ATOM 1144 H LEU A 730 -101.058 -5.277 13.911 1.00 0.00 H ATOM 1145 N ALA A 731 -102.297 -4.828 16.919 1.00 21.98 N ATOM 1146 CA ALA A 731 -102.941 -4.232 18.087 1.00 25.89 C ATOM 1147 C ALA A 731 -104.466 -4.219 17.941 1.00 25.96 C ATOM 1148 O ALA A 731 -105.186 -4.549 18.893 1.00 23.66 O ATOM 1149 CB ALA A 731 -102.394 -2.821 18.330 1.00 23.40 C ATOM 1150 H ALA A 731 -101.664 -4.256 16.324 1.00 0.00 H ATOM 1151 N ASN A 732 -104.975 -3.878 16.750 1.00 23.90 N ATOM 1152 CA ASN A 732 -106.426 -3.887 16.523 1.00 27.46 C ATOM 1153 C ASN A 732 -107.008 -5.293 16.628 1.00 23.28 C ATOM 1154 O ASN A 732 -108.147 -5.468 17.068 1.00 26.15 O ATOM 1155 CB ASN A 732 -106.762 -3.301 15.151 1.00 27.09 C ATOM 1156 CG ASN A 732 -106.391 -1.845 15.025 1.00 29.16 C ATOM 1157 OD1 ASN A 732 -106.194 -1.143 16.024 1.00 29.30 O ATOM 1158 ND2 ASN A 732 -106.304 -1.371 13.782 1.00 32.47 N ATOM 1159 HD22 ASN A 732 -106.478 -2.000 12.972 1.00 0.00 H ATOM 1160 HD21 ASN A 732 -106.062 -0.372 13.622 1.00 0.00 H ATOM 1161 H ASN A 732 -104.335 -3.604 15.977 1.00 0.00 H ATOM 1162 N MET A 733 -106.258 -6.301 16.203 1.00 28.33 N ATOM 1163 CA MET A 733 -106.680 -7.694 16.325 1.00 26.27 C ATOM 1164 C MET A 733 -106.516 -8.245 17.738 1.00 30.66 C ATOM 1165 O MET A 733 -106.762 -9.442 17.940 1.00 27.52 O ATOM 1166 CB MET A 733 -105.891 -8.576 15.352 1.00 26.62 C ATOM 1167 CG MET A 733 -106.096 -8.239 13.872 1.00 29.33 C ATOM 1168 SD MET A 733 -107.762 -8.587 13.222 1.00 27.82 S ATOM 1169 CE MET A 733 -108.048 -10.228 13.841 1.00 32.45 C ATOM 1170 H MET A 733 -105.337 -6.092 15.768 1.00 0.00 H ATOM 1171 N ASN A 734 -106.059 -7.412 18.682 1.00 25.93 N ATOM 1172 CA ASN A 734 -105.924 -7.701 20.110 1.00 30.15 C ATOM 1173 C ASN A 734 -104.744 -8.621 20.427 1.00 33.52 C ATOM 1174 O ASN A 734 -104.847 -9.464 21.324 1.00 29.46 O ATOM 1175 CB ASN A 734 -107.223 -8.299 20.674 1.00 31.95 C ATOM 1176 CG ASN A 734 -107.342 -8.131 22.181 1.00 33.90 C ATOM 1177 OD1 ASN A 734 -106.743 -7.229 22.771 1.00 33.30 O ATOM 1178 ND2 ASN A 734 -108.114 -9.008 22.811 1.00 38.05 N ATOM 1179 HD22 ASN A 734 -108.601 -9.753 22.273 1.00 0.00 H ATOM 1180 HD21 ASN A 734 -108.232 -8.950 23.843 1.00 0.00 H ATOM 1181 H ASN A 734 -105.771 -6.463 18.368 1.00 0.00 H ATOM 1182 N TYR A 735 -103.623 -8.466 19.718 1.00 26.89 N ATOM 1183 CA TYR A 735 -102.385 -9.175 20.042 1.00 31.87 C ATOM 1184 C TYR A 735 -101.327 -8.188 20.520 1.00 25.27 C ATOM 1185 O TYR A 735 -101.117 -7.132 19.902 1.00 29.43 O ATOM 1186 CB TYR A 735 -101.862 -9.987 18.842 1.00 28.96 C ATOM 1187 CG TYR A 735 -102.763 -11.169 18.569 1.00 36.14 C ATOM 1188 CD1 TYR A 735 -102.696 -12.324 19.354 1.00 40.27 C ATOM 1189 CD2 TYR A 735 -103.740 -11.100 17.584 1.00 36.05 C ATOM 1190 CE1 TYR A 735 -103.556 -13.398 19.124 1.00 42.63 C ATOM 1191 CE2 TYR A 735 -104.601 -12.162 17.345 1.00 41.73 C ATOM 1192 CZ TYR A 735 -104.506 -13.305 18.113 1.00 47.90 C ATOM 1193 OH TYR A 735 -105.376 -14.346 17.856 1.00 50.28 O ATOM 1194 HH TYR A 735 -105.190 -15.091 18.480 1.00 0.00 H ATOM 1195 H TYR A 735 -103.630 -7.817 18.905 1.00 0.00 H ATOM 1196 N VAL A 736 -100.675 -8.538 21.620 1.00 26.63 N ATOM 1197 CA VAL A 736 -99.506 -7.830 22.128 1.00 25.77 C ATOM 1198 C VAL A 736 -98.272 -8.629 21.740 1.00 24.47 C ATOM 1199 O VAL A 736 -98.181 -9.832 22.019 1.00 23.85 O ATOM 1200 CB VAL A 736 -99.585 -7.635 23.655 1.00 22.26 C ATOM 1201 CG1 VAL A 736 -98.355 -6.883 24.163 1.00 25.57 C ATOM 1202 CG2 VAL A 736 -100.871 -6.878 24.029 1.00 27.13 C ATOM 1203 H VAL A 736 -101.017 -9.365 22.151 1.00 0.00 H ATOM 1204 N HIS A 737 -97.319 -7.965 21.097 1.00 26.39 N ATOM 1205 CA HIS A 737 -96.164 -8.678 20.575 1.00 22.07 C ATOM 1206 C HIS A 737 -95.165 -9.025 21.681 1.00 23.82 C ATOM 1207 O HIS A 737 -94.757 -10.183 21.806 1.00 23.37 O ATOM 1208 CB HIS A 737 -95.510 -7.848 19.472 1.00 21.58 C ATOM 1209 CG HIS A 737 -94.509 -8.612 18.674 1.00 26.14 C ATOM 1210 ND1 HIS A 737 -93.283 -8.977 19.181 1.00 24.67 N ATOM 1211 CD2 HIS A 737 -94.562 -9.111 17.415 1.00 28.71 C ATOM 1212 CE1 HIS A 737 -92.608 -9.641 18.260 1.00 30.34 C ATOM 1213 NE2 HIS A 737 -93.366 -9.746 17.184 1.00 28.38 N ATOM 1214 H HIS A 737 -97.398 -6.936 20.967 1.00 0.00 H ATOM 1215 N ARG A 738 -94.761 -8.027 22.484 1.00 23.60 N ATOM 1216 CA ARG A 738 -93.850 -8.157 23.624 1.00 25.69 C ATOM 1217 C ARG A 738 -92.380 -8.244 23.255 1.00 26.83 C ATOM 1218 O ARG A 738 -91.533 -8.006 24.118 1.00 23.43 O ATOM 1219 CB ARG A 738 -94.173 -9.378 24.489 1.00 28.68 C ATOM 1220 CG ARG A 738 -95.549 -9.379 25.088 1.00 29.77 C ATOM 1221 CD ARG A 738 -95.717 -10.630 25.928 1.00 36.23 C ATOM 1222 NE ARG A 738 -96.912 -10.545 26.729 1.00 39.21 N ATOM 1223 CZ ARG A 738 -98.121 -10.878 26.286 1.00 45.70 C ATOM 1224 NH1 ARG A 738 -98.287 -11.322 25.042 1.00 48.07 N ATOM 1225 NH2 ARG A 738 -99.181 -10.763 27.083 1.00 48.06 N ATOM 1226 HE ARG A 738 -96.824 -10.204 27.708 1.00 0.00 H ATOM 1227 HH12 ARG A 738 -99.236 -11.580 24.704 1.00 0.00 H ATOM 1228 HH11 ARG A 738 -97.467 -11.411 24.408 1.00 0.00 H ATOM 1229 HH22 ARG A 738 -100.125 -11.024 26.734 1.00 0.00 H ATOM 1230 HH21 ARG A 738 -99.065 -10.412 28.055 1.00 0.00 H ATOM 1231 H ARG A 738 -95.128 -7.076 22.278 1.00 0.00 H ATOM 1232 N ASP A 739 -92.065 -8.594 22.002 1.00 26.61 N ATOM 1233 CA ASP A 739 -90.698 -8.814 21.532 1.00 24.86 C ATOM 1234 C ASP A 739 -90.454 -8.038 20.236 1.00 25.95 C ATOM 1235 O ASP A 739 -89.728 -8.472 19.339 1.00 24.53 O ATOM 1236 CB ASP A 739 -90.432 -10.313 21.354 1.00 27.66 C ATOM 1237 CG ASP A 739 -88.942 -10.681 21.384 1.00 34.29 C ATOM 1238 OD1 ASP A 739 -88.104 -9.860 21.828 1.00 30.88 O ATOM 1239 OD2 ASP A 739 -88.615 -11.821 20.969 1.00 41.58 O ATOM 1240 H ASP A 739 -92.841 -8.717 21.320 1.00 0.00 H ATOM 1241 N LEU A 740 -91.053 -6.861 20.129 1.00 23.21 N ATOM 1242 CA LEU A 740 -90.891 -6.027 18.949 1.00 22.40 C ATOM 1243 C LEU A 740 -89.475 -5.467 18.931 1.00 23.62 C ATOM 1244 O LEU A 740 -89.129 -4.618 19.758 1.00 19.37 O ATOM 1245 CB LEU A 740 -91.926 -4.905 18.954 1.00 22.21 C ATOM 1246 CG LEU A 740 -91.955 -3.990 17.731 1.00 23.31 C ATOM 1247 CD1 LEU A 740 -92.069 -4.818 16.464 1.00 21.23 C ATOM 1248 CD2 LEU A 740 -93.117 -2.994 17.839 1.00 24.57 C ATOM 1249 H LEU A 740 -91.654 -6.525 20.908 1.00 0.00 H ATOM 1250 N ALA A 741 -88.665 -5.938 17.979 1.00 22.58 N ATOM 1251 CA ALA A 741 -87.282 -5.522 17.807 1.00 21.66 C ATOM 1252 C ALA A 741 -86.919 -5.726 16.349 1.00 19.41 C ATOM 1253 O ALA A 741 -87.549 -6.519 15.647 1.00 19.49 O ATOM 1254 CB ALA A 741 -86.314 -6.319 18.688 1.00 20.67 C ATOM 1255 H ALA A 741 -89.047 -6.646 17.320 1.00 0.00 H ATOM 1256 N ALA A 742 -85.890 -5.004 15.896 1.00 18.56 N ATOM 1257 CA ALA A 742 -85.504 -5.121 14.496 1.00 18.71 C ATOM 1258 C ALA A 742 -85.127 -6.555 14.138 1.00 19.93 C ATOM 1259 O ALA A 742 -85.327 -6.978 12.990 1.00 20.26 O ATOM 1260 CB ALA A 742 -84.366 -4.157 14.170 1.00 19.65 C ATOM 1261 H ALA A 742 -85.372 -4.367 16.534 1.00 0.00 H ATOM 1262 N ARG A 743 -84.607 -7.327 15.103 1.00 20.73 N ATOM 1263 CA ARG A 743 -84.274 -8.727 14.832 1.00 23.76 C ATOM 1264 C ARG A 743 -85.510 -9.579 14.567 1.00 24.64 C ATOM 1265 O ARG A 743 -85.386 -10.704 14.063 1.00 21.58 O ATOM 1266 CB ARG A 743 -83.490 -9.325 16.000 1.00 23.97 C ATOM 1267 CG ARG A 743 -84.319 -9.424 17.267 1.00 25.90 C ATOM 1268 CD ARG A 743 -83.517 -9.957 18.446 1.00 32.22 C ATOM 1269 NE ARG A 743 -84.289 -9.723 19.667 1.00 34.98 N ATOM 1270 CZ ARG A 743 -84.161 -8.653 20.448 1.00 36.17 C ATOM 1271 NH1 ARG A 743 -83.265 -7.708 20.185 1.00 31.62 N ATOM 1272 NH2 ARG A 743 -84.939 -8.533 21.506 1.00 42.32 N ATOM 1273 HE ARG A 743 -84.986 -10.443 19.944 1.00 0.00 H ATOM 1274 HH12 ARG A 743 -83.183 -6.881 20.810 1.00 0.00 H ATOM 1275 HH11 ARG A 743 -82.645 -7.796 19.354 1.00 0.00 H ATOM 1276 HH22 ARG A 743 -84.850 -7.702 22.125 1.00 0.00 H ATOM 1277 HH21 ARG A 743 -85.641 -9.269 21.721 1.00 0.00 H ATOM 1278 H ARG A 743 -84.439 -6.929 16.049 1.00 0.00 H ATOM 1279 N ASN A 744 -86.698 -9.086 14.910 1.00 23.83 N ATOM 1280 CA ASN A 744 -87.929 -9.820 14.658 1.00 27.22 C ATOM 1281 C ASN A 744 -88.719 -9.261 13.467 1.00 23.82 C ATOM 1282 O ASN A 744 -89.855 -9.683 13.238 1.00 28.55 O ATOM 1283 CB ASN A 744 -88.775 -9.851 15.948 1.00 20.73 C ATOM 1284 CG ASN A 744 -88.180 -10.772 17.007 1.00 30.61 C ATOM 1285 OD1 ASN A 744 -87.675 -11.841 16.679 1.00 28.93 O ATOM 1286 ND2 ASN A 744 -88.219 -10.354 18.282 1.00 26.89 N ATOM 1287 HD22 ASN A 744 -88.657 -9.440 18.517 1.00 0.00 H ATOM 1288 HD21 ASN A 744 -87.811 -10.944 19.035 1.00 0.00 H ATOM 1289 H ASN A 744 -86.748 -8.154 15.369 1.00 0.00 H ATOM 1290 N ILE A 745 -88.141 -8.335 12.695 1.00 19.67 N ATOM 1291 CA ILE A 745 -88.742 -7.852 11.455 1.00 20.40 C ATOM 1292 C ILE A 745 -87.948 -8.433 10.286 1.00 23.33 C ATOM 1293 O ILE A 745 -86.715 -8.499 10.340 1.00 22.75 O ATOM 1294 CB ILE A 745 -88.763 -6.308 11.380 1.00 19.47 C ATOM 1295 CG1 ILE A 745 -89.360 -5.667 12.641 1.00 19.22 C ATOM 1296 CG2 ILE A 745 -89.499 -5.817 10.119 1.00 20.06 C ATOM 1297 CD1 ILE A 745 -90.796 -6.078 12.910 1.00 27.36 C ATOM 1298 H ILE A 745 -87.224 -7.942 12.990 1.00 0.00 H ATOM 1299 N LEU A 746 -88.642 -8.870 9.238 1.00 21.38 N ATOM 1300 CA LEU A 746 -87.971 -9.350 8.033 1.00 22.85 C ATOM 1301 C LEU A 746 -88.177 -8.374 6.875 1.00 21.99 C ATOM 1302 O LEU A 746 -89.123 -7.583 6.861 1.00 19.86 O ATOM 1303 CB LEU A 746 -88.473 -10.749 7.635 1.00 26.40 C ATOM 1304 CG LEU A 746 -88.170 -11.909 8.595 1.00 29.92 C ATOM 1305 CD1 LEU A 746 -89.080 -13.109 8.308 1.00 33.23 C ATOM 1306 CD2 LEU A 746 -86.743 -12.320 8.483 1.00 30.08 C ATOM 1307 H LEU A 746 -89.681 -8.870 9.278 1.00 0.00 H ATOM 1308 N VAL A 747 -87.278 -8.443 5.882 1.00 19.61 N ATOM 1309 CA VAL A 747 -87.241 -7.472 4.797 1.00 20.61 C ATOM 1310 C VAL A 747 -87.214 -8.212 3.465 1.00 21.33 C ATOM 1311 O VAL A 747 -86.472 -9.186 3.309 1.00 21.06 O ATOM 1312 CB VAL A 747 -86.018 -6.530 4.902 1.00 22.54 C ATOM 1313 CG1 VAL A 747 -86.137 -5.433 3.854 1.00 20.61 C ATOM 1314 CG2 VAL A 747 -85.861 -5.961 6.340 1.00 19.00 C ATOM 1315 H VAL A 747 -86.583 -9.217 5.887 1.00 0.00 H ATOM 1316 N ASN A 748 -88.013 -7.759 2.504 1.00 21.49 N ATOM 1317 CA ASN A 748 -88.032 -8.437 1.214 1.00 23.45 C ATOM 1318 C ASN A 748 -87.344 -7.564 0.163 1.00 25.92 C ATOM 1319 O ASN A 748 -86.848 -6.466 0.453 1.00 21.58 O ATOM 1320 CB ASN A 748 -89.462 -8.846 0.820 1.00 23.37 C ATOM 1321 CG ASN A 748 -90.355 -7.675 0.456 1.00 21.60 C ATOM 1322 OD1 ASN A 748 -89.906 -6.545 0.300 1.00 22.32 O ATOM 1323 ND2 ASN A 748 -91.650 -7.955 0.309 1.00 24.87 N ATOM 1324 HD22 ASN A 748 -91.991 -8.927 0.450 1.00 0.00 H ATOM 1325 HD21 ASN A 748 -92.319 -7.201 0.053 1.00 0.00 H ATOM 1326 H ASN A 748 -88.618 -6.930 2.671 1.00 0.00 H ATOM 1327 N SER A 749 -87.303 -8.073 -1.072 1.00 24.64 N ATOM 1328 CA SER A 749 -86.607 -7.385 -2.157 1.00 27.73 C ATOM 1329 C SER A 749 -87.351 -6.155 -2.661 1.00 28.69 C ATOM 1330 O SER A 749 -86.842 -5.478 -3.564 1.00 29.46 O ATOM 1331 CB SER A 749 -86.354 -8.346 -3.315 1.00 28.80 C ATOM 1332 OG SER A 749 -87.577 -8.700 -3.932 1.00 35.54 O ATOM 1333 HG SER A 749 -88.019 -7.884 -4.278 1.00 0.00 H ATOM 1334 H SER A 749 -87.777 -8.978 -1.265 1.00 0.00 H ATOM 1335 N ASN A 750 -88.526 -5.842 -2.109 1.00 27.99 N ATOM 1336 CA ASN A 750 -89.161 -4.549 -2.319 1.00 25.38 C ATOM 1337 C ASN A 750 -88.910 -3.587 -1.154 1.00 26.46 C ATOM 1338 O ASN A 750 -89.518 -2.512 -1.102 1.00 22.72 O ATOM 1339 CB ASN A 750 -90.668 -4.724 -2.553 1.00 27.19 C ATOM 1340 CG ASN A 750 -91.009 -5.168 -3.987 1.00 36.34 C ATOM 1341 OD1 ASN A 750 -90.307 -4.828 -4.943 1.00 37.45 O ATOM 1342 ND2 ASN A 750 -92.100 -5.921 -4.135 1.00 35.98 N ATOM 1343 HD22 ASN A 750 -92.665 -6.186 -3.303 1.00 0.00 H ATOM 1344 HD21 ASN A 750 -92.385 -6.243 -5.082 1.00 0.00 H ATOM 1345 H ASN A 750 -89.003 -6.545 -1.509 1.00 0.00 H ATOM 1346 N LEU A 751 -88.026 -3.944 -0.223 1.00 23.90 N ATOM 1347 CA LEU A 751 -87.742 -3.140 0.964 1.00 27.18 C ATOM 1348 C LEU A 751 -88.954 -3.042 1.901 1.00 26.25 C ATOM 1349 O LEU A 751 -89.020 -2.139 2.746 1.00 27.38 O ATOM 1350 CB LEU A 751 -87.237 -1.736 0.584 1.00 23.94 C ATOM 1351 CG LEU A 751 -86.158 -1.143 1.490 1.00 30.34 C ATOM 1352 CD1 LEU A 751 -84.952 -2.081 1.573 1.00 22.21 C ATOM 1353 CD2 LEU A 751 -85.726 0.249 1.014 1.00 30.99 C ATOM 1354 H LEU A 751 -87.512 -4.840 -0.347 1.00 0.00 H ATOM 1355 N VAL A 752 -89.915 -3.963 1.780 1.00 22.21 N ATOM 1356 CA VAL A 752 -91.065 -4.013 2.681 1.00 23.80 C ATOM 1357 C VAL A 752 -90.687 -4.796 3.934 1.00 25.16 C ATOM 1358 O VAL A 752 -90.187 -5.925 3.848 1.00 20.01 O ATOM 1359 CB VAL A 752 -92.290 -4.642 1.992 1.00 22.06 C ATOM 1360 CG1 VAL A 752 -93.461 -4.786 2.995 1.00 20.54 C ATOM 1361 CG2 VAL A 752 -92.718 -3.815 0.795 1.00 20.56 C ATOM 1362 H VAL A 752 -89.842 -4.668 1.019 1.00 0.00 H ATOM 1363 N CYS A 753 -90.967 -4.207 5.096 1.00 22.69 N ATOM 1364 CA CYS A 753 -90.718 -4.813 6.403 1.00 20.06 C ATOM 1365 C CYS A 753 -92.000 -5.447 6.931 1.00 23.45 C ATOM 1366 O CYS A 753 -93.071 -4.821 6.908 1.00 21.34 O ATOM 1367 CB CYS A 753 -90.202 -3.763 7.385 1.00 20.20 C ATOM 1368 SG CYS A 753 -88.633 -3.007 6.853 1.00 24.51 S ATOM 1369 H CYS A 753 -91.389 -3.257 5.072 1.00 0.00 H ATOM 1370 N LYS A 754 -91.900 -6.696 7.377 1.00 20.12 N ATOM 1371 CA LYS A 754 -93.055 -7.426 7.872 1.00 21.05 C ATOM 1372 C LYS A 754 -92.746 -7.968 9.260 1.00 23.84 C ATOM 1373 O LYS A 754 -91.654 -8.503 9.496 1.00 19.38 O ATOM 1374 CB LYS A 754 -93.445 -8.565 6.926 1.00 21.54 C ATOM 1375 CG LYS A 754 -93.715 -8.097 5.502 1.00 23.11 C ATOM 1376 CD LYS A 754 -94.220 -9.215 4.638 1.00 23.54 C ATOM 1377 CE LYS A 754 -94.325 -8.722 3.185 1.00 24.89 C ATOM 1378 NZ LYS A 754 -95.433 -9.369 2.462 1.00 26.85 N ATOM 1379 HZ1 LYS A 754 -95.281 -10.398 2.447 1.00 0.00 H ATOM 1380 HZ2 LYS A 754 -96.330 -9.157 2.943 1.00 0.00 H ATOM 1381 HZ3 LYS A 754 -95.467 -9.008 1.487 1.00 0.00 H ATOM 1382 H LYS A 754 -90.971 -7.163 7.371 1.00 0.00 H ATOM 1383 N VAL A 755 -93.703 -7.811 10.177 1.00 20.94 N ATOM 1384 CA VAL A 755 -93.540 -8.347 11.518 1.00 22.05 C ATOM 1385 C VAL A 755 -93.595 -9.866 11.455 1.00 24.68 C ATOM 1386 O VAL A 755 -94.425 -10.448 10.739 1.00 24.72 O ATOM 1387 CB VAL A 755 -94.623 -7.794 12.461 1.00 24.86 C ATOM 1388 CG1 VAL A 755 -94.375 -8.257 13.916 1.00 25.16 C ATOM 1389 CG2 VAL A 755 -94.673 -6.289 12.375 1.00 22.98 C ATOM 1390 H VAL A 755 -94.574 -7.300 9.929 1.00 0.00 H ATOM 1391 N SER A 756 -92.680 -10.508 12.163 1.00 23.92 N ATOM 1392 CA SER A 756 -92.740 -11.951 12.402 1.00 36.61 C ATOM 1393 C SER A 756 -92.551 -12.208 13.895 1.00 40.11 C ATOM 1394 O SER A 756 -92.814 -11.349 14.750 1.00 34.33 O ATOM 1395 CB SER A 756 -91.750 -12.658 11.461 1.00 35.88 C ATOM 1396 OG SER A 756 -91.686 -14.038 11.783 1.00 44.03 O ATOM 1397 HG SER A 756 -91.048 -14.488 11.175 1.00 0.00 H ATOM 1398 H SER A 756 -91.888 -9.967 12.565 1.00 0.00 H ATOM 1399 N ASP A 757 -92.161 -13.426 14.224 1.00 44.28 N ATOM 1400 CA ASP A 757 -91.785 -13.892 15.552 1.00 47.08 C ATOM 1401 C ASP A 757 -93.043 -14.072 16.312 1.00 50.44 C ATOM 1402 O ASP A 757 -93.405 -15.131 16.690 1.00 57.71 O ATOM 1403 CB ASP A 757 -90.944 -12.910 16.385 1.00 44.35 C ATOM 1404 CG ASP A 757 -90.453 -13.529 17.730 1.00 49.54 C ATOM 1405 OD1 ASP A 757 -90.240 -14.751 17.779 1.00 52.98 O ATOM 1406 OD2 ASP A 757 -90.281 -12.824 18.730 1.00 44.58 O ATOM 1407 H ASP A 757 -92.118 -14.125 13.455 1.00 0.00 H ATOM 1408 N PHE A 758 -93.697 -12.967 16.545 1.00 52.93 N ATOM 1409 CA PHE A 758 -94.952 -12.910 17.255 1.00 51.42 C ATOM 1410 C PHE A 758 -94.756 -12.659 18.711 1.00 42.97 C ATOM 1411 O PHE A 758 -95.655 -12.449 19.463 1.00 40.35 O ATOM 1412 CB PHE A 758 -95.892 -13.998 16.816 1.00 48.31 C ATOM 1413 CG PHE A 758 -96.420 -13.717 15.463 1.00 56.41 C ATOM 1414 CD1 PHE A 758 -97.462 -12.859 15.292 1.00 59.08 C ATOM 1415 CD2 PHE A 758 -95.757 -14.162 14.353 1.00 53.78 C ATOM 1416 CE1 PHE A 758 -97.908 -12.546 14.038 1.00 57.81 C ATOM 1417 CE2 PHE A 758 -96.202 -13.846 13.096 1.00 54.40 C ATOM 1418 CZ PHE A 758 -97.276 -13.030 12.936 1.00 55.93 C ATOM 1419 H PHE A 758 -93.290 -12.075 16.199 1.00 0.00 H ATOM 1420 N GLY A 759 -93.501 -12.621 19.045 1.00 45.55 N ATOM 1421 CA GLY A 759 -93.087 -12.309 20.344 1.00 44.27 C ATOM 1422 C GLY A 759 -93.360 -13.443 21.225 1.00 49.25 C ATOM 1423 O GLY A 759 -93.503 -14.586 20.819 1.00 49.03 O ATOM 1424 H GLY A 759 -92.781 -12.829 18.324 1.00 0.00 H ATOM 1425 N LEU A 760 -93.401 -13.052 22.472 1.00 44.61 N ATOM 1426 CA LEU A 760 -93.587 -13.981 23.559 1.00 47.85 C ATOM 1427 C LEU A 760 -95.073 -14.058 23.877 1.00 52.42 C ATOM 1428 O LEU A 760 -95.833 -13.108 23.646 1.00 45.15 O ATOM 1429 CB LEU A 760 -92.774 -13.538 24.784 1.00 44.08 C ATOM 1430 CG LEU A 760 -91.233 -13.411 24.734 1.00 50.83 C ATOM 1431 CD1 LEU A 760 -90.571 -13.873 23.421 1.00 45.60 C ATOM 1432 CD2 LEU A 760 -90.760 -11.991 25.118 1.00 40.22 C ATOM 1433 H LEU A 760 -93.296 -12.040 22.686 1.00 0.00 H ATOM 1434 N SER A 761 -95.485 -15.217 24.380 1.00 56.17 N ATOM 1435 CA SER A 761 -96.863 -15.430 24.783 1.00 57.48 C ATOM 1436 C SER A 761 -97.089 -14.881 26.194 1.00 49.91 C ATOM 1437 O SER A 761 -98.190 -14.977 26.740 1.00 53.40 O ATOM 1438 CB SER A 761 -97.203 -16.921 24.714 1.00 56.19 C ATOM 1439 OG SER A 761 -97.212 -17.380 23.370 1.00 64.96 O ATOM 1440 HG SER A 761 -96.318 -17.239 22.968 1.00 0.00 H ATOM 1441 H SER A 761 -94.801 -15.993 24.488 1.00 0.00 H TER 1442 SER A 761 ATOM 1443 N ILE A 779 -87.568 -11.774 27.637 1.00 45.62 N ATOM 1444 CA ILE A 779 -87.813 -10.348 27.876 1.00 45.86 C ATOM 1445 C ILE A 779 -86.607 -9.483 27.508 1.00 39.87 C ATOM 1446 O ILE A 779 -85.725 -9.273 28.337 1.00 42.44 O ATOM 1447 CB ILE A 779 -88.192 -10.077 29.345 1.00 47.78 C ATOM 1448 CG1 ILE A 779 -89.209 -11.106 29.848 1.00 49.95 C ATOM 1449 CG2 ILE A 779 -88.704 -8.648 29.504 1.00 40.96 C ATOM 1450 CD1 ILE A 779 -88.580 -12.266 30.624 1.00 52.93 C ATOM 1451 HN3 ILE A 779 -86.759 -12.087 28.211 1.00 0.00 H ATOM 1452 HN2 ILE A 779 -87.358 -11.924 26.630 1.00 0.00 H ATOM 1453 HN1 ILE A 779 -88.414 -12.319 27.901 1.00 0.00 H ATOM 1454 N PRO A 780 -86.587 -8.958 26.285 1.00 40.51 N ATOM 1455 CA PRO A 780 -85.464 -8.107 25.861 1.00 33.81 C ATOM 1456 C PRO A 780 -85.459 -6.759 26.557 1.00 27.16 C ATOM 1457 O PRO A 780 -86.199 -5.854 26.153 1.00 27.67 O ATOM 1458 CB PRO A 780 -85.708 -7.946 24.359 1.00 35.82 C ATOM 1459 CG PRO A 780 -87.179 -8.042 24.220 1.00 32.54 C ATOM 1460 CD PRO A 780 -87.655 -9.011 25.273 1.00 32.24 C ATOM 1461 N ILE A 781 -84.594 -6.608 27.567 1.00 30.94 N ATOM 1462 CA ILE A 781 -84.650 -5.462 28.477 1.00 25.42 C ATOM 1463 C ILE A 781 -84.591 -4.147 27.713 1.00 22.30 C ATOM 1464 O ILE A 781 -85.348 -3.205 27.996 1.00 18.88 O ATOM 1465 CB ILE A 781 -83.514 -5.549 29.515 1.00 30.55 C ATOM 1466 CG1 ILE A 781 -83.792 -6.668 30.511 1.00 37.07 C ATOM 1467 CG2 ILE A 781 -83.359 -4.232 30.249 1.00 28.56 C ATOM 1468 CD1 ILE A 781 -84.875 -6.297 31.516 1.00 36.00 C ATOM 1469 H ILE A 781 -83.858 -7.328 27.710 1.00 0.00 H ATOM 1470 N ARG A 782 -83.671 -4.057 26.745 1.00 23.13 N ATOM 1471 CA ARG A 782 -83.392 -2.802 26.054 1.00 25.46 C ATOM 1472 C ARG A 782 -84.537 -2.343 25.163 1.00 22.89 C ATOM 1473 O ARG A 782 -84.533 -1.184 24.728 1.00 22.04 O ATOM 1474 CB ARG A 782 -82.121 -2.946 25.216 1.00 25.51 C ATOM 1475 CG ARG A 782 -80.882 -2.741 26.028 1.00 29.67 C ATOM 1476 CD ARG A 782 -79.656 -3.434 25.446 1.00 31.14 C ATOM 1477 NE ARG A 782 -78.835 -3.899 26.563 1.00 31.78 N ATOM 1478 CZ ARG A 782 -77.854 -3.200 27.119 1.00 34.78 C ATOM 1479 NH1 ARG A 782 -77.201 -3.704 28.169 1.00 35.91 N ATOM 1480 NH2 ARG A 782 -77.510 -2.015 26.622 1.00 33.31 N ATOM 1481 HE ARG A 782 -79.034 -4.844 26.949 1.00 0.00 H ATOM 1482 HH12 ARG A 782 -76.431 -3.163 28.611 1.00 0.00 H ATOM 1483 HH11 ARG A 782 -77.463 -4.638 28.545 1.00 0.00 H ATOM 1484 HH22 ARG A 782 -76.740 -1.471 27.061 1.00 0.00 H ATOM 1485 HH21 ARG A 782 -78.011 -1.633 25.794 1.00 0.00 H ATOM 1486 H ARG A 782 -83.138 -4.909 26.477 1.00 0.00 H ATOM 1487 N TRP A 783 -85.498 -3.217 24.873 1.00 20.80 N ATOM 1488 CA TRP A 783 -86.628 -2.888 24.023 1.00 21.96 C ATOM 1489 C TRP A 783 -87.921 -2.787 24.805 1.00 25.78 C ATOM 1490 O TRP A 783 -88.963 -2.485 24.210 1.00 21.98 O ATOM 1491 CB TRP A 783 -86.789 -3.946 22.915 1.00 21.56 C ATOM 1492 CG TRP A 783 -85.803 -3.837 21.782 1.00 20.72 C ATOM 1493 CD1 TRP A 783 -86.029 -3.285 20.549 1.00 22.24 C ATOM 1494 CD2 TRP A 783 -84.436 -4.283 21.777 1.00 20.75 C ATOM 1495 NE1 TRP A 783 -84.883 -3.358 19.782 1.00 22.13 N ATOM 1496 CE2 TRP A 783 -83.898 -3.973 20.508 1.00 21.06 C ATOM 1497 CE3 TRP A 783 -83.624 -4.926 22.715 1.00 24.64 C ATOM 1498 CZ2 TRP A 783 -82.574 -4.274 20.156 1.00 25.62 C ATOM 1499 CZ3 TRP A 783 -82.307 -5.219 22.373 1.00 28.56 C ATOM 1500 CH2 TRP A 783 -81.795 -4.896 21.098 1.00 24.67 C ATOM 1501 HE1 TRP A 783 -84.784 -3.003 18.809 1.00 0.00 H ATOM 1502 H TRP A 783 -85.437 -4.176 25.272 1.00 0.00 H ATOM 1503 N THR A 784 -87.892 -3.050 26.110 1.00 21.81 N ATOM 1504 CA THR A 784 -89.115 -3.274 26.867 1.00 22.15 C ATOM 1505 C THR A 784 -89.506 -2.014 27.629 1.00 21.63 C ATOM 1506 O THR A 784 -88.648 -1.287 28.151 1.00 20.21 O ATOM 1507 CB THR A 784 -88.963 -4.474 27.808 1.00 23.09 C ATOM 1508 OG1 THR A 784 -88.730 -5.653 27.026 1.00 25.51 O ATOM 1509 CG2 THR A 784 -90.217 -4.707 28.618 1.00 23.28 C ATOM 1510 HG1 THR A 784 -87.903 -5.537 26.495 1.00 0.00 H ATOM 1511 H THR A 784 -86.975 -3.096 26.599 1.00 0.00 H ATOM 1512 N ALA A 785 -90.805 -1.754 27.669 1.00 20.11 N ATOM 1513 CA ALA A 785 -91.296 -0.560 28.324 1.00 20.82 C ATOM 1514 C ALA A 785 -91.103 -0.650 29.839 1.00 24.31 C ATOM 1515 O ALA A 785 -91.094 -1.747 30.413 1.00 21.18 O ATOM 1516 CB ALA A 785 -92.767 -0.344 27.992 1.00 20.95 C ATOM 1517 H ALA A 785 -91.477 -2.413 27.226 1.00 0.00 H ATOM 1518 N PRO A 786 -90.961 0.502 30.506 1.00 22.87 N ATOM 1519 CA PRO A 786 -90.756 0.501 31.971 1.00 29.65 C ATOM 1520 C PRO A 786 -91.820 -0.264 32.745 1.00 27.25 C ATOM 1521 O PRO A 786 -91.481 -1.063 33.625 1.00 28.68 O ATOM 1522 CB PRO A 786 -90.770 1.997 32.334 1.00 28.61 C ATOM 1523 CG PRO A 786 -90.537 2.738 31.048 1.00 33.94 C ATOM 1524 CD PRO A 786 -91.024 1.859 29.930 1.00 23.62 C ATOM 1525 N GLU A 787 -93.102 -0.065 32.426 1.00 29.33 N ATOM 1526 CA GLU A 787 -94.160 -0.760 33.158 1.00 26.67 C ATOM 1527 C GLU A 787 -94.107 -2.271 32.944 1.00 26.48 C ATOM 1528 O GLU A 787 -94.555 -3.036 33.811 1.00 25.48 O ATOM 1529 CB GLU A 787 -95.534 -0.211 32.761 1.00 24.44 C ATOM 1530 CG GLU A 787 -96.028 -0.603 31.369 1.00 22.75 C ATOM 1531 CD GLU A 787 -95.586 0.378 30.281 1.00 26.59 C ATOM 1532 OE1 GLU A 787 -94.706 1.239 30.564 1.00 23.90 O ATOM 1533 OE2 GLU A 787 -96.123 0.283 29.140 1.00 27.50 O ATOM 1534 H GLU A 787 -93.348 0.587 31.654 1.00 0.00 H ATOM 1535 N ALA A 788 -93.572 -2.724 31.803 1.00 19.47 N ATOM 1536 CA ALA A 788 -93.481 -4.160 31.555 1.00 22.41 C ATOM 1537 C ALA A 788 -92.291 -4.772 32.290 1.00 27.49 C ATOM 1538 O ALA A 788 -92.396 -5.887 32.818 1.00 24.74 O ATOM 1539 CB ALA A 788 -93.387 -4.430 30.046 1.00 22.47 C ATOM 1540 H ALA A 788 -93.221 -2.051 31.092 1.00 0.00 H ATOM 1541 N ILE A 789 -91.161 -4.050 32.342 1.00 25.43 N ATOM 1542 CA ILE A 789 -90.026 -4.474 33.164 1.00 23.82 C ATOM 1543 C ILE A 789 -90.433 -4.520 34.627 1.00 32.37 C ATOM 1544 O ILE A 789 -90.144 -5.481 35.352 1.00 33.43 O ATOM 1545 CB ILE A 789 -88.826 -3.524 32.974 1.00 27.57 C ATOM 1546 CG1 ILE A 789 -88.223 -3.637 31.571 1.00 23.71 C ATOM 1547 CG2 ILE A 789 -87.751 -3.800 34.025 1.00 30.35 C ATOM 1548 CD1 ILE A 789 -87.201 -2.525 31.257 1.00 23.14 C ATOM 1549 H ILE A 789 -91.090 -3.173 31.788 1.00 0.00 H ATOM 1550 N SER A 790 -91.109 -3.471 35.080 1.00 31.57 N ATOM 1551 CA SER A 790 -91.275 -3.271 36.508 1.00 31.39 C ATOM 1552 C SER A 790 -92.411 -4.115 37.074 1.00 32.43 C ATOM 1553 O SER A 790 -92.276 -4.671 38.169 1.00 31.09 O ATOM 1554 CB SER A 790 -91.488 -1.789 36.789 1.00 32.50 C ATOM 1555 OG SER A 790 -91.860 -1.613 38.128 1.00 40.61 O ATOM 1556 HG SER A 790 -91.998 -0.649 38.307 1.00 0.00 H ATOM 1557 H SER A 790 -91.521 -2.791 34.410 1.00 0.00 H ATOM 1558 N TYR A 791 -93.540 -4.245 36.358 1.00 25.34 N ATOM 1559 CA TYR A 791 -94.592 -5.084 36.928 1.00 28.50 C ATOM 1560 C TYR A 791 -95.337 -5.913 35.881 1.00 27.99 C ATOM 1561 O TYR A 791 -96.485 -6.311 36.106 1.00 28.31 O ATOM 1562 CB TYR A 791 -95.575 -4.248 37.757 1.00 27.74 C ATOM 1563 CG TYR A 791 -96.255 -3.069 37.077 1.00 29.27 C ATOM 1564 CD1 TYR A 791 -97.523 -3.204 36.530 1.00 27.98 C ATOM 1565 CD2 TYR A 791 -95.657 -1.808 37.048 1.00 32.36 C ATOM 1566 CE1 TYR A 791 -98.168 -2.137 35.953 1.00 30.79 C ATOM 1567 CE2 TYR A 791 -96.304 -0.722 36.466 1.00 30.07 C ATOM 1568 CZ TYR A 791 -97.554 -0.900 35.922 1.00 27.20 C ATOM 1569 OH TYR A 791 -98.209 0.157 35.340 1.00 37.00 O ATOM 1570 HH TYR A 791 -99.089 -0.147 35.003 1.00 0.00 H ATOM 1571 H TYR A 791 -93.660 -3.770 35.440 1.00 0.00 H ATOM 1572 N ARG A 792 -94.689 -6.210 34.751 1.00 26.09 N ATOM 1573 CA ARG A 792 -95.177 -7.198 33.785 1.00 30.05 C ATOM 1574 C ARG A 792 -96.471 -6.770 33.104 1.00 22.10 C ATOM 1575 O ARG A 792 -97.263 -7.614 32.670 1.00 26.25 O ATOM 1576 CB ARG A 792 -95.378 -8.570 34.426 1.00 28.82 C ATOM 1577 CG ARG A 792 -94.353 -8.975 35.422 1.00 36.14 C ATOM 1578 CD ARG A 792 -94.483 -10.458 35.661 1.00 45.66 C ATOM 1579 NE ARG A 792 -94.105 -10.781 37.026 1.00 44.34 N ATOM 1580 CZ ARG A 792 -93.069 -11.541 37.340 1.00 52.46 C ATOM 1581 NH1 ARG A 792 -92.782 -11.777 38.619 1.00 47.68 N ATOM 1582 NH2 ARG A 792 -92.314 -12.049 36.369 1.00 55.34 N ATOM 1583 HE ARG A 792 -94.681 -10.393 37.800 1.00 0.00 H ATOM 1584 HH12 ARG A 792 -91.968 -12.374 38.868 1.00 0.00 H ATOM 1585 HH11 ARG A 792 -93.372 -11.364 39.369 1.00 0.00 H ATOM 1586 HH22 ARG A 792 -91.497 -12.648 36.605 1.00 0.00 H ATOM 1587 HH21 ARG A 792 -92.541 -11.847 35.374 1.00 0.00 H ATOM 1588 H ARG A 792 -93.796 -5.717 34.547 1.00 0.00 H ATOM 1589 N LYS A 793 -96.719 -5.470 33.013 1.00 21.55 N ATOM 1590 CA LYS A 793 -97.865 -4.984 32.261 1.00 26.26 C ATOM 1591 C LYS A 793 -97.444 -4.835 30.804 1.00 25.00 C ATOM 1592 O LYS A 793 -96.830 -3.832 30.419 1.00 23.87 O ATOM 1593 CB LYS A 793 -98.384 -3.672 32.820 1.00 24.37 C ATOM 1594 CG LYS A 793 -99.831 -3.460 32.417 1.00 27.37 C ATOM 1595 CD LYS A 793 -100.250 -2.020 32.485 1.00 36.57 C ATOM 1596 CE LYS A 793 -101.776 -1.933 32.495 1.00 34.78 C ATOM 1597 NZ LYS A 793 -102.412 -2.809 31.457 1.00 39.18 N ATOM 1598 HZ1 LYS A 793 -102.082 -2.522 30.513 1.00 0.00 H ATOM 1599 HZ2 LYS A 793 -102.147 -3.800 31.632 1.00 0.00 H ATOM 1600 HZ3 LYS A 793 -103.446 -2.711 31.509 1.00 0.00 H ATOM 1601 H LYS A 793 -96.087 -4.791 33.484 1.00 0.00 H ATOM 1602 N PHE A 794 -97.754 -5.841 29.996 1.00 26.03 N ATOM 1603 CA PHE A 794 -97.524 -5.785 28.553 1.00 24.05 C ATOM 1604 C PHE A 794 -98.840 -5.456 27.867 1.00 23.22 C ATOM 1605 O PHE A 794 -99.816 -6.198 28.014 1.00 24.21 O ATOM 1606 CB PHE A 794 -96.974 -7.108 28.018 1.00 20.57 C ATOM 1607 CG PHE A 794 -95.557 -7.400 28.438 1.00 27.27 C ATOM 1608 CD1 PHE A 794 -94.498 -7.124 27.587 1.00 25.35 C ATOM 1609 CD2 PHE A 794 -95.286 -7.958 29.686 1.00 29.67 C ATOM 1610 CE1 PHE A 794 -93.200 -7.405 27.962 1.00 24.52 C ATOM 1611 CE2 PHE A 794 -93.981 -8.237 30.081 1.00 27.19 C ATOM 1612 CZ PHE A 794 -92.939 -7.962 29.224 1.00 33.90 C ATOM 1613 H PHE A 794 -98.176 -6.700 30.404 1.00 0.00 H ATOM 1614 N THR A 795 -98.862 -4.359 27.104 1.00 26.31 N ATOM 1615 CA THR A 795 -100.034 -3.935 26.341 1.00 21.82 C ATOM 1616 C THR A 795 -99.575 -3.423 24.975 1.00 25.29 C ATOM 1617 O THR A 795 -98.382 -3.371 24.679 1.00 21.80 O ATOM 1618 CB THR A 795 -100.792 -2.827 27.066 1.00 23.47 C ATOM 1619 OG1 THR A 795 -99.925 -1.693 27.188 1.00 21.52 O ATOM 1620 CG2 THR A 795 -101.248 -3.300 28.475 1.00 25.98 C ATOM 1621 HG1 THR A 795 -99.120 -1.948 27.705 1.00 0.00 H ATOM 1622 H THR A 795 -98.001 -3.778 27.051 1.00 0.00 H ATOM 1623 N SER A 796 -100.528 -3.003 24.140 1.00 20.77 N ATOM 1624 CA SER A 796 -100.115 -2.396 22.884 1.00 25.72 C ATOM 1625 C SER A 796 -99.326 -1.108 23.106 1.00 25.22 C ATOM 1626 O SER A 796 -98.548 -0.715 22.230 1.00 24.03 O ATOM 1627 CB SER A 796 -101.335 -2.153 21.995 1.00 25.30 C ATOM 1628 OG SER A 796 -101.786 -3.403 21.486 1.00 28.97 O ATOM 1629 HG SER A 796 -101.062 -3.823 20.957 1.00 0.00 H ATOM 1630 H SER A 796 -101.535 -3.106 24.380 1.00 0.00 H ATOM 1631 N ALA A 797 -99.494 -0.459 24.267 1.00 25.45 N ATOM 1632 CA ALA A 797 -98.721 0.737 24.584 1.00 23.26 C ATOM 1633 C ALA A 797 -97.267 0.404 24.925 1.00 21.79 C ATOM 1634 O ALA A 797 -96.369 1.208 24.645 1.00 18.99 O ATOM 1635 CB ALA A 797 -99.380 1.497 25.738 1.00 21.90 C ATOM 1636 H ALA A 797 -100.188 -0.815 24.955 1.00 0.00 H ATOM 1637 N SER A 798 -96.999 -0.762 25.528 1.00 17.85 N ATOM 1638 CA SER A 798 -95.599 -1.131 25.694 1.00 21.77 C ATOM 1639 C SER A 798 -94.976 -1.578 24.372 1.00 21.03 C ATOM 1640 O SER A 798 -93.763 -1.419 24.188 1.00 21.56 O ATOM 1641 CB SER A 798 -95.433 -2.190 26.789 1.00 22.49 C ATOM 1642 OG SER A 798 -96.261 -3.305 26.601 1.00 22.64 O ATOM 1643 HG SER A 798 -96.046 -3.732 25.734 1.00 0.00 H ATOM 1644 H SER A 798 -97.763 -1.382 25.866 1.00 0.00 H ATOM 1645 N ASP A 799 -95.776 -2.125 23.448 1.00 21.02 N ATOM 1646 CA ASP A 799 -95.293 -2.331 22.082 1.00 23.91 C ATOM 1647 C ASP A 799 -94.923 -1.007 21.415 1.00 21.35 C ATOM 1648 O ASP A 799 -93.954 -0.944 20.649 1.00 17.32 O ATOM 1649 CB ASP A 799 -96.338 -3.059 21.224 1.00 25.07 C ATOM 1650 CG ASP A 799 -96.434 -4.560 21.512 1.00 21.63 C ATOM 1651 OD1 ASP A 799 -95.508 -5.161 22.110 1.00 21.60 O ATOM 1652 OD2 ASP A 799 -97.432 -5.160 21.075 1.00 22.67 O ATOM 1653 H ASP A 799 -96.745 -2.405 23.702 1.00 0.00 H ATOM 1654 N VAL A 800 -95.697 0.056 21.674 1.00 18.49 N ATOM 1655 CA VAL A 800 -95.373 1.375 21.121 1.00 20.74 C ATOM 1656 C VAL A 800 -94.006 1.849 21.606 1.00 17.24 C ATOM 1657 O VAL A 800 -93.231 2.444 20.848 1.00 18.68 O ATOM 1658 CB VAL A 800 -96.474 2.397 21.475 1.00 21.36 C ATOM 1659 CG1 VAL A 800 -95.970 3.817 21.245 1.00 20.07 C ATOM 1660 CG2 VAL A 800 -97.712 2.140 20.626 1.00 26.44 C ATOM 1661 H VAL A 800 -96.538 -0.056 22.275 1.00 0.00 H ATOM 1662 N TRP A 801 -93.707 1.630 22.886 1.00 17.77 N ATOM 1663 CA TRP A 801 -92.356 1.881 23.386 1.00 21.48 C ATOM 1664 C TRP A 801 -91.318 1.104 22.577 1.00 16.50 C ATOM 1665 O TRP A 801 -90.322 1.674 22.119 1.00 16.99 O ATOM 1666 CB TRP A 801 -92.277 1.519 24.875 1.00 19.56 C ATOM 1667 CG TRP A 801 -90.878 1.713 25.478 1.00 21.57 C ATOM 1668 CD1 TRP A 801 -89.772 0.945 25.245 1.00 18.66 C ATOM 1669 CD2 TRP A 801 -90.476 2.718 26.414 1.00 19.77 C ATOM 1670 NE1 TRP A 801 -88.688 1.427 25.950 1.00 20.73 N ATOM 1671 CE2 TRP A 801 -89.098 2.505 26.692 1.00 22.55 C ATOM 1672 CE3 TRP A 801 -91.139 3.779 27.043 1.00 21.35 C ATOM 1673 CZ2 TRP A 801 -88.374 3.318 27.561 1.00 21.24 C ATOM 1674 CZ3 TRP A 801 -90.403 4.595 27.932 1.00 24.76 C ATOM 1675 CH2 TRP A 801 -89.041 4.355 28.170 1.00 23.90 C ATOM 1676 HE1 TRP A 801 -87.724 1.039 25.923 1.00 0.00 H ATOM 1677 H TRP A 801 -94.440 1.278 23.534 1.00 0.00 H ATOM 1678 N SER A 802 -91.522 -0.211 22.412 1.00 16.30 N ATOM 1679 CA SER A 802 -90.577 -1.009 21.628 1.00 19.41 C ATOM 1680 C SER A 802 -90.442 -0.476 20.207 1.00 20.15 C ATOM 1681 O SER A 802 -89.334 -0.460 19.642 1.00 19.40 O ATOM 1682 CB SER A 802 -91.010 -2.470 21.594 1.00 19.65 C ATOM 1683 OG SER A 802 -91.210 -2.964 22.898 1.00 18.52 O ATOM 1684 HG SER A 802 -90.365 -2.893 23.410 1.00 0.00 H ATOM 1685 H SER A 802 -92.353 -0.665 22.842 1.00 0.00 H ATOM 1686 N PHE A 803 -91.551 -0.007 19.619 1.00 16.53 N ATOM 1687 CA PHE A 803 -91.493 0.526 18.261 1.00 12.97 C ATOM 1688 C PHE A 803 -90.599 1.756 18.190 1.00 16.48 C ATOM 1689 O PHE A 803 -89.891 1.971 17.192 1.00 15.88 O ATOM 1690 CB PHE A 803 -92.906 0.870 17.752 1.00 17.25 C ATOM 1691 CG PHE A 803 -92.904 1.483 16.357 1.00 18.17 C ATOM 1692 CD1 PHE A 803 -92.768 0.679 15.242 1.00 17.54 C ATOM 1693 CD2 PHE A 803 -92.978 2.857 16.180 1.00 17.49 C ATOM 1694 CE1 PHE A 803 -92.717 1.232 13.958 1.00 19.92 C ATOM 1695 CE2 PHE A 803 -92.932 3.411 14.905 1.00 19.63 C ATOM 1696 CZ PHE A 803 -92.791 2.597 13.799 1.00 18.32 C ATOM 1697 H PHE A 803 -92.456 -0.023 20.132 1.00 0.00 H ATOM 1698 N GLY A 804 -90.635 2.589 19.228 1.00 17.85 N ATOM 1699 CA GLY A 804 -89.715 3.709 19.296 1.00 17.99 C ATOM 1700 C GLY A 804 -88.269 3.256 19.263 1.00 18.21 C ATOM 1701 O GLY A 804 -87.435 3.859 18.575 1.00 16.76 O ATOM 1702 H GLY A 804 -91.324 2.437 19.992 1.00 0.00 H ATOM 1703 N ILE A 805 -87.954 2.169 19.987 1.00 17.69 N ATOM 1704 CA ILE A 805 -86.607 1.598 19.913 1.00 18.83 C ATOM 1705 C ILE A 805 -86.308 1.137 18.486 1.00 19.19 C ATOM 1706 O ILE A 805 -85.238 1.415 17.948 1.00 20.09 O ATOM 1707 CB ILE A 805 -86.433 0.457 20.938 1.00 18.66 C ATOM 1708 CG1 ILE A 805 -86.886 0.888 22.361 1.00 19.28 C ATOM 1709 CG2 ILE A 805 -84.961 -0.030 20.964 1.00 21.26 C ATOM 1710 CD1 ILE A 805 -86.004 1.993 23.055 1.00 17.34 C ATOM 1711 H ILE A 805 -88.669 1.731 20.602 1.00 0.00 H ATOM 1712 N VAL A 806 -87.259 0.462 17.837 1.00 20.32 N ATOM 1713 CA VAL A 806 -87.054 0.025 16.451 1.00 20.05 C ATOM 1714 C VAL A 806 -86.781 1.216 15.533 1.00 18.52 C ATOM 1715 O VAL A 806 -85.898 1.157 14.666 1.00 22.15 O ATOM 1716 CB VAL A 806 -88.265 -0.791 15.954 1.00 18.89 C ATOM 1717 CG1 VAL A 806 -88.080 -1.170 14.479 1.00 21.53 C ATOM 1718 CG2 VAL A 806 -88.430 -2.046 16.764 1.00 18.28 C ATOM 1719 H VAL A 806 -88.155 0.243 18.318 1.00 0.00 H ATOM 1720 N MET A 807 -87.550 2.304 15.687 1.00 16.11 N ATOM 1721 CA MET A 807 -87.251 3.533 14.960 1.00 18.28 C ATOM 1722 C MET A 807 -85.792 3.914 15.137 1.00 21.07 C ATOM 1723 O MET A 807 -85.101 4.249 14.167 1.00 21.33 O ATOM 1724 CB MET A 807 -88.146 4.685 15.443 1.00 20.05 C ATOM 1725 CG MET A 807 -89.657 4.552 15.175 1.00 20.15 C ATOM 1726 SD MET A 807 -90.595 6.003 15.788 1.00 25.14 S ATOM 1727 CE MET A 807 -90.046 7.261 14.647 1.00 23.30 C ATOM 1728 H MET A 807 -88.367 2.271 16.330 1.00 0.00 H ATOM 1729 N TRP A 808 -85.303 3.852 16.376 1.00 20.16 N ATOM 1730 CA TRP A 808 -83.931 4.250 16.644 1.00 21.38 C ATOM 1731 C TRP A 808 -82.945 3.266 16.002 1.00 19.86 C ATOM 1732 O TRP A 808 -81.943 3.687 15.410 1.00 21.19 O ATOM 1733 CB TRP A 808 -83.748 4.396 18.160 1.00 19.15 C ATOM 1734 CG TRP A 808 -82.459 5.026 18.568 1.00 22.05 C ATOM 1735 CD1 TRP A 808 -82.208 6.357 18.772 1.00 21.59 C ATOM 1736 CD2 TRP A 808 -81.237 4.341 18.819 1.00 18.70 C ATOM 1737 NE1 TRP A 808 -80.896 6.534 19.158 1.00 22.58 N ATOM 1738 CE2 TRP A 808 -80.275 5.312 19.177 1.00 21.49 C ATOM 1739 CE3 TRP A 808 -80.860 2.995 18.787 1.00 20.88 C ATOM 1740 CZ2 TRP A 808 -78.960 4.977 19.494 1.00 21.60 C ATOM 1741 CZ3 TRP A 808 -79.548 2.662 19.102 1.00 24.34 C ATOM 1742 CH2 TRP A 808 -78.615 3.653 19.449 1.00 25.06 C ATOM 1743 HE1 TRP A 808 -80.451 7.444 19.395 1.00 0.00 H ATOM 1744 H TRP A 808 -85.906 3.517 17.154 1.00 0.00 H ATOM 1745 N GLU A 809 -83.247 1.960 16.049 1.00 18.52 N ATOM 1746 CA GLU A 809 -82.422 0.961 15.365 1.00 20.11 C ATOM 1747 C GLU A 809 -82.325 1.227 13.864 1.00 19.69 C ATOM 1748 O GLU A 809 -81.253 1.064 13.270 1.00 21.58 O ATOM 1749 CB GLU A 809 -82.989 -0.437 15.575 1.00 21.14 C ATOM 1750 CG GLU A 809 -82.827 -1.042 16.960 1.00 20.98 C ATOM 1751 CD GLU A 809 -83.328 -2.475 16.968 1.00 23.46 C ATOM 1752 OE1 GLU A 809 -82.475 -3.399 16.844 1.00 23.73 O ATOM 1753 OE2 GLU A 809 -84.566 -2.674 17.045 1.00 18.12 O ATOM 1754 H GLU A 809 -84.084 1.650 16.582 1.00 0.00 H ATOM 1755 N VAL A 810 -83.440 1.599 13.229 1.00 17.33 N ATOM 1756 CA VAL A 810 -83.443 1.834 11.783 1.00 23.79 C ATOM 1757 C VAL A 810 -82.678 3.110 11.442 1.00 24.67 C ATOM 1758 O VAL A 810 -81.864 3.131 10.510 1.00 22.22 O ATOM 1759 CB VAL A 810 -84.885 1.888 11.236 1.00 20.13 C ATOM 1760 CG1 VAL A 810 -84.884 2.319 9.757 1.00 22.96 C ATOM 1761 CG2 VAL A 810 -85.578 0.541 11.379 1.00 19.28 C ATOM 1762 H VAL A 810 -84.320 1.724 13.770 1.00 0.00 H ATOM 1763 N MET A 811 -82.940 4.185 12.153 1.00 20.64 N ATOM 1764 CA MET A 811 -82.291 5.445 11.917 1.00 20.69 C ATOM 1765 C MET A 811 -80.775 5.420 12.162 1.00 25.47 C ATOM 1766 O MET A 811 -80.073 6.189 11.621 1.00 26.31 O ATOM 1767 CB MET A 811 -82.958 6.567 12.681 1.00 20.15 C ATOM 1768 CG MET A 811 -84.402 6.830 12.298 1.00 19.50 C ATOM 1769 SD MET A 811 -84.774 6.820 10.550 1.00 27.39 S ATOM 1770 CE MET A 811 -83.780 8.164 10.101 1.00 30.97 C ATOM 1771 H MET A 811 -83.644 4.121 12.916 1.00 0.00 H ATOM 1772 N THR A 812 -80.302 4.526 13.000 1.00 23.96 N ATOM 1773 CA THR A 812 -78.876 4.372 13.264 1.00 22.02 C ATOM 1774 C THR A 812 -78.250 3.254 12.456 1.00 24.40 C ATOM 1775 O THR A 812 -77.064 2.978 12.647 1.00 23.90 O ATOM 1776 CB THR A 812 -78.605 4.071 14.744 1.00 23.59 C ATOM 1777 OG1 THR A 812 -79.227 2.825 15.099 1.00 20.27 O ATOM 1778 CG2 THR A 812 -79.076 5.211 15.666 1.00 18.98 C ATOM 1779 HG1 THR A 812 -80.203 2.890 14.947 1.00 0.00 H ATOM 1780 H THR A 812 -80.971 3.903 13.495 1.00 0.00 H ATOM 1781 N TYR A 813 -79.034 2.563 11.630 1.00 20.43 N ATOM 1782 CA TYR A 813 -78.565 1.418 10.849 1.00 25.90 C ATOM 1783 C TYR A 813 -78.122 0.263 11.748 1.00 23.32 C ATOM 1784 O TYR A 813 -77.090 -0.372 11.510 1.00 21.58 O ATOM 1785 CB TYR A 813 -77.440 1.824 9.885 1.00 19.62 C ATOM 1786 CG TYR A 813 -77.932 2.624 8.698 1.00 26.75 C ATOM 1787 CD1 TYR A 813 -78.382 1.984 7.538 1.00 26.09 C ATOM 1788 CD2 TYR A 813 -77.963 4.017 8.737 1.00 26.86 C ATOM 1789 CE1 TYR A 813 -78.838 2.715 6.449 1.00 28.33 C ATOM 1790 CE2 TYR A 813 -78.424 4.759 7.654 1.00 30.29 C ATOM 1791 CZ TYR A 813 -78.857 4.102 6.514 1.00 32.01 C ATOM 1792 OH TYR A 813 -79.297 4.834 5.431 1.00 33.99 O ATOM 1793 HH TYR A 813 -80.071 5.388 5.701 1.00 0.00 H ATOM 1794 H TYR A 813 -80.029 2.852 11.536 1.00 0.00 H ATOM 1795 N GLY A 814 -78.907 -0.025 12.783 1.00 20.25 N ATOM 1796 CA GLY A 814 -78.646 -1.197 13.589 1.00 23.45 C ATOM 1797 C GLY A 814 -77.688 -1.015 14.755 1.00 21.56 C ATOM 1798 O GLY A 814 -77.075 -1.997 15.188 1.00 19.47 O ATOM 1799 H GLY A 814 -79.710 0.594 13.013 1.00 0.00 H ATOM 1800 N GLU A 815 -77.544 0.198 15.290 1.00 24.30 N ATOM 1801 CA GLU A 815 -76.816 0.346 16.548 1.00 25.41 C ATOM 1802 C GLU A 815 -77.545 -0.374 17.672 1.00 23.55 C ATOM 1803 O GLU A 815 -78.772 -0.504 17.669 1.00 20.81 O ATOM 1804 CB GLU A 815 -76.625 1.826 16.924 1.00 28.98 C ATOM 1805 CG GLU A 815 -75.649 2.592 16.017 1.00 30.76 C ATOM 1806 CD GLU A 815 -74.214 2.073 16.101 1.00 40.23 C ATOM 1807 OE1 GLU A 815 -73.587 2.218 17.171 1.00 39.05 O ATOM 1808 OE2 GLU A 815 -73.711 1.511 15.094 1.00 43.87 O ATOM 1809 H GLU A 815 -77.946 1.032 14.816 1.00 0.00 H ATOM 1810 N ARG A 816 -76.768 -0.851 18.639 1.00 26.87 N ATOM 1811 CA ARG A 816 -77.311 -1.478 19.839 1.00 26.39 C ATOM 1812 C ARG A 816 -77.814 -0.420 20.811 1.00 26.27 C ATOM 1813 O ARG A 816 -77.044 0.455 21.211 1.00 27.89 O ATOM 1814 CB ARG A 816 -76.253 -2.318 20.532 1.00 34.75 C ATOM 1815 CG ARG A 816 -75.784 -3.495 19.726 1.00 35.98 C ATOM 1816 CD ARG A 816 -76.101 -4.789 20.444 1.00 37.45 C ATOM 1817 NE ARG A 816 -76.448 -5.788 19.446 1.00 44.27 N ATOM 1818 CZ ARG A 816 -77.359 -6.737 19.610 1.00 40.91 C ATOM 1819 NH1 ARG A 816 -78.031 -6.843 20.757 1.00 36.63 N ATOM 1820 NH2 ARG A 816 -77.579 -7.586 18.616 1.00 38.93 N ATOM 1821 HE ARG A 816 -75.944 -5.756 18.537 1.00 0.00 H ATOM 1822 HH12 ARG A 816 -78.744 -7.591 20.875 1.00 0.00 H ATOM 1823 HH11 ARG A 816 -77.842 -6.177 21.534 1.00 0.00 H ATOM 1824 HH22 ARG A 816 -78.289 -8.338 18.722 1.00 0.00 H ATOM 1825 HH21 ARG A 816 -77.042 -7.500 17.730 1.00 0.00 H ATOM 1826 H ARG A 816 -75.736 -0.775 18.537 1.00 0.00 H ATOM 1827 N PRO A 817 -79.073 -0.494 21.240 1.00 28.42 N ATOM 1828 CA PRO A 817 -79.601 0.497 22.190 1.00 26.65 C ATOM 1829 C PRO A 817 -78.820 0.521 23.502 1.00 25.64 C ATOM 1830 O PRO A 817 -78.609 -0.517 24.135 1.00 26.12 O ATOM 1831 CB PRO A 817 -81.049 0.033 22.415 1.00 23.83 C ATOM 1832 CG PRO A 817 -81.371 -0.843 21.233 1.00 26.44 C ATOM 1833 CD PRO A 817 -80.086 -1.483 20.827 1.00 24.69 C ATOM 1834 N TYR A 818 -78.437 1.731 23.929 1.00 24.44 N ATOM 1835 CA TYR A 818 -77.806 1.969 25.240 1.00 31.11 C ATOM 1836 C TYR A 818 -76.447 1.271 25.333 1.00 35.27 C ATOM 1837 O TYR A 818 -76.083 0.711 26.368 1.00 36.12 O ATOM 1838 CB TYR A 818 -78.709 1.532 26.403 1.00 27.58 C ATOM 1839 CG TYR A 818 -80.168 1.928 26.318 1.00 24.64 C ATOM 1840 CD1 TYR A 818 -80.600 3.194 26.716 1.00 23.11 C ATOM 1841 CD2 TYR A 818 -81.120 1.012 25.881 1.00 24.34 C ATOM 1842 CE1 TYR A 818 -81.967 3.540 26.652 1.00 24.91 C ATOM 1843 CE2 TYR A 818 -82.459 1.343 25.806 1.00 23.15 C ATOM 1844 CZ TYR A 818 -82.884 2.598 26.182 1.00 22.30 C ATOM 1845 OH TYR A 818 -84.242 2.876 26.091 1.00 22.52 O ATOM 1846 HH TYR A 818 -84.746 2.248 26.667 1.00 0.00 H ATOM 1847 H TYR A 818 -78.593 2.546 23.302 1.00 0.00 H ATOM 1848 N TRP A 819 -75.667 1.391 24.268 1.00 39.59 N ATOM 1849 CA TRP A 819 -74.723 0.373 23.776 1.00 42.65 C ATOM 1850 C TRP A 819 -73.984 -0.678 24.721 1.00 47.67 C ATOM 1851 O TRP A 819 -74.521 -1.790 24.787 1.00 46.61 O ATOM 1852 CB TRP A 819 -73.619 1.084 22.955 1.00 42.99 C ATOM 1853 CG TRP A 819 -74.056 2.001 21.714 1.00 47.31 C ATOM 1854 CD1 TRP A 819 -73.760 1.800 20.369 1.00 42.87 C ATOM 1855 CD2 TRP A 819 -74.803 3.230 21.762 1.00 46.10 C ATOM 1856 NE1 TRP A 819 -74.277 2.838 19.611 1.00 44.66 N ATOM 1857 CE2 TRP A 819 -74.924 3.717 20.445 1.00 47.61 C ATOM 1858 CE3 TRP A 819 -75.401 3.952 22.790 1.00 50.80 C ATOM 1859 CZ2 TRP A 819 -75.594 4.904 20.156 1.00 40.73 C ATOM 1860 CZ3 TRP A 819 -76.058 5.115 22.512 1.00 45.54 C ATOM 1861 CH2 TRP A 819 -76.147 5.589 21.207 1.00 43.76 C ATOM 1862 HE1 TRP A 819 -74.190 2.936 18.579 1.00 0.00 H ATOM 1863 H TRP A 819 -75.727 2.281 23.733 1.00 0.00 H ATOM 1864 N GLU A 820 -73.060 -0.482 25.649 1.00 46.44 N ATOM 1865 CA GLU A 820 -72.771 0.586 26.538 1.00 50.58 C ATOM 1866 C GLU A 820 -73.207 -0.003 27.957 1.00 45.16 C ATOM 1867 O GLU A 820 -72.547 -0.890 28.487 1.00 47.54 O ATOM 1868 CB GLU A 820 -73.356 1.935 26.126 1.00 48.54 C ATOM 1869 CG GLU A 820 -72.958 3.042 27.065 1.00 56.52 C ATOM 1870 CD GLU A 820 -73.439 4.452 26.739 1.00 63.32 C ATOM 1871 OE1 GLU A 820 -74.161 4.600 25.742 1.00 64.97 O ATOM 1872 OE2 GLU A 820 -73.036 5.430 27.406 1.00 64.89 O ATOM 1873 H GLU A 820 -72.405 -1.284 25.748 1.00 0.00 H ATOM 1874 N LEU A 821 -74.323 0.466 28.486 1.00 40.17 N ATOM 1875 CA LEU A 821 -74.953 0.235 29.773 1.00 35.26 C ATOM 1876 C LEU A 821 -75.249 -1.243 29.981 1.00 35.61 C ATOM 1877 O LEU A 821 -75.518 -1.989 29.035 1.00 37.17 O ATOM 1878 CB LEU A 821 -76.248 1.046 29.871 1.00 34.72 C ATOM 1879 CG LEU A 821 -76.188 2.534 30.262 1.00 38.37 C ATOM 1880 CD1 LEU A 821 -75.073 3.278 29.569 1.00 37.55 C ATOM 1881 CD2 LEU A 821 -77.525 3.218 30.006 1.00 33.23 C ATOM 1882 H LEU A 821 -74.845 1.120 27.868 1.00 0.00 H ATOM 1883 N SER A 822 -75.188 -1.666 31.240 1.00 34.56 N ATOM 1884 CA SER A 822 -75.665 -2.988 31.601 1.00 32.29 C ATOM 1885 C SER A 822 -77.185 -3.004 31.587 1.00 28.82 C ATOM 1886 O SER A 822 -77.838 -1.955 31.594 1.00 28.21 O ATOM 1887 CB SER A 822 -75.170 -3.381 32.990 1.00 29.44 C ATOM 1888 OG SER A 822 -75.692 -2.482 33.953 1.00 25.65 O ATOM 1889 HG SER A 822 -75.369 -2.740 34.853 1.00 0.00 H ATOM 1890 H SER A 822 -74.794 -1.043 31.974 1.00 0.00 H ATOM 1891 N ASN A 823 -77.748 -4.214 31.583 1.00 28.55 N ATOM 1892 CA ASN A 823 -79.202 -4.341 31.676 1.00 33.27 C ATOM 1893 C ASN A 823 -79.744 -3.615 32.899 1.00 35.09 C ATOM 1894 O ASN A 823 -80.764 -2.916 32.821 1.00 32.50 O ATOM 1895 CB ASN A 823 -79.604 -5.812 31.718 1.00 33.84 C ATOM 1896 CG ASN A 823 -79.583 -6.448 30.349 1.00 41.55 C ATOM 1897 OD1 ASN A 823 -79.472 -5.755 29.332 1.00 42.71 O ATOM 1898 ND2 ASN A 823 -79.700 -7.769 30.309 1.00 44.47 N ATOM 1899 HD22 ASN A 823 -79.791 -8.310 31.193 1.00 0.00 H ATOM 1900 HD21 ASN A 823 -79.701 -8.264 29.394 1.00 0.00 H ATOM 1901 H ASN A 823 -77.154 -5.065 31.514 1.00 0.00 H ATOM 1902 N HIS A 824 -79.068 -3.755 34.041 1.00 30.59 N ATOM 1903 CA HIS A 824 -79.549 -3.078 35.235 1.00 32.23 C ATOM 1904 C HIS A 824 -79.435 -1.565 35.093 1.00 29.08 C ATOM 1905 O HIS A 824 -80.314 -0.827 35.548 1.00 34.22 O ATOM 1906 CB HIS A 824 -78.792 -3.561 36.471 1.00 31.79 C ATOM 1907 CG HIS A 824 -79.235 -2.875 37.715 1.00 34.42 C ATOM 1908 ND1 HIS A 824 -78.566 -1.791 38.244 1.00 39.97 N ATOM 1909 CD2 HIS A 824 -80.329 -3.062 38.493 1.00 35.00 C ATOM 1910 CE1 HIS A 824 -79.204 -1.367 39.322 1.00 34.96 C ATOM 1911 NE2 HIS A 824 -80.277 -2.122 39.495 1.00 40.78 N ATOM 1912 H HIS A 824 -78.209 -4.340 34.077 1.00 0.00 H ATOM 1913 N GLU A 825 -78.369 -1.082 34.458 1.00 29.14 N ATOM 1914 CA GLU A 825 -78.214 0.359 34.290 1.00 34.72 C ATOM 1915 C GLU A 825 -79.245 0.937 33.321 1.00 33.26 C ATOM 1916 O GLU A 825 -79.698 2.075 33.500 1.00 29.43 O ATOM 1917 CB GLU A 825 -76.799 0.674 33.825 1.00 35.70 C ATOM 1918 CG GLU A 825 -75.814 0.685 34.969 1.00 34.98 C ATOM 1919 CD GLU A 825 -74.388 0.664 34.505 1.00 39.31 C ATOM 1920 OE1 GLU A 825 -74.143 0.525 33.277 1.00 39.02 O ATOM 1921 OE2 GLU A 825 -73.505 0.806 35.384 1.00 46.29 O ATOM 1922 H GLU A 825 -77.648 -1.731 34.082 1.00 0.00 H ATOM 1923 N VAL A 826 -79.622 0.178 32.287 1.00 28.88 N ATOM 1924 CA VAL A 826 -80.685 0.627 31.394 1.00 27.32 C ATOM 1925 C VAL A 826 -81.981 0.817 32.174 1.00 29.06 C ATOM 1926 O VAL A 826 -82.635 1.866 32.086 1.00 29.98 O ATOM 1927 CB VAL A 826 -80.863 -0.363 30.225 1.00 29.44 C ATOM 1928 CG1 VAL A 826 -82.118 -0.011 29.399 1.00 26.70 C ATOM 1929 CG2 VAL A 826 -79.639 -0.364 29.340 1.00 26.90 C ATOM 1930 H VAL A 826 -79.156 -0.736 32.118 1.00 0.00 H ATOM 1931 N MET A 827 -82.368 -0.192 32.959 1.00 32.47 N ATOM 1932 CA MET A 827 -83.609 -0.084 33.719 1.00 34.29 C ATOM 1933 C MET A 827 -83.567 1.115 34.653 1.00 37.54 C ATOM 1934 O MET A 827 -84.521 1.898 34.718 1.00 38.45 O ATOM 1935 CB MET A 827 -83.868 -1.378 34.489 1.00 36.04 C ATOM 1936 CG MET A 827 -83.807 -2.627 33.612 1.00 39.87 C ATOM 1937 SD MET A 827 -84.267 -4.166 34.476 1.00 49.57 S ATOM 1938 CE MET A 827 -82.714 -5.057 34.534 1.00 39.65 C ATOM 1939 H MET A 827 -81.787 -1.052 33.028 1.00 0.00 H ATOM 1940 N LYS A 828 -82.441 1.306 35.339 1.00 36.87 N ATOM 1941 CA LYS A 828 -82.285 2.459 36.218 1.00 40.29 C ATOM 1942 C LYS A 828 -82.315 3.767 35.433 1.00 39.26 C ATOM 1943 O LYS A 828 -82.938 4.744 35.864 1.00 38.62 O ATOM 1944 CB LYS A 828 -80.981 2.320 37.007 1.00 42.72 C ATOM 1945 CG LYS A 828 -80.365 3.629 37.468 1.00 46.48 C ATOM 1946 CD LYS A 828 -80.820 4.000 38.884 1.00 52.85 C ATOM 1947 CE LYS A 828 -80.046 5.211 39.417 1.00 53.17 C ATOM 1948 NZ LYS A 828 -80.560 5.697 40.727 1.00 50.03 N ATOM 1949 HZ1 LYS A 828 -81.556 5.977 40.625 1.00 0.00 H ATOM 1950 HZ2 LYS A 828 -80.483 4.936 41.432 1.00 0.00 H ATOM 1951 HZ3 LYS A 828 -79.998 6.516 41.036 1.00 0.00 H ATOM 1952 H LYS A 828 -81.662 0.623 35.246 1.00 0.00 H ATOM 1953 N ALA A 829 -81.656 3.803 34.273 1.00 41.09 N ATOM 1954 CA ALA A 829 -81.618 5.024 33.465 1.00 38.13 C ATOM 1955 C ALA A 829 -83.004 5.395 32.948 1.00 39.55 C ATOM 1956 O ALA A 829 -83.423 6.557 33.037 1.00 42.20 O ATOM 1957 CB ALA A 829 -80.641 4.849 32.303 1.00 35.94 C ATOM 1958 H ALA A 829 -81.162 2.951 33.938 1.00 0.00 H ATOM 1959 N ILE A 830 -83.726 4.419 32.391 1.00 36.09 N ATOM 1960 CA ILE A 830 -85.063 4.680 31.868 1.00 37.75 C ATOM 1961 C ILE A 830 -85.952 5.284 32.951 1.00 44.54 C ATOM 1962 O ILE A 830 -86.677 6.260 32.717 1.00 43.03 O ATOM 1963 CB ILE A 830 -85.676 3.389 31.304 1.00 38.54 C ATOM 1964 CG1 ILE A 830 -84.905 2.925 30.073 1.00 33.90 C ATOM 1965 CG2 ILE A 830 -87.099 3.624 30.939 1.00 41.74 C ATOM 1966 CD1 ILE A 830 -84.901 3.924 28.973 1.00 36.12 C ATOM 1967 H ILE A 830 -83.330 3.459 32.329 1.00 0.00 H ATOM 1968 N ASN A 831 -85.906 4.720 34.159 1.00 41.59 N ATOM 1969 CA ASN A 831 -86.792 5.216 35.204 1.00 44.75 C ATOM 1970 C ASN A 831 -86.385 6.599 35.694 1.00 42.81 C ATOM 1971 O ASN A 831 -87.237 7.337 36.200 1.00 48.07 O ATOM 1972 CB ASN A 831 -86.853 4.217 36.362 1.00 43.54 C ATOM 1973 CG ASN A 831 -87.692 3.001 36.021 1.00 47.08 C ATOM 1974 OD1 ASN A 831 -88.788 3.126 35.454 1.00 46.72 O ATOM 1975 ND2 ASN A 831 -87.179 1.812 36.351 1.00 44.88 N ATOM 1976 HD22 ASN A 831 -86.255 1.758 36.826 1.00 0.00 H ATOM 1977 HD21 ASN A 831 -87.703 0.941 36.133 1.00 0.00 H ATOM 1978 H ASN A 831 -85.248 3.938 34.352 1.00 0.00 H ATOM 1979 N ASP A 832 -85.120 6.972 35.541 1.00 41.08 N ATOM 1980 CA ASP A 832 -84.661 8.325 35.823 1.00 42.45 C ATOM 1981 C ASP A 832 -84.928 9.297 34.672 1.00 38.12 C ATOM 1982 O ASP A 832 -84.480 10.447 34.744 1.00 43.22 O ATOM 1983 CB ASP A 832 -83.159 8.319 36.140 1.00 42.94 C ATOM 1984 CG ASP A 832 -82.859 8.039 37.617 1.00 52.14 C ATOM 1985 OD1 ASP A 832 -83.775 8.162 38.466 1.00 52.70 O ATOM 1986 OD2 ASP A 832 -81.692 7.696 37.920 1.00 45.79 O ATOM 1987 H ASP A 832 -84.429 6.270 35.206 1.00 0.00 H ATOM 1988 N GLY A 833 -85.611 8.868 33.611 1.00 40.56 N ATOM 1989 CA GLY A 833 -85.943 9.752 32.511 1.00 35.32 C ATOM 1990 C GLY A 833 -84.912 9.840 31.403 1.00 38.12 C ATOM 1991 O GLY A 833 -85.107 10.624 30.462 1.00 30.22 O ATOM 1992 H GLY A 833 -85.913 7.874 33.571 1.00 0.00 H ATOM 1993 N PHE A 834 -83.820 9.078 31.485 1.00 32.70 N ATOM 1994 CA PHE A 834 -82.828 9.061 30.415 1.00 34.46 C ATOM 1995 C PHE A 834 -83.391 8.353 29.186 1.00 27.23 C ATOM 1996 O PHE A 834 -84.208 7.435 29.297 1.00 29.38 O ATOM 1997 CB PHE A 834 -81.553 8.344 30.869 1.00 36.76 C ATOM 1998 CG PHE A 834 -80.769 9.080 31.921 1.00 43.81 C ATOM 1999 CD1 PHE A 834 -79.444 9.416 31.694 1.00 48.10 C ATOM 2000 CD2 PHE A 834 -81.342 9.413 33.145 1.00 43.39 C ATOM 2001 CE1 PHE A 834 -78.710 10.084 32.654 1.00 49.87 C ATOM 2002 CE2 PHE A 834 -80.608 10.085 34.108 1.00 45.67 C ATOM 2003 CZ PHE A 834 -79.292 10.417 33.861 1.00 41.93 C ATOM 2004 H PHE A 834 -83.673 8.485 32.327 1.00 0.00 H ATOM 2005 N ARG A 835 -82.936 8.772 28.002 1.00 28.10 N ATOM 2006 CA ARG A 835 -83.444 8.210 26.750 1.00 28.34 C ATOM 2007 C ARG A 835 -82.318 8.132 25.724 1.00 28.34 C ATOM 2008 O ARG A 835 -81.265 8.764 25.877 1.00 26.75 O ATOM 2009 CB ARG A 835 -84.615 9.040 26.171 1.00 26.37 C ATOM 2010 CG ARG A 835 -85.871 9.101 27.045 1.00 25.96 C ATOM 2011 CD ARG A 835 -86.475 7.722 27.228 1.00 25.51 C ATOM 2012 NE ARG A 835 -87.761 7.722 27.926 1.00 24.04 N ATOM 2013 CZ ARG A 835 -87.909 7.601 29.240 1.00 25.72 C ATOM 2014 NH1 ARG A 835 -86.845 7.490 30.018 1.00 28.87 N ATOM 2015 NH2 ARG A 835 -89.125 7.592 29.779 1.00 28.77 N ATOM 2016 HE ARG A 835 -88.622 7.824 27.351 1.00 0.00 H ATOM 2017 HH12 ARG A 835 -86.961 7.395 31.047 1.00 0.00 H ATOM 2018 HH11 ARG A 835 -85.892 7.497 29.601 1.00 0.00 H ATOM 2019 HH22 ARG A 835 -89.237 7.497 30.809 1.00 0.00 H ATOM 2020 HH21 ARG A 835 -89.964 7.680 29.171 1.00 0.00 H ATOM 2021 H ARG A 835 -82.206 9.512 27.969 1.00 0.00 H ATOM 2022 N LEU A 836 -82.566 7.356 24.665 1.00 21.25 N ATOM 2023 CA LEU A 836 -81.590 7.194 23.592 1.00 23.78 C ATOM 2024 C LEU A 836 -81.367 8.526 22.869 1.00 24.02 C ATOM 2025 O LEU A 836 -82.304 9.315 22.720 1.00 26.67 O ATOM 2026 CB LEU A 836 -82.060 6.131 22.598 1.00 24.03 C ATOM 2027 CG LEU A 836 -82.064 4.676 23.088 1.00 24.24 C ATOM 2028 CD1 LEU A 836 -82.778 3.783 22.084 1.00 27.33 C ATOM 2029 CD2 LEU A 836 -80.630 4.172 23.356 1.00 22.63 C ATOM 2030 H LEU A 836 -83.476 6.856 24.604 1.00 0.00 H ATOM 2031 N PRO A 837 -80.149 8.799 22.407 1.00 26.02 N ATOM 2032 CA PRO A 837 -79.830 10.121 21.859 1.00 26.90 C ATOM 2033 C PRO A 837 -80.194 10.209 20.383 1.00 29.81 C ATOM 2034 O PRO A 837 -80.558 9.219 19.740 1.00 26.70 O ATOM 2035 CB PRO A 837 -78.309 10.200 22.039 1.00 29.11 C ATOM 2036 CG PRO A 837 -77.878 8.785 21.752 1.00 29.90 C ATOM 2037 CD PRO A 837 -78.975 7.904 22.370 1.00 26.04 C ATOM 2038 N THR A 838 -80.042 11.414 19.846 1.00 26.86 N ATOM 2039 CA THR A 838 -80.418 11.663 18.454 1.00 32.34 C ATOM 2040 C THR A 838 -79.484 10.919 17.501 1.00 27.49 C ATOM 2041 O THR A 838 -78.264 11.075 17.598 1.00 28.46 O ATOM 2042 CB THR A 838 -80.375 13.161 18.169 1.00 33.73 C ATOM 2043 OG1 THR A 838 -81.077 13.853 19.209 1.00 35.14 O ATOM 2044 CG2 THR A 838 -81.043 13.459 16.827 1.00 31.19 C ATOM 2045 HG1 THR A 838 -80.644 13.665 20.079 1.00 0.00 H ATOM 2046 H THR A 838 -79.652 12.188 20.420 1.00 0.00 H ATOM 2047 N PRO A 839 -80.007 10.095 16.591 1.00 28.00 N ATOM 2048 CA PRO A 839 -79.153 9.510 15.547 1.00 26.94 C ATOM 2049 C PRO A 839 -78.659 10.563 14.570 1.00 26.35 C ATOM 2050 O PRO A 839 -79.229 11.648 14.439 1.00 25.83 O ATOM 2051 CB PRO A 839 -80.073 8.505 14.836 1.00 26.36 C ATOM 2052 CG PRO A 839 -81.187 8.249 15.818 1.00 29.16 C ATOM 2053 CD PRO A 839 -81.375 9.558 16.543 1.00 22.98 C ATOM 2054 N MET A 840 -77.568 10.217 13.884 1.00 30.53 N ATOM 2055 CA MET A 840 -77.063 11.031 12.783 1.00 34.58 C ATOM 2056 C MET A 840 -78.087 11.073 11.666 1.00 30.04 C ATOM 2057 O MET A 840 -78.761 10.078 11.394 1.00 31.76 O ATOM 2058 CB MET A 840 -75.758 10.454 12.229 1.00 35.26 C ATOM 2059 CG MET A 840 -74.690 10.139 13.254 1.00 42.28 C ATOM 2060 SD MET A 840 -73.213 9.384 12.528 1.00 53.53 S ATOM 2061 CE MET A 840 -73.333 7.716 13.171 1.00 38.47 C ATOM 2062 H MET A 840 -77.064 9.344 14.141 1.00 0.00 H ATOM 2063 N ASP A 841 -78.197 12.225 11.010 1.00 33.82 N ATOM 2064 CA ASP A 841 -79.073 12.370 9.839 1.00 36.69 C ATOM 2065 C ASP A 841 -80.507 11.943 10.148 1.00 33.40 C ATOM 2066 O ASP A 841 -81.138 11.207 9.380 1.00 29.43 O ATOM 2067 CB ASP A 841 -78.533 11.568 8.650 1.00 42.79 C ATOM 2068 CG ASP A 841 -77.224 12.113 8.110 1.00 45.55 C ATOM 2069 OD1 ASP A 841 -76.771 13.192 8.563 1.00 42.28 O ATOM 2070 OD2 ASP A 841 -76.651 11.445 7.222 1.00 49.83 O ATOM 2071 H ASP A 841 -77.648 13.046 11.335 1.00 0.00 H ATOM 2072 N CYS A 842 -81.025 12.382 11.294 1.00 27.00 N ATOM 2073 CA CYS A 842 -82.375 11.999 11.684 1.00 29.42 C ATOM 2074 C CYS A 842 -83.304 13.202 11.647 1.00 30.19 C ATOM 2075 O CYS A 842 -83.017 14.209 12.304 1.00 29.55 O ATOM 2076 CB CYS A 842 -82.362 11.391 13.096 1.00 29.16 C ATOM 2077 SG CYS A 842 -83.981 10.932 13.720 1.00 29.15 S ATOM 2078 H CYS A 842 -80.463 13.001 11.913 1.00 0.00 H ATOM 2079 N PRO A 843 -84.426 13.143 10.922 1.00 32.36 N ATOM 2080 CA PRO A 843 -85.352 14.285 10.909 1.00 31.77 C ATOM 2081 C PRO A 843 -85.859 14.622 12.306 1.00 31.89 C ATOM 2082 O PRO A 843 -86.082 13.737 13.138 1.00 29.97 O ATOM 2083 CB PRO A 843 -86.493 13.807 10.000 1.00 33.07 C ATOM 2084 CG PRO A 843 -85.890 12.732 9.149 1.00 28.47 C ATOM 2085 CD PRO A 843 -84.893 12.048 10.057 1.00 30.13 C ATOM 2086 N SER A 844 -86.047 15.925 12.554 1.00 32.76 N ATOM 2087 CA SER A 844 -86.642 16.371 13.813 1.00 32.10 C ATOM 2088 C SER A 844 -87.935 15.630 14.111 1.00 30.21 C ATOM 2089 O SER A 844 -88.143 15.155 15.232 1.00 28.17 O ATOM 2090 CB SER A 844 -86.905 17.877 13.781 1.00 32.50 C ATOM 2091 OG SER A 844 -85.729 18.579 13.419 1.00 41.42 O ATOM 2092 HG SER A 844 -85.434 18.285 12.521 1.00 0.00 H ATOM 2093 H SER A 844 -85.766 16.629 11.842 1.00 0.00 H ATOM 2094 N ALA A 845 -88.827 15.536 13.114 1.00 30.09 N ATOM 2095 CA ALA A 845 -90.125 14.905 13.334 1.00 30.15 C ATOM 2096 C ALA A 845 -89.976 13.453 13.752 1.00 28.00 C ATOM 2097 O ALA A 845 -90.781 12.949 14.548 1.00 23.29 O ATOM 2098 CB ALA A 845 -90.982 14.986 12.069 1.00 28.20 C ATOM 2099 H ALA A 845 -88.592 15.916 12.175 1.00 0.00 H ATOM 2100 N ILE A 846 -88.963 12.769 13.213 1.00 25.88 N ATOM 2101 CA ILE A 846 -88.745 11.359 13.523 1.00 27.74 C ATOM 2102 C ILE A 846 -88.200 11.203 14.942 1.00 24.84 C ATOM 2103 O ILE A 846 -88.667 10.350 15.712 1.00 27.22 O ATOM 2104 CB ILE A 846 -87.827 10.740 12.448 1.00 24.95 C ATOM 2105 CG1 ILE A 846 -88.559 10.762 11.098 1.00 29.53 C ATOM 2106 CG2 ILE A 846 -87.420 9.311 12.788 1.00 24.93 C ATOM 2107 CD1 ILE A 846 -89.831 9.907 11.084 1.00 25.05 C ATOM 2108 H ILE A 846 -88.315 13.252 12.558 1.00 0.00 H ATOM 2109 N TYR A 847 -87.244 12.048 15.334 1.00 24.08 N ATOM 2110 CA TYR A 847 -86.755 11.976 16.709 1.00 27.47 C ATOM 2111 C TYR A 847 -87.846 12.388 17.696 1.00 27.50 C ATOM 2112 O TYR A 847 -87.997 11.767 18.756 1.00 22.05 O ATOM 2113 CB TYR A 847 -85.492 12.825 16.890 1.00 25.87 C ATOM 2114 CG TYR A 847 -84.817 12.569 18.230 1.00 26.69 C ATOM 2115 CD1 TYR A 847 -84.300 11.313 18.538 1.00 26.66 C ATOM 2116 CD2 TYR A 847 -84.743 13.564 19.205 1.00 29.65 C ATOM 2117 CE1 TYR A 847 -83.708 11.055 19.766 1.00 26.91 C ATOM 2118 CE2 TYR A 847 -84.140 13.319 20.443 1.00 31.85 C ATOM 2119 CZ TYR A 847 -83.614 12.066 20.711 1.00 31.75 C ATOM 2120 OH TYR A 847 -83.018 11.818 21.938 1.00 29.50 O ATOM 2121 HH TYR A 847 -82.698 10.882 21.965 1.00 0.00 H ATOM 2122 H TYR A 847 -86.853 12.747 14.671 1.00 0.00 H ATOM 2123 N GLN A 848 -88.650 13.398 17.344 1.00 24.48 N ATOM 2124 CA GLN A 848 -89.757 13.789 18.218 1.00 27.58 C ATOM 2125 C GLN A 848 -90.753 12.649 18.402 1.00 26.38 C ATOM 2126 O GLN A 848 -91.218 12.387 19.521 1.00 26.11 O ATOM 2127 CB GLN A 848 -90.455 15.030 17.659 1.00 28.13 C ATOM 2128 CG GLN A 848 -89.656 16.309 17.892 1.00 28.42 C ATOM 2129 CD GLN A 848 -90.229 17.519 17.180 1.00 37.80 C ATOM 2130 OE1 GLN A 848 -91.439 17.647 17.020 1.00 37.24 O ATOM 2131 NE2 GLN A 848 -89.352 18.428 16.765 1.00 41.18 N ATOM 2132 HE22 GLN A 848 -88.335 18.279 16.922 1.00 0.00 H ATOM 2133 HE21 GLN A 848 -89.683 19.288 16.284 1.00 0.00 H ATOM 2134 H GLN A 848 -88.488 13.905 16.450 1.00 0.00 H ATOM 2135 N LEU A 849 -91.083 11.947 17.318 1.00 24.74 N ATOM 2136 CA LEU A 849 -92.037 10.848 17.423 1.00 24.77 C ATOM 2137 C LEU A 849 -91.494 9.718 18.299 1.00 21.42 C ATOM 2138 O LEU A 849 -92.223 9.189 19.148 1.00 21.57 O ATOM 2139 CB LEU A 849 -92.406 10.344 16.026 1.00 19.99 C ATOM 2140 CG LEU A 849 -93.315 9.120 15.890 1.00 23.20 C ATOM 2141 CD1 LEU A 849 -94.706 9.382 16.480 1.00 24.36 C ATOM 2142 CD2 LEU A 849 -93.432 8.752 14.421 1.00 25.44 C ATOM 2143 H LEU A 849 -90.660 12.183 16.397 1.00 0.00 H ATOM 2144 N MET A 850 -90.227 9.325 18.120 1.00 23.36 N ATOM 2145 CA MET A 850 -89.721 8.246 18.975 1.00 22.68 C ATOM 2146 C MET A 850 -89.648 8.689 20.432 1.00 24.94 C ATOM 2147 O MET A 850 -89.894 7.877 21.329 1.00 22.70 O ATOM 2148 CB MET A 850 -88.370 7.694 18.476 1.00 27.16 C ATOM 2149 CG MET A 850 -87.142 8.601 18.442 1.00 25.10 C ATOM 2150 SD MET A 850 -85.645 7.734 17.786 1.00 24.41 S ATOM 2151 CE MET A 850 -85.850 7.902 16.018 1.00 22.25 C ATOM 2152 H MET A 850 -89.622 9.769 17.400 1.00 0.00 H ATOM 2153 N MET A 851 -89.399 9.979 20.684 1.00 22.89 N ATOM 2154 CA MET A 851 -89.399 10.485 22.055 1.00 27.93 C ATOM 2155 C MET A 851 -90.793 10.403 22.678 1.00 29.32 C ATOM 2156 O MET A 851 -90.929 10.127 23.874 1.00 24.40 O ATOM 2157 CB MET A 851 -88.875 11.921 22.070 1.00 28.70 C ATOM 2158 CG MET A 851 -88.347 12.408 23.412 1.00 39.60 C ATOM 2159 SD MET A 851 -86.777 11.694 24.018 1.00 38.52 S ATOM 2160 CE MET A 851 -86.008 11.099 22.556 1.00 33.73 C ATOM 2161 H MET A 851 -89.203 10.629 19.896 1.00 0.00 H ATOM 2162 N GLN A 852 -91.842 10.633 21.878 1.00 26.59 N ATOM 2163 CA GLN A 852 -93.212 10.441 22.358 1.00 28.16 C ATOM 2164 C GLN A 852 -93.529 8.970 22.622 1.00 25.66 C ATOM 2165 O GLN A 852 -94.313 8.652 23.528 1.00 29.16 O ATOM 2166 CB GLN A 852 -94.211 11.012 21.345 1.00 29.39 C ATOM 2167 CG GLN A 852 -94.166 12.523 21.223 1.00 36.17 C ATOM 2168 CD GLN A 852 -94.557 13.211 22.514 1.00 43.34 C ATOM 2169 OE1 GLN A 852 -95.389 12.706 23.276 1.00 47.87 O ATOM 2170 NE2 GLN A 852 -93.955 14.370 22.773 1.00 46.26 N ATOM 2171 HE22 GLN A 852 -93.261 14.757 22.102 1.00 0.00 H ATOM 2172 HE21 GLN A 852 -94.179 14.889 23.646 1.00 0.00 H ATOM 2173 H GLN A 852 -91.681 10.953 20.901 1.00 0.00 H ATOM 2174 N CYS A 853 -92.997 8.057 21.805 1.00 22.73 N ATOM 2175 CA CYS A 853 -93.173 6.636 22.103 1.00 23.09 C ATOM 2176 C CYS A 853 -92.548 6.259 23.445 1.00 24.71 C ATOM 2177 O CYS A 853 -92.936 5.250 24.047 1.00 20.92 O ATOM 2178 CB CYS A 853 -92.549 5.774 21.005 1.00 20.36 C ATOM 2179 SG CYS A 853 -93.229 5.990 19.336 1.00 26.59 S ATOM 2180 H CYS A 853 -92.462 8.354 20.964 1.00 0.00 H ATOM 2181 N TRP A 854 -91.585 7.044 23.923 1.00 22.28 N ATOM 2182 CA TRP A 854 -90.868 6.740 25.149 1.00 25.77 C ATOM 2183 C TRP A 854 -91.364 7.566 26.326 1.00 25.32 C ATOM 2184 O TRP A 854 -90.605 7.803 27.266 1.00 26.63 O ATOM 2185 CB TRP A 854 -89.365 6.953 24.953 1.00 23.64 C ATOM 2186 CG TRP A 854 -88.744 6.121 23.856 1.00 27.24 C ATOM 2187 CD1 TRP A 854 -89.131 4.868 23.428 1.00 22.35 C ATOM 2188 CD2 TRP A 854 -87.613 6.490 23.047 1.00 24.62 C ATOM 2189 NE1 TRP A 854 -88.294 4.440 22.405 1.00 20.96 N ATOM 2190 CE2 TRP A 854 -87.370 5.422 22.146 1.00 23.74 C ATOM 2191 CE3 TRP A 854 -86.800 7.624 22.984 1.00 22.85 C ATOM 2192 CZ2 TRP A 854 -86.330 5.461 21.197 1.00 21.48 C ATOM 2193 CZ3 TRP A 854 -85.765 7.656 22.041 1.00 24.77 C ATOM 2194 CH2 TRP A 854 -85.535 6.574 21.175 1.00 21.91 C ATOM 2195 HE1 TRP A 854 -88.357 3.525 21.915 1.00 0.00 H ATOM 2196 H TRP A 854 -91.337 7.907 23.399 1.00 0.00 H ATOM 2197 N GLN A 855 -92.604 8.043 26.275 1.00 28.87 N ATOM 2198 CA GLN A 855 -93.196 8.689 27.439 1.00 29.70 C ATOM 2199 C GLN A 855 -93.286 7.693 28.585 1.00 29.06 C ATOM 2200 O GLN A 855 -93.781 6.578 28.414 1.00 28.66 O ATOM 2201 CB GLN A 855 -94.591 9.223 27.103 1.00 31.86 C ATOM 2202 CG GLN A 855 -94.618 10.334 26.076 1.00 34.59 C ATOM 2203 CD GLN A 855 -94.405 11.697 26.691 1.00 42.07 C ATOM 2204 OE1 GLN A 855 -93.798 11.825 27.758 1.00 40.85 O ATOM 2205 NE2 GLN A 855 -94.922 12.731 26.028 1.00 43.44 N ATOM 2206 HE22 GLN A 855 -95.426 12.575 25.132 1.00 0.00 H ATOM 2207 HE21 GLN A 855 -94.822 13.694 26.407 1.00 0.00 H ATOM 2208 H GLN A 855 -93.155 7.954 25.398 1.00 0.00 H ATOM 2209 N GLN A 856 -92.806 8.098 29.758 1.00 33.38 N ATOM 2210 CA GLN A 856 -92.880 7.233 30.932 1.00 31.53 C ATOM 2211 C GLN A 856 -94.310 6.765 31.182 1.00 31.48 C ATOM 2212 O GLN A 856 -94.555 5.588 31.479 1.00 26.91 O ATOM 2213 CB GLN A 856 -92.334 7.986 32.149 1.00 33.12 C ATOM 2214 CG GLN A 856 -92.139 7.129 33.395 1.00 40.27 C ATOM 2215 CD GLN A 856 -90.918 6.216 33.306 1.00 42.69 C ATOM 2216 OE1 GLN A 856 -89.952 6.500 32.580 1.00 42.18 O ATOM 2217 NE2 GLN A 856 -90.958 5.114 34.048 1.00 43.00 N ATOM 2218 HE22 GLN A 856 -91.789 4.917 34.642 1.00 0.00 H ATOM 2219 HE21 GLN A 856 -90.159 4.449 34.035 1.00 0.00 H ATOM 2220 H GLN A 856 -92.374 9.040 29.839 1.00 0.00 H ATOM 2221 N GLU A 857 -95.274 7.664 31.024 1.00 29.75 N ATOM 2222 CA GLU A 857 -96.670 7.346 31.279 1.00 37.62 C ATOM 2223 C GLU A 857 -97.290 6.760 30.011 1.00 34.55 C ATOM 2224 O GLU A 857 -97.268 7.402 28.952 1.00 31.93 O ATOM 2225 CB GLU A 857 -97.400 8.598 31.766 1.00 36.86 C ATOM 2226 CG GLU A 857 -96.982 9.127 33.126 1.00 44.74 C ATOM 2227 CD GLU A 857 -97.709 10.424 33.507 1.00 53.23 C ATOM 2228 OE1 GLU A 857 -98.385 10.995 32.632 1.00 53.61 O ATOM 2229 OE2 GLU A 857 -97.607 10.834 34.684 1.00 56.41 O ATOM 2230 H GLU A 857 -95.024 8.623 30.709 1.00 0.00 H ATOM 2231 N ARG A 858 -97.785 5.516 30.129 1.00 32.67 N ATOM 2232 CA ARG A 858 -98.416 4.785 29.033 1.00 31.66 C ATOM 2233 C ARG A 858 -99.403 5.652 28.272 1.00 37.22 C ATOM 2234 O ARG A 858 -99.395 5.695 27.037 1.00 32.85 O ATOM 2235 CB ARG A 858 -99.162 3.564 29.583 1.00 37.29 C ATOM 2236 CG ARG A 858 -98.506 2.231 29.401 1.00 35.66 C ATOM 2237 CD ARG A 858 -99.465 1.108 29.817 1.00 31.42 C ATOM 2238 NE ARG A 858 -100.027 1.321 31.148 1.00 43.77 N ATOM 2239 CZ ARG A 858 -101.329 1.296 31.436 1.00 46.44 C ATOM 2240 NH1 ARG A 858 -102.226 1.046 30.486 1.00 42.23 N ATOM 2241 NH2 ARG A 858 -101.733 1.507 32.685 1.00 46.69 N ATOM 2242 HE ARG A 858 -99.364 1.506 31.928 1.00 0.00 H ATOM 2243 HH12 ARG A 858 -103.239 1.028 30.719 1.00 0.00 H ATOM 2244 HH11 ARG A 858 -101.914 0.868 29.510 1.00 0.00 H ATOM 2245 HH22 ARG A 858 -102.747 1.488 32.914 1.00 0.00 H ATOM 2246 HH21 ARG A 858 -101.035 1.691 33.433 1.00 0.00 H ATOM 2247 H ARG A 858 -97.715 5.047 31.054 1.00 0.00 H ATOM 2248 N ALA A 859 -100.285 6.336 29.003 1.00 38.58 N ATOM 2249 CA ALA A 859 -101.386 7.027 28.354 1.00 35.86 C ATOM 2250 C ALA A 859 -100.917 8.196 27.506 1.00 35.26 C ATOM 2251 O ALA A 859 -101.672 8.654 26.647 1.00 37.80 O ATOM 2252 CB ALA A 859 -102.398 7.502 29.391 1.00 36.97 C ATOM 2253 H ALA A 859 -100.184 6.375 30.037 1.00 0.00 H ATOM 2254 N ARG A 860 -99.697 8.684 27.713 1.00 37.34 N ATOM 2255 CA ARG A 860 -99.172 9.766 26.888 1.00 36.41 C ATOM 2256 C ARG A 860 -98.471 9.267 25.633 1.00 35.68 C ATOM 2257 O ARG A 860 -98.101 10.082 24.779 1.00 40.68 O ATOM 2258 CB ARG A 860 -98.217 10.646 27.706 1.00 34.16 C ATOM 2259 CG ARG A 860 -98.889 11.263 28.929 1.00 41.56 C ATOM 2260 CD ARG A 860 -98.109 12.438 29.488 1.00 45.02 C ATOM 2261 NE ARG A 860 -98.543 12.753 30.847 1.00 55.74 N ATOM 2262 CZ ARG A 860 -99.598 13.510 31.147 1.00 59.73 C ATOM 2263 NH1 ARG A 860 -100.336 14.044 30.181 1.00 59.21 N ATOM 2264 NH2 ARG A 860 -99.912 13.735 32.420 1.00 62.05 N ATOM 2265 HE ARG A 860 -97.990 12.359 31.635 1.00 0.00 H ATOM 2266 HH12 ARG A 860 -101.158 14.634 30.421 1.00 0.00 H ATOM 2267 HH11 ARG A 860 -100.092 13.872 29.185 1.00 0.00 H ATOM 2268 HH22 ARG A 860 -100.735 14.325 32.656 1.00 0.00 H ATOM 2269 HH21 ARG A 860 -99.335 13.320 33.179 1.00 0.00 H ATOM 2270 H ARG A 860 -99.109 8.288 28.474 1.00 0.00 H ATOM 2271 N ARG A 861 -98.301 7.968 25.480 1.00 32.08 N ATOM 2272 CA ARG A 861 -97.724 7.495 24.230 1.00 31.17 C ATOM 2273 C ARG A 861 -98.755 7.566 23.101 1.00 28.77 C ATOM 2274 O ARG A 861 -99.951 7.385 23.330 1.00 27.66 O ATOM 2275 CB ARG A 861 -97.216 6.063 24.389 1.00 25.08 C ATOM 2276 CG ARG A 861 -95.987 5.970 25.304 1.00 24.48 C ATOM 2277 CD ARG A 861 -95.636 4.543 25.701 1.00 25.47 C ATOM 2278 NE ARG A 861 -95.016 4.526 27.029 1.00 24.06 N ATOM 2279 CZ ARG A 861 -94.909 3.456 27.810 1.00 23.36 C ATOM 2280 NH1 ARG A 861 -95.359 2.273 27.403 1.00 20.98 N ATOM 2281 NH2 ARG A 861 -94.347 3.576 29.019 1.00 28.92 N ATOM 2282 HE ARG A 861 -94.629 5.422 27.389 1.00 0.00 H ATOM 2283 HH12 ARG A 861 -95.270 1.442 28.022 1.00 0.00 H ATOM 2284 HH11 ARG A 861 -95.800 2.179 26.466 1.00 0.00 H ATOM 2285 HH22 ARG A 861 -94.259 2.744 29.637 1.00 0.00 H ATOM 2286 HH21 ARG A 861 -93.998 4.501 29.341 1.00 0.00 H ATOM 2287 H ARG A 861 -98.571 7.301 26.231 1.00 0.00 H ATOM 2288 N PRO A 862 -98.316 7.827 21.873 1.00 29.11 N ATOM 2289 CA PRO A 862 -99.233 7.742 20.729 1.00 30.91 C ATOM 2290 C PRO A 862 -99.688 6.311 20.492 1.00 29.23 C ATOM 2291 O PRO A 862 -99.015 5.346 20.859 1.00 26.34 O ATOM 2292 CB PRO A 862 -98.390 8.254 19.553 1.00 25.57 C ATOM 2293 CG PRO A 862 -96.964 7.989 19.969 1.00 31.11 C ATOM 2294 CD PRO A 862 -96.935 8.161 21.469 1.00 27.00 C ATOM 2295 N LYS A 863 -100.853 6.181 19.862 1.00 27.35 N ATOM 2296 CA LYS A 863 -101.290 4.884 19.369 1.00 28.87 C ATOM 2297 C LYS A 863 -100.577 4.557 18.069 1.00 24.94 C ATOM 2298 O LYS A 863 -100.004 5.423 17.413 1.00 24.89 O ATOM 2299 CB LYS A 863 -102.797 4.876 19.123 1.00 33.05 C ATOM 2300 CG LYS A 863 -103.517 4.974 20.407 1.00 36.32 C ATOM 2301 CD LYS A 863 -104.977 4.914 20.124 1.00 50.72 C ATOM 2302 CE LYS A 863 -105.494 6.154 19.373 1.00 50.05 C ATOM 2303 NZ LYS A 863 -105.297 7.360 20.244 1.00 52.71 N ATOM 2304 HZ1 LYS A 863 -105.827 7.236 21.130 1.00 0.00 H ATOM 2305 HZ2 LYS A 863 -104.285 7.471 20.456 1.00 0.00 H ATOM 2306 HZ3 LYS A 863 -105.643 8.205 19.747 1.00 0.00 H ATOM 2307 H LYS A 863 -101.457 7.015 19.721 1.00 0.00 H ATOM 2308 N PHE A 864 -100.639 3.289 17.686 1.00 26.24 N ATOM 2309 CA PHE A 864 -100.103 2.919 16.384 1.00 27.55 C ATOM 2310 C PHE A 864 -100.845 3.621 15.255 1.00 28.50 C ATOM 2311 O PHE A 864 -100.228 3.993 14.250 1.00 29.61 O ATOM 2312 CB PHE A 864 -100.136 1.406 16.222 1.00 25.17 C ATOM 2313 CG PHE A 864 -98.979 0.717 16.905 1.00 24.06 C ATOM 2314 CD1 PHE A 864 -97.676 0.976 16.491 1.00 22.22 C ATOM 2315 CD2 PHE A 864 -99.192 -0.170 17.962 1.00 20.60 C ATOM 2316 CE1 PHE A 864 -96.589 0.364 17.113 1.00 23.48 C ATOM 2317 CE2 PHE A 864 -98.116 -0.806 18.584 1.00 21.34 C ATOM 2318 CZ PHE A 864 -96.815 -0.533 18.165 1.00 24.53 C ATOM 2319 H PHE A 864 -101.064 2.570 18.306 1.00 0.00 H ATOM 2320 N ALA A 865 -102.156 3.839 15.413 1.00 29.22 N ATOM 2321 CA ALA A 865 -102.896 4.623 14.431 1.00 31.36 C ATOM 2322 C ALA A 865 -102.318 6.026 14.287 1.00 28.93 C ATOM 2323 O ALA A 865 -102.126 6.509 13.165 1.00 28.60 O ATOM 2324 CB ALA A 865 -104.371 4.686 14.818 1.00 30.34 C ATOM 2325 H ALA A 865 -102.650 3.447 16.240 1.00 0.00 H ATOM 2326 N ASP A 866 -102.050 6.705 15.411 1.00 25.29 N ATOM 2327 CA ASP A 866 -101.408 8.015 15.346 1.00 29.51 C ATOM 2328 C ASP A 866 -100.054 7.932 14.645 1.00 29.68 C ATOM 2329 O ASP A 866 -99.706 8.798 13.831 1.00 25.86 O ATOM 2330 CB ASP A 866 -101.235 8.598 16.755 1.00 31.03 C ATOM 2331 CG ASP A 866 -102.515 8.540 17.584 1.00 34.98 C ATOM 2332 OD1 ASP A 866 -103.610 8.697 17.000 1.00 40.31 O ATOM 2333 OD2 ASP A 866 -102.426 8.326 18.818 1.00 34.41 O ATOM 2334 H ASP A 866 -102.301 6.297 16.334 1.00 0.00 H ATOM 2335 N ILE A 867 -99.275 6.892 14.953 1.00 25.10 N ATOM 2336 CA ILE A 867 -97.928 6.768 14.395 1.00 26.00 C ATOM 2337 C ILE A 867 -97.986 6.628 12.878 1.00 28.12 C ATOM 2338 O ILE A 867 -97.277 7.332 12.148 1.00 23.84 O ATOM 2339 CB ILE A 867 -97.191 5.581 15.041 1.00 26.36 C ATOM 2340 CG1 ILE A 867 -96.928 5.857 16.520 1.00 25.53 C ATOM 2341 CG2 ILE A 867 -95.899 5.259 14.272 1.00 23.59 C ATOM 2342 CD1 ILE A 867 -96.463 4.626 17.294 1.00 27.66 C ATOM 2343 H ILE A 867 -99.631 6.159 15.599 1.00 0.00 H ATOM 2344 N VAL A 868 -98.804 5.686 12.384 1.00 28.86 N ATOM 2345 CA VAL A 868 -98.951 5.492 10.941 1.00 29.73 C ATOM 2346 C VAL A 868 -99.373 6.795 10.279 1.00 28.48 C ATOM 2347 O VAL A 868 -98.819 7.194 9.246 1.00 27.99 O ATOM 2348 CB VAL A 868 -99.964 4.363 10.646 1.00 28.63 C ATOM 2349 CG1 VAL A 868 -100.232 4.245 9.132 1.00 31.67 C ATOM 2350 CG2 VAL A 868 -99.487 3.036 11.224 1.00 25.49 C ATOM 2351 H VAL A 868 -99.343 5.083 13.038 1.00 0.00 H ATOM 2352 N SER A 869 -100.340 7.496 10.883 1.00 28.32 N ATOM 2353 CA SER A 869 -100.844 8.730 10.289 1.00 30.10 C ATOM 2354 C SER A 869 -99.738 9.766 10.152 1.00 30.42 C ATOM 2355 O SER A 869 -99.571 10.368 9.086 1.00 28.59 O ATOM 2356 CB SER A 869 -102.000 9.291 11.120 1.00 29.86 C ATOM 2357 OG SER A 869 -103.170 8.528 10.910 1.00 42.31 O ATOM 2358 HG SER A 869 -103.003 7.590 11.179 1.00 0.00 H ATOM 2359 H SER A 869 -100.736 7.158 11.784 1.00 0.00 H ATOM 2360 N ILE A 870 -98.972 9.989 11.227 1.00 31.22 N ATOM 2361 CA ILE A 870 -97.879 10.963 11.186 1.00 28.75 C ATOM 2362 C ILE A 870 -96.840 10.567 10.144 1.00 29.81 C ATOM 2363 O ILE A 870 -96.378 11.400 9.352 1.00 26.72 O ATOM 2364 CB ILE A 870 -97.244 11.112 12.581 1.00 33.45 C ATOM 2365 CG1 ILE A 870 -98.254 11.729 13.552 1.00 31.60 C ATOM 2366 CG2 ILE A 870 -95.968 11.949 12.511 1.00 32.54 C ATOM 2367 CD1 ILE A 870 -97.935 11.471 15.013 1.00 37.19 C ATOM 2368 H ILE A 870 -99.156 9.462 12.105 1.00 0.00 H ATOM 2369 N LEU A 871 -96.429 9.298 10.148 1.00 27.54 N ATOM 2370 CA LEU A 871 -95.430 8.866 9.175 1.00 25.99 C ATOM 2371 C LEU A 871 -95.953 9.029 7.747 1.00 30.37 C ATOM 2372 O LEU A 871 -95.198 9.398 6.844 1.00 29.89 O ATOM 2373 CB LEU A 871 -95.014 7.422 9.460 1.00 24.71 C ATOM 2374 CG LEU A 871 -94.251 7.260 10.793 1.00 26.46 C ATOM 2375 CD1 LEU A 871 -93.961 5.805 11.103 1.00 25.94 C ATOM 2376 CD2 LEU A 871 -92.951 8.060 10.777 1.00 23.50 C ATOM 2377 H LEU A 871 -96.816 8.623 10.838 1.00 0.00 H ATOM 2378 N ASP A 872 -97.257 8.803 7.537 1.00 32.63 N ATOM 2379 CA ASP A 872 -97.856 9.029 6.219 1.00 32.64 C ATOM 2380 C ASP A 872 -97.753 10.495 5.788 1.00 34.96 C ATOM 2381 O ASP A 872 -97.428 10.790 4.626 1.00 34.18 O ATOM 2382 CB ASP A 872 -99.320 8.579 6.219 1.00 34.52 C ATOM 2383 CG ASP A 872 -99.478 7.090 5.953 1.00 37.74 C ATOM 2384 OD1 ASP A 872 -98.495 6.436 5.540 1.00 41.38 O ATOM 2385 OD2 ASP A 872 -100.598 6.567 6.140 1.00 38.82 O ATOM 2386 H ASP A 872 -97.852 8.463 8.320 1.00 0.00 H ATOM 2387 N LYS A 873 -98.041 11.429 6.699 1.00 33.03 N ATOM 2388 CA LYS A 873 -97.924 12.844 6.349 1.00 36.51 C ATOM 2389 C LYS A 873 -96.484 13.214 6.021 1.00 36.17 C ATOM 2390 O LYS A 873 -96.227 13.970 5.072 1.00 33.70 O ATOM 2391 CB LYS A 873 -98.447 13.721 7.484 1.00 37.65 C ATOM 2392 CG LYS A 873 -99.935 13.606 7.720 1.00 39.34 C ATOM 2393 CD LYS A 873 -100.363 14.492 8.882 1.00 46.28 C ATOM 2394 CE LYS A 873 -101.867 14.413 9.126 1.00 51.25 C ATOM 2395 NZ LYS A 873 -102.297 15.263 10.281 1.00 57.96 N ATOM 2396 HZ1 LYS A 873 -101.812 14.945 11.144 1.00 0.00 H ATOM 2397 HZ2 LYS A 873 -102.051 16.255 10.090 1.00 0.00 H ATOM 2398 HZ3 LYS A 873 -103.326 15.178 10.409 1.00 0.00 H ATOM 2399 H LYS A 873 -98.347 11.151 7.653 1.00 0.00 H ATOM 2400 N LEU A 874 -95.528 12.682 6.788 1.00 30.60 N ATOM 2401 CA LEU A 874 -94.129 12.958 6.495 1.00 33.55 C ATOM 2402 C LEU A 874 -93.739 12.405 5.127 1.00 33.07 C ATOM 2403 O LEU A 874 -93.027 13.067 4.363 1.00 34.10 O ATOM 2404 CB LEU A 874 -93.243 12.385 7.604 1.00 25.78 C ATOM 2405 CG LEU A 874 -93.565 12.975 8.989 1.00 30.03 C ATOM 2406 CD1 LEU A 874 -92.748 12.310 10.091 1.00 30.74 C ATOM 2407 CD2 LEU A 874 -93.311 14.466 8.991 1.00 29.15 C ATOM 2408 H LEU A 874 -95.782 12.073 7.592 1.00 0.00 H ATOM 2409 N ILE A 875 -94.221 11.206 4.788 1.00 32.43 N ATOM 2410 CA ILE A 875 -93.839 10.586 3.519 1.00 35.66 C ATOM 2411 C ILE A 875 -94.458 11.332 2.340 1.00 37.21 C ATOM 2412 O ILE A 875 -93.857 11.413 1.259 1.00 38.65 O ATOM 2413 CB ILE A 875 -94.227 9.092 3.516 1.00 33.42 C ATOM 2414 CG1 ILE A 875 -93.305 8.294 4.440 1.00 35.90 C ATOM 2415 CG2 ILE A 875 -94.149 8.494 2.108 1.00 38.00 C ATOM 2416 CD1 ILE A 875 -93.651 6.814 4.497 1.00 35.57 C ATOM 2417 H ILE A 875 -94.872 10.710 5.430 1.00 0.00 H ATOM 2418 N ARG A 876 -95.659 11.889 2.521 1.00 37.44 N ATOM 2419 CA ARG A 876 -96.331 12.593 1.436 1.00 41.23 C ATOM 2420 C ARG A 876 -95.781 13.995 1.216 1.00 42.36 C ATOM 2421 O ARG A 876 -95.936 14.539 0.119 1.00 40.30 O ATOM 2422 CB ARG A 876 -97.835 12.648 1.705 1.00 37.23 C ATOM 2423 CG ARG A 876 -98.480 11.302 1.546 1.00 38.43 C ATOM 2424 CD ARG A 876 -99.861 11.267 2.148 1.00 44.10 C ATOM 2425 NE ARG A 876 -100.442 9.936 2.016 1.00 51.87 N ATOM 2426 CZ ARG A 876 -101.469 9.499 2.738 1.00 56.46 C ATOM 2427 NH1 ARG A 876 -101.936 8.268 2.556 1.00 55.92 N ATOM 2428 NH2 ARG A 876 -102.023 10.294 3.651 1.00 50.61 N ATOM 2429 HE ARG A 876 -100.028 9.290 1.315 1.00 0.00 H ATOM 2430 HH12 ARG A 876 -102.740 7.928 3.122 1.00 0.00 H ATOM 2431 HH11 ARG A 876 -101.498 7.645 1.848 1.00 0.00 H ATOM 2432 HH22 ARG A 876 -102.827 9.955 4.217 1.00 0.00 H ATOM 2433 HH21 ARG A 876 -101.652 11.254 3.798 1.00 0.00 H ATOM 2434 H ARG A 876 -96.121 11.819 3.450 1.00 0.00 H ATOM 2435 N ALA A 877 -95.135 14.581 2.226 1.00 37.96 N ATOM 2436 CA ALA A 877 -94.477 15.880 2.113 1.00 38.90 C ATOM 2437 C ALA A 877 -93.006 15.675 2.433 1.00 39.48 C ATOM 2438 O ALA A 877 -92.539 16.056 3.515 1.00 35.74 O ATOM 2439 CB ALA A 877 -95.089 16.919 3.048 1.00 37.97 C ATOM 2440 H ALA A 877 -95.098 14.087 3.141 1.00 0.00 H ATOM 2441 N PRO A 878 -92.244 15.088 1.505 1.00 38.47 N ATOM 2442 CA PRO A 878 -90.902 14.598 1.860 1.00 41.80 C ATOM 2443 C PRO A 878 -89.917 15.697 2.232 1.00 40.53 C ATOM 2444 O PRO A 878 -88.902 15.398 2.874 1.00 40.31 O ATOM 2445 CB PRO A 878 -90.452 13.846 0.599 1.00 41.36 C ATOM 2446 CG PRO A 878 -91.691 13.678 -0.230 1.00 43.53 C ATOM 2447 CD PRO A 878 -92.570 14.827 0.096 1.00 40.23 C ATOM 2448 N ASP A 879 -90.174 16.956 1.876 1.00 40.46 N ATOM 2449 CA ASP A 879 -89.275 18.011 2.332 1.00 44.65 C ATOM 2450 C ASP A 879 -89.303 18.170 3.849 1.00 36.76 C ATOM 2451 O ASP A 879 -88.347 18.696 4.422 1.00 40.53 O ATOM 2452 CB ASP A 879 -89.620 19.336 1.642 1.00 47.61 C ATOM 2453 CG ASP A 879 -89.326 19.307 0.146 1.00 53.19 C ATOM 2454 OD1 ASP A 879 -88.611 18.375 -0.292 1.00 50.14 O ATOM 2455 OD2 ASP A 879 -89.809 20.204 -0.585 1.00 57.06 O ATOM 2456 H ASP A 879 -90.999 17.182 1.285 1.00 0.00 H ATOM 2457 N SER A 880 -90.371 17.710 4.510 1.00 37.87 N ATOM 2458 CA SER A 880 -90.430 17.764 5.968 1.00 38.33 C ATOM 2459 C SER A 880 -89.327 16.930 6.598 1.00 36.79 C ATOM 2460 O SER A 880 -88.899 17.206 7.723 1.00 38.43 O ATOM 2461 CB SER A 880 -91.794 17.276 6.456 1.00 39.43 C ATOM 2462 OG SER A 880 -92.012 15.918 6.083 1.00 38.13 O ATOM 2463 HG SER A 880 -91.979 15.839 5.097 1.00 0.00 H ATOM 2464 H SER A 880 -91.170 17.309 3.979 1.00 0.00 H ATOM 2465 N LEU A 881 -88.870 15.901 5.895 1.00 37.71 N ATOM 2466 CA LEU A 881 -87.804 15.048 6.385 1.00 35.27 C ATOM 2467 C LEU A 881 -86.435 15.686 6.231 1.00 37.04 C ATOM 2468 O LEU A 881 -85.455 15.150 6.765 1.00 35.97 O ATOM 2469 CB LEU A 881 -87.835 13.706 5.652 1.00 30.82 C ATOM 2470 CG LEU A 881 -89.099 12.879 5.853 1.00 31.84 C ATOM 2471 CD1 LEU A 881 -88.933 11.521 5.178 1.00 29.23 C ATOM 2472 CD2 LEU A 881 -89.381 12.728 7.342 1.00 32.20 C ATOM 2473 H LEU A 881 -89.289 15.700 4.965 1.00 0.00 H ATOM 2474 N LYS A 882 -86.345 16.811 5.519 1.00 40.78 N ATOM 2475 CA LYS A 882 -85.063 17.469 5.326 1.00 35.58 C ATOM 2476 C LYS A 882 -84.632 18.280 6.537 1.00 35.52 C ATOM 2477 O LYS A 882 -83.439 18.569 6.671 1.00 36.03 O ATOM 2478 CB LYS A 882 -85.113 18.361 4.083 1.00 39.40 C ATOM 2479 CG LYS A 882 -85.175 17.579 2.778 1.00 43.89 C ATOM 2480 CD LYS A 882 -84.887 18.480 1.581 1.00 46.11 C ATOM 2481 CE LYS A 882 -85.048 17.728 0.263 1.00 58.23 C ATOM 2482 NZ LYS A 882 -84.669 18.562 -0.924 1.00 59.93 N ATOM 2483 HZ1 LYS A 882 -85.275 19.407 -0.960 1.00 0.00 H ATOM 2484 HZ2 LYS A 882 -83.674 18.851 -0.839 1.00 0.00 H ATOM 2485 HZ3 LYS A 882 -84.797 18.005 -1.793 1.00 0.00 H ATOM 2486 H LYS A 882 -87.202 17.222 5.097 1.00 0.00 H ATOM 2487 N THR A 883 -85.560 18.636 7.425 1.00 32.90 N ATOM 2488 CA THR A 883 -85.213 19.294 8.684 1.00 37.72 C ATOM 2489 C THR A 883 -84.727 18.243 9.676 1.00 34.58 C ATOM 2490 O THR A 883 -85.521 17.428 10.157 1.00 33.50 O ATOM 2491 CB THR A 883 -86.414 20.048 9.250 1.00 38.52 C ATOM 2492 OG1 THR A 883 -86.805 21.072 8.338 1.00 41.49 O ATOM 2493 CG2 THR A 883 -86.068 20.680 10.585 1.00 41.48 C ATOM 2494 HG1 THR A 883 -87.584 21.560 8.706 1.00 0.00 H ATOM 2495 H THR A 883 -86.560 18.440 7.216 1.00 0.00 H ATOM 2496 N LEU A 884 -83.432 18.278 9.998 1.00 36.04 N ATOM 2497 CA LEU A 884 -82.777 17.261 10.811 1.00 33.69 C ATOM 2498 C LEU A 884 -82.648 17.714 12.258 1.00 36.14 C ATOM 2499 O LEU A 884 -82.320 18.872 12.531 1.00 37.02 O ATOM 2500 CB LEU A 884 -81.383 16.939 10.264 1.00 35.38 C ATOM 2501 CG LEU A 884 -81.297 16.555 8.780 1.00 32.39 C ATOM 2502 CD1 LEU A 884 -79.835 16.362 8.375 1.00 36.08 C ATOM 2503 CD2 LEU A 884 -82.105 15.294 8.526 1.00 32.68 C ATOM 2504 H LEU A 884 -82.860 19.074 9.650 1.00 0.00 H ATOM 2505 N ALA A 885 -82.898 16.795 13.187 1.00 30.64 N ATOM 2506 CA ALA A 885 -82.568 17.067 14.578 1.00 35.90 C ATOM 2507 C ALA A 885 -81.054 17.163 14.728 1.00 36.04 C ATOM 2508 O ALA A 885 -80.303 16.450 14.053 1.00 32.09 O ATOM 2509 CB ALA A 885 -83.128 15.973 15.489 1.00 36.18 C ATOM 2510 H ALA A 885 -83.327 15.886 12.920 1.00 0.00 H ATOM 2511 N ASP A 886 -80.604 18.072 15.597 1.00 39.31 N ATOM 2512 CA ASP A 886 -79.173 18.215 15.850 1.00 40.58 C ATOM 2513 C ASP A 886 -78.595 16.920 16.415 1.00 41.92 C ATOM 2514 O ASP A 886 -79.198 16.273 17.277 1.00 38.91 O ATOM 2515 CB ASP A 886 -78.915 19.373 16.816 1.00 45.36 C ATOM 2516 CG ASP A 886 -77.426 19.646 17.032 1.00 49.73 C ATOM 2517 OD1 ASP A 886 -76.628 19.511 16.071 1.00 48.31 O ATOM 2518 OD2 ASP A 886 -77.058 19.994 18.174 1.00 45.73 O ATOM 2519 H ASP A 886 -81.279 18.684 16.098 1.00 0.00 H ATOM 2520 N PHE A 887 -77.424 16.540 15.909 1.00 41.66 N ATOM 2521 CA PHE A 887 -76.714 15.339 16.329 1.00 43.37 C ATOM 2522 C PHE A 887 -75.518 15.715 17.194 1.00 50.78 C ATOM 2523 O PHE A 887 -74.814 16.691 16.907 1.00 51.74 O ATOM 2524 CB PHE A 887 -76.227 14.532 15.118 1.00 39.83 C ATOM 2525 CG PHE A 887 -75.273 13.425 15.475 1.00 41.75 C ATOM 2526 CD1 PHE A 887 -75.726 12.278 16.112 1.00 38.17 C ATOM 2527 CD2 PHE A 887 -73.922 13.535 15.187 1.00 46.85 C ATOM 2528 CE1 PHE A 887 -74.853 11.261 16.454 1.00 41.27 C ATOM 2529 CE2 PHE A 887 -73.042 12.521 15.516 1.00 44.94 C ATOM 2530 CZ PHE A 887 -73.507 11.380 16.153 1.00 46.02 C ATOM 2531 H PHE A 887 -76.992 17.134 15.173 1.00 0.00 H ATOM 2532 N ASP A 888 -75.271 14.925 18.234 1.00 48.45 N ATOM 2533 CA ASP A 888 -74.085 15.144 19.065 1.00 52.70 C ATOM 2534 C ASP A 888 -73.511 13.851 19.638 1.00 47.92 C ATOM 2535 O ASP A 888 -72.300 13.627 19.582 1.00 55.72 O ATOM 2536 CB ASP A 888 -74.411 16.107 20.203 1.00 57.18 C ATOM 2537 CG ASP A 888 -73.217 16.957 20.607 1.00 65.02 C ATOM 2538 OD1 ASP A 888 -72.063 16.493 20.434 1.00 61.76 O ATOM 2539 OD2 ASP A 888 -73.442 18.090 21.097 1.00 68.23 O ATOM 2540 H ASP A 888 -75.924 14.147 18.459 1.00 0.00 H TER 2541 ASP A 888 HETATM 2542 O HOH 1 -98.033 10.580 36.820 1.00 46.75 O HETATM 2543 O HOH 2 -78.566 7.659 10.614 1.00 30.04 O HETATM 2544 O HOH 3 -97.545 -9.941 3.450 1.00 34.42 O HETATM 2545 O HOH 4 -96.804 -12.092 21.686 1.00 33.23 O HETATM 2546 O HOH 5 -76.149 -24.742 5.078 1.00 51.76 O HETATM 2547 O HOH 6 -98.052 -12.479 19.042 1.00 44.77 O HETATM 2548 O HOH 7 -90.931 -12.107 -0.285 1.00 39.57 O HETATM 2549 O HOH 8 -106.412 -0.701 18.446 1.00 35.60 O HETATM 2550 O HOH 9 -85.712 0.882 26.197 1.00 21.07 O HETATM 2551 O HOH 10 -91.015 -5.821 25.214 1.00 25.01 O HETATM 2552 O HOH 11 -73.320 -3.310 1.786 1.00 35.75 O HETATM 2553 O HOH 12 -80.117 -2.821 16.181 1.00 28.21 O HETATM 2554 O HOH 13 -95.187 -16.716 17.532 1.00 47.14 O HETATM 2555 O HOH 14 -100.225 -32.252 4.585 1.00 36.63 O HETATM 2556 O HOH 15 -79.710 10.700 26.444 1.00 42.92 O HETATM 2557 O HOH 16 -72.511 -2.278 10.753 1.00 27.44 O HETATM 2558 O HOH 17 -99.938 -4.511 20.073 1.00 22.44 O HETATM 2559 O HOH 18 -98.026 -1.522 28.938 1.00 26.43 O HETATM 2560 O HOH 19 -96.092 -23.525 -10.208 1.00 59.01 O HETATM 2561 O HOH 20 -83.085 -11.961 13.831 1.00 34.20 O HETATM 2562 O HOH 21 -104.089 -4.671 21.672 1.00 37.44 O HETATM 2563 O HOH 22 -79.455 7.384 6.086 1.00 40.72 O HETATM 2564 O HOH 23 -80.643 -9.853 6.975 1.00 31.07 O HETATM 2565 O HOH 24 -74.689 -2.793 36.384 1.00 34.41 O HETATM 2566 O HOH 25 -74.602 3.794 13.199 1.00 39.86 O HETATM 2567 O HOH 26 -74.614 5.853 9.349 1.00 41.66 O HETATM 2568 O HOH 27 -90.557 0.036 2.933 1.00 33.68 O HETATM 2569 O HOH 28 -102.350 8.544 23.537 1.00 43.01 O HETATM 2570 O HOH 29 -88.173 16.760 10.257 1.00 33.29 O HETATM 2571 O HOH 30 -86.054 -0.640 28.349 1.00 21.60 O HETATM 2572 O HOH 31 -82.938 -6.029 17.179 1.00 22.20 O HETATM 2573 O HOH 32 -75.697 18.359 13.801 1.00 49.71 O HETATM 2574 O HOH 33 -97.716 -0.314 4.758 1.00 32.67 O HETATM 2575 O HOH 34 -91.063 -32.679 1.217 1.00 48.22 O HETATM 2576 O HOH 35 -100.215 -13.618 7.714 1.00 34.69 O HETATM 2577 O HOH 36 -74.307 20.634 21.529 1.00 57.10 O HETATM 2578 O HOH 37 -85.467 8.042 -1.909 1.00 34.53 O HETATM 2579 O HOH 38 -76.987 14.751 10.794 1.00 42.08 O HETATM 2580 O HOH 39 -80.391 -7.266 17.341 1.00 30.33 O HETATM 2581 O HOH 40 -79.985 20.170 11.931 1.00 41.52 O HETATM 2582 O HOH 41 -103.466 1.864 16.788 1.00 38.64 O HETATM 2583 O HOH 42 -79.622 13.998 13.027 1.00 34.79 O HETATM 2584 O HOH 43 -92.091 -16.266 -0.987 1.00 37.41 O HETATM 2585 O HOH 44 -76.972 13.014 19.247 1.00 37.40 O HETATM 2586 O HOH 45 -74.281 0.220 11.601 1.00 37.97 O HETATM 2587 O HOH 46 -91.745 10.580 30.359 1.00 40.10 O HETATM 2588 O HOH 47 -89.063 -24.499 13.234 1.00 45.53 O HETATM 2589 O HOH 48 -102.191 -4.605 3.970 1.00 28.29 O HETATM 2590 O HOH 49 -79.144 16.147 20.044 1.00 46.89 O HETATM 2591 O HOH 50 -94.958 -5.165 24.832 1.00 23.44 O HETATM 2592 O HOH 51 -79.384 -8.049 0.946 1.00 32.44 O HETATM 2593 O HOH 52 -74.816 -3.287 -0.245 1.00 39.23 O HETATM 2594 O HOH 53 -92.632 -5.281 22.271 1.00 20.43 O HETATM 2595 O HOH 54 -92.012 -1.616 5.076 1.00 26.49 O HETATM 2596 O HOH 55 -77.567 -11.576 5.637 1.00 48.53 O HETATM 2597 O HOH 56 -98.548 -8.004 0.521 1.00 37.99 O HETATM 2598 O HOH 57 -88.625 -7.229 -6.130 1.00 43.32 O HETATM 2599 O HOH 58 -72.155 -1.841 6.749 1.00 31.15 O HETATM 2600 O HOH 59 -94.860 -35.759 19.738 1.00 42.65 O HETATM 2601 O HOH 60 -95.124 -8.717 -0.308 1.00 34.65 O HETATM 2602 O HOH 61 -80.046 -10.905 14.004 1.00 46.05 O HETATM 2603 O HOH 62 -94.295 1.826 3.641 1.00 33.26 O HETATM 2604 O HOH 63 -81.462 11.218 28.368 1.00 37.15 O HETATM 2605 O HOH 64 -92.300 -3.524 25.541 1.00 22.73 O HETATM 2606 O HOH 65 -81.002 -12.359 8.748 1.00 29.41 O HETATM 2607 O HOH 66 -77.037 -5.776 34.637 1.00 29.74 O HETATM 2608 O HOH 67 -100.329 6.391 31.931 1.00 52.60 O HETATM 2609 O HOH 68 -103.260 -3.840 24.796 1.00 26.13 O HETATM 2610 O HOH 69 -106.475 8.396 17.591 1.00 48.33 O HETATM 2611 O HOH 70 -96.905 -30.161 27.315 1.00 45.50 O HETATM 2612 O HOH 71 -101.591 -15.147 5.950 1.00 44.23 O HETATM 2613 O HOH 72 -94.972 10.577 30.585 1.00 37.97 O HETATM 2614 O HOH 73 -100.007 3.537 22.987 1.00 33.32 O HETATM 2615 O HOH 74 -76.031 -6.635 31.471 1.00 40.18 O HETATM 2616 O HOH 75 -92.360 18.166 0.259 1.00 35.29 O HETATM 2617 O HOH 76 -100.515 -11.311 6.122 1.00 53.33 O HETATM 2618 O HOH 77 -98.119 -10.546 29.870 1.00 47.52 O HETATM 2619 O HOH 78 -92.770 -5.953 -7.051 1.00 38.21 O HETATM 2620 O HOH 79 -85.063 5.530 24.967 1.00 22.83 O HETATM 2621 O HOH 80 -109.382 -10.982 20.945 1.00 44.57 O HETATM 2622 O HOH 81 -96.556 -16.430 20.601 1.00 54.41 O HETATM 2623 O HOH 82 -103.802 5.463 10.895 1.00 35.14 O HETATM 2624 O HOH 83 -93.595 -17.561 24.420 1.00 55.54 O HETATM 2625 O HOH 84 -102.755 -35.855 2.063 1.00 45.26 O HETATM 2626 O HOH 85 -79.334 1.864 -2.238 1.00 40.46 O HETATM 2627 O HOH 86 -106.469 -27.207 2.990 1.00 43.55 O HETATM 2628 O HOH 87 -98.417 15.922 4.275 1.00 38.65 O HETATM 2629 O HOH 88 -93.245 -33.827 6.880 1.00 36.48 O HETATM 2630 O HOH 89 -76.610 7.278 13.860 1.00 30.81 O HETATM 2631 O HOH 90 -72.148 -0.209 3.720 1.00 41.94 O HETATM 2632 O HOH 91 -76.889 -9.922 16.660 1.00 41.98 O HETATM 2633 O HOH 92 -81.786 -6.430 25.969 1.00 25.18 O HETATM 2634 O HOH 93 -84.554 11.139 1.347 1.00 36.06 O HETATM 2635 O HOH 94 -93.328 -36.052 6.183 1.00 39.97 O HETATM 2636 O HOH 95 -81.305 11.136 2.478 1.00 32.12 O HETATM 2637 O HOH 96 -98.833 -12.955 22.125 1.00 44.88 O HETATM 2638 O HOH 97 -94.287 -6.049 -1.788 1.00 28.26 O HETATM 2639 O HOH 98 -100.660 -29.063 -1.586 1.00 39.12 O HETATM 2640 O HOH 99 -80.164 -9.363 19.372 1.00 38.90 O HETATM 2641 O HOH 100 -101.382 -11.274 23.180 1.00 30.77 O HETATM 2642 O HOH 101 -78.928 13.911 21.633 1.00 37.39 O HETATM 2643 O HOH 102 -87.569 2.439 -2.450 1.00 41.35 O HETATM 2644 O HOH 103 -95.478 -38.865 8.349 1.00 35.38 O HETATM 2645 O HOH 104 -102.746 -0.294 7.308 1.00 39.31 O HETATM 2646 O HOH 105 -102.204 1.035 19.434 1.00 24.45 O HETATM 2647 O HOH 106 -93.848 -38.536 6.817 1.00 42.26 O HETATM 2648 O HOH 107 -98.156 4.430 33.299 1.00 45.38 O HETATM 2649 O HOH 108 -94.653 -1.055 3.334 1.00 20.08 O HETATM 2650 O HOH 109 -107.818 -27.608 5.556 1.00 49.97 O HETATM 2651 O HOH 110 -90.696 -9.354 -2.682 1.00 39.18 O HETATM 2652 O HOH 111 -77.590 17.163 12.018 1.00 43.57 O HETATM 2653 O HOH 112 -110.466 -14.614 11.662 1.00 46.07 O HETATM 2654 O HOH 113 -78.084 8.381 27.245 1.00 46.23 O HETATM 2655 O HOH 114 -101.340 1.712 22.243 1.00 33.81 O HETATM 2656 O HOH 115 -101.488 -12.510 4.310 1.00 55.86 O HETATM 2657 O HOH 116 -80.892 20.395 8.780 1.00 50.77 O HETATM 2658 O HOH 117 -103.769 5.840 8.601 1.00 45.26 O HETATM 2659 O HOH 118 -74.796 11.046 19.869 1.00 45.12 O HETATM 2660 O HOH 119 -76.808 -4.987 23.664 1.00 41.22 O HETATM 2661 O HOH 120 -88.511 -35.625 12.765 1.00 44.36 O HETATM 2662 O HOH 121 -95.563 4.243 3.259 1.00 44.85 O HETATM 2663 O HOH 122 -83.700 14.033 24.984 1.00 41.79 O HETATM 2664 O HOH 123 -81.779 12.557 25.727 1.00 42.00 O HETATM 2665 O HOH 124 -82.282 12.858 31.839 1.00 39.76 O HETATM 2666 O HOH 125 -72.350 0.129 39.053 1.00 42.70 O HETATM 2667 O HOH 126 -91.400 5.986 0.653 1.00 43.25 O HETATM 2668 O HOH 127 -91.327 -37.399 13.062 1.00 37.85 O HETATM 2669 O HOH 128 -76.413 7.401 9.402 1.00 42.51 O HETATM 2670 O HOH 129 -77.448 -19.516 7.389 1.00 52.51 O HETATM 2671 O HOH 130 -102.439 -33.115 2.936 1.00 43.41 O HETATM 2672 O HOH 131 -93.181 -36.534 15.371 1.00 41.97 O HETATM 2673 O HOH 132 -70.751 3.340 23.296 1.00 38.56 O HETATM 2674 O HOH 133 -76.285 8.440 25.104 1.00 41.33 O HETATM 2675 O HOH 134 -92.122 -34.949 4.546 1.00 46.76 O HETATM 2676 O HOH 135 -96.781 -40.696 9.697 1.00 44.11 O HETATM 2677 O HOH 136 -79.843 13.243 2.889 1.00 51.40 O HETATM 2678 C13 ZZL A 137 -89.123 -17.003 8.313 1.00 0.04 C HETATM 2679 C12 ZZL A 137 -88.012 -16.612 7.569 1.00 0.02 C HETATM 2680 C11 ZZL A 137 -88.368 -16.095 6.329 1.00 0.02 C HETATM 2681 N10 ZZL A 137 -87.329 -15.675 5.485 1.00 -0.26 N HETATM 2682 C09 ZZL A 137 -86.036 -15.760 5.839 1.00 0.21 C HETATM 2683 N08 ZZL A 137 -85.161 -15.320 4.907 1.00 -0.24 N HETATM 2684 C07 ZZL A 137 -83.844 -15.038 5.095 1.00 0.07 C HETATM 2685 C06 ZZL A 137 -83.131 -14.594 3.978 1.00 -0.03 C HETATM 2686 C05 ZZL A 137 -81.776 -14.281 4.048 1.00 -0.06 C HETATM 2687 C04 ZZL A 137 -81.104 -14.401 5.259 1.00 -0.00 C HETATM 2688 C02 ZZL A 137 -79.753 -14.070 5.346 1.00 0.06 C HETATM 2689 O01 ZZL A 137 -79.013 -14.148 4.337 1.00 -0.56 O HETATM 2690 O03 ZZL A 137 -79.287 -13.643 6.431 1.00 -0.56 O HETATM 2691 C34 ZZL A 137 -81.791 -14.836 6.390 1.00 -0.06 C HETATM 2692 C33 ZZL A 137 -83.149 -15.158 6.301 1.00 -0.03 C HETATM 2693 H13 ZZL A 137 -83.672 -15.507 7.184 1.00 0.05 H HETATM 2694 H14 ZZL A 137 -81.273 -14.925 7.338 1.00 0.06 H HETATM 2695 H6 ZZL A 137 -81.248 -13.945 3.163 1.00 0.06 H HETATM 2696 H7 ZZL A 137 -83.647 -14.490 3.030 1.00 0.05 H HETATM 2697 H8 ZZL A 137 -85.531 -15.184 3.955 1.00 0.22 H HETATM 2698 N32 ZZL A 137 -85.706 -16.297 7.042 1.00 -0.25 N HETATM 2699 C31 ZZL A 137 -86.667 -16.707 7.908 1.00 0.06 C HETATM 2700 C30 ZZL A 137 -86.191 -17.211 9.125 1.00 0.02 C HETATM 2701 C24 ZZL A 137 -86.849 -17.149 10.359 1.00 0.03 C HETATM 2702 C15 ZZL A 137 -88.086 -16.545 10.607 1.00 0.06 C HETATM 2703 N14 ZZL A 137 -89.068 -16.443 9.696 1.00 -0.33 N HETATM 2704 C16 ZZL A 137 -88.284 -15.848 11.816 1.00 0.08 C HETATM 2705 C17 ZZL A 137 -89.310 -16.159 12.711 1.00 0.15 C HETATM 2706 F18 ZZL A 137 -90.189 -17.211 12.485 1.00 -0.18 F HETATM 2707 C19 ZZL A 137 -89.460 -15.419 13.877 1.00 -0.02 C HETATM 2708 C20 ZZL A 137 -88.625 -14.350 14.170 1.00 -0.06 C HETATM 2709 C21 ZZL A 137 -87.613 -14.023 13.288 1.00 -0.02 C HETATM 2710 C22 ZZL A 137 -87.452 -14.762 12.115 1.00 0.15 C HETATM 2711 F23 ZZL A 137 -86.414 -14.401 11.261 1.00 -0.18 F HETATM 2712 H4 ZZL A 137 -86.947 -13.196 13.506 1.00 0.06 H HETATM 2713 H3 ZZL A 137 -88.765 -13.778 15.080 1.00 0.07 H HETATM 2714 H10 ZZL A 137 -90.247 -15.683 14.574 1.00 0.06 H HETATM 2715 C25 ZZL A 137 -86.247 -17.683 11.501 1.00 -0.03 C HETATM 2716 C26 ZZL A 137 -85.000 -18.304 11.396 1.00 0.05 C HETATM 2717 C28 ZZL A 137 -84.348 -18.364 10.166 1.00 -0.04 C HETATM 2718 C29 ZZL A 137 -84.938 -17.813 9.027 1.00 -0.04 C HETATM 2719 H12 ZZL A 137 -84.425 -17.853 8.073 1.00 0.07 H HETATM 2720 H5 ZZL A 137 -83.377 -18.841 10.093 1.00 0.07 H HETATM 2721 CL1 ZZL A 137 -84.231 -19.005 12.813 1.00 -0.07 CL HETATM 2722 H11 ZZL A 137 -86.744 -17.616 12.462 1.00 0.07 H HETATM 2723 H9 ZZL A 137 -89.406 -16.019 6.026 1.00 0.08 H HETATM 2724 H1 ZZL A 137 -89.148 -18.101 8.371 1.00 0.06 H HETATM 2725 H2 ZZL A 137 -90.034 -16.641 7.815 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 274 275 283 284 285 CONECT 283 274 CONECT 284 274 CONECT 285 274 CONECT 1443 1444 1451 1452 1453 CONECT 1451 1443 CONECT 1452 1443 CONECT 1453 1443 CONECT 2678 2679 2703 2724 2725 CONECT 2679 2678 2680 2699 CONECT 2680 2679 2681 2723 CONECT 2681 2680 2682 CONECT 2682 2681 2683 2698 CONECT 2683 2682 2684 2697 CONECT 2684 2683 2685 2692 CONECT 2685 2684 2686 2696 CONECT 2686 2685 2687 2695 CONECT 2687 2686 2688 2691 CONECT 2688 2687 2689 2690 CONECT 2689 2688 CONECT 2690 2688 CONECT 2691 2687 2692 2694 CONECT 2692 2684 2691 2693 CONECT 2693 2692 CONECT 2694 2691 CONECT 2695 2686 CONECT 2696 2685 CONECT 2697 2683 CONECT 2698 2682 2699 CONECT 2699 2679 2698 2700 CONECT 2700 2699 2701 2718 CONECT 2701 2700 2702 2715 CONECT 2702 2701 2703 2704 CONECT 2703 2678 2702 CONECT 2704 2702 2705 2710 CONECT 2705 2704 2706 2707 CONECT 2706 2705 CONECT 2707 2705 2708 2714 CONECT 2708 2707 2709 2713 CONECT 2709 2708 2710 2712 CONECT 2710 2704 2709 2711 CONECT 2711 2710 CONECT 2712 2709 CONECT 2713 2708 CONECT 2714 2707 CONECT 2715 2701 2716 2722 CONECT 2716 2715 2717 2721 CONECT 2717 2716 2718 2720 CONECT 2718 2700 2717 2719 CONECT 2719 2718 CONECT 2720 2717 CONECT 2721 2716 CONECT 2722 2715 CONECT 2723 2680 CONECT 2724 2678 CONECT 2725 2678 MASTER 0 0 0 0 0 0 0 0 2722 3 60 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5ia1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5i9x
RCSB PDB
PDBbind
306aa, >5I9X_1|Chain... *
5i9y
RCSB PDB
PDBbind
306aa, >5I9Y_1|Chain... at 100%
5i9z
RCSB PDB
PDBbind
306aa, >5I9Z_1|Chain... at 100%
5ia0
RCSB PDB
PDBbind
306aa, >5IA0_1|Chains... 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%
5nkd
RCSB PDB
PDBbind
306aa, >5NKD_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
2wtv
RCSB PDB
PDBbind
ZZL
2wtw
RCSB PDB
PDBbind
ZZL
2x81
RCSB PDB
PDBbind
ZZL
Entry Information
PDB ID
5ia1
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Ephrin A2 (EphA2) Receptor Protein Kinase
Ligand Name
ZZL
EC.Number
E.C.2.7.10.1
Resolution
2.04(Å)
Affinity (Kd/Ki/IC50)
Kd=530nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) ACS Chem. Biol. Vol. 11: pp. 3400-3411
Ligand Properties
Formula
C
2
5
H
1
5
ClF
2
N
4
O
2
Molecular Weight
476.862
Exact Mass
476.085
No. of atoms
49
No. of bonds
53
Polar Surface Area
87.47
LOGP Value
6.26 (
Computed with XLOGP3
)
5.38 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 5
Canonical SMILES
Clc1ccc2c(c1)C(=NCc1c2nc(nc1)Nc1ccc(cc1)C(=O)O)c1c(F)cccc1F
InChI String
InChI=1S/C25H15ClF2N4O2/c26-15-6-9-17-18(10-15)23(21-19(27)2-1-3-20(21)28)29-11-14-12-30-25(32-22(14)17)31-16-7-4-13(5-8-16)24(33)34/h1-10,12H,11H2,(H,33,34)(H,30,31,32)
Links to External Databases
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PDBsum
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Pubchem
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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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