Browse entries in the PDBbind-CN Database
HEADER 5BVW_COMPLEX COMPND 5BVW_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 28 ASP PHE PRO ARG SER ARG LEU ARG PHE LYS GLU LYS LEU SEQRES 2 A 28 GLY GLU GLY GLN PHE GLY GLU VAL HIS LEU CYS GLU VAL SEQRES 3 A 28 ASP SER SEQRES 1 A 74 HIS PRO LEU LEU VAL ALA VAL LYS ILE LEU ARG PRO ASP SEQRES 2 A 74 ALA THR LYS ASN ALA ARG ASN ASP PHE LEU LYS GLU VAL SEQRES 3 A 74 LYS ILE MET SER ARG LEU LYS ASP PRO ASN ILE ILE ARG SEQRES 4 A 74 LEU LEU GLY VAL CYS VAL GLN ASP ASP PRO LEU CYS MET SEQRES 5 A 74 ILE THR ASP TYR MET GLU ASN GLY ASP LEU ASN GLN PHE SEQRES 6 A 74 LEU SER ALA HIS GLN LEU GLU ASP LYS SEQRES 1 A 51 PRO THR ILE SER TYR PRO MET LEU LEU HIS VAL ALA ALA SEQRES 2 A 51 GLN ILE ALA SER GLY MET ARG TYR LEU ALA THR LEU ASN SEQRES 3 A 51 PHE VAL HIS ARG ASP LEU ALA THR ARG ASN CYS LEU VAL SEQRES 4 A 51 GLY GLU ASN PHE THR ILE LYS ILE ALA ASP PHE GLY SEQRES 1 A 121 LEU TYR ALA GLY ASP TYR TYR ARG VAL GLN GLY ARG ALA SEQRES 2 A 121 VAL LEU PRO ILE ARG TRP MET ALA TRP GLU CYS ILE LEU SEQRES 3 A 121 MET GLY LYS PHE THR THR ALA SER ASP VAL TRP ALA PHE SEQRES 4 A 121 GLY VAL THR LEU TRP GLU VAL LEU MET LEU CYS ARG ALA SEQRES 5 A 121 GLN PRO PHE GLY GLN LEU THR ASP GLU GLN VAL ILE GLU SEQRES 6 A 121 ASN ALA GLY GLU PHE PHE ARG ASP GLN GLY ARG GLN VAL SEQRES 7 A 121 TYR LEU SER ARG PRO PRO ALA CYS PRO GLN GLY LEU TYR SEQRES 8 A 121 GLU LEU MET LEU ARG CYS TRP SER ARG GLU SER GLU GLN SEQRES 9 A 121 ARG PRO PRO PHE SER GLN LEU HIS ARG PHE LEU ALA GLU SEQRES 10 A 121 ASP ALA LEU ASN HET UNN A 562 60 SSBOND 1 CYS A 691 CYS A 698 ATOM 1 N ASP A 604 36.289 50.040 34.737 1.00 90.26 N ATOM 2 CA ASP A 604 35.354 48.926 34.886 1.00 86.96 C ATOM 3 C ASP A 604 35.218 48.466 36.347 1.00 87.00 C ATOM 4 O ASP A 604 36.176 47.917 36.891 1.00 86.52 O ATOM 5 CB ASP A 604 35.742 47.745 33.963 1.00 88.23 C ATOM 6 CG ASP A 604 35.077 46.417 34.309 1.00 95.81 C ATOM 7 OD1 ASP A 604 33.850 46.287 34.083 1.00 93.14 O ATOM 8 OD2 ASP A 604 35.778 45.522 34.834 1.00103.09 O ATOM 9 HN3 ASP A 604 37.230 49.749 35.071 1.00 0.00 H ATOM 10 HN2 ASP A 604 35.955 50.849 35.299 1.00 0.00 H ATOM 11 HN1 ASP A 604 36.345 50.312 33.735 1.00 0.00 H ATOM 12 N PHE A 605 34.060 48.692 37.006 1.00 81.12 N ATOM 13 CA PHE A 605 32.953 49.582 36.615 1.00 80.71 C ATOM 14 C PHE A 605 32.696 50.514 37.808 1.00 82.77 C ATOM 15 O PHE A 605 32.642 50.014 38.938 1.00 81.24 O ATOM 16 CB PHE A 605 31.668 48.784 36.264 1.00 80.78 C ATOM 17 CG PHE A 605 30.418 49.633 36.125 1.00 83.02 C ATOM 18 CD1 PHE A 605 30.095 50.234 34.914 1.00 87.70 C ATOM 19 CD2 PHE A 605 29.573 49.843 37.210 1.00 84.33 C ATOM 20 CE1 PHE A 605 28.949 51.030 34.792 1.00 89.08 C ATOM 21 CE2 PHE A 605 28.427 50.632 37.083 1.00 87.58 C ATOM 22 CZ PHE A 605 28.123 51.221 35.876 1.00 86.86 C ATOM 23 H PHE A 605 33.935 48.174 37.899 1.00 0.00 H ATOM 24 N PRO A 606 32.527 51.848 37.604 1.00 79.42 N ATOM 25 CA PRO A 606 32.339 52.747 38.762 1.00 79.30 C ATOM 26 C PRO A 606 31.047 52.443 39.523 1.00 77.95 C ATOM 27 O PRO A 606 29.946 52.709 39.026 1.00 77.24 O ATOM 28 CB PRO A 606 32.349 54.144 38.142 1.00 83.86 C ATOM 29 CG PRO A 606 31.958 53.934 36.720 1.00 88.32 C ATOM 30 CD PRO A 606 32.490 52.594 36.328 1.00 82.38 C ATOM 31 N ARG A 607 31.195 51.875 40.734 1.00 70.56 N ATOM 32 CA ARG A 607 30.087 51.396 41.557 1.00 67.73 C ATOM 33 C ARG A 607 29.058 52.479 41.862 1.00 72.06 C ATOM 34 O ARG A 607 27.874 52.173 41.933 1.00 70.52 O ATOM 35 CB ARG A 607 30.599 50.773 42.857 1.00 66.50 C ATOM 36 CG ARG A 607 29.614 49.782 43.460 1.00 76.94 C ATOM 37 CD ARG A 607 29.862 49.573 44.933 1.00 81.54 C ATOM 38 NE ARG A 607 28.983 48.548 45.507 1.00 83.95 N ATOM 39 CZ ARG A 607 27.778 48.790 46.015 1.00 89.25 C ATOM 40 NH1 ARG A 607 27.286 50.024 46.020 1.00 60.40 N ATOM 41 NH2 ARG A 607 27.054 47.799 46.520 1.00 73.36 N ATOM 42 HE ARG A 607 29.325 47.566 45.517 1.00 0.00 H ATOM 43 HH12 ARG A 607 26.343 50.206 46.419 1.00 0.00 H ATOM 44 HH11 ARG A 607 27.844 50.808 45.625 1.00 0.00 H ATOM 45 HH22 ARG A 607 26.112 47.993 46.916 1.00 0.00 H ATOM 46 HH21 ARG A 607 27.428 46.829 46.519 1.00 0.00 H ATOM 47 H ARG A 607 32.160 51.770 41.108 1.00 0.00 H ATOM 48 N SER A 608 29.501 53.738 42.026 1.00 70.09 N ATOM 49 CA SER A 608 28.632 54.860 42.387 1.00 71.02 C ATOM 50 C SER A 608 27.600 55.233 41.296 1.00 74.35 C ATOM 51 O SER A 608 26.696 56.027 41.558 1.00 74.92 O ATOM 52 CB SER A 608 29.461 56.067 42.822 1.00 77.04 C ATOM 53 OG SER A 608 30.453 56.424 41.874 1.00 88.40 O ATOM 54 HG SER A 608 30.958 57.208 42.206 1.00 0.00 H ATOM 55 H SER A 608 30.515 53.925 41.889 1.00 0.00 H ATOM 56 N ARG A 609 27.720 54.657 40.087 1.00 69.27 N ATOM 57 CA ARG A 609 26.707 54.828 39.042 1.00 68.93 C ATOM 58 C ARG A 609 25.439 53.953 39.251 1.00 67.92 C ATOM 59 O ARG A 609 24.456 54.107 38.520 1.00 67.56 O ATOM 60 CB ARG A 609 27.318 54.611 37.647 1.00 71.82 C ATOM 61 CG ARG A 609 28.090 55.818 37.133 1.00 89.24 C ATOM 62 CD ARG A 609 28.661 55.563 35.756 1.00103.61 C ATOM 63 NE ARG A 609 29.792 56.449 35.478 1.00124.62 N ATOM 64 CZ ARG A 609 30.571 56.360 34.405 1.00145.65 C ATOM 65 NH1 ARG A 609 30.353 55.421 33.492 1.00135.40 N ATOM 66 NH2 ARG A 609 31.577 57.208 34.238 1.00136.15 N ATOM 67 HE ARG A 609 30.000 57.200 36.167 1.00 0.00 H ATOM 68 HH12 ARG A 609 30.967 55.357 32.655 1.00 0.00 H ATOM 69 HH11 ARG A 609 29.569 54.749 33.614 1.00 0.00 H ATOM 70 HH22 ARG A 609 32.184 57.135 33.397 1.00 0.00 H ATOM 71 HH21 ARG A 609 31.758 57.946 34.948 1.00 0.00 H ATOM 72 H ARG A 609 28.557 54.073 39.888 1.00 0.00 H ATOM 73 N LEU A 610 25.461 53.057 40.248 1.00 61.38 N ATOM 74 CA LEU A 610 24.418 52.048 40.482 1.00 58.16 C ATOM 75 C LEU A 610 23.395 52.549 41.499 1.00 57.44 C ATOM 76 O LEU A 610 23.779 53.044 42.554 1.00 58.47 O ATOM 77 CB LEU A 610 25.077 50.753 41.004 1.00 56.70 C ATOM 78 CG LEU A 610 25.055 49.480 40.174 1.00 59.58 C ATOM 79 CD1 LEU A 610 25.300 49.727 38.680 1.00 59.23 C ATOM 80 CD2 LEU A 610 26.072 48.501 40.718 1.00 61.83 C ATOM 81 H LEU A 610 26.271 53.077 40.900 1.00 0.00 H ATOM 82 N ARG A 611 22.098 52.403 41.181 1.00 49.59 N ATOM 83 CA ARG A 611 20.970 52.737 42.051 1.00 48.64 C ATOM 84 C ARG A 611 20.092 51.468 42.296 1.00 46.39 C ATOM 85 O ARG A 611 19.369 51.027 41.396 1.00 45.22 O ATOM 86 CB ARG A 611 20.171 53.887 41.400 1.00 52.26 C ATOM 87 CG ARG A 611 19.148 54.557 42.282 1.00 66.20 C ATOM 88 CD ARG A 611 18.287 55.515 41.490 1.00 77.58 C ATOM 89 NE ARG A 611 18.995 56.750 41.163 1.00 87.75 N ATOM 90 CZ ARG A 611 19.270 57.159 39.930 1.00 95.35 C ATOM 91 NH1 ARG A 611 18.896 56.435 38.882 1.00 64.36 N ATOM 92 NH2 ARG A 611 19.916 58.300 39.734 1.00 94.88 N ATOM 93 HE ARG A 611 19.306 57.352 41.952 1.00 0.00 H ATOM 94 HH12 ARG A 611 19.115 56.762 37.919 1.00 0.00 H ATOM 95 HH11 ARG A 611 18.384 55.541 39.024 1.00 0.00 H ATOM 96 HH22 ARG A 611 20.130 58.617 38.767 1.00 0.00 H ATOM 97 HH21 ARG A 611 20.209 58.878 40.547 1.00 0.00 H ATOM 98 H ARG A 611 21.878 52.021 40.239 1.00 0.00 H ATOM 99 N PHE A 612 20.163 50.893 43.510 1.00 41.33 N ATOM 100 CA PHE A 612 19.458 49.653 43.887 1.00 40.03 C ATOM 101 C PHE A 612 17.973 49.906 44.039 1.00 45.59 C ATOM 102 O PHE A 612 17.584 50.848 44.738 1.00 44.01 O ATOM 103 CB PHE A 612 20.063 49.051 45.189 1.00 41.15 C ATOM 104 CG PHE A 612 21.407 48.396 44.983 1.00 41.20 C ATOM 105 CD1 PHE A 612 21.506 47.027 44.789 1.00 41.11 C ATOM 106 CD2 PHE A 612 22.574 49.155 44.957 1.00 42.82 C ATOM 107 CE1 PHE A 612 22.754 46.417 44.578 1.00 40.78 C ATOM 108 CE2 PHE A 612 23.811 48.554 44.738 1.00 43.78 C ATOM 109 CZ PHE A 612 23.894 47.181 44.552 1.00 40.42 C ATOM 110 H PHE A 612 20.754 51.353 44.231 1.00 0.00 H ATOM 111 N LYS A 613 17.146 49.069 43.384 1.00 43.59 N ATOM 112 CA LYS A 613 15.702 49.267 43.245 1.00 45.37 C ATOM 113 C LYS A 613 14.845 48.168 43.891 1.00 50.27 C ATOM 114 O LYS A 613 13.906 48.491 44.641 1.00 52.43 O ATOM 115 CB LYS A 613 15.301 49.471 41.767 1.00 48.40 C ATOM 116 CG LYS A 613 15.700 50.825 41.160 1.00 56.59 C ATOM 117 CD LYS A 613 15.170 52.011 41.980 1.00 71.03 C ATOM 118 CE LYS A 613 15.364 53.332 41.292 1.00 84.42 C ATOM 119 NZ LYS A 613 15.071 54.468 42.202 1.00 96.65 N ATOM 120 HZ1 LYS A 613 14.084 54.406 42.525 1.00 0.00 H ATOM 121 HZ2 LYS A 613 15.709 54.427 43.022 1.00 0.00 H ATOM 122 HZ3 LYS A 613 15.215 55.364 41.694 1.00 0.00 H ATOM 123 H LYS A 613 17.562 48.222 42.946 1.00 0.00 H ATOM 124 N GLU A 614 15.147 46.895 43.607 1.00 44.63 N ATOM 125 CA GLU A 614 14.489 45.744 44.253 1.00 44.95 C ATOM 126 C GLU A 614 15.361 44.520 44.285 1.00 44.19 C ATOM 127 O GLU A 614 16.184 44.331 43.386 1.00 41.29 O ATOM 128 CB GLU A 614 13.101 45.415 43.659 1.00 47.61 C ATOM 129 CG GLU A 614 13.057 45.042 42.193 1.00 60.75 C ATOM 130 CD GLU A 614 11.707 45.181 41.512 1.00 92.67 C ATOM 131 OE1 GLU A 614 10.920 46.066 41.921 1.00 98.24 O ATOM 132 OE2 GLU A 614 11.462 44.445 40.527 1.00 92.44 O ATOM 133 H GLU A 614 15.882 46.708 42.895 1.00 0.00 H ATOM 134 N LYS A 615 15.184 43.682 45.317 1.00 40.77 N ATOM 135 CA LYS A 615 15.908 42.427 45.436 1.00 40.05 C ATOM 136 C LYS A 615 15.167 41.427 44.545 1.00 44.29 C ATOM 137 O LYS A 615 13.954 41.262 44.700 1.00 45.64 O ATOM 138 CB LYS A 615 15.917 41.951 46.899 1.00 42.62 C ATOM 139 CG LYS A 615 16.908 40.839 47.173 1.00 43.89 C ATOM 140 CD LYS A 615 16.682 40.308 48.581 1.00 49.42 C ATOM 141 CE LYS A 615 17.426 39.035 48.834 1.00 50.59 C ATOM 142 NZ LYS A 615 17.393 38.687 50.280 1.00 53.03 N ATOM 143 HZ1 LYS A 615 17.835 39.451 50.829 1.00 0.00 H ATOM 144 HZ2 LYS A 615 16.406 38.567 50.584 1.00 0.00 H ATOM 145 HZ3 LYS A 615 17.915 37.801 50.434 1.00 0.00 H ATOM 146 H LYS A 615 14.503 43.940 46.060 1.00 0.00 H ATOM 147 N LEU A 616 15.876 40.788 43.616 1.00 39.03 N ATOM 148 CA LEU A 616 15.247 39.851 42.676 1.00 39.30 C ATOM 149 C LEU A 616 15.274 38.431 43.194 1.00 47.69 C ATOM 150 O LEU A 616 14.342 37.674 42.961 1.00 48.22 O ATOM 151 CB LEU A 616 15.866 39.950 41.269 1.00 38.28 C ATOM 152 CG LEU A 616 15.694 41.301 40.546 1.00 40.58 C ATOM 153 CD1 LEU A 616 16.600 41.375 39.289 1.00 38.12 C ATOM 154 CD2 LEU A 616 14.253 41.557 40.150 1.00 39.73 C ATOM 155 H LEU A 616 16.900 40.957 43.555 1.00 0.00 H ATOM 156 N GLY A 617 16.337 38.089 43.900 1.00 44.97 N ATOM 157 CA GLY A 617 16.556 36.740 44.388 1.00 44.20 C ATOM 158 C GLY A 617 17.874 36.598 45.107 1.00 47.98 C ATOM 159 O GLY A 617 18.614 37.571 45.309 1.00 45.29 O ATOM 160 H GLY A 617 17.047 38.818 44.115 1.00 0.00 H ATOM 161 N GLU A 618 18.171 35.366 45.483 1.00 46.52 N ATOM 162 CA GLU A 618 19.174 35.047 46.469 1.00 47.34 C ATOM 163 C GLU A 618 19.569 33.579 46.262 1.00 50.02 C ATOM 164 O GLU A 618 18.698 32.734 46.081 1.00 47.13 O ATOM 165 CB GLU A 618 18.514 35.231 47.838 1.00 50.58 C ATOM 166 CG GLU A 618 19.338 34.866 49.044 1.00 60.46 C ATOM 167 CD GLU A 618 18.606 35.363 50.267 1.00 75.40 C ATOM 168 OE1 GLU A 618 17.636 34.696 50.695 1.00 74.16 O ATOM 169 OE2 GLU A 618 18.924 36.487 50.714 1.00 65.31 O ATOM 170 H GLU A 618 17.651 34.581 45.042 1.00 0.00 H ATOM 171 N GLY A 619 20.871 33.317 46.292 1.00 48.59 N ATOM 172 CA GLY A 619 21.428 31.966 46.252 1.00 50.53 C ATOM 173 C GLY A 619 22.429 31.719 47.359 1.00 56.40 C ATOM 174 O GLY A 619 22.336 32.324 48.428 1.00 55.99 O ATOM 175 H GLY A 619 21.531 34.118 46.347 1.00 0.00 H ATOM 176 N GLN A 620 23.401 30.837 47.096 1.00 55.26 N ATOM 177 CA GLN A 620 24.315 30.261 48.089 1.00 56.76 C ATOM 178 C GLN A 620 25.408 31.230 48.559 1.00 59.63 C ATOM 179 O GLN A 620 25.804 31.196 49.727 1.00 61.08 O ATOM 180 CB GLN A 620 24.952 28.985 47.519 1.00 58.75 C ATOM 181 CG GLN A 620 25.371 27.958 48.576 1.00 82.73 C ATOM 182 CD GLN A 620 26.091 26.750 47.995 1.00106.65 C ATOM 183 OE1 GLN A 620 26.185 26.548 46.774 1.00101.92 O ATOM 184 NE2 GLN A 620 26.624 25.907 48.864 1.00102.75 N ATOM 185 HE22 GLN A 620 26.538 26.088 49.884 1.00 0.00 H ATOM 186 HE21 GLN A 620 27.129 25.063 48.527 1.00 0.00 H ATOM 187 H GLN A 620 23.518 30.535 46.108 1.00 0.00 H ATOM 188 N PHE A 621 25.900 32.078 47.658 1.00 53.49 N ATOM 189 CA PHE A 621 26.976 33.023 47.988 1.00 53.01 C ATOM 190 C PHE A 621 26.720 34.433 47.414 1.00 54.72 C ATOM 191 O PHE A 621 27.635 35.260 47.373 1.00 55.36 O ATOM 192 CB PHE A 621 28.344 32.475 47.519 1.00 54.31 C ATOM 193 CG PHE A 621 28.392 32.133 46.057 1.00 54.27 C ATOM 194 CD1 PHE A 621 28.246 30.819 45.631 1.00 56.95 C ATOM 195 CD2 PHE A 621 28.576 33.125 45.101 1.00 55.44 C ATOM 196 CE1 PHE A 621 28.284 30.501 44.272 1.00 57.86 C ATOM 197 CE2 PHE A 621 28.610 32.810 43.745 1.00 57.81 C ATOM 198 CZ PHE A 621 28.472 31.498 43.338 1.00 56.44 C ATOM 199 H PHE A 621 25.512 32.071 46.693 1.00 0.00 H ATOM 200 N GLY A 622 25.488 34.682 46.977 1.00 48.09 N ATOM 201 CA GLY A 622 25.118 35.943 46.348 1.00 44.95 C ATOM 202 C GLY A 622 23.637 36.252 46.414 1.00 44.61 C ATOM 203 O GLY A 622 22.810 35.407 46.775 1.00 42.50 O ATOM 204 H GLY A 622 24.760 33.947 47.089 1.00 0.00 H ATOM 205 N GLU A 623 23.316 37.489 46.030 1.00 37.79 N ATOM 206 CA GLU A 623 22.014 38.106 46.137 1.00 36.31 C ATOM 207 C GLU A 623 21.882 38.979 44.888 1.00 35.85 C ATOM 208 O GLU A 623 22.776 39.757 44.632 1.00 34.93 O ATOM 209 CB GLU A 623 22.095 38.970 47.395 1.00 38.80 C ATOM 210 CG GLU A 623 20.848 39.668 47.818 1.00 50.05 C ATOM 211 CD GLU A 623 21.083 40.311 49.162 1.00 58.25 C ATOM 212 OE1 GLU A 623 21.263 41.548 49.220 1.00 39.33 O ATOM 213 OE2 GLU A 623 21.134 39.560 50.158 1.00 51.84 O ATOM 214 H GLU A 623 24.076 38.064 45.614 1.00 0.00 H ATOM 215 N VAL A 624 20.791 38.859 44.107 1.00 34.05 N ATOM 216 CA VAL A 624 20.650 39.687 42.901 1.00 32.38 C ATOM 217 C VAL A 624 19.672 40.810 43.128 1.00 35.81 C ATOM 218 O VAL A 624 18.622 40.591 43.727 1.00 36.39 O ATOM 219 CB VAL A 624 20.328 38.879 41.598 1.00 34.13 C ATOM 220 CG1 VAL A 624 20.226 39.814 40.377 1.00 32.54 C ATOM 221 CG2 VAL A 624 21.387 37.828 41.352 1.00 34.21 C ATOM 222 H VAL A 624 20.046 38.178 44.358 1.00 0.00 H ATOM 223 N HIS A 625 20.005 42.012 42.631 1.00 32.54 N ATOM 224 CA HIS A 625 19.131 43.151 42.725 1.00 33.24 C ATOM 225 C HIS A 625 18.926 43.784 41.351 1.00 36.04 C ATOM 226 O HIS A 625 19.842 43.793 40.523 1.00 35.75 O ATOM 227 CB HIS A 625 19.676 44.210 43.691 1.00 35.59 C ATOM 228 CG HIS A 625 19.734 43.799 45.131 1.00 40.15 C ATOM 229 ND1 HIS A 625 18.892 44.361 46.066 1.00 42.72 N ATOM 230 CD2 HIS A 625 20.548 42.909 45.750 1.00 41.56 C ATOM 231 CE1 HIS A 625 19.197 43.791 47.216 1.00 42.49 C ATOM 232 NE2 HIS A 625 20.199 42.919 47.082 1.00 42.29 N ATOM 233 H HIS A 625 20.926 42.124 42.162 1.00 0.00 H ATOM 234 N LEU A 626 17.723 44.296 41.112 1.00 31.95 N ATOM 235 CA LEU A 626 17.465 45.197 39.999 1.00 33.19 C ATOM 236 C LEU A 626 18.115 46.581 40.296 1.00 40.67 C ATOM 237 O LEU A 626 17.857 47.152 41.351 1.00 42.52 O ATOM 238 CB LEU A 626 15.935 45.364 39.801 1.00 33.93 C ATOM 239 CG LEU A 626 15.495 46.432 38.763 1.00 37.65 C ATOM 240 CD1 LEU A 626 16.048 46.116 37.401 1.00 36.77 C ATOM 241 CD2 LEU A 626 13.996 46.512 38.670 1.00 40.33 C ATOM 242 H LEU A 626 16.937 44.043 41.744 1.00 0.00 H ATOM 243 N CYS A 627 18.937 47.114 39.370 1.00 39.01 N ATOM 244 CA CYS A 627 19.576 48.429 39.513 1.00 40.00 C ATOM 245 C CYS A 627 19.350 49.339 38.306 1.00 43.49 C ATOM 246 O CYS A 627 19.125 48.845 37.215 1.00 41.05 O ATOM 247 CB CYS A 627 21.063 48.283 39.819 1.00 39.84 C ATOM 248 SG CYS A 627 21.414 47.457 41.387 1.00 43.07 S ATOM 249 H CYS A 627 19.129 46.565 38.508 1.00 0.00 H ATOM 250 N GLU A 628 19.398 50.652 38.517 1.00 43.95 N ATOM 251 CA GLU A 628 19.372 51.663 37.454 1.00 45.85 C ATOM 252 C GLU A 628 20.760 52.256 37.279 1.00 52.89 C ATOM 253 O GLU A 628 21.448 52.468 38.268 1.00 52.19 O ATOM 254 CB GLU A 628 18.386 52.802 37.764 1.00 48.07 C ATOM 255 CG GLU A 628 16.927 52.396 37.758 1.00 53.07 C ATOM 256 CD GLU A 628 15.954 53.564 37.796 1.00 78.45 C ATOM 257 OE1 GLU A 628 16.347 54.662 38.255 1.00 80.00 O ATOM 258 OE2 GLU A 628 14.788 53.375 37.379 1.00 70.01 O ATOM 259 H GLU A 628 19.458 50.984 39.501 1.00 0.00 H ATOM 260 N VAL A 629 21.174 52.516 36.033 1.00 54.74 N ATOM 261 CA VAL A 629 22.480 53.132 35.741 1.00 58.40 C ATOM 262 C VAL A 629 22.243 54.512 35.143 1.00 69.12 C ATOM 263 O VAL A 629 21.466 54.638 34.197 1.00 69.23 O ATOM 264 CB VAL A 629 23.407 52.266 34.829 1.00 61.83 C ATOM 265 CG1 VAL A 629 24.825 52.838 34.778 1.00 63.15 C ATOM 266 CG2 VAL A 629 23.433 50.805 35.268 1.00 59.22 C ATOM 267 H VAL A 629 20.548 52.273 35.239 1.00 0.00 H ATOM 268 N ASP A 630 22.916 55.534 35.699 1.00 71.76 N ATOM 269 CA ASP A 630 22.853 56.930 35.269 1.00 76.40 C ATOM 270 C ASP A 630 23.560 57.191 33.942 1.00 83.84 C ATOM 271 O ASP A 630 22.961 57.809 33.053 1.00 85.06 O ATOM 272 CB ASP A 630 23.409 57.846 36.361 1.00 80.99 C ATOM 273 CG ASP A 630 22.503 57.919 37.565 1.00 97.95 C ATOM 274 OD1 ASP A 630 21.478 58.641 37.491 1.00100.85 O ATOM 275 OD2 ASP A 630 22.795 57.225 38.571 1.00102.53 O ATOM 276 H ASP A 630 23.535 55.313 36.505 1.00 0.00 H ATOM 277 N SER A 631 24.834 56.723 33.817 1.00 80.77 N ATOM 278 CA SER A 631 25.679 56.787 32.613 1.00117.92 C ATOM 279 C SER A 631 25.912 58.214 32.084 1.00149.07 C ATOM 280 O SER A 631 25.059 58.794 31.413 1.00111.87 O ATOM 281 CB SER A 631 25.164 55.845 31.523 1.00119.94 C ATOM 282 OG SER A 631 25.995 55.853 30.374 1.00130.36 O ATOM 283 HG SER A 631 26.030 56.769 30.000 1.00 0.00 H ATOM 284 H SER A 631 25.252 56.275 34.658 1.00 0.00 H TER 285 SER A 631 ATOM 286 N HIS A 648 16.870 57.629 28.973 1.00 94.35 N ATOM 287 CA HIS A 648 17.500 57.827 30.277 1.00 93.58 C ATOM 288 C HIS A 648 17.575 56.542 31.165 1.00 91.91 C ATOM 289 O HIS A 648 18.670 56.268 31.662 1.00 91.66 O ATOM 290 CB HIS A 648 16.831 58.984 31.041 1.00 96.75 C ATOM 291 CG HIS A 648 17.734 59.697 32.007 1.00101.54 C ATOM 292 ND1 HIS A 648 18.002 61.055 31.877 1.00106.64 N ATOM 293 CD2 HIS A 648 18.398 59.223 33.091 1.00101.81 C ATOM 294 CE1 HIS A 648 18.816 61.358 32.876 1.00106.31 C ATOM 295 NE2 HIS A 648 19.083 60.290 33.634 1.00103.79 N ATOM 296 HN3 HIS A 648 15.894 57.297 29.108 1.00 0.00 H ATOM 297 HN2 HIS A 648 17.407 56.920 28.434 1.00 0.00 H ATOM 298 HN1 HIS A 648 16.863 58.529 28.453 1.00 0.00 H ATOM 299 N PRO A 649 16.490 55.737 31.387 1.00 83.63 N ATOM 300 CA PRO A 649 16.539 54.733 32.476 1.00 79.00 C ATOM 301 C PRO A 649 17.135 53.363 32.115 1.00 72.17 C ATOM 302 O PRO A 649 16.389 52.477 31.686 1.00 71.11 O ATOM 303 CB PRO A 649 15.064 54.617 32.909 1.00 81.31 C ATOM 304 CG PRO A 649 14.241 55.232 31.764 1.00 88.32 C ATOM 305 CD PRO A 649 15.188 55.682 30.687 1.00 85.42 C ATOM 306 N LEU A 650 18.466 53.172 32.291 1.00 61.96 N ATOM 307 CA LEU A 650 19.093 51.866 32.011 1.00 58.16 C ATOM 308 C LEU A 650 18.992 50.870 33.193 1.00 53.96 C ATOM 309 O LEU A 650 19.539 51.129 34.266 1.00 53.32 O ATOM 310 CB LEU A 650 20.559 52.004 31.521 1.00 58.92 C ATOM 311 CG LEU A 650 21.369 50.678 31.368 1.00 60.99 C ATOM 312 CD1 LEU A 650 20.895 49.839 30.179 1.00 59.26 C ATOM 313 CD2 LEU A 650 22.853 50.943 31.306 1.00 63.64 C ATOM 314 H LEU A 650 19.055 53.960 32.629 1.00 0.00 H ATOM 315 N LEU A 651 18.295 49.734 32.983 1.00 45.32 N ATOM 316 CA LEU A 651 18.147 48.703 34.019 1.00 42.49 C ATOM 317 C LEU A 651 19.175 47.623 33.853 1.00 44.81 C ATOM 318 O LEU A 651 19.446 47.207 32.731 1.00 44.29 O ATOM 319 CB LEU A 651 16.730 48.076 34.056 1.00 41.83 C ATOM 320 CG LEU A 651 15.528 49.053 34.180 1.00 47.02 C ATOM 321 CD1 LEU A 651 14.202 48.322 33.994 1.00 45.13 C ATOM 322 CD2 LEU A 651 15.534 49.774 35.522 1.00 47.35 C ATOM 323 H LEU A 651 17.847 49.583 32.056 1.00 0.00 H ATOM 324 N VAL A 652 19.768 47.157 34.973 1.00 38.19 N ATOM 325 CA VAL A 652 20.692 46.026 34.949 1.00 34.83 C ATOM 326 C VAL A 652 20.394 45.141 36.148 1.00 36.35 C ATOM 327 O VAL A 652 19.806 45.623 37.141 1.00 34.80 O ATOM 328 CB VAL A 652 22.197 46.466 34.931 1.00 38.99 C ATOM 329 CG1 VAL A 652 22.583 47.188 33.619 1.00 40.57 C ATOM 330 CG2 VAL A 652 22.551 47.317 36.159 1.00 38.85 C ATOM 331 H VAL A 652 19.560 47.618 35.882 1.00 0.00 H ATOM 332 N ALA A 653 20.819 43.868 36.078 1.00 29.79 N ATOM 333 CA ALA A 653 20.798 43.005 37.259 1.00 30.47 C ATOM 334 C ALA A 653 22.177 42.991 37.907 1.00 34.27 C ATOM 335 O ALA A 653 23.198 42.890 37.207 1.00 31.22 O ATOM 336 CB ALA A 653 20.384 41.580 36.870 1.00 30.93 C ATOM 337 H ALA A 653 21.167 43.492 35.173 1.00 0.00 H ATOM 338 N VAL A 654 22.218 43.101 39.258 1.00 31.24 N ATOM 339 CA VAL A 654 23.489 43.191 39.955 1.00 30.88 C ATOM 340 C VAL A 654 23.565 42.136 41.033 1.00 34.63 C ATOM 341 O VAL A 654 22.741 42.138 41.944 1.00 37.64 O ATOM 342 CB VAL A 654 23.779 44.630 40.507 1.00 34.72 C ATOM 343 CG1 VAL A 654 25.053 44.671 41.353 1.00 35.17 C ATOM 344 CG2 VAL A 654 23.869 45.659 39.382 1.00 35.57 C ATOM 345 H VAL A 654 21.331 43.121 39.800 1.00 0.00 H ATOM 346 N LYS A 655 24.552 41.259 40.956 1.00 29.99 N ATOM 347 CA LYS A 655 24.750 40.279 42.017 1.00 29.91 C ATOM 348 C LYS A 655 25.850 40.750 42.952 1.00 34.06 C ATOM 349 O LYS A 655 26.920 41.136 42.492 1.00 33.93 O ATOM 350 CB LYS A 655 25.070 38.902 41.432 1.00 30.88 C ATOM 351 CG LYS A 655 25.022 37.761 42.432 1.00 39.69 C ATOM 352 CD LYS A 655 25.346 36.533 41.616 1.00 38.64 C ATOM 353 CE LYS A 655 25.387 35.260 42.366 1.00 45.91 C ATOM 354 NZ LYS A 655 25.382 34.124 41.412 1.00 43.97 N ATOM 355 HZ1 LYS A 655 24.517 34.160 40.836 1.00 0.00 H ATOM 356 HZ2 LYS A 655 26.215 34.189 40.793 1.00 0.00 H ATOM 357 HZ3 LYS A 655 25.411 33.229 41.941 1.00 0.00 H ATOM 358 H LYS A 655 25.190 41.269 40.135 1.00 0.00 H ATOM 359 N ILE A 656 25.574 40.728 44.267 1.00 31.55 N ATOM 360 CA ILE A 656 26.532 41.134 45.319 1.00 32.57 C ATOM 361 C ILE A 656 26.625 40.049 46.369 1.00 35.52 C ATOM 362 O ILE A 656 25.767 39.169 46.377 1.00 34.90 O ATOM 363 CB ILE A 656 26.032 42.460 45.964 1.00 36.82 C ATOM 364 CG1 ILE A 656 24.628 42.245 46.631 1.00 34.71 C ATOM 365 CG2 ILE A 656 26.020 43.567 44.906 1.00 36.43 C ATOM 366 CD1 ILE A 656 24.096 43.578 47.417 1.00 35.57 C ATOM 367 H ILE A 656 24.630 40.406 44.563 1.00 0.00 H ATOM 368 N LEU A 657 27.636 40.085 47.245 1.00 33.81 N ATOM 369 CA LEU A 657 27.681 39.073 48.315 1.00 35.21 C ATOM 370 C LEU A 657 26.440 39.191 49.206 1.00 39.67 C ATOM 371 O LEU A 657 25.847 40.276 49.349 1.00 39.46 O ATOM 372 CB LEU A 657 28.970 39.201 49.163 1.00 36.38 C ATOM 373 CG LEU A 657 30.294 38.835 48.436 1.00 41.55 C ATOM 374 CD1 LEU A 657 31.483 39.058 49.358 1.00 46.70 C ATOM 375 CD2 LEU A 657 30.320 37.378 48.045 1.00 38.53 C ATOM 376 H LEU A 657 28.375 40.813 47.172 1.00 0.00 H ATOM 377 N ARG A 658 26.036 38.081 49.769 1.00 36.38 N ATOM 378 CA ARG A 658 24.999 38.058 50.786 1.00 37.34 C ATOM 379 C ARG A 658 25.530 38.792 52.053 1.00 37.18 C ATOM 380 O ARG A 658 26.745 38.868 52.246 1.00 36.93 O ATOM 381 CB ARG A 658 24.634 36.607 51.079 1.00 39.91 C ATOM 382 CG ARG A 658 23.710 36.012 50.024 1.00 46.97 C ATOM 383 CD ARG A 658 23.503 34.549 50.324 1.00 70.82 C ATOM 384 NE ARG A 658 22.316 34.325 51.148 1.00 87.39 N ATOM 385 CZ ARG A 658 22.309 33.629 52.279 1.00108.89 C ATOM 386 NH1 ARG A 658 23.426 33.079 52.736 1.00104.63 N ATOM 387 NH2 ARG A 658 21.182 33.476 52.961 1.00 98.93 N ATOM 388 HE ARG A 658 21.417 34.738 50.827 1.00 0.00 H ATOM 389 HH12 ARG A 658 23.413 32.535 53.622 1.00 0.00 H ATOM 390 HH11 ARG A 658 24.315 33.191 52.208 1.00 0.00 H ATOM 391 HH22 ARG A 658 21.180 32.930 53.846 1.00 0.00 H ATOM 392 HH21 ARG A 658 20.300 33.902 52.610 1.00 0.00 H ATOM 393 H ARG A 658 26.473 37.183 49.478 1.00 0.00 H ATOM 394 N PRO A 659 24.666 39.374 52.891 1.00 34.19 N ATOM 395 CA PRO A 659 25.157 39.992 54.156 1.00 34.64 C ATOM 396 C PRO A 659 25.874 39.071 55.125 1.00 41.54 C ATOM 397 O PRO A 659 26.657 39.538 55.959 1.00 43.31 O ATOM 398 CB PRO A 659 23.897 40.593 54.796 1.00 35.91 C ATOM 399 CG PRO A 659 22.834 40.512 53.810 1.00 39.96 C ATOM 400 CD PRO A 659 23.216 39.585 52.696 1.00 35.31 C ATOM 401 N ASP A 660 25.620 37.772 55.030 1.00 40.02 N ATOM 402 CA ASP A 660 26.277 36.813 55.907 1.00 43.07 C ATOM 403 C ASP A 660 27.536 36.199 55.242 1.00 47.08 C ATOM 404 O ASP A 660 28.040 35.197 55.737 1.00 47.20 O ATOM 405 CB ASP A 660 25.275 35.697 56.297 1.00 46.83 C ATOM 406 CG ASP A 660 24.755 34.871 55.127 1.00 60.49 C ATOM 407 OD1 ASP A 660 25.167 35.132 53.983 1.00 58.40 O ATOM 408 OD2 ASP A 660 23.940 33.964 55.361 1.00 74.11 O ATOM 409 H ASP A 660 24.941 37.434 54.318 1.00 0.00 H ATOM 410 N ALA A 661 28.029 36.786 54.127 1.00 43.88 N ATOM 411 CA ALA A 661 29.118 36.180 53.338 1.00 43.02 C ATOM 412 C ALA A 661 30.386 35.937 54.153 1.00 50.63 C ATOM 413 O ALA A 661 30.809 36.790 54.941 1.00 51.75 O ATOM 414 CB ALA A 661 29.434 37.020 52.117 1.00 42.34 C ATOM 415 H ALA A 661 27.627 37.694 53.816 1.00 0.00 H ATOM 416 N THR A 662 30.967 34.754 53.958 1.00 47.54 N ATOM 417 CA THR A 662 32.226 34.294 54.544 1.00 48.88 C ATOM 418 C THR A 662 33.311 34.427 53.455 1.00 50.01 C ATOM 419 O THR A 662 32.990 34.745 52.325 1.00 47.54 O ATOM 420 CB THR A 662 32.077 32.811 54.930 1.00 55.12 C ATOM 421 OG1 THR A 662 31.601 32.094 53.784 1.00 50.61 O ATOM 422 CG2 THR A 662 31.112 32.597 56.088 1.00 57.14 C ATOM 423 HG1 THR A 662 30.725 32.463 53.506 1.00 0.00 H ATOM 424 H THR A 662 30.476 34.091 53.325 1.00 0.00 H ATOM 425 N LYS A 663 34.584 34.177 53.797 1.00 47.94 N ATOM 426 CA LYS A 663 35.663 34.130 52.811 1.00 46.34 C ATOM 427 C LYS A 663 35.470 33.032 51.762 1.00 46.41 C ATOM 428 O LYS A 663 35.903 33.222 50.625 1.00 43.86 O ATOM 429 CB LYS A 663 37.033 34.031 53.496 1.00 51.81 C ATOM 430 CG LYS A 663 37.378 35.285 54.319 1.00 77.36 C ATOM 431 CD LYS A 663 37.682 36.540 53.464 1.00 88.13 C ATOM 432 CE LYS A 663 39.156 36.723 53.170 1.00104.11 C ATOM 433 NZ LYS A 663 39.931 37.076 54.391 1.00114.31 N ATOM 434 HZ1 LYS A 663 39.566 37.966 54.787 1.00 0.00 H ATOM 435 HZ2 LYS A 663 39.832 36.316 55.094 1.00 0.00 H ATOM 436 HZ3 LYS A 663 40.934 37.191 54.142 1.00 0.00 H ATOM 437 H LYS A 663 34.811 34.011 54.798 1.00 0.00 H ATOM 438 N ASN A 664 34.812 31.890 52.130 1.00 42.01 N ATOM 439 CA ASN A 664 34.461 30.846 51.151 1.00 40.52 C ATOM 440 C ASN A 664 33.472 31.406 50.106 1.00 41.74 C ATOM 441 O ASN A 664 33.610 31.096 48.917 1.00 39.95 O ATOM 442 CB ASN A 664 33.869 29.612 51.840 1.00 42.39 C ATOM 443 CG ASN A 664 34.733 28.964 52.903 1.00 54.82 C ATOM 444 OD1 ASN A 664 35.899 29.301 53.110 1.00 48.42 O ATOM 445 ND2 ASN A 664 34.163 28.027 53.638 1.00 51.68 N ATOM 446 HD22 ASN A 664 33.177 27.750 53.455 1.00 0.00 H ATOM 447 HD21 ASN A 664 34.699 27.566 54.400 1.00 0.00 H ATOM 448 H ASN A 664 34.553 31.755 53.128 1.00 0.00 H ATOM 449 N ALA A 665 32.474 32.238 50.544 1.00 36.49 N ATOM 450 CA ALA A 665 31.502 32.839 49.599 1.00 34.21 C ATOM 451 C ALA A 665 32.203 33.813 48.652 1.00 38.33 C ATOM 452 O ALA A 665 31.885 33.848 47.459 1.00 38.31 O ATOM 453 CB ALA A 665 30.376 33.563 50.354 1.00 34.95 C ATOM 454 H ALA A 665 32.397 32.452 51.559 1.00 0.00 H ATOM 455 N ARG A 666 33.145 34.605 49.177 1.00 36.92 N ATOM 456 CA ARG A 666 33.899 35.563 48.366 1.00 37.40 C ATOM 457 C ARG A 666 34.716 34.824 47.307 1.00 38.57 C ATOM 458 O ARG A 666 34.773 35.263 46.159 1.00 36.68 O ATOM 459 CB ARG A 666 34.781 36.452 49.265 1.00 39.21 C ATOM 460 CG ARG A 666 35.654 37.420 48.510 1.00 44.37 C ATOM 461 CD ARG A 666 36.673 38.122 49.372 1.00 51.12 C ATOM 462 NE ARG A 666 37.473 39.023 48.539 1.00 68.21 N ATOM 463 CZ ARG A 666 38.590 38.682 47.896 1.00 83.58 C ATOM 464 NH1 ARG A 666 39.068 37.444 47.985 1.00 59.50 N ATOM 465 NH2 ARG A 666 39.239 39.577 47.162 1.00 79.28 N ATOM 466 HE ARG A 666 37.144 40.005 48.442 1.00 0.00 H ATOM 467 HH12 ARG A 666 39.940 37.186 47.480 1.00 0.00 H ATOM 468 HH11 ARG A 666 38.570 36.734 48.559 1.00 0.00 H ATOM 469 HH22 ARG A 666 40.110 39.307 46.662 1.00 0.00 H ATOM 470 HH21 ARG A 666 38.877 40.549 47.087 1.00 0.00 H ATOM 471 H ARG A 666 33.348 34.538 50.195 1.00 0.00 H ATOM 472 N ASN A 667 35.336 33.694 47.686 1.00 36.17 N ATOM 473 CA ASN A 667 36.077 32.859 46.738 1.00 36.36 C ATOM 474 C ASN A 667 35.169 32.316 45.610 1.00 39.61 C ATOM 475 O ASN A 667 35.555 32.378 44.435 1.00 36.33 O ATOM 476 CB ASN A 667 36.829 31.715 47.455 1.00 31.74 C ATOM 477 CG ASN A 667 37.552 30.832 46.481 1.00 42.03 C ATOM 478 OD1 ASN A 667 38.545 31.223 45.864 1.00 35.35 O ATOM 479 ND2 ASN A 667 37.054 29.634 46.289 1.00 37.70 N ATOM 480 HD22 ASN A 667 36.215 29.328 46.822 1.00 0.00 H ATOM 481 HD21 ASN A 667 37.498 28.990 45.603 1.00 0.00 H ATOM 482 H ASN A 667 35.288 33.403 48.683 1.00 0.00 H ATOM 483 N ASP A 668 33.961 31.794 45.966 1.00 35.11 N ATOM 484 CA ASP A 668 33.024 31.281 44.951 1.00 34.37 C ATOM 485 C ASP A 668 32.534 32.361 44.006 1.00 35.58 C ATOM 486 O ASP A 668 32.322 32.092 42.837 1.00 35.66 O ATOM 487 CB ASP A 668 31.833 30.553 45.596 1.00 36.77 C ATOM 488 CG ASP A 668 32.200 29.230 46.208 1.00 49.60 C ATOM 489 OD1 ASP A 668 33.215 28.650 45.794 1.00 52.54 O ATOM 490 OD2 ASP A 668 31.462 28.764 47.089 1.00 59.09 O ATOM 491 H ASP A 668 33.696 31.757 46.971 1.00 0.00 H ATOM 492 N PHE A 669 32.367 33.580 44.516 1.00 32.33 N ATOM 493 CA PHE A 669 31.892 34.712 43.741 1.00 32.56 C ATOM 494 C PHE A 669 32.948 35.126 42.695 1.00 33.46 C ATOM 495 O PHE A 669 32.596 35.363 41.559 1.00 32.75 O ATOM 496 CB PHE A 669 31.616 35.865 44.718 1.00 34.34 C ATOM 497 CG PHE A 669 30.959 37.075 44.120 1.00 33.96 C ATOM 498 CD1 PHE A 669 29.598 37.303 44.298 1.00 34.55 C ATOM 499 CD2 PHE A 669 31.704 38.011 43.404 1.00 36.53 C ATOM 500 CE1 PHE A 669 28.992 38.447 43.759 1.00 35.93 C ATOM 501 CE2 PHE A 669 31.093 39.149 42.860 1.00 38.18 C ATOM 502 CZ PHE A 669 29.740 39.354 43.038 1.00 35.16 C ATOM 503 H PHE A 669 32.588 33.729 45.521 1.00 0.00 H ATOM 504 N LEU A 670 34.226 35.225 43.096 1.00 32.24 N ATOM 505 CA LEU A 670 35.368 35.482 42.187 1.00 33.77 C ATOM 506 C LEU A 670 35.490 34.440 41.073 1.00 36.23 C ATOM 507 O LEU A 670 35.724 34.807 39.924 1.00 35.98 O ATOM 508 CB LEU A 670 36.686 35.646 42.962 1.00 36.21 C ATOM 509 CG LEU A 670 36.793 36.926 43.811 1.00 42.87 C ATOM 510 CD1 LEU A 670 38.042 36.901 44.650 1.00 45.48 C ATOM 511 CD2 LEU A 670 36.749 38.218 42.939 1.00 45.13 C ATOM 512 H LEU A 670 34.427 35.114 44.110 1.00 0.00 H ATOM 513 N LYS A 671 35.298 33.148 41.401 1.00 33.05 N ATOM 514 CA LYS A 671 35.271 32.043 40.425 1.00 30.36 C ATOM 515 C LYS A 671 34.171 32.154 39.467 1.00 31.66 C ATOM 516 O LYS A 671 34.413 31.998 38.277 1.00 33.36 O ATOM 517 CB LYS A 671 35.261 30.667 41.108 1.00 33.96 C ATOM 518 CG LYS A 671 36.653 30.242 41.489 1.00 33.94 C ATOM 519 CD LYS A 671 36.837 28.760 41.860 1.00 39.83 C ATOM 520 CE LYS A 671 35.879 28.211 42.909 1.00 33.19 C ATOM 521 NZ LYS A 671 36.366 26.886 43.316 1.00 40.40 N ATOM 522 HZ1 LYS A 671 36.392 26.258 42.487 1.00 0.00 H ATOM 523 HZ2 LYS A 671 37.323 26.977 43.714 1.00 0.00 H ATOM 524 HZ3 LYS A 671 35.727 26.489 44.034 1.00 0.00 H ATOM 525 H LYS A 671 35.160 32.915 42.405 1.00 0.00 H ATOM 526 N GLU A 672 32.939 32.460 39.938 1.00 29.97 N ATOM 527 CA GLU A 672 31.821 32.613 39.038 1.00 29.55 C ATOM 528 C GLU A 672 32.081 33.783 38.088 1.00 30.83 C ATOM 529 O GLU A 672 31.720 33.686 36.929 1.00 32.18 O ATOM 530 CB GLU A 672 30.515 32.797 39.841 1.00 31.29 C ATOM 531 CG GLU A 672 29.288 33.108 38.994 1.00 38.67 C ATOM 532 CD GLU A 672 28.011 33.344 39.778 1.00 52.06 C ATOM 533 OE1 GLU A 672 28.091 33.716 40.970 1.00 43.05 O ATOM 534 OE2 GLU A 672 26.920 33.202 39.185 1.00 44.80 O ATOM 535 H GLU A 672 32.797 32.586 40.960 1.00 0.00 H ATOM 536 N VAL A 673 32.713 34.879 38.559 1.00 28.45 N ATOM 537 CA VAL A 673 33.143 35.961 37.652 1.00 27.97 C ATOM 538 C VAL A 673 34.025 35.413 36.515 1.00 32.65 C ATOM 539 O VAL A 673 33.820 35.797 35.344 1.00 30.38 O ATOM 540 CB VAL A 673 33.873 37.154 38.373 1.00 31.89 C ATOM 541 CG1 VAL A 673 34.489 38.132 37.354 1.00 32.39 C ATOM 542 CG2 VAL A 673 32.914 37.910 39.296 1.00 31.51 C ATOM 543 H VAL A 673 32.900 34.962 39.579 1.00 0.00 H ATOM 544 N LYS A 674 35.021 34.554 36.869 1.00 32.38 N ATOM 545 CA LYS A 674 35.949 33.994 35.884 1.00 32.90 C ATOM 546 C LYS A 674 35.194 33.111 34.935 1.00 35.89 C ATOM 547 O LYS A 674 35.411 33.209 33.730 1.00 36.85 O ATOM 548 CB LYS A 674 37.098 33.194 36.518 1.00 36.19 C ATOM 549 CG LYS A 674 37.986 34.032 37.400 1.00 34.42 C ATOM 550 CD LYS A 674 39.301 33.344 37.614 1.00 50.15 C ATOM 551 CE LYS A 674 40.173 34.199 38.475 1.00 69.72 C ATOM 552 NZ LYS A 674 40.866 35.263 37.702 1.00 85.54 N ATOM 553 HZ1 LYS A 674 41.464 34.826 36.972 1.00 0.00 H ATOM 554 HZ2 LYS A 674 40.159 35.878 37.250 1.00 0.00 H ATOM 555 HZ3 LYS A 674 41.457 35.827 38.345 1.00 0.00 H ATOM 556 H LYS A 674 35.126 34.288 37.869 1.00 0.00 H ATOM 557 N ILE A 675 34.311 32.249 35.466 1.00 31.50 N ATOM 558 CA ILE A 675 33.546 31.333 34.600 1.00 30.88 C ATOM 559 C ILE A 675 32.712 32.200 33.640 1.00 37.84 C ATOM 560 O ILE A 675 32.729 31.979 32.433 1.00 36.93 O ATOM 561 CB ILE A 675 32.699 30.329 35.460 1.00 32.84 C ATOM 562 CG1 ILE A 675 33.591 29.386 36.296 1.00 31.95 C ATOM 563 CG2 ILE A 675 31.684 29.519 34.609 1.00 35.07 C ATOM 564 CD1 ILE A 675 32.809 28.723 37.442 1.00 30.27 C ATOM 565 H ILE A 675 34.166 32.228 36.496 1.00 0.00 H ATOM 566 N MET A 676 32.001 33.207 34.175 1.00 36.57 N ATOM 567 CA MET A 676 31.065 33.981 33.356 1.00 37.44 C ATOM 568 C MET A 676 31.671 34.869 32.308 1.00 40.31 C ATOM 569 O MET A 676 31.071 35.023 31.241 1.00 37.64 O ATOM 570 CB MET A 676 30.131 34.779 34.221 1.00 39.49 C ATOM 571 CG MET A 676 28.985 33.902 34.562 1.00 43.55 C ATOM 572 SD MET A 676 27.709 34.742 35.392 1.00 47.75 S ATOM 573 CE MET A 676 27.289 36.097 34.165 1.00 43.02 C ATOM 574 H MET A 676 32.117 33.440 35.182 1.00 0.00 H ATOM 575 N SER A 677 32.854 35.441 32.594 1.00 38.74 N ATOM 576 CA SER A 677 33.612 36.256 31.661 1.00 40.02 C ATOM 577 C SER A 677 33.857 35.539 30.340 1.00 46.39 C ATOM 578 O SER A 677 33.934 36.209 29.308 1.00 48.29 O ATOM 579 CB SER A 677 34.945 36.682 32.277 1.00 44.32 C ATOM 580 OG SER A 677 35.894 35.630 32.198 1.00 49.52 O ATOM 581 HG SER A 677 35.552 34.841 32.689 1.00 0.00 H ATOM 582 H SER A 677 33.251 35.290 33.543 1.00 0.00 H ATOM 583 N ARG A 678 33.973 34.199 30.343 1.00 43.56 N ATOM 584 CA ARG A 678 34.235 33.523 29.066 1.00 45.76 C ATOM 585 C ARG A 678 32.963 33.293 28.200 1.00 46.04 C ATOM 586 O ARG A 678 33.094 32.902 27.043 1.00 45.17 O ATOM 587 CB ARG A 678 35.046 32.227 29.231 1.00 50.21 C ATOM 588 CG ARG A 678 34.381 31.095 30.010 1.00 55.31 C ATOM 589 CD ARG A 678 35.462 30.155 30.520 1.00 61.49 C ATOM 590 NE ARG A 678 35.288 28.752 30.115 1.00 56.43 N ATOM 591 CZ ARG A 678 35.514 28.262 28.898 1.00 62.78 C ATOM 592 NH1 ARG A 678 35.941 29.058 27.915 1.00 55.99 N ATOM 593 NH2 ARG A 678 35.332 26.974 28.656 1.00 51.76 N ATOM 594 HE ARG A 678 34.960 28.085 30.842 1.00 0.00 H ATOM 595 HH12 ARG A 678 36.115 28.667 26.967 1.00 0.00 H ATOM 596 HH11 ARG A 678 36.100 30.070 28.097 1.00 0.00 H ATOM 597 HH22 ARG A 678 35.509 26.594 27.704 1.00 0.00 H ATOM 598 HH21 ARG A 678 35.012 26.342 29.417 1.00 0.00 H ATOM 599 H ARG A 678 33.880 33.657 31.225 1.00 0.00 H ATOM 600 N LEU A 679 31.761 33.554 28.729 1.00 39.75 N ATOM 601 CA LEU A 679 30.569 33.159 27.975 1.00 38.54 C ATOM 602 C LEU A 679 29.952 34.342 27.230 1.00 38.65 C ATOM 603 O LEU A 679 29.434 35.281 27.832 1.00 37.93 O ATOM 604 CB LEU A 679 29.565 32.407 28.875 1.00 38.30 C ATOM 605 CG LEU A 679 30.187 31.225 29.712 1.00 41.91 C ATOM 606 CD1 LEU A 679 29.126 30.481 30.492 1.00 41.54 C ATOM 607 CD2 LEU A 679 30.952 30.254 28.856 1.00 40.20 C ATOM 608 H LEU A 679 31.676 34.025 29.652 1.00 0.00 H ATOM 609 N LYS A 680 30.031 34.282 25.902 1.00 32.61 N ATOM 610 CA LYS A 680 29.661 35.371 25.017 1.00 32.43 C ATOM 611 C LYS A 680 28.794 34.844 23.859 1.00 37.44 C ATOM 612 O LYS A 680 29.313 34.504 22.793 1.00 38.30 O ATOM 613 CB LYS A 680 30.961 35.992 24.465 1.00 35.90 C ATOM 614 CG LYS A 680 31.729 36.831 25.494 1.00 50.31 C ATOM 615 CD LYS A 680 33.181 37.026 25.069 1.00 61.35 C ATOM 616 CE LYS A 680 33.823 38.230 25.728 1.00 80.90 C ATOM 617 NZ LYS A 680 34.036 38.037 27.189 1.00 94.11 N ATOM 618 HZ1 LYS A 680 33.120 37.869 27.652 1.00 0.00 H ATOM 619 HZ2 LYS A 680 34.659 37.218 27.342 1.00 0.00 H ATOM 620 HZ3 LYS A 680 34.477 38.889 27.589 1.00 0.00 H ATOM 621 H LYS A 680 30.379 33.401 25.473 1.00 0.00 H ATOM 622 N ASP A 681 27.484 34.792 24.065 1.00 33.63 N ATOM 623 CA ASP A 681 26.551 34.268 23.057 1.00 33.94 C ATOM 624 C ASP A 681 25.188 34.952 23.255 1.00 38.05 C ATOM 625 O ASP A 681 24.849 35.288 24.388 1.00 39.21 O ATOM 626 CB ASP A 681 26.407 32.733 23.225 1.00 33.91 C ATOM 627 CG ASP A 681 25.554 32.035 22.185 1.00 37.86 C ATOM 628 OD1 ASP A 681 26.063 31.781 21.065 1.00 35.14 O ATOM 629 OD2 ASP A 681 24.393 31.700 22.496 1.00 34.49 O ATOM 630 H ASP A 681 27.104 35.134 24.971 1.00 0.00 H ATOM 631 N PRO A 682 24.380 35.166 22.197 1.00 35.03 N ATOM 632 CA PRO A 682 23.050 35.769 22.409 1.00 34.49 C ATOM 633 C PRO A 682 22.114 35.003 23.340 1.00 36.02 C ATOM 634 O PRO A 682 21.197 35.610 23.870 1.00 35.68 O ATOM 635 CB PRO A 682 22.452 35.833 21.002 1.00 37.89 C ATOM 636 CG PRO A 682 23.605 35.775 20.085 1.00 43.70 C ATOM 637 CD PRO A 682 24.626 34.901 20.760 1.00 38.18 C ATOM 638 N ASN A 683 22.326 33.696 23.543 1.00 32.05 N ATOM 639 CA ASN A 683 21.386 32.926 24.354 1.00 30.20 C ATOM 640 C ASN A 683 22.004 32.400 25.641 1.00 34.64 C ATOM 641 O ASN A 683 21.523 31.410 26.199 1.00 33.57 O ATOM 642 CB ASN A 683 20.746 31.810 23.525 1.00 29.62 C ATOM 643 CG ASN A 683 19.894 32.338 22.399 1.00 36.69 C ATOM 644 OD1 ASN A 683 20.194 32.096 21.240 1.00 34.21 O ATOM 645 ND2 ASN A 683 18.821 33.078 22.735 1.00 28.08 N ATOM 646 HD22 ASN A 683 18.606 33.257 23.737 1.00 0.00 H ATOM 647 HD21 ASN A 683 18.207 33.471 21.993 1.00 0.00 H ATOM 648 H ASN A 683 23.157 33.231 23.125 1.00 0.00 H ATOM 649 N ILE A 684 23.088 33.074 26.107 1.00 31.61 N ATOM 650 CA ILE A 684 23.703 32.821 27.389 1.00 28.83 C ATOM 651 C ILE A 684 23.746 34.155 28.091 1.00 33.56 C ATOM 652 O ILE A 684 24.066 35.166 27.451 1.00 30.35 O ATOM 653 CB ILE A 684 25.155 32.244 27.234 1.00 32.54 C ATOM 654 CG1 ILE A 684 25.204 30.970 26.339 1.00 31.75 C ATOM 655 CG2 ILE A 684 25.801 31.963 28.641 1.00 32.60 C ATOM 656 CD1 ILE A 684 24.386 29.810 26.844 1.00 31.47 C ATOM 657 H ILE A 684 23.499 33.816 25.505 1.00 0.00 H ATOM 658 N ILE A 685 23.450 34.169 29.397 1.00 32.18 N ATOM 659 CA ILE A 685 23.617 35.408 30.161 1.00 34.07 C ATOM 660 C ILE A 685 25.043 36.022 29.962 1.00 32.89 C ATOM 661 O ILE A 685 26.024 35.311 29.985 1.00 31.21 O ATOM 662 CB ILE A 685 23.221 35.226 31.657 1.00 38.36 C ATOM 663 CG1 ILE A 685 22.937 36.586 32.337 1.00 39.60 C ATOM 664 CG2 ILE A 685 24.201 34.386 32.448 1.00 38.47 C ATOM 665 CD1 ILE A 685 21.494 37.149 31.985 1.00 41.68 C ATOM 666 H ILE A 685 23.104 33.307 29.865 1.00 0.00 H ATOM 667 N ARG A 686 25.130 37.321 29.744 1.00 33.24 N ATOM 668 CA ARG A 686 26.410 37.980 29.519 1.00 33.84 C ATOM 669 C ARG A 686 26.831 38.874 30.698 1.00 37.45 C ATOM 670 O ARG A 686 26.048 39.700 31.163 1.00 38.30 O ATOM 671 CB ARG A 686 26.358 38.810 28.207 1.00 34.43 C ATOM 672 CG ARG A 686 27.734 39.126 27.648 1.00 37.13 C ATOM 673 CD ARG A 686 27.684 39.862 26.325 1.00 57.08 C ATOM 674 NE ARG A 686 29.037 40.259 25.918 1.00 75.57 N ATOM 675 CZ ARG A 686 29.685 39.795 24.852 1.00 87.51 C ATOM 676 NH1 ARG A 686 29.108 38.911 24.047 1.00 72.76 N ATOM 677 NH2 ARG A 686 30.909 40.220 24.578 1.00 74.49 N ATOM 678 HE ARG A 686 29.529 40.959 26.510 1.00 0.00 H ATOM 679 HH12 ARG A 686 29.620 38.553 23.216 1.00 0.00 H ATOM 680 HH11 ARG A 686 28.144 38.577 24.248 1.00 0.00 H ATOM 681 HH22 ARG A 686 31.412 39.855 23.744 1.00 0.00 H ATOM 682 HH21 ARG A 686 31.367 40.919 25.197 1.00 0.00 H ATOM 683 H ARG A 686 24.260 37.891 29.733 1.00 0.00 H ATOM 684 N LEU A 687 28.075 38.726 31.160 1.00 33.70 N ATOM 685 CA LEU A 687 28.672 39.657 32.116 1.00 34.43 C ATOM 686 C LEU A 687 28.957 41.020 31.413 1.00 39.01 C ATOM 687 O LEU A 687 29.768 41.082 30.485 1.00 39.04 O ATOM 688 CB LEU A 687 29.969 39.034 32.655 1.00 35.54 C ATOM 689 CG LEU A 687 30.632 39.694 33.854 1.00 41.24 C ATOM 690 CD1 LEU A 687 29.722 39.655 35.058 1.00 40.17 C ATOM 691 CD2 LEU A 687 31.927 39.017 34.161 1.00 43.10 C ATOM 692 H LEU A 687 28.640 37.919 30.827 1.00 0.00 H ATOM 693 N LEU A 688 28.273 42.091 31.850 1.00 36.28 N ATOM 694 CA LEU A 688 28.454 43.454 31.304 1.00 38.48 C ATOM 695 C LEU A 688 29.575 44.182 32.017 1.00 47.05 C ATOM 696 O LEU A 688 30.177 45.105 31.451 1.00 48.34 O ATOM 697 CB LEU A 688 27.170 44.302 31.460 1.00 38.81 C ATOM 698 CG LEU A 688 25.862 43.817 30.847 1.00 42.61 C ATOM 699 CD1 LEU A 688 24.770 44.830 31.117 1.00 43.38 C ATOM 700 CD2 LEU A 688 25.993 43.585 29.323 1.00 45.57 C ATOM 701 H LEU A 688 27.579 41.954 32.613 1.00 0.00 H ATOM 702 N GLY A 689 29.836 43.779 33.258 1.00 43.23 N ATOM 703 CA GLY A 689 30.787 44.478 34.098 1.00 43.65 C ATOM 704 C GLY A 689 30.936 43.888 35.476 1.00 47.23 C ATOM 705 O GLY A 689 30.246 42.930 35.847 1.00 41.53 O ATOM 706 H GLY A 689 29.346 42.942 33.634 1.00 0.00 H ATOM 707 N VAL A 690 31.846 44.496 36.249 1.00 47.77 N ATOM 708 CA VAL A 690 32.314 43.976 37.526 1.00 48.16 C ATOM 709 C VAL A 690 32.745 45.150 38.430 1.00 55.53 C ATOM 710 O VAL A 690 33.189 46.167 37.901 1.00 54.69 O ATOM 711 CB VAL A 690 33.451 42.967 37.161 1.00 53.04 C ATOM 712 CG1 VAL A 690 34.836 43.380 37.652 1.00 54.62 C ATOM 713 CG2 VAL A 690 33.093 41.547 37.535 1.00 51.01 C ATOM 714 H VAL A 690 32.244 45.397 35.915 1.00 0.00 H ATOM 715 N CYS A 691 32.585 45.015 39.778 1.00 56.22 N ATOM 716 CA CYS A 691 33.164 45.911 40.813 1.00 60.02 C ATOM 717 C CYS A 691 34.399 45.195 41.523 1.00 74.34 C ATOM 718 O CYS A 691 34.868 45.729 42.540 1.00 76.42 O ATOM 719 CB CYS A 691 32.122 46.313 41.874 1.00 58.25 C ATOM 720 SG CYS A 691 30.529 46.952 41.260 1.00 59.96 S ATOM 721 H CYS A 691 32.008 44.216 40.110 1.00 0.00 H ATOM 722 N VAL A 692 34.921 44.020 41.015 1.00 74.88 N ATOM 723 CA VAL A 692 35.845 43.108 41.765 1.00 77.01 C ATOM 724 C VAL A 692 37.193 43.748 42.287 1.00 86.51 C ATOM 725 O VAL A 692 37.885 43.092 43.079 1.00 86.69 O ATOM 726 CB VAL A 692 36.178 41.744 41.071 1.00 80.35 C ATOM 727 CG1 VAL A 692 34.924 40.966 40.684 1.00 77.99 C ATOM 728 CG2 VAL A 692 37.140 41.900 39.894 1.00 81.52 C ATOM 729 H VAL A 692 34.655 43.750 40.047 1.00 0.00 H ATOM 730 N GLN A 693 37.556 44.979 41.860 1.00 86.78 N ATOM 731 CA GLN A 693 38.765 45.694 42.318 1.00 89.68 C ATOM 732 C GLN A 693 38.603 46.218 43.778 1.00 95.69 C ATOM 733 O GLN A 693 38.685 45.407 44.707 1.00 95.56 O ATOM 734 CB GLN A 693 39.213 46.789 41.310 1.00 92.88 C ATOM 735 CG GLN A 693 38.150 47.826 40.866 1.00109.79 C ATOM 736 CD GLN A 693 37.034 47.333 39.963 1.00126.18 C ATOM 737 OE1 GLN A 693 35.900 47.814 40.044 1.00120.30 O ATOM 738 NE2 GLN A 693 37.317 46.386 39.071 1.00118.13 N ATOM 739 HE22 GLN A 693 38.278 45.993 39.017 1.00 0.00 H ATOM 740 HE21 GLN A 693 36.577 46.040 38.428 1.00 0.00 H ATOM 741 H GLN A 693 36.945 45.453 41.165 1.00 0.00 H ATOM 742 N ASP A 694 38.386 47.542 43.986 1.00 93.63 N ATOM 743 CA ASP A 694 37.945 48.117 45.264 1.00 93.85 C ATOM 744 C ASP A 694 36.545 47.587 45.603 1.00 94.22 C ATOM 745 O ASP A 694 35.680 47.521 44.722 1.00 93.27 O ATOM 746 CB ASP A 694 37.935 49.658 45.186 1.00 98.39 C ATOM 747 CG ASP A 694 37.330 50.404 46.374 1.00115.50 C ATOM 748 OD1 ASP A 694 37.251 49.813 47.480 1.00116.64 O ATOM 749 OD2 ASP A 694 36.972 51.592 46.208 1.00124.22 O ATOM 750 H ASP A 694 38.542 48.191 43.189 1.00 0.00 H ATOM 751 N ASP A 695 36.333 47.217 46.882 1.00 87.75 N ATOM 752 CA ASP A 695 35.083 46.632 47.395 1.00 83.58 C ATOM 753 C ASP A 695 33.891 47.615 47.358 1.00 81.52 C ATOM 754 O ASP A 695 34.105 48.820 47.190 1.00 83.31 O ATOM 755 CB ASP A 695 35.296 46.094 48.827 1.00 85.79 C ATOM 756 CG ASP A 695 35.650 44.624 48.860 1.00 92.17 C ATOM 757 OD1 ASP A 695 34.788 43.815 49.270 1.00 90.68 O ATOM 758 OD2 ASP A 695 36.770 44.277 48.437 1.00 97.34 O ATOM 759 H ASP A 695 37.112 47.355 47.558 1.00 0.00 H ATOM 760 N PRO A 696 32.630 47.149 47.495 1.00 70.52 N ATOM 761 CA PRO A 696 32.156 45.752 47.509 1.00 66.03 C ATOM 762 C PRO A 696 32.098 45.086 46.143 1.00 61.03 C ATOM 763 O PRO A 696 31.850 45.744 45.134 1.00 60.50 O ATOM 764 CB PRO A 696 30.771 45.844 48.177 1.00 67.79 C ATOM 765 CG PRO A 696 30.556 47.312 48.542 1.00 74.72 C ATOM 766 CD PRO A 696 31.516 48.089 47.696 1.00 71.74 C ATOM 767 N LEU A 697 32.332 43.767 46.118 1.00 50.79 N ATOM 768 CA LEU A 697 32.268 42.944 44.898 1.00 46.93 C ATOM 769 C LEU A 697 30.883 42.988 44.268 1.00 46.49 C ATOM 770 O LEU A 697 29.871 42.964 44.976 1.00 41.38 O ATOM 771 CB LEU A 697 32.617 41.480 45.201 1.00 45.17 C ATOM 772 CG LEU A 697 33.959 41.173 45.877 1.00 50.68 C ATOM 773 CD1 LEU A 697 34.177 39.676 45.931 1.00 49.56 C ATOM 774 CD2 LEU A 697 35.141 41.875 45.160 1.00 52.60 C ATOM 775 H LEU A 697 32.573 43.296 47.013 1.00 0.00 H ATOM 776 N CYS A 698 30.847 43.057 42.937 1.00 45.26 N ATOM 777 CA CYS A 698 29.606 42.992 42.191 1.00 45.45 C ATOM 778 C CYS A 698 29.824 42.406 40.781 1.00 44.12 C ATOM 779 O CYS A 698 30.917 42.512 40.216 1.00 42.87 O ATOM 780 CB CYS A 698 28.886 44.353 42.184 1.00 49.15 C ATOM 781 SG CYS A 698 29.273 45.406 40.764 1.00 55.97 S ATOM 782 H CYS A 698 31.741 43.161 42.416 1.00 0.00 H ATOM 783 N MET A 699 28.779 41.767 40.248 1.00 38.53 N ATOM 784 CA MET A 699 28.667 41.295 38.871 1.00 37.79 C ATOM 785 C MET A 699 27.448 41.948 38.301 1.00 38.48 C ATOM 786 O MET A 699 26.425 41.999 38.966 1.00 36.24 O ATOM 787 CB MET A 699 28.418 39.792 38.827 1.00 39.20 C ATOM 788 CG MET A 699 29.652 38.970 38.862 1.00 42.88 C ATOM 789 SD MET A 699 29.197 37.213 38.724 1.00 44.34 S ATOM 790 CE MET A 699 29.141 36.810 40.387 1.00 40.80 C ATOM 791 H MET A 699 27.968 41.589 40.874 1.00 0.00 H ATOM 792 N ILE A 700 27.542 42.430 37.071 1.00 35.63 N ATOM 793 CA ILE A 700 26.458 43.145 36.383 1.00 34.90 C ATOM 794 C ILE A 700 26.099 42.421 35.108 1.00 39.02 C ATOM 795 O ILE A 700 26.988 42.196 34.291 1.00 39.07 O ATOM 796 CB ILE A 700 26.887 44.599 36.088 1.00 39.24 C ATOM 797 CG1 ILE A 700 27.357 45.321 37.372 1.00 40.59 C ATOM 798 CG2 ILE A 700 25.769 45.374 35.348 1.00 39.24 C ATOM 799 CD1 ILE A 700 28.097 46.654 37.106 1.00 49.29 C ATOM 800 H ILE A 700 28.438 42.294 36.561 1.00 0.00 H ATOM 801 N THR A 701 24.796 42.042 34.926 1.00 34.85 N ATOM 802 CA THR A 701 24.317 41.480 33.648 1.00 33.69 C ATOM 803 C THR A 701 23.172 42.310 33.098 1.00 38.56 C ATOM 804 O THR A 701 22.714 43.248 33.754 1.00 35.27 O ATOM 805 CB THR A 701 23.838 40.023 33.808 1.00 35.62 C ATOM 806 OG1 THR A 701 22.542 39.979 34.471 1.00 31.14 O ATOM 807 CG2 THR A 701 24.873 39.121 34.492 1.00 29.44 C ATOM 808 HG1 THR A 701 21.879 40.478 33.931 1.00 0.00 H ATOM 809 H THR A 701 24.124 42.153 35.712 1.00 0.00 H ATOM 810 N ASP A 702 22.697 41.963 31.890 1.00 38.02 N ATOM 811 CA ASP A 702 21.413 42.471 31.374 1.00 38.60 C ATOM 812 C ASP A 702 20.339 42.175 32.406 1.00 38.78 C ATOM 813 O ASP A 702 20.374 41.126 33.053 1.00 38.23 O ATOM 814 CB ASP A 702 21.035 41.729 30.055 1.00 41.66 C ATOM 815 CG ASP A 702 21.975 41.998 28.894 1.00 59.45 C ATOM 816 OD1 ASP A 702 22.246 43.186 28.612 1.00 61.19 O ATOM 817 OD2 ASP A 702 22.466 41.019 28.289 1.00 69.29 O ATOM 818 H ASP A 702 23.254 41.314 31.299 1.00 0.00 H ATOM 819 N TYR A 703 19.388 43.083 32.562 1.00 36.29 N ATOM 820 CA TYR A 703 18.218 42.781 33.336 1.00 35.09 C ATOM 821 C TYR A 703 17.206 42.125 32.426 1.00 37.10 C ATOM 822 O TYR A 703 16.733 42.747 31.469 1.00 39.08 O ATOM 823 CB TYR A 703 17.630 44.014 34.043 1.00 35.83 C ATOM 824 CG TYR A 703 16.279 43.746 34.668 1.00 36.11 C ATOM 825 CD1 TYR A 703 16.123 42.768 35.649 1.00 36.88 C ATOM 826 CD2 TYR A 703 15.145 44.445 34.253 1.00 37.38 C ATOM 827 CE1 TYR A 703 14.873 42.496 36.208 1.00 37.09 C ATOM 828 CE2 TYR A 703 13.898 44.207 34.829 1.00 38.10 C ATOM 829 CZ TYR A 703 13.771 43.233 35.807 1.00 39.15 C ATOM 830 OH TYR A 703 12.552 42.965 36.346 1.00 38.34 O ATOM 831 HH TYR A 703 12.642 42.249 37.023 1.00 0.00 H ATOM 832 H TYR A 703 19.489 44.020 32.121 1.00 0.00 H ATOM 833 N MET A 704 16.873 40.865 32.736 1.00 38.40 N ATOM 834 CA MET A 704 15.933 40.077 31.938 1.00 34.83 C ATOM 835 C MET A 704 14.548 40.269 32.536 1.00 38.25 C ATOM 836 O MET A 704 14.228 39.679 33.563 1.00 36.97 O ATOM 837 CB MET A 704 16.360 38.604 31.923 1.00 34.68 C ATOM 838 CG MET A 704 17.771 38.372 31.306 1.00 37.12 C ATOM 839 SD MET A 704 17.840 38.836 29.570 1.00 41.57 S ATOM 840 CE MET A 704 17.087 37.432 28.807 1.00 38.06 C ATOM 841 H MET A 704 17.300 40.429 33.578 1.00 0.00 H ATOM 842 N GLU A 705 13.714 41.108 31.897 1.00 36.31 N ATOM 843 CA GLU A 705 12.555 41.692 32.579 1.00 37.44 C ATOM 844 C GLU A 705 11.409 40.720 32.879 1.00 40.25 C ATOM 845 O GLU A 705 10.518 41.076 33.658 1.00 39.37 O ATOM 846 CB GLU A 705 12.025 42.931 31.809 1.00 40.43 C ATOM 847 CG GLU A 705 11.420 42.635 30.434 1.00 53.78 C ATOM 848 CD GLU A 705 10.663 43.795 29.796 1.00 76.56 C ATOM 849 OE1 GLU A 705 10.154 43.627 28.663 1.00 56.62 O ATOM 850 OE2 GLU A 705 10.552 44.863 30.441 1.00 73.34 O ATOM 851 H GLU A 705 13.894 41.347 30.901 1.00 0.00 H ATOM 852 N ASN A 706 11.414 39.521 32.277 1.00 35.73 N ATOM 853 CA ASN A 706 10.331 38.550 32.455 1.00 36.14 C ATOM 854 C ASN A 706 10.658 37.388 33.435 1.00 39.83 C ATOM 855 O ASN A 706 9.838 36.487 33.595 1.00 39.74 O ATOM 856 CB ASN A 706 9.854 38.042 31.098 1.00 39.28 C ATOM 857 CG ASN A 706 9.050 39.091 30.353 1.00 49.41 C ATOM 858 OD1 ASN A 706 8.066 39.598 30.852 1.00 41.54 O ATOM 859 ND2 ASN A 706 9.454 39.475 29.161 1.00 40.73 N ATOM 860 HD22 ASN A 706 10.297 39.041 28.733 1.00 0.00 H ATOM 861 HD21 ASN A 706 8.931 40.212 28.647 1.00 0.00 H ATOM 862 H ASN A 706 12.215 39.272 31.662 1.00 0.00 H ATOM 863 N GLY A 707 11.832 37.430 34.090 1.00 34.47 N ATOM 864 CA GLY A 707 12.174 36.482 35.149 1.00 32.28 C ATOM 865 C GLY A 707 12.527 35.139 34.580 1.00 33.81 C ATOM 866 O GLY A 707 12.859 35.061 33.409 1.00 34.17 O ATOM 867 H GLY A 707 12.522 38.164 33.833 1.00 0.00 H ATOM 868 N ASP A 708 12.449 34.089 35.378 1.00 31.23 N ATOM 869 CA ASP A 708 12.845 32.752 34.907 1.00 30.85 C ATOM 870 C ASP A 708 11.740 32.147 34.052 1.00 32.49 C ATOM 871 O ASP A 708 10.537 32.489 34.158 1.00 31.50 O ATOM 872 CB ASP A 708 13.319 31.816 36.058 1.00 32.22 C ATOM 873 CG ASP A 708 12.204 31.148 36.863 1.00 41.38 C ATOM 874 OD1 ASP A 708 11.359 30.449 36.255 1.00 40.03 O ATOM 875 OD2 ASP A 708 12.194 31.295 38.084 1.00 41.34 O ATOM 876 H ASP A 708 12.103 34.209 36.352 1.00 0.00 H ATOM 877 N LEU A 709 12.144 31.262 33.203 1.00 25.90 N ATOM 878 CA LEU A 709 11.242 30.710 32.186 1.00 26.18 C ATOM 879 C LEU A 709 10.169 29.818 32.772 1.00 30.68 C ATOM 880 O LEU A 709 9.090 29.704 32.180 1.00 32.02 O ATOM 881 CB LEU A 709 12.100 29.927 31.159 1.00 24.21 C ATOM 882 CG LEU A 709 11.394 29.226 29.967 1.00 25.34 C ATOM 883 CD1 LEU A 709 10.528 30.222 29.123 1.00 26.12 C ATOM 884 CD2 LEU A 709 12.468 28.523 29.081 1.00 24.05 C ATOM 885 H LEU A 709 13.130 30.933 33.241 1.00 0.00 H ATOM 886 N ASN A 710 10.460 29.180 33.922 1.00 25.75 N ATOM 887 CA ASN A 710 9.483 28.332 34.616 1.00 26.37 C ATOM 888 C ASN A 710 8.287 29.174 35.094 1.00 33.93 C ATOM 889 O ASN A 710 7.134 28.830 34.790 1.00 31.56 O ATOM 890 CB ASN A 710 10.147 27.644 35.822 1.00 28.04 C ATOM 891 CG ASN A 710 9.315 26.503 36.353 1.00 46.76 C ATOM 892 OD1 ASN A 710 9.707 25.347 36.319 1.00 38.75 O ATOM 893 ND2 ASN A 710 8.147 26.802 36.851 1.00 37.73 N ATOM 894 HD22 ASN A 710 7.829 27.792 36.872 1.00 0.00 H ATOM 895 HD21 ASN A 710 7.534 26.051 37.227 1.00 0.00 H ATOM 896 H ASN A 710 11.409 29.292 34.332 1.00 0.00 H ATOM 897 N GLN A 711 8.554 30.263 35.846 1.00 33.31 N ATOM 898 CA GLN A 711 7.489 31.189 36.269 1.00 36.05 C ATOM 899 C GLN A 711 6.735 31.800 35.053 1.00 40.47 C ATOM 900 O GLN A 711 5.499 31.840 35.038 1.00 38.46 O ATOM 901 CB GLN A 711 8.057 32.308 37.160 1.00 39.37 C ATOM 902 CG GLN A 711 8.573 31.834 38.513 1.00 67.18 C ATOM 903 CD GLN A 711 9.118 32.945 39.393 1.00102.76 C ATOM 904 OE1 GLN A 711 8.616 34.080 39.412 1.00102.90 O ATOM 905 NE2 GLN A 711 10.133 32.622 40.190 1.00 94.88 N ATOM 906 HE22 GLN A 711 10.537 31.664 40.156 1.00 0.00 H ATOM 907 HE21 GLN A 711 10.523 33.327 40.847 1.00 0.00 H ATOM 908 H GLN A 711 9.535 30.453 36.134 1.00 0.00 H ATOM 909 N PHE A 712 7.471 32.264 34.045 1.00 35.73 N ATOM 910 CA PHE A 712 6.873 32.827 32.811 1.00 35.85 C ATOM 911 C PHE A 712 5.901 31.840 32.080 1.00 37.31 C ATOM 912 O PHE A 712 4.733 32.173 31.891 1.00 39.48 O ATOM 913 CB PHE A 712 8.012 33.315 31.903 1.00 37.29 C ATOM 914 CG PHE A 712 7.616 33.974 30.608 1.00 39.15 C ATOM 915 CD1 PHE A 712 7.302 35.324 30.568 1.00 43.66 C ATOM 916 CD2 PHE A 712 7.587 33.250 29.422 1.00 40.96 C ATOM 917 CE1 PHE A 712 6.950 35.949 29.359 1.00 44.67 C ATOM 918 CE2 PHE A 712 7.244 33.875 28.218 1.00 45.54 C ATOM 919 CZ PHE A 712 6.928 35.227 28.201 1.00 43.41 C ATOM 920 H PHE A 712 8.507 32.230 34.127 1.00 0.00 H ATOM 921 N LEU A 713 6.371 30.640 31.680 1.00 31.64 N ATOM 922 CA LEU A 713 5.500 29.613 31.068 1.00 31.05 C ATOM 923 C LEU A 713 4.352 29.203 31.959 1.00 32.31 C ATOM 924 O LEU A 713 3.270 28.973 31.450 1.00 31.53 O ATOM 925 CB LEU A 713 6.295 28.362 30.600 1.00 29.67 C ATOM 926 CG LEU A 713 7.207 28.558 29.366 1.00 34.24 C ATOM 927 CD1 LEU A 713 7.871 27.282 28.982 1.00 34.58 C ATOM 928 CD2 LEU A 713 6.451 29.071 28.162 1.00 35.95 C ATOM 929 H LEU A 713 7.382 30.430 31.807 1.00 0.00 H ATOM 930 N SER A 714 4.576 29.122 33.295 1.00 32.97 N ATOM 931 CA SER A 714 3.470 28.901 34.253 1.00 35.69 C ATOM 932 C SER A 714 2.340 29.947 34.157 1.00 41.15 C ATOM 933 O SER A 714 1.184 29.622 34.462 1.00 40.20 O ATOM 934 CB SER A 714 3.992 28.837 35.685 1.00 36.10 C ATOM 935 OG SER A 714 4.848 27.720 35.744 1.00 41.90 O ATOM 936 HG SER A 714 5.590 27.840 35.100 1.00 0.00 H ATOM 937 H SER A 714 5.547 29.217 33.654 1.00 0.00 H ATOM 938 N ALA A 715 2.661 31.189 33.738 1.00 39.05 N ATOM 939 CA ALA A 715 1.650 32.257 33.650 1.00 40.64 C ATOM 940 C ALA A 715 0.930 32.293 32.293 1.00 44.27 C ATOM 941 O ALA A 715 0.023 33.107 32.111 1.00 43.96 O ATOM 942 CB ALA A 715 2.292 33.607 33.947 1.00 42.23 C ATOM 943 H ALA A 715 3.644 31.397 33.471 1.00 0.00 H ATOM 944 N HIS A 716 1.323 31.418 31.339 1.00 39.64 N ATOM 945 CA HIS A 716 0.738 31.364 29.983 1.00 38.65 C ATOM 946 C HIS A 716 -0.032 30.077 29.789 1.00 41.65 C ATOM 947 O HIS A 716 0.206 29.087 30.472 1.00 40.13 O ATOM 948 CB HIS A 716 1.837 31.479 28.877 1.00 38.45 C ATOM 949 CG HIS A 716 2.490 32.823 28.810 1.00 42.06 C ATOM 950 ND1 HIS A 716 3.322 33.279 29.824 1.00 43.37 N ATOM 951 CD2 HIS A 716 2.396 33.782 27.862 1.00 44.14 C ATOM 952 CE1 HIS A 716 3.707 34.486 29.461 1.00 42.85 C ATOM 953 NE2 HIS A 716 3.174 34.832 28.286 1.00 43.95 N ATOM 954 H HIS A 716 2.080 30.745 31.573 1.00 0.00 H ATOM 955 N GLN A 717 -0.969 30.091 28.845 1.00 38.70 N ATOM 956 CA GLN A 717 -1.663 28.892 28.416 1.00 38.28 C ATOM 957 C GLN A 717 -1.423 28.737 26.934 1.00 39.50 C ATOM 958 O GLN A 717 -1.186 29.744 26.281 1.00 41.45 O ATOM 959 CB GLN A 717 -3.184 29.083 28.658 1.00 41.21 C ATOM 960 CG GLN A 717 -3.620 28.617 30.037 1.00 57.70 C ATOM 961 CD GLN A 717 -5.125 28.691 30.210 1.00 75.22 C ATOM 962 OE1 GLN A 717 -5.820 29.518 29.601 1.00 59.10 O ATOM 963 NE2 GLN A 717 -5.658 27.813 31.044 1.00 73.07 N ATOM 964 HE22 GLN A 717 -5.049 27.131 31.541 1.00 0.00 H ATOM 965 HE21 GLN A 717 -6.686 27.804 31.203 1.00 0.00 H ATOM 966 H GLN A 717 -1.213 30.997 28.397 1.00 0.00 H ATOM 967 N LEU A 718 -1.507 27.499 26.392 1.00 35.04 N ATOM 968 CA LEU A 718 -1.354 27.263 24.954 1.00 33.74 C ATOM 969 C LEU A 718 -2.574 27.867 24.233 1.00 42.01 C ATOM 970 O LEU A 718 -3.698 27.591 24.638 1.00 41.95 O ATOM 971 CB LEU A 718 -1.276 25.754 24.669 1.00 33.33 C ATOM 972 CG LEU A 718 -0.961 25.410 23.226 1.00 38.89 C ATOM 973 CD1 LEU A 718 0.583 25.459 22.978 1.00 39.51 C ATOM 974 CD2 LEU A 718 -1.486 24.070 22.871 1.00 40.16 C ATOM 975 H LEU A 718 -1.686 26.688 27.018 1.00 0.00 H ATOM 976 N GLU A 719 -2.342 28.686 23.180 1.00 41.46 N ATOM 977 CA GLU A 719 -3.367 29.282 22.304 1.00 44.36 C ATOM 978 C GLU A 719 -4.398 28.196 21.909 1.00 49.89 C ATOM 979 O GLU A 719 -3.998 27.125 21.419 1.00 49.05 O ATOM 980 CB GLU A 719 -2.659 29.751 21.036 1.00 46.13 C ATOM 981 CG GLU A 719 -3.155 31.027 20.393 1.00 63.13 C ATOM 982 CD GLU A 719 -2.207 31.457 19.291 1.00 74.34 C ATOM 983 OE1 GLU A 719 -2.047 30.688 18.317 1.00 69.87 O ATOM 984 OE2 GLU A 719 -1.532 32.498 19.459 1.00 63.62 O ATOM 985 H GLU A 719 -1.350 28.916 22.970 1.00 0.00 H ATOM 986 N ASP A 720 -5.691 28.465 22.145 1.00 47.89 N ATOM 987 CA ASP A 720 -6.812 27.664 21.631 1.00 49.60 C ATOM 988 C ASP A 720 -7.079 28.023 20.155 1.00 55.01 C ATOM 989 O ASP A 720 -7.589 29.111 19.863 1.00 54.16 O ATOM 990 CB ASP A 720 -8.075 27.864 22.504 1.00 52.07 C ATOM 991 CG ASP A 720 -9.367 27.143 22.100 1.00 59.74 C ATOM 992 OD1 ASP A 720 -9.318 26.261 21.198 1.00 60.23 O ATOM 993 OD2 ASP A 720 -10.414 27.432 22.707 1.00 65.17 O ATOM 994 H ASP A 720 -5.915 29.295 22.730 1.00 0.00 H ATOM 995 N LYS A 721 -6.726 27.075 19.249 1.00 51.52 N ATOM 996 CA LYS A 721 -6.842 27.059 17.773 1.00 64.58 C ATOM 997 C LYS A 721 -5.597 27.624 17.093 1.00118.43 C ATOM 998 O LYS A 721 -4.667 26.876 16.792 1.00 87.45 O ATOM 999 CB LYS A 721 -8.131 27.730 17.230 1.00 68.50 C ATOM 1000 CG LYS A 721 -9.442 27.189 17.795 1.00 76.93 C ATOM 1001 CD LYS A 721 -10.343 28.347 18.207 1.00 88.49 C ATOM 1002 CE LYS A 721 -11.618 27.902 18.871 1.00100.54 C ATOM 1003 NZ LYS A 721 -12.606 27.391 17.887 1.00109.68 N ATOM 1004 HZ1 LYS A 721 -12.838 28.143 17.207 1.00 0.00 H ATOM 1005 HZ2 LYS A 721 -12.201 26.578 17.381 1.00 0.00 H ATOM 1006 HZ3 LYS A 721 -13.469 27.095 18.386 1.00 0.00 H ATOM 1007 H LYS A 721 -6.304 26.218 19.660 1.00 0.00 H TER 1008 LYS A 721 ATOM 1009 N PRO A 736 -3.151 35.391 29.125 1.00 58.42 N ATOM 1010 CA PRO A 736 -1.863 35.476 28.414 1.00 56.18 C ATOM 1011 C PRO A 736 -1.541 34.144 27.737 1.00 55.17 C ATOM 1012 O PRO A 736 -1.340 33.153 28.423 1.00 54.52 O ATOM 1013 CB PRO A 736 -0.857 35.859 29.516 1.00 57.31 C ATOM 1014 CG PRO A 736 -1.583 35.667 30.828 1.00 63.24 C ATOM 1015 CD PRO A 736 -2.956 35.093 30.556 1.00 60.01 C ATOM 1016 HN2 PRO A 736 -3.725 34.637 28.697 1.00 0.00 H ATOM 1017 HN1 PRO A 736 -3.649 36.299 29.033 1.00 0.00 H ATOM 1018 N THR A 737 -1.518 34.131 26.391 1.00 49.20 N ATOM 1019 CA THR A 737 -1.372 32.929 25.569 1.00 46.07 C ATOM 1020 C THR A 737 0.000 32.842 24.922 1.00 46.65 C ATOM 1021 O THR A 737 0.726 33.836 24.811 1.00 46.76 O ATOM 1022 CB THR A 737 -2.516 32.766 24.523 1.00 50.33 C ATOM 1023 OG1 THR A 737 -2.475 33.840 23.593 1.00 50.88 O ATOM 1024 CG2 THR A 737 -3.889 32.659 25.146 1.00 52.74 C ATOM 1025 HG1 THR A 737 -1.602 33.838 23.127 1.00 0.00 H ATOM 1026 H THR A 737 -1.611 35.043 25.899 1.00 0.00 H ATOM 1027 N ILE A 738 0.362 31.627 24.509 1.00 40.38 N ATOM 1028 CA ILE A 738 1.600 31.355 23.793 1.00 37.41 C ATOM 1029 C ILE A 738 1.301 30.373 22.686 1.00 38.10 C ATOM 1030 O ILE A 738 0.565 29.415 22.891 1.00 37.25 O ATOM 1031 CB ILE A 738 2.731 30.919 24.780 1.00 38.89 C ATOM 1032 CG1 ILE A 738 4.127 30.928 24.104 1.00 37.67 C ATOM 1033 CG2 ILE A 738 2.433 29.583 25.485 1.00 38.79 C ATOM 1034 CD1 ILE A 738 5.311 30.966 25.113 1.00 36.30 C ATOM 1035 H ILE A 738 -0.275 30.830 24.709 1.00 0.00 H ATOM 1036 N SER A 739 1.863 30.601 21.509 1.00 33.85 N ATOM 1037 CA SER A 739 1.626 29.685 20.422 1.00 33.20 C ATOM 1038 C SER A 739 2.600 28.508 20.436 1.00 35.87 C ATOM 1039 O SER A 739 3.725 28.589 20.974 1.00 33.97 O ATOM 1040 CB SER A 739 1.675 30.430 19.091 1.00 33.97 C ATOM 1041 OG SER A 739 3.028 30.652 18.743 1.00 32.08 O ATOM 1042 HG SER A 739 3.071 31.135 17.880 1.00 0.00 H ATOM 1043 H SER A 739 2.470 31.434 21.370 1.00 0.00 H ATOM 1044 N TYR A 740 2.173 27.406 19.834 1.00 33.62 N ATOM 1045 CA TYR A 740 3.066 26.264 19.613 1.00 31.43 C ATOM 1046 C TYR A 740 4.344 26.686 18.871 1.00 32.89 C ATOM 1047 O TYR A 740 5.425 26.342 19.347 1.00 30.03 O ATOM 1048 CB TYR A 740 2.325 25.111 18.887 1.00 34.64 C ATOM 1049 CG TYR A 740 3.231 23.962 18.503 1.00 35.69 C ATOM 1050 CD1 TYR A 740 3.728 23.085 19.465 1.00 37.09 C ATOM 1051 CD2 TYR A 740 3.601 23.756 17.177 1.00 37.77 C ATOM 1052 CE1 TYR A 740 4.577 22.032 19.115 1.00 36.56 C ATOM 1053 CE2 TYR A 740 4.439 22.700 16.814 1.00 37.89 C ATOM 1054 CZ TYR A 740 4.933 21.846 17.789 1.00 41.61 C ATOM 1055 OH TYR A 740 5.773 20.816 17.430 1.00 37.57 O ATOM 1056 HH TYR A 740 5.306 20.216 16.796 1.00 0.00 H ATOM 1057 H TYR A 740 1.186 27.351 19.512 1.00 0.00 H ATOM 1058 N PRO A 741 4.294 27.418 17.723 1.00 30.98 N ATOM 1059 CA PRO A 741 5.556 27.875 17.114 1.00 29.47 C ATOM 1060 C PRO A 741 6.421 28.704 18.058 1.00 33.37 C ATOM 1061 O PRO A 741 7.640 28.659 17.927 1.00 32.50 O ATOM 1062 CB PRO A 741 5.095 28.641 15.858 1.00 31.02 C ATOM 1063 CG PRO A 741 3.720 28.173 15.614 1.00 35.86 C ATOM 1064 CD PRO A 741 3.122 27.837 16.901 1.00 33.26 C ATOM 1065 N MET A 742 5.810 29.448 19.016 1.00 31.18 N ATOM 1066 CA MET A 742 6.590 30.169 20.044 1.00 30.64 C ATOM 1067 C MET A 742 7.274 29.222 21.035 1.00 33.96 C ATOM 1068 O MET A 742 8.401 29.481 21.477 1.00 32.08 O ATOM 1069 CB MET A 742 5.766 31.246 20.767 1.00 32.48 C ATOM 1070 CG MET A 742 6.635 32.131 21.666 1.00 36.10 C ATOM 1071 SD MET A 742 8.017 32.981 20.809 1.00 39.40 S ATOM 1072 CE MET A 742 7.178 34.359 20.174 1.00 36.51 C ATOM 1073 H MET A 742 4.772 29.512 19.027 1.00 0.00 H ATOM 1074 N LEU A 743 6.606 28.112 21.383 1.00 32.17 N ATOM 1075 CA LEU A 743 7.234 27.109 22.241 1.00 29.97 C ATOM 1076 C LEU A 743 8.461 26.562 21.557 1.00 33.35 C ATOM 1077 O LEU A 743 9.496 26.415 22.214 1.00 31.57 O ATOM 1078 CB LEU A 743 6.247 25.996 22.584 1.00 30.41 C ATOM 1079 CG LEU A 743 5.036 26.394 23.433 1.00 34.34 C ATOM 1080 CD1 LEU A 743 4.208 25.189 23.713 1.00 36.04 C ATOM 1081 CD2 LEU A 743 5.463 27.036 24.771 1.00 29.75 C ATOM 1082 H LEU A 743 5.635 27.964 21.040 1.00 0.00 H ATOM 1083 N LEU A 744 8.361 26.283 20.220 1.00 31.54 N ATOM 1084 CA LEU A 744 9.525 25.818 19.448 1.00 30.65 C ATOM 1085 C LEU A 744 10.634 26.846 19.435 1.00 33.41 C ATOM 1086 O LEU A 744 11.792 26.455 19.563 1.00 31.59 O ATOM 1087 CB LEU A 744 9.168 25.468 17.976 1.00 30.37 C ATOM 1088 CG LEU A 744 8.221 24.277 17.784 1.00 35.03 C ATOM 1089 CD1 LEU A 744 7.812 24.156 16.327 1.00 35.85 C ATOM 1090 CD2 LEU A 744 8.869 22.932 18.326 1.00 34.37 C ATOM 1091 H LEU A 744 7.446 26.402 19.741 1.00 0.00 H ATOM 1092 N HIS A 745 10.281 28.151 19.277 1.00 29.09 N ATOM 1093 CA HIS A 745 11.263 29.228 19.216 1.00 31.00 C ATOM 1094 C HIS A 745 12.017 29.367 20.535 1.00 34.87 C ATOM 1095 O HIS A 745 13.235 29.633 20.521 1.00 35.22 O ATOM 1096 CB HIS A 745 10.606 30.555 18.772 1.00 32.75 C ATOM 1097 CG HIS A 745 11.532 31.739 18.760 1.00 37.13 C ATOM 1098 ND1 HIS A 745 12.719 31.734 18.017 1.00 39.07 N ATOM 1099 CD2 HIS A 745 11.411 32.936 19.383 1.00 39.51 C ATOM 1100 CE1 HIS A 745 13.273 32.920 18.225 1.00 38.93 C ATOM 1101 NE2 HIS A 745 12.523 33.680 19.034 1.00 39.76 N ATOM 1102 H HIS A 745 9.272 28.390 19.197 1.00 0.00 H ATOM 1103 N VAL A 746 11.293 29.167 21.671 1.00 29.23 N ATOM 1104 CA VAL A 746 11.858 29.143 23.028 1.00 27.89 C ATOM 1105 C VAL A 746 12.885 28.006 23.162 1.00 31.47 C ATOM 1106 O VAL A 746 14.028 28.253 23.551 1.00 27.64 O ATOM 1107 CB VAL A 746 10.735 29.109 24.114 1.00 30.65 C ATOM 1108 CG1 VAL A 746 11.258 28.613 25.456 1.00 29.27 C ATOM 1109 CG2 VAL A 746 10.051 30.501 24.251 1.00 31.08 C ATOM 1110 H VAL A 746 10.268 29.021 21.572 1.00 0.00 H ATOM 1111 N ALA A 747 12.465 26.760 22.822 1.00 29.55 N ATOM 1112 CA ALA A 747 13.322 25.585 22.795 1.00 29.34 C ATOM 1113 C ALA A 747 14.504 25.729 21.844 1.00 31.75 C ATOM 1114 O ALA A 747 15.587 25.324 22.209 1.00 30.28 O ATOM 1115 CB ALA A 747 12.513 24.368 22.401 1.00 29.66 C ATOM 1116 H ALA A 747 11.465 26.638 22.564 1.00 0.00 H ATOM 1117 N ALA A 748 14.318 26.267 20.650 1.00 28.77 N ATOM 1118 CA ALA A 748 15.450 26.493 19.699 1.00 26.88 C ATOM 1119 C ALA A 748 16.509 27.426 20.276 1.00 30.98 C ATOM 1120 O ALA A 748 17.694 27.178 20.088 1.00 30.43 O ATOM 1121 CB ALA A 748 14.951 27.019 18.346 1.00 26.76 C ATOM 1122 H ALA A 748 13.356 26.541 20.364 1.00 0.00 H ATOM 1123 N GLN A 749 16.096 28.511 20.971 1.00 29.51 N ATOM 1124 CA GLN A 749 17.052 29.451 21.586 1.00 29.11 C ATOM 1125 C GLN A 749 17.871 28.778 22.700 1.00 32.07 C ATOM 1126 O GLN A 749 19.087 29.007 22.794 1.00 31.31 O ATOM 1127 CB GLN A 749 16.323 30.641 22.175 1.00 29.52 C ATOM 1128 CG GLN A 749 15.723 31.546 21.109 1.00 30.20 C ATOM 1129 CD GLN A 749 15.015 32.687 21.785 1.00 35.34 C ATOM 1130 OE1 GLN A 749 15.666 33.600 22.297 1.00 34.48 O ATOM 1131 NE2 GLN A 749 13.685 32.603 21.939 1.00 27.41 N ATOM 1132 HE22 GLN A 749 13.159 31.823 21.497 1.00 0.00 H ATOM 1133 HE21 GLN A 749 13.180 33.318 22.501 1.00 0.00 H ATOM 1134 H GLN A 749 15.076 28.687 21.074 1.00 0.00 H ATOM 1135 N ILE A 750 17.209 27.958 23.540 1.00 26.86 N ATOM 1136 CA ILE A 750 17.954 27.161 24.542 1.00 25.88 C ATOM 1137 C ILE A 750 18.957 26.245 23.803 1.00 28.79 C ATOM 1138 O ILE A 750 20.125 26.144 24.216 1.00 27.46 O ATOM 1139 CB ILE A 750 17.007 26.363 25.477 1.00 26.70 C ATOM 1140 CG1 ILE A 750 16.073 27.333 26.278 1.00 27.45 C ATOM 1141 CG2 ILE A 750 17.861 25.531 26.476 1.00 23.18 C ATOM 1142 CD1 ILE A 750 14.852 26.698 26.808 1.00 31.19 C ATOM 1143 H ILE A 750 16.173 27.885 23.485 1.00 0.00 H ATOM 1144 N ALA A 751 18.502 25.581 22.727 1.00 24.79 N ATOM 1145 CA ALA A 751 19.374 24.632 21.986 1.00 25.60 C ATOM 1146 C ALA A 751 20.554 25.383 21.371 1.00 30.56 C ATOM 1147 O ALA A 751 21.644 24.850 21.359 1.00 30.24 O ATOM 1148 CB ALA A 751 18.580 23.879 20.916 1.00 24.72 C ATOM 1149 H ALA A 751 17.524 25.733 22.407 1.00 0.00 H ATOM 1150 N SER A 752 20.350 26.632 20.870 1.00 29.78 N ATOM 1151 CA SER A 752 21.473 27.398 20.277 1.00 30.24 C ATOM 1152 C SER A 752 22.487 27.812 21.388 1.00 32.53 C ATOM 1153 O SER A 752 23.730 27.783 21.188 1.00 29.13 O ATOM 1154 CB SER A 752 20.944 28.641 19.543 1.00 31.53 C ATOM 1155 OG SER A 752 21.989 29.347 18.892 1.00 36.24 O ATOM 1156 HG SER A 752 22.656 29.639 19.563 1.00 0.00 H ATOM 1157 H SER A 752 19.399 27.052 20.903 1.00 0.00 H ATOM 1158 N GLY A 753 21.948 28.189 22.555 1.00 28.92 N ATOM 1159 CA GLY A 753 22.785 28.544 23.690 1.00 28.43 C ATOM 1160 C GLY A 753 23.651 27.386 24.110 1.00 32.65 C ATOM 1161 O GLY A 753 24.863 27.547 24.310 1.00 32.59 O ATOM 1162 H GLY A 753 20.913 28.228 22.651 1.00 0.00 H ATOM 1163 N MET A 754 23.027 26.204 24.229 1.00 28.57 N ATOM 1164 CA MET A 754 23.733 24.956 24.553 1.00 28.42 C ATOM 1165 C MET A 754 24.728 24.510 23.479 1.00 33.28 C ATOM 1166 O MET A 754 25.783 23.958 23.822 1.00 30.34 O ATOM 1167 CB MET A 754 22.741 23.812 24.853 1.00 29.46 C ATOM 1168 CG MET A 754 21.888 24.032 26.094 1.00 29.97 C ATOM 1169 SD MET A 754 22.809 24.333 27.638 1.00 31.69 S ATOM 1170 CE MET A 754 23.651 22.709 27.849 1.00 28.45 C ATOM 1171 H MET A 754 21.998 26.169 24.086 1.00 0.00 H ATOM 1172 N ARG A 755 24.388 24.747 22.177 1.00 33.09 N ATOM 1173 CA ARG A 755 25.285 24.522 21.041 1.00 30.95 C ATOM 1174 C ARG A 755 26.572 25.294 21.252 1.00 34.12 C ATOM 1175 O ARG A 755 27.653 24.746 21.050 1.00 30.48 O ATOM 1176 CB ARG A 755 24.598 24.896 19.707 1.00 31.25 C ATOM 1177 CG ARG A 755 25.462 24.650 18.434 1.00 36.55 C ATOM 1178 CD ARG A 755 24.795 25.067 17.120 1.00 41.15 C ATOM 1179 NE ARG A 755 24.091 26.357 17.210 1.00 48.47 N ATOM 1180 CZ ARG A 755 23.187 26.798 16.332 1.00 59.22 C ATOM 1181 NH1 ARG A 755 22.862 26.063 15.272 1.00 40.39 N ATOM 1182 NH2 ARG A 755 22.604 27.978 16.506 1.00 43.22 N ATOM 1183 HE ARG A 755 24.315 26.971 18.019 1.00 0.00 H ATOM 1184 HH12 ARG A 755 22.157 26.413 14.593 1.00 0.00 H ATOM 1185 HH11 ARG A 755 23.313 25.138 15.123 1.00 0.00 H ATOM 1186 HH22 ARG A 755 21.900 28.317 15.819 1.00 0.00 H ATOM 1187 HH21 ARG A 755 22.851 28.564 17.329 1.00 0.00 H ATOM 1188 H ARG A 755 23.433 25.110 21.980 1.00 0.00 H ATOM 1189 N TYR A 756 26.464 26.567 21.673 1.00 31.97 N ATOM 1190 CA TYR A 756 27.637 27.400 21.944 1.00 31.35 C ATOM 1191 C TYR A 756 28.470 26.846 23.116 1.00 35.33 C ATOM 1192 O TYR A 756 29.687 26.733 22.982 1.00 36.68 O ATOM 1193 CB TYR A 756 27.208 28.846 22.209 1.00 31.07 C ATOM 1194 CG TYR A 756 28.296 29.687 22.855 1.00 32.05 C ATOM 1195 CD1 TYR A 756 29.318 30.254 22.088 1.00 34.27 C ATOM 1196 CD2 TYR A 756 28.298 29.925 24.233 1.00 29.88 C ATOM 1197 CE1 TYR A 756 30.320 31.029 22.676 1.00 35.37 C ATOM 1198 CE2 TYR A 756 29.307 30.680 24.834 1.00 29.92 C ATOM 1199 CZ TYR A 756 30.303 31.247 24.049 1.00 37.26 C ATOM 1200 OH TYR A 756 31.279 32.021 24.627 1.00 36.28 O ATOM 1201 HH TYR A 756 31.902 32.342 23.927 1.00 0.00 H ATOM 1202 H TYR A 756 25.516 26.973 21.810 1.00 0.00 H ATOM 1203 N LEU A 757 27.825 26.510 24.253 1.00 30.51 N ATOM 1204 CA LEU A 757 28.499 25.851 25.388 1.00 31.07 C ATOM 1205 C LEU A 757 29.268 24.574 24.990 1.00 35.48 C ATOM 1206 O LEU A 757 30.423 24.420 25.379 1.00 35.16 O ATOM 1207 CB LEU A 757 27.527 25.561 26.564 1.00 28.95 C ATOM 1208 CG LEU A 757 26.843 26.782 27.251 1.00 32.17 C ATOM 1209 CD1 LEU A 757 26.016 26.291 28.504 1.00 28.08 C ATOM 1210 CD2 LEU A 757 27.894 27.845 27.708 1.00 34.84 C ATOM 1211 H LEU A 757 26.810 26.725 24.332 1.00 0.00 H ATOM 1212 N ALA A 758 28.636 23.689 24.208 1.00 33.09 N ATOM 1213 CA ALA A 758 29.268 22.491 23.657 1.00 34.43 C ATOM 1214 C ALA A 758 30.545 22.773 22.842 1.00 39.98 C ATOM 1215 O ALA A 758 31.503 21.993 22.961 1.00 39.86 O ATOM 1216 CB ALA A 758 28.266 21.677 22.847 1.00 35.13 C ATOM 1217 H ALA A 758 27.637 23.864 23.979 1.00 0.00 H ATOM 1218 N THR A 759 30.590 23.880 22.022 1.00 36.35 N ATOM 1219 CA THR A 759 31.816 24.207 21.261 1.00 37.16 C ATOM 1220 C THR A 759 32.979 24.552 22.183 1.00 43.16 C ATOM 1221 O THR A 759 34.130 24.380 21.795 1.00 45.58 O ATOM 1222 CB THR A 759 31.643 25.380 20.256 1.00 43.25 C ATOM 1223 OG1 THR A 759 31.472 26.602 20.987 1.00 39.26 O ATOM 1224 CG2 THR A 759 30.512 25.165 19.301 1.00 38.81 C ATOM 1225 HG1 THR A 759 30.668 26.532 21.560 1.00 0.00 H ATOM 1226 H THR A 759 29.753 24.492 21.937 1.00 0.00 H ATOM 1227 N LEU A 760 32.676 25.041 23.392 1.00 38.09 N ATOM 1228 CA LEU A 760 33.680 25.416 24.391 1.00 38.88 C ATOM 1229 C LEU A 760 33.978 24.254 25.321 1.00 43.18 C ATOM 1230 O LEU A 760 34.757 24.419 26.262 1.00 44.18 O ATOM 1231 CB LEU A 760 33.182 26.591 25.236 1.00 38.57 C ATOM 1232 CG LEU A 760 32.931 27.945 24.577 1.00 43.29 C ATOM 1233 CD1 LEU A 760 32.381 28.898 25.603 1.00 43.57 C ATOM 1234 CD2 LEU A 760 34.197 28.512 23.989 1.00 47.63 C ATOM 1235 H LEU A 760 31.672 25.161 23.636 1.00 0.00 H ATOM 1236 N ASN A 761 33.340 23.078 25.075 1.00 39.04 N ATOM 1237 CA ASN A 761 33.429 21.904 25.942 1.00 38.42 C ATOM 1238 C ASN A 761 33.059 22.336 27.383 1.00 40.36 C ATOM 1239 O ASN A 761 33.675 21.908 28.356 1.00 39.54 O ATOM 1240 CB ASN A 761 34.841 21.241 25.825 1.00 43.29 C ATOM 1241 CG ASN A 761 35.245 20.903 24.415 1.00 66.29 C ATOM 1242 OD1 ASN A 761 34.614 20.090 23.736 1.00 67.64 O ATOM 1243 ND2 ASN A 761 36.303 21.534 23.938 1.00 64.59 N ATOM 1244 HD22 ASN A 761 36.815 22.215 24.535 1.00 0.00 H ATOM 1245 HD21 ASN A 761 36.624 21.350 22.966 1.00 0.00 H ATOM 1246 H ASN A 761 32.754 23.010 24.219 1.00 0.00 H ATOM 1247 N PHE A 762 32.034 23.218 27.499 1.00 33.86 N ATOM 1248 CA PHE A 762 31.587 23.699 28.793 1.00 32.40 C ATOM 1249 C PHE A 762 30.330 22.901 29.153 1.00 33.37 C ATOM 1250 O PHE A 762 29.373 22.932 28.398 1.00 33.42 O ATOM 1251 CB PHE A 762 31.286 25.211 28.751 1.00 34.31 C ATOM 1252 CG PHE A 762 30.870 25.800 30.083 1.00 35.37 C ATOM 1253 CD1 PHE A 762 31.805 26.408 30.913 1.00 40.88 C ATOM 1254 CD2 PHE A 762 29.537 25.758 30.499 1.00 35.15 C ATOM 1255 CE1 PHE A 762 31.417 26.956 32.141 1.00 40.95 C ATOM 1256 CE2 PHE A 762 29.146 26.314 31.716 1.00 37.75 C ATOM 1257 CZ PHE A 762 30.087 26.905 32.535 1.00 37.94 C ATOM 1258 H PHE A 762 31.557 23.557 26.639 1.00 0.00 H ATOM 1259 N VAL A 763 30.353 22.196 30.278 1.00 28.26 N ATOM 1260 CA VAL A 763 29.233 21.358 30.756 1.00 28.65 C ATOM 1261 C VAL A 763 28.415 22.199 31.760 1.00 34.65 C ATOM 1262 O VAL A 763 28.974 22.722 32.700 1.00 35.58 O ATOM 1263 CB VAL A 763 29.701 19.991 31.318 1.00 30.99 C ATOM 1264 CG1 VAL A 763 28.511 19.168 31.815 1.00 30.26 C ATOM 1265 CG2 VAL A 763 30.465 19.201 30.245 1.00 30.26 C ATOM 1266 H VAL A 763 31.214 22.236 30.860 1.00 0.00 H ATOM 1267 N HIS A 764 27.102 22.340 31.535 1.00 30.70 N ATOM 1268 CA HIS A 764 26.266 23.244 32.337 1.00 28.27 C ATOM 1269 C HIS A 764 25.953 22.609 33.689 1.00 31.61 C ATOM 1270 O HIS A 764 26.084 23.262 34.731 1.00 31.92 O ATOM 1271 CB HIS A 764 24.966 23.625 31.567 1.00 28.13 C ATOM 1272 CG HIS A 764 24.164 24.655 32.319 1.00 30.51 C ATOM 1273 ND1 HIS A 764 23.486 24.340 33.500 1.00 31.04 N ATOM 1274 CD2 HIS A 764 23.996 25.964 32.062 1.00 30.34 C ATOM 1275 CE1 HIS A 764 22.924 25.467 33.896 1.00 29.10 C ATOM 1276 NE2 HIS A 764 23.199 26.460 33.065 1.00 30.04 N ATOM 1277 H HIS A 764 26.661 21.793 30.769 1.00 0.00 H ATOM 1278 N ARG A 765 25.543 21.328 33.662 1.00 26.48 N ATOM 1279 CA ARG A 765 25.180 20.472 34.800 1.00 27.37 C ATOM 1280 C ARG A 765 23.856 20.794 35.439 1.00 28.63 C ATOM 1281 O ARG A 765 23.392 19.995 36.253 1.00 27.85 O ATOM 1282 CB ARG A 765 26.239 20.455 35.921 1.00 30.69 C ATOM 1283 CG ARG A 765 27.682 20.190 35.480 1.00 37.28 C ATOM 1284 CD ARG A 765 28.617 20.708 36.569 1.00 46.28 C ATOM 1285 NE ARG A 765 28.736 19.764 37.690 1.00 48.44 N ATOM 1286 CZ ARG A 765 29.590 18.742 37.722 1.00 60.96 C ATOM 1287 NH1 ARG A 765 30.392 18.508 36.695 1.00 49.29 N ATOM 1288 NH2 ARG A 765 29.642 17.943 38.784 1.00 48.61 N ATOM 1289 HE ARG A 765 28.113 19.903 38.511 1.00 0.00 H ATOM 1290 HH12 ARG A 765 31.057 17.709 36.726 1.00 0.00 H ATOM 1291 HH11 ARG A 765 30.357 19.124 35.857 1.00 0.00 H ATOM 1292 HH22 ARG A 765 30.311 17.147 38.803 1.00 0.00 H ATOM 1293 HH21 ARG A 765 29.014 18.115 39.595 1.00 0.00 H ATOM 1294 H ARG A 765 25.475 20.890 32.721 1.00 0.00 H ATOM 1295 N ASP A 766 23.227 21.937 35.129 1.00 26.36 N ATOM 1296 CA ASP A 766 21.887 22.150 35.731 1.00 26.14 C ATOM 1297 C ASP A 766 20.936 22.839 34.735 1.00 28.92 C ATOM 1298 O ASP A 766 20.283 23.843 35.063 1.00 27.41 O ATOM 1299 CB ASP A 766 22.003 22.900 37.109 1.00 27.39 C ATOM 1300 CG ASP A 766 20.736 22.879 37.971 1.00 29.29 C ATOM 1301 OD1 ASP A 766 19.812 22.102 37.656 1.00 28.72 O ATOM 1302 OD2 ASP A 766 20.695 23.618 38.993 1.00 25.02 O ATOM 1303 H ASP A 766 23.658 22.641 34.496 1.00 0.00 H ATOM 1304 N LEU A 767 20.864 22.297 33.508 1.00 25.56 N ATOM 1305 CA LEU A 767 19.938 22.848 32.539 1.00 25.97 C ATOM 1306 C LEU A 767 18.485 22.478 32.952 1.00 29.11 C ATOM 1307 O LEU A 767 18.183 21.308 33.221 1.00 25.73 O ATOM 1308 CB LEU A 767 20.286 22.429 31.080 1.00 26.63 C ATOM 1309 CG LEU A 767 19.327 22.987 29.991 1.00 31.70 C ATOM 1310 CD1 LEU A 767 19.348 24.536 29.951 1.00 31.77 C ATOM 1311 CD2 LEU A 767 19.676 22.413 28.622 1.00 30.62 C ATOM 1312 H LEU A 767 21.468 21.489 33.256 1.00 0.00 H ATOM 1313 N ALA A 768 17.603 23.496 33.026 1.00 26.06 N ATOM 1314 CA ALA A 768 16.166 23.338 33.416 1.00 26.25 C ATOM 1315 C ALA A 768 15.525 24.665 33.120 1.00 26.82 C ATOM 1316 O ALA A 768 16.249 25.671 33.025 1.00 25.24 O ATOM 1317 CB ALA A 768 16.061 23.083 34.919 1.00 27.00 C ATOM 1318 H ALA A 768 17.943 24.452 32.798 1.00 0.00 H ATOM 1319 N THR A 769 14.189 24.716 32.987 1.00 22.63 N ATOM 1320 CA THR A 769 13.552 26.024 32.710 1.00 23.53 C ATOM 1321 C THR A 769 13.770 27.028 33.838 1.00 26.39 C ATOM 1322 O THR A 769 13.845 28.223 33.560 1.00 25.05 O ATOM 1323 CB THR A 769 12.065 25.906 32.396 1.00 22.48 C ATOM 1324 OG1 THR A 769 11.375 25.358 33.539 1.00 25.74 O ATOM 1325 CG2 THR A 769 11.824 25.075 31.111 1.00 19.52 C ATOM 1326 HG1 THR A 769 11.742 24.462 33.746 1.00 0.00 H ATOM 1327 H THR A 769 13.614 23.854 33.077 1.00 0.00 H ATOM 1328 N ARG A 770 13.876 26.547 35.102 1.00 25.15 N ATOM 1329 CA ARG A 770 14.103 27.435 36.253 1.00 24.60 C ATOM 1330 C ARG A 770 15.468 28.193 36.126 1.00 28.65 C ATOM 1331 O ARG A 770 15.632 29.219 36.792 1.00 28.12 O ATOM 1332 CB ARG A 770 14.104 26.632 37.574 1.00 27.22 C ATOM 1333 CG ARG A 770 15.267 25.603 37.721 1.00 26.54 C ATOM 1334 CD ARG A 770 15.276 24.787 39.050 1.00 26.11 C ATOM 1335 NE ARG A 770 16.284 23.730 38.877 1.00 27.45 N ATOM 1336 CZ ARG A 770 16.034 22.552 38.308 1.00 34.43 C ATOM 1337 NH1 ARG A 770 14.809 22.249 37.904 1.00 26.80 N ATOM 1338 NH2 ARG A 770 17.012 21.678 38.121 1.00 28.40 N ATOM 1339 HE ARG A 770 17.249 23.913 39.219 1.00 0.00 H ATOM 1340 HH12 ARG A 770 14.621 21.327 37.460 1.00 0.00 H ATOM 1341 HH11 ARG A 770 14.036 22.933 38.030 1.00 0.00 H ATOM 1342 HH22 ARG A 770 16.811 20.760 37.676 1.00 0.00 H ATOM 1343 HH21 ARG A 770 17.981 21.910 38.419 1.00 0.00 H ATOM 1344 H ARG A 770 13.795 25.523 35.262 1.00 0.00 H ATOM 1345 N ASN A 771 16.433 27.661 35.296 1.00 24.89 N ATOM 1346 CA ASN A 771 17.757 28.299 35.084 1.00 26.23 C ATOM 1347 C ASN A 771 17.853 29.062 33.799 1.00 27.57 C ATOM 1348 O ASN A 771 18.951 29.439 33.431 1.00 28.62 O ATOM 1349 CB ASN A 771 18.910 27.299 35.225 1.00 21.74 C ATOM 1350 CG ASN A 771 19.021 26.899 36.667 1.00 35.55 C ATOM 1351 OD1 ASN A 771 18.622 27.648 37.561 1.00 36.50 O ATOM 1352 ND2 ASN A 771 19.395 25.670 36.939 1.00 30.83 N ATOM 1353 HD22 ASN A 771 19.730 25.047 36.176 1.00 0.00 H ATOM 1354 HD21 ASN A 771 19.356 25.319 37.917 1.00 0.00 H ATOM 1355 H ASN A 771 16.224 26.773 34.796 1.00 0.00 H ATOM 1356 N CYS A 772 16.702 29.289 33.127 1.00 25.53 N ATOM 1357 CA CYS A 772 16.599 30.119 31.916 1.00 26.35 C ATOM 1358 C CYS A 772 15.902 31.408 32.252 1.00 30.87 C ATOM 1359 O CYS A 772 14.946 31.397 33.019 1.00 27.92 O ATOM 1360 CB CYS A 772 15.892 29.377 30.787 1.00 26.92 C ATOM 1361 SG CYS A 772 16.779 27.894 30.245 1.00 30.98 S ATOM 1362 H CYS A 772 15.833 28.848 33.490 1.00 0.00 H ATOM 1363 N LEU A 773 16.381 32.514 31.663 1.00 26.69 N ATOM 1364 CA LEU A 773 15.823 33.841 31.893 1.00 28.87 C ATOM 1365 C LEU A 773 15.154 34.326 30.622 1.00 32.79 C ATOM 1366 O LEU A 773 15.571 33.931 29.535 1.00 29.34 O ATOM 1367 CB LEU A 773 16.888 34.819 32.388 1.00 29.67 C ATOM 1368 CG LEU A 773 17.350 34.596 33.850 1.00 35.12 C ATOM 1369 CD1 LEU A 773 18.679 35.336 34.142 1.00 35.01 C ATOM 1370 CD2 LEU A 773 16.239 35.022 34.849 1.00 34.20 C ATOM 1371 H LEU A 773 17.187 32.420 31.013 1.00 0.00 H ATOM 1372 N VAL A 774 14.117 35.156 30.773 1.00 29.61 N ATOM 1373 CA VAL A 774 13.297 35.633 29.643 1.00 31.59 C ATOM 1374 C VAL A 774 13.392 37.139 29.565 1.00 35.12 C ATOM 1375 O VAL A 774 13.157 37.824 30.562 1.00 37.62 O ATOM 1376 CB VAL A 774 11.814 35.169 29.777 1.00 35.77 C ATOM 1377 CG1 VAL A 774 10.983 35.533 28.540 1.00 36.19 C ATOM 1378 CG2 VAL A 774 11.728 33.666 30.072 1.00 33.86 C ATOM 1379 H VAL A 774 13.877 35.481 31.732 1.00 0.00 H ATOM 1380 N GLY A 775 13.731 37.642 28.386 1.00 32.79 N ATOM 1381 CA GLY A 775 13.823 39.074 28.115 1.00 36.00 C ATOM 1382 C GLY A 775 12.630 39.579 27.333 1.00 41.95 C ATOM 1383 O GLY A 775 11.521 39.057 27.455 1.00 40.86 O ATOM 1384 H GLY A 775 13.943 36.981 27.612 1.00 0.00 H ATOM 1385 N GLU A 776 12.860 40.602 26.535 1.00 41.78 N ATOM 1386 CA GLU A 776 11.857 41.199 25.645 1.00 42.28 C ATOM 1387 C GLU A 776 11.711 40.292 24.429 1.00 46.30 C ATOM 1388 O GLU A 776 12.684 39.639 24.020 1.00 41.75 O ATOM 1389 CB GLU A 776 12.346 42.560 25.157 1.00 44.99 C ATOM 1390 CG GLU A 776 12.487 43.607 26.246 1.00 52.48 C ATOM 1391 CD GLU A 776 13.128 44.897 25.773 1.00 82.66 C ATOM 1392 OE1 GLU A 776 12.695 45.424 24.721 1.00 70.19 O ATOM 1393 OE2 GLU A 776 14.041 45.398 26.472 1.00 83.31 O ATOM 1394 H GLU A 776 13.815 41.014 26.536 1.00 0.00 H ATOM 1395 N ASN A 777 10.495 40.258 23.849 1.00 45.34 N ATOM 1396 CA ASN A 777 10.186 39.513 22.607 1.00 44.81 C ATOM 1397 C ASN A 777 10.601 38.047 22.705 1.00 45.87 C ATOM 1398 O ASN A 777 11.206 37.516 21.777 1.00 44.23 O ATOM 1399 CB ASN A 777 10.822 40.195 21.386 1.00 48.90 C ATOM 1400 CG ASN A 777 10.450 41.634 21.245 1.00 72.93 C ATOM 1401 OD1 ASN A 777 9.307 41.972 20.925 1.00 71.89 O ATOM 1402 ND2 ASN A 777 11.410 42.508 21.490 1.00 64.64 N ATOM 1403 HD22 ASN A 777 12.359 42.177 21.757 1.00 0.00 H ATOM 1404 HD21 ASN A 777 11.217 43.527 21.416 1.00 0.00 H ATOM 1405 H ASN A 777 9.724 40.789 24.303 1.00 0.00 H ATOM 1406 N PHE A 778 10.282 37.399 23.851 1.00 42.17 N ATOM 1407 CA PHE A 778 10.521 35.976 24.123 1.00 41.14 C ATOM 1408 C PHE A 778 12.004 35.511 23.938 1.00 39.52 C ATOM 1409 O PHE A 778 12.260 34.341 23.634 1.00 40.61 O ATOM 1410 CB PHE A 778 9.557 35.111 23.294 1.00 43.80 C ATOM 1411 CG PHE A 778 8.090 35.305 23.621 1.00 45.89 C ATOM 1412 CD1 PHE A 778 7.442 34.452 24.503 1.00 48.26 C ATOM 1413 CD2 PHE A 778 7.358 36.338 23.038 1.00 48.80 C ATOM 1414 CE1 PHE A 778 6.082 34.634 24.798 1.00 49.95 C ATOM 1415 CE2 PHE A 778 6.003 36.513 23.326 1.00 51.50 C ATOM 1416 CZ PHE A 778 5.378 35.664 24.209 1.00 49.70 C ATOM 1417 H PHE A 778 9.829 37.957 24.603 1.00 0.00 H ATOM 1418 N THR A 779 12.952 36.429 24.113 1.00 34.26 N ATOM 1419 CA THR A 779 14.400 36.202 24.128 1.00 32.33 C ATOM 1420 C THR A 779 14.715 35.382 25.357 1.00 35.21 C ATOM 1421 O THR A 779 14.257 35.718 26.462 1.00 35.85 O ATOM 1422 CB THR A 779 15.165 37.551 24.115 1.00 42.60 C ATOM 1423 OG1 THR A 779 14.922 38.207 22.871 1.00 50.74 O ATOM 1424 CG2 THR A 779 16.668 37.383 24.257 1.00 44.22 C ATOM 1425 HG1 THR A 779 13.951 38.371 22.770 1.00 0.00 H ATOM 1426 H THR A 779 12.632 37.409 24.254 1.00 0.00 H ATOM 1427 N ILE A 780 15.485 34.310 25.155 1.00 30.84 N ATOM 1428 CA ILE A 780 15.909 33.391 26.207 1.00 29.07 C ATOM 1429 C ILE A 780 17.418 33.461 26.382 1.00 33.25 C ATOM 1430 O ILE A 780 18.147 33.366 25.392 1.00 32.98 O ATOM 1431 CB ILE A 780 15.515 31.919 25.898 1.00 29.61 C ATOM 1432 CG1 ILE A 780 14.025 31.782 25.553 1.00 27.97 C ATOM 1433 CG2 ILE A 780 15.959 30.966 27.069 1.00 31.06 C ATOM 1434 CD1 ILE A 780 12.996 32.143 26.688 1.00 24.69 C ATOM 1435 H ILE A 780 15.804 34.117 24.184 1.00 0.00 H ATOM 1436 N LYS A 781 17.869 33.611 27.649 1.00 28.49 N ATOM 1437 CA LYS A 781 19.275 33.479 28.023 1.00 28.52 C ATOM 1438 C LYS A 781 19.424 32.420 29.102 1.00 31.59 C ATOM 1439 O LYS A 781 18.776 32.482 30.153 1.00 30.23 O ATOM 1440 CB LYS A 781 19.836 34.803 28.519 1.00 30.94 C ATOM 1441 CG LYS A 781 20.079 35.787 27.357 1.00 39.08 C ATOM 1442 CD LYS A 781 20.752 37.046 27.865 1.00 41.34 C ATOM 1443 CE LYS A 781 20.543 38.257 26.964 1.00 51.62 C ATOM 1444 NZ LYS A 781 20.818 37.950 25.538 1.00 54.20 N ATOM 1445 HZ1 LYS A 781 21.805 37.637 25.436 1.00 0.00 H ATOM 1446 HZ2 LYS A 781 20.179 37.195 25.218 1.00 0.00 H ATOM 1447 HZ3 LYS A 781 20.662 38.804 24.965 1.00 0.00 H ATOM 1448 H LYS A 781 17.179 33.832 28.395 1.00 0.00 H ATOM 1449 N ILE A 782 20.270 31.457 28.846 1.00 29.48 N ATOM 1450 CA ILE A 782 20.581 30.432 29.881 1.00 29.75 C ATOM 1451 C ILE A 782 21.486 31.051 30.969 1.00 35.66 C ATOM 1452 O ILE A 782 22.438 31.760 30.647 1.00 35.76 O ATOM 1453 CB ILE A 782 21.250 29.207 29.239 1.00 32.57 C ATOM 1454 CG1 ILE A 782 20.342 28.591 28.145 1.00 31.89 C ATOM 1455 CG2 ILE A 782 21.645 28.179 30.326 1.00 34.29 C ATOM 1456 CD1 ILE A 782 21.066 27.531 27.215 1.00 27.32 C ATOM 1457 H ILE A 782 20.729 31.406 27.914 1.00 0.00 H ATOM 1458 N ALA A 783 21.179 30.796 32.241 1.00 34.77 N ATOM 1459 CA ALA A 783 21.995 31.261 33.368 1.00 38.01 C ATOM 1460 C ALA A 783 22.604 30.014 34.032 1.00 47.17 C ATOM 1461 O ALA A 783 22.272 28.919 33.609 1.00 45.14 O ATOM 1462 CB ALA A 783 21.105 32.002 34.354 1.00 39.03 C ATOM 1463 H ALA A 783 20.322 30.242 32.444 1.00 0.00 H ATOM 1464 N ASP A 784 23.468 30.145 35.038 1.00 51.21 N ATOM 1465 CA ASP A 784 23.876 28.960 35.842 1.00 54.26 C ATOM 1466 C ASP A 784 23.157 28.907 37.207 1.00 64.15 C ATOM 1467 O ASP A 784 23.080 27.835 37.831 1.00 63.62 O ATOM 1468 CB ASP A 784 25.391 28.842 35.983 1.00 56.88 C ATOM 1469 CG ASP A 784 26.135 29.246 34.726 1.00 78.88 C ATOM 1470 OD1 ASP A 784 26.351 28.370 33.853 1.00 80.66 O ATOM 1471 OD2 ASP A 784 26.483 30.442 34.602 1.00 90.48 O ATOM 1472 H ASP A 784 23.860 31.082 35.263 1.00 0.00 H ATOM 1473 N PHE A 785 22.670 30.098 37.647 1.00 64.13 N ATOM 1474 CA PHE A 785 21.531 30.412 38.514 1.00 65.80 C ATOM 1475 C PHE A 785 21.309 29.491 39.730 1.00 71.42 C ATOM 1476 O PHE A 785 21.063 28.294 39.579 1.00 70.78 O ATOM 1477 CB PHE A 785 20.236 30.492 37.676 1.00 67.44 C ATOM 1478 CG PHE A 785 19.295 31.618 38.037 1.00 70.25 C ATOM 1479 CD1 PHE A 785 19.465 32.889 37.501 1.00 74.42 C ATOM 1480 CD2 PHE A 785 18.235 31.406 38.909 1.00 73.98 C ATOM 1481 CE1 PHE A 785 18.597 33.933 37.838 1.00 76.66 C ATOM 1482 CE2 PHE A 785 17.363 32.450 39.244 1.00 78.24 C ATOM 1483 CZ PHE A 785 17.550 33.706 38.706 1.00 77.00 C ATOM 1484 H PHE A 785 23.197 30.929 37.310 1.00 0.00 H ATOM 1485 N GLY A 786 21.388 30.089 40.921 1.00 68.99 N ATOM 1486 CA GLY A 786 21.114 29.428 42.186 1.00 85.11 C ATOM 1487 C GLY A 786 20.242 30.261 43.101 1.00113.73 C ATOM 1488 O GLY A 786 19.230 30.814 42.672 1.00 79.13 O ATOM 1489 H GLY A 786 21.663 31.092 40.945 1.00 0.00 H TER 1490 GLY A 786 ATOM 1491 N LEU A 791 13.159 28.037 46.939 1.00 62.38 N ATOM 1492 CA LEU A 791 13.063 28.570 45.583 1.00 61.73 C ATOM 1493 C LEU A 791 12.349 27.530 44.658 1.00 60.46 C ATOM 1494 O LEU A 791 11.132 27.633 44.407 1.00 61.21 O ATOM 1495 CB LEU A 791 14.470 28.988 45.047 1.00 61.82 C ATOM 1496 CG LEU A 791 15.695 28.785 45.986 1.00 67.93 C ATOM 1497 CD1 LEU A 791 16.883 28.294 45.219 1.00 68.34 C ATOM 1498 CD2 LEU A 791 16.081 30.075 46.712 1.00 70.88 C ATOM 1499 HN3 LEU A 791 13.707 27.153 46.925 1.00 0.00 H ATOM 1500 HN2 LEU A 791 12.204 27.848 47.304 1.00 0.00 H ATOM 1501 HN1 LEU A 791 13.634 28.731 47.550 1.00 0.00 H ATOM 1502 N TYR A 792 13.129 26.537 44.183 1.00 48.97 N ATOM 1503 CA TYR A 792 12.716 25.294 43.509 1.00 43.96 C ATOM 1504 C TYR A 792 13.337 24.122 44.292 1.00 42.32 C ATOM 1505 O TYR A 792 13.891 23.206 43.707 1.00 38.33 O ATOM 1506 CB TYR A 792 13.220 25.294 42.048 1.00 41.23 C ATOM 1507 CG TYR A 792 12.535 26.330 41.186 1.00 39.48 C ATOM 1508 CD1 TYR A 792 13.089 27.589 41.009 1.00 39.44 C ATOM 1509 CD2 TYR A 792 11.311 26.062 40.575 1.00 40.25 C ATOM 1510 CE1 TYR A 792 12.455 28.555 40.236 1.00 39.53 C ATOM 1511 CE2 TYR A 792 10.666 27.024 39.799 1.00 40.81 C ATOM 1512 CZ TYR A 792 11.245 28.270 39.633 1.00 44.64 C ATOM 1513 OH TYR A 792 10.633 29.233 38.868 1.00 41.34 O ATOM 1514 HH TYR A 792 11.189 30.052 38.864 1.00 0.00 H ATOM 1515 H TYR A 792 14.153 26.666 44.309 1.00 0.00 H ATOM 1516 N ALA A 793 13.239 24.174 45.634 1.00 41.57 N ATOM 1517 CA ALA A 793 13.832 23.210 46.572 1.00 41.43 C ATOM 1518 C ALA A 793 13.459 21.782 46.216 1.00 42.33 C ATOM 1519 O ALA A 793 14.303 20.899 46.291 1.00 43.18 O ATOM 1520 CB ALA A 793 13.379 23.528 47.993 1.00 43.94 C ATOM 1521 H ALA A 793 12.698 24.963 46.041 1.00 0.00 H ATOM 1522 N GLY A 794 12.203 21.568 45.817 1.00 37.74 N ATOM 1523 CA GLY A 794 11.685 20.263 45.446 1.00 37.27 C ATOM 1524 C GLY A 794 12.308 19.677 44.196 1.00 37.78 C ATOM 1525 O GLY A 794 12.105 18.506 43.918 1.00 38.64 O ATOM 1526 H GLY A 794 11.558 22.383 45.769 1.00 0.00 H ATOM 1527 N ASP A 795 13.071 20.480 43.420 1.00 33.38 N ATOM 1528 CA ASP A 795 13.762 19.997 42.208 1.00 30.40 C ATOM 1529 C ASP A 795 15.139 19.422 42.480 1.00 31.07 C ATOM 1530 O ASP A 795 15.821 18.973 41.542 1.00 28.83 O ATOM 1531 CB ASP A 795 13.882 21.119 41.185 1.00 30.13 C ATOM 1532 CG ASP A 795 12.561 21.553 40.624 1.00 35.90 C ATOM 1533 OD1 ASP A 795 11.559 20.818 40.828 1.00 31.75 O ATOM 1534 OD2 ASP A 795 12.525 22.612 39.971 1.00 37.90 O ATOM 1535 H ASP A 795 13.175 21.479 43.688 1.00 0.00 H ATOM 1536 N TYR A 796 15.554 19.434 43.751 1.00 28.84 N ATOM 1537 CA TYR A 796 16.896 18.948 44.140 1.00 28.15 C ATOM 1538 C TYR A 796 16.818 17.895 45.231 1.00 36.01 C ATOM 1539 O TYR A 796 16.037 18.033 46.168 1.00 37.33 O ATOM 1540 CB TYR A 796 17.747 20.113 44.648 1.00 29.21 C ATOM 1541 CG TYR A 796 17.979 21.110 43.542 1.00 29.30 C ATOM 1542 CD1 TYR A 796 19.051 20.969 42.671 1.00 27.93 C ATOM 1543 CD2 TYR A 796 17.127 22.197 43.366 1.00 30.11 C ATOM 1544 CE1 TYR A 796 19.262 21.867 41.632 1.00 29.84 C ATOM 1545 CE2 TYR A 796 17.327 23.107 42.319 1.00 30.48 C ATOM 1546 CZ TYR A 796 18.409 22.942 41.468 1.00 33.07 C ATOM 1547 OH TYR A 796 18.635 23.815 40.420 1.00 31.10 O ATOM 1548 HH TYR A 796 19.448 23.536 39.929 1.00 0.00 H ATOM 1549 H TYR A 796 14.915 19.795 44.487 1.00 0.00 H ATOM 1550 N TYR A 797 17.622 16.860 45.094 1.00 29.52 N ATOM 1551 CA TYR A 797 17.722 15.747 46.033 1.00 30.50 C ATOM 1552 C TYR A 797 18.930 16.031 46.937 1.00 36.52 C ATOM 1553 O TYR A 797 20.064 16.125 46.453 1.00 34.39 O ATOM 1554 CB TYR A 797 17.945 14.479 45.212 1.00 32.13 C ATOM 1555 CG TYR A 797 18.124 13.239 46.032 1.00 35.52 C ATOM 1556 CD1 TYR A 797 17.102 12.773 46.856 1.00 38.62 C ATOM 1557 CD2 TYR A 797 19.320 12.524 45.996 1.00 35.14 C ATOM 1558 CE1 TYR A 797 17.271 11.635 47.638 1.00 39.98 C ATOM 1559 CE2 TYR A 797 19.495 11.383 46.773 1.00 37.76 C ATOM 1560 CZ TYR A 797 18.466 10.944 47.591 1.00 42.95 C ATOM 1561 OH TYR A 797 18.620 9.810 48.341 1.00 41.12 O ATOM 1562 HH TYR A 797 18.793 9.041 47.742 1.00 0.00 H ATOM 1563 H TYR A 797 18.232 16.834 44.252 1.00 0.00 H ATOM 1564 N ARG A 798 18.665 16.198 48.239 1.00 33.53 N ATOM 1565 CA ARG A 798 19.639 16.619 49.243 1.00 35.65 C ATOM 1566 C ARG A 798 19.929 15.473 50.200 1.00 41.79 C ATOM 1567 O ARG A 798 19.012 14.967 50.844 1.00 43.62 O ATOM 1568 CB ARG A 798 19.106 17.824 50.040 1.00 39.84 C ATOM 1569 CG ARG A 798 18.971 19.067 49.172 1.00 51.39 C ATOM 1570 CD ARG A 798 18.406 20.266 49.911 1.00 55.60 C ATOM 1571 NE ARG A 798 18.488 21.453 49.052 1.00 61.57 N ATOM 1572 CZ ARG A 798 17.520 21.861 48.235 1.00 72.29 C ATOM 1573 NH1 ARG A 798 16.371 21.188 48.163 1.00 48.01 N ATOM 1574 NH2 ARG A 798 17.690 22.946 47.484 1.00 55.34 N ATOM 1575 HE ARG A 798 19.363 22.014 49.084 1.00 0.00 H ATOM 1576 HH12 ARG A 798 15.618 21.512 47.523 1.00 0.00 H ATOM 1577 HH11 ARG A 798 16.228 20.340 48.747 1.00 0.00 H ATOM 1578 HH22 ARG A 798 16.931 23.262 46.847 1.00 0.00 H ATOM 1579 HH21 ARG A 798 18.582 23.479 47.534 1.00 0.00 H ATOM 1580 H ARG A 798 17.693 16.014 48.559 1.00 0.00 H ATOM 1581 N VAL A 799 21.206 15.058 50.271 1.00 34.49 N ATOM 1582 CA VAL A 799 21.699 14.099 51.254 1.00 35.50 C ATOM 1583 C VAL A 799 22.826 14.826 51.957 1.00 39.68 C ATOM 1584 O VAL A 799 23.631 15.485 51.305 1.00 37.27 O ATOM 1585 CB VAL A 799 22.163 12.744 50.636 1.00 37.89 C ATOM 1586 CG1 VAL A 799 22.859 11.857 51.683 1.00 38.84 C ATOM 1587 CG2 VAL A 799 20.983 11.998 50.018 1.00 36.71 C ATOM 1588 H VAL A 799 21.884 15.444 49.583 1.00 0.00 H ATOM 1589 N GLN A 800 22.866 14.732 53.270 1.00 38.72 N ATOM 1590 CA GLN A 800 23.872 15.394 54.078 1.00 40.20 C ATOM 1591 C GLN A 800 25.305 14.970 53.677 1.00 40.65 C ATOM 1592 O GLN A 800 25.624 13.778 53.554 1.00 38.17 O ATOM 1593 CB GLN A 800 23.593 15.126 55.563 1.00 43.71 C ATOM 1594 CG GLN A 800 24.515 15.871 56.525 1.00 62.04 C ATOM 1595 CD GLN A 800 24.184 15.553 57.969 1.00 92.81 C ATOM 1596 OE1 GLN A 800 23.040 15.242 58.331 1.00 94.08 O ATOM 1597 NE2 GLN A 800 25.179 15.622 58.833 1.00 85.15 N ATOM 1598 HE22 GLN A 800 26.132 15.885 58.509 1.00 0.00 H ATOM 1599 HE21 GLN A 800 25.011 15.414 59.838 1.00 0.00 H ATOM 1600 H GLN A 800 22.144 14.157 53.749 1.00 0.00 H ATOM 1601 N GLY A 801 26.142 15.966 53.466 1.00 36.85 N ATOM 1602 CA GLY A 801 27.524 15.725 53.081 1.00 36.77 C ATOM 1603 C GLY A 801 27.696 15.420 51.609 1.00 38.58 C ATOM 1604 O GLY A 801 28.823 15.176 51.193 1.00 38.76 O ATOM 1605 H GLY A 801 25.808 16.944 53.577 1.00 0.00 H ATOM 1606 N ARG A 802 26.594 15.430 50.809 1.00 34.48 N ATOM 1607 CA ARG A 802 26.645 15.236 49.342 1.00 32.37 C ATOM 1608 C ARG A 802 26.263 16.513 48.591 1.00 38.49 C ATOM 1609 O ARG A 802 25.580 17.387 49.134 1.00 36.18 O ATOM 1610 CB ARG A 802 25.682 14.114 48.869 1.00 31.92 C ATOM 1611 CG ARG A 802 25.937 12.745 49.505 1.00 34.15 C ATOM 1612 CD ARG A 802 25.189 11.662 48.729 1.00 36.78 C ATOM 1613 NE ARG A 802 25.254 10.376 49.432 1.00 39.45 N ATOM 1614 CZ ARG A 802 24.446 9.346 49.217 1.00 56.12 C ATOM 1615 NH1 ARG A 802 23.478 9.430 48.313 1.00 44.94 N ATOM 1616 NH2 ARG A 802 24.589 8.226 49.916 1.00 44.31 N ATOM 1617 HE ARG A 802 25.992 10.263 50.156 1.00 0.00 H ATOM 1618 HH12 ARG A 802 22.848 8.619 48.149 1.00 0.00 H ATOM 1619 HH11 ARG A 802 23.350 10.307 47.769 1.00 0.00 H ATOM 1620 HH22 ARG A 802 23.953 7.421 49.744 1.00 0.00 H ATOM 1621 HH21 ARG A 802 25.337 8.154 50.635 1.00 0.00 H ATOM 1622 H ARG A 802 25.666 15.582 51.253 1.00 0.00 H ATOM 1623 N ALA A 803 26.704 16.605 47.311 1.00 36.64 N ATOM 1624 CA ALA A 803 26.275 17.664 46.411 1.00 35.34 C ATOM 1625 C ALA A 803 24.742 17.595 46.229 1.00 38.91 C ATOM 1626 O ALA A 803 24.164 16.515 46.250 1.00 37.96 O ATOM 1627 CB ALA A 803 26.982 17.522 45.065 1.00 36.40 C ATOM 1628 H ALA A 803 27.374 15.891 46.960 1.00 0.00 H ATOM 1629 N VAL A 804 24.101 18.743 46.072 1.00 36.23 N ATOM 1630 CA VAL A 804 22.645 18.882 45.887 1.00 36.99 C ATOM 1631 C VAL A 804 22.339 18.567 44.393 1.00 38.60 C ATOM 1632 O VAL A 804 22.916 19.212 43.512 1.00 38.07 O ATOM 1633 CB VAL A 804 22.302 20.344 46.282 1.00 40.54 C ATOM 1634 CG1 VAL A 804 20.814 20.656 46.111 1.00 38.72 C ATOM 1635 CG2 VAL A 804 22.770 20.643 47.717 1.00 41.17 C ATOM 1636 H VAL A 804 24.669 19.614 46.080 1.00 0.00 H ATOM 1637 N LEU A 805 21.460 17.594 44.097 1.00 32.87 N ATOM 1638 CA LEU A 805 21.367 17.026 42.732 1.00 31.43 C ATOM 1639 C LEU A 805 19.982 17.143 42.100 1.00 30.72 C ATOM 1640 O LEU A 805 19.012 16.673 42.681 1.00 29.07 O ATOM 1641 CB LEU A 805 21.785 15.530 42.651 1.00 33.62 C ATOM 1642 CG LEU A 805 23.281 15.076 42.710 1.00 39.64 C ATOM 1643 CD1 LEU A 805 24.269 16.013 42.071 1.00 39.98 C ATOM 1644 CD2 LEU A 805 23.622 14.483 43.942 1.00 39.96 C ATOM 1645 H LEU A 805 20.832 17.232 44.842 1.00 0.00 H ATOM 1646 N PRO A 806 19.896 17.777 40.908 1.00 27.23 N ATOM 1647 CA PRO A 806 18.608 17.871 40.197 1.00 25.74 C ATOM 1648 C PRO A 806 18.268 16.546 39.492 1.00 27.20 C ATOM 1649 O PRO A 806 18.213 16.496 38.264 1.00 25.82 O ATOM 1650 CB PRO A 806 18.877 18.995 39.184 1.00 26.67 C ATOM 1651 CG PRO A 806 20.371 18.867 38.868 1.00 31.90 C ATOM 1652 CD PRO A 806 21.003 18.431 40.149 1.00 29.30 C ATOM 1653 N ILE A 807 18.036 15.475 40.270 1.00 26.30 N ATOM 1654 CA ILE A 807 17.909 14.096 39.769 1.00 27.02 C ATOM 1655 C ILE A 807 16.858 13.934 38.676 1.00 30.53 C ATOM 1656 O ILE A 807 17.058 13.106 37.786 1.00 29.91 O ATOM 1657 CB ILE A 807 17.697 13.050 40.911 1.00 30.43 C ATOM 1658 CG1 ILE A 807 16.405 13.334 41.717 1.00 30.13 C ATOM 1659 CG2 ILE A 807 18.968 12.986 41.797 1.00 33.12 C ATOM 1660 CD1 ILE A 807 16.061 12.367 42.916 1.00 30.91 C ATOM 1661 H ILE A 807 17.940 15.630 41.294 1.00 0.00 H ATOM 1662 N ARG A 808 15.747 14.694 38.733 1.00 29.58 N ATOM 1663 CA ARG A 808 14.714 14.535 37.705 1.00 29.74 C ATOM 1664 C ARG A 808 15.144 15.040 36.295 1.00 31.50 C ATOM 1665 O ARG A 808 14.495 14.693 35.312 1.00 30.58 O ATOM 1666 CB ARG A 808 13.385 15.152 38.152 1.00 30.34 C ATOM 1667 CG ARG A 808 12.777 14.395 39.351 1.00 30.96 C ATOM 1668 CD ARG A 808 11.853 15.269 40.201 1.00 31.94 C ATOM 1669 NE ARG A 808 11.581 14.615 41.488 1.00 32.08 N ATOM 1670 CZ ARG A 808 10.665 13.673 41.669 1.00 37.17 C ATOM 1671 NH1 ARG A 808 9.891 13.287 40.662 1.00 32.69 N ATOM 1672 NH2 ARG A 808 10.509 13.111 42.862 1.00 31.60 N ATOM 1673 HE ARG A 808 12.144 14.910 42.311 1.00 0.00 H ATOM 1674 HH12 ARG A 808 9.175 12.548 40.810 1.00 0.00 H ATOM 1675 HH11 ARG A 808 10.001 13.724 39.725 1.00 0.00 H ATOM 1676 HH22 ARG A 808 9.789 12.373 42.999 1.00 0.00 H ATOM 1677 HH21 ARG A 808 11.106 13.409 43.659 1.00 0.00 H ATOM 1678 H ARG A 808 15.623 15.387 39.499 1.00 0.00 H ATOM 1679 N TRP A 809 16.232 15.820 36.200 1.00 27.16 N ATOM 1680 CA TRP A 809 16.802 16.288 34.909 1.00 27.65 C ATOM 1681 C TRP A 809 18.039 15.486 34.521 1.00 30.81 C ATOM 1682 O TRP A 809 18.621 15.711 33.453 1.00 28.42 O ATOM 1683 CB TRP A 809 17.119 17.816 34.961 1.00 26.36 C ATOM 1684 CG TRP A 809 15.892 18.697 34.882 1.00 26.48 C ATOM 1685 CD1 TRP A 809 15.495 19.450 33.807 1.00 28.32 C ATOM 1686 CD2 TRP A 809 14.941 18.969 35.940 1.00 26.80 C ATOM 1687 NE1 TRP A 809 14.336 20.133 34.111 1.00 27.96 N ATOM 1688 CE2 TRP A 809 13.964 19.843 35.409 1.00 29.75 C ATOM 1689 CE3 TRP A 809 14.784 18.511 37.274 1.00 28.33 C ATOM 1690 CZ2 TRP A 809 12.850 20.272 36.161 1.00 28.11 C ATOM 1691 CZ3 TRP A 809 13.672 18.930 38.008 1.00 29.04 C ATOM 1692 CH2 TRP A 809 12.731 19.809 37.455 1.00 28.92 C ATOM 1693 HE1 TRP A 809 13.823 20.766 33.465 1.00 0.00 H ATOM 1694 H TRP A 809 16.703 16.114 37.079 1.00 0.00 H ATOM 1695 N MET A 810 18.456 14.530 35.398 1.00 29.22 N ATOM 1696 CA MET A 810 19.774 13.888 35.258 1.00 28.10 C ATOM 1697 C MET A 810 19.729 12.572 34.497 1.00 32.36 C ATOM 1698 O MET A 810 18.894 11.707 34.782 1.00 31.92 O ATOM 1699 CB MET A 810 20.478 13.711 36.623 1.00 29.39 C ATOM 1700 CG MET A 810 21.117 15.002 37.169 1.00 29.27 C ATOM 1701 SD MET A 810 21.420 14.873 38.952 1.00 32.21 S ATOM 1702 CE MET A 810 22.838 13.689 38.916 1.00 31.84 C ATOM 1703 H MET A 810 17.832 14.248 36.181 1.00 0.00 H ATOM 1704 N ALA A 811 20.645 12.433 33.501 1.00 29.18 N ATOM 1705 CA ALA A 811 20.842 11.195 32.742 1.00 27.37 C ATOM 1706 C ALA A 811 21.119 10.061 33.698 1.00 30.72 C ATOM 1707 O ALA A 811 21.711 10.302 34.760 1.00 31.74 O ATOM 1708 CB ALA A 811 22.008 11.366 31.772 1.00 27.65 C ATOM 1709 H ALA A 811 21.240 13.253 33.265 1.00 0.00 H ATOM 1710 N TRP A 812 20.710 8.834 33.353 1.00 29.86 N ATOM 1711 CA TRP A 812 20.902 7.681 34.267 1.00 33.75 C ATOM 1712 C TRP A 812 22.367 7.534 34.724 1.00 35.83 C ATOM 1713 O TRP A 812 22.598 7.165 35.876 1.00 36.26 O ATOM 1714 CB TRP A 812 20.367 6.385 33.652 1.00 34.71 C ATOM 1715 CG TRP A 812 21.221 5.897 32.512 1.00 37.75 C ATOM 1716 CD1 TRP A 812 21.066 6.190 31.188 1.00 40.30 C ATOM 1717 CD2 TRP A 812 22.369 5.037 32.603 1.00 39.72 C ATOM 1718 NE1 TRP A 812 22.030 5.547 30.445 1.00 41.23 N ATOM 1719 CE2 TRP A 812 22.858 4.852 31.290 1.00 44.80 C ATOM 1720 CE3 TRP A 812 23.049 4.418 33.670 1.00 41.91 C ATOM 1721 CZ2 TRP A 812 23.981 4.060 31.015 1.00 45.52 C ATOM 1722 CZ3 TRP A 812 24.158 3.633 33.397 1.00 45.22 C ATOM 1723 CH2 TRP A 812 24.613 3.459 32.084 1.00 46.63 C ATOM 1724 HE1 TRP A 812 22.117 5.582 29.409 1.00 0.00 H ATOM 1725 H TRP A 812 20.251 8.687 32.431 1.00 0.00 H ATOM 1726 N GLU A 813 23.358 7.836 33.849 1.00 34.53 N ATOM 1727 CA GLU A 813 24.778 7.719 34.253 1.00 36.54 C ATOM 1728 C GLU A 813 25.238 8.793 35.235 1.00 39.97 C ATOM 1729 O GLU A 813 26.195 8.508 35.970 1.00 40.89 O ATOM 1730 CB GLU A 813 25.777 7.625 33.056 1.00 37.87 C ATOM 1731 CG GLU A 813 25.909 8.907 32.225 1.00 35.77 C ATOM 1732 CD GLU A 813 24.812 9.201 31.213 1.00 41.08 C ATOM 1733 OE1 GLU A 813 23.815 8.442 31.135 1.00 33.34 O ATOM 1734 OE2 GLU A 813 24.981 10.184 30.458 1.00 36.71 O ATOM 1735 H GLU A 813 23.119 8.152 32.887 1.00 0.00 H ATOM 1736 N CYS A 814 24.607 10.008 35.252 1.00 36.78 N ATOM 1737 CA CYS A 814 24.910 11.068 36.261 1.00 37.84 C ATOM 1738 C CYS A 814 24.436 10.640 37.623 1.00 43.33 C ATOM 1739 O CYS A 814 25.140 10.876 38.601 1.00 42.31 O ATOM 1740 CB CYS A 814 24.278 12.411 35.918 1.00 38.92 C ATOM 1741 SG CYS A 814 24.525 12.941 34.230 1.00 43.64 S ATOM 1742 H CYS A 814 23.884 10.202 34.530 1.00 0.00 H ATOM 1743 N ILE A 815 23.222 10.038 37.694 1.00 38.47 N ATOM 1744 CA ILE A 815 22.693 9.570 38.965 1.00 39.21 C ATOM 1745 C ILE A 815 23.551 8.424 39.473 1.00 47.08 C ATOM 1746 O ILE A 815 23.916 8.421 40.649 1.00 48.97 O ATOM 1747 CB ILE A 815 21.176 9.206 38.888 1.00 41.85 C ATOM 1748 CG1 ILE A 815 20.307 10.454 38.539 1.00 40.44 C ATOM 1749 CG2 ILE A 815 20.713 8.481 40.188 1.00 43.45 C ATOM 1750 CD1 ILE A 815 18.870 10.137 38.043 1.00 40.52 C ATOM 1751 H ILE A 815 22.662 9.910 36.827 1.00 0.00 H ATOM 1752 N LEU A 816 23.890 7.457 38.601 1.00 45.46 N ATOM 1753 CA LEU A 816 24.598 6.272 39.088 1.00 47.62 C ATOM 1754 C LEU A 816 26.084 6.521 39.328 1.00 55.05 C ATOM 1755 O LEU A 816 26.674 5.837 40.153 1.00 56.69 O ATOM 1756 CB LEU A 816 24.372 5.050 38.179 1.00 47.78 C ATOM 1757 CG LEU A 816 22.907 4.565 37.992 1.00 51.59 C ATOM 1758 CD1 LEU A 816 22.894 3.192 37.428 1.00 52.82 C ATOM 1759 CD2 LEU A 816 22.115 4.554 39.306 1.00 53.87 C ATOM 1760 H LEU A 816 23.652 7.550 37.593 1.00 0.00 H ATOM 1761 N MET A 817 26.686 7.495 38.632 1.00 52.07 N ATOM 1762 CA MET A 817 28.139 7.680 38.657 1.00 53.75 C ATOM 1763 C MET A 817 28.622 9.118 38.821 1.00 58.33 C ATOM 1764 O MET A 817 29.817 9.334 38.736 1.00 59.03 O ATOM 1765 CB MET A 817 28.794 7.063 37.400 1.00 57.49 C ATOM 1766 CG MET A 817 28.770 5.556 37.375 1.00 64.59 C ATOM 1767 SD MET A 817 29.098 4.905 35.722 1.00 72.36 S ATOM 1768 CE MET A 817 27.444 4.828 35.039 1.00 67.52 C ATOM 1769 H MET A 817 26.105 8.138 38.057 1.00 0.00 H ATOM 1770 N GLY A 818 27.735 10.085 39.035 1.00 55.96 N ATOM 1771 CA GLY A 818 28.111 11.502 39.090 1.00 55.42 C ATOM 1772 C GLY A 818 28.901 12.027 37.896 1.00 58.71 C ATOM 1773 O GLY A 818 29.524 13.090 37.998 1.00 59.53 O ATOM 1774 H GLY A 818 26.736 9.827 39.169 1.00 0.00 H ATOM 1775 N LYS A 819 28.891 11.294 36.750 1.00 52.72 N ATOM 1776 CA LYS A 819 29.565 11.734 35.523 1.00 52.66 C ATOM 1777 C LYS A 819 28.650 12.746 34.785 1.00 51.53 C ATOM 1778 O LYS A 819 27.531 12.378 34.439 1.00 50.50 O ATOM 1779 CB LYS A 819 29.883 10.504 34.639 1.00 57.36 C ATOM 1780 CG LYS A 819 30.568 10.806 33.300 1.00 75.95 C ATOM 1781 CD LYS A 819 30.994 9.514 32.597 1.00 88.23 C ATOM 1782 CE LYS A 819 31.423 9.696 31.154 1.00 93.22 C ATOM 1783 NZ LYS A 819 32.679 10.482 31.024 1.00 99.96 N ATOM 1784 HZ1 LYS A 819 32.540 11.426 31.437 1.00 0.00 H ATOM 1785 HZ2 LYS A 819 33.447 9.992 31.526 1.00 0.00 H ATOM 1786 HZ3 LYS A 819 32.925 10.576 30.018 1.00 0.00 H ATOM 1787 H LYS A 819 28.385 10.385 36.743 1.00 0.00 H ATOM 1788 N PHE A 820 29.119 14.013 34.569 1.00 43.66 N ATOM 1789 CA PHE A 820 28.390 15.054 33.823 1.00 39.37 C ATOM 1790 C PHE A 820 29.167 15.378 32.548 1.00 39.21 C ATOM 1791 O PHE A 820 30.362 15.654 32.614 1.00 36.87 O ATOM 1792 CB PHE A 820 28.182 16.325 34.679 1.00 41.00 C ATOM 1793 CG PHE A 820 27.201 16.158 35.812 1.00 42.10 C ATOM 1794 CD1 PHE A 820 25.883 16.573 35.677 1.00 43.26 C ATOM 1795 CD2 PHE A 820 27.591 15.574 37.010 1.00 46.11 C ATOM 1796 CE1 PHE A 820 24.974 16.417 36.716 1.00 43.44 C ATOM 1797 CE2 PHE A 820 26.677 15.415 38.052 1.00 48.26 C ATOM 1798 CZ PHE A 820 25.376 15.847 37.896 1.00 43.67 C ATOM 1799 H PHE A 820 30.052 14.258 34.957 1.00 0.00 H ATOM 1800 N THR A 821 28.502 15.329 31.376 1.00 31.97 N ATOM 1801 CA THR A 821 29.165 15.526 30.080 1.00 30.08 C ATOM 1802 C THR A 821 28.240 16.385 29.199 1.00 32.93 C ATOM 1803 O THR A 821 27.108 16.657 29.608 1.00 30.40 O ATOM 1804 CB THR A 821 29.386 14.147 29.426 1.00 35.65 C ATOM 1805 OG1 THR A 821 28.109 13.554 29.208 1.00 32.41 O ATOM 1806 CG2 THR A 821 30.257 13.194 30.280 1.00 36.12 C ATOM 1807 HG1 THR A 821 27.642 13.451 30.075 1.00 0.00 H ATOM 1808 H THR A 821 27.479 15.144 31.390 1.00 0.00 H ATOM 1809 N THR A 822 28.691 16.810 28.001 1.00 30.27 N ATOM 1810 CA THR A 822 27.747 17.389 27.022 1.00 30.34 C ATOM 1811 C THR A 822 26.599 16.397 26.781 1.00 32.68 C ATOM 1812 O THR A 822 25.442 16.818 26.639 1.00 31.18 O ATOM 1813 CB THR A 822 28.461 17.750 25.722 1.00 39.39 C ATOM 1814 OG1 THR A 822 29.455 18.714 26.026 1.00 39.01 O ATOM 1815 CG2 THR A 822 27.493 18.306 24.655 1.00 33.22 C ATOM 1816 HG1 THR A 822 29.934 18.965 25.197 1.00 0.00 H ATOM 1817 H THR A 822 29.701 16.730 27.767 1.00 0.00 H ATOM 1818 N ALA A 823 26.905 15.087 26.763 1.00 27.97 N ATOM 1819 CA ALA A 823 25.818 14.103 26.588 1.00 27.55 C ATOM 1820 C ALA A 823 24.752 14.115 27.700 1.00 31.92 C ATOM 1821 O ALA A 823 23.574 13.870 27.430 1.00 30.14 O ATOM 1822 CB ALA A 823 26.416 12.705 26.424 1.00 30.22 C ATOM 1823 H ALA A 823 27.891 14.773 26.871 1.00 0.00 H ATOM 1824 N SER A 824 25.142 14.388 28.944 1.00 29.26 N ATOM 1825 CA SER A 824 24.183 14.500 30.007 1.00 28.41 C ATOM 1826 C SER A 824 23.470 15.825 29.900 1.00 28.34 C ATOM 1827 O SER A 824 22.304 15.892 30.246 1.00 26.89 O ATOM 1828 CB SER A 824 24.801 14.206 31.377 1.00 31.21 C ATOM 1829 OG SER A 824 25.778 15.151 31.784 1.00 29.36 O ATOM 1830 HG SER A 824 25.365 16.049 31.836 1.00 0.00 H ATOM 1831 H SER A 824 26.153 14.522 29.148 1.00 0.00 H ATOM 1832 N ASP A 825 24.116 16.885 29.379 1.00 26.69 N ATOM 1833 CA ASP A 825 23.374 18.139 29.134 1.00 24.34 C ATOM 1834 C ASP A 825 22.276 17.981 28.080 1.00 27.12 C ATOM 1835 O ASP A 825 21.261 18.649 28.191 1.00 25.43 O ATOM 1836 CB ASP A 825 24.275 19.322 28.739 1.00 25.66 C ATOM 1837 CG ASP A 825 25.103 19.994 29.852 1.00 29.60 C ATOM 1838 OD1 ASP A 825 24.761 19.818 31.081 1.00 29.00 O ATOM 1839 OD2 ASP A 825 26.001 20.773 29.510 1.00 33.59 O ATOM 1840 H ASP A 825 25.129 16.822 29.151 1.00 0.00 H ATOM 1841 N VAL A 826 22.490 17.118 27.063 1.00 24.74 N ATOM 1842 CA VAL A 826 21.467 16.752 26.078 1.00 24.56 C ATOM 1843 C VAL A 826 20.280 16.071 26.757 1.00 26.31 C ATOM 1844 O VAL A 826 19.130 16.423 26.492 1.00 26.52 O ATOM 1845 CB VAL A 826 22.081 15.879 24.920 1.00 30.25 C ATOM 1846 CG1 VAL A 826 20.978 15.345 23.983 1.00 30.79 C ATOM 1847 CG2 VAL A 826 23.130 16.670 24.134 1.00 29.83 C ATOM 1848 H VAL A 826 23.433 16.689 26.974 1.00 0.00 H ATOM 1849 N TRP A 827 20.533 15.104 27.605 1.00 24.45 N ATOM 1850 CA TRP A 827 19.437 14.480 28.357 1.00 25.42 C ATOM 1851 C TRP A 827 18.628 15.538 29.130 1.00 26.18 C ATOM 1852 O TRP A 827 17.397 15.554 29.032 1.00 23.50 O ATOM 1853 CB TRP A 827 20.026 13.443 29.321 1.00 25.88 C ATOM 1854 CG TRP A 827 19.013 12.706 30.161 1.00 26.87 C ATOM 1855 CD1 TRP A 827 18.193 13.228 31.115 1.00 29.39 C ATOM 1856 CD2 TRP A 827 18.773 11.294 30.150 1.00 28.47 C ATOM 1857 NE1 TRP A 827 17.431 12.226 31.682 1.00 29.73 N ATOM 1858 CE2 TRP A 827 17.779 11.028 31.119 1.00 31.96 C ATOM 1859 CE3 TRP A 827 19.338 10.218 29.437 1.00 30.15 C ATOM 1860 CZ2 TRP A 827 17.317 9.731 31.381 1.00 32.58 C ATOM 1861 CZ3 TRP A 827 18.864 8.934 29.678 1.00 33.03 C ATOM 1862 CH2 TRP A 827 17.875 8.696 30.645 1.00 33.11 C ATOM 1863 HE1 TRP A 827 16.709 12.360 32.418 1.00 0.00 H ATOM 1864 H TRP A 827 21.511 14.778 27.745 1.00 0.00 H ATOM 1865 N ALA A 828 19.305 16.417 29.883 1.00 24.12 N ATOM 1866 CA ALA A 828 18.627 17.556 30.577 1.00 24.40 C ATOM 1867 C ALA A 828 17.902 18.489 29.632 1.00 29.40 C ATOM 1868 O ALA A 828 16.826 19.008 29.983 1.00 27.70 O ATOM 1869 CB ALA A 828 19.644 18.364 31.388 1.00 25.44 C ATOM 1870 H ALA A 828 20.333 16.304 29.988 1.00 0.00 H ATOM 1871 N PHE A 829 18.493 18.742 28.444 1.00 25.43 N ATOM 1872 CA PHE A 829 17.783 19.494 27.411 1.00 25.01 C ATOM 1873 C PHE A 829 16.466 18.812 27.000 1.00 30.03 C ATOM 1874 O PHE A 829 15.477 19.512 26.838 1.00 26.54 O ATOM 1875 CB PHE A 829 18.646 19.760 26.186 1.00 26.24 C ATOM 1876 CG PHE A 829 17.866 20.507 25.116 1.00 26.66 C ATOM 1877 CD1 PHE A 829 17.709 21.887 25.181 1.00 28.22 C ATOM 1878 CD2 PHE A 829 17.268 19.821 24.063 1.00 26.68 C ATOM 1879 CE1 PHE A 829 16.958 22.570 24.211 1.00 29.35 C ATOM 1880 CE2 PHE A 829 16.513 20.500 23.092 1.00 28.72 C ATOM 1881 CZ PHE A 829 16.360 21.860 23.172 1.00 28.65 C ATOM 1882 H PHE A 829 19.458 18.400 28.263 1.00 0.00 H ATOM 1883 N GLY A 830 16.480 17.472 26.846 1.00 29.21 N ATOM 1884 CA GLY A 830 15.266 16.682 26.588 1.00 27.81 C ATOM 1885 C GLY A 830 14.209 16.951 27.646 1.00 29.57 C ATOM 1886 O GLY A 830 13.038 17.174 27.301 1.00 26.32 O ATOM 1887 H GLY A 830 17.391 16.974 26.913 1.00 0.00 H ATOM 1888 N VAL A 831 14.620 16.930 28.965 1.00 26.30 N ATOM 1889 CA VAL A 831 13.711 17.201 30.097 1.00 25.17 C ATOM 1890 C VAL A 831 13.212 18.661 30.070 1.00 28.31 C ATOM 1891 O VAL A 831 12.029 18.905 30.314 1.00 26.80 O ATOM 1892 CB VAL A 831 14.303 16.808 31.493 1.00 28.27 C ATOM 1893 CG1 VAL A 831 13.285 17.081 32.610 1.00 28.11 C ATOM 1894 CG2 VAL A 831 14.709 15.328 31.525 1.00 27.71 C ATOM 1895 H VAL A 831 15.616 16.713 29.170 1.00 0.00 H ATOM 1896 N THR A 832 14.122 19.625 29.779 1.00 24.77 N ATOM 1897 CA THR A 832 13.805 21.074 29.641 1.00 23.49 C ATOM 1898 C THR A 832 12.777 21.328 28.531 1.00 27.14 C ATOM 1899 O THR A 832 11.839 22.108 28.737 1.00 27.70 O ATOM 1900 CB THR A 832 15.134 21.852 29.460 1.00 26.64 C ATOM 1901 OG1 THR A 832 15.972 21.568 30.581 1.00 26.50 O ATOM 1902 CG2 THR A 832 14.921 23.323 29.311 1.00 22.98 C ATOM 1903 HG1 THR A 832 16.149 20.595 30.621 1.00 0.00 H ATOM 1904 H THR A 832 15.110 19.331 29.643 1.00 0.00 H ATOM 1905 N LEU A 833 12.959 20.664 27.336 1.00 25.54 N ATOM 1906 CA LEU A 833 12.003 20.720 26.227 1.00 25.36 C ATOM 1907 C LEU A 833 10.641 20.137 26.641 1.00 28.75 C ATOM 1908 O LEU A 833 9.606 20.709 26.312 1.00 29.01 O ATOM 1909 CB LEU A 833 12.581 19.953 25.017 1.00 26.50 C ATOM 1910 CG LEU A 833 11.696 19.871 23.760 1.00 32.24 C ATOM 1911 CD1 LEU A 833 11.358 21.225 23.219 1.00 31.75 C ATOM 1912 CD2 LEU A 833 12.337 18.994 22.689 1.00 35.16 C ATOM 1913 H LEU A 833 13.820 20.093 27.216 1.00 0.00 H ATOM 1914 N TRP A 834 10.632 19.009 27.379 1.00 25.83 N ATOM 1915 CA TRP A 834 9.390 18.427 27.943 1.00 25.02 C ATOM 1916 C TRP A 834 8.719 19.499 28.840 1.00 30.11 C ATOM 1917 O TRP A 834 7.527 19.739 28.696 1.00 28.93 O ATOM 1918 CB TRP A 834 9.747 17.140 28.759 1.00 24.28 C ATOM 1919 CG TRP A 834 8.548 16.497 29.407 1.00 24.99 C ATOM 1920 CD1 TRP A 834 7.735 15.561 28.849 1.00 28.57 C ATOM 1921 CD2 TRP A 834 8.013 16.765 30.727 1.00 25.18 C ATOM 1922 NE1 TRP A 834 6.695 15.252 29.716 1.00 29.28 N ATOM 1923 CE2 TRP A 834 6.859 15.957 30.884 1.00 28.76 C ATOM 1924 CE3 TRP A 834 8.382 17.631 31.783 1.00 25.68 C ATOM 1925 CZ2 TRP A 834 6.100 15.946 32.061 1.00 27.71 C ATOM 1926 CZ3 TRP A 834 7.603 17.647 32.939 1.00 26.63 C ATOM 1927 CH2 TRP A 834 6.471 16.815 33.064 1.00 28.11 C ATOM 1928 HE1 TRP A 834 5.917 14.593 29.514 1.00 0.00 H ATOM 1929 H TRP A 834 11.535 18.526 27.561 1.00 0.00 H ATOM 1930 N GLU A 835 9.482 20.153 29.762 1.00 27.74 N ATOM 1931 CA GLU A 835 8.925 21.237 30.611 1.00 26.97 C ATOM 1932 C GLU A 835 8.287 22.368 29.759 1.00 27.39 C ATOM 1933 O GLU A 835 7.199 22.852 30.091 1.00 27.67 O ATOM 1934 CB GLU A 835 10.023 21.894 31.438 1.00 27.95 C ATOM 1935 CG GLU A 835 10.728 21.079 32.522 1.00 29.40 C ATOM 1936 CD GLU A 835 11.667 22.004 33.278 1.00 32.06 C ATOM 1937 OE1 GLU A 835 11.186 22.715 34.180 1.00 30.65 O ATOM 1938 OE2 GLU A 835 12.848 22.123 32.889 1.00 27.90 O ATOM 1939 H GLU A 835 10.481 19.885 29.874 1.00 0.00 H ATOM 1940 N VAL A 836 8.968 22.798 28.675 1.00 25.50 N ATOM 1941 CA VAL A 836 8.446 23.869 27.791 1.00 25.67 C ATOM 1942 C VAL A 836 7.112 23.449 27.165 1.00 29.31 C ATOM 1943 O VAL A 836 6.153 24.206 27.175 1.00 26.25 O ATOM 1944 CB VAL A 836 9.496 24.302 26.736 1.00 28.88 C ATOM 1945 CG1 VAL A 836 8.900 25.267 25.703 1.00 29.39 C ATOM 1946 CG2 VAL A 836 10.737 24.900 27.411 1.00 27.98 C ATOM 1947 H VAL A 836 9.887 22.365 28.453 1.00 0.00 H ATOM 1948 N LEU A 837 7.045 22.241 26.627 1.00 29.54 N ATOM 1949 CA LEU A 837 5.835 21.731 25.955 1.00 28.73 C ATOM 1950 C LEU A 837 4.717 21.415 26.924 1.00 31.49 C ATOM 1951 O LEU A 837 3.555 21.356 26.520 1.00 28.25 O ATOM 1952 CB LEU A 837 6.214 20.486 25.113 1.00 29.54 C ATOM 1953 CG LEU A 837 6.594 20.738 23.618 1.00 34.21 C ATOM 1954 CD1 LEU A 837 5.448 21.388 22.843 1.00 34.92 C ATOM 1955 CD2 LEU A 837 7.785 21.622 23.471 1.00 34.58 C ATOM 1956 H LEU A 837 7.881 21.625 26.681 1.00 0.00 H ATOM 1957 N MET A 838 5.071 21.201 28.213 1.00 27.75 N ATOM 1958 CA MET A 838 4.096 21.044 29.299 1.00 27.11 C ATOM 1959 C MET A 838 3.667 22.409 29.834 1.00 30.68 C ATOM 1960 O MET A 838 2.742 22.463 30.638 1.00 31.78 O ATOM 1961 CB MET A 838 4.743 20.281 30.483 1.00 28.21 C ATOM 1962 CG MET A 838 4.916 18.792 30.250 1.00 28.98 C ATOM 1963 SD MET A 838 3.343 17.944 30.109 1.00 31.53 S ATOM 1964 CE MET A 838 2.779 17.990 31.848 1.00 31.42 C ATOM 1965 H MET A 838 6.083 21.145 28.445 1.00 0.00 H ATOM 1966 N LEU A 839 4.342 23.516 29.398 1.00 26.42 N ATOM 1967 CA LEU A 839 4.138 24.873 29.917 1.00 27.65 C ATOM 1968 C LEU A 839 4.396 24.937 31.420 1.00 32.54 C ATOM 1969 O LEU A 839 3.742 25.688 32.161 1.00 31.39 O ATOM 1970 CB LEU A 839 2.756 25.444 29.521 1.00 29.32 C ATOM 1971 CG LEU A 839 2.683 25.878 28.017 1.00 33.68 C ATOM 1972 CD1 LEU A 839 2.285 24.700 27.087 1.00 34.34 C ATOM 1973 CD2 LEU A 839 1.720 27.011 27.821 1.00 39.02 C ATOM 1974 H LEU A 839 5.049 23.387 28.646 1.00 0.00 H ATOM 1975 N CYS A 840 5.396 24.125 31.877 1.00 29.15 N ATOM 1976 CA CYS A 840 5.814 24.038 33.271 1.00 29.52 C ATOM 1977 C CYS A 840 4.633 23.745 34.230 1.00 33.72 C ATOM 1978 O CYS A 840 4.658 24.124 35.392 1.00 35.94 O ATOM 1979 CB CYS A 840 6.627 25.281 33.665 1.00 31.44 C ATOM 1980 SG CYS A 840 8.084 25.560 32.587 1.00 34.63 S ATOM 1981 H CYS A 840 5.892 23.529 31.184 1.00 0.00 H ATOM 1982 N ARG A 841 3.602 23.042 33.735 1.00 31.61 N ATOM 1983 CA ARG A 841 2.415 22.696 34.547 1.00 31.88 C ATOM 1984 C ARG A 841 2.685 21.544 35.509 1.00 37.25 C ATOM 1985 O ARG A 841 1.871 21.306 36.389 1.00 34.89 O ATOM 1986 CB ARG A 841 1.236 22.316 33.641 1.00 37.13 C ATOM 1987 CG ARG A 841 0.503 23.485 32.968 1.00 42.87 C ATOM 1988 CD ARG A 841 0.516 24.723 33.813 1.00 46.66 C ATOM 1989 NE ARG A 841 -0.478 25.702 33.386 1.00 50.40 N ATOM 1990 CZ ARG A 841 -0.221 26.737 32.592 1.00 62.34 C ATOM 1991 NH1 ARG A 841 1.008 26.935 32.119 1.00 36.49 N ATOM 1992 NH2 ARG A 841 -1.188 27.585 32.266 1.00 44.11 N ATOM 1993 HE ARG A 841 -1.454 25.582 33.726 1.00 0.00 H ATOM 1994 HH12 ARG A 841 1.202 27.747 31.498 1.00 0.00 H ATOM 1995 HH11 ARG A 841 1.774 26.278 32.370 1.00 0.00 H ATOM 1996 HH22 ARG A 841 -0.983 28.393 31.645 1.00 0.00 H ATOM 1997 HH21 ARG A 841 -2.151 27.441 32.632 1.00 0.00 H ATOM 1998 H ARG A 841 3.639 22.729 32.744 1.00 0.00 H ATOM 1999 N ALA A 842 3.832 20.813 35.358 1.00 35.26 N ATOM 2000 CA ALA A 842 4.056 19.640 36.203 1.00 34.65 C ATOM 2001 C ALA A 842 5.525 19.379 36.354 1.00 35.34 C ATOM 2002 O ALA A 842 6.285 19.583 35.419 1.00 35.45 O ATOM 2003 CB ALA A 842 3.352 18.410 35.609 1.00 36.97 C ATOM 2004 H ALA A 842 4.539 21.089 34.648 1.00 0.00 H ATOM 2005 N GLN A 843 5.940 18.929 37.547 1.00 29.27 N ATOM 2006 CA GLN A 843 7.319 18.546 37.773 1.00 27.74 C ATOM 2007 C GLN A 843 7.609 17.250 36.948 1.00 30.53 C ATOM 2008 O GLN A 843 6.749 16.373 36.881 1.00 28.73 O ATOM 2009 CB GLN A 843 7.545 18.315 39.280 1.00 28.94 C ATOM 2010 CG GLN A 843 9.044 18.055 39.579 1.00 28.98 C ATOM 2011 CD GLN A 843 9.256 17.513 40.941 1.00 37.70 C ATOM 2012 OE1 GLN A 843 8.633 16.549 41.349 1.00 36.69 O ATOM 2013 NE2 GLN A 843 10.095 18.164 41.681 1.00 33.28 N ATOM 2014 HE22 GLN A 843 10.606 18.982 41.292 1.00 0.00 H ATOM 2015 HE21 GLN A 843 10.258 17.869 42.665 1.00 0.00 H ATOM 2016 H GLN A 843 5.257 18.853 38.327 1.00 0.00 H ATOM 2017 N PRO A 844 8.798 17.131 36.300 1.00 29.01 N ATOM 2018 CA PRO A 844 9.164 15.862 35.626 1.00 26.90 C ATOM 2019 C PRO A 844 9.083 14.687 36.584 1.00 29.67 C ATOM 2020 O PRO A 844 9.557 14.821 37.695 1.00 26.03 O ATOM 2021 CB PRO A 844 10.651 16.070 35.239 1.00 29.82 C ATOM 2022 CG PRO A 844 10.846 17.503 35.206 1.00 35.30 C ATOM 2023 CD PRO A 844 9.864 18.148 36.163 1.00 31.71 C ATOM 2024 N PHE A 845 8.474 13.545 36.170 1.00 27.33 N ATOM 2025 CA PHE A 845 8.210 12.383 37.061 1.00 28.42 C ATOM 2026 C PHE A 845 7.496 12.786 38.345 1.00 32.55 C ATOM 2027 O PHE A 845 7.713 12.174 39.390 1.00 32.74 O ATOM 2028 CB PHE A 845 9.535 11.613 37.384 1.00 29.34 C ATOM 2029 CG PHE A 845 10.255 11.042 36.184 1.00 30.64 C ATOM 2030 CD1 PHE A 845 9.664 10.053 35.401 1.00 31.54 C ATOM 2031 CD2 PHE A 845 11.522 11.489 35.838 1.00 31.58 C ATOM 2032 CE1 PHE A 845 10.322 9.522 34.299 1.00 32.07 C ATOM 2033 CE2 PHE A 845 12.183 10.961 34.723 1.00 33.87 C ATOM 2034 CZ PHE A 845 11.584 9.973 33.969 1.00 32.49 C ATOM 2035 H PHE A 845 8.176 13.480 35.176 1.00 0.00 H ATOM 2036 N GLY A 846 6.641 13.804 38.259 1.00 31.49 N ATOM 2037 CA GLY A 846 6.054 14.457 39.427 1.00 31.57 C ATOM 2038 C GLY A 846 5.287 13.557 40.371 1.00 36.89 C ATOM 2039 O GLY A 846 5.221 13.854 41.563 1.00 35.24 O ATOM 2040 H GLY A 846 6.378 14.151 37.314 1.00 0.00 H ATOM 2041 N GLN A 847 4.694 12.456 39.857 1.00 32.85 N ATOM 2042 CA GLN A 847 3.993 11.471 40.722 1.00 34.14 C ATOM 2043 C GLN A 847 4.898 10.368 41.264 1.00 38.49 C ATOM 2044 O GLN A 847 4.419 9.481 41.965 1.00 40.33 O ATOM 2045 CB GLN A 847 2.785 10.902 40.001 1.00 36.20 C ATOM 2046 CG GLN A 847 1.821 11.990 39.511 1.00 43.74 C ATOM 2047 CD GLN A 847 0.951 12.516 40.615 1.00 63.83 C ATOM 2048 OE1 GLN A 847 -0.115 11.967 40.917 1.00 55.73 O ATOM 2049 NE2 GLN A 847 1.370 13.615 41.222 1.00 59.55 N ATOM 2050 HE22 GLN A 847 2.272 14.051 40.943 1.00 0.00 H ATOM 2051 HE21 GLN A 847 0.797 14.042 41.978 1.00 0.00 H ATOM 2052 H GLN A 847 4.729 12.294 38.830 1.00 0.00 H ATOM 2053 N LEU A 848 6.208 10.424 40.953 1.00 33.48 N ATOM 2054 CA LEU A 848 7.216 9.461 41.485 1.00 34.37 C ATOM 2055 C LEU A 848 8.070 10.117 42.588 1.00 37.37 C ATOM 2056 O LEU A 848 8.346 11.316 42.516 1.00 37.07 O ATOM 2057 CB LEU A 848 8.174 8.982 40.350 1.00 32.10 C ATOM 2058 CG LEU A 848 7.562 8.238 39.129 1.00 34.18 C ATOM 2059 CD1 LEU A 848 8.666 7.689 38.200 1.00 32.80 C ATOM 2060 CD2 LEU A 848 6.615 7.120 39.543 1.00 31.20 C ATOM 2061 H LEU A 848 6.532 11.175 40.311 1.00 0.00 H ATOM 2062 N THR A 849 8.494 9.344 43.582 1.00 35.16 N ATOM 2063 CA THR A 849 9.326 9.883 44.670 1.00 35.92 C ATOM 2064 C THR A 849 10.764 10.018 44.162 1.00 37.97 C ATOM 2065 O THR A 849 11.112 9.459 43.099 1.00 35.83 O ATOM 2066 CB THR A 849 9.344 8.953 45.915 1.00 39.09 C ATOM 2067 OG1 THR A 849 9.959 7.749 45.515 1.00 36.61 O ATOM 2068 CG2 THR A 849 7.941 8.689 46.545 1.00 38.29 C ATOM 2069 HG1 THR A 849 9.991 7.125 46.283 1.00 0.00 H ATOM 2070 H THR A 849 8.233 8.337 43.591 1.00 0.00 H ATOM 2071 N ASP A 850 11.603 10.751 44.917 1.00 32.94 N ATOM 2072 CA ASP A 850 13.037 10.804 44.607 1.00 30.78 C ATOM 2073 C ASP A 850 13.679 9.424 44.484 1.00 34.67 C ATOM 2074 O ASP A 850 14.430 9.199 43.534 1.00 34.27 O ATOM 2075 CB ASP A 850 13.785 11.655 45.640 1.00 33.06 C ATOM 2076 CG ASP A 850 13.454 13.129 45.572 1.00 41.31 C ATOM 2077 OD1 ASP A 850 12.944 13.577 44.516 1.00 40.47 O ATOM 2078 OD2 ASP A 850 13.681 13.838 46.584 1.00 39.74 O ATOM 2079 H ASP A 850 11.232 11.285 45.728 1.00 0.00 H ATOM 2080 N GLU A 851 13.393 8.513 45.428 1.00 34.25 N ATOM 2081 CA GLU A 851 13.906 7.129 45.422 1.00 36.37 C ATOM 2082 C GLU A 851 13.477 6.344 44.159 1.00 38.67 C ATOM 2083 O GLU A 851 14.275 5.585 43.625 1.00 37.69 O ATOM 2084 CB GLU A 851 13.455 6.354 46.679 1.00 40.39 C ATOM 2085 CG GLU A 851 14.101 6.825 47.971 1.00 56.05 C ATOM 2086 CD GLU A 851 13.369 6.446 49.250 1.00107.01 C ATOM 2087 OE1 GLU A 851 12.116 6.514 49.273 1.00113.37 O ATOM 2088 OE2 GLU A 851 14.057 6.115 50.246 1.00109.66 O ATOM 2089 H GLU A 851 12.772 8.800 46.211 1.00 0.00 H ATOM 2090 N GLN A 852 12.236 6.516 43.704 1.00 36.67 N ATOM 2091 CA GLN A 852 11.765 5.884 42.466 1.00 36.96 C ATOM 2092 C GLN A 852 12.496 6.409 41.248 1.00 37.52 C ATOM 2093 O GLN A 852 12.790 5.640 40.322 1.00 36.80 O ATOM 2094 CB GLN A 852 10.249 6.053 42.299 1.00 38.33 C ATOM 2095 CG GLN A 852 9.456 5.124 43.240 1.00 40.48 C ATOM 2096 CD GLN A 852 7.979 5.373 43.166 1.00 48.22 C ATOM 2097 OE1 GLN A 852 7.513 6.519 43.272 1.00 38.13 O ATOM 2098 NE2 GLN A 852 7.198 4.293 43.061 1.00 43.35 N ATOM 2099 HE22 GLN A 852 7.625 3.349 42.974 1.00 0.00 H ATOM 2100 HE21 GLN A 852 6.163 4.397 43.066 1.00 0.00 H ATOM 2101 H GLN A 852 11.581 7.117 44.243 1.00 0.00 H ATOM 2102 N VAL A 853 12.794 7.740 41.243 1.00 30.92 N ATOM 2103 CA VAL A 853 13.547 8.379 40.141 1.00 28.96 C ATOM 2104 C VAL A 853 14.978 7.784 40.107 1.00 35.23 C ATOM 2105 O VAL A 853 15.515 7.487 39.034 1.00 33.23 O ATOM 2106 CB VAL A 853 13.501 9.931 40.315 1.00 30.55 C ATOM 2107 CG1 VAL A 853 14.509 10.654 39.408 1.00 28.87 C ATOM 2108 CG2 VAL A 853 12.081 10.451 40.076 1.00 29.90 C ATOM 2109 H VAL A 853 12.481 8.327 42.042 1.00 0.00 H ATOM 2110 N ILE A 854 15.580 7.591 41.297 1.00 35.94 N ATOM 2111 CA ILE A 854 16.929 7.024 41.441 1.00 35.58 C ATOM 2112 C ILE A 854 16.906 5.553 41.012 1.00 40.31 C ATOM 2113 O ILE A 854 17.782 5.151 40.261 1.00 39.26 O ATOM 2114 CB ILE A 854 17.469 7.248 42.891 1.00 38.21 C ATOM 2115 CG1 ILE A 854 17.787 8.741 43.114 1.00 36.45 C ATOM 2116 CG2 ILE A 854 18.664 6.335 43.232 1.00 38.19 C ATOM 2117 CD1 ILE A 854 17.964 9.117 44.537 1.00 39.95 C ATOM 2118 H ILE A 854 15.063 7.857 42.159 1.00 0.00 H ATOM 2119 N GLU A 855 15.905 4.751 41.483 1.00 39.44 N ATOM 2120 CA GLU A 855 15.785 3.351 41.039 1.00 40.10 C ATOM 2121 C GLU A 855 15.465 3.244 39.500 1.00 39.74 C ATOM 2122 O GLU A 855 15.857 2.268 38.884 1.00 39.83 O ATOM 2123 CB GLU A 855 14.816 2.512 41.935 1.00 43.26 C ATOM 2124 CG GLU A 855 13.354 2.904 41.873 1.00 59.85 C ATOM 2125 CD GLU A 855 12.296 2.087 42.606 1.00 82.18 C ATOM 2126 OE1 GLU A 855 11.246 1.778 41.987 1.00 61.10 O ATOM 2127 OE2 GLU A 855 12.465 1.856 43.827 1.00 69.26 O ATOM 2128 H GLU A 855 15.219 5.134 42.164 1.00 0.00 H ATOM 2129 N ASN A 856 14.784 4.231 38.891 1.00 35.39 N ATOM 2130 CA ASN A 856 14.584 4.280 37.434 1.00 34.30 C ATOM 2131 C ASN A 856 15.932 4.409 36.692 1.00 38.44 C ATOM 2132 O ASN A 856 16.102 3.778 35.634 1.00 39.53 O ATOM 2133 CB ASN A 856 13.692 5.469 37.032 1.00 30.53 C ATOM 2134 CG ASN A 856 13.206 5.378 35.618 1.00 38.23 C ATOM 2135 OD1 ASN A 856 12.829 4.310 35.151 1.00 38.83 O ATOM 2136 ND2 ASN A 856 13.165 6.501 34.903 1.00 29.05 N ATOM 2137 HD22 ASN A 856 13.491 7.396 35.321 1.00 0.00 H ATOM 2138 HD21 ASN A 856 12.807 6.483 33.927 1.00 0.00 H ATOM 2139 H ASN A 856 14.382 4.992 39.475 1.00 0.00 H ATOM 2140 N ALA A 857 16.875 5.224 37.226 1.00 32.33 N ATOM 2141 CA ALA A 857 18.246 5.255 36.678 1.00 33.21 C ATOM 2142 C ALA A 857 18.906 3.865 36.695 1.00 40.37 C ATOM 2143 O ALA A 857 19.540 3.507 35.710 1.00 43.62 O ATOM 2144 CB ALA A 857 19.114 6.285 37.395 1.00 32.61 C ATOM 2145 H ALA A 857 16.630 5.835 38.031 1.00 0.00 H ATOM 2146 N GLY A 858 18.740 3.100 37.785 1.00 38.18 N ATOM 2147 CA GLY A 858 19.190 1.707 37.869 1.00 39.50 C ATOM 2148 C GLY A 858 18.564 0.826 36.802 1.00 45.21 C ATOM 2149 O GLY A 858 19.183 -0.127 36.344 1.00 45.69 O ATOM 2150 H GLY A 858 18.268 3.517 38.613 1.00 0.00 H ATOM 2151 N GLU A 859 17.318 1.146 36.385 1.00 43.43 N ATOM 2152 CA GLU A 859 16.606 0.435 35.331 1.00 43.00 C ATOM 2153 C GLU A 859 17.152 0.738 33.941 1.00 43.93 C ATOM 2154 O GLU A 859 17.218 -0.189 33.133 1.00 44.47 O ATOM 2155 CB GLU A 859 15.083 0.648 35.413 1.00 43.98 C ATOM 2156 CG GLU A 859 14.430 -0.044 36.608 1.00 55.74 C ATOM 2157 CD GLU A 859 14.393 -1.567 36.614 1.00 78.78 C ATOM 2158 OE1 GLU A 859 14.053 -2.141 37.676 1.00 72.40 O ATOM 2159 OE2 GLU A 859 14.716 -2.188 35.573 1.00 65.75 O ATOM 2160 H GLU A 859 16.839 1.947 36.844 1.00 0.00 H ATOM 2161 N PHE A 860 17.544 2.016 33.643 1.00 41.04 N ATOM 2162 CA PHE A 860 18.305 2.328 32.412 1.00 39.35 C ATOM 2163 C PHE A 860 19.602 1.533 32.341 1.00 44.77 C ATOM 2164 O PHE A 860 19.888 0.947 31.294 1.00 44.95 O ATOM 2165 CB PHE A 860 18.602 3.820 32.265 1.00 38.64 C ATOM 2166 CG PHE A 860 17.448 4.651 31.763 1.00 37.74 C ATOM 2167 CD1 PHE A 860 17.285 4.892 30.400 1.00 39.03 C ATOM 2168 CD2 PHE A 860 16.516 5.187 32.651 1.00 36.91 C ATOM 2169 CE1 PHE A 860 16.195 5.643 29.934 1.00 38.61 C ATOM 2170 CE2 PHE A 860 15.440 5.954 32.187 1.00 37.60 C ATOM 2171 CZ PHE A 860 15.286 6.181 30.833 1.00 35.60 C ATOM 2172 H PHE A 860 17.301 2.787 34.298 1.00 0.00 H ATOM 2173 N PHE A 861 20.379 1.512 33.446 1.00 42.88 N ATOM 2174 CA PHE A 861 21.589 0.678 33.572 1.00 44.87 C ATOM 2175 C PHE A 861 21.316 -0.775 33.210 1.00 52.40 C ATOM 2176 O PHE A 861 21.965 -1.305 32.305 1.00 51.60 O ATOM 2177 CB PHE A 861 22.251 0.790 34.958 1.00 46.58 C ATOM 2178 CG PHE A 861 23.373 -0.207 35.214 1.00 49.98 C ATOM 2179 CD1 PHE A 861 23.200 -1.261 36.107 1.00 54.02 C ATOM 2180 CD2 PHE A 861 24.591 -0.099 34.547 1.00 51.97 C ATOM 2181 CE1 PHE A 861 24.225 -2.188 36.334 1.00 56.48 C ATOM 2182 CE2 PHE A 861 25.614 -1.028 34.770 1.00 56.20 C ATOM 2183 CZ PHE A 861 25.426 -2.065 35.666 1.00 55.57 C ATOM 2184 H PHE A 861 20.110 2.115 34.249 1.00 0.00 H ATOM 2185 N ARG A 862 20.356 -1.412 33.898 1.00 51.63 N ATOM 2186 CA ARG A 862 20.066 -2.836 33.714 1.00 53.71 C ATOM 2187 C ARG A 862 19.522 -3.171 32.304 1.00 57.84 C ATOM 2188 O ARG A 862 19.722 -4.291 31.849 1.00 60.15 O ATOM 2189 CB ARG A 862 19.144 -3.378 34.833 1.00 54.06 C ATOM 2190 CG ARG A 862 19.880 -3.595 36.160 1.00 58.80 C ATOM 2191 CD ARG A 862 18.995 -4.140 37.284 1.00 62.91 C ATOM 2192 NE ARG A 862 17.998 -3.171 37.761 1.00 72.07 N ATOM 2193 CZ ARG A 862 18.249 -2.178 38.615 1.00 86.69 C ATOM 2194 NH1 ARG A 862 19.473 -2.002 39.100 1.00 76.44 N ATOM 2195 NH2 ARG A 862 17.278 -1.350 38.984 1.00 70.01 N ATOM 2196 HE ARG A 862 17.025 -3.267 37.406 1.00 0.00 H ATOM 2197 HH12 ARG A 862 19.662 -1.226 39.766 1.00 0.00 H ATOM 2198 HH11 ARG A 862 20.242 -2.641 38.814 1.00 0.00 H ATOM 2199 HH22 ARG A 862 17.479 -0.577 39.650 1.00 0.00 H ATOM 2200 HH21 ARG A 862 16.317 -1.475 38.607 1.00 0.00 H ATOM 2201 H ARG A 862 19.796 -0.873 34.589 1.00 0.00 H ATOM 2202 N ASP A 863 18.849 -2.214 31.620 1.00 51.74 N ATOM 2203 CA ASP A 863 18.401 -2.350 30.221 1.00 51.50 C ATOM 2204 C ASP A 863 17.557 -3.636 29.970 1.00 59.01 C ATOM 2205 O ASP A 863 17.821 -4.408 29.038 1.00 58.81 O ATOM 2206 CB ASP A 863 19.614 -2.252 29.263 1.00 53.20 C ATOM 2207 CG ASP A 863 19.302 -1.843 27.843 1.00 68.48 C ATOM 2208 OD1 ASP A 863 18.269 -1.153 27.630 1.00 69.80 O ATOM 2209 OD2 ASP A 863 20.132 -2.125 26.954 1.00 77.83 O ATOM 2210 H ASP A 863 18.634 -1.325 32.114 1.00 0.00 H ATOM 2211 N GLN A 864 16.540 -3.851 30.824 1.00 57.01 N ATOM 2212 CA GLN A 864 15.640 -5.008 30.755 1.00 57.72 C ATOM 2213 C GLN A 864 14.175 -4.585 30.489 1.00 59.85 C ATOM 2214 O GLN A 864 13.254 -5.289 30.894 1.00 61.13 O ATOM 2215 CB GLN A 864 15.784 -5.867 32.027 1.00 60.34 C ATOM 2216 CG GLN A 864 17.182 -6.464 32.187 1.00 67.32 C ATOM 2217 CD GLN A 864 17.321 -7.558 33.215 1.00 84.92 C ATOM 2218 OE1 GLN A 864 16.592 -8.559 33.211 1.00 91.46 O ATOM 2219 NE2 GLN A 864 18.363 -7.464 34.027 1.00 66.80 N ATOM 2220 HE22 GLN A 864 18.960 -6.612 34.011 1.00 0.00 H ATOM 2221 HE21 GLN A 864 18.585 -8.242 34.681 1.00 0.00 H ATOM 2222 H GLN A 864 16.382 -3.154 31.580 1.00 0.00 H ATOM 2223 N GLY A 865 13.989 -3.440 29.816 1.00 54.38 N ATOM 2224 CA GLY A 865 12.684 -2.902 29.425 1.00 53.16 C ATOM 2225 C GLY A 865 11.763 -2.454 30.553 1.00 55.44 C ATOM 2226 O GLY A 865 10.543 -2.402 30.368 1.00 53.78 O ATOM 2227 H GLY A 865 14.834 -2.894 29.552 1.00 0.00 H ATOM 2228 N ARG A 866 12.330 -2.128 31.733 1.00 50.95 N ATOM 2229 CA ARG A 866 11.549 -1.657 32.883 1.00 49.35 C ATOM 2230 C ARG A 866 11.780 -0.166 33.175 1.00 48.54 C ATOM 2231 O ARG A 866 11.162 0.374 34.093 1.00 47.55 O ATOM 2232 CB ARG A 866 11.839 -2.513 34.137 1.00 50.07 C ATOM 2233 CG ARG A 866 11.262 -3.930 34.100 1.00 63.19 C ATOM 2234 CD ARG A 866 11.845 -4.743 35.247 1.00 74.26 C ATOM 2235 NE ARG A 866 11.441 -6.150 35.214 1.00 91.38 N ATOM 2236 CZ ARG A 866 10.630 -6.720 36.103 1.00110.68 C ATOM 2237 NH1 ARG A 866 10.123 -6.009 37.104 1.00 96.05 N ATOM 2238 NH2 ARG A 866 10.322 -8.006 36.000 1.00102.16 N ATOM 2239 HE ARG A 866 11.812 -6.744 34.445 1.00 0.00 H ATOM 2240 HH12 ARG A 866 9.490 -6.461 37.795 1.00 0.00 H ATOM 2241 HH11 ARG A 866 10.359 -5.000 37.197 1.00 0.00 H ATOM 2242 HH22 ARG A 866 9.688 -8.446 36.697 1.00 0.00 H ATOM 2243 HH21 ARG A 866 10.714 -8.574 35.222 1.00 0.00 H ATOM 2244 H ARG A 866 13.362 -2.214 31.832 1.00 0.00 H ATOM 2245 N GLN A 867 12.666 0.497 32.401 1.00 40.36 N ATOM 2246 CA GLN A 867 12.924 1.938 32.510 1.00 37.43 C ATOM 2247 C GLN A 867 11.669 2.657 32.076 1.00 39.01 C ATOM 2248 O GLN A 867 10.935 2.167 31.222 1.00 37.10 O ATOM 2249 CB GLN A 867 14.097 2.409 31.585 1.00 37.47 C ATOM 2250 CG GLN A 867 14.989 1.245 31.091 1.00 70.15 C ATOM 2251 CD GLN A 867 15.023 1.049 29.597 1.00 84.18 C ATOM 2252 OE1 GLN A 867 14.047 1.274 28.880 1.00 78.96 O ATOM 2253 NE2 GLN A 867 16.156 0.586 29.098 1.00 80.16 N ATOM 2254 HE22 GLN A 867 16.965 0.405 29.726 1.00 0.00 H ATOM 2255 HE21 GLN A 867 16.238 0.403 28.078 1.00 0.00 H ATOM 2256 H GLN A 867 13.195 -0.044 31.688 1.00 0.00 H ATOM 2257 N VAL A 868 11.456 3.833 32.655 1.00 36.10 N ATOM 2258 CA VAL A 868 10.265 4.617 32.432 1.00 37.78 C ATOM 2259 C VAL A 868 10.695 6.013 31.953 1.00 37.33 C ATOM 2260 O VAL A 868 11.778 6.443 32.294 1.00 35.47 O ATOM 2261 CB VAL A 868 9.519 4.511 33.791 1.00 42.72 C ATOM 2262 CG1 VAL A 868 9.334 5.815 34.553 1.00 41.83 C ATOM 2263 CG2 VAL A 868 8.313 3.606 33.729 1.00 42.94 C ATOM 2264 H VAL A 868 12.182 4.207 33.300 1.00 0.00 H ATOM 2265 N TYR A 869 9.846 6.692 31.140 1.00 32.88 N ATOM 2266 CA TYR A 869 10.103 7.997 30.515 1.00 31.34 C ATOM 2267 C TYR A 869 9.008 8.997 30.871 1.00 33.00 C ATOM 2268 O TYR A 869 7.874 8.620 31.223 1.00 32.27 O ATOM 2269 CB TYR A 869 10.164 7.872 28.945 1.00 31.94 C ATOM 2270 CG TYR A 869 11.207 6.909 28.437 1.00 32.86 C ATOM 2271 CD1 TYR A 869 12.497 7.339 28.147 1.00 34.83 C ATOM 2272 CD2 TYR A 869 10.912 5.559 28.267 1.00 35.42 C ATOM 2273 CE1 TYR A 869 13.467 6.454 27.689 1.00 35.70 C ATOM 2274 CE2 TYR A 869 11.873 4.662 27.810 1.00 36.91 C ATOM 2275 CZ TYR A 869 13.149 5.114 27.519 1.00 42.77 C ATOM 2276 OH TYR A 869 14.095 4.232 27.065 1.00 39.93 O ATOM 2277 HH TYR A 869 14.945 4.714 26.907 1.00 0.00 H ATOM 2278 H TYR A 869 8.927 6.247 30.941 1.00 0.00 H ATOM 2279 N LEU A 870 9.355 10.263 30.778 1.00 28.04 N ATOM 2280 CA LEU A 870 8.374 11.351 30.739 1.00 28.49 C ATOM 2281 C LEU A 870 7.388 11.108 29.600 1.00 32.81 C ATOM 2282 O LEU A 870 7.806 10.652 28.517 1.00 32.36 O ATOM 2283 CB LEU A 870 9.082 12.695 30.576 1.00 26.85 C ATOM 2284 CG LEU A 870 10.070 13.033 31.744 1.00 28.27 C ATOM 2285 CD1 LEU A 870 10.874 14.293 31.470 1.00 26.44 C ATOM 2286 CD2 LEU A 870 9.317 13.212 33.040 1.00 29.31 C ATOM 2287 H LEU A 870 10.366 10.501 30.730 1.00 0.00 H ATOM 2288 N SER A 871 6.073 11.394 29.852 1.00 29.43 N ATOM 2289 CA SER A 871 5.011 11.093 28.868 1.00 27.72 C ATOM 2290 C SER A 871 4.973 12.223 27.856 1.00 32.53 C ATOM 2291 O SER A 871 5.524 13.290 28.117 1.00 30.74 O ATOM 2292 CB SER A 871 3.641 10.986 29.531 1.00 29.09 C ATOM 2293 OG SER A 871 3.644 9.988 30.532 1.00 37.47 O ATOM 2294 HG SER A 871 2.747 9.936 30.948 1.00 0.00 H ATOM 2295 H SER A 871 5.815 11.834 30.758 1.00 0.00 H ATOM 2296 N ARG A 872 4.303 12.001 26.716 1.00 30.02 N ATOM 2297 CA ARG A 872 4.198 13.025 25.677 1.00 31.74 C ATOM 2298 C ARG A 872 3.308 14.169 26.191 1.00 34.04 C ATOM 2299 O ARG A 872 2.162 13.929 26.523 1.00 33.65 O ATOM 2300 CB ARG A 872 3.610 12.434 24.376 1.00 31.60 C ATOM 2301 CG ARG A 872 3.701 13.386 23.175 1.00 36.90 C ATOM 2302 CD ARG A 872 3.128 12.709 21.945 1.00 45.07 C ATOM 2303 NE ARG A 872 1.673 12.659 22.046 1.00 48.92 N ATOM 2304 CZ ARG A 872 0.882 11.921 21.287 1.00 61.03 C ATOM 2305 NH1 ARG A 872 1.395 11.135 20.341 1.00 50.52 N ATOM 2306 NH2 ARG A 872 -0.429 11.952 21.467 1.00 48.95 N ATOM 2307 HE ARG A 872 1.223 13.251 22.773 1.00 0.00 H ATOM 2308 HH12 ARG A 872 0.766 10.557 19.748 1.00 0.00 H ATOM 2309 HH11 ARG A 872 2.424 11.100 20.196 1.00 0.00 H ATOM 2310 HH22 ARG A 872 -1.050 11.371 20.869 1.00 0.00 H ATOM 2311 HH21 ARG A 872 -0.838 12.558 22.207 1.00 0.00 H ATOM 2312 H ARG A 872 3.847 11.078 26.567 1.00 0.00 H ATOM 2313 N PRO A 873 3.824 15.410 26.288 1.00 29.10 N ATOM 2314 CA PRO A 873 2.951 16.551 26.650 1.00 28.08 C ATOM 2315 C PRO A 873 1.759 16.725 25.748 1.00 33.69 C ATOM 2316 O PRO A 873 1.858 16.468 24.541 1.00 33.60 O ATOM 2317 CB PRO A 873 3.888 17.754 26.526 1.00 27.26 C ATOM 2318 CG PRO A 873 5.283 17.150 26.857 1.00 28.26 C ATOM 2319 CD PRO A 873 5.226 15.850 26.102 1.00 27.06 C ATOM 2320 N PRO A 874 0.590 17.164 26.296 1.00 32.74 N ATOM 2321 CA PRO A 874 -0.582 17.398 25.410 1.00 31.64 C ATOM 2322 C PRO A 874 -0.257 18.284 24.196 1.00 33.21 C ATOM 2323 O PRO A 874 -0.723 18.006 23.096 1.00 32.31 O ATOM 2324 CB PRO A 874 -1.618 18.044 26.336 1.00 33.75 C ATOM 2325 CG PRO A 874 -1.222 17.632 27.714 1.00 38.80 C ATOM 2326 CD PRO A 874 0.281 17.445 27.714 1.00 33.35 C ATOM 2327 N ALA A 875 0.550 19.347 24.376 1.00 31.46 N ATOM 2328 CA ALA A 875 0.928 20.268 23.265 1.00 31.31 C ATOM 2329 C ALA A 875 1.965 19.696 22.292 1.00 36.20 C ATOM 2330 O ALA A 875 2.262 20.332 21.275 1.00 37.26 O ATOM 2331 CB ALA A 875 1.442 21.590 23.838 1.00 31.74 C ATOM 2332 H ALA A 875 0.925 19.533 25.328 1.00 0.00 H ATOM 2333 N CYS A 876 2.518 18.508 22.589 1.00 31.56 N ATOM 2334 CA CYS A 876 3.632 17.932 21.848 1.00 29.85 C ATOM 2335 C CYS A 876 3.206 16.931 20.756 1.00 34.03 C ATOM 2336 O CYS A 876 2.643 15.917 21.119 1.00 33.65 O ATOM 2337 CB CYS A 876 4.613 17.283 22.823 1.00 28.91 C ATOM 2338 SG CYS A 876 6.129 16.703 22.043 1.00 31.44 S ATOM 2339 H CYS A 876 2.130 17.971 23.391 1.00 0.00 H ATOM 2340 N PRO A 877 3.474 17.158 19.444 1.00 31.27 N ATOM 2341 CA PRO A 877 3.225 16.086 18.441 1.00 31.51 C ATOM 2342 C PRO A 877 4.196 14.928 18.588 1.00 33.19 C ATOM 2343 O PRO A 877 5.263 15.091 19.183 1.00 33.42 O ATOM 2344 CB PRO A 877 3.505 16.771 17.081 1.00 34.49 C ATOM 2345 CG PRO A 877 3.754 18.207 17.368 1.00 37.96 C ATOM 2346 CD PRO A 877 4.014 18.389 18.818 1.00 32.02 C ATOM 2347 N GLN A 878 3.834 13.753 18.041 1.00 32.69 N ATOM 2348 CA GLN A 878 4.640 12.536 18.104 1.00 30.46 C ATOM 2349 C GLN A 878 6.080 12.752 17.574 1.00 35.96 C ATOM 2350 O GLN A 878 6.996 12.230 18.185 1.00 34.60 O ATOM 2351 CB GLN A 878 3.952 11.378 17.369 1.00 32.85 C ATOM 2352 CG GLN A 878 4.670 10.018 17.520 1.00 35.64 C ATOM 2353 CD GLN A 878 4.903 9.590 18.971 1.00 50.52 C ATOM 2354 OE1 GLN A 878 4.197 10.001 19.897 1.00 36.95 O ATOM 2355 NE2 GLN A 878 5.917 8.749 19.203 1.00 47.98 N ATOM 2356 HE22 GLN A 878 6.503 8.411 18.413 1.00 0.00 H ATOM 2357 HE21 GLN A 878 6.119 8.433 20.173 1.00 0.00 H ATOM 2358 H GLN A 878 2.923 13.708 17.542 1.00 0.00 H ATOM 2359 N GLY A 879 6.251 13.491 16.458 1.00 32.13 N ATOM 2360 CA GLY A 879 7.565 13.752 15.876 1.00 31.68 C ATOM 2361 C GLY A 879 8.511 14.467 16.832 1.00 34.25 C ATOM 2362 O GLY A 879 9.684 14.127 16.923 1.00 34.90 O ATOM 2363 H GLY A 879 5.412 13.892 15.993 1.00 0.00 H ATOM 2364 N LEU A 880 8.016 15.449 17.543 1.00 29.89 N ATOM 2365 CA LEU A 880 8.770 16.185 18.564 1.00 29.48 C ATOM 2366 C LEU A 880 9.025 15.324 19.816 1.00 32.74 C ATOM 2367 O LEU A 880 10.119 15.357 20.388 1.00 30.77 O ATOM 2368 CB LEU A 880 8.020 17.487 18.891 1.00 30.21 C ATOM 2369 CG LEU A 880 8.714 18.451 19.879 1.00 35.57 C ATOM 2370 CD1 LEU A 880 10.133 18.879 19.367 1.00 34.79 C ATOM 2371 CD2 LEU A 880 7.813 19.654 20.165 1.00 36.23 C ATOM 2372 H LEU A 880 7.027 15.724 17.373 1.00 0.00 H ATOM 2373 N TYR A 881 8.034 14.538 20.227 1.00 29.24 N ATOM 2374 CA TYR A 881 8.240 13.524 21.273 1.00 28.22 C ATOM 2375 C TYR A 881 9.372 12.512 21.003 1.00 33.22 C ATOM 2376 O TYR A 881 10.106 12.129 21.914 1.00 34.82 O ATOM 2377 CB TYR A 881 6.938 12.768 21.519 1.00 29.57 C ATOM 2378 CG TYR A 881 7.008 11.908 22.764 1.00 29.32 C ATOM 2379 CD1 TYR A 881 7.371 12.453 23.992 1.00 28.87 C ATOM 2380 CD2 TYR A 881 6.720 10.547 22.710 1.00 32.33 C ATOM 2381 CE1 TYR A 881 7.451 11.659 25.142 1.00 27.20 C ATOM 2382 CE2 TYR A 881 6.784 9.745 23.854 1.00 32.57 C ATOM 2383 CZ TYR A 881 7.157 10.306 25.065 1.00 30.92 C ATOM 2384 OH TYR A 881 7.202 9.512 26.195 1.00 31.42 O ATOM 2385 HH TYR A 881 7.484 10.059 26.970 1.00 0.00 H ATOM 2386 H TYR A 881 7.092 14.643 19.799 1.00 0.00 H ATOM 2387 N GLU A 882 9.505 12.068 19.760 1.00 29.49 N ATOM 2388 CA GLU A 882 10.572 11.160 19.343 1.00 29.58 C ATOM 2389 C GLU A 882 11.938 11.807 19.469 1.00 34.41 C ATOM 2390 O GLU A 882 12.926 11.131 19.796 1.00 34.65 O ATOM 2391 CB GLU A 882 10.293 10.690 17.880 1.00 31.30 C ATOM 2392 CG GLU A 882 9.170 9.666 17.915 1.00 39.18 C ATOM 2393 CD GLU A 882 8.664 9.096 16.612 1.00 67.46 C ATOM 2394 OE1 GLU A 882 9.389 9.165 15.593 1.00 66.02 O ATOM 2395 OE2 GLU A 882 7.554 8.518 16.632 1.00 66.63 O ATOM 2396 H GLU A 882 8.816 12.381 19.047 1.00 0.00 H ATOM 2397 N LEU A 883 11.999 13.106 19.229 1.00 32.96 N ATOM 2398 CA LEU A 883 13.221 13.889 19.410 1.00 32.45 C ATOM 2399 C LEU A 883 13.611 13.914 20.901 1.00 33.74 C ATOM 2400 O LEU A 883 14.794 13.730 21.225 1.00 31.46 O ATOM 2401 CB LEU A 883 13.060 15.329 18.853 1.00 32.17 C ATOM 2402 CG LEU A 883 14.236 16.276 19.162 1.00 37.35 C ATOM 2403 CD1 LEU A 883 15.431 15.751 18.564 1.00 41.72 C ATOM 2404 CD2 LEU A 883 14.069 17.622 18.543 1.00 39.20 C ATOM 2405 H LEU A 883 11.141 13.592 18.897 1.00 0.00 H ATOM 2406 N MET A 884 12.623 14.154 21.799 1.00 27.84 N ATOM 2407 CA MET A 884 12.854 14.067 23.261 1.00 27.15 C ATOM 2408 C MET A 884 13.329 12.682 23.593 1.00 27.89 C ATOM 2409 O MET A 884 14.261 12.531 24.373 1.00 29.02 O ATOM 2410 CB MET A 884 11.568 14.312 24.075 1.00 29.31 C ATOM 2411 CG MET A 884 11.064 15.739 24.072 1.00 33.02 C ATOM 2412 SD MET A 884 9.429 15.824 24.888 1.00 36.09 S ATOM 2413 CE MET A 884 8.877 17.458 24.277 1.00 33.02 C ATOM 2414 H MET A 884 11.676 14.406 21.452 1.00 0.00 H ATOM 2415 N LEU A 885 12.718 11.653 23.011 1.00 26.15 N ATOM 2416 CA LEU A 885 13.170 10.284 23.336 1.00 27.81 C ATOM 2417 C LEU A 885 14.632 9.983 22.931 1.00 34.19 C ATOM 2418 O LEU A 885 15.313 9.246 23.640 1.00 35.01 O ATOM 2419 CB LEU A 885 12.231 9.212 22.769 1.00 28.76 C ATOM 2420 CG LEU A 885 10.764 9.206 23.316 1.00 34.71 C ATOM 2421 CD1 LEU A 885 9.825 8.355 22.400 1.00 33.11 C ATOM 2422 CD2 LEU A 885 10.685 8.805 24.775 1.00 35.19 C ATOM 2423 H LEU A 885 11.938 11.809 22.341 1.00 0.00 H ATOM 2424 N ARG A 886 15.104 10.534 21.799 1.00 31.87 N ATOM 2425 CA ARG A 886 16.506 10.397 21.362 1.00 33.32 C ATOM 2426 C ARG A 886 17.463 11.039 22.368 1.00 34.93 C ATOM 2427 O ARG A 886 18.576 10.530 22.532 1.00 33.14 O ATOM 2428 CB ARG A 886 16.731 10.985 19.959 1.00 35.69 C ATOM 2429 CG ARG A 886 16.057 10.184 18.831 1.00 42.05 C ATOM 2430 CD ARG A 886 16.458 10.628 17.431 1.00 41.53 C ATOM 2431 NE ARG A 886 15.891 11.922 17.031 1.00 46.70 N ATOM 2432 CZ ARG A 886 14.669 12.103 16.519 1.00 55.76 C ATOM 2433 NH1 ARG A 886 13.854 11.072 16.344 1.00 40.87 N ATOM 2434 NH2 ARG A 886 14.255 13.320 16.187 1.00 47.82 N ATOM 2435 HE ARG A 886 16.487 12.765 17.156 1.00 0.00 H ATOM 2436 HH12 ARG A 886 12.905 11.221 15.945 1.00 0.00 H ATOM 2437 HH11 ARG A 886 14.164 10.114 16.606 1.00 0.00 H ATOM 2438 HH22 ARG A 886 13.304 13.455 15.789 1.00 0.00 H ATOM 2439 HH21 ARG A 886 14.882 14.138 16.325 1.00 0.00 H ATOM 2440 H ARG A 886 14.450 11.082 21.204 1.00 0.00 H ATOM 2441 N CYS A 887 17.022 12.152 23.049 1.00 28.73 N ATOM 2442 CA CYS A 887 17.780 12.843 24.104 1.00 28.53 C ATOM 2443 C CYS A 887 17.961 11.943 25.311 1.00 31.75 C ATOM 2444 O CYS A 887 18.886 12.161 26.090 1.00 27.90 O ATOM 2445 CB CYS A 887 17.097 14.142 24.524 1.00 28.48 C ATOM 2446 SG CYS A 887 17.087 15.430 23.245 1.00 32.65 S ATOM 2447 H CYS A 887 16.086 12.531 22.800 1.00 0.00 H ATOM 2448 N TRP A 888 17.047 10.963 25.484 1.00 29.50 N ATOM 2449 CA TRP A 888 17.052 10.037 26.595 1.00 29.16 C ATOM 2450 C TRP A 888 17.524 8.637 26.167 1.00 34.08 C ATOM 2451 O TRP A 888 17.269 7.647 26.858 1.00 33.22 O ATOM 2452 CB TRP A 888 15.677 10.020 27.311 1.00 27.85 C ATOM 2453 CG TRP A 888 15.158 11.379 27.723 1.00 27.09 C ATOM 2454 CD1 TRP A 888 15.876 12.424 28.234 1.00 28.54 C ATOM 2455 CD2 TRP A 888 13.800 11.835 27.620 1.00 26.37 C ATOM 2456 NE1 TRP A 888 15.046 13.493 28.480 1.00 26.08 N ATOM 2457 CE2 TRP A 888 13.758 13.149 28.137 1.00 27.94 C ATOM 2458 CE3 TRP A 888 12.600 11.239 27.190 1.00 27.33 C ATOM 2459 CZ2 TRP A 888 12.571 13.896 28.178 1.00 25.46 C ATOM 2460 CZ3 TRP A 888 11.432 11.984 27.237 1.00 27.27 C ATOM 2461 CH2 TRP A 888 11.430 13.295 27.726 1.00 26.59 C ATOM 2462 HE1 TRP A 888 15.344 14.413 28.863 1.00 0.00 H ATOM 2463 H TRP A 888 16.293 10.869 24.774 1.00 0.00 H ATOM 2464 N SER A 889 18.246 8.550 25.028 1.00 33.35 N ATOM 2465 CA SER A 889 18.923 7.288 24.652 1.00 33.51 C ATOM 2466 C SER A 889 19.811 6.809 25.824 1.00 38.12 C ATOM 2467 O SER A 889 20.466 7.627 26.482 1.00 33.70 O ATOM 2468 CB SER A 889 19.815 7.498 23.430 1.00 31.90 C ATOM 2469 OG SER A 889 19.107 8.019 22.324 1.00 42.06 O ATOM 2470 HG SER A 889 18.714 8.894 22.568 1.00 0.00 H ATOM 2471 H SER A 889 18.327 9.380 24.407 1.00 0.00 H ATOM 2472 N ARG A 890 19.827 5.491 26.079 1.00 36.55 N ATOM 2473 CA ARG A 890 20.724 4.897 27.083 1.00 36.99 C ATOM 2474 C ARG A 890 22.217 5.192 26.771 1.00 39.67 C ATOM 2475 O ARG A 890 22.963 5.606 27.667 1.00 36.61 O ATOM 2476 CB ARG A 890 20.478 3.382 27.180 1.00 39.62 C ATOM 2477 CG ARG A 890 21.264 2.720 28.301 1.00 41.63 C ATOM 2478 CD ARG A 890 21.190 1.204 28.251 1.00 47.67 C ATOM 2479 NE ARG A 890 21.895 0.613 29.396 1.00 45.03 N ATOM 2480 CZ ARG A 890 23.206 0.394 29.460 1.00 57.08 C ATOM 2481 NH1 ARG A 890 23.995 0.712 28.435 1.00 49.69 N ATOM 2482 NH2 ARG A 890 23.739 -0.136 30.544 1.00 43.93 N ATOM 2483 HE ARG A 890 21.324 0.344 30.223 1.00 0.00 H ATOM 2484 HH12 ARG A 890 25.019 0.538 28.493 1.00 0.00 H ATOM 2485 HH11 ARG A 890 23.587 1.135 27.577 1.00 0.00 H ATOM 2486 HH22 ARG A 890 24.764 -0.306 30.590 1.00 0.00 H ATOM 2487 HH21 ARG A 890 23.134 -0.384 31.353 1.00 0.00 H ATOM 2488 H ARG A 890 19.184 4.869 25.549 1.00 0.00 H ATOM 2489 N GLU A 891 22.626 4.995 25.504 1.00 37.06 N ATOM 2490 CA GLU A 891 24.004 5.231 25.045 1.00 36.08 C ATOM 2491 C GLU A 891 24.183 6.708 24.817 1.00 40.76 C ATOM 2492 O GLU A 891 23.505 7.289 23.972 1.00 40.73 O ATOM 2493 CB GLU A 891 24.322 4.443 23.741 1.00 37.95 C ATOM 2494 CG GLU A 891 23.968 2.955 23.765 1.00 40.57 C ATOM 2495 CD GLU A 891 24.442 2.212 25.001 1.00 58.12 C ATOM 2496 OE1 GLU A 891 25.623 2.385 25.380 1.00 51.93 O ATOM 2497 OE2 GLU A 891 23.626 1.487 25.614 1.00 56.66 O ATOM 2498 H GLU A 891 21.929 4.657 24.810 1.00 0.00 H ATOM 2499 N SER A 892 25.095 7.316 25.577 1.00 39.99 N ATOM 2500 CA SER A 892 25.467 8.721 25.508 1.00 39.57 C ATOM 2501 C SER A 892 25.767 9.154 24.074 1.00 44.23 C ATOM 2502 O SER A 892 25.292 10.198 23.669 1.00 42.49 O ATOM 2503 CB SER A 892 26.684 8.978 26.397 1.00 45.18 C ATOM 2504 OG SER A 892 26.275 8.945 27.752 1.00 52.15 O ATOM 2505 HG SER A 892 25.890 8.056 27.958 1.00 0.00 H ATOM 2506 H SER A 892 25.585 6.732 26.284 1.00 0.00 H ATOM 2507 N GLU A 893 26.543 8.354 23.301 1.00 42.22 N ATOM 2508 CA GLU A 893 26.914 8.704 21.915 1.00 42.96 C ATOM 2509 C GLU A 893 25.726 8.689 20.938 1.00 46.27 C ATOM 2510 O GLU A 893 25.864 9.238 19.841 1.00 45.61 O ATOM 2511 CB GLU A 893 28.071 7.821 21.343 1.00 46.61 C ATOM 2512 CG GLU A 893 28.818 6.952 22.337 1.00 61.39 C ATOM 2513 CD GLU A 893 28.011 5.797 22.890 1.00 69.78 C ATOM 2514 OE1 GLU A 893 27.563 4.932 22.101 1.00 74.40 O ATOM 2515 OE2 GLU A 893 27.801 5.783 24.123 1.00 58.85 O ATOM 2516 H GLU A 893 26.890 7.459 23.700 1.00 0.00 H ATOM 2517 N GLN A 894 24.574 8.066 21.321 1.00 41.15 N ATOM 2518 CA GLN A 894 23.367 8.031 20.470 1.00 40.99 C ATOM 2519 C GLN A 894 22.456 9.244 20.644 1.00 43.23 C ATOM 2520 O GLN A 894 21.535 9.442 19.853 1.00 44.76 O ATOM 2521 CB GLN A 894 22.582 6.727 20.653 1.00 43.19 C ATOM 2522 CG GLN A 894 23.306 5.509 20.040 1.00 53.08 C ATOM 2523 CD GLN A 894 22.703 4.155 20.380 1.00 85.95 C ATOM 2524 OE1 GLN A 894 21.504 4.009 20.661 1.00 79.45 O ATOM 2525 NE2 GLN A 894 23.531 3.113 20.309 1.00 85.88 N ATOM 2526 HE22 GLN A 894 24.533 3.260 20.072 1.00 0.00 H ATOM 2527 HE21 GLN A 894 23.175 2.153 20.491 1.00 0.00 H ATOM 2528 H GLN A 894 24.545 7.597 22.249 1.00 0.00 H ATOM 2529 N ARG A 895 22.699 10.049 21.674 1.00 35.34 N ATOM 2530 CA ARG A 895 21.919 11.255 21.944 1.00 33.11 C ATOM 2531 C ARG A 895 22.285 12.321 20.868 1.00 36.19 C ATOM 2532 O ARG A 895 23.459 12.456 20.571 1.00 35.09 O ATOM 2533 CB ARG A 895 22.168 11.760 23.377 1.00 31.45 C ATOM 2534 CG ARG A 895 21.752 10.760 24.452 1.00 33.71 C ATOM 2535 CD ARG A 895 22.021 11.212 25.908 1.00 28.37 C ATOM 2536 NE ARG A 895 22.097 9.986 26.724 1.00 30.65 N ATOM 2537 CZ ARG A 895 22.674 9.889 27.909 1.00 32.75 C ATOM 2538 NH1 ARG A 895 23.215 10.964 28.485 1.00 25.94 N ATOM 2539 NH2 ARG A 895 22.704 8.725 28.543 1.00 32.97 N ATOM 2540 HE ARG A 895 21.660 9.126 26.335 1.00 0.00 H ATOM 2541 HH12 ARG A 895 23.668 10.882 29.418 1.00 0.00 H ATOM 2542 HH11 ARG A 895 23.184 11.884 28.001 1.00 0.00 H ATOM 2543 HH22 ARG A 895 23.159 8.652 29.475 1.00 0.00 H ATOM 2544 HH21 ARG A 895 22.273 7.885 28.108 1.00 0.00 H ATOM 2545 H ARG A 895 23.480 9.809 22.317 1.00 0.00 H ATOM 2546 N PRO A 896 21.324 13.074 20.272 1.00 32.45 N ATOM 2547 CA PRO A 896 21.691 14.000 19.163 1.00 32.97 C ATOM 2548 C PRO A 896 22.580 15.122 19.675 1.00 37.81 C ATOM 2549 O PRO A 896 22.436 15.474 20.854 1.00 36.99 O ATOM 2550 CB PRO A 896 20.341 14.575 18.710 1.00 34.23 C ATOM 2551 CG PRO A 896 19.303 13.687 19.296 1.00 37.14 C ATOM 2552 CD PRO A 896 19.877 13.138 20.569 1.00 32.37 C ATOM 2553 N PRO A 897 23.498 15.708 18.853 1.00 33.90 N ATOM 2554 CA PRO A 897 24.224 16.898 19.332 1.00 32.00 C ATOM 2555 C PRO A 897 23.307 18.118 19.302 1.00 33.12 C ATOM 2556 O PRO A 897 22.248 18.114 18.634 1.00 32.43 O ATOM 2557 CB PRO A 897 25.409 17.016 18.360 1.00 35.43 C ATOM 2558 CG PRO A 897 24.926 16.363 17.089 1.00 41.06 C ATOM 2559 CD PRO A 897 23.912 15.326 17.474 1.00 37.10 C ATOM 2560 N PHE A 898 23.696 19.170 20.027 1.00 29.99 N ATOM 2561 CA PHE A 898 22.904 20.397 20.088 1.00 29.45 C ATOM 2562 C PHE A 898 22.685 21.029 18.706 1.00 33.71 C ATOM 2563 O PHE A 898 21.628 21.617 18.488 1.00 29.38 O ATOM 2564 CB PHE A 898 23.516 21.380 21.081 1.00 30.14 C ATOM 2565 CG PHE A 898 23.171 20.988 22.498 1.00 30.39 C ATOM 2566 CD1 PHE A 898 21.849 21.052 22.954 1.00 32.02 C ATOM 2567 CD2 PHE A 898 24.166 20.541 23.379 1.00 29.65 C ATOM 2568 CE1 PHE A 898 21.530 20.689 24.262 1.00 31.41 C ATOM 2569 CE2 PHE A 898 23.849 20.191 24.693 1.00 30.33 C ATOM 2570 CZ PHE A 898 22.532 20.259 25.127 1.00 28.85 C ATOM 2571 H PHE A 898 24.586 19.115 20.562 1.00 0.00 H ATOM 2572 N SER A 899 23.660 20.864 17.762 1.00 33.89 N ATOM 2573 CA SER A 899 23.501 21.379 16.380 1.00 33.97 C ATOM 2574 C SER A 899 22.278 20.726 15.683 1.00 37.20 C ATOM 2575 O SER A 899 21.518 21.425 15.016 1.00 37.38 O ATOM 2576 CB SER A 899 24.768 21.134 15.562 1.00 36.03 C ATOM 2577 OG SER A 899 25.117 19.757 15.595 1.00 42.95 O ATOM 2578 HG SER A 899 24.377 19.221 15.214 1.00 0.00 H ATOM 2579 H SER A 899 24.535 20.365 18.019 1.00 0.00 H ATOM 2580 N GLN A 900 22.095 19.391 15.851 1.00 32.03 N ATOM 2581 CA GLN A 900 20.954 18.656 15.286 1.00 32.90 C ATOM 2582 C GLN A 900 19.656 19.045 15.993 1.00 38.25 C ATOM 2583 O GLN A 900 18.637 19.275 15.327 1.00 39.03 O ATOM 2584 CB GLN A 900 21.176 17.142 15.392 1.00 34.32 C ATOM 2585 CG GLN A 900 21.450 16.450 14.092 1.00 53.55 C ATOM 2586 CD GLN A 900 22.089 15.092 14.315 1.00 68.95 C ATOM 2587 OE1 GLN A 900 21.511 14.179 14.934 1.00 53.67 O ATOM 2588 NE2 GLN A 900 23.309 14.943 13.821 1.00 67.39 N ATOM 2589 HE22 GLN A 900 23.762 15.727 13.309 1.00 0.00 H ATOM 2590 HE21 GLN A 900 23.814 14.042 13.945 1.00 0.00 H ATOM 2591 H GLN A 900 22.797 18.862 16.407 1.00 0.00 H ATOM 2592 N LEU A 901 19.675 19.120 17.346 1.00 32.55 N ATOM 2593 CA LEU A 901 18.463 19.500 18.096 1.00 30.84 C ATOM 2594 C LEU A 901 17.991 20.883 17.644 1.00 33.08 C ATOM 2595 O LEU A 901 16.795 21.099 17.469 1.00 32.34 O ATOM 2596 CB LEU A 901 18.761 19.517 19.616 1.00 29.28 C ATOM 2597 CG LEU A 901 19.086 18.136 20.183 1.00 31.66 C ATOM 2598 CD1 LEU A 901 19.731 18.256 21.572 1.00 30.63 C ATOM 2599 CD2 LEU A 901 17.829 17.309 20.270 1.00 33.68 C ATOM 2600 H LEU A 901 20.553 18.907 17.861 1.00 0.00 H ATOM 2601 N HIS A 902 18.935 21.809 17.459 1.00 28.83 N ATOM 2602 CA HIS A 902 18.645 23.174 16.979 1.00 29.24 C ATOM 2603 C HIS A 902 18.028 23.201 15.570 1.00 36.17 C ATOM 2604 O HIS A 902 16.984 23.825 15.342 1.00 33.15 O ATOM 2605 CB HIS A 902 19.880 24.092 17.041 1.00 29.52 C ATOM 2606 CG HIS A 902 19.511 25.465 16.595 1.00 32.29 C ATOM 2607 ND1 HIS A 902 19.686 25.862 15.281 1.00 35.82 N ATOM 2608 CD2 HIS A 902 18.912 26.469 17.280 1.00 33.06 C ATOM 2609 CE1 HIS A 902 19.221 27.099 15.214 1.00 34.82 C ATOM 2610 NE2 HIS A 902 18.747 27.505 16.397 1.00 33.75 N ATOM 2611 H HIS A 902 19.923 21.556 17.663 1.00 0.00 H ATOM 2612 N ARG A 903 18.676 22.536 14.621 1.00 35.94 N ATOM 2613 CA ARG A 903 18.075 22.380 13.310 1.00 36.73 C ATOM 2614 C ARG A 903 16.647 21.845 13.375 1.00 38.47 C ATOM 2615 O ARG A 903 15.787 22.386 12.674 1.00 39.08 O ATOM 2616 CB ARG A 903 18.940 21.478 12.417 1.00 34.93 C ATOM 2617 CG ARG A 903 18.468 21.363 10.938 1.00 37.92 C ATOM 2618 CD ARG A 903 19.483 20.647 10.045 1.00 47.34 C ATOM 2619 NE ARG A 903 20.873 20.822 10.522 1.00 71.84 N ATOM 2620 CZ ARG A 903 21.596 19.897 11.169 1.00 83.70 C ATOM 2621 NH1 ARG A 903 21.082 18.698 11.428 1.00 69.31 N ATOM 2622 NH2 ARG A 903 22.832 20.170 11.565 1.00 61.08 N ATOM 2623 HE ARG A 903 21.327 21.740 10.340 1.00 0.00 H ATOM 2624 HH12 ARG A 903 21.650 17.986 11.930 1.00 0.00 H ATOM 2625 HH11 ARG A 903 20.112 18.472 11.128 1.00 0.00 H ATOM 2626 HH22 ARG A 903 23.389 19.449 12.067 1.00 0.00 H ATOM 2627 HH21 ARG A 903 23.245 21.105 11.374 1.00 0.00 H ATOM 2628 H ARG A 903 19.612 22.128 14.817 1.00 0.00 H ATOM 2629 N PHE A 904 16.384 20.790 14.195 1.00 33.27 N ATOM 2630 CA PHE A 904 15.055 20.157 14.206 1.00 30.97 C ATOM 2631 C PHE A 904 14.005 21.144 14.676 1.00 34.17 C ATOM 2632 O PHE A 904 12.931 21.198 14.108 1.00 34.65 O ATOM 2633 CB PHE A 904 14.985 18.913 15.142 1.00 31.62 C ATOM 2634 CG PHE A 904 13.737 18.077 14.895 1.00 31.97 C ATOM 2635 CD1 PHE A 904 13.777 16.972 14.049 1.00 33.34 C ATOM 2636 CD2 PHE A 904 12.528 18.407 15.491 1.00 33.80 C ATOM 2637 CE1 PHE A 904 12.624 16.218 13.807 1.00 35.90 C ATOM 2638 CE2 PHE A 904 11.372 17.652 15.249 1.00 37.18 C ATOM 2639 CZ PHE A 904 11.426 16.569 14.411 1.00 36.20 C ATOM 2640 H PHE A 904 17.131 20.427 14.821 1.00 0.00 H ATOM 2641 N LEU A 905 14.322 21.913 15.721 1.00 28.57 N ATOM 2642 CA LEU A 905 13.354 22.764 16.415 1.00 28.85 C ATOM 2643 C LEU A 905 13.129 24.038 15.657 1.00 35.52 C ATOM 2644 O LEU A 905 12.057 24.608 15.770 1.00 35.21 O ATOM 2645 CB LEU A 905 13.883 23.097 17.816 1.00 27.31 C ATOM 2646 CG LEU A 905 13.818 21.953 18.840 1.00 31.66 C ATOM 2647 CD1 LEU A 905 14.670 22.282 20.019 1.00 30.94 C ATOM 2648 CD2 LEU A 905 12.405 21.766 19.349 1.00 29.94 C ATOM 2649 H LEU A 905 15.306 21.907 16.059 1.00 0.00 H ATOM 2650 N ALA A 906 14.143 24.493 14.903 1.00 33.31 N ATOM 2651 CA ALA A 906 14.027 25.669 14.042 1.00 36.53 C ATOM 2652 C ALA A 906 13.393 25.369 12.717 1.00 44.23 C ATOM 2653 O ALA A 906 12.741 26.244 12.161 1.00 48.22 O ATOM 2654 CB ALA A 906 15.380 26.333 13.832 1.00 38.27 C ATOM 2655 H ALA A 906 15.051 23.986 14.933 1.00 0.00 H ATOM 2656 N GLU A 907 13.549 24.155 12.202 1.00 39.98 N ATOM 2657 CA GLU A 907 13.132 23.888 10.841 1.00 39.59 C ATOM 2658 C GLU A 907 12.150 22.717 10.744 1.00 43.45 C ATOM 2659 O GLU A 907 11.002 22.949 10.389 1.00 42.81 O ATOM 2660 CB GLU A 907 14.352 23.749 9.902 1.00 41.75 C ATOM 2661 CG GLU A 907 15.206 25.023 9.805 1.00 47.00 C ATOM 2662 CD GLU A 907 14.549 26.351 9.409 1.00 64.42 C ATOM 2663 OE1 GLU A 907 13.718 26.357 8.473 1.00 41.59 O ATOM 2664 OE2 GLU A 907 14.929 27.403 9.978 1.00 51.21 O ATOM 2665 H GLU A 907 13.970 23.397 12.776 1.00 0.00 H ATOM 2666 N ASP A 908 12.570 21.478 11.060 1.00 40.45 N ATOM 2667 CA ASP A 908 11.771 20.261 10.858 1.00 39.34 C ATOM 2668 C ASP A 908 10.493 20.273 11.641 1.00 41.86 C ATOM 2669 O ASP A 908 9.498 19.695 11.203 1.00 40.06 O ATOM 2670 CB ASP A 908 12.549 19.012 11.254 1.00 40.68 C ATOM 2671 CG ASP A 908 13.771 18.818 10.415 1.00 46.21 C ATOM 2672 OD1 ASP A 908 14.725 19.618 10.564 1.00 44.59 O ATOM 2673 OD2 ASP A 908 13.774 17.885 9.595 1.00 54.90 O ATOM 2674 H ASP A 908 13.519 21.375 11.473 1.00 0.00 H ATOM 2675 N ALA A 909 10.519 20.936 12.810 1.00 36.04 N ATOM 2676 CA ALA A 909 9.398 20.932 13.729 1.00 34.77 C ATOM 2677 C ALA A 909 8.224 21.746 13.152 1.00 39.35 C ATOM 2678 O ALA A 909 7.099 21.597 13.596 1.00 38.16 O ATOM 2679 CB ALA A 909 9.847 21.476 15.080 1.00 33.42 C ATOM 2680 H ALA A 909 11.374 21.471 13.064 1.00 0.00 H ATOM 2681 N LEU A 910 8.493 22.594 12.155 1.00 37.61 N ATOM 2682 CA LEU A 910 7.475 23.428 11.524 1.00 39.40 C ATOM 2683 C LEU A 910 6.583 22.684 10.549 1.00 49.25 C ATOM 2684 O LEU A 910 5.493 23.192 10.208 1.00 51.09 O ATOM 2685 CB LEU A 910 8.131 24.630 10.787 1.00 39.11 C ATOM 2686 CG LEU A 910 8.923 25.605 11.631 1.00 42.37 C ATOM 2687 CD1 LEU A 910 9.588 26.647 10.759 1.00 41.84 C ATOM 2688 CD2 LEU A 910 8.048 26.241 12.738 1.00 47.86 C ATOM 2689 H LEU A 910 9.473 22.663 11.813 1.00 0.00 H ATOM 2690 N ASN A 911 7.035 21.495 10.079 1.00 45.54 N ATOM 2691 CA ASN A 911 6.365 20.760 9.005 1.00 59.86 C ATOM 2692 C ASN A 911 5.413 19.689 9.519 1.00 82.38 C ATOM 2693 O ASN A 911 4.725 19.912 10.501 1.00 51.66 O ATOM 2694 CB ASN A 911 7.370 20.188 7.982 1.00 61.03 C ATOM 2695 CG ASN A 911 8.112 18.924 8.356 1.00 77.09 C ATOM 2696 OD1 ASN A 911 7.728 18.171 9.257 1.00 80.22 O ATOM 2697 ND2 ASN A 911 9.199 18.652 7.644 1.00 57.40 N ATOM 2698 HD22 ASN A 911 9.503 19.301 6.890 1.00 0.00 H ATOM 2699 HD21 ASN A 911 9.747 17.790 7.840 1.00 0.00 H ATOM 2700 H ASN A 911 7.895 21.088 10.500 1.00 0.00 H TER 2701 ASN A 911 HETATM 2702 O HOH 1 31.804 9.086 40.260 1.00 50.18 O HETATM 2703 O HOH 2 5.905 19.842 15.030 1.00 45.41 O HETATM 2704 O HOH 3 12.914 26.248 6.043 1.00126.83 O HETATM 2705 O HOH 4 1.159 20.545 27.027 1.00 28.69 O HETATM 2706 O HOH 5 23.587 39.738 30.382 1.00 59.97 O HETATM 2707 O HOH 6 11.313 13.062 15.203 1.00 37.20 O HETATM 2708 O HOH 7 27.313 11.588 30.738 1.00 32.01 O HETATM 2709 O HOH 8 11.995 38.157 41.897 1.00 44.93 O HETATM 2710 O HOH 9 28.239 33.026 20.267 1.00 46.38 O HETATM 2711 O HOH 10 13.505 33.021 39.577 1.00 58.39 O HETATM 2712 O HOH 11 25.030 28.538 19.013 1.00 35.32 O HETATM 2713 O HOH 12 6.739 21.124 33.316 1.00 54.82 O HETATM 2714 O HOH 13 10.716 23.299 38.156 1.00 39.49 O HETATM 2715 O HOH 14 9.138 -0.568 35.530 1.00 55.08 O HETATM 2716 O HOH 15 11.816 1.995 36.093 1.00 46.98 O HETATM 2717 O HOH 16 36.789 41.635 48.149 1.00 68.21 O HETATM 2718 O HOH 17 20.759 8.236 48.220 1.00 49.23 O HETATM 2719 O HOH 18 26.205 52.129 44.005 1.00 49.92 O HETATM 2720 O HOH 19 25.465 11.546 54.997 1.00 55.03 O HETATM 2721 O HOH 20 17.514 28.036 10.098 1.00 69.83 O HETATM 2722 O HOH 21 -0.348 33.647 21.551 1.00 66.45 O HETATM 2723 O HOH 22 9.079 28.570 15.681 1.00 34.33 O HETATM 2724 O HOH 23 21.342 15.114 32.618 1.00 36.94 O HETATM 2725 O HOH 24 14.990 16.576 40.690 1.00 27.74 O HETATM 2726 O HOH 25 30.360 29.576 49.397 1.00 58.03 O HETATM 2727 O HOH 26 30.013 37.037 29.777 1.00 41.57 O HETATM 2728 O HOH 27 30.087 13.805 49.262 1.00 41.52 O HETATM 2729 O HOH 28 16.362 11.343 35.885 1.00 30.98 O HETATM 2730 O HOH 29 34.774 28.756 47.977 1.00 43.86 O HETATM 2731 O HOH 30 24.342 18.570 13.315 1.00 61.60 O HETATM 2732 O HOH 31 22.418 33.926 57.572 1.00 70.58 O HETATM 2733 O HOH 32 16.308 5.326 25.897 1.00 36.85 O HETATM 2734 O HOH 33 31.179 19.565 24.142 1.00 52.63 O HETATM 2735 O HOH 34 26.727 31.579 37.045 1.00 50.46 O HETATM 2736 O HOH 35 12.565 23.978 36.118 1.00 27.75 O HETATM 2737 O HOH 36 24.310 41.461 26.376 1.00 65.04 O HETATM 2738 O HOH 37 27.086 25.984 34.870 1.00 48.98 O HETATM 2739 O HOH 38 3.983 32.135 37.249 1.00 44.86 O HETATM 2740 O HOH 39 24.961 17.568 32.660 1.00 27.93 O HETATM 2741 O HOH 40 25.909 19.895 50.083 1.00 43.03 O HETATM 2742 O HOH 41 14.281 12.875 49.039 1.00 52.13 O HETATM 2743 O HOH 42 11.660 10.207 14.550 1.00 61.43 O HETATM 2744 O HOH 43 25.419 42.510 50.820 1.00 40.97 O HETATM 2745 O HOH 44 20.775 4.022 23.271 1.00 42.85 O HETATM 2746 O HOH 45 28.229 22.719 19.345 1.00 39.00 O HETATM 2747 O HOH 46 27.857 45.243 46.936 1.00 69.58 O HETATM 2748 O HOH 47 13.658 16.545 46.429 1.00 48.70 O HETATM 2749 O HOH 48 31.724 29.573 42.023 1.00 57.11 O HETATM 2750 O HOH 49 0.864 21.231 19.129 1.00 52.81 O HETATM 2751 O HOH 50 32.238 42.887 49.131 1.00 45.49 O HETATM 2752 O HOH 51 29.361 42.413 47.588 1.00 38.21 O HETATM 2753 O HOH 52 22.737 31.564 20.344 1.00 31.24 O HETATM 2754 O HOH 53 22.839 17.408 49.553 1.00 36.83 O HETATM 2755 O HOH 54 8.573 1.384 42.297 1.00 44.21 O HETATM 2756 O HOH 55 37.441 36.906 39.659 1.00 37.51 O HETATM 2757 O HOH 56 19.416 3.095 40.992 1.00 53.59 O HETATM 2758 O HOH 57 27.459 5.083 26.736 1.00 60.48 O HETATM 2759 O HOH 58 0.474 21.079 30.020 1.00 38.44 O HETATM 2760 O HOH 59 11.395 3.363 39.762 1.00 44.51 O HETATM 2761 O HOH 60 39.244 44.072 49.570 1.00 70.82 O HETATM 2762 O HOH 61 27.868 29.589 50.507 1.00 98.87 O HETATM 2763 O HOH 62 23.020 21.878 42.927 1.00 51.58 O HETATM 2764 O HOH 63 3.657 37.113 26.861 1.00 50.99 O HETATM 2765 O HOH 64 19.441 45.346 30.727 1.00 49.32 O HETATM 2766 O HOH 65 24.627 30.605 52.129 1.00 51.51 O HETATM 2767 O HOH 66 35.729 24.251 28.818 1.00 67.11 O HETATM 2768 O HOH 67 15.010 6.531 23.880 1.00 45.30 O HETATM 2769 O HOH 68 13.003 8.413 19.424 1.00 53.26 O HETATM 2770 O HOH 69 9.338 29.426 43.355 1.00 65.68 O HETATM 2771 O HOH 70 22.324 19.984 32.336 1.00 28.21 O HETATM 2772 O HOH 71 27.670 21.098 27.265 1.00 41.94 O HETATM 2773 O HOH 72 4.606 15.048 35.784 1.00 39.03 O HETATM 2774 O HOH 73 7.927 28.759 38.968 1.00 51.52 O HETATM 2775 O HOH 74 25.255 31.202 18.500 1.00 53.18 O HETATM 2776 O HOH 75 13.638 15.855 43.138 1.00 34.62 O HETATM 2777 O HOH 76 25.340 21.297 11.408 1.00 67.59 O HETATM 2778 O HOH 77 17.393 6.349 20.944 1.00 59.03 O HETATM 2779 O HOH 78 39.488 33.807 46.130 1.00 45.55 O HETATM 2780 O HOH 79 35.937 24.151 43.361 1.00 16.11 O HETATM 2781 O HOH 80 10.295 21.087 8.377 1.00116.79 O HETATM 2782 O HOH 81 15.644 20.788 8.216 1.00 49.06 O HETATM 2783 O HOH 82 31.611 18.815 34.215 1.00 45.45 O HETATM 2784 O HOH 83 23.851 33.049 39.351 1.00 42.40 O HETATM 2785 O HOH 84 28.889 32.630 53.449 1.00 64.16 O HETATM 2786 O HOH 85 31.441 15.925 36.719 1.00 64.29 O HETATM 2787 O HOH 86 9.456 -3.493 38.127 1.00 64.42 O HETATM 2788 O HOH 87 9.771 5.559 47.246 1.00 41.49 O HETATM 2789 O HOH 88 16.408 4.679 45.193 1.00 62.41 O HETATM 2790 O HOH 89 3.352 9.474 25.976 1.00 38.57 O HETATM 2791 O HOH 90 42.521 37.697 53.518 1.00105.41 O HETATM 2792 O HOH 91 18.213 3.753 24.584 1.00 45.40 O HETATM 2793 O HOH 92 14.561 42.206 29.459 1.00 47.85 O HETATM 2794 O HOH 93 1.955 14.119 43.919 1.00 34.37 O HETATM 2795 O HOH 94 18.987 20.192 35.768 1.00 26.25 O HETATM 2796 O HOH 95 28.247 24.646 46.937 1.00 72.62 O HETATM 2797 O HOH 96 15.495 -1.896 27.952 1.00 56.62 O HETATM 2798 O HOH 97 16.764 25.134 45.978 1.00 51.98 O HETATM 2799 O HOH 98 11.266 34.826 37.824 1.00 45.81 O HETATM 2800 O HOH 99 13.200 36.198 20.096 1.00 46.91 O HETATM 2801 O HOH 100 11.935 19.207 7.277 1.00 50.86 O HETATM 2802 O HOH 101 23.973 19.810 39.003 1.00 40.70 O HETATM 2803 O HOH 102 17.198 48.866 30.538 1.00 51.55 O HETATM 2804 O HOH 103 23.869 37.585 25.692 1.00 38.19 O HETATM 2805 O HOH 104 31.483 16.474 27.809 1.00 36.99 O HETATM 2806 O HOH 105 33.413 32.675 22.903 1.00 45.66 O HETATM 2807 O HOH 106 24.695 30.220 31.368 1.00 61.21 O HETATM 2808 O HOH 107 -0.856 18.623 20.339 1.00 60.51 O HETATM 2809 O HOH 108 -2.424 25.700 19.548 1.00 66.16 O HETATM 2810 O HOH 109 22.347 14.452 46.922 1.00 32.65 O HETATM 2811 O HOH 110 15.388 12.567 33.666 1.00 33.44 O HETATM 2812 O HOH 111 5.241 16.676 41.819 1.00 52.08 O HETATM 2813 O HOH 112 26.014 12.649 22.430 1.00 49.74 O HETATM 2814 O HOH 113 31.704 34.787 21.287 1.00 60.02 O HETATM 2815 O HOH 114 39.714 35.493 56.747 1.00 72.38 O HETATM 2816 O HOH 115 26.776 35.743 26.769 1.00 35.95 O HETATM 2817 O HOH 116 15.136 -2.099 32.641 1.00 62.73 O HETATM 2818 O HOH 117 21.087 18.378 35.672 1.00 32.92 O HETATM 2819 O HOH 118 12.170 10.576 30.274 1.00 30.61 O HETATM 2820 O HOH 119 35.417 31.705 25.836 1.00 64.41 O HETATM 2821 O HOH 120 28.196 41.348 52.445 1.00 57.35 O HETATM 2822 O HOH 121 7.024 13.138 44.319 1.00 53.52 O HETATM 2823 O HOH 122 22.781 42.980 51.219 1.00 53.09 O HETATM 2824 O HOH 123 11.969 9.244 48.304 1.00 44.95 O HETATM 2825 O HOH 124 32.483 42.019 30.915 1.00 60.16 O HETATM 2826 O HOH 125 34.725 23.388 19.129 1.00 71.07 O HETATM 2827 O HOH 126 26.569 12.002 19.268 1.00 56.69 O HETATM 2828 O HOH 127 6.620 38.770 33.239 1.00 52.15 O HETATM 2829 O HOH 128 8.852 38.220 26.604 1.00 45.69 O HETATM 2830 O HOH 129 -3.849 27.159 33.378 1.00 62.80 O HETATM 2831 O HOH 130 3.965 18.213 39.576 1.00 39.38 O HETATM 2832 O HOH 131 -0.254 30.862 16.016 1.00 60.38 O HETATM 2833 O HOH 132 26.421 18.853 21.046 1.00 32.80 O HETATM 2834 O HOH 133 8.395 22.415 35.016 1.00 44.27 O HETATM 2835 O HOH 134 8.725 35.269 36.018 1.00 54.82 O HETATM 2836 O HOH 135 37.075 26.108 25.646 1.00 57.14 O HETATM 2837 O HOH 136 20.964 13.143 54.843 1.00 41.69 O HETATM 2838 O HOH 137 15.499 8.701 36.357 1.00 36.49 O HETATM 2839 O HOH 138 22.083 -2.467 40.375 1.00 72.38 O HETATM 2840 O HOH 139 20.972 -6.860 32.796 1.00 88.29 O HETATM 2841 O HOH 140 11.227 0.397 28.816 1.00 58.59 O HETATM 2842 O HOH 141 26.563 56.736 44.425 1.00 90.83 O HETATM 2843 O HOH 142 -6.464 31.218 22.899 1.00 58.20 O HETATM 2844 O HOH 143 -0.557 27.331 18.653 1.00 44.09 O HETATM 2845 O HOH 144 15.911 16.057 49.369 1.00 41.33 O HETATM 2846 O HOH 145 28.634 14.651 46.137 1.00 48.55 O HETATM 2847 O HOH 146 21.193 0.221 24.425 1.00 71.53 O HETATM 2848 O HOH 147 25.926 6.129 28.726 1.00 65.09 O HETATM 2849 O HOH 148 27.877 57.965 29.359 1.00 82.80 O HETATM 2850 O HOH 149 2.833 25.249 37.500 1.00 52.41 O HETATM 2851 O HOH 150 7.161 6.545 25.671 1.00 47.29 O HETATM 2852 O HOH 151 1.061 13.493 16.881 1.00 41.12 O HETATM 2853 O HOH 152 8.710 17.235 44.295 1.00 75.85 O HETATM 2854 O HOH 153 10.326 12.451 47.077 1.00 41.79 O HETATM 2855 O HOH 154 4.212 14.308 14.368 1.00 40.89 O HETATM 2856 O HOH 155 25.417 18.913 53.506 1.00 67.36 O HETATM 2857 O HOH 156 16.221 45.596 30.529 1.00 66.69 O HETATM 2858 O HOH 157 16.196 13.809 50.764 1.00 68.80 O HETATM 2859 O HOH 158 17.593 35.150 20.505 1.00 65.99 O HETATM 2860 O HOH 159 -5.587 33.531 29.067 1.00 80.59 O HETATM 2861 O HOH 160 8.182 41.790 25.161 1.00 46.30 O HETATM 2862 O HOH 161 5.945 13.107 34.482 1.00 16.87 O HETATM 2863 O HOH 162 21.200 30.457 15.347 1.00 64.24 O HETATM 2864 O HOH 163 31.197 28.023 54.456 1.00 75.81 O HETATM 2865 O HOH 164 24.597 23.951 13.841 1.00 55.04 O HETATM 2866 O HOH 165 13.663 29.447 16.170 1.00 46.11 O HETATM 2867 O HOH 166 -0.706 13.398 25.434 1.00 60.20 O HETATM 2868 O HOH 167 25.917 21.280 45.988 1.00 50.79 O HETATM 2869 O HOH 168 29.041 5.783 42.198 1.00 75.27 O HETATM 2870 O HOH 169 5.241 39.547 29.492 1.00 63.57 O HETATM 2871 O HOH 170 31.396 38.970 28.623 1.00 50.71 O HETATM 2872 O HOH 171 1.139 31.015 37.285 1.00 60.96 O HETATM 2873 O HOH 172 37.712 34.898 29.734 1.00 51.47 O HETATM 2874 O HOH 173 25.161 24.273 37.572 1.00 68.06 O HETATM 2875 O HOH 174 29.732 14.055 25.794 1.00 39.72 O HETATM 2876 O HOH 175 1.221 13.979 29.554 1.00 47.90 O HETATM 2877 O HOH 176 4.361 12.526 44.331 1.00 42.76 O HETATM 2878 O HOH 177 -2.467 36.971 25.256 1.00 77.21 O HETATM 2879 O HOH 178 10.840 16.016 45.487 1.00 48.45 O HETATM 2880 O HOH 179 14.294 11.594 31.468 1.00 33.40 O HETATM 2881 O HOH 180 10.699 47.366 38.993 1.00 71.65 O HETATM 2882 O HOH 181 18.917 0.196 41.376 1.00 85.00 O HETATM 2883 O HOH 182 20.472 10.803 17.121 1.00 58.63 O HETATM 2884 O HOH 183 16.880 28.158 40.260 1.00 48.31 O HETATM 2885 O HOH 184 32.613 18.687 26.815 1.00 72.20 O HETATM 2886 O HOH 185 22.171 28.606 45.064 1.00 53.28 O HETATM 2887 O HOH 186 30.853 25.585 46.481 1.00 51.90 O HETATM 2888 O HOH 187 7.698 46.732 41.731 1.00 77.35 O HETATM 2889 O HOH 188 22.972 12.005 46.277 1.00 34.91 O HETATM 2890 O HOH 189 7.585 6.136 20.416 1.00 66.53 O HETATM 2891 O HOH 190 17.715 8.564 34.923 1.00 54.38 O HETATM 2892 O HOH 191 24.547 30.722 41.914 1.00 63.99 O HETATM 2893 O HOH 192 22.943 5.325 50.445 1.00 61.40 O HETATM 2894 O HOH 193 37.344 24.771 22.777 1.00 75.85 O HETATM 2895 O HOH 194 26.896 20.663 18.827 1.00 26.17 O HETATM 2896 O HOH 195 28.172 18.575 16.605 1.00 58.75 O HETATM 2897 O HOH 196 13.286 38.401 46.495 1.00 63.01 O HETATM 2898 O HOH 197 30.022 37.841 20.889 1.00 79.73 O HETATM 2899 O HOH 198 35.282 10.249 33.297 1.00 74.80 O HETATM 2900 O HOH 199 6.971 17.138 14.692 1.00 29.03 O HETATM 2901 O HOH 200 4.193 35.067 37.492 1.00 54.78 O HETATM 2902 O HOH 201 18.911 57.499 44.601 1.00 74.72 O HETATM 2903 O HOH 202 29.507 55.858 30.003 1.00 84.77 O HETATM 2904 O HOH 203 38.037 37.237 34.502 1.00 63.52 O HETATM 2905 O HOH 204 30.092 11.658 26.966 1.00 43.93 O HETATM 2906 O HOH 205 16.293 41.116 25.806 1.00 49.78 O HETATM 2907 O HOH 206 21.585 0.551 40.370 1.00 61.80 O HETATM 2908 O HOH 207 40.789 43.453 46.806 1.00 87.38 O HETATM 2909 O HOH 208 15.011 33.716 45.970 1.00 46.69 O HETATM 2910 O HOH 209 18.680 -5.122 40.723 1.00 75.94 O HETATM 2911 O HOH 210 9.705 22.703 43.455 1.00 54.32 O HETATM 2912 O HOH 211 13.343 38.768 19.134 1.00 65.23 O HETATM 2913 O HOH 212 8.724 44.066 23.833 1.00 71.27 O HETATM 2914 O HOH 213 17.876 26.804 42.357 1.00 66.49 O HETATM 2915 O HOH 214 22.471 17.348 33.603 1.00 30.14 O HETATM 2916 O HOH 215 12.030 19.387 48.763 1.00 66.48 O HETATM 2917 O HOH 216 31.427 26.921 51.447 1.00 54.78 O HETATM 2918 O HOH 217 -8.978 26.401 31.756 1.00 55.83 O HETATM 2919 O HOH 218 31.116 20.140 41.339 1.00 51.45 O HETATM 2920 O HOH 219 23.434 -4.610 33.001 1.00 73.15 O HETATM 2921 O HOH 220 21.105 26.004 42.464 1.00 80.75 O HETATM 2922 O HOH 221 28.611 15.500 56.165 1.00 65.82 O HETATM 2923 O HOH 222 27.731 27.990 18.513 1.00 35.02 O HETATM 2924 O HOH 223 21.635 36.822 54.883 1.00 42.75 O HETATM 2925 O HOH 224 17.667 34.752 41.859 1.00 67.43 O HETATM 2926 O HOH 225 -8.365 30.061 32.350 1.00 60.44 O HETATM 2927 O HOH 226 23.591 61.207 34.549 1.00 72.82 O HETATM 2928 O HOH 227 38.642 46.520 32.593 1.00 91.28 O HETATM 2929 O HOH 228 14.222 1.493 24.476 1.00 66.42 O HETATM 2930 O HOH 229 21.050 17.927 54.131 1.00 54.62 O HETATM 2931 O HOH 230 12.668 5.273 23.724 1.00 60.04 O HETATM 2932 O HOH 231 28.637 20.818 14.711 1.00 72.84 O HETATM 2933 O HOH 232 18.469 12.743 53.854 1.00 70.07 O HETATM 2934 O HOH 233 28.222 16.088 41.767 1.00 43.06 O HETATM 2935 O HOH 234 6.352 39.621 21.324 1.00 74.30 O HETATM 2936 O HOH 235 23.155 32.855 18.023 1.00 43.78 O HETATM 2937 O HOH 236 -3.022 22.872 33.449 1.00 54.90 O HETATM 2938 O HOH 237 23.107 11.013 16.432 1.00 80.54 O HETATM 2939 O HOH 238 19.146 25.810 11.452 1.00 52.43 O HETATM 2940 O HOH 239 2.689 17.832 7.922 1.00 55.00 O HETATM 2941 O HOH 240 6.268 42.503 28.985 1.00 68.77 O HETATM 2942 O HOH 241 22.259 19.123 51.511 1.00 44.66 O HETATM 2943 O HOH 242 16.495 -6.624 38.807 1.00 96.81 O HETATM 2944 O HOH 243 38.239 38.157 37.063 1.00 79.73 O HETATM 2945 O HOH 244 22.372 -0.586 21.200 1.00 79.84 O HETATM 2946 O HOH 245 16.441 26.231 49.349 1.00 73.71 O HETATM 2947 O HOH 246 3.494 21.301 40.033 1.00 54.62 O HETATM 2948 O HOH 247 14.739 36.678 47.995 1.00 52.44 O HETATM 2949 O HOH 248 30.410 29.273 39.703 1.00 66.16 O HETATM 2950 O HOH 249 38.443 24.340 28.703 1.00 55.14 O HETATM 2951 O HOH 250 26.957 27.180 14.365 1.00 56.10 O HETATM 2952 O HOH 251 9.761 13.833 12.808 1.00 68.52 O HETATM 2953 O HOH 252 5.731 36.267 34.117 1.00 78.71 O HETATM 2954 O HOH 253 24.630 57.609 26.871 1.00 68.91 O HETATM 2955 O HOH 254 6.037 38.553 26.919 1.00 45.85 O HETATM 2956 O HOH 255 34.225 38.643 53.306 1.00 65.41 O HETATM 2957 O HOH 256 20.333 24.378 44.524 1.00 78.98 O HETATM 2958 O HOH 257 14.166 10.340 49.823 1.00 51.69 O HETATM 2959 O HOH 258 27.413 37.419 20.220 1.00 65.84 O HETATM 2960 O HOH 259 6.303 39.875 24.622 1.00 71.90 O HETATM 2961 O HOH 260 2.540 6.589 17.696 1.00 62.83 O HETATM 2962 O HOH 261 24.738 19.306 56.656 1.00 88.24 O HETATM 2963 O HOH 262 27.184 23.199 13.916 1.00 72.82 O HETATM 2964 O HOH 263 28.407 26.408 16.550 1.00 54.94 O HETATM 2965 O HOH 264 17.228 30.001 12.640 1.00 67.91 O HETATM 2966 O HOH 265 27.563 44.664 49.556 1.00 47.57 O HETATM 2967 O HOH 266 2.854 16.902 43.745 1.00 62.75 O HETATM 2968 O HOH 267 4.279 37.060 31.918 1.00 58.97 O HETATM 2969 O HOH 268 27.814 35.196 18.671 1.00 50.51 O HETATM 2970 O HOH 269 2.166 14.721 36.956 1.00 62.80 O HETATM 2971 O HOH 270 5.125 30.292 39.387 1.00 63.01 O HETATM 2972 O HOH 271 13.366 9.937 52.504 1.00 66.48 O HETATM 2973 O HOH 272 1.211 20.740 16.480 1.00 50.98 O HETATM 2974 O HOH 273 27.909 1.269 32.084 1.00 59.47 O HETATM 2975 O HOH 274 28.061 -1.654 28.920 1.00 61.89 O HETATM 2976 O HOH 275 -0.454 19.038 31.493 1.00 44.07 O HETATM 2977 O HOH 276 -0.809 16.470 30.815 1.00 54.67 O HETATM 2978 O HOH 277 6.623 -4.348 40.061 1.00 69.54 O HETATM 2979 O HOH 278 28.315 23.734 16.318 1.00 53.18 O HETATM 2980 O HOH 279 15.068 13.894 53.678 1.00 63.03 O HETATM 2981 O HOH 280 7.985 47.226 45.833 1.00 87.68 O HETATM 2982 O HOH 281 -7.833 30.891 15.082 1.00 68.73 O HETATM 2983 O HOH 282 -0.263 17.324 15.936 1.00 59.88 O HETATM 2984 O HOH 283 3.064 39.705 23.784 1.00 82.99 O HETATM 2985 O HOH 284 32.644 16.742 18.571 1.00 86.51 O HETATM 2986 O HOH 285 28.266 29.407 13.230 1.00 72.64 O HETATM 2987 O HOH 286 31.732 18.300 16.559 1.00 64.31 O HETATM 2988 O HOH 287 23.336 59.388 24.507 1.00 74.18 O HETATM 2989 C1 UNN A 288 19.196 38.868 35.332 1.00 -0.01 C HETATM 2990 C2 UNN A 288 19.336 38.113 36.443 1.00 0.11 C HETATM 2991 C3 UNN A 288 20.526 37.482 37.047 1.00 0.23 C HETATM 2992 N2 UNN A 288 21.733 37.862 36.565 1.00 -0.24 N HETATM 2993 C4 UNN A 288 23.001 37.329 36.959 1.00 0.08 C HETATM 2994 C9 UNN A 288 23.916 38.130 37.646 1.00 -0.02 C HETATM 2995 C8 UNN A 288 25.154 37.586 37.991 1.00 -0.07 C HETATM 2996 C7 UNN A 288 25.453 36.264 37.695 1.00 -0.08 C HETATM 2997 C6 UNN A 288 24.533 35.468 37.040 1.00 -0.07 C HETATM 2998 C5 UNN A 288 23.310 36.002 36.683 1.00 0.05 C HETATM 2999 CL UNN A 288 22.170 35.002 35.843 1.00 -0.09 CL HETATM 3000 H22 UNN A 288 24.768 34.435 36.809 1.00 0.05 H HETATM 3001 H3 UNN A 288 26.415 35.853 37.980 1.00 0.05 H HETATM 3002 H4 UNN A 288 25.889 38.203 38.495 1.00 0.05 H HETATM 3003 C10 UNN A 288 23.604 39.566 37.989 1.00 -0.04 C HETATM 3004 H5 UNN A 288 24.456 40.008 38.526 1.00 0.04 H HETATM 3005 H6 UNN A 288 22.709 39.605 38.627 1.00 0.04 H HETATM 3006 H7 UNN A 288 23.420 40.132 37.064 1.00 0.04 H HETATM 3007 H21 UNN A 288 21.739 38.581 35.870 1.00 0.22 H HETATM 3008 O UNN A 288 20.415 36.653 37.945 1.00 -0.39 O HETATM 3009 S UNN A 288 17.831 37.869 37.223 1.00 0.04 S HETATM 3010 C UNN A 288 17.092 38.829 35.986 1.00 0.21 C HETATM 3011 N UNN A 288 15.761 39.100 35.967 1.00 -0.22 N HETATM 3012 C11 UNN A 288 14.780 38.712 36.871 1.00 0.13 C HETATM 3013 C12 UNN A 288 13.491 39.264 36.840 1.00 0.02 C HETATM 3014 C13 UNN A 288 12.589 38.781 37.802 1.00 0.11 C HETATM 3015 N3 UNN A 288 12.931 37.825 38.688 1.00 -0.27 N HETATM 3016 C14 UNN A 288 14.182 37.361 38.640 1.00 0.07 C HETATM 3017 C15 UNN A 288 14.581 36.313 39.625 1.00 -0.00 C HETATM 3018 H9 UNN A 288 13.727 36.078 40.277 1.00 0.05 H HETATM 3019 H10 UNN A 288 15.418 36.683 40.236 1.00 0.05 H HETATM 3020 H11 UNN A 288 14.893 35.405 39.088 1.00 0.05 H HETATM 3021 N4 UNN A 288 15.103 37.764 37.770 1.00 -0.27 N HETATM 3022 N5 UNN A 288 11.271 39.260 37.877 1.00 -0.28 N HETATM 3023 C16 UNN A 288 10.367 38.446 38.710 1.00 0.07 C HETATM 3024 C17 UNN A 288 8.933 38.944 38.699 1.00 -0.01 C HETATM 3025 N6 UNN A 288 8.483 39.130 37.322 1.00 0.24 N HETATM 3026 C20 UNN A 288 7.040 39.377 37.246 1.00 -0.01 C HETATM 3027 C21 UNN A 288 6.219 38.142 37.543 1.00 0.08 C HETATM 3028 O1 UNN A 288 4.850 38.488 37.692 1.00 -0.39 O HETATM 3029 H27 UNN A 288 4.345 37.705 37.878 1.00 0.21 H HETATM 3030 H18 UNN A 288 6.580 37.680 38.474 1.00 0.06 H HETATM 3031 H19 UNN A 288 6.325 37.427 36.714 1.00 0.06 H HETATM 3032 H16 UNN A 288 6.796 39.726 36.232 1.00 0.08 H HETATM 3033 H17 UNN A 288 6.778 40.157 37.975 1.00 0.08 H HETATM 3034 C18 UNN A 288 9.262 40.223 36.746 1.00 -0.01 C HETATM 3035 C19 UNN A 288 10.718 39.808 36.626 1.00 0.07 C HETATM 3036 H14 UNN A 288 10.799 39.041 35.842 1.00 0.06 H HETATM 3037 H15 UNN A 288 11.310 40.689 36.339 1.00 0.06 H HETATM 3038 H25 UNN A 288 9.187 41.107 37.396 1.00 0.08 H HETATM 3039 H26 UNN A 288 8.868 40.466 35.748 1.00 0.08 H HETATM 3040 H2 UNN A 288 8.678 38.288 36.803 1.00 0.20 H HETATM 3041 H23 UNN A 288 8.287 38.207 39.198 1.00 0.08 H HETATM 3042 H24 UNN A 288 8.876 39.903 39.234 1.00 0.08 H HETATM 3043 H12 UNN A 288 10.735 38.464 39.746 1.00 0.06 H HETATM 3044 H13 UNN A 288 10.381 37.412 38.334 1.00 0.06 H HETATM 3045 H8 UNN A 288 13.208 40.019 36.116 1.00 0.05 H HETATM 3046 H20 UNN A 288 15.435 39.671 35.174 1.00 0.23 H HETATM 3047 N1 UNN A 288 17.910 39.278 35.076 1.00 -0.30 N HETATM 3048 H1 UNN A 288 20.036 39.131 34.690 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 286 287 296 297 298 CONECT 296 286 CONECT 297 286 CONECT 298 286 CONECT 720 719 781 CONECT 781 720 780 CONECT 1009 1010 1015 1016 1017 CONECT 1016 1009 CONECT 1017 1009 CONECT 1491 1492 1499 1500 1501 CONECT 1499 1491 CONECT 1500 1491 CONECT 1501 1491 CONECT 2989 2990 3047 3048 CONECT 2990 2989 2991 3009 CONECT 2991 2990 2992 3008 CONECT 2992 2991 2993 3007 CONECT 2993 2992 2994 2998 CONECT 2994 2993 2995 3003 CONECT 2995 2994 2996 3002 CONECT 2996 2995 2997 3001 CONECT 2997 2996 2998 3000 CONECT 2998 2993 2997 2999 CONECT 2999 2998 CONECT 3000 2997 CONECT 3001 2996 CONECT 3002 2995 CONECT 3003 2994 3004 3005 3006 CONECT 3004 3003 CONECT 3005 3003 CONECT 3006 3003 CONECT 3007 2992 CONECT 3008 2991 CONECT 3009 2990 3010 CONECT 3010 3009 3011 3047 CONECT 3011 3010 3012 3046 CONECT 3012 3011 3013 3021 CONECT 3013 3012 3014 3045 CONECT 3014 3013 3015 3022 CONECT 3015 3014 3016 CONECT 3016 3015 3017 3021 CONECT 3017 3016 3018 3019 3020 CONECT 3018 3017 CONECT 3019 3017 CONECT 3020 3017 CONECT 3021 3012 3016 CONECT 3022 3014 3023 3035 CONECT 3023 3022 3024 3043 3044 CONECT 3024 3023 3025 3041 3042 CONECT 3025 3024 3026 3034 3040 CONECT 3026 3025 3027 3032 3033 CONECT 3027 3026 3028 3030 3031 CONECT 3028 3027 3029 CONECT 3029 3028 CONECT 3030 3027 CONECT 3031 3027 CONECT 3032 3026 CONECT 3033 3026 CONECT 3034 3025 3035 3038 3039 CONECT 3035 3022 3034 3036 3037 CONECT 3036 3035 CONECT 3037 3035 CONECT 3038 3034 CONECT 3039 3034 CONECT 3040 3025 CONECT 3041 3024 CONECT 3042 3024 CONECT 3043 3023 CONECT 3044 3023 CONECT 3045 3013 CONECT 3046 3011 CONECT 3047 2989 3010 CONECT 3048 2989 MASTER 0 0 0 0 0 0 0 0 3044 4 77 23 END
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Complexes with the same small molecule ligand
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Ligand Name
2y6o
RCSB PDB
PDBbind
1N1
2zva
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PDBbind
1N1
3g5d
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PDBbind
1N1
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PDBbind
1N1
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RCSB PDB
PDBbind
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Entry Information
PDB ID
5bvw
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Epithelial discoidin domain-containing receptor 1
Ligand Name
1N1
EC.Number
E.C.2.7.10.1
Resolution
1.94(Å)
Affinity (Kd/Ki/IC50)
IC50=0.0015uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Acs Med.Chem.Lett. Vol. 6: pp. 798-803
Ligand Properties
Formula
C
2
2
H
2
7
ClN
7
O
2
S
Molecular Weight
489.013
Exact Mass
488.164
No. of atoms
60
No. of bonds
63
Polar Surface Area
135.95
LOGP Value
3.59 (
Computed with XLOGP3
)
3.68 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 4
Canonical SMILES
OCC[NH+]1CCN(CC1)c1cc(nc(n1)C)Nc1ncc(s1)C(=O)Nc1c(C)cccc1Cl
InChI String
InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q08345
Entrez Gene ID
NCBI Entrez Gene ID:
780
ASD
Information of known allosteric effects of PDB entries
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