Browse entries in the PDBbind-CN Database
HEADER 5WIK_COMPLEX COMPND 5WIK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 274 VAL PHE HIS LYS ILE ARG ASN GLU ASP LEU ILE PHE ASN SEQRES 2 B 274 GLU SER LEU GLY GLN GLY THR PHE THR LYS ILE PHE LYS SEQRES 3 B 274 GLY VAL ARG ARG GLU VAL GLY ASP TYR GLY GLN LEU HIS SEQRES 4 B 274 GLU THR GLU VAL LEU LEU LYS VAL LEU ASP LYS ALA HIS SEQRES 5 B 274 ARG ASN TYR SER GLU SER PHE PHE GLU ALA ALA SER MET SEQRES 6 B 274 MET SER LYS LEU SER HIS LYS HIS LEU VAL LEU ASN TYR SEQRES 7 B 274 GLY VAL CYS VAL CYS GLY ASP GLU ASN ILE LEU VAL GLN SEQRES 8 B 274 GLU PHE VAL LYS PHE GLY SER LEU ASP THR TYR LEU LYS SEQRES 9 B 274 LYS ASN LYS ASN CYS ILE ASN ILE LEU TRP LYS LEU GLU SEQRES 10 B 274 VAL ALA LYS GLN LEU ALA ALA ALA MET HIS PHE LEU GLU SEQRES 11 B 274 GLU ASN THR LEU ILE HIS GLY ASN VAL CYS ALA LYS ASN SEQRES 12 B 274 ILE LEU LEU ILE ARG GLU GLU ASP ARG LYS THR GLY ASN SEQRES 13 B 274 PRO PRO PHE ILE LYS LEU SER ASP PRO GLY ILE SER ILE SEQRES 14 B 274 THR VAL LEU PRO LYS ASP ILE LEU GLN GLU ARG ILE PRO SEQRES 15 B 274 TRP VAL PRO PRO GLU CYS ILE GLU ASN PRO LYS ASN LEU SEQRES 16 B 274 ASN LEU ALA THR ASP LYS TRP SER PHE GLY THR THR LEU SEQRES 17 B 274 TRP GLU ILE CYS SER GLY GLY ASP LYS PRO LEU SER ALA SEQRES 18 B 274 LEU ASP SER GLN ARG LYS LEU GLN PHE TYR GLU ASP ARG SEQRES 19 B 274 HIS GLN LEU PRO ALA PRO LYS ALA ALA GLU LEU ALA ASN SEQRES 20 B 274 LEU ILE ASN ASN CYS MET ASP TYR GLU PRO ASP HIS ARG SEQRES 21 B 274 PRO SER PHE ARG ALA ILE ILE ARG ASP LEU ASN SER LEU SEQRES 22 B 274 PHE HET MOL A 296 51 ATOM 1 N VAL B 536 36.734 58.104 107.404 1.00 78.78 N ATOM 2 CA VAL B 536 35.579 58.858 106.936 1.00 75.88 C ATOM 3 C VAL B 536 35.848 59.427 105.544 1.00 76.49 C ATOM 4 O VAL B 536 35.539 58.787 104.538 1.00 82.74 O ATOM 5 CB VAL B 536 35.205 59.978 107.927 1.00 65.85 C ATOM 6 CG1 VAL B 536 33.898 60.643 107.517 1.00 70.82 C ATOM 7 CG2 VAL B 536 35.099 59.421 109.337 1.00 72.50 C ATOM 8 HN3 VAL B 536 37.562 58.732 107.447 1.00 0.00 H ATOM 9 HN2 VAL B 536 36.925 57.321 106.747 1.00 0.00 H ATOM 10 HN1 VAL B 536 36.537 57.723 108.351 1.00 0.00 H ATOM 11 N PHE B 537 36.435 60.622 105.485 1.00 63.88 N ATOM 12 CA PHE B 537 36.647 61.318 104.225 1.00 65.01 C ATOM 13 C PHE B 537 38.079 61.819 104.113 1.00 54.34 C ATOM 14 O PHE B 537 38.725 62.149 105.112 1.00 60.97 O ATOM 15 CB PHE B 537 35.689 62.506 104.066 1.00 66.16 C ATOM 16 CG PHE B 537 34.293 62.112 103.692 1.00 61.51 C ATOM 17 CD1 PHE B 537 34.041 61.472 102.491 1.00 54.13 C ATOM 18 CD2 PHE B 537 33.230 62.394 104.533 1.00 68.77 C ATOM 19 CE1 PHE B 537 32.757 61.110 102.141 1.00 52.29 C ATOM 20 CE2 PHE B 537 31.943 62.035 104.188 1.00 60.03 C ATOM 21 CZ PHE B 537 31.707 61.394 102.990 1.00 56.13 C ATOM 22 H PHE B 537 36.752 61.071 106.368 1.00 0.00 H ATOM 23 N HIS B 538 38.561 61.875 102.874 1.00 50.04 N ATOM 24 CA HIS B 538 39.847 62.484 102.571 1.00 47.11 C ATOM 25 C HIS B 538 39.725 64.002 102.608 1.00 49.93 C ATOM 26 O HIS B 538 38.748 64.573 102.115 1.00 49.37 O ATOM 27 CB HIS B 538 40.335 62.027 101.196 1.00 57.67 C ATOM 28 CG HIS B 538 41.573 62.725 100.727 1.00 71.83 C ATOM 29 ND1 HIS B 538 42.839 62.324 101.097 1.00 73.48 N ATOM 30 CD2 HIS B 538 41.740 63.793 99.912 1.00 57.16 C ATOM 31 CE1 HIS B 538 43.732 63.117 100.531 1.00 62.75 C ATOM 32 NE2 HIS B 538 43.091 64.017 99.808 1.00 63.42 N ATOM 33 H HIS B 538 38.000 61.470 102.097 1.00 0.00 H ATOM 34 N LYS B 539 40.723 64.655 103.194 1.00 55.11 N ATOM 35 CA LYS B 539 40.691 66.099 103.387 1.00 53.92 C ATOM 36 C LYS B 539 41.364 66.796 102.210 1.00 50.78 C ATOM 37 O LYS B 539 42.549 66.571 101.941 1.00 54.18 O ATOM 38 CB LYS B 539 41.370 66.482 104.702 1.00 54.14 C ATOM 39 CG LYS B 539 40.661 65.951 105.938 1.00 68.97 C ATOM 40 CD LYS B 539 41.331 66.441 107.211 1.00 78.51 C ATOM 41 CE LYS B 539 40.594 65.955 108.449 1.00 81.37 C ATOM 42 NZ LYS B 539 41.231 66.454 109.699 1.00 90.66 N ATOM 43 HZ1 LYS B 539 42.213 66.113 109.746 1.00 0.00 H ATOM 44 HZ2 LYS B 539 41.223 67.494 109.699 1.00 0.00 H ATOM 45 HZ3 LYS B 539 40.701 66.102 110.521 1.00 0.00 H ATOM 46 H LYS B 539 41.551 64.120 103.525 1.00 0.00 H ATOM 47 N ILE B 540 40.606 67.639 101.513 1.00 49.98 N ATOM 48 CA ILE B 540 41.119 68.471 100.430 1.00 54.99 C ATOM 49 C ILE B 540 41.184 69.901 100.949 1.00 60.39 C ATOM 50 O ILE B 540 40.168 70.456 101.386 1.00 66.46 O ATOM 51 CB ILE B 540 40.242 68.373 99.173 1.00 46.36 C ATOM 52 CG1 ILE B 540 40.107 66.914 98.732 1.00 49.05 C ATOM 53 CG2 ILE B 540 40.825 69.216 98.050 1.00 49.99 C ATOM 54 CD1 ILE B 540 39.257 66.726 97.497 1.00 49.32 C ATOM 55 H ILE B 540 39.596 67.708 101.753 1.00 0.00 H ATOM 56 N ARG B 541 42.372 70.497 100.904 1.00 56.85 N ATOM 57 CA ARG B 541 42.568 71.784 101.549 1.00 58.20 C ATOM 58 C ARG B 541 42.023 72.921 100.685 1.00 56.12 C ATOM 59 O ARG B 541 41.731 72.763 99.497 1.00 46.23 O ATOM 60 CB ARG B 541 44.046 72.009 101.870 1.00 65.70 C ATOM 61 CG ARG B 541 44.969 71.951 100.670 1.00 62.86 C ATOM 62 CD ARG B 541 46.411 71.706 101.092 1.00 64.04 C ATOM 63 NE ARG B 541 47.178 72.941 101.226 1.00 71.28 N ATOM 64 CZ ARG B 541 47.879 73.491 100.240 1.00 73.70 C ATOM 65 NH1 ARG B 541 47.906 72.916 99.046 1.00 69.61 N ATOM 66 NH2 ARG B 541 48.552 74.615 100.446 1.00 67.60 N ATOM 67 HE ARG B 541 47.176 73.420 102.149 1.00 0.00 H ATOM 68 HH12 ARG B 541 48.454 73.346 98.274 1.00 0.00 H ATOM 69 HH11 ARG B 541 47.379 72.035 98.881 1.00 0.00 H ATOM 70 HH22 ARG B 541 49.100 75.043 99.672 1.00 0.00 H ATOM 71 HH21 ARG B 541 48.532 75.069 101.382 1.00 0.00 H ATOM 72 H ARG B 541 43.163 70.041 100.406 1.00 0.00 H ATOM 73 N ASN B 542 41.902 74.088 101.322 1.00 75.21 N ATOM 74 CA ASN B 542 41.286 75.260 100.707 1.00 67.42 C ATOM 75 C ASN B 542 41.930 75.608 99.370 1.00 70.21 C ATOM 76 O ASN B 542 41.240 75.851 98.373 1.00 69.59 O ATOM 77 CB ASN B 542 41.402 76.444 101.669 1.00 65.86 C ATOM 78 CG ASN B 542 40.175 77.322 101.673 1.00 78.26 C ATOM 79 OD1 ASN B 542 39.352 77.273 100.759 1.00 83.87 O ATOM 80 ND2 ASN B 542 40.047 78.143 102.709 1.00 87.13 N ATOM 81 HD22 ASN B 542 40.768 78.150 103.459 1.00 0.00 H ATOM 82 HD21 ASN B 542 39.226 78.779 102.771 1.00 0.00 H ATOM 83 H ASN B 542 42.261 74.165 102.295 1.00 0.00 H ATOM 84 N GLU B 543 43.262 75.631 99.336 1.00 54.79 N ATOM 85 CA GLU B 543 43.991 76.219 98.220 1.00 60.51 C ATOM 86 C GLU B 543 43.950 75.357 96.967 1.00 56.24 C ATOM 87 O GLU B 543 44.221 75.865 95.873 1.00 43.75 O ATOM 88 CB GLU B 543 45.441 76.471 98.639 1.00 68.82 C ATOM 89 CG GLU B 543 45.588 77.236 99.955 1.00 77.81 C ATOM 90 CD GLU B 543 45.377 76.370 101.190 1.00 78.94 C ATOM 91 OE1 GLU B 543 44.924 75.215 101.046 1.00 79.88 O ATOM 92 OE2 GLU B 543 45.662 76.849 102.308 1.00 84.60 O ATOM 93 H GLU B 543 43.796 75.218 100.127 1.00 0.00 H ATOM 94 N ASP B 544 43.616 74.074 97.096 1.00 63.80 N ATOM 95 CA ASP B 544 43.561 73.187 95.943 1.00 53.66 C ATOM 96 C ASP B 544 42.247 73.275 95.181 1.00 49.60 C ATOM 97 O ASP B 544 42.117 72.629 94.137 1.00 58.06 O ATOM 98 CB ASP B 544 43.798 71.741 96.383 1.00 58.46 C ATOM 99 CG ASP B 544 45.242 71.476 96.756 1.00 68.29 C ATOM 100 OD1 ASP B 544 46.139 71.889 95.992 1.00 59.40 O ATOM 101 OD2 ASP B 544 45.482 70.858 97.814 1.00 75.12 O ATOM 102 H ASP B 544 43.390 73.699 98.039 1.00 0.00 H ATOM 103 N LEU B 545 41.282 74.054 95.661 1.00 44.80 N ATOM 104 CA LEU B 545 39.952 74.110 95.071 1.00 52.76 C ATOM 105 C LEU B 545 39.602 75.536 94.670 1.00 51.18 C ATOM 106 O LEU B 545 39.888 76.489 95.402 1.00 48.83 O ATOM 107 CB LEU B 545 38.899 73.573 96.044 1.00 44.99 C ATOM 108 CG LEU B 545 38.902 72.058 96.250 1.00 42.34 C ATOM 109 CD1 LEU B 545 38.000 71.674 97.406 1.00 41.10 C ATOM 110 CD2 LEU B 545 38.466 71.356 94.976 1.00 39.70 C ATOM 111 H LEU B 545 41.485 74.647 96.491 1.00 0.00 H ATOM 112 N ILE B 546 38.979 75.669 93.502 1.00 52.37 N ATOM 113 CA ILE B 546 38.479 76.940 92.995 1.00 38.74 C ATOM 114 C ILE B 546 36.989 76.784 92.726 1.00 48.60 C ATOM 115 O ILE B 546 36.578 75.867 92.006 1.00 43.74 O ATOM 116 CB ILE B 546 39.219 77.377 91.717 1.00 39.42 C ATOM 117 CG1 ILE B 546 40.719 77.515 91.985 1.00 50.22 C ATOM 118 CG2 ILE B 546 38.642 78.682 91.186 1.00 37.83 C ATOM 119 CD1 ILE B 546 41.061 78.541 93.042 1.00 56.72 C ATOM 120 H ILE B 546 38.841 74.819 92.919 1.00 0.00 H ATOM 121 N PHE B 547 36.186 77.671 93.306 1.00 47.57 N ATOM 122 CA PHE B 547 34.741 77.654 93.115 1.00 31.47 C ATOM 123 C PHE B 547 34.372 78.488 91.895 1.00 35.10 C ATOM 124 O PHE B 547 34.804 79.638 91.769 1.00 44.23 O ATOM 125 CB PHE B 547 34.025 78.190 94.355 1.00 28.67 C ATOM 126 CG PHE B 547 33.926 77.198 95.478 1.00 35.50 C ATOM 127 CD1 PHE B 547 35.048 76.837 96.205 1.00 37.65 C ATOM 128 CD2 PHE B 547 32.706 76.635 95.814 1.00 36.03 C ATOM 129 CE1 PHE B 547 34.957 75.925 97.241 1.00 43.43 C ATOM 130 CE2 PHE B 547 32.608 75.724 96.849 1.00 37.71 C ATOM 131 CZ PHE B 547 33.734 75.369 97.563 1.00 44.70 C ATOM 132 H PHE B 547 36.603 78.402 93.917 1.00 0.00 H ATOM 133 N ASN B 548 33.570 77.909 91.002 1.00 37.27 N ATOM 134 CA ASN B 548 33.142 78.630 89.809 1.00 43.82 C ATOM 135 C ASN B 548 31.624 78.740 89.729 1.00 35.15 C ATOM 136 O ASN B 548 30.971 79.146 90.696 1.00 36.88 O ATOM 137 CB ASN B 548 33.686 77.957 88.547 1.00 40.69 C ATOM 138 CG ASN B 548 35.196 78.027 88.454 1.00 51.87 C ATOM 139 OD1 ASN B 548 35.819 78.949 88.979 1.00 55.60 O ATOM 140 ND2 ASN B 548 35.793 77.051 87.780 1.00 44.41 N ATOM 141 HD22 ASN B 548 35.225 76.291 87.353 1.00 0.00 H ATOM 142 HD21 ASN B 548 36.828 77.046 87.679 1.00 0.00 H ATOM 143 H ASN B 548 33.246 76.933 91.158 1.00 0.00 H ATOM 144 N GLU B 549 31.076 78.424 88.596 1.00 31.03 N ATOM 145 CA GLU B 549 29.668 78.568 88.362 1.00 41.99 C ATOM 146 C GLU B 549 28.683 77.799 89.191 1.00 36.72 C ATOM 147 O GLU B 549 28.874 76.691 89.523 1.00 39.46 O ATOM 148 CB GLU B 549 29.398 78.320 86.911 1.00 39.30 C ATOM 149 CG GLU B 549 29.992 77.035 86.462 1.00 50.48 C ATOM 150 CD GLU B 549 30.694 77.066 85.136 1.00 66.54 C ATOM 151 OE1 GLU B 549 30.055 76.738 84.143 1.00 69.44 O ATOM 152 OE2 GLU B 549 31.890 77.325 85.085 1.00 53.14 O ATOM 153 H GLU B 549 31.677 78.054 87.832 1.00 0.00 H ATOM 154 N SER B 550 27.607 78.443 89.543 1.00 41.27 N ATOM 155 CA SER B 550 26.553 77.732 90.252 1.00 42.72 C ATOM 156 C SER B 550 25.754 76.889 89.267 1.00 34.51 C ATOM 157 O SER B 550 25.286 77.394 88.241 1.00 33.89 O ATOM 158 CB SER B 550 25.634 78.714 90.977 1.00 33.03 C ATOM 159 OG SER B 550 24.573 78.033 91.626 1.00 43.47 O ATOM 160 HG SER B 550 23.994 78.690 92.087 1.00 0.00 H ATOM 161 H SER B 550 27.502 79.453 89.320 1.00 0.00 H ATOM 162 N LEU B 551 25.605 75.602 89.577 1.00 36.56 N ATOM 163 CA LEU B 551 24.892 74.678 88.707 1.00 32.53 C ATOM 164 C LEU B 551 23.445 74.457 89.121 1.00 42.94 C ATOM 165 O LEU B 551 22.634 74.042 88.286 1.00 39.36 O ATOM 166 CB LEU B 551 25.615 73.327 88.669 1.00 38.75 C ATOM 167 CG LEU B 551 27.051 73.367 88.148 1.00 39.03 C ATOM 168 CD1 LEU B 551 27.729 72.024 88.347 1.00 37.82 C ATOM 169 CD2 LEU B 551 27.076 73.773 86.682 1.00 38.46 C ATOM 170 H LEU B 551 26.010 75.247 90.467 1.00 0.00 H ATOM 171 N GLY B 552 23.107 74.723 90.373 1.00 33.27 N ATOM 172 CA GLY B 552 21.751 74.519 90.851 1.00 28.19 C ATOM 173 C GLY B 552 21.743 74.368 92.362 1.00 38.19 C ATOM 174 O GLY B 552 22.608 74.903 93.056 1.00 35.44 O ATOM 175 H GLY B 552 23.828 75.086 91.028 1.00 0.00 H ATOM 176 N GLN B 553 20.750 73.627 92.847 1.00 47.30 N ATOM 177 CA GLN B 553 20.552 73.449 94.276 1.00 44.12 C ATOM 178 C GLN B 553 20.141 72.016 94.571 1.00 45.65 C ATOM 179 O GLN B 553 19.489 71.356 93.757 1.00 44.67 O ATOM 180 CB GLN B 553 19.473 74.392 94.826 1.00 52.07 C ATOM 181 CG GLN B 553 19.713 75.867 94.575 1.00 48.01 C ATOM 182 CD GLN B 553 18.420 76.651 94.549 1.00 56.69 C ATOM 183 OE1 GLN B 553 17.523 76.355 93.762 1.00 62.41 O ATOM 184 NE2 GLN B 553 18.310 77.646 95.420 1.00 74.95 N ATOM 185 HE22 GLN B 553 19.096 77.860 96.067 1.00 0.00 H ATOM 186 HE21 GLN B 553 17.438 78.212 95.456 1.00 0.00 H ATOM 187 H GLN B 553 20.097 73.162 92.185 1.00 0.00 H ATOM 188 N GLY B 554 20.537 71.543 95.751 1.00 41.04 N ATOM 189 CA GLY B 554 19.949 70.379 96.362 1.00 35.96 C ATOM 190 C GLY B 554 19.068 70.763 97.534 1.00 41.66 C ATOM 191 O GLY B 554 18.705 71.927 97.724 1.00 51.15 O ATOM 192 H GLY B 554 21.304 72.035 96.253 1.00 0.00 H ATOM 193 N THR B 555 18.726 69.760 98.334 1.00 40.47 N ATOM 194 CA THR B 555 17.981 70.018 99.560 1.00 43.97 C ATOM 195 C THR B 555 18.904 70.706 100.557 1.00 47.85 C ATOM 196 O THR B 555 19.838 70.088 101.077 1.00 50.82 O ATOM 197 CB THR B 555 17.420 68.721 100.134 1.00 46.89 C ATOM 198 OG1 THR B 555 16.496 68.147 99.202 1.00 47.94 O ATOM 199 CG2 THR B 555 16.700 68.992 101.448 1.00 46.37 C ATOM 200 HG1 THR B 555 16.132 67.305 99.575 1.00 0.00 H ATOM 201 H THR B 555 18.991 68.786 98.085 1.00 0.00 H ATOM 202 N PHE B 556 18.660 71.997 100.800 1.00 45.68 N ATOM 203 CA PHE B 556 19.435 72.796 101.751 1.00 45.56 C ATOM 204 C PHE B 556 20.902 72.913 101.347 1.00 51.07 C ATOM 205 O PHE B 556 21.773 73.103 102.198 1.00 50.65 O ATOM 206 CB PHE B 556 19.331 72.233 103.173 1.00 42.31 C ATOM 207 CG PHE B 556 17.926 72.145 103.694 1.00 51.93 C ATOM 208 CD1 PHE B 556 16.962 73.052 103.290 1.00 44.21 C ATOM 209 CD2 PHE B 556 17.571 71.151 104.592 1.00 51.72 C ATOM 210 CE1 PHE B 556 15.670 72.970 103.770 1.00 54.99 C ATOM 211 CE2 PHE B 556 16.280 71.064 105.074 1.00 55.21 C ATOM 212 CZ PHE B 556 15.328 71.974 104.664 1.00 59.71 C ATOM 213 H PHE B 556 17.881 72.457 100.288 1.00 0.00 H ATOM 214 N THR B 557 21.203 72.794 100.055 1.00 50.45 N ATOM 215 CA THR B 557 22.580 72.883 99.590 1.00 46.22 C ATOM 216 C THR B 557 22.653 73.742 98.336 1.00 41.35 C ATOM 217 O THR B 557 21.672 73.906 97.606 1.00 47.80 O ATOM 218 CB THR B 557 23.193 71.503 99.288 1.00 38.92 C ATOM 219 OG1 THR B 557 22.535 70.918 98.157 1.00 41.35 O ATOM 220 CG2 THR B 557 23.063 70.572 100.483 1.00 39.30 C ATOM 221 HG1 THR B 557 22.933 70.031 97.967 1.00 0.00 H ATOM 222 H THR B 557 20.441 72.635 99.366 1.00 0.00 H ATOM 223 N LYS B 558 23.840 74.293 98.103 1.00 37.33 N ATOM 224 CA LYS B 558 24.181 74.974 96.864 1.00 37.82 C ATOM 225 C LYS B 558 25.254 74.165 96.148 1.00 32.66 C ATOM 226 O LYS B 558 26.154 73.612 96.788 1.00 32.68 O ATOM 227 CB LYS B 558 24.675 76.400 97.130 1.00 33.59 C ATOM 228 CG LYS B 558 23.688 77.267 97.900 1.00 40.23 C ATOM 229 CD LYS B 558 22.410 77.494 97.107 1.00 49.77 C ATOM 230 CE LYS B 558 21.397 78.305 97.901 1.00 66.38 C ATOM 231 NZ LYS B 558 20.888 77.564 99.089 1.00 64.72 N ATOM 232 HZ1 LYS B 558 20.426 76.686 98.777 1.00 0.00 H ATOM 233 HZ2 LYS B 558 21.683 77.334 99.719 1.00 0.00 H ATOM 234 HZ3 LYS B 558 20.201 78.157 99.598 1.00 0.00 H ATOM 235 H LYS B 558 24.564 74.234 98.847 1.00 0.00 H ATOM 236 N ILE B 559 25.154 74.089 94.824 1.00 35.84 N ATOM 237 CA ILE B 559 25.983 73.200 94.018 1.00 34.68 C ATOM 238 C ILE B 559 26.698 74.021 92.954 1.00 36.55 C ATOM 239 O ILE B 559 26.068 74.816 92.246 1.00 37.23 O ATOM 240 CB ILE B 559 25.141 72.077 93.386 1.00 35.11 C ATOM 241 CG1 ILE B 559 24.593 71.160 94.483 1.00 27.31 C ATOM 242 CG2 ILE B 559 25.959 71.288 92.381 1.00 27.19 C ATOM 243 CD1 ILE B 559 23.624 70.115 93.991 1.00 41.49 C ATOM 244 H ILE B 559 24.454 74.689 94.343 1.00 0.00 H ATOM 245 N PHE B 560 28.013 73.820 92.840 1.00 34.60 N ATOM 246 CA PHE B 560 28.860 74.589 91.941 1.00 32.00 C ATOM 247 C PHE B 560 29.750 73.661 91.127 1.00 35.58 C ATOM 248 O PHE B 560 30.060 72.543 91.546 1.00 32.34 O ATOM 249 CB PHE B 560 29.759 75.572 92.706 1.00 31.78 C ATOM 250 CG PHE B 560 29.011 76.542 93.570 1.00 37.03 C ATOM 251 CD1 PHE B 560 28.587 76.179 94.838 1.00 33.43 C ATOM 252 CD2 PHE B 560 28.750 77.826 93.122 1.00 31.62 C ATOM 253 CE1 PHE B 560 27.905 77.073 95.637 1.00 31.04 C ATOM 254 CE2 PHE B 560 28.070 78.725 93.917 1.00 33.54 C ATOM 255 CZ PHE B 560 27.646 78.348 95.177 1.00 38.02 C ATOM 256 H PHE B 560 28.453 73.078 93.422 1.00 0.00 H ATOM 257 N LYS B 561 30.165 74.145 89.959 1.00 37.47 N ATOM 258 CA LYS B 561 31.253 73.533 89.209 1.00 40.32 C ATOM 259 C LYS B 561 32.567 74.117 89.709 1.00 37.26 C ATOM 260 O LYS B 561 32.684 75.333 89.879 1.00 46.95 O ATOM 261 CB LYS B 561 31.094 73.776 87.708 1.00 37.40 C ATOM 262 CG LYS B 561 32.265 73.274 86.873 1.00 41.69 C ATOM 263 CD LYS B 561 31.983 73.380 85.382 1.00 46.12 C ATOM 264 CE LYS B 561 33.102 72.746 84.568 1.00 44.66 C ATOM 265 NZ LYS B 561 32.776 72.680 83.115 1.00 49.77 N ATOM 266 HZ1 LYS B 561 31.916 72.111 82.979 1.00 0.00 H ATOM 267 HZ2 LYS B 561 32.618 73.642 82.752 1.00 0.00 H ATOM 268 HZ3 LYS B 561 33.568 72.241 82.603 1.00 0.00 H ATOM 269 H LYS B 561 29.697 74.988 89.569 1.00 0.00 H ATOM 270 N GLY B 562 33.552 73.249 89.958 1.00 35.63 N ATOM 271 CA GLY B 562 34.805 73.672 90.539 1.00 32.02 C ATOM 272 C GLY B 562 35.998 73.074 89.813 1.00 39.38 C ATOM 273 O GLY B 562 35.859 72.220 88.934 1.00 40.03 O ATOM 274 H GLY B 562 33.413 72.244 89.728 1.00 0.00 H ATOM 275 N VAL B 563 37.179 73.549 90.203 1.00 34.55 N ATOM 276 CA VAL B 563 38.449 73.084 89.657 1.00 44.35 C ATOM 277 C VAL B 563 39.358 72.701 90.815 1.00 36.29 C ATOM 278 O VAL B 563 39.483 73.455 91.787 1.00 42.10 O ATOM 279 CB VAL B 563 39.120 74.150 88.769 1.00 41.19 C ATOM 280 CG1 VAL B 563 40.562 73.763 88.468 1.00 47.41 C ATOM 281 CG2 VAL B 563 38.338 74.331 87.480 1.00 36.15 C ATOM 282 H VAL B 563 37.197 74.289 90.934 1.00 0.00 H ATOM 283 N ARG B 564 39.991 71.535 90.712 1.00 35.38 N ATOM 284 CA ARG B 564 40.873 71.017 91.750 1.00 45.23 C ATOM 285 C ARG B 564 42.270 70.806 91.182 1.00 39.16 C ATOM 286 O ARG B 564 42.427 70.184 90.127 1.00 50.02 O ATOM 287 CB ARG B 564 40.342 69.698 92.320 1.00 45.28 C ATOM 288 CG ARG B 564 41.216 69.083 93.412 1.00 49.10 C ATOM 289 CD ARG B 564 40.903 67.600 93.575 1.00 50.81 C ATOM 290 NE ARG B 564 41.586 67.007 94.721 1.00 55.39 N ATOM 291 CZ ARG B 564 41.562 65.712 95.020 1.00 59.20 C ATOM 292 NH1 ARG B 564 40.891 64.862 94.255 1.00 48.05 N ATOM 293 NH2 ARG B 564 42.212 65.266 96.087 1.00 57.02 N ATOM 294 HE ARG B 564 42.127 67.639 95.345 1.00 0.00 H ATOM 295 HH12 ARG B 564 40.875 63.850 94.493 1.00 0.00 H ATOM 296 HH11 ARG B 564 40.381 65.208 93.417 1.00 0.00 H ATOM 297 HH22 ARG B 564 42.194 64.253 96.321 1.00 0.00 H ATOM 298 HH21 ARG B 564 42.740 65.929 96.689 1.00 0.00 H ATOM 299 H ARG B 564 39.850 70.968 89.852 1.00 0.00 H ATOM 300 N ARG B 565 43.276 71.330 91.877 1.00 41.67 N ATOM 301 CA ARG B 565 44.674 71.033 91.594 1.00 44.68 C ATOM 302 C ARG B 565 45.069 69.840 92.449 1.00 39.73 C ATOM 303 O ARG B 565 44.851 69.856 93.663 1.00 39.85 O ATOM 304 CB ARG B 565 45.581 72.226 91.918 1.00 49.06 C ATOM 305 CG ARG B 565 45.131 73.585 91.384 1.00 68.29 C ATOM 306 CD ARG B 565 46.350 74.393 90.946 1.00 81.84 C ATOM 307 NE ARG B 565 46.034 75.489 90.031 1.00 90.51 N ATOM 308 CZ ARG B 565 46.698 76.640 89.981 1.00 81.22 C ATOM 309 NH1 ARG B 565 46.343 77.570 89.106 1.00 72.09 N ATOM 310 NH2 ARG B 565 47.703 76.872 90.815 1.00 77.24 N ATOM 311 HE ARG B 565 45.237 75.360 89.376 1.00 0.00 H ATOM 312 HH12 ARG B 565 46.861 78.471 89.066 1.00 0.00 H ATOM 313 HH11 ARG B 565 45.546 77.399 88.460 1.00 0.00 H ATOM 314 HH22 ARG B 565 48.218 77.774 90.770 1.00 0.00 H ATOM 315 HH21 ARG B 565 47.976 76.151 91.514 1.00 0.00 H ATOM 316 H ARG B 565 43.055 71.981 92.657 1.00 0.00 H ATOM 317 N GLU B 566 45.652 68.815 91.828 1.00 36.92 N ATOM 318 CA GLU B 566 45.986 67.602 92.564 1.00 40.66 C ATOM 319 C GLU B 566 47.208 66.931 91.957 1.00 45.32 C ATOM 320 O GLU B 566 47.593 67.204 90.817 1.00 47.69 O ATOM 321 CB GLU B 566 44.819 66.610 92.574 1.00 49.54 C ATOM 322 CG GLU B 566 44.399 66.170 91.185 1.00 45.30 C ATOM 323 CD GLU B 566 43.249 65.190 91.198 1.00 62.60 C ATOM 324 OE1 GLU B 566 42.966 64.620 92.271 1.00 69.51 O ATOM 325 OE2 GLU B 566 42.630 64.993 90.132 1.00 58.66 O ATOM 326 H GLU B 566 45.870 68.881 90.813 1.00 0.00 H ATOM 327 N VAL B 567 47.810 66.039 92.738 1.00 44.35 N ATOM 328 CA VAL B 567 48.845 65.140 92.241 1.00 40.81 C ATOM 329 C VAL B 567 48.170 63.826 91.871 1.00 38.60 C ATOM 330 O VAL B 567 47.599 63.149 92.732 1.00 45.63 O ATOM 331 CB VAL B 567 49.951 64.923 93.285 1.00 50.64 C ATOM 332 CG1 VAL B 567 51.147 64.221 92.655 1.00 39.50 C ATOM 333 CG2 VAL B 567 50.369 66.248 93.904 1.00 43.94 C ATOM 334 H VAL B 567 47.533 65.980 93.739 1.00 0.00 H ATOM 335 N GLY B 568 48.212 63.479 90.593 1.00 41.68 N ATOM 336 CA GLY B 568 47.568 62.290 90.079 1.00 33.74 C ATOM 337 C GLY B 568 48.517 61.116 89.970 1.00 54.75 C ATOM 338 O GLY B 568 49.479 60.987 90.738 1.00 47.08 O ATOM 339 H GLY B 568 48.731 64.089 89.930 1.00 0.00 H ATOM 340 N ASP B 569 48.241 60.242 89.007 1.00 51.22 N ATOM 341 CA ASP B 569 49.104 59.094 88.772 1.00 41.25 C ATOM 342 C ASP B 569 50.457 59.549 88.242 1.00 42.49 C ATOM 343 O ASP B 569 50.549 60.509 87.472 1.00 49.23 O ATOM 344 CB ASP B 569 48.451 58.125 87.787 1.00 49.79 C ATOM 345 CG ASP B 569 47.214 57.461 88.356 1.00 54.14 C ATOM 346 OD1 ASP B 569 47.062 57.451 89.596 1.00 62.14 O ATOM 347 OD2 ASP B 569 46.398 56.944 87.565 1.00 48.74 O ATOM 348 H ASP B 569 47.398 60.380 88.414 1.00 0.00 H ATOM 349 N TYR B 570 51.510 58.852 88.673 1.00 41.98 N ATOM 350 CA TYR B 570 52.887 59.129 88.260 1.00 41.81 C ATOM 351 C TYR B 570 53.357 60.508 88.715 1.00 52.22 C ATOM 352 O TYR B 570 54.232 61.113 88.091 1.00 55.05 O ATOM 353 CB TYR B 570 53.058 58.988 86.744 1.00 44.01 C ATOM 354 CG TYR B 570 52.425 57.744 86.165 1.00 49.33 C ATOM 355 CD1 TYR B 570 52.955 56.488 86.425 1.00 55.45 C ATOM 356 CD2 TYR B 570 51.304 57.828 85.351 1.00 51.82 C ATOM 357 CE1 TYR B 570 52.381 55.348 85.895 1.00 65.58 C ATOM 358 CE2 TYR B 570 50.723 56.695 84.816 1.00 47.85 C ATOM 359 CZ TYR B 570 51.267 55.458 85.090 1.00 68.15 C ATOM 360 OH TYR B 570 50.692 54.325 84.561 1.00 69.43 O ATOM 361 HH TYR B 570 51.203 53.529 84.854 1.00 0.00 H ATOM 362 H TYR B 570 51.344 58.070 89.338 1.00 0.00 H ATOM 363 N GLY B 571 52.789 61.016 89.808 1.00 47.14 N ATOM 364 CA GLY B 571 53.161 62.327 90.303 1.00 41.11 C ATOM 365 C GLY B 571 52.753 63.486 89.423 1.00 48.85 C ATOM 366 O GLY B 571 53.141 64.624 89.704 1.00 36.60 O ATOM 367 H GLY B 571 52.068 60.464 90.314 1.00 0.00 H ATOM 368 N GLN B 572 51.982 63.232 88.369 1.00 46.21 N ATOM 369 CA GLN B 572 51.560 64.289 87.460 1.00 48.06 C ATOM 370 C GLN B 572 50.625 65.265 88.165 1.00 47.76 C ATOM 371 O GLN B 572 49.809 64.873 89.003 1.00 48.13 O ATOM 372 CB GLN B 572 50.868 63.677 86.241 1.00 49.33 C ATOM 373 CG GLN B 572 50.317 64.680 85.236 1.00 55.98 C ATOM 374 CD GLN B 572 51.400 65.338 84.403 1.00 73.18 C ATOM 375 OE1 GLN B 572 52.116 66.222 84.875 1.00 75.06 O ATOM 376 NE2 GLN B 572 51.524 64.909 83.152 1.00 66.65 N ATOM 377 HE22 GLN B 572 50.897 64.160 82.795 1.00 0.00 H ATOM 378 HE21 GLN B 572 52.248 65.322 82.530 1.00 0.00 H ATOM 379 H GLN B 572 51.673 62.255 88.190 1.00 0.00 H ATOM 380 N LEU B 573 50.756 66.546 87.827 1.00 50.35 N ATOM 381 CA LEU B 573 49.866 67.581 88.337 1.00 45.28 C ATOM 382 C LEU B 573 48.645 67.700 87.433 1.00 54.37 C ATOM 383 O LEU B 573 48.781 67.815 86.210 1.00 53.98 O ATOM 384 CB LEU B 573 50.591 68.924 88.427 1.00 39.87 C ATOM 385 CG LEU B 573 51.496 69.117 89.644 1.00 47.14 C ATOM 386 CD1 LEU B 573 52.268 70.421 89.538 1.00 41.55 C ATOM 387 CD2 LEU B 573 50.672 69.085 90.922 1.00 46.09 C ATOM 388 H LEU B 573 51.520 66.818 87.176 1.00 0.00 H ATOM 389 N HIS B 574 47.458 67.680 88.037 1.00 48.31 N ATOM 390 CA HIS B 574 46.202 67.699 87.301 1.00 55.97 C ATOM 391 C HIS B 574 45.344 68.895 87.703 1.00 55.62 C ATOM 392 O HIS B 574 45.278 69.261 88.882 1.00 47.84 O ATOM 393 CB HIS B 574 45.409 66.400 87.523 1.00 55.18 C ATOM 394 CG HIS B 574 45.922 65.229 86.741 1.00 54.97 C ATOM 395 ND1 HIS B 574 46.841 64.336 87.250 1.00 69.41 N ATOM 396 CD2 HIS B 574 45.639 64.802 85.487 1.00 65.01 C ATOM 397 CE1 HIS B 574 47.103 63.411 86.343 1.00 64.21 C ATOM 398 NE2 HIS B 574 46.387 63.671 85.264 1.00 67.06 N ATOM 399 H HIS B 574 47.427 67.650 89.076 1.00 0.00 H ATOM 400 N GLU B 575 44.705 69.504 86.697 1.00 56.87 N ATOM 401 CA GLU B 575 43.594 70.444 86.868 1.00 51.45 C ATOM 402 C GLU B 575 42.294 69.669 86.678 1.00 51.69 C ATOM 403 O GLU B 575 41.841 69.467 85.549 1.00 54.91 O ATOM 404 CB GLU B 575 43.680 71.588 85.863 1.00 50.06 C ATOM 405 CG GLU B 575 44.806 72.560 86.093 1.00 70.42 C ATOM 406 CD GLU B 575 44.654 73.378 87.372 1.00 76.72 C ATOM 407 OE1 GLU B 575 44.955 72.844 88.454 1.00 68.46 O ATOM 408 OE2 GLU B 575 44.263 74.574 87.303 1.00 72.60 O ATOM 409 H GLU B 575 45.018 69.296 85.727 1.00 0.00 H ATOM 410 N THR B 576 41.683 69.234 87.773 1.00 49.52 N ATOM 411 CA THR B 576 40.530 68.348 87.693 1.00 40.68 C ATOM 412 C THR B 576 39.236 69.108 87.958 1.00 39.12 C ATOM 413 O THR B 576 39.093 69.759 88.998 1.00 41.63 O ATOM 414 CB THR B 576 40.661 67.183 88.676 1.00 45.90 C ATOM 415 OG1 THR B 576 41.893 66.489 88.436 1.00 47.47 O ATOM 416 CG2 THR B 576 39.500 66.212 88.490 1.00 36.73 C ATOM 417 HG1 THR B 576 41.976 65.736 89.073 1.00 0.00 H ATOM 418 H THR B 576 42.034 69.531 88.706 1.00 0.00 H ATOM 419 N GLU B 577 38.295 69.010 87.020 1.00 46.06 N ATOM 420 CA GLU B 577 36.947 69.509 87.258 1.00 42.77 C ATOM 421 C GLU B 577 36.266 68.670 88.331 1.00 43.70 C ATOM 422 O GLU B 577 36.332 67.438 88.315 1.00 33.66 O ATOM 423 CB GLU B 577 36.115 69.473 85.976 1.00 32.69 C ATOM 424 CG GLU B 577 36.683 70.268 84.817 1.00 36.21 C ATOM 425 CD GLU B 577 35.853 70.112 83.558 1.00 51.02 C ATOM 426 OE1 GLU B 577 35.546 71.135 82.911 1.00 61.83 O ATOM 427 OE2 GLU B 577 35.500 68.961 83.222 1.00 60.48 O ATOM 428 H GLU B 577 38.526 68.571 86.106 1.00 0.00 H ATOM 429 N VAL B 578 35.604 69.344 89.271 1.00 34.90 N ATOM 430 CA VAL B 578 34.939 68.686 90.387 1.00 34.93 C ATOM 431 C VAL B 578 33.563 69.307 90.579 1.00 39.65 C ATOM 432 O VAL B 578 33.249 70.367 90.034 1.00 39.59 O ATOM 433 CB VAL B 578 35.752 68.786 91.696 1.00 39.72 C ATOM 434 CG1 VAL B 578 37.061 68.021 91.575 1.00 31.31 C ATOM 435 CG2 VAL B 578 36.007 70.245 92.047 1.00 27.10 C ATOM 436 H VAL B 578 35.561 70.381 89.205 1.00 0.00 H ATOM 437 N LEU B 579 32.737 68.623 91.364 1.00 36.30 N ATOM 438 CA LEU B 579 31.468 69.158 91.832 1.00 38.35 C ATOM 439 C LEU B 579 31.592 69.503 93.308 1.00 37.47 C ATOM 440 O LEU B 579 32.195 68.753 94.082 1.00 39.76 O ATOM 441 CB LEU B 579 30.326 68.162 91.626 1.00 43.66 C ATOM 442 CG LEU B 579 28.948 68.749 91.934 1.00 39.11 C ATOM 443 CD1 LEU B 579 28.223 69.110 90.646 1.00 39.82 C ATOM 444 CD2 LEU B 579 28.119 67.808 92.795 1.00 40.68 C ATOM 445 H LEU B 579 33.010 67.663 91.656 1.00 0.00 H ATOM 446 N LEU B 580 31.021 70.638 93.696 1.00 37.44 N ATOM 447 CA LEU B 580 31.135 71.150 95.056 1.00 36.18 C ATOM 448 C LEU B 580 29.735 71.369 95.616 1.00 38.89 C ATOM 449 O LEU B 580 29.050 72.323 95.234 1.00 38.77 O ATOM 450 CB LEU B 580 31.952 72.442 95.077 1.00 28.88 C ATOM 451 CG LEU B 580 33.355 72.327 94.474 1.00 35.87 C ATOM 452 CD1 LEU B 580 33.955 73.698 94.207 1.00 32.48 C ATOM 453 CD2 LEU B 580 34.264 71.514 95.383 1.00 41.17 C ATOM 454 H LEU B 580 30.471 71.183 93.002 1.00 0.00 H ATOM 455 N LYS B 581 29.310 70.480 96.512 1.00 39.51 N ATOM 456 CA LYS B 581 28.041 70.626 97.213 1.00 37.11 C ATOM 457 C LYS B 581 28.287 71.352 98.529 1.00 36.57 C ATOM 458 O LYS B 581 29.000 70.844 99.401 1.00 33.70 O ATOM 459 CB LYS B 581 27.392 69.266 97.467 1.00 38.67 C ATOM 460 CG LYS B 581 26.852 68.586 96.223 1.00 50.01 C ATOM 461 CD LYS B 581 26.184 67.268 96.574 1.00 48.60 C ATOM 462 CE LYS B 581 25.648 66.575 95.334 1.00 54.57 C ATOM 463 NZ LYS B 581 25.144 65.207 95.636 1.00 50.85 N ATOM 464 HZ1 LYS B 581 25.919 64.631 96.022 1.00 0.00 H ATOM 465 HZ2 LYS B 581 24.375 65.268 96.333 1.00 0.00 H ATOM 466 HZ3 LYS B 581 24.787 64.770 94.762 1.00 0.00 H ATOM 467 H LYS B 581 29.905 69.652 96.719 1.00 0.00 H ATOM 468 N VAL B 582 27.698 72.534 98.672 1.00 35.08 N ATOM 469 CA VAL B 582 27.890 73.377 99.844 1.00 39.79 C ATOM 470 C VAL B 582 26.598 73.355 100.646 1.00 39.94 C ATOM 471 O VAL B 582 25.574 73.892 100.207 1.00 42.50 O ATOM 472 CB VAL B 582 28.280 74.810 99.458 1.00 34.88 C ATOM 473 CG1 VAL B 582 28.646 75.612 100.695 1.00 34.63 C ATOM 474 CG2 VAL B 582 29.428 74.798 98.457 1.00 31.64 C ATOM 475 H VAL B 582 27.072 72.872 97.914 1.00 0.00 H ATOM 476 N LEU B 583 26.642 72.730 101.821 1.00 38.04 N ATOM 477 CA LEU B 583 25.492 72.740 102.715 1.00 43.93 C ATOM 478 C LEU B 583 25.199 74.164 103.171 1.00 48.03 C ATOM 479 O LEU B 583 26.115 74.922 103.505 1.00 46.96 O ATOM 480 CB LEU B 583 25.752 71.834 103.919 1.00 45.21 C ATOM 481 CG LEU B 583 24.657 71.775 104.986 1.00 49.73 C ATOM 482 CD1 LEU B 583 23.359 71.243 104.401 1.00 44.25 C ATOM 483 CD2 LEU B 583 25.107 70.929 106.166 1.00 48.46 C ATOM 484 H LEU B 583 27.508 72.229 102.104 1.00 0.00 H ATOM 485 N ASP B 584 23.915 74.525 103.179 1.00 55.91 N ATOM 486 CA ASP B 584 23.520 75.897 103.470 1.00 52.16 C ATOM 487 C ASP B 584 23.993 76.330 104.852 1.00 62.40 C ATOM 488 O ASP B 584 23.989 75.548 105.806 1.00 59.97 O ATOM 489 CB ASP B 584 21.999 76.046 103.367 1.00 56.96 C ATOM 490 CG ASP B 584 21.534 76.358 101.954 1.00 56.70 C ATOM 491 OD1 ASP B 584 22.400 76.567 101.079 1.00 60.77 O ATOM 492 OD2 ASP B 584 20.307 76.395 101.714 1.00 52.14 O ATOM 493 H ASP B 584 23.183 73.815 102.974 1.00 0.00 H ATOM 494 N LYS B 585 24.414 77.595 104.944 1.00 75.34 N ATOM 495 CA LYS B 585 24.804 78.170 106.227 1.00 69.25 C ATOM 496 C LYS B 585 23.668 78.103 107.238 1.00 61.66 C ATOM 497 O LYS B 585 23.906 77.836 108.421 1.00 64.85 O ATOM 498 CB LYS B 585 25.258 79.617 106.027 1.00 74.17 C ATOM 499 CG LYS B 585 25.600 80.380 107.296 1.00 82.04 C ATOM 500 CD LYS B 585 26.895 81.200 107.107 1.00 79.30 C ATOM 501 CE LYS B 585 27.339 81.877 108.404 1.00 81.28 C ATOM 502 NZ LYS B 585 28.368 82.950 108.210 1.00 67.24 N ATOM 503 HZ1 LYS B 585 29.217 82.539 107.771 1.00 0.00 H ATOM 504 HZ2 LYS B 585 27.981 83.692 107.592 1.00 0.00 H ATOM 505 HZ3 LYS B 585 28.617 83.360 109.133 1.00 0.00 H ATOM 506 H LYS B 585 24.465 78.180 104.086 1.00 0.00 H ATOM 507 N ALA B 586 22.428 78.321 106.791 1.00 58.26 N ATOM 508 CA ALA B 586 21.281 78.274 107.691 1.00 57.24 C ATOM 509 C ALA B 586 20.894 76.852 108.090 1.00 63.90 C ATOM 510 O ALA B 586 20.156 76.681 109.068 1.00 68.11 O ATOM 511 CB ALA B 586 20.081 78.971 107.044 1.00 49.91 C ATOM 512 H ALA B 586 22.278 78.528 105.783 1.00 0.00 H ATOM 513 N HIS B 587 21.368 75.835 107.369 1.00 62.10 N ATOM 514 CA HIS B 587 20.948 74.452 107.576 1.00 57.99 C ATOM 515 C HIS B 587 22.119 73.547 107.946 1.00 62.56 C ATOM 516 O HIS B 587 22.162 72.370 107.561 1.00 67.43 O ATOM 517 CB HIS B 587 20.243 73.899 106.337 1.00 55.83 C ATOM 518 CG HIS B 587 19.055 74.702 105.896 1.00 57.24 C ATOM 519 ND1 HIS B 587 17.858 74.708 106.581 1.00 53.98 N ATOM 520 CD2 HIS B 587 18.873 75.506 104.820 1.00 52.45 C ATOM 521 CE1 HIS B 587 16.996 75.490 105.955 1.00 62.94 C ATOM 522 NE2 HIS B 587 17.587 75.987 104.883 1.00 70.18 N ATOM 523 H HIS B 587 22.068 76.036 106.626 1.00 0.00 H ATOM 524 N ARG B 588 23.083 74.067 108.708 1.00 61.68 N ATOM 525 CA ARG B 588 24.177 73.219 109.168 1.00 58.74 C ATOM 526 C ARG B 588 23.763 72.247 110.257 1.00 57.93 C ATOM 527 O ARG B 588 24.601 71.447 110.697 1.00 66.44 O ATOM 528 CB ARG B 588 25.345 74.066 109.680 1.00 78.26 C ATOM 529 CG ARG B 588 26.101 74.694 108.540 1.00 80.47 C ATOM 530 CD ARG B 588 27.544 75.047 108.861 1.00 89.81 C ATOM 531 NE ARG B 588 28.044 75.966 107.839 1.00 96.25 N ATOM 532 CZ ARG B 588 27.817 77.275 107.791 1.00 95.16 C ATOM 533 NH1 ARG B 588 28.318 77.968 106.790 1.00 91.38 N ATOM 534 NH2 ARG B 588 27.096 77.889 108.714 1.00 98.80 N ATOM 535 HE ARG B 588 28.630 75.559 107.082 1.00 0.00 H ATOM 536 HH12 ARG B 588 28.153 78.993 106.733 1.00 0.00 H ATOM 537 HH11 ARG B 588 28.879 77.490 106.056 1.00 0.00 H ATOM 538 HH22 ARG B 588 26.935 78.914 108.651 1.00 0.00 H ATOM 539 HH21 ARG B 588 26.690 77.346 109.503 1.00 0.00 H ATOM 540 H ARG B 588 23.054 75.072 108.973 1.00 0.00 H ATOM 541 N ASN B 589 22.513 72.319 110.716 1.00 59.77 N ATOM 542 CA ASN B 589 21.969 71.274 111.573 1.00 61.33 C ATOM 543 C ASN B 589 22.191 69.897 110.958 1.00 64.00 C ATOM 544 O ASN B 589 22.717 68.982 111.602 1.00 72.31 O ATOM 545 CB ASN B 589 20.473 71.522 111.792 1.00 67.23 C ATOM 546 CG ASN B 589 20.159 72.083 113.160 1.00 77.67 C ATOM 547 OD1 ASN B 589 20.813 71.748 114.152 1.00 79.84 O ATOM 548 ND2 ASN B 589 19.136 72.920 113.226 1.00 75.40 N ATOM 549 HD22 ASN B 589 18.615 73.173 112.362 1.00 0.00 H ATOM 550 HD21 ASN B 589 18.853 73.325 114.141 1.00 0.00 H ATOM 551 H ASN B 589 21.918 73.132 110.459 1.00 0.00 H ATOM 552 N TYR B 590 21.812 69.752 109.691 1.00 63.07 N ATOM 553 CA TYR B 590 21.886 68.492 108.964 1.00 62.61 C ATOM 554 C TYR B 590 23.302 68.130 108.526 1.00 59.15 C ATOM 555 O TYR B 590 23.452 67.350 107.580 1.00 61.17 O ATOM 556 CB TYR B 590 20.962 68.543 107.745 1.00 61.53 C ATOM 557 CG TYR B 590 19.560 68.998 108.081 1.00 62.22 C ATOM 558 CD1 TYR B 590 18.668 68.138 108.697 1.00 47.52 C ATOM 559 CD2 TYR B 590 19.131 70.287 107.787 1.00 63.47 C ATOM 560 CE1 TYR B 590 17.386 68.539 109.012 1.00 63.38 C ATOM 561 CE2 TYR B 590 17.846 70.700 108.099 1.00 45.67 C ATOM 562 CZ TYR B 590 16.978 69.820 108.712 1.00 55.45 C ATOM 563 OH TYR B 590 15.698 70.217 109.027 1.00 56.65 O ATOM 564 HH TYR B 590 15.218 69.466 109.458 1.00 0.00 H ATOM 565 H TYR B 590 21.442 70.586 109.191 1.00 0.00 H ATOM 566 N SER B 591 24.331 68.672 109.184 1.00 67.61 N ATOM 567 CA SER B 591 25.706 68.393 108.779 1.00 57.27 C ATOM 568 C SER B 591 26.011 66.901 108.827 1.00 56.24 C ATOM 569 O SER B 591 26.719 66.377 107.958 1.00 52.68 O ATOM 570 CB SER B 591 26.684 69.165 109.667 1.00 55.40 C ATOM 571 OG SER B 591 28.022 68.767 109.420 1.00 69.19 O ATOM 572 HG SER B 591 28.118 67.800 109.609 1.00 0.00 H ATOM 573 H SER B 591 24.151 69.299 109.994 1.00 0.00 H ATOM 574 N GLU B 592 25.482 66.198 109.829 1.00 62.04 N ATOM 575 CA GLU B 592 25.764 64.772 109.962 1.00 63.32 C ATOM 576 C GLU B 592 25.103 63.972 108.845 1.00 63.15 C ATOM 577 O GLU B 592 25.749 63.139 108.199 1.00 67.28 O ATOM 578 CB GLU B 592 25.308 64.277 111.335 1.00 61.05 C ATOM 579 CG GLU B 592 25.479 62.783 111.547 1.00 65.24 C ATOM 580 CD GLU B 592 25.554 62.412 113.014 1.00 78.57 C ATOM 581 OE1 GLU B 592 26.585 62.715 113.652 1.00 80.78 O ATOM 582 OE2 GLU B 592 24.580 61.826 113.532 1.00 76.34 O ATOM 583 H GLU B 592 24.864 66.669 110.521 1.00 0.00 H ATOM 584 N SER B 593 23.811 64.211 108.603 1.00 50.40 N ATOM 585 CA SER B 593 23.133 63.539 107.499 1.00 57.30 C ATOM 586 C SER B 593 23.699 63.970 106.153 1.00 55.27 C ATOM 587 O SER B 593 23.655 63.199 105.186 1.00 64.93 O ATOM 588 CB SER B 593 21.631 63.817 107.558 1.00 58.18 C ATOM 589 OG SER B 593 20.952 63.193 106.481 1.00 54.39 O ATOM 590 HG SER B 593 21.305 63.541 105.624 1.00 0.00 H ATOM 591 H SER B 593 23.286 64.879 109.204 1.00 0.00 H ATOM 592 N PHE B 594 24.234 65.190 106.074 1.00 56.34 N ATOM 593 CA PHE B 594 24.827 65.672 104.831 1.00 56.80 C ATOM 594 C PHE B 594 26.028 64.826 104.428 1.00 55.57 C ATOM 595 O PHE B 594 26.239 64.558 103.239 1.00 48.44 O ATOM 596 CB PHE B 594 25.222 67.141 104.990 1.00 49.73 C ATOM 597 CG PHE B 594 25.884 67.735 103.782 1.00 50.61 C ATOM 598 CD1 PHE B 594 25.145 68.054 102.656 1.00 49.81 C ATOM 599 CD2 PHE B 594 27.243 68.001 103.783 1.00 45.32 C ATOM 600 CE1 PHE B 594 25.753 68.610 101.546 1.00 40.42 C ATOM 601 CE2 PHE B 594 27.856 68.558 102.677 1.00 45.36 C ATOM 602 CZ PHE B 594 27.109 68.863 101.557 1.00 47.52 C ATOM 603 H PHE B 594 24.228 65.807 106.911 1.00 0.00 H ATOM 604 N PHE B 595 26.818 64.382 105.406 1.00 50.45 N ATOM 605 CA PHE B 595 28.029 63.621 105.129 1.00 43.61 C ATOM 606 C PHE B 595 27.810 62.116 105.165 1.00 56.37 C ATOM 607 O PHE B 595 28.559 61.376 104.517 1.00 48.48 O ATOM 608 CB PHE B 595 29.125 64.003 106.128 1.00 46.44 C ATOM 609 CG PHE B 595 29.690 65.375 105.906 1.00 54.53 C ATOM 610 CD1 PHE B 595 30.120 65.763 104.649 1.00 57.04 C ATOM 611 CD2 PHE B 595 29.780 66.281 106.950 1.00 49.23 C ATOM 612 CE1 PHE B 595 30.639 67.025 104.437 1.00 56.49 C ATOM 613 CE2 PHE B 595 30.297 67.546 106.744 1.00 52.96 C ATOM 614 CZ PHE B 595 30.728 67.917 105.485 1.00 53.43 C ATOM 615 H PHE B 595 26.563 64.584 106.394 1.00 0.00 H ATOM 616 N GLU B 596 26.807 61.643 105.910 1.00 64.55 N ATOM 617 CA GLU B 596 26.527 60.211 105.942 1.00 49.64 C ATOM 618 C GLU B 596 26.073 59.709 104.577 1.00 51.07 C ATOM 619 O GLU B 596 26.443 58.605 104.161 1.00 59.94 O ATOM 620 CB GLU B 596 25.477 59.904 107.011 1.00 47.68 C ATOM 621 CG GLU B 596 25.004 58.457 107.031 1.00 70.57 C ATOM 622 CD GLU B 596 23.642 58.276 106.381 1.00 82.94 C ATOM 623 OE1 GLU B 596 22.806 59.199 106.484 1.00 84.24 O ATOM 624 OE2 GLU B 596 23.409 57.213 105.767 1.00 67.40 O ATOM 625 H GLU B 596 26.224 62.298 106.469 1.00 0.00 H ATOM 626 N ALA B 597 25.279 60.510 103.861 1.00 51.64 N ATOM 627 CA ALA B 597 24.838 60.115 102.528 1.00 51.07 C ATOM 628 C ALA B 597 26.004 60.021 101.554 1.00 52.57 C ATOM 629 O ALA B 597 25.986 59.182 100.647 1.00 61.04 O ATOM 630 CB ALA B 597 23.792 61.098 102.009 1.00 37.24 C ATOM 631 H ALA B 597 24.973 61.422 104.257 1.00 0.00 H ATOM 632 N ALA B 598 27.019 60.873 101.716 1.00 56.25 N ATOM 633 CA ALA B 598 28.216 60.764 100.893 1.00 46.34 C ATOM 634 C ALA B 598 29.157 59.687 101.411 1.00 49.18 C ATOM 635 O ALA B 598 29.848 59.040 100.616 1.00 54.91 O ATOM 636 CB ALA B 598 28.936 62.109 100.824 1.00 44.21 C ATOM 637 H ALA B 598 26.955 61.621 102.436 1.00 0.00 H ATOM 638 N SER B 599 29.191 59.473 102.727 1.00 51.55 N ATOM 639 CA SER B 599 29.912 58.350 103.311 1.00 50.57 C ATOM 640 C SER B 599 29.227 57.020 103.035 1.00 63.40 C ATOM 641 O SER B 599 29.616 56.000 103.615 1.00 76.38 O ATOM 642 CB SER B 599 30.075 58.551 104.820 1.00 60.18 C ATOM 643 OG SER B 599 30.793 57.478 105.403 1.00 56.06 O ATOM 644 HG SER B 599 30.304 56.632 105.247 1.00 0.00 H ATOM 645 H SER B 599 28.686 60.129 103.357 1.00 0.00 H ATOM 646 N MET B 600 28.210 57.021 102.175 1.00 69.83 N ATOM 647 CA MET B 600 27.523 55.817 101.734 1.00 62.96 C ATOM 648 C MET B 600 28.005 55.362 100.363 1.00 51.83 C ATOM 649 O MET B 600 28.347 54.190 100.182 1.00 59.64 O ATOM 650 CB MET B 600 26.010 56.065 101.713 1.00 58.19 C ATOM 651 CG MET B 600 25.178 54.808 101.578 1.00 66.76 C ATOM 652 SD MET B 600 23.995 54.880 100.220 1.00 77.49 S ATOM 653 CE MET B 600 22.917 56.184 100.796 1.00 58.69 C ATOM 654 H MET B 600 27.889 57.935 101.797 1.00 0.00 H ATOM 655 N MET B 601 28.037 56.276 99.390 1.00 66.58 N ATOM 656 CA MET B 601 28.645 55.985 98.097 1.00 61.19 C ATOM 657 C MET B 601 30.160 55.868 98.191 1.00 57.12 C ATOM 658 O MET B 601 30.791 55.366 97.255 1.00 66.28 O ATOM 659 CB MET B 601 28.276 57.074 97.086 1.00 64.42 C ATOM 660 CG MET B 601 27.360 56.623 95.956 1.00 57.75 C ATOM 661 SD MET B 601 25.833 55.853 96.528 1.00 69.41 S ATOM 662 CE MET B 601 25.232 57.084 97.678 1.00 58.35 C ATOM 663 H MET B 601 27.620 57.214 99.558 1.00 0.00 H ATOM 664 N SER B 602 30.753 56.322 99.297 1.00 57.56 N ATOM 665 CA SER B 602 32.205 56.307 99.433 1.00 49.27 C ATOM 666 C SER B 602 32.715 54.952 99.908 1.00 60.64 C ATOM 667 O SER B 602 33.764 54.487 99.449 1.00 64.60 O ATOM 668 CB SER B 602 32.648 57.410 100.395 1.00 56.24 C ATOM 669 OG SER B 602 34.053 57.406 100.568 1.00 80.82 O ATOM 670 HG SER B 602 34.336 56.532 100.937 1.00 0.00 H ATOM 671 H SER B 602 30.170 56.693 100.075 1.00 0.00 H ATOM 672 N LYS B 603 31.991 54.306 100.820 1.00 65.76 N ATOM 673 CA LYS B 603 32.399 53.016 101.364 1.00 64.65 C ATOM 674 C LYS B 603 32.105 51.852 100.425 1.00 68.87 C ATOM 675 O LYS B 603 32.405 50.705 100.775 1.00 75.14 O ATOM 676 CB LYS B 603 31.721 52.784 102.717 1.00 70.03 C ATOM 677 CG LYS B 603 32.138 53.781 103.793 1.00 76.23 C ATOM 678 CD LYS B 603 33.524 53.464 104.344 1.00 78.71 C ATOM 679 CE LYS B 603 34.131 54.665 105.060 1.00 65.55 C ATOM 680 NZ LYS B 603 33.214 55.251 106.077 1.00 74.99 N ATOM 681 HZ1 LYS B 603 32.338 55.565 105.612 1.00 0.00 H ATOM 682 HZ2 LYS B 603 32.989 54.532 106.794 1.00 0.00 H ATOM 683 HZ3 LYS B 603 33.677 56.063 106.532 1.00 0.00 H ATOM 684 H LYS B 603 31.105 54.736 101.155 1.00 0.00 H ATOM 685 N LEU B 604 31.524 52.112 99.256 1.00 64.68 N ATOM 686 CA LEU B 604 31.315 51.098 98.234 1.00 48.50 C ATOM 687 C LEU B 604 31.868 51.606 96.910 1.00 44.93 C ATOM 688 O LEU B 604 32.051 52.809 96.710 1.00 55.67 O ATOM 689 CB LEU B 604 29.831 50.727 98.080 1.00 41.57 C ATOM 690 CG LEU B 604 29.224 49.767 99.109 1.00 50.45 C ATOM 691 CD1 LEU B 604 28.981 50.458 100.435 1.00 58.00 C ATOM 692 CD2 LEU B 604 27.935 49.154 98.587 1.00 55.75 C ATOM 693 H LEU B 604 31.205 53.083 99.065 1.00 0.00 H ATOM 694 N SER B 605 32.135 50.670 96.002 1.00 37.09 N ATOM 695 CA SER B 605 32.704 50.984 94.697 1.00 33.70 C ATOM 696 C SER B 605 31.930 50.233 93.626 1.00 34.99 C ATOM 697 O SER B 605 31.815 49.004 93.686 1.00 39.12 O ATOM 698 CB SER B 605 34.192 50.622 94.640 1.00 37.63 C ATOM 699 OG SER B 605 34.728 50.869 93.352 1.00 37.74 O ATOM 700 HG SER B 605 35.688 50.627 93.343 1.00 0.00 H ATOM 701 H SER B 605 31.930 49.677 96.232 1.00 0.00 H ATOM 702 N HIS B 606 31.407 50.970 92.650 1.00 28.68 N ATOM 703 CA HIS B 606 30.657 50.384 91.549 1.00 26.31 C ATOM 704 C HIS B 606 30.655 51.372 90.393 1.00 30.90 C ATOM 705 O HIS B 606 30.690 52.588 90.600 1.00 31.73 O ATOM 706 CB HIS B 606 29.225 50.032 91.967 1.00 31.16 C ATOM 707 CG HIS B 606 28.485 49.206 90.962 1.00 30.41 C ATOM 708 ND1 HIS B 606 27.858 49.754 89.864 1.00 35.41 N ATOM 709 CD2 HIS B 606 28.263 47.872 90.895 1.00 29.27 C ATOM 710 CE1 HIS B 606 27.286 48.793 89.161 1.00 29.70 C ATOM 711 NE2 HIS B 606 27.516 47.641 89.765 1.00 33.67 N ATOM 712 H HIS B 606 31.539 52.001 92.675 1.00 0.00 H ATOM 713 N LYS B 607 30.607 50.834 89.172 1.00 34.82 N ATOM 714 CA LYS B 607 30.718 51.666 87.980 1.00 34.41 C ATOM 715 C LYS B 607 29.541 52.621 87.814 1.00 35.63 C ATOM 716 O LYS B 607 29.674 53.627 87.108 1.00 29.77 O ATOM 717 CB LYS B 607 30.851 50.784 86.737 1.00 27.52 C ATOM 718 CG LYS B 607 29.591 50.013 86.376 1.00 28.79 C ATOM 719 CD LYS B 607 29.872 48.985 85.293 1.00 26.53 C ATOM 720 CE LYS B 607 28.588 48.466 84.674 1.00 23.75 C ATOM 721 NZ LYS B 607 28.847 47.347 83.729 1.00 28.72 N ATOM 722 HZ1 LYS B 607 29.470 47.678 82.964 1.00 0.00 H ATOM 723 HZ2 LYS B 607 29.306 46.564 84.238 1.00 0.00 H ATOM 724 HZ3 LYS B 607 27.946 47.019 83.326 1.00 0.00 H ATOM 725 H LYS B 607 30.489 49.806 89.070 1.00 0.00 H ATOM 726 N HIS B 608 28.401 52.339 88.443 1.00 31.87 N ATOM 727 CA HIS B 608 27.214 53.174 88.318 1.00 33.94 C ATOM 728 C HIS B 608 26.992 54.071 89.531 1.00 35.82 C ATOM 729 O HIS B 608 25.879 54.571 89.727 1.00 32.41 O ATOM 730 CB HIS B 608 25.979 52.305 88.074 1.00 24.00 C ATOM 731 CG HIS B 608 25.899 51.740 86.691 1.00 26.63 C ATOM 732 ND1 HIS B 608 26.061 52.513 85.561 1.00 25.12 N ATOM 733 CD2 HIS B 608 25.659 50.481 86.254 1.00 26.20 C ATOM 734 CE1 HIS B 608 25.934 51.752 84.488 1.00 27.69 C ATOM 735 NE2 HIS B 608 25.688 50.515 84.881 1.00 25.84 N ATOM 736 H HIS B 608 28.357 51.492 89.045 1.00 0.00 H ATOM 737 N LEU B 609 28.022 54.290 90.344 1.00 33.77 N ATOM 738 CA LEU B 609 27.932 55.154 91.513 1.00 36.07 C ATOM 739 C LEU B 609 28.911 56.312 91.373 1.00 37.62 C ATOM 740 O LEU B 609 30.060 56.119 90.963 1.00 36.51 O ATOM 741 CB LEU B 609 28.214 54.375 92.802 1.00 30.30 C ATOM 742 CG LEU B 609 27.225 53.258 93.148 1.00 37.45 C ATOM 743 CD1 LEU B 609 27.699 52.478 94.364 1.00 25.46 C ATOM 744 CD2 LEU B 609 25.829 53.822 93.380 1.00 32.26 C ATOM 745 H LEU B 609 28.929 53.825 90.136 1.00 0.00 H ATOM 746 N VAL B 610 28.447 57.515 91.717 1.00 38.80 N ATOM 747 CA VAL B 610 29.268 58.712 91.577 1.00 34.84 C ATOM 748 C VAL B 610 30.446 58.651 92.540 1.00 37.13 C ATOM 749 O VAL B 610 30.299 58.286 93.714 1.00 46.58 O ATOM 750 CB VAL B 610 28.414 59.971 91.810 1.00 34.45 C ATOM 751 CG1 VAL B 610 29.296 61.185 92.063 1.00 30.65 C ATOM 752 CG2 VAL B 610 27.505 60.217 90.617 1.00 35.27 C ATOM 753 H VAL B 610 27.481 57.601 92.092 1.00 0.00 H ATOM 754 N LEU B 611 31.628 59.008 92.041 1.00 39.42 N ATOM 755 CA LEU B 611 32.840 58.980 92.848 1.00 35.92 C ATOM 756 C LEU B 611 32.908 60.182 93.782 1.00 38.09 C ATOM 757 O LEU B 611 32.612 61.314 93.388 1.00 38.69 O ATOM 758 CB LEU B 611 34.077 58.957 91.949 1.00 36.57 C ATOM 759 CG LEU B 611 34.465 57.613 91.334 1.00 45.38 C ATOM 760 CD1 LEU B 611 35.602 57.790 90.340 1.00 27.41 C ATOM 761 CD2 LEU B 611 34.857 56.630 92.425 1.00 47.84 C ATOM 762 H LEU B 611 31.687 59.315 91.049 1.00 0.00 H ATOM 763 N ASN B 612 33.305 59.925 95.025 1.00 41.29 N ATOM 764 CA ASN B 612 33.565 60.971 96.005 1.00 33.98 C ATOM 765 C ASN B 612 35.057 61.271 96.034 1.00 39.55 C ATOM 766 O ASN B 612 35.879 60.350 96.079 1.00 46.21 O ATOM 767 CB ASN B 612 33.088 60.558 97.398 1.00 39.39 C ATOM 768 CG ASN B 612 31.578 60.511 97.511 1.00 50.86 C ATOM 769 OD1 ASN B 612 30.871 61.284 96.867 1.00 57.78 O ATOM 770 ND2 ASN B 612 31.076 59.602 98.338 1.00 58.64 N ATOM 771 HD22 ASN B 612 31.712 58.969 98.863 1.00 0.00 H ATOM 772 HD21 ASN B 612 30.046 59.523 98.461 1.00 0.00 H ATOM 773 H ASN B 612 33.436 58.933 95.310 1.00 0.00 H ATOM 774 N TYR B 613 35.400 62.556 96.006 1.00 47.87 N ATOM 775 CA TYR B 613 36.790 62.983 96.093 1.00 33.60 C ATOM 776 C TYR B 613 37.216 63.358 97.505 1.00 36.14 C ATOM 777 O TYR B 613 38.404 63.255 97.826 1.00 50.56 O ATOM 778 CB TYR B 613 37.040 64.171 95.159 1.00 40.92 C ATOM 779 CG TYR B 613 36.971 63.818 93.691 1.00 40.72 C ATOM 780 CD1 TYR B 613 37.359 62.563 93.241 1.00 33.11 C ATOM 781 CD2 TYR B 613 36.516 64.737 92.755 1.00 36.46 C ATOM 782 CE1 TYR B 613 37.299 62.235 91.900 1.00 30.53 C ATOM 783 CE2 TYR B 613 36.452 64.418 91.412 1.00 31.22 C ATOM 784 CZ TYR B 613 36.844 63.166 90.991 1.00 40.52 C ATOM 785 OH TYR B 613 36.783 62.843 89.654 1.00 43.71 O ATOM 786 HH TYR B 613 37.098 61.913 89.526 1.00 0.00 H ATOM 787 H TYR B 613 34.655 63.276 95.920 1.00 0.00 H ATOM 788 N GLY B 614 36.288 63.789 98.351 1.00 36.92 N ATOM 789 CA GLY B 614 36.605 64.099 99.726 1.00 47.15 C ATOM 790 C GLY B 614 35.813 65.291 100.217 1.00 43.89 C ATOM 791 O GLY B 614 34.758 65.623 99.679 1.00 38.41 O ATOM 792 H GLY B 614 35.310 63.906 98.016 1.00 0.00 H ATOM 793 N VAL B 615 36.346 65.931 101.256 1.00 47.65 N ATOM 794 CA VAL B 615 35.703 67.055 101.926 1.00 46.37 C ATOM 795 C VAL B 615 36.661 68.237 101.913 1.00 53.38 C ATOM 796 O VAL B 615 37.853 68.078 102.200 1.00 53.52 O ATOM 797 CB VAL B 615 35.299 66.694 103.370 1.00 42.92 C ATOM 798 CG1 VAL B 615 35.103 67.946 104.209 1.00 56.56 C ATOM 799 CG2 VAL B 615 34.035 65.850 103.366 1.00 56.89 C ATOM 800 H VAL B 615 37.271 65.612 101.609 1.00 0.00 H ATOM 801 N CYS B 616 36.146 69.418 101.574 1.00 48.05 N ATOM 802 CA CYS B 616 36.964 70.623 101.563 1.00 53.10 C ATOM 803 C CYS B 616 37.087 71.189 102.971 1.00 55.46 C ATOM 804 O CYS B 616 36.088 71.337 103.682 1.00 48.02 O ATOM 805 CB CYS B 616 36.368 71.671 100.626 1.00 50.43 C ATOM 806 SG CYS B 616 37.273 73.240 100.606 1.00 63.58 S ATOM 807 H CYS B 616 35.141 69.481 101.312 1.00 0.00 H ATOM 808 N VAL B 617 38.314 71.509 103.369 1.00 67.12 N ATOM 809 CA VAL B 617 38.599 72.085 104.677 1.00 67.56 C ATOM 810 C VAL B 617 38.679 73.597 104.513 1.00 56.59 C ATOM 811 O VAL B 617 39.618 74.115 103.898 1.00 77.92 O ATOM 812 CB VAL B 617 39.894 71.518 105.274 1.00 64.93 C ATOM 813 CG1 VAL B 617 40.330 72.340 106.479 1.00 75.19 C ATOM 814 CG2 VAL B 617 39.702 70.061 105.664 1.00 54.69 C ATOM 815 H VAL B 617 39.107 71.341 102.717 1.00 0.00 H ATOM 816 N CYS B 618 37.687 74.304 105.058 1.00 67.73 N ATOM 817 CA CYS B 618 37.679 75.763 105.075 1.00 73.61 C ATOM 818 C CYS B 618 36.549 76.287 105.952 1.00 79.10 C ATOM 819 O CYS B 618 35.392 75.886 105.787 1.00 80.66 O ATOM 820 CB CYS B 618 37.550 76.331 103.660 1.00 80.89 C ATOM 821 SG CYS B 618 36.102 75.783 102.741 1.00 84.68 S ATOM 822 H CYS B 618 36.888 73.795 105.488 1.00 0.00 H ATOM 823 N GLY B 619 36.878 77.181 106.881 1.00 86.87 N ATOM 824 CA GLY B 619 35.922 77.810 107.771 1.00 82.73 C ATOM 825 C GLY B 619 35.066 76.796 108.499 1.00 82.21 C ATOM 826 O GLY B 619 35.470 75.657 108.749 1.00 75.35 O ATOM 827 H GLY B 619 37.880 77.444 106.974 1.00 0.00 H ATOM 828 N ASP B 620 33.852 77.220 108.849 1.00 79.57 N ATOM 829 CA ASP B 620 32.858 76.340 109.443 1.00 70.99 C ATOM 830 C ASP B 620 31.923 75.739 108.402 1.00 80.46 C ATOM 831 O ASP B 620 30.821 75.296 108.748 1.00 75.46 O ATOM 832 CB ASP B 620 32.055 77.092 110.509 1.00 81.72 C ATOM 833 CG ASP B 620 31.409 78.360 109.975 1.00 91.93 C ATOM 834 OD1 ASP B 620 31.507 78.624 108.758 1.00 95.65 O ATOM 835 OD2 ASP B 620 30.803 79.098 110.779 1.00 93.41 O ATOM 836 H ASP B 620 33.606 78.218 108.691 1.00 0.00 H ATOM 837 N GLU B 621 32.338 75.717 107.141 1.00 74.23 N ATOM 838 CA GLU B 621 31.500 75.258 106.047 1.00 72.68 C ATOM 839 C GLU B 621 31.629 73.751 105.852 1.00 66.74 C ATOM 840 O GLU B 621 32.573 73.112 106.322 1.00 68.77 O ATOM 841 CB GLU B 621 31.868 75.984 104.754 1.00 67.27 C ATOM 842 CG GLU B 621 31.651 77.483 104.792 1.00 57.96 C ATOM 843 CD GLU B 621 31.858 78.128 103.438 1.00 62.92 C ATOM 844 OE1 GLU B 621 33.019 78.428 103.088 1.00 66.90 O ATOM 845 OE2 GLU B 621 30.857 78.322 102.717 1.00 65.13 O ATOM 846 H GLU B 621 33.303 76.042 106.928 1.00 0.00 H ATOM 847 N ASN B 622 30.654 73.190 105.140 1.00 69.35 N ATOM 848 CA ASN B 622 30.598 71.763 104.839 1.00 55.79 C ATOM 849 C ASN B 622 30.528 71.606 103.327 1.00 56.21 C ATOM 850 O ASN B 622 29.485 71.873 102.719 1.00 52.09 O ATOM 851 CB ASN B 622 29.394 71.110 105.515 1.00 54.67 C ATOM 852 CG ASN B 622 29.334 71.394 107.002 1.00 61.25 C ATOM 853 OD1 ASN B 622 28.342 71.924 107.504 1.00 65.75 O ATOM 854 ND2 ASN B 622 30.398 71.046 107.715 1.00 58.94 N ATOM 855 HD22 ASN B 622 31.214 70.601 107.248 1.00 0.00 H ATOM 856 HD21 ASN B 622 30.416 71.219 108.740 1.00 0.00 H ATOM 857 H ASN B 622 29.893 73.800 104.780 1.00 0.00 H ATOM 858 N ILE B 623 31.632 71.178 102.719 1.00 46.88 N ATOM 859 CA ILE B 623 31.730 71.039 101.271 1.00 41.17 C ATOM 860 C ILE B 623 32.084 69.599 100.943 1.00 40.04 C ATOM 861 O ILE B 623 33.072 69.063 101.458 1.00 47.30 O ATOM 862 CB ILE B 623 32.773 71.997 100.666 1.00 48.77 C ATOM 863 CG1 ILE B 623 32.460 73.447 101.034 1.00 53.79 C ATOM 864 CG2 ILE B 623 32.837 71.831 99.154 1.00 40.93 C ATOM 865 CD1 ILE B 623 33.197 73.924 102.253 1.00 62.64 C ATOM 866 H ILE B 623 32.459 70.933 103.301 1.00 0.00 H ATOM 867 N LEU B 624 31.280 68.978 100.088 1.00 37.96 N ATOM 868 CA LEU B 624 31.590 67.676 99.521 1.00 34.62 C ATOM 869 C LEU B 624 32.160 67.873 98.124 1.00 44.28 C ATOM 870 O LEU B 624 31.623 68.659 97.336 1.00 37.15 O ATOM 871 CB LEU B 624 30.348 66.786 99.474 1.00 49.71 C ATOM 872 CG LEU B 624 29.908 66.200 100.814 1.00 52.91 C ATOM 873 CD1 LEU B 624 28.509 65.622 100.708 1.00 45.70 C ATOM 874 CD2 LEU B 624 30.900 65.141 101.272 1.00 40.98 C ATOM 875 H LEU B 624 30.391 69.443 99.812 1.00 0.00 H ATOM 876 N VAL B 625 33.251 67.174 97.829 1.00 39.61 N ATOM 877 CA VAL B 625 33.914 67.246 96.534 1.00 39.38 C ATOM 878 C VAL B 625 33.670 65.925 95.821 1.00 35.35 C ATOM 879 O VAL B 625 34.083 64.864 96.305 1.00 40.39 O ATOM 880 CB VAL B 625 35.416 67.534 96.680 1.00 43.48 C ATOM 881 CG1 VAL B 625 36.056 67.709 95.313 1.00 44.41 C ATOM 882 CG2 VAL B 625 35.634 68.772 97.540 1.00 33.94 C ATOM 883 H VAL B 625 33.650 66.547 98.556 1.00 0.00 H ATOM 884 N GLN B 626 32.993 65.987 94.677 1.00 34.90 N ATOM 885 CA GLN B 626 32.552 64.794 93.975 1.00 34.76 C ATOM 886 C GLN B 626 32.879 64.898 92.492 1.00 33.65 C ATOM 887 O GLN B 626 33.178 65.975 91.970 1.00 38.03 O ATOM 888 CB GLN B 626 31.048 64.563 94.167 1.00 36.82 C ATOM 889 CG GLN B 626 30.665 64.221 95.595 1.00 50.06 C ATOM 890 CD GLN B 626 29.168 64.209 95.812 1.00 40.79 C ATOM 891 OE1 GLN B 626 28.540 65.260 95.913 1.00 58.20 O ATOM 892 NE2 GLN B 626 28.588 63.018 95.886 1.00 52.20 N ATOM 893 HE22 GLN B 626 29.160 62.154 95.795 1.00 0.00 H ATOM 894 HE21 GLN B 626 27.561 62.948 96.035 1.00 0.00 H ATOM 895 H GLN B 626 32.773 66.919 94.273 1.00 0.00 H ATOM 896 N GLU B 627 32.814 63.747 91.826 1.00 30.16 N ATOM 897 CA GLU B 627 33.098 63.665 90.400 1.00 30.79 C ATOM 898 C GLU B 627 32.176 64.584 89.611 1.00 31.97 C ATOM 899 O GLU B 627 30.957 64.572 89.800 1.00 37.40 O ATOM 900 CB GLU B 627 32.935 62.219 89.930 1.00 26.40 C ATOM 901 CG GLU B 627 32.900 62.035 88.422 1.00 37.91 C ATOM 902 CD GLU B 627 32.465 60.635 88.024 1.00 45.49 C ATOM 903 OE1 GLU B 627 31.924 59.911 88.887 1.00 37.49 O ATOM 904 OE2 GLU B 627 32.666 60.257 86.850 1.00 51.35 O ATOM 905 H GLU B 627 32.553 62.881 92.339 1.00 0.00 H ATOM 906 N PHE B 628 32.761 65.389 88.727 1.00 27.27 N ATOM 907 CA PHE B 628 31.977 66.250 87.854 1.00 38.13 C ATOM 908 C PHE B 628 31.644 65.509 86.567 1.00 37.89 C ATOM 909 O PHE B 628 32.521 64.907 85.940 1.00 40.96 O ATOM 910 CB PHE B 628 32.712 67.552 87.532 1.00 37.50 C ATOM 911 CG PHE B 628 31.907 68.498 86.685 1.00 36.16 C ATOM 912 CD1 PHE B 628 30.949 69.318 87.261 1.00 36.06 C ATOM 913 CD2 PHE B 628 32.092 68.555 85.312 1.00 31.11 C ATOM 914 CE1 PHE B 628 30.198 70.184 86.486 1.00 31.37 C ATOM 915 CE2 PHE B 628 31.344 69.419 84.533 1.00 36.30 C ATOM 916 CZ PHE B 628 30.396 70.234 85.121 1.00 32.73 C ATOM 917 H PHE B 628 33.799 65.403 88.659 1.00 0.00 H ATOM 918 N VAL B 629 30.374 65.564 86.181 1.00 37.76 N ATOM 919 CA VAL B 629 29.869 64.926 84.973 1.00 38.85 C ATOM 920 C VAL B 629 29.468 66.026 84.001 1.00 41.28 C ATOM 921 O VAL B 629 28.767 66.971 84.383 1.00 45.32 O ATOM 922 CB VAL B 629 28.685 63.998 85.292 1.00 51.28 C ATOM 923 CG1 VAL B 629 28.161 63.360 84.031 1.00 43.81 C ATOM 924 CG2 VAL B 629 29.104 62.936 86.301 1.00 47.45 C ATOM 925 H VAL B 629 29.703 66.092 86.775 1.00 0.00 H ATOM 926 N LYS B 630 29.913 65.907 82.747 1.00 40.40 N ATOM 927 CA LYS B 630 29.760 67.017 81.810 1.00 44.42 C ATOM 928 C LYS B 630 28.302 67.244 81.429 1.00 42.91 C ATOM 929 O LYS B 630 27.839 68.390 81.390 1.00 55.89 O ATOM 930 CB LYS B 630 30.604 66.779 80.557 1.00 58.83 C ATOM 931 CG LYS B 630 30.433 67.870 79.504 1.00 60.85 C ATOM 932 CD LYS B 630 31.720 68.134 78.735 1.00 64.39 C ATOM 933 CE LYS B 630 31.875 67.196 77.549 1.00 63.83 C ATOM 934 NZ LYS B 630 30.842 67.451 76.507 1.00 54.75 N ATOM 935 HZ1 LYS B 630 29.896 67.309 76.916 1.00 0.00 H ATOM 936 HZ2 LYS B 630 30.930 68.429 76.165 1.00 0.00 H ATOM 937 HZ3 LYS B 630 30.981 66.792 75.715 1.00 0.00 H ATOM 938 H LYS B 630 30.368 65.024 82.438 1.00 0.00 H ATOM 939 N PHE B 631 27.560 66.176 81.147 1.00 55.86 N ATOM 940 CA PHE B 631 26.227 66.298 80.573 1.00 38.60 C ATOM 941 C PHE B 631 25.132 66.504 81.617 1.00 42.95 C ATOM 942 O PHE B 631 23.948 66.483 81.263 1.00 46.61 O ATOM 943 CB PHE B 631 25.916 65.070 79.715 1.00 35.19 C ATOM 944 CG PHE B 631 26.938 64.812 78.645 1.00 47.98 C ATOM 945 CD1 PHE B 631 26.947 65.563 77.481 1.00 47.74 C ATOM 946 CD2 PHE B 631 27.895 63.823 78.805 1.00 45.48 C ATOM 947 CE1 PHE B 631 27.889 65.331 76.495 1.00 48.93 C ATOM 948 CE2 PHE B 631 28.839 63.586 77.822 1.00 50.99 C ATOM 949 CZ PHE B 631 28.836 64.341 76.666 1.00 55.04 C ATOM 950 H PHE B 631 27.942 65.229 81.342 1.00 0.00 H ATOM 951 N GLY B 632 25.493 66.702 82.883 1.00 35.63 N ATOM 952 CA GLY B 632 24.515 67.114 83.874 1.00 36.46 C ATOM 953 C GLY B 632 23.531 66.028 84.288 1.00 40.18 C ATOM 954 O GLY B 632 23.773 64.826 84.151 1.00 45.18 O ATOM 955 H GLY B 632 26.484 66.560 83.165 1.00 0.00 H ATOM 956 N SER B 633 22.394 66.487 84.805 1.00 45.03 N ATOM 957 CA SER B 633 21.378 65.599 85.350 1.00 39.15 C ATOM 958 C SER B 633 20.607 64.888 84.247 1.00 43.94 C ATOM 959 O SER B 633 20.363 65.438 83.169 1.00 39.33 O ATOM 960 CB SER B 633 20.394 66.375 86.227 1.00 38.86 C ATOM 961 OG SER B 633 20.850 66.466 87.564 1.00 54.71 O ATOM 962 HG SER B 633 20.954 65.556 87.939 1.00 0.00 H ATOM 963 H SER B 633 22.226 67.513 84.820 1.00 0.00 H ATOM 964 N LEU B 634 20.219 63.644 84.536 1.00 40.88 N ATOM 965 CA LEU B 634 19.245 62.958 83.697 1.00 43.95 C ATOM 966 C LEU B 634 17.914 63.697 83.687 1.00 37.32 C ATOM 967 O LEU B 634 17.213 63.703 82.669 1.00 35.79 O ATOM 968 CB LEU B 634 19.052 61.524 84.191 1.00 39.08 C ATOM 969 CG LEU B 634 18.031 60.667 83.444 1.00 39.14 C ATOM 970 CD1 LEU B 634 18.519 60.381 82.037 1.00 44.18 C ATOM 971 CD2 LEU B 634 17.750 59.377 84.196 1.00 38.77 C ATOM 972 H LEU B 634 20.615 63.160 85.367 1.00 0.00 H ATOM 973 N ASP B 635 17.562 64.328 84.809 1.00 51.80 N ATOM 974 CA ASP B 635 16.319 65.087 84.910 1.00 41.72 C ATOM 975 C ASP B 635 16.238 66.153 83.824 1.00 49.09 C ATOM 976 O ASP B 635 15.308 66.163 83.010 1.00 63.19 O ATOM 977 CB ASP B 635 16.223 65.715 86.304 1.00 43.16 C ATOM 978 CG ASP B 635 14.912 66.444 86.540 1.00 75.69 C ATOM 979 OD1 ASP B 635 14.030 66.426 85.654 1.00 84.22 O ATOM 980 OD2 ASP B 635 14.767 67.040 87.629 1.00 82.32 O ATOM 981 H ASP B 635 18.191 64.278 85.635 1.00 0.00 H ATOM 982 N THR B 636 17.209 67.065 83.798 1.00 46.52 N ATOM 983 CA THR B 636 17.200 68.122 82.797 1.00 47.32 C ATOM 984 C THR B 636 17.599 67.625 81.413 1.00 40.36 C ATOM 985 O THR B 636 17.339 68.319 80.426 1.00 56.87 O ATOM 986 CB THR B 636 18.122 69.267 83.227 1.00 45.48 C ATOM 987 OG1 THR B 636 19.427 68.755 83.524 1.00 60.12 O ATOM 988 CG2 THR B 636 17.562 69.960 84.462 1.00 45.48 C ATOM 989 HG1 THR B 636 20.017 69.500 83.801 1.00 0.00 H ATOM 990 H THR B 636 17.978 67.021 84.497 1.00 0.00 H ATOM 991 N TYR B 637 18.210 66.442 81.313 1.00 40.56 N ATOM 992 CA TYR B 637 18.579 65.924 79.999 1.00 40.72 C ATOM 993 C TYR B 637 17.392 65.268 79.303 1.00 48.71 C ATOM 994 O TYR B 637 17.181 65.484 78.104 1.00 46.80 O ATOM 995 CB TYR B 637 19.740 64.935 80.119 1.00 35.54 C ATOM 996 CG TYR B 637 20.325 64.543 78.783 1.00 39.68 C ATOM 997 CD1 TYR B 637 21.338 65.293 78.201 1.00 44.46 C ATOM 998 CD2 TYR B 637 19.857 63.429 78.096 1.00 43.41 C ATOM 999 CE1 TYR B 637 21.872 64.943 76.976 1.00 49.29 C ATOM 1000 CE2 TYR B 637 20.385 63.072 76.869 1.00 45.54 C ATOM 1001 CZ TYR B 637 21.393 63.831 76.314 1.00 58.06 C ATOM 1002 OH TYR B 637 21.923 63.478 75.093 1.00 63.01 O ATOM 1003 HH TYR B 637 22.631 64.124 74.843 1.00 0.00 H ATOM 1004 H TYR B 637 18.422 65.891 82.169 1.00 0.00 H ATOM 1005 N LEU B 638 16.620 64.454 80.033 1.00 44.44 N ATOM 1006 CA LEU B 638 15.373 63.924 79.488 1.00 42.47 C ATOM 1007 C LEU B 638 14.467 65.043 79.003 1.00 50.20 C ATOM 1008 O LEU B 638 13.749 64.883 78.011 1.00 58.88 O ATOM 1009 CB LEU B 638 14.637 63.097 80.543 1.00 44.39 C ATOM 1010 CG LEU B 638 15.217 61.770 81.028 1.00 40.77 C ATOM 1011 CD1 LEU B 638 14.593 61.412 82.365 1.00 30.40 C ATOM 1012 CD2 LEU B 638 14.969 60.671 80.010 1.00 38.40 C ATOM 1013 H LEU B 638 16.911 64.196 80.998 1.00 0.00 H ATOM 1014 N LYS B 639 14.498 66.184 79.690 1.00 61.71 N ATOM 1015 CA LYS B 639 13.629 67.301 79.348 1.00 50.00 C ATOM 1016 C LYS B 639 14.081 67.981 78.060 1.00 55.45 C ATOM 1017 O LYS B 639 13.278 68.194 77.144 1.00 55.38 O ATOM 1018 CB LYS B 639 13.603 68.282 80.521 1.00 50.95 C ATOM 1019 CG LYS B 639 13.147 69.688 80.208 1.00 50.59 C ATOM 1020 CD LYS B 639 13.376 70.555 81.439 1.00 68.70 C ATOM 1021 CE LYS B 639 12.866 71.972 81.262 1.00 67.98 C ATOM 1022 NZ LYS B 639 13.079 72.772 82.503 1.00 60.14 N ATOM 1023 HZ1 LYS B 639 12.568 72.328 83.292 1.00 0.00 H ATOM 1024 HZ2 LYS B 639 14.095 72.806 82.722 1.00 0.00 H ATOM 1025 HZ3 LYS B 639 12.722 73.738 82.357 1.00 0.00 H ATOM 1026 H LYS B 639 15.158 66.279 80.488 1.00 0.00 H ATOM 1027 N LYS B 640 15.371 68.319 77.963 1.00 59.74 N ATOM 1028 CA LYS B 640 15.854 69.033 76.783 1.00 52.19 C ATOM 1029 C LYS B 640 15.945 68.125 75.562 1.00 56.09 C ATOM 1030 O LYS B 640 15.891 68.612 74.426 1.00 54.62 O ATOM 1031 CB LYS B 640 17.216 69.667 77.066 1.00 51.76 C ATOM 1032 CG LYS B 640 17.228 70.605 78.262 1.00 58.54 C ATOM 1033 CD LYS B 640 18.533 71.381 78.335 1.00 61.38 C ATOM 1034 CE LYS B 640 18.793 71.903 79.739 1.00 69.47 C ATOM 1035 NZ LYS B 640 19.834 72.972 79.748 1.00 65.56 N ATOM 1036 HZ1 LYS B 640 20.725 72.590 79.371 1.00 0.00 H ATOM 1037 HZ2 LYS B 640 19.518 73.767 79.156 1.00 0.00 H ATOM 1038 HZ3 LYS B 640 19.982 73.302 80.723 1.00 0.00 H ATOM 1039 H LYS B 640 16.031 68.074 78.728 1.00 0.00 H ATOM 1040 N ASN B 641 16.084 66.815 75.767 1.00 61.04 N ATOM 1041 CA ASN B 641 16.187 65.854 74.675 1.00 61.35 C ATOM 1042 C ASN B 641 14.969 64.935 74.600 1.00 66.87 C ATOM 1043 O ASN B 641 15.069 63.798 74.133 1.00 76.43 O ATOM 1044 CB ASN B 641 17.465 65.028 74.808 1.00 62.23 C ATOM 1045 CG ASN B 641 18.705 65.806 74.416 1.00 65.35 C ATOM 1046 OD1 ASN B 641 19.149 65.746 73.270 1.00 69.60 O ATOM 1047 ND2 ASN B 641 19.269 66.542 75.366 1.00 62.74 N ATOM 1048 HD22 ASN B 641 18.858 66.562 76.321 1.00 0.00 H ATOM 1049 HD21 ASN B 641 20.122 67.099 75.155 1.00 0.00 H ATOM 1050 H ASN B 641 16.120 66.464 76.745 1.00 0.00 H ATOM 1051 N LYS B 642 13.809 65.423 75.049 1.00 66.04 N ATOM 1052 CA LYS B 642 12.603 64.599 75.046 1.00 73.99 C ATOM 1053 C LYS B 642 12.156 64.251 73.632 1.00 78.63 C ATOM 1054 O LYS B 642 11.509 63.218 73.423 1.00 81.13 O ATOM 1055 CB LYS B 642 11.474 65.318 75.786 1.00 65.94 C ATOM 1056 CG LYS B 642 11.081 66.641 75.150 1.00 74.01 C ATOM 1057 CD LYS B 642 9.911 67.289 75.866 1.00 73.06 C ATOM 1058 CE LYS B 642 9.534 68.602 75.198 1.00 70.04 C ATOM 1059 NZ LYS B 642 8.391 69.269 75.878 1.00 82.48 N ATOM 1060 HZ1 LYS B 642 7.561 68.643 75.853 1.00 0.00 H ATOM 1061 HZ2 LYS B 642 8.646 69.470 76.866 1.00 0.00 H ATOM 1062 HZ3 LYS B 642 8.170 70.159 75.388 1.00 0.00 H ATOM 1063 H LYS B 642 13.764 66.399 75.404 1.00 0.00 H ATOM 1064 N ASN B 643 12.490 65.094 72.654 1.00 89.32 N ATOM 1065 CA ASN B 643 12.008 64.884 71.292 1.00 94.33 C ATOM 1066 C ASN B 643 12.598 63.618 70.683 1.00 87.70 C ATOM 1067 O ASN B 643 11.876 62.812 70.085 1.00 88.56 O ATOM 1068 CB ASN B 643 12.334 66.102 70.427 1.00100.11 C ATOM 1069 CG ASN B 643 11.406 67.270 70.694 1.00 95.83 C ATOM 1070 OD1 ASN B 643 10.665 67.278 71.677 1.00 96.14 O ATOM 1071 ND2 ASN B 643 11.440 68.265 69.816 1.00 98.07 N ATOM 1072 HD22 ASN B 643 12.082 68.216 68.999 1.00 0.00 H ATOM 1073 HD21 ASN B 643 10.825 69.093 69.945 1.00 0.00 H ATOM 1074 H ASN B 643 13.100 65.910 72.864 1.00 0.00 H ATOM 1075 N CYS B 644 13.908 63.422 70.823 1.00 90.14 N ATOM 1076 CA CYS B 644 14.544 62.269 70.199 1.00 95.53 C ATOM 1077 C CYS B 644 15.229 61.373 71.223 1.00 86.29 C ATOM 1078 O CYS B 644 16.430 61.105 71.126 1.00 83.71 O ATOM 1079 CB CYS B 644 15.534 62.724 69.129 1.00 91.42 C ATOM 1080 SG CYS B 644 14.734 63.533 67.722 1.00109.64 S ATOM 1081 H CYS B 644 14.477 64.092 71.378 1.00 0.00 H ATOM 1082 N ILE B 645 14.467 60.916 72.211 1.00 91.92 N ATOM 1083 CA ILE B 645 14.858 59.813 73.080 1.00 80.64 C ATOM 1084 C ILE B 645 13.832 58.712 72.850 1.00 73.88 C ATOM 1085 O ILE B 645 12.661 58.855 73.226 1.00 76.09 O ATOM 1086 CB ILE B 645 14.925 60.224 74.558 1.00 75.47 C ATOM 1087 CG1 ILE B 645 16.258 60.913 74.860 1.00 57.17 C ATOM 1088 CG2 ILE B 645 14.742 59.017 75.464 1.00 62.87 C ATOM 1089 CD1 ILE B 645 16.455 61.247 76.324 1.00 52.23 C ATOM 1090 H ILE B 645 13.545 61.368 72.372 1.00 0.00 H ATOM 1091 N ASN B 646 14.255 57.631 72.199 1.00 64.25 N ATOM 1092 CA ASN B 646 13.338 56.556 71.865 1.00 68.30 C ATOM 1093 C ASN B 646 13.270 55.547 73.008 1.00 63.64 C ATOM 1094 O ASN B 646 13.897 55.710 74.057 1.00 62.83 O ATOM 1095 CB ASN B 646 13.741 55.892 70.547 1.00 58.89 C ATOM 1096 CG ASN B 646 15.145 55.318 70.577 1.00 59.95 C ATOM 1097 OD1 ASN B 646 15.818 55.328 71.607 1.00 70.16 O ATOM 1098 ND2 ASN B 646 15.593 54.805 69.436 1.00 69.30 N ATOM 1099 HD22 ASN B 646 14.991 54.817 68.588 1.00 0.00 H ATOM 1100 HD21 ASN B 646 16.546 54.391 69.391 1.00 0.00 H ATOM 1101 H ASN B 646 15.256 57.555 71.926 1.00 0.00 H ATOM 1102 N ILE B 647 12.495 54.482 72.796 1.00 61.36 N ATOM 1103 CA ILE B 647 12.264 53.502 73.853 1.00 56.28 C ATOM 1104 C ILE B 647 13.564 52.805 74.234 1.00 62.10 C ATOM 1105 O ILE B 647 13.832 52.563 75.418 1.00 61.92 O ATOM 1106 CB ILE B 647 11.181 52.495 73.418 1.00 57.09 C ATOM 1107 CG1 ILE B 647 9.817 53.182 73.291 1.00 77.69 C ATOM 1108 CG2 ILE B 647 11.097 51.335 74.399 1.00 57.75 C ATOM 1109 CD1 ILE B 647 9.522 53.761 71.917 1.00 66.08 C ATOM 1110 H ILE B 647 12.050 54.348 71.866 1.00 0.00 H ATOM 1111 N LEU B 648 14.401 52.487 73.243 1.00 61.38 N ATOM 1112 CA LEU B 648 15.638 51.764 73.522 1.00 55.47 C ATOM 1113 C LEU B 648 16.611 52.596 74.348 1.00 54.79 C ATOM 1114 O LEU B 648 17.342 52.043 75.178 1.00 45.74 O ATOM 1115 CB LEU B 648 16.290 51.316 72.215 1.00 57.67 C ATOM 1116 CG LEU B 648 15.484 50.298 71.405 1.00 67.64 C ATOM 1117 CD1 LEU B 648 16.226 49.911 70.137 1.00 76.70 C ATOM 1118 CD2 LEU B 648 15.172 49.068 72.248 1.00 63.96 C ATOM 1119 H LEU B 648 14.170 52.756 72.265 1.00 0.00 H ATOM 1120 N TRP B 649 16.642 53.913 74.136 1.00 54.06 N ATOM 1121 CA TRP B 649 17.460 54.775 74.983 1.00 52.07 C ATOM 1122 C TRP B 649 16.973 54.731 76.424 1.00 55.74 C ATOM 1123 O TRP B 649 17.772 54.622 77.361 1.00 52.82 O ATOM 1124 CB TRP B 649 17.439 56.210 74.452 1.00 54.25 C ATOM 1125 CG TRP B 649 18.407 57.140 75.139 1.00 52.40 C ATOM 1126 CD1 TRP B 649 19.616 57.557 74.664 1.00 51.74 C ATOM 1127 CD2 TRP B 649 18.241 57.772 76.419 1.00 55.34 C ATOM 1128 NE1 TRP B 649 20.213 58.405 75.565 1.00 49.04 N ATOM 1129 CE2 TRP B 649 19.390 58.553 76.650 1.00 52.09 C ATOM 1130 CE3 TRP B 649 17.235 57.751 77.390 1.00 48.03 C ATOM 1131 CZ2 TRP B 649 19.560 59.304 77.811 1.00 51.36 C ATOM 1132 CZ3 TRP B 649 17.405 58.497 78.539 1.00 54.05 C ATOM 1133 CH2 TRP B 649 18.558 59.263 78.740 1.00 48.84 C ATOM 1134 HE1 TRP B 649 21.140 58.861 75.443 1.00 0.00 H ATOM 1135 H TRP B 649 16.081 54.327 73.364 1.00 0.00 H ATOM 1136 N LYS B 650 15.655 54.828 76.619 1.00 56.92 N ATOM 1137 CA LYS B 650 15.092 54.741 77.962 1.00 57.14 C ATOM 1138 C LYS B 650 15.386 53.388 78.591 1.00 48.75 C ATOM 1139 O LYS B 650 15.681 53.300 79.788 1.00 43.14 O ATOM 1140 CB LYS B 650 13.584 54.987 77.913 1.00 51.33 C ATOM 1141 CG LYS B 650 13.183 56.216 77.121 1.00 53.95 C ATOM 1142 CD LYS B 650 11.707 56.193 76.761 1.00 54.92 C ATOM 1143 CE LYS B 650 11.384 57.266 75.734 1.00 64.12 C ATOM 1144 NZ LYS B 650 9.948 57.271 75.348 1.00 60.59 N ATOM 1145 HZ1 LYS B 650 9.697 56.349 74.938 1.00 0.00 H ATOM 1146 HZ2 LYS B 650 9.364 57.447 76.191 1.00 0.00 H ATOM 1147 HZ3 LYS B 650 9.781 58.020 74.646 1.00 0.00 H ATOM 1148 H LYS B 650 15.023 54.967 75.805 1.00 0.00 H ATOM 1149 N LEU B 651 15.316 52.320 77.793 1.00 54.57 N ATOM 1150 CA LEU B 651 15.553 50.980 78.319 1.00 45.23 C ATOM 1151 C LEU B 651 16.992 50.821 78.793 1.00 44.36 C ATOM 1152 O LEU B 651 17.243 50.226 79.847 1.00 40.68 O ATOM 1153 CB LEU B 651 15.220 49.937 77.253 1.00 51.54 C ATOM 1154 CG LEU B 651 14.741 48.572 77.745 1.00 68.01 C ATOM 1155 CD1 LEU B 651 13.345 48.683 78.343 1.00 54.79 C ATOM 1156 CD2 LEU B 651 14.768 47.557 76.615 1.00 63.16 C ATOM 1157 H LEU B 651 15.090 52.445 76.786 1.00 0.00 H ATOM 1158 N GLU B 652 17.950 51.353 78.030 1.00 47.47 N ATOM 1159 CA GLU B 652 19.355 51.218 78.403 1.00 39.95 C ATOM 1160 C GLU B 652 19.654 51.946 79.706 1.00 35.99 C ATOM 1161 O GLU B 652 20.371 51.424 80.568 1.00 36.95 O ATOM 1162 CB GLU B 652 20.246 51.738 77.275 1.00 39.13 C ATOM 1163 CG GLU B 652 21.736 51.615 77.545 1.00 49.99 C ATOM 1164 CD GLU B 652 22.157 50.196 77.875 1.00 61.46 C ATOM 1165 OE1 GLU B 652 23.005 50.022 78.775 1.00 56.86 O ATOM 1166 OE2 GLU B 652 21.637 49.254 77.239 1.00 66.81 O ATOM 1167 H GLU B 652 17.693 51.867 77.163 1.00 0.00 H ATOM 1168 N VAL B 653 19.112 53.155 79.871 1.00 44.39 N ATOM 1169 CA VAL B 653 19.294 53.887 81.119 1.00 34.38 C ATOM 1170 C VAL B 653 18.547 53.205 82.259 1.00 39.17 C ATOM 1171 O VAL B 653 19.016 53.199 83.404 1.00 32.06 O ATOM 1172 CB VAL B 653 18.849 55.351 80.938 1.00 39.55 C ATOM 1173 CG1 VAL B 653 18.940 56.113 82.252 1.00 38.55 C ATOM 1174 CG2 VAL B 653 19.693 56.027 79.868 1.00 35.11 C ATOM 1175 H VAL B 653 18.555 53.579 79.102 1.00 0.00 H ATOM 1176 N ALA B 654 17.387 52.608 81.969 1.00 30.43 N ATOM 1177 CA ALA B 654 16.631 51.912 83.005 1.00 32.01 C ATOM 1178 C ALA B 654 17.392 50.700 83.529 1.00 30.02 C ATOM 1179 O ALA B 654 17.383 50.426 84.735 1.00 30.29 O ATOM 1180 CB ALA B 654 15.264 51.492 82.466 1.00 28.43 C ATOM 1181 H ALA B 654 17.020 52.640 80.996 1.00 0.00 H ATOM 1182 N LYS B 655 18.055 49.960 82.637 1.00 30.68 N ATOM 1183 CA LYS B 655 18.826 48.798 83.070 1.00 23.63 C ATOM 1184 C LYS B 655 20.023 49.209 83.915 1.00 23.98 C ATOM 1185 O LYS B 655 20.315 48.576 84.936 1.00 22.73 O ATOM 1186 CB LYS B 655 19.286 47.991 81.859 1.00 23.77 C ATOM 1187 CG LYS B 655 18.155 47.455 81.016 1.00 29.21 C ATOM 1188 CD LYS B 655 18.682 46.746 79.788 1.00 27.89 C ATOM 1189 CE LYS B 655 17.541 46.289 78.902 1.00 45.36 C ATOM 1190 NZ LYS B 655 18.027 45.477 77.755 1.00 53.28 N ATOM 1191 HZ1 LYS B 655 18.680 46.047 77.181 1.00 0.00 H ATOM 1192 HZ2 LYS B 655 18.522 44.635 78.113 1.00 0.00 H ATOM 1193 HZ3 LYS B 655 17.217 45.183 77.172 1.00 0.00 H ATOM 1194 H LYS B 655 18.022 50.213 81.629 1.00 0.00 H ATOM 1195 N GLN B 656 20.732 50.262 83.501 1.00 28.29 N ATOM 1196 CA GLN B 656 21.894 50.715 84.258 1.00 29.46 C ATOM 1197 C GLN B 656 21.494 51.197 85.646 1.00 28.15 C ATOM 1198 O GLN B 656 22.226 50.987 86.620 1.00 23.82 O ATOM 1199 CB GLN B 656 22.621 51.820 83.491 1.00 25.06 C ATOM 1200 CG GLN B 656 23.202 51.370 82.161 1.00 23.92 C ATOM 1201 CD GLN B 656 23.814 52.512 81.375 1.00 34.93 C ATOM 1202 OE1 GLN B 656 24.128 53.564 81.930 1.00 32.76 O ATOM 1203 NE2 GLN B 656 23.981 52.311 80.073 1.00 40.97 N ATOM 1204 HE22 GLN B 656 23.701 51.405 79.647 1.00 0.00 H ATOM 1205 HE21 GLN B 656 24.392 53.060 79.480 1.00 0.00 H ATOM 1206 H GLN B 656 20.454 50.763 82.633 1.00 0.00 H ATOM 1207 N LEU B 657 20.331 51.844 85.759 1.00 29.84 N ATOM 1208 CA LEU B 657 19.853 52.259 87.073 1.00 29.85 C ATOM 1209 C LEU B 657 19.457 51.055 87.917 1.00 28.59 C ATOM 1210 O LEU B 657 19.805 50.980 89.101 1.00 33.22 O ATOM 1211 CB LEU B 657 18.679 53.226 86.930 1.00 23.12 C ATOM 1212 CG LEU B 657 18.101 53.744 88.249 1.00 26.81 C ATOM 1213 CD1 LEU B 657 19.166 54.474 89.053 1.00 24.60 C ATOM 1214 CD2 LEU B 657 16.903 54.643 87.998 1.00 31.16 C ATOM 1215 H LEU B 657 19.767 52.052 84.911 1.00 0.00 H ATOM 1216 N ALA B 658 18.737 50.099 87.325 1.00 22.51 N ATOM 1217 CA ALA B 658 18.359 48.898 88.063 1.00 24.33 C ATOM 1218 C ALA B 658 19.587 48.096 88.473 1.00 26.81 C ATOM 1219 O ALA B 658 19.618 47.508 89.561 1.00 27.38 O ATOM 1220 CB ALA B 658 17.409 48.043 87.224 1.00 25.45 C ATOM 1221 H ALA B 658 18.444 50.211 86.333 1.00 0.00 H ATOM 1222 N ALA B 659 20.611 48.061 87.616 1.00 28.37 N ATOM 1223 CA ALA B 659 21.853 47.381 87.972 1.00 26.59 C ATOM 1224 C ALA B 659 22.514 48.042 89.174 1.00 22.77 C ATOM 1225 O ALA B 659 23.051 47.356 90.052 1.00 26.86 O ATOM 1226 CB ALA B 659 22.806 47.364 86.778 1.00 13.33 C ATOM 1227 H ALA B 659 20.523 48.522 86.688 1.00 0.00 H ATOM 1228 N ALA B 660 22.486 49.375 89.231 1.00 29.58 N ATOM 1229 CA ALA B 660 23.012 50.076 90.397 1.00 22.90 C ATOM 1230 C ALA B 660 22.183 49.776 91.638 1.00 32.76 C ATOM 1231 O ALA B 660 22.735 49.554 92.722 1.00 35.86 O ATOM 1232 CB ALA B 660 23.056 51.580 90.130 1.00 23.39 C ATOM 1233 H ALA B 660 22.086 49.918 88.439 1.00 0.00 H ATOM 1234 N MET B 661 20.854 49.762 91.500 1.00 30.16 N ATOM 1235 CA MET B 661 19.999 49.443 92.638 1.00 27.61 C ATOM 1236 C MET B 661 20.121 47.979 93.041 1.00 32.61 C ATOM 1237 O MET B 661 20.015 47.656 94.229 1.00 32.13 O ATOM 1238 CB MET B 661 18.545 49.783 92.317 1.00 29.64 C ATOM 1239 CG MET B 661 18.313 51.220 91.879 1.00 26.96 C ATOM 1240 SD MET B 661 18.977 52.421 93.043 1.00 37.12 S ATOM 1241 CE MET B 661 18.119 51.950 94.539 1.00 22.47 C ATOM 1242 H MET B 661 20.427 49.980 90.577 1.00 0.00 H ATOM 1243 N HIS B 662 20.336 47.084 92.074 1.00 28.71 N ATOM 1244 CA HIS B 662 20.565 45.682 92.409 1.00 31.64 C ATOM 1245 C HIS B 662 21.854 45.516 93.203 1.00 33.32 C ATOM 1246 O HIS B 662 21.930 44.684 94.115 1.00 35.84 O ATOM 1247 CB HIS B 662 20.602 44.835 91.137 1.00 27.51 C ATOM 1248 CG HIS B 662 20.796 43.373 91.390 1.00 41.77 C ATOM 1249 ND1 HIS B 662 20.069 42.677 92.331 1.00 42.42 N ATOM 1250 CD2 HIS B 662 21.633 42.473 90.821 1.00 49.42 C ATOM 1251 CE1 HIS B 662 20.451 41.412 92.333 1.00 43.24 C ATOM 1252 NE2 HIS B 662 21.398 41.262 91.426 1.00 46.99 N ATOM 1253 H HIS B 662 20.340 47.387 91.079 1.00 0.00 H ATOM 1254 N PHE B 663 22.878 46.305 92.870 1.00 30.85 N ATOM 1255 CA PHE B 663 24.122 46.273 93.632 1.00 31.52 C ATOM 1256 C PHE B 663 23.906 46.756 95.060 1.00 29.94 C ATOM 1257 O PHE B 663 24.458 46.186 96.008 1.00 35.48 O ATOM 1258 CB PHE B 663 25.181 47.120 92.926 1.00 35.07 C ATOM 1259 CG PHE B 663 26.467 47.255 93.691 1.00 33.23 C ATOM 1260 CD1 PHE B 663 27.398 46.229 93.698 1.00 39.09 C ATOM 1261 CD2 PHE B 663 26.753 48.417 94.390 1.00 36.56 C ATOM 1262 CE1 PHE B 663 28.585 46.354 94.396 1.00 35.25 C ATOM 1263 CE2 PHE B 663 27.937 48.548 95.090 1.00 31.95 C ATOM 1264 CZ PHE B 663 28.854 47.515 95.094 1.00 34.92 C ATOM 1265 H PHE B 663 22.788 46.949 92.059 1.00 0.00 H ATOM 1266 N LEU B 664 23.101 47.807 95.235 1.00 36.62 N ATOM 1267 CA LEU B 664 22.815 48.301 96.579 1.00 32.41 C ATOM 1268 C LEU B 664 21.958 47.313 97.361 1.00 38.97 C ATOM 1269 O LEU B 664 22.120 47.170 98.579 1.00 42.97 O ATOM 1270 CB LEU B 664 22.124 49.662 96.504 1.00 30.69 C ATOM 1271 CG LEU B 664 22.934 50.822 95.923 1.00 30.56 C ATOM 1272 CD1 LEU B 664 22.111 52.103 95.930 1.00 20.41 C ATOM 1273 CD2 LEU B 664 24.233 51.008 96.693 1.00 20.24 C ATOM 1274 H LEU B 664 22.676 48.276 94.410 1.00 0.00 H ATOM 1275 N GLU B 665 21.041 46.623 96.677 1.00 35.46 N ATOM 1276 CA GLU B 665 20.160 45.681 97.360 1.00 33.86 C ATOM 1277 C GLU B 665 20.939 44.496 97.919 1.00 31.54 C ATOM 1278 O GLU B 665 20.666 44.037 99.035 1.00 35.64 O ATOM 1279 CB GLU B 665 19.067 45.201 96.406 1.00 44.80 C ATOM 1280 CG GLU B 665 17.964 44.396 97.069 1.00 40.97 C ATOM 1281 CD GLU B 665 16.909 43.931 96.083 1.00 50.03 C ATOM 1282 OE1 GLU B 665 17.260 43.681 94.911 1.00 51.23 O ATOM 1283 OE2 GLU B 665 15.728 43.822 96.479 1.00 43.70 O ATOM 1284 H GLU B 665 20.954 46.758 95.649 1.00 0.00 H ATOM 1285 N GLU B 666 21.915 43.990 97.161 1.00 33.07 N ATOM 1286 CA GLU B 666 22.720 42.872 97.641 1.00 32.25 C ATOM 1287 C GLU B 666 23.584 43.271 98.829 1.00 33.71 C ATOM 1288 O GLU B 666 23.879 42.432 99.689 1.00 46.91 O ATOM 1289 CB GLU B 666 23.584 42.324 96.505 1.00 43.25 C ATOM 1290 CG GLU B 666 22.785 41.679 95.381 1.00 57.30 C ATOM 1291 CD GLU B 666 22.240 40.312 95.757 1.00 62.45 C ATOM 1292 OE1 GLU B 666 22.880 39.299 95.405 1.00 60.44 O ATOM 1293 OE2 GLU B 666 21.176 40.250 96.409 1.00 68.54 O ATOM 1294 H GLU B 666 22.103 44.396 96.222 1.00 0.00 H ATOM 1295 N ASN B 667 23.999 44.532 98.898 1.00 34.08 N ATOM 1296 CA ASN B 667 24.719 45.047 100.054 1.00 28.63 C ATOM 1297 C ASN B 667 23.788 45.548 101.150 1.00 41.63 C ATOM 1298 O ASN B 667 24.274 46.018 102.184 1.00 41.69 O ATOM 1299 CB ASN B 667 25.669 46.173 99.629 1.00 29.01 C ATOM 1300 CG ASN B 667 26.800 45.681 98.747 1.00 33.79 C ATOM 1301 OD1 ASN B 667 27.866 45.306 99.235 1.00 37.72 O ATOM 1302 ND2 ASN B 667 26.574 45.684 97.438 1.00 30.42 N ATOM 1303 HD22 ASN B 667 25.658 46.010 97.069 1.00 0.00 H ATOM 1304 HD21 ASN B 667 27.313 45.361 96.782 1.00 0.00 H ATOM 1305 H ASN B 667 23.803 45.171 98.101 1.00 0.00 H ATOM 1306 N THR B 668 22.472 45.444 100.950 1.00 38.99 N ATOM 1307 CA THR B 668 21.464 45.922 101.901 1.00 35.12 C ATOM 1308 C THR B 668 21.751 47.361 102.327 1.00 37.72 C ATOM 1309 O THR B 668 21.754 47.702 103.512 1.00 38.17 O ATOM 1310 CB THR B 668 21.359 44.998 103.118 1.00 39.98 C ATOM 1311 OG1 THR B 668 22.622 44.931 103.793 1.00 53.34 O ATOM 1312 CG2 THR B 668 20.939 43.601 102.689 1.00 39.74 C ATOM 1313 HG1 THR B 668 23.308 44.577 103.173 1.00 0.00 H ATOM 1314 H THR B 668 22.143 44.999 100.070 1.00 0.00 H ATOM 1315 N LEU B 669 21.993 48.210 101.334 1.00 41.50 N ATOM 1316 CA LEU B 669 22.323 49.614 101.545 1.00 34.41 C ATOM 1317 C LEU B 669 21.180 50.460 100.995 1.00 41.70 C ATOM 1318 O LEU B 669 20.951 50.490 99.782 1.00 40.22 O ATOM 1319 CB LEU B 669 23.646 49.959 100.868 1.00 49.40 C ATOM 1320 CG LEU B 669 24.263 51.318 101.187 1.00 59.47 C ATOM 1321 CD1 LEU B 669 24.611 51.416 102.665 1.00 61.57 C ATOM 1322 CD2 LEU B 669 25.493 51.534 100.323 1.00 64.09 C ATOM 1323 H LEU B 669 21.945 47.855 100.358 1.00 0.00 H ATOM 1324 N ILE B 670 20.468 51.142 101.886 1.00 32.40 N ATOM 1325 CA ILE B 670 19.311 51.942 101.498 1.00 37.41 C ATOM 1326 C ILE B 670 19.794 53.277 100.945 1.00 41.09 C ATOM 1327 O ILE B 670 20.510 54.019 101.625 1.00 47.40 O ATOM 1328 CB ILE B 670 18.360 52.148 102.685 1.00 44.27 C ATOM 1329 CG1 ILE B 670 17.887 50.799 103.229 1.00 39.89 C ATOM 1330 CG2 ILE B 670 17.177 53.013 102.277 1.00 33.17 C ATOM 1331 CD1 ILE B 670 17.230 50.888 104.588 1.00 45.07 C ATOM 1332 H ILE B 670 20.743 51.104 102.888 1.00 0.00 H ATOM 1333 N HIS B 671 19.401 53.585 99.710 1.00 37.47 N ATOM 1334 CA HIS B 671 19.728 54.871 99.108 1.00 35.28 C ATOM 1335 C HIS B 671 18.848 55.959 99.709 1.00 42.00 C ATOM 1336 O HIS B 671 19.326 56.803 100.474 1.00 41.28 O ATOM 1337 CB HIS B 671 19.562 54.815 97.589 1.00 36.58 C ATOM 1338 CG HIS B 671 20.056 56.037 96.880 1.00 34.66 C ATOM 1339 ND1 HIS B 671 19.301 57.185 96.759 1.00 33.43 N ATOM 1340 CD2 HIS B 671 21.226 56.288 96.247 1.00 30.29 C ATOM 1341 CE1 HIS B 671 19.986 58.090 96.084 1.00 29.01 C ATOM 1342 NE2 HIS B 671 21.158 57.572 95.763 1.00 33.39 N ATOM 1343 H HIS B 671 18.849 52.893 99.164 1.00 0.00 H ATOM 1344 N GLY B 672 17.561 55.948 99.367 1.00 39.96 N ATOM 1345 CA GLY B 672 16.593 56.821 99.994 1.00 32.64 C ATOM 1346 C GLY B 672 16.176 58.033 99.192 1.00 34.57 C ATOM 1347 O GLY B 672 15.337 58.806 99.670 1.00 36.70 O ATOM 1348 H GLY B 672 17.242 55.291 98.626 1.00 0.00 H ATOM 1349 N ASN B 673 16.725 58.232 98.000 1.00 36.70 N ATOM 1350 CA ASN B 673 16.362 59.385 97.188 1.00 35.53 C ATOM 1351 C ASN B 673 16.705 59.112 95.725 1.00 34.65 C ATOM 1352 O ASN B 673 17.487 59.818 95.092 1.00 34.69 O ATOM 1353 CB ASN B 673 17.057 60.645 97.700 1.00 42.62 C ATOM 1354 CG ASN B 673 16.532 61.909 97.046 1.00 42.45 C ATOM 1355 OD1 ASN B 673 15.462 61.910 96.436 1.00 53.97 O ATOM 1356 ND2 ASN B 673 17.284 62.994 97.173 1.00 44.73 N ATOM 1357 HD22 ASN B 673 18.181 62.947 97.697 1.00 0.00 H ATOM 1358 HD21 ASN B 673 16.977 63.892 96.748 1.00 0.00 H ATOM 1359 H ASN B 673 17.426 57.553 97.640 1.00 0.00 H ATOM 1360 N VAL B 674 16.105 58.068 95.163 1.00 28.35 N ATOM 1361 CA VAL B 674 16.283 57.755 93.750 1.00 23.94 C ATOM 1362 C VAL B 674 15.358 58.650 92.935 1.00 36.78 C ATOM 1363 O VAL B 674 14.134 58.611 93.100 1.00 38.49 O ATOM 1364 CB VAL B 674 16.007 56.271 93.472 1.00 29.41 C ATOM 1365 CG1 VAL B 674 16.335 55.930 92.024 1.00 26.40 C ATOM 1366 CG2 VAL B 674 16.809 55.395 94.421 1.00 23.52 C ATOM 1367 H VAL B 674 15.494 57.460 95.745 1.00 0.00 H ATOM 1368 N CYS B 675 15.944 59.471 92.068 1.00 35.16 N ATOM 1369 CA CYS B 675 15.176 60.340 91.188 1.00 33.30 C ATOM 1370 C CYS B 675 16.056 60.728 90.010 1.00 29.45 C ATOM 1371 O CYS B 675 17.284 60.621 90.068 1.00 36.73 O ATOM 1372 CB CYS B 675 14.663 61.585 91.921 1.00 36.03 C ATOM 1373 SG CYS B 675 15.942 62.559 92.746 1.00 47.40 S ATOM 1374 H CYS B 675 16.983 59.493 92.017 1.00 0.00 H ATOM 1375 N ALA B 676 15.407 61.179 88.934 1.00 33.40 N ATOM 1376 CA ALA B 676 16.134 61.558 87.728 1.00 33.62 C ATOM 1377 C ALA B 676 17.114 62.697 87.974 1.00 35.51 C ATOM 1378 O ALA B 676 18.059 62.867 87.194 1.00 33.18 O ATOM 1379 CB ALA B 676 15.151 61.943 86.622 1.00 34.45 C ATOM 1380 H ALA B 676 14.370 61.261 88.956 1.00 0.00 H ATOM 1381 N LYS B 677 16.916 63.478 89.038 1.00 39.38 N ATOM 1382 CA LYS B 677 17.835 64.568 89.346 1.00 42.28 C ATOM 1383 C LYS B 677 19.139 64.062 89.949 1.00 44.67 C ATOM 1384 O LYS B 677 20.195 64.666 89.726 1.00 45.92 O ATOM 1385 CB LYS B 677 17.165 65.566 90.292 1.00 32.99 C ATOM 1386 CG LYS B 677 17.978 66.822 90.548 1.00 55.13 C ATOM 1387 CD LYS B 677 17.216 67.810 91.415 1.00 70.77 C ATOM 1388 CE LYS B 677 18.014 69.088 91.630 1.00 62.85 C ATOM 1389 NZ LYS B 677 17.259 70.084 92.441 1.00 43.85 N ATOM 1390 HZ1 LYS B 677 16.375 70.330 91.951 1.00 0.00 H ATOM 1391 HZ2 LYS B 677 17.039 69.676 93.372 1.00 0.00 H ATOM 1392 HZ3 LYS B 677 17.838 70.939 92.564 1.00 0.00 H ATOM 1393 H LYS B 677 16.096 63.307 89.655 1.00 0.00 H ATOM 1394 N ASN B 678 19.093 62.965 90.703 1.00 39.44 N ATOM 1395 CA ASN B 678 20.286 62.374 91.294 1.00 31.48 C ATOM 1396 C ASN B 678 21.016 61.436 90.340 1.00 36.60 C ATOM 1397 O ASN B 678 21.891 60.684 90.780 1.00 37.57 O ATOM 1398 CB ASN B 678 19.926 61.625 92.580 1.00 30.11 C ATOM 1399 CG ASN B 678 19.483 62.554 93.690 1.00 35.75 C ATOM 1400 OD1 ASN B 678 19.765 63.752 93.662 1.00 44.68 O ATOM 1401 ND2 ASN B 678 18.790 62.005 94.681 1.00 39.79 N ATOM 1402 HD22 ASN B 678 18.574 60.988 94.664 1.00 0.00 H ATOM 1403 HD21 ASN B 678 18.463 62.592 95.475 1.00 0.00 H ATOM 1404 H ASN B 678 18.172 62.514 90.876 1.00 0.00 H ATOM 1405 N ILE B 679 20.680 61.464 89.054 1.00 35.52 N ATOM 1406 CA ILE B 679 21.312 60.623 88.044 1.00 31.37 C ATOM 1407 C ILE B 679 22.110 61.519 87.109 1.00 40.16 C ATOM 1408 O ILE B 679 21.597 62.536 86.626 1.00 37.97 O ATOM 1409 CB ILE B 679 20.270 59.797 87.271 1.00 25.49 C ATOM 1410 CG1 ILE B 679 19.519 58.869 88.229 1.00 31.64 C ATOM 1411 CG2 ILE B 679 20.934 59.003 86.158 1.00 26.45 C ATOM 1412 CD1 ILE B 679 18.409 58.080 87.575 1.00 33.64 C ATOM 1413 H ILE B 679 19.929 62.118 88.753 1.00 0.00 H ATOM 1414 N LEU B 680 23.360 61.145 86.858 1.00 38.14 N ATOM 1415 CA LEU B 680 24.264 61.925 86.027 1.00 32.26 C ATOM 1416 C LEU B 680 24.602 61.156 84.759 1.00 38.59 C ATOM 1417 O LEU B 680 24.894 59.958 84.807 1.00 39.56 O ATOM 1418 CB LEU B 680 25.545 62.276 86.789 1.00 40.35 C ATOM 1419 CG LEU B 680 25.393 63.356 87.862 1.00 52.12 C ATOM 1420 CD1 LEU B 680 24.494 64.472 87.348 1.00 46.69 C ATOM 1421 CD2 LEU B 680 24.865 62.790 89.175 1.00 49.17 C ATOM 1422 H LEU B 680 23.707 60.257 87.273 1.00 0.00 H ATOM 1423 N LEU B 681 24.564 61.855 83.627 1.00 38.01 N ATOM 1424 CA LEU B 681 24.778 61.256 82.310 1.00 38.80 C ATOM 1425 C LEU B 681 26.241 61.450 81.922 1.00 44.88 C ATOM 1426 O LEU B 681 26.634 62.524 81.462 1.00 43.88 O ATOM 1427 CB LEU B 681 23.841 61.879 81.283 1.00 32.98 C ATOM 1428 CG LEU B 681 23.836 61.243 79.893 1.00 36.06 C ATOM 1429 CD1 LEU B 681 23.146 59.888 79.931 1.00 35.93 C ATOM 1430 CD2 LEU B 681 23.172 62.166 78.887 1.00 46.53 C ATOM 1431 H LEU B 681 24.373 62.876 83.682 1.00 0.00 H ATOM 1432 N ILE B 682 27.044 60.400 82.095 1.00 50.59 N ATOM 1433 CA ILE B 682 28.480 60.503 81.855 1.00 43.14 C ATOM 1434 C ILE B 682 28.785 60.519 80.363 1.00 41.32 C ATOM 1435 O ILE B 682 29.570 61.346 79.885 1.00 52.48 O ATOM 1436 CB ILE B 682 29.220 59.360 82.571 1.00 39.00 C ATOM 1437 CG1 ILE B 682 29.237 59.606 84.078 1.00 47.54 C ATOM 1438 CG2 ILE B 682 30.635 59.210 82.028 1.00 40.56 C ATOM 1439 CD1 ILE B 682 30.158 58.682 84.822 1.00 62.25 C ATOM 1440 H ILE B 682 26.641 59.493 82.406 1.00 0.00 H ATOM 1441 N ARG B 683 28.187 59.602 79.611 1.00 37.66 N ATOM 1442 CA ARG B 683 28.376 59.523 78.170 1.00 38.35 C ATOM 1443 C ARG B 683 27.020 59.588 77.491 1.00 39.54 C ATOM 1444 O ARG B 683 26.104 58.847 77.861 1.00 54.19 O ATOM 1445 CB ARG B 683 29.092 58.231 77.764 1.00 46.54 C ATOM 1446 CG ARG B 683 30.587 58.206 78.018 1.00 59.64 C ATOM 1447 CD ARG B 683 31.087 56.776 77.934 1.00 57.54 C ATOM 1448 NE ARG B 683 30.118 55.930 77.244 1.00 56.56 N ATOM 1449 CZ ARG B 683 30.060 54.608 77.360 1.00 62.28 C ATOM 1450 NH1 ARG B 683 30.918 53.973 78.146 1.00 60.30 N ATOM 1451 NH2 ARG B 683 29.139 53.923 76.696 1.00 49.99 N ATOM 1452 HE ARG B 683 29.427 56.393 76.620 1.00 0.00 H ATOM 1453 HH12 ARG B 683 30.872 52.938 78.237 1.00 0.00 H ATOM 1454 HH11 ARG B 683 31.637 54.510 78.672 1.00 0.00 H ATOM 1455 HH22 ARG B 683 29.094 52.888 76.787 1.00 0.00 H ATOM 1456 HH21 ARG B 683 28.461 54.421 76.084 1.00 0.00 H ATOM 1457 H ARG B 683 27.558 58.913 80.070 1.00 0.00 H ATOM 1458 N GLU B 684 26.893 60.472 76.508 1.00 43.84 N ATOM 1459 CA GLU B 684 25.696 60.486 75.688 1.00 41.55 C ATOM 1460 C GLU B 684 25.676 59.272 74.766 1.00 47.40 C ATOM 1461 O GLU B 684 26.711 58.671 74.459 1.00 60.08 O ATOM 1462 CB GLU B 684 25.624 61.764 74.855 1.00 41.45 C ATOM 1463 CG GLU B 684 25.178 62.993 75.621 1.00 51.11 C ATOM 1464 CD GLU B 684 25.053 64.208 74.725 1.00 55.56 C ATOM 1465 OE1 GLU B 684 26.010 64.495 73.975 1.00 56.61 O ATOM 1466 OE2 GLU B 684 23.993 64.866 74.757 1.00 54.22 O ATOM 1467 H GLU B 684 27.654 61.157 76.325 1.00 0.00 H ATOM 1468 N GLU B 685 24.475 58.905 74.333 1.00 51.42 N ATOM 1469 CA GLU B 685 24.344 57.888 73.301 1.00 51.58 C ATOM 1470 C GLU B 685 25.047 58.352 72.034 1.00 63.71 C ATOM 1471 O GLU B 685 24.883 59.496 71.603 1.00 67.73 O ATOM 1472 CB GLU B 685 22.871 57.604 73.014 1.00 56.80 C ATOM 1473 CG GLU B 685 22.641 56.728 71.796 1.00 61.96 C ATOM 1474 CD GLU B 685 21.272 56.934 71.181 1.00 75.39 C ATOM 1475 OE1 GLU B 685 20.626 57.961 71.483 1.00 85.03 O ATOM 1476 OE2 GLU B 685 20.840 56.068 70.393 1.00 75.27 O ATOM 1477 H GLU B 685 23.623 59.347 74.734 1.00 0.00 H ATOM 1478 N ASP B 686 25.841 57.468 71.442 1.00 63.17 N ATOM 1479 CA ASP B 686 26.556 57.761 70.203 1.00 62.79 C ATOM 1480 C ASP B 686 25.832 57.040 69.072 1.00 70.39 C ATOM 1481 O ASP B 686 26.003 55.833 68.871 1.00 73.80 O ATOM 1482 CB ASP B 686 28.014 57.331 70.298 1.00 71.57 C ATOM 1483 CG ASP B 686 28.853 57.811 69.116 1.00 80.33 C ATOM 1484 OD1 ASP B 686 28.284 58.330 68.125 1.00 75.22 O ATOM 1485 OD2 ASP B 686 30.089 57.670 69.177 1.00 78.55 O ATOM 1486 H ASP B 686 25.958 56.531 71.877 1.00 0.00 H ATOM 1487 N ARG B 687 25.021 57.791 68.332 1.00 85.02 N ATOM 1488 CA ARG B 687 24.286 57.302 67.164 1.00 80.69 C ATOM 1489 C ARG B 687 25.160 57.009 66.003 1.00 84.39 C ATOM 1490 O ARG B 687 24.651 56.530 64.983 1.00 90.21 O ATOM 1491 CB ARG B 687 23.230 58.325 66.752 1.00 77.57 C ATOM 1492 CG ARG B 687 22.128 58.492 67.749 1.00 88.25 C ATOM 1493 CD ARG B 687 21.112 59.477 67.245 1.00 91.78 C ATOM 1494 NE ARG B 687 20.074 59.697 68.238 1.00 94.14 N ATOM 1495 CZ ARG B 687 19.116 60.604 68.101 1.00 95.92 C ATOM 1496 NH1 ARG B 687 18.197 60.758 69.043 1.00102.05 N ATOM 1497 NH2 ARG B 687 19.086 61.366 67.013 1.00 87.17 N ATOM 1498 HE ARG B 687 20.083 59.114 69.099 1.00 0.00 H ATOM 1499 HH12 ARG B 687 17.449 61.471 68.928 1.00 0.00 H ATOM 1500 HH11 ARG B 687 18.224 60.165 69.897 1.00 0.00 H ATOM 1501 HH22 ARG B 687 18.338 62.079 66.898 1.00 0.00 H ATOM 1502 HH21 ARG B 687 19.810 61.249 66.276 1.00 0.00 H ATOM 1503 H ARG B 687 24.901 58.789 68.600 1.00 0.00 H ATOM 1504 N LYS B 688 26.444 57.335 66.104 1.00 77.79 N ATOM 1505 CA LYS B 688 27.379 57.105 65.009 1.00 81.19 C ATOM 1506 C LYS B 688 27.905 55.679 65.028 1.00 79.82 C ATOM 1507 O LYS B 688 28.166 55.086 63.981 1.00 86.20 O ATOM 1508 CB LYS B 688 28.543 58.096 65.082 1.00 88.61 C ATOM 1509 CG LYS B 688 28.246 59.449 64.457 1.00 77.27 C ATOM 1510 CD LYS B 688 29.221 59.765 63.335 1.00 78.07 C ATOM 1511 CE LYS B 688 28.522 59.788 61.985 1.00 79.02 C ATOM 1512 NZ LYS B 688 29.290 60.567 60.975 1.00 74.63 N ATOM 1513 HZ1 LYS B 688 29.397 61.548 61.304 1.00 0.00 H ATOM 1514 HZ2 LYS B 688 30.229 60.138 60.849 1.00 0.00 H ATOM 1515 HZ3 LYS B 688 28.779 60.557 60.069 1.00 0.00 H ATOM 1516 H LYS B 688 26.791 57.765 66.985 1.00 0.00 H ATOM 1517 N THR B 689 28.058 55.133 66.229 1.00 77.64 N ATOM 1518 CA THR B 689 28.553 53.774 66.387 1.00 85.57 C ATOM 1519 C THR B 689 27.602 52.943 67.237 1.00 90.10 C ATOM 1520 O THR B 689 27.961 51.858 67.697 1.00 92.58 O ATOM 1521 CB THR B 689 29.952 53.755 67.030 1.00 74.10 C ATOM 1522 OG1 THR B 689 30.167 52.493 67.676 1.00 79.60 O ATOM 1523 CG2 THR B 689 30.084 54.872 68.054 1.00 91.99 C ATOM 1524 HG1 THR B 689 29.480 52.361 68.377 1.00 0.00 H ATOM 1525 H THR B 689 27.819 55.689 67.075 1.00 0.00 H ATOM 1526 N GLY B 690 26.389 53.447 67.447 1.00 75.78 N ATOM 1527 CA GLY B 690 25.431 52.723 68.240 1.00 69.88 C ATOM 1528 C GLY B 690 25.893 52.529 69.656 1.00 74.27 C ATOM 1529 O GLY B 690 25.510 51.603 70.280 1.00 87.58 O ATOM 1530 H GLY B 690 26.132 54.367 67.037 1.00 0.00 H ATOM 1531 N ASN B 691 26.725 53.399 70.170 1.00 69.08 N ATOM 1532 CA ASN B 691 27.214 53.215 71.494 1.00 65.83 C ATOM 1533 C ASN B 691 26.134 53.719 72.435 1.00 68.33 C ATOM 1534 O ASN B 691 25.586 54.750 72.200 1.00 56.57 O ATOM 1535 CB ASN B 691 28.525 53.949 71.628 1.00 53.83 C ATOM 1536 CG ASN B 691 29.487 53.258 72.544 1.00 58.13 C ATOM 1537 OD1 ASN B 691 29.939 52.182 72.271 1.00 72.53 O ATOM 1538 ND2 ASN B 691 29.802 53.881 73.632 1.00 52.09 N ATOM 1539 HD22 ASN B 691 29.389 54.814 73.835 1.00 0.00 H ATOM 1540 HD21 ASN B 691 30.468 53.449 74.304 1.00 0.00 H ATOM 1541 H ASN B 691 27.028 54.223 69.612 1.00 0.00 H ATOM 1542 N PRO B 692 25.826 52.973 73.494 1.00 53.58 N ATOM 1543 CA PRO B 692 24.761 53.360 74.414 1.00 40.64 C ATOM 1544 C PRO B 692 25.213 54.469 75.344 1.00 42.11 C ATOM 1545 O PRO B 692 26.420 54.708 75.503 1.00 48.90 O ATOM 1546 CB PRO B 692 24.485 52.066 75.188 1.00 43.59 C ATOM 1547 CG PRO B 692 25.800 51.366 75.189 1.00 47.46 C ATOM 1548 CD PRO B 692 26.447 51.691 73.866 1.00 43.72 C ATOM 1549 N PRO B 693 24.277 55.171 75.976 1.00 49.60 N ATOM 1550 CA PRO B 693 24.652 56.153 76.998 1.00 39.66 C ATOM 1551 C PRO B 693 25.089 55.463 78.281 1.00 40.80 C ATOM 1552 O PRO B 693 24.935 54.255 78.464 1.00 55.63 O ATOM 1553 CB PRO B 693 23.369 56.961 77.201 1.00 42.57 C ATOM 1554 CG PRO B 693 22.277 56.016 76.831 1.00 37.19 C ATOM 1555 CD PRO B 693 22.825 55.163 75.722 1.00 43.83 C ATOM 1556 N PHE B 694 25.649 56.262 79.185 1.00 39.23 N ATOM 1557 CA PHE B 694 26.111 55.762 80.470 1.00 35.26 C ATOM 1558 C PHE B 694 25.687 56.734 81.560 1.00 33.63 C ATOM 1559 O PHE B 694 25.716 57.951 81.360 1.00 37.93 O ATOM 1560 CB PHE B 694 27.633 55.576 80.487 1.00 33.51 C ATOM 1561 CG PHE B 694 28.115 54.631 81.550 1.00 35.03 C ATOM 1562 CD1 PHE B 694 28.345 55.077 82.840 1.00 27.49 C ATOM 1563 CD2 PHE B 694 28.337 53.295 81.258 1.00 31.70 C ATOM 1564 CE1 PHE B 694 28.787 54.208 83.820 1.00 39.06 C ATOM 1565 CE2 PHE B 694 28.780 52.421 82.233 1.00 28.08 C ATOM 1566 CZ PHE B 694 29.006 52.878 83.516 1.00 31.69 C ATOM 1567 H PHE B 694 25.760 57.273 78.967 1.00 0.00 H ATOM 1568 N ILE B 695 25.289 56.190 82.711 1.00 30.78 N ATOM 1569 CA ILE B 695 24.782 56.990 83.816 1.00 31.00 C ATOM 1570 C ILE B 695 25.493 56.596 85.103 1.00 32.82 C ATOM 1571 O ILE B 695 26.140 55.552 85.196 1.00 37.59 O ATOM 1572 CB ILE B 695 23.257 56.842 83.998 1.00 31.89 C ATOM 1573 CG1 ILE B 695 22.910 55.397 84.365 1.00 28.82 C ATOM 1574 CG2 ILE B 695 22.516 57.288 82.744 1.00 33.51 C ATOM 1575 CD1 ILE B 695 21.491 55.209 84.849 1.00 31.01 C ATOM 1576 H ILE B 695 25.343 55.157 82.823 1.00 0.00 H ATOM 1577 N LYS B 696 25.355 57.461 86.107 1.00 29.19 N ATOM 1578 CA LYS B 696 25.796 57.181 87.464 1.00 28.02 C ATOM 1579 C LYS B 696 24.759 57.722 88.437 1.00 32.20 C ATOM 1580 O LYS B 696 24.039 58.677 88.133 1.00 38.59 O ATOM 1581 CB LYS B 696 27.168 57.799 87.770 1.00 35.02 C ATOM 1582 CG LYS B 696 28.351 56.901 87.455 1.00 38.88 C ATOM 1583 CD LYS B 696 29.625 57.450 88.079 1.00 33.17 C ATOM 1584 CE LYS B 696 30.832 56.602 87.719 1.00 41.07 C ATOM 1585 NZ LYS B 696 32.093 57.160 88.282 1.00 42.55 N ATOM 1586 HZ1 LYS B 696 32.245 58.118 87.907 1.00 0.00 H ATOM 1587 HZ2 LYS B 696 32.021 57.200 89.319 1.00 0.00 H ATOM 1588 HZ3 LYS B 696 32.891 56.550 88.012 1.00 0.00 H ATOM 1589 H LYS B 696 24.911 58.381 85.911 1.00 0.00 H ATOM 1590 N LEU B 697 24.688 57.103 89.611 1.00 30.90 N ATOM 1591 CA LEU B 697 23.765 57.508 90.662 1.00 35.31 C ATOM 1592 C LEU B 697 24.537 58.225 91.760 1.00 36.96 C ATOM 1593 O LEU B 697 25.504 57.679 92.302 1.00 41.32 O ATOM 1594 CB LEU B 697 23.020 56.299 91.234 1.00 37.54 C ATOM 1595 CG LEU B 697 22.022 56.591 92.358 1.00 31.14 C ATOM 1596 CD1 LEU B 697 21.010 57.638 91.920 1.00 39.37 C ATOM 1597 CD2 LEU B 697 21.319 55.317 92.799 1.00 28.43 C ATOM 1598 H LEU B 697 25.319 56.295 89.787 1.00 0.00 H ATOM 1599 N SER B 698 24.111 59.444 92.084 1.00 29.01 N ATOM 1600 CA SER B 698 24.779 60.248 93.094 1.00 34.56 C ATOM 1601 C SER B 698 24.231 59.921 94.482 1.00 30.09 C ATOM 1602 O SER B 698 23.381 59.044 94.654 1.00 35.31 O ATOM 1603 CB SER B 698 24.625 61.735 92.780 1.00 45.94 C ATOM 1604 OG SER B 698 23.284 62.159 92.949 1.00 56.23 O ATOM 1605 HG SER B 698 22.697 61.645 92.340 1.00 0.00 H ATOM 1606 H SER B 698 23.276 59.832 91.600 1.00 0.00 H ATOM 1607 N ASP B 699 24.725 60.640 95.491 1.00 35.25 N ATOM 1608 CA ASP B 699 24.294 60.396 96.857 1.00 35.10 C ATOM 1609 C ASP B 699 22.889 60.957 97.087 1.00 41.51 C ATOM 1610 O ASP B 699 22.464 61.887 96.397 1.00 43.16 O ATOM 1611 CB ASP B 699 25.274 61.018 97.850 1.00 44.12 C ATOM 1612 CG ASP B 699 25.306 62.528 97.775 1.00 44.49 C ATOM 1613 OD1 ASP B 699 25.771 63.067 96.749 1.00 51.12 O ATOM 1614 OD2 ASP B 699 24.856 63.176 98.742 1.00 44.52 O ATOM 1615 H ASP B 699 25.426 61.383 95.298 1.00 0.00 H ATOM 1616 N PRO B 700 22.146 60.401 98.050 1.00 37.53 N ATOM 1617 CA PRO B 700 20.750 60.820 98.242 1.00 41.96 C ATOM 1618 C PRO B 700 20.580 62.164 98.927 1.00 47.15 C ATOM 1619 O PRO B 700 19.448 62.662 98.992 1.00 44.28 O ATOM 1620 CB PRO B 700 20.177 59.698 99.116 1.00 48.40 C ATOM 1621 CG PRO B 700 21.344 59.246 99.912 1.00 40.97 C ATOM 1622 CD PRO B 700 22.519 59.315 98.974 1.00 36.37 C ATOM 1623 N GLY B 701 21.648 62.765 99.441 1.00 45.54 N ATOM 1624 CA GLY B 701 21.501 63.983 100.207 1.00 42.20 C ATOM 1625 C GLY B 701 21.001 63.698 101.613 1.00 37.73 C ATOM 1626 O GLY B 701 21.045 62.568 102.106 1.00 46.96 O ATOM 1627 H GLY B 701 22.593 62.358 99.292 1.00 0.00 H ATOM 1628 N ILE B 702 20.508 64.755 102.263 1.00 43.88 N ATOM 1629 CA ILE B 702 20.051 64.634 103.642 1.00 48.08 C ATOM 1630 C ILE B 702 18.894 63.648 103.708 1.00 48.30 C ATOM 1631 O ILE B 702 17.973 63.684 102.882 1.00 61.04 O ATOM 1632 CB ILE B 702 19.659 66.010 104.203 1.00 54.62 C ATOM 1633 CG1 ILE B 702 20.855 66.968 104.174 1.00 54.57 C ATOM 1634 CG2 ILE B 702 19.147 65.880 105.628 1.00 62.33 C ATOM 1635 CD1 ILE B 702 20.961 67.802 102.915 1.00 59.89 C ATOM 1636 H ILE B 702 20.449 65.674 101.780 1.00 0.00 H ATOM 1637 N SER B 703 18.943 62.754 104.693 1.00 52.40 N ATOM 1638 CA SER B 703 17.982 61.664 104.781 1.00 54.87 C ATOM 1639 C SER B 703 16.580 62.182 105.087 1.00 56.18 C ATOM 1640 O SER B 703 16.397 63.170 105.803 1.00 58.00 O ATOM 1641 CB SER B 703 18.412 60.664 105.854 1.00 51.73 C ATOM 1642 OG SER B 703 17.514 59.570 105.923 1.00 49.74 O ATOM 1643 HG SER B 703 17.816 58.940 106.624 1.00 0.00 H ATOM 1644 H SER B 703 19.685 62.836 105.417 1.00 0.00 H ATOM 1645 N ILE B 704 15.579 61.490 104.534 1.00 54.73 N ATOM 1646 CA ILE B 704 14.190 61.860 104.772 1.00 53.20 C ATOM 1647 C ILE B 704 13.759 61.552 106.198 1.00 53.83 C ATOM 1648 O ILE B 704 12.757 62.101 106.670 1.00 61.90 O ATOM 1649 CB ILE B 704 13.258 61.151 103.774 1.00 45.11 C ATOM 1650 CG1 ILE B 704 13.422 59.634 103.885 1.00 52.21 C ATOM 1651 CG2 ILE B 704 13.532 61.632 102.357 1.00 43.92 C ATOM 1652 CD1 ILE B 704 12.174 58.857 103.534 1.00 45.93 C ATOM 1653 H ILE B 704 15.795 60.675 103.925 1.00 0.00 H ATOM 1654 N THR B 705 14.487 60.682 106.900 1.00 43.67 N ATOM 1655 CA THR B 705 14.220 60.420 108.309 1.00 51.43 C ATOM 1656 C THR B 705 14.563 61.603 109.203 1.00 62.47 C ATOM 1657 O THR B 705 14.459 61.480 110.428 1.00 67.59 O ATOM 1658 CB THR B 705 15.008 59.194 108.775 1.00 58.47 C ATOM 1659 OG1 THR B 705 16.411 59.452 108.644 1.00 46.43 O ATOM 1660 CG2 THR B 705 14.646 57.975 107.943 1.00 53.59 C ATOM 1661 HG1 THR B 705 16.623 59.641 107.696 1.00 0.00 H ATOM 1662 H THR B 705 15.265 60.177 106.430 1.00 0.00 H ATOM 1663 N VAL B 706 14.970 62.732 108.625 1.00 59.52 N ATOM 1664 CA VAL B 706 15.491 63.866 109.379 1.00 49.33 C ATOM 1665 C VAL B 706 14.891 65.154 108.824 1.00 62.07 C ATOM 1666 O VAL B 706 14.755 66.152 109.542 1.00 69.95 O ATOM 1667 CB VAL B 706 17.033 63.880 109.326 1.00 55.22 C ATOM 1668 CG1 VAL B 706 17.593 65.147 109.933 1.00 61.53 C ATOM 1669 CG2 VAL B 706 17.602 62.666 110.052 1.00 64.53 C ATOM 1670 H VAL B 706 14.914 62.808 107.589 1.00 0.00 H ATOM 1671 N LEU B 707 14.505 65.131 107.550 1.00 54.37 N ATOM 1672 CA LEU B 707 13.950 66.313 106.910 1.00 53.30 C ATOM 1673 C LEU B 707 12.575 66.653 107.488 1.00 52.47 C ATOM 1674 O LEU B 707 11.846 65.766 107.942 1.00 61.94 O ATOM 1675 CB LEU B 707 13.834 66.097 105.403 1.00 51.14 C ATOM 1676 CG LEU B 707 15.131 65.965 104.605 1.00 50.98 C ATOM 1677 CD1 LEU B 707 14.830 65.596 103.161 1.00 47.80 C ATOM 1678 CD2 LEU B 707 15.927 67.255 104.674 1.00 47.63 C ATOM 1679 H LEU B 707 14.602 64.252 107.003 1.00 0.00 H ATOM 1680 N PRO B 708 12.200 67.930 107.485 1.00 51.45 N ATOM 1681 CA PRO B 708 10.871 68.311 107.976 1.00 58.50 C ATOM 1682 C PRO B 708 9.770 67.837 107.038 1.00 54.55 C ATOM 1683 O PRO B 708 10.004 67.472 105.884 1.00 54.17 O ATOM 1684 CB PRO B 708 10.935 69.841 108.033 1.00 51.17 C ATOM 1685 CG PRO B 708 12.006 70.211 107.063 1.00 57.78 C ATOM 1686 CD PRO B 708 13.015 69.103 107.126 1.00 50.97 C ATOM 1687 N LYS B 709 8.539 67.863 107.559 1.00 53.49 N ATOM 1688 CA LYS B 709 7.420 67.255 106.844 1.00 51.03 C ATOM 1689 C LYS B 709 7.059 68.021 105.576 1.00 54.29 C ATOM 1690 O LYS B 709 6.508 67.433 104.639 1.00 56.97 O ATOM 1691 CB LYS B 709 6.199 67.149 107.760 1.00 61.84 C ATOM 1692 CG LYS B 709 5.383 68.428 107.881 1.00 70.28 C ATOM 1693 CD LYS B 709 4.132 68.213 108.718 1.00 76.23 C ATOM 1694 CE LYS B 709 3.194 69.405 108.623 1.00 75.39 C ATOM 1695 NZ LYS B 709 3.861 70.677 109.016 1.00 79.41 N ATOM 1696 HZ1 LYS B 709 4.193 70.604 109.999 1.00 0.00 H ATOM 1697 HZ2 LYS B 709 4.671 70.851 108.387 1.00 0.00 H ATOM 1698 HZ3 LYS B 709 3.183 71.462 108.936 1.00 0.00 H ATOM 1699 H LYS B 709 8.377 68.319 108.479 1.00 0.00 H ATOM 1700 N ASP B 710 7.355 69.322 105.520 1.00 57.63 N ATOM 1701 CA ASP B 710 7.012 70.090 104.327 1.00 55.43 C ATOM 1702 C ASP B 710 7.836 69.650 103.123 1.00 52.99 C ATOM 1703 O ASP B 710 7.343 69.684 101.989 1.00 51.21 O ATOM 1704 CB ASP B 710 7.194 71.588 104.586 1.00 55.40 C ATOM 1705 CG ASP B 710 8.602 71.941 105.032 1.00 75.42 C ATOM 1706 OD1 ASP B 710 9.385 71.016 105.336 1.00 83.65 O ATOM 1707 OD2 ASP B 710 8.927 73.147 105.075 1.00 74.48 O ATOM 1708 H ASP B 710 7.827 69.786 106.322 1.00 0.00 H ATOM 1709 N ILE B 711 9.080 69.225 103.346 1.00 47.77 N ATOM 1710 CA ILE B 711 9.914 68.758 102.244 1.00 54.68 C ATOM 1711 C ILE B 711 9.506 67.354 101.815 1.00 51.81 C ATOM 1712 O ILE B 711 9.457 67.049 100.618 1.00 51.90 O ATOM 1713 CB ILE B 711 11.401 68.823 102.641 1.00 50.30 C ATOM 1714 CG1 ILE B 711 11.791 70.255 103.016 1.00 51.85 C ATOM 1715 CG2 ILE B 711 12.282 68.305 101.514 1.00 41.25 C ATOM 1716 CD1 ILE B 711 11.585 71.259 101.902 1.00 56.44 C ATOM 1717 H ILE B 711 9.459 69.226 104.314 1.00 0.00 H ATOM 1718 N LEU B 712 9.200 66.480 102.779 1.00 45.36 N ATOM 1719 CA LEU B 712 8.809 65.112 102.450 1.00 42.90 C ATOM 1720 C LEU B 712 7.530 65.087 101.624 1.00 42.89 C ATOM 1721 O LEU B 712 7.464 64.430 100.579 1.00 46.66 O ATOM 1722 CB LEU B 712 8.638 64.291 103.728 1.00 41.05 C ATOM 1723 CG LEU B 712 9.794 63.365 104.104 1.00 43.66 C ATOM 1724 CD1 LEU B 712 11.067 64.158 104.314 1.00 53.89 C ATOM 1725 CD2 LEU B 712 9.450 62.563 105.346 1.00 53.38 C ATOM 1726 H LEU B 712 9.241 66.778 103.775 1.00 0.00 H ATOM 1727 N GLN B 713 6.497 65.798 102.083 1.00 47.65 N ATOM 1728 CA GLN B 713 5.251 65.862 101.326 1.00 40.40 C ATOM 1729 C GLN B 713 5.457 66.521 99.970 1.00 44.76 C ATOM 1730 O GLN B 713 4.717 66.238 99.021 1.00 42.90 O ATOM 1731 CB GLN B 713 4.189 66.609 102.134 1.00 46.16 C ATOM 1732 CG GLN B 713 3.941 66.012 103.511 1.00 54.26 C ATOM 1733 CD GLN B 713 2.940 66.805 104.325 1.00 56.86 C ATOM 1734 OE1 GLN B 713 2.270 67.699 103.808 1.00 63.50 O ATOM 1735 NE2 GLN B 713 2.835 66.483 105.609 1.00 55.37 N ATOM 1736 HE22 GLN B 713 3.422 65.720 106.003 1.00 0.00 H ATOM 1737 HE21 GLN B 713 2.166 66.994 106.220 1.00 0.00 H ATOM 1738 H GLN B 713 6.581 66.309 102.985 1.00 0.00 H ATOM 1739 N GLU B 714 6.460 67.396 99.857 1.00 45.43 N ATOM 1740 CA GLU B 714 6.788 67.988 98.565 1.00 43.54 C ATOM 1741 C GLU B 714 7.416 66.965 97.627 1.00 46.05 C ATOM 1742 O GLU B 714 7.323 67.109 96.403 1.00 46.39 O ATOM 1743 CB GLU B 714 7.725 69.180 98.763 1.00 44.30 C ATOM 1744 CG GLU B 714 7.900 70.060 97.537 1.00 51.69 C ATOM 1745 CD GLU B 714 8.761 71.279 97.813 1.00 79.27 C ATOM 1746 OE1 GLU B 714 9.943 71.108 98.180 1.00 67.38 O ATOM 1747 OE2 GLU B 714 8.250 72.411 97.672 1.00 83.99 O ATOM 1748 H GLU B 714 7.012 67.658 100.698 1.00 0.00 H ATOM 1749 N ARG B 715 8.045 65.928 98.178 1.00 41.25 N ATOM 1750 CA ARG B 715 8.738 64.916 97.391 1.00 32.80 C ATOM 1751 C ARG B 715 7.824 63.797 96.904 1.00 41.62 C ATOM 1752 O ARG B 715 8.317 62.835 96.306 1.00 45.30 O ATOM 1753 CB ARG B 715 9.890 64.316 98.201 1.00 44.34 C ATOM 1754 CG ARG B 715 11.093 65.234 98.356 1.00 41.38 C ATOM 1755 CD ARG B 715 12.254 64.501 99.005 1.00 37.38 C ATOM 1756 NE ARG B 715 13.497 65.263 98.934 1.00 48.67 N ATOM 1757 CZ ARG B 715 14.686 64.786 99.286 1.00 46.78 C ATOM 1758 NH1 ARG B 715 14.798 63.542 99.734 1.00 44.46 N ATOM 1759 NH2 ARG B 715 15.765 65.550 99.188 1.00 50.20 N ATOM 1760 HE ARG B 715 13.449 66.242 98.586 1.00 0.00 H ATOM 1761 HH12 ARG B 715 15.730 63.170 100.009 1.00 0.00 H ATOM 1762 HH11 ARG B 715 13.954 62.939 99.810 1.00 0.00 H ATOM 1763 HH22 ARG B 715 16.695 65.175 99.464 1.00 0.00 H ATOM 1764 HH21 ARG B 715 15.682 66.525 98.835 1.00 0.00 H ATOM 1765 H ARG B 715 8.041 65.837 99.214 1.00 0.00 H ATOM 1766 N ILE B 716 6.525 63.887 97.153 1.00 30.64 N ATOM 1767 CA ILE B 716 5.583 62.918 96.578 1.00 33.34 C ATOM 1768 C ILE B 716 5.552 63.100 95.065 1.00 34.95 C ATOM 1769 O ILE B 716 5.523 64.249 94.588 1.00 27.73 O ATOM 1770 CB ILE B 716 4.193 63.106 97.196 1.00 42.15 C ATOM 1771 CG1 ILE B 716 4.184 62.602 98.642 1.00 31.83 C ATOM 1772 CG2 ILE B 716 3.110 62.413 96.377 1.00 34.28 C ATOM 1773 CD1 ILE B 716 2.860 62.791 99.348 1.00 39.96 C ATOM 1774 H ILE B 716 6.169 64.652 97.762 1.00 0.00 H ATOM 1775 N PRO B 717 5.556 62.019 94.262 1.00 34.54 N ATOM 1776 CA PRO B 717 5.516 60.604 94.645 1.00 25.34 C ATOM 1777 C PRO B 717 6.862 59.878 94.682 1.00 34.35 C ATOM 1778 O PRO B 717 6.885 58.667 94.467 1.00 33.98 O ATOM 1779 CB PRO B 717 4.638 59.999 93.555 1.00 32.80 C ATOM 1780 CG PRO B 717 5.020 60.782 92.339 1.00 28.92 C ATOM 1781 CD PRO B 717 5.358 62.184 92.810 1.00 30.42 C ATOM 1782 N TRP B 718 7.961 60.586 94.942 1.00 33.54 N ATOM 1783 CA TRP B 718 9.239 59.892 95.070 1.00 34.96 C ATOM 1784 C TRP B 718 9.366 59.218 96.430 1.00 32.07 C ATOM 1785 O TRP B 718 9.808 58.067 96.517 1.00 32.26 O ATOM 1786 CB TRP B 718 10.396 60.861 94.828 1.00 32.62 C ATOM 1787 CG TRP B 718 10.504 61.290 93.398 1.00 29.84 C ATOM 1788 CD1 TRP B 718 11.167 60.643 92.397 1.00 30.47 C ATOM 1789 CD2 TRP B 718 9.920 62.455 92.805 1.00 32.91 C ATOM 1790 NE1 TRP B 718 11.036 61.335 91.218 1.00 31.84 N ATOM 1791 CE2 TRP B 718 10.275 62.452 91.442 1.00 34.16 C ATOM 1792 CE3 TRP B 718 9.134 63.503 93.296 1.00 32.71 C ATOM 1793 CZ2 TRP B 718 9.872 63.456 90.563 1.00 39.80 C ATOM 1794 CZ3 TRP B 718 8.735 64.497 92.422 1.00 30.38 C ATOM 1795 CH2 TRP B 718 9.104 64.467 91.072 1.00 40.07 C ATOM 1796 HE1 TRP B 718 11.447 61.057 90.304 1.00 0.00 H ATOM 1797 H TRP B 718 7.909 61.619 95.052 1.00 0.00 H ATOM 1798 N VAL B 719 8.978 59.908 97.493 1.00 38.21 N ATOM 1799 CA VAL B 719 8.927 59.281 98.817 1.00 31.13 C ATOM 1800 C VAL B 719 7.737 58.326 98.866 1.00 43.19 C ATOM 1801 O VAL B 719 6.609 58.730 98.530 1.00 38.50 O ATOM 1802 CB VAL B 719 8.827 60.349 99.907 1.00 38.65 C ATOM 1803 CG1 VAL B 719 8.591 59.709 101.260 1.00 49.22 C ATOM 1804 CG2 VAL B 719 10.091 61.190 99.936 1.00 43.71 C ATOM 1805 H VAL B 719 8.706 60.906 97.386 1.00 0.00 H ATOM 1806 N PRO B 720 7.928 57.071 99.264 1.00 34.92 N ATOM 1807 CA PRO B 720 6.825 56.101 99.242 1.00 38.53 C ATOM 1808 C PRO B 720 5.780 56.431 100.290 1.00 35.30 C ATOM 1809 O PRO B 720 6.049 57.199 101.228 1.00 37.29 O ATOM 1810 CB PRO B 720 7.528 54.768 99.546 1.00 34.61 C ATOM 1811 CG PRO B 720 8.731 55.157 100.325 1.00 36.69 C ATOM 1812 CD PRO B 720 9.182 56.472 99.751 1.00 40.37 C ATOM 1813 N PRO B 721 4.570 55.875 100.169 1.00 36.60 N ATOM 1814 CA PRO B 721 3.499 56.235 101.115 1.00 38.16 C ATOM 1815 C PRO B 721 3.772 55.821 102.551 1.00 38.95 C ATOM 1816 O PRO B 721 3.310 56.504 103.474 1.00 49.92 O ATOM 1817 CB PRO B 721 2.270 55.512 100.543 1.00 28.03 C ATOM 1818 CG PRO B 721 2.826 54.423 99.688 1.00 37.30 C ATOM 1819 CD PRO B 721 4.085 54.978 99.106 1.00 35.18 C ATOM 1820 N GLU B 722 4.501 54.725 102.776 1.00 40.74 N ATOM 1821 CA GLU B 722 4.789 54.307 104.144 1.00 49.18 C ATOM 1822 C GLU B 722 5.781 55.233 104.833 1.00 50.53 C ATOM 1823 O GLU B 722 5.836 55.254 106.068 1.00 47.83 O ATOM 1824 CB GLU B 722 5.314 52.870 104.170 1.00 35.16 C ATOM 1825 CG GLU B 722 6.682 52.683 103.540 1.00 45.77 C ATOM 1826 CD GLU B 722 6.609 52.444 102.045 1.00 49.46 C ATOM 1827 OE1 GLU B 722 5.608 52.851 101.419 1.00 40.68 O ATOM 1828 OE2 GLU B 722 7.553 51.839 101.495 1.00 45.58 O ATOM 1829 H GLU B 722 4.864 54.169 101.976 1.00 0.00 H ATOM 1830 N CYS B 723 6.566 55.997 104.069 1.00 48.43 N ATOM 1831 CA CYS B 723 7.441 56.993 104.674 1.00 55.58 C ATOM 1832 C CYS B 723 6.710 58.305 104.925 1.00 51.71 C ATOM 1833 O CYS B 723 7.096 59.064 105.822 1.00 52.89 O ATOM 1834 CB CYS B 723 8.668 57.230 103.793 1.00 45.27 C ATOM 1835 SG CYS B 723 9.848 55.860 103.757 1.00 50.77 S ATOM 1836 H CYS B 723 6.553 55.880 103.036 1.00 0.00 H ATOM 1837 N ILE B 724 5.663 58.589 104.147 1.00 47.85 N ATOM 1838 CA ILE B 724 4.810 59.735 104.444 1.00 42.41 C ATOM 1839 C ILE B 724 4.054 59.506 105.746 1.00 48.03 C ATOM 1840 O ILE B 724 3.913 60.420 106.568 1.00 53.93 O ATOM 1841 CB ILE B 724 3.854 60.007 103.269 1.00 44.78 C ATOM 1842 CG1 ILE B 724 4.640 60.407 102.018 1.00 45.73 C ATOM 1843 CG2 ILE B 724 2.848 61.088 103.636 1.00 46.56 C ATOM 1844 CD1 ILE B 724 5.376 61.724 102.151 1.00 41.53 C ATOM 1845 H ILE B 724 5.454 57.989 103.323 1.00 0.00 H ATOM 1846 N GLU B 725 3.556 58.283 105.956 1.00 56.65 N ATOM 1847 CA GLU B 725 2.964 57.936 107.245 1.00 55.24 C ATOM 1848 C GLU B 725 3.979 58.086 108.369 1.00 52.19 C ATOM 1849 O GLU B 725 3.658 58.609 109.443 1.00 58.07 O ATOM 1850 CB GLU B 725 2.428 56.505 107.216 1.00 55.93 C ATOM 1851 CG GLU B 725 1.136 56.311 106.447 1.00 58.91 C ATOM 1852 CD GLU B 725 0.682 54.862 106.453 1.00 88.78 C ATOM 1853 OE1 GLU B 725 1.544 53.970 106.607 1.00 78.68 O ATOM 1854 OE2 GLU B 725 -0.534 54.615 106.311 1.00 89.34 O ATOM 1855 H GLU B 725 3.591 57.574 105.196 1.00 0.00 H ATOM 1856 N ASN B 726 5.206 57.634 108.138 1.00 54.49 N ATOM 1857 CA ASN B 726 6.260 57.669 109.139 1.00 50.60 C ATOM 1858 C ASN B 726 7.611 57.513 108.454 1.00 57.58 C ATOM 1859 O ASN B 726 7.885 56.463 107.859 1.00 67.86 O ATOM 1860 CB ASN B 726 6.050 56.567 110.178 1.00 55.89 C ATOM 1861 CG ASN B 726 7.085 56.600 111.280 1.00 63.15 C ATOM 1862 OD1 ASN B 726 7.721 57.626 111.519 1.00 72.95 O ATOM 1863 ND2 ASN B 726 7.260 55.474 111.962 1.00 66.16 N ATOM 1864 HD22 ASN B 726 6.700 54.630 111.725 1.00 0.00 H ATOM 1865 HD21 ASN B 726 7.957 55.436 112.733 1.00 0.00 H ATOM 1866 H ASN B 726 5.422 57.238 107.201 1.00 0.00 H ATOM 1867 N PRO B 727 8.477 58.529 108.508 1.00 63.43 N ATOM 1868 CA PRO B 727 9.797 58.409 107.865 1.00 61.02 C ATOM 1869 C PRO B 727 10.643 57.277 108.422 1.00 54.82 C ATOM 1870 O PRO B 727 11.631 56.896 107.784 1.00 55.52 O ATOM 1871 CB PRO B 727 10.449 59.773 108.135 1.00 52.31 C ATOM 1872 CG PRO B 727 9.308 60.692 108.442 1.00 56.04 C ATOM 1873 CD PRO B 727 8.279 59.850 109.125 1.00 57.19 C ATOM 1874 N LYS B 728 10.285 56.728 109.584 1.00 49.16 N ATOM 1875 CA LYS B 728 11.022 55.617 110.167 1.00 56.79 C ATOM 1876 C LYS B 728 10.814 54.311 109.414 1.00 65.47 C ATOM 1877 O LYS B 728 11.510 53.333 109.705 1.00 56.16 O ATOM 1878 CB LYS B 728 10.617 55.447 111.631 1.00 70.39 C ATOM 1879 CG LYS B 728 10.654 56.746 112.415 1.00 83.97 C ATOM 1880 CD LYS B 728 9.964 56.624 113.763 1.00 93.45 C ATOM 1881 CE LYS B 728 10.646 55.604 114.656 1.00 86.90 C ATOM 1882 NZ LYS B 728 12.049 55.986 114.961 1.00 75.43 N ATOM 1883 HZ1 LYS B 728 12.588 56.056 114.075 1.00 0.00 H ATOM 1884 HZ2 LYS B 728 12.059 56.905 115.448 1.00 0.00 H ATOM 1885 HZ3 LYS B 728 12.479 55.263 115.573 1.00 0.00 H ATOM 1886 H LYS B 728 9.456 57.104 110.087 1.00 0.00 H ATOM 1887 N ASN B 729 9.878 54.268 108.468 1.00 57.48 N ATOM 1888 CA ASN B 729 9.681 53.102 107.618 1.00 53.14 C ATOM 1889 C ASN B 729 10.662 53.048 106.455 1.00 51.51 C ATOM 1890 O ASN B 729 10.440 52.279 105.514 1.00 55.62 O ATOM 1891 CB ASN B 729 8.246 53.075 107.084 1.00 55.97 C ATOM 1892 CG ASN B 729 7.228 52.774 108.165 1.00 64.54 C ATOM 1893 OD1 ASN B 729 7.455 51.927 109.028 1.00 60.15 O ATOM 1894 ND2 ASN B 729 6.098 53.472 108.125 1.00 57.14 N ATOM 1895 HD22 ASN B 729 5.949 54.178 107.376 1.00 0.00 H ATOM 1896 HD21 ASN B 729 5.362 53.312 108.842 1.00 0.00 H ATOM 1897 H ASN B 729 9.265 55.097 108.331 1.00 0.00 H ATOM 1898 N LEU B 730 11.727 53.846 106.494 1.00 54.71 N ATOM 1899 CA LEU B 730 12.733 53.814 105.441 1.00 54.51 C ATOM 1900 C LEU B 730 13.368 52.432 105.376 1.00 51.88 C ATOM 1901 O LEU B 730 13.929 51.947 106.364 1.00 56.81 O ATOM 1902 CB LEU B 730 13.792 54.887 105.693 1.00 53.63 C ATOM 1903 CG LEU B 730 14.805 55.113 104.569 1.00 43.31 C ATOM 1904 CD1 LEU B 730 14.090 55.381 103.257 1.00 44.41 C ATOM 1905 CD2 LEU B 730 15.736 56.263 104.913 1.00 48.55 C ATOM 1906 H LEU B 730 11.843 54.504 107.291 1.00 0.00 H ATOM 1907 N ASN B 731 13.272 51.797 104.211 1.00 51.81 N ATOM 1908 CA ASN B 731 13.654 50.402 104.066 1.00 51.61 C ATOM 1909 C ASN B 731 14.163 50.181 102.648 1.00 45.61 C ATOM 1910 O ASN B 731 14.131 51.083 101.807 1.00 42.39 O ATOM 1911 CB ASN B 731 12.470 49.479 104.386 1.00 49.55 C ATOM 1912 CG ASN B 731 12.884 48.035 104.582 1.00 68.72 C ATOM 1913 OD1 ASN B 731 13.985 47.750 105.054 1.00 73.22 O ATOM 1914 ND2 ASN B 731 12.003 47.113 104.212 1.00 56.57 N ATOM 1915 HD22 ASN B 731 11.084 47.400 103.818 1.00 0.00 H ATOM 1916 HD21 ASN B 731 12.232 46.104 104.316 1.00 0.00 H ATOM 1917 H ASN B 731 12.914 52.312 103.382 1.00 0.00 H ATOM 1918 N LEU B 732 14.648 48.962 102.392 1.00 49.39 N ATOM 1919 CA LEU B 732 15.022 48.586 101.033 1.00 46.37 C ATOM 1920 C LEU B 732 13.839 48.697 100.079 1.00 43.54 C ATOM 1921 O LEU B 732 14.025 48.971 98.888 1.00 50.98 O ATOM 1922 CB LEU B 732 15.584 47.164 101.013 1.00 43.51 C ATOM 1923 CG LEU B 732 16.976 46.936 101.607 1.00 43.98 C ATOM 1924 CD1 LEU B 732 17.296 45.450 101.648 1.00 34.44 C ATOM 1925 CD2 LEU B 732 18.027 47.687 100.807 1.00 33.88 C ATOM 1926 H LEU B 732 14.759 48.277 103.167 1.00 0.00 H ATOM 1927 N ALA B 733 12.619 48.491 100.583 1.00 42.74 N ATOM 1928 CA ALA B 733 11.432 48.607 99.746 1.00 38.41 C ATOM 1929 C ALA B 733 11.161 50.043 99.317 1.00 42.27 C ATOM 1930 O ALA B 733 10.439 50.256 98.337 1.00 42.45 O ATOM 1931 CB ALA B 733 10.214 48.045 100.480 1.00 33.90 C ATOM 1932 H ALA B 733 12.515 48.244 101.588 1.00 0.00 H ATOM 1933 N THR B 734 11.713 51.028 100.031 1.00 36.30 N ATOM 1934 CA THR B 734 11.557 52.420 99.618 1.00 42.03 C ATOM 1935 C THR B 734 12.197 52.664 98.258 1.00 37.81 C ATOM 1936 O THR B 734 11.621 53.349 97.403 1.00 38.79 O ATOM 1937 CB THR B 734 12.166 53.350 100.669 1.00 39.79 C ATOM 1938 OG1 THR B 734 11.312 53.405 101.819 1.00 55.16 O ATOM 1939 CG2 THR B 734 12.358 54.754 100.107 1.00 37.16 C ATOM 1940 HG1 THR B 734 11.710 54.008 102.496 1.00 0.00 H ATOM 1941 H THR B 734 12.258 50.802 100.887 1.00 0.00 H ATOM 1942 N ASP B 735 13.385 52.098 98.033 1.00 35.89 N ATOM 1943 CA ASP B 735 14.089 52.318 96.775 1.00 33.26 C ATOM 1944 C ASP B 735 13.376 51.659 95.601 1.00 30.83 C ATOM 1945 O ASP B 735 13.531 52.103 94.457 1.00 26.55 O ATOM 1946 CB ASP B 735 15.523 51.805 96.889 1.00 25.93 C ATOM 1947 CG ASP B 735 16.386 52.683 97.777 1.00 43.36 C ATOM 1948 OD1 ASP B 735 16.264 53.925 97.691 1.00 32.85 O ATOM 1949 OD2 ASP B 735 17.185 52.132 98.563 1.00 45.87 O ATOM 1950 H ASP B 735 13.813 51.493 98.763 1.00 0.00 H ATOM 1951 N LYS B 736 12.599 50.604 95.857 1.00 28.51 N ATOM 1952 CA LYS B 736 11.808 49.993 94.794 1.00 26.36 C ATOM 1953 C LYS B 736 10.700 50.927 94.325 1.00 30.51 C ATOM 1954 O LYS B 736 10.439 51.039 93.121 1.00 30.47 O ATOM 1955 CB LYS B 736 11.223 48.666 95.276 1.00 26.29 C ATOM 1956 CG LYS B 736 12.260 47.609 95.610 1.00 19.69 C ATOM 1957 CD LYS B 736 11.682 46.567 96.553 1.00 43.78 C ATOM 1958 CE LYS B 736 12.517 45.298 96.567 1.00 39.24 C ATOM 1959 NZ LYS B 736 13.949 45.566 96.870 1.00 53.51 N ATOM 1960 HZ1 LYS B 736 14.342 46.202 96.147 1.00 0.00 H ATOM 1961 HZ2 LYS B 736 14.026 46.013 97.806 1.00 0.00 H ATOM 1962 HZ3 LYS B 736 14.476 44.670 96.868 1.00 0.00 H ATOM 1963 H LYS B 736 12.557 50.215 96.821 1.00 0.00 H ATOM 1964 N TRP B 737 10.034 51.603 95.265 1.00 33.08 N ATOM 1965 CA TRP B 737 9.008 52.574 94.900 1.00 28.68 C ATOM 1966 C TRP B 737 9.610 53.734 94.118 1.00 29.93 C ATOM 1967 O TRP B 737 9.129 54.085 93.034 1.00 30.39 O ATOM 1968 CB TRP B 737 8.299 53.080 96.160 1.00 32.00 C ATOM 1969 CG TRP B 737 7.263 54.143 95.909 1.00 26.18 C ATOM 1970 CD1 TRP B 737 7.488 55.465 95.650 1.00 31.28 C ATOM 1971 CD2 TRP B 737 5.839 53.974 95.912 1.00 35.49 C ATOM 1972 NE1 TRP B 737 6.295 56.125 95.481 1.00 35.52 N ATOM 1973 CE2 TRP B 737 5.268 55.233 95.638 1.00 31.53 C ATOM 1974 CE3 TRP B 737 4.992 52.880 96.118 1.00 29.21 C ATOM 1975 CZ2 TRP B 737 3.890 55.428 95.562 1.00 31.72 C ATOM 1976 CZ3 TRP B 737 3.624 53.075 96.040 1.00 29.22 C ATOM 1977 CH2 TRP B 737 3.087 54.340 95.765 1.00 28.75 C ATOM 1978 HE1 TRP B 737 6.189 57.138 95.268 1.00 0.00 H ATOM 1979 H TRP B 737 10.249 51.435 96.269 1.00 0.00 H ATOM 1980 N SER B 738 10.672 54.341 94.658 1.00 29.90 N ATOM 1981 CA SER B 738 11.281 55.500 94.012 1.00 24.53 C ATOM 1982 C SER B 738 11.836 55.153 92.638 1.00 25.93 C ATOM 1983 O SER B 738 11.866 56.009 91.747 1.00 26.32 O ATOM 1984 CB SER B 738 12.386 56.071 94.900 1.00 27.07 C ATOM 1985 OG SER B 738 11.924 56.271 96.224 1.00 31.66 O ATOM 1986 HG SER B 738 11.165 56.906 96.215 1.00 0.00 H ATOM 1987 H SER B 738 11.069 53.983 95.550 1.00 0.00 H ATOM 1988 N PHE B 739 12.285 53.910 92.450 1.00 26.59 N ATOM 1989 CA PHE B 739 12.725 53.475 91.129 1.00 23.83 C ATOM 1990 C PHE B 739 11.583 53.544 90.124 1.00 25.07 C ATOM 1991 O PHE B 739 11.784 53.947 88.972 1.00 24.22 O ATOM 1992 CB PHE B 739 13.291 52.057 91.210 1.00 26.96 C ATOM 1993 CG PHE B 739 13.627 51.456 89.874 1.00 29.66 C ATOM 1994 CD1 PHE B 739 14.838 51.731 89.261 1.00 25.52 C ATOM 1995 CD2 PHE B 739 12.737 50.604 89.238 1.00 24.65 C ATOM 1996 CE1 PHE B 739 15.152 51.175 88.034 1.00 27.75 C ATOM 1997 CE2 PHE B 739 13.044 50.046 88.012 1.00 28.38 C ATOM 1998 CZ PHE B 739 14.254 50.331 87.409 1.00 31.67 C ATOM 1999 H PHE B 739 12.321 53.247 93.251 1.00 0.00 H ATOM 2000 N GLY B 740 10.376 53.156 90.543 1.00 27.41 N ATOM 2001 CA GLY B 740 9.231 53.249 89.653 1.00 21.05 C ATOM 2002 C GLY B 740 8.895 54.682 89.288 1.00 23.95 C ATOM 2003 O GLY B 740 8.524 54.972 88.148 1.00 25.74 O ATOM 2004 H GLY B 740 10.255 52.787 91.508 1.00 0.00 H ATOM 2005 N THR B 741 9.023 55.598 90.250 1.00 28.92 N ATOM 2006 CA THR B 741 8.786 57.009 89.961 1.00 24.50 C ATOM 2007 C THR B 741 9.826 57.548 88.990 1.00 28.15 C ATOM 2008 O THR B 741 9.490 58.281 88.051 1.00 30.42 O ATOM 2009 CB THR B 741 8.794 57.821 91.255 1.00 25.13 C ATOM 2010 OG1 THR B 741 7.958 57.183 92.228 1.00 32.54 O ATOM 2011 CG2 THR B 741 8.275 59.227 90.999 1.00 37.78 C ATOM 2012 HG1 THR B 741 7.965 57.712 93.065 1.00 0.00 H ATOM 2013 H THR B 741 9.293 55.305 91.211 1.00 0.00 H ATOM 2014 N THR B 742 11.098 57.202 89.205 1.00 31.54 N ATOM 2015 CA THR B 742 12.143 57.582 88.259 1.00 30.69 C ATOM 2016 C THR B 742 11.884 56.970 86.890 1.00 30.11 C ATOM 2017 O THR B 742 12.062 57.631 85.859 1.00 28.28 O ATOM 2018 CB THR B 742 13.512 57.147 88.784 1.00 32.10 C ATOM 2019 OG1 THR B 742 13.745 57.742 90.066 1.00 27.78 O ATOM 2020 CG2 THR B 742 14.614 57.568 87.823 1.00 22.10 C ATOM 2021 HG1 THR B 742 13.041 57.449 90.697 1.00 0.00 H ATOM 2022 H THR B 742 11.347 56.656 90.055 1.00 0.00 H ATOM 2023 N LEU B 743 11.458 55.705 86.862 1.00 29.85 N ATOM 2024 CA LEU B 743 11.101 55.066 85.602 1.00 24.14 C ATOM 2025 C LEU B 743 9.959 55.800 84.913 1.00 30.68 C ATOM 2026 O LEU B 743 9.865 55.789 83.680 1.00 32.68 O ATOM 2027 CB LEU B 743 10.733 53.603 85.855 1.00 31.33 C ATOM 2028 CG LEU B 743 10.862 52.617 84.696 1.00 35.51 C ATOM 2029 CD1 LEU B 743 12.268 52.647 84.132 1.00 37.08 C ATOM 2030 CD2 LEU B 743 10.508 51.217 85.164 1.00 39.94 C ATOM 2031 H LEU B 743 11.380 55.169 87.750 1.00 0.00 H ATOM 2032 N TRP B 744 9.087 56.449 85.689 1.00 25.92 N ATOM 2033 CA TRP B 744 8.039 57.274 85.097 1.00 27.74 C ATOM 2034 C TRP B 744 8.614 58.568 84.533 1.00 37.17 C ATOM 2035 O TRP B 744 8.205 59.018 83.457 1.00 37.84 O ATOM 2036 CB TRP B 744 6.957 57.569 86.136 1.00 31.74 C ATOM 2037 CG TRP B 744 5.711 58.168 85.559 1.00 40.37 C ATOM 2038 CD1 TRP B 744 4.594 57.498 85.150 1.00 42.70 C ATOM 2039 CD2 TRP B 744 5.453 59.558 85.328 1.00 38.89 C ATOM 2040 NE1 TRP B 744 3.657 58.385 84.678 1.00 39.00 N ATOM 2041 CE2 TRP B 744 4.160 59.656 84.776 1.00 41.13 C ATOM 2042 CE3 TRP B 744 6.189 60.729 85.534 1.00 36.29 C ATOM 2043 CZ2 TRP B 744 3.587 60.878 84.427 1.00 32.79 C ATOM 2044 CZ3 TRP B 744 5.620 61.940 85.185 1.00 42.63 C ATOM 2045 CH2 TRP B 744 4.331 62.005 84.639 1.00 38.88 C ATOM 2046 HE1 TRP B 744 2.719 58.133 84.307 1.00 0.00 H ATOM 2047 H TRP B 744 9.155 56.366 86.723 1.00 0.00 H ATOM 2048 N GLU B 745 9.563 59.179 85.249 1.00 35.63 N ATOM 2049 CA GLU B 745 10.241 60.366 84.735 1.00 30.79 C ATOM 2050 C GLU B 745 10.926 60.078 83.406 1.00 31.96 C ATOM 2051 O GLU B 745 10.868 60.893 82.477 1.00 42.95 O ATOM 2052 CB GLU B 745 11.270 60.867 85.749 1.00 36.72 C ATOM 2053 CG GLU B 745 10.712 61.661 86.914 1.00 30.58 C ATOM 2054 CD GLU B 745 11.799 62.070 87.893 1.00 48.71 C ATOM 2055 OE1 GLU B 745 12.363 61.180 88.564 1.00 44.46 O ATOM 2056 OE2 GLU B 745 12.104 63.279 87.977 1.00 57.08 O ATOM 2057 H GLU B 745 9.822 58.804 86.184 1.00 0.00 H ATOM 2058 N ILE B 746 11.585 58.923 83.300 1.00 30.89 N ATOM 2059 CA ILE B 746 12.342 58.594 82.098 1.00 40.11 C ATOM 2060 C ILE B 746 11.418 58.431 80.897 1.00 38.28 C ATOM 2061 O ILE B 746 11.781 58.795 79.771 1.00 43.59 O ATOM 2062 CB ILE B 746 13.192 57.334 82.353 1.00 42.98 C ATOM 2063 CG1 ILE B 746 14.240 57.619 83.431 1.00 20.64 C ATOM 2064 CG2 ILE B 746 13.860 56.854 81.075 1.00 41.92 C ATOM 2065 CD1 ILE B 746 14.986 56.393 83.903 1.00 21.87 C ATOM 2066 H ILE B 746 11.558 58.245 84.088 1.00 0.00 H ATOM 2067 N CYS B 747 10.211 57.912 81.109 1.00 37.23 N ATOM 2068 CA CYS B 747 9.249 57.726 80.032 1.00 40.17 C ATOM 2069 C CYS B 747 8.360 58.942 79.805 1.00 47.62 C ATOM 2070 O CYS B 747 7.517 58.912 78.903 1.00 49.73 O ATOM 2071 CB CYS B 747 8.372 56.503 80.315 1.00 48.95 C ATOM 2072 SG CYS B 747 9.289 54.968 80.536 1.00 44.94 S ATOM 2073 H CYS B 747 9.947 57.630 82.075 1.00 0.00 H ATOM 2074 N SER B 748 8.524 60.004 80.592 1.00 46.69 N ATOM 2075 CA SER B 748 7.676 61.183 80.489 1.00 42.36 C ATOM 2076 C SER B 748 8.389 62.386 79.890 1.00 49.26 C ATOM 2077 O SER B 748 7.769 63.446 79.750 1.00 54.11 O ATOM 2078 CB SER B 748 7.117 61.553 81.868 1.00 41.35 C ATOM 2079 OG SER B 748 6.339 60.494 82.395 1.00 47.35 O ATOM 2080 HG SER B 748 6.903 59.685 82.485 1.00 0.00 H ATOM 2081 H SER B 748 9.283 59.991 81.303 1.00 0.00 H ATOM 2082 N GLY B 749 9.665 62.258 79.537 1.00 62.24 N ATOM 2083 CA GLY B 749 10.398 63.359 78.945 1.00 50.05 C ATOM 2084 C GLY B 749 10.563 64.545 79.872 1.00 62.78 C ATOM 2085 O GLY B 749 10.195 65.671 79.522 1.00 67.61 O ATOM 2086 H GLY B 749 10.147 61.349 79.689 1.00 0.00 H ATOM 2087 N GLY B 750 11.108 64.302 81.063 1.00 58.82 N ATOM 2088 CA GLY B 750 11.367 65.356 82.020 1.00 63.55 C ATOM 2089 C GLY B 750 10.182 65.793 82.855 1.00 62.86 C ATOM 2090 O GLY B 750 10.360 66.618 83.761 1.00 66.41 O ATOM 2091 H GLY B 750 11.355 63.323 81.313 1.00 0.00 H ATOM 2092 N ASP B 751 8.985 65.275 82.587 1.00 59.44 N ATOM 2093 CA ASP B 751 7.808 65.680 83.346 1.00 45.15 C ATOM 2094 C ASP B 751 7.914 65.210 84.791 1.00 46.83 C ATOM 2095 O ASP B 751 8.292 64.065 85.058 1.00 57.11 O ATOM 2096 CB ASP B 751 6.539 65.119 82.705 1.00 42.06 C ATOM 2097 CG ASP B 751 6.231 65.755 81.366 1.00 51.83 C ATOM 2098 OD1 ASP B 751 6.736 66.867 81.106 1.00 61.23 O ATOM 2099 OD2 ASP B 751 5.478 65.147 80.577 1.00 54.71 O ATOM 2100 H ASP B 751 8.888 64.572 81.826 1.00 0.00 H ATOM 2101 N LYS B 752 7.581 66.099 85.723 1.00 33.81 N ATOM 2102 CA LYS B 752 7.534 65.739 87.132 1.00 40.87 C ATOM 2103 C LYS B 752 6.154 65.195 87.465 1.00 35.90 C ATOM 2104 O LYS B 752 5.157 65.898 87.251 1.00 36.87 O ATOM 2105 CB LYS B 752 7.846 66.938 88.008 1.00 27.21 C ATOM 2106 CG LYS B 752 9.254 67.461 87.843 1.00 41.80 C ATOM 2107 CD LYS B 752 10.262 66.332 87.947 1.00 47.39 C ATOM 2108 CE LYS B 752 11.673 66.858 87.812 1.00 56.75 C ATOM 2109 NZ LYS B 752 11.853 67.629 86.550 1.00 53.77 N ATOM 2110 HZ1 LYS B 752 11.653 67.012 85.737 1.00 0.00 H ATOM 2111 HZ2 LYS B 752 11.199 68.437 86.543 1.00 0.00 H ATOM 2112 HZ3 LYS B 752 12.833 67.974 86.492 1.00 0.00 H ATOM 2113 H LYS B 752 7.349 67.072 85.438 1.00 0.00 H ATOM 2114 N PRO B 753 6.043 63.970 87.974 1.00 40.58 N ATOM 2115 CA PRO B 753 4.718 63.432 88.300 1.00 28.77 C ATOM 2116 C PRO B 753 4.042 64.252 89.388 1.00 33.73 C ATOM 2117 O PRO B 753 4.666 64.646 90.376 1.00 29.90 O ATOM 2118 CB PRO B 753 5.018 62.003 88.768 1.00 33.01 C ATOM 2119 CG PRO B 753 6.457 62.027 89.180 1.00 39.82 C ATOM 2120 CD PRO B 753 7.124 63.015 88.271 1.00 34.23 C ATOM 2121 N LEU B 754 2.750 64.519 89.181 1.00 32.60 N ATOM 2122 CA LEU B 754 1.932 65.290 90.118 1.00 29.53 C ATOM 2123 C LEU B 754 2.479 66.705 90.298 1.00 37.60 C ATOM 2124 O LEU B 754 2.528 67.236 91.409 1.00 44.50 O ATOM 2125 CB LEU B 754 1.808 64.576 91.467 1.00 25.96 C ATOM 2126 CG LEU B 754 1.454 63.087 91.430 1.00 26.44 C ATOM 2127 CD1 LEU B 754 1.253 62.551 92.839 1.00 20.02 C ATOM 2128 CD2 LEU B 754 0.226 62.825 90.568 1.00 18.17 C ATOM 2129 H LEU B 754 2.304 64.162 88.312 1.00 0.00 H ATOM 2130 N SER B 755 2.897 67.321 89.189 1.00 41.93 N ATOM 2131 CA SER B 755 3.361 68.704 89.244 1.00 34.77 C ATOM 2132 C SER B 755 2.228 69.648 89.622 1.00 33.91 C ATOM 2133 O SER B 755 2.403 70.532 90.468 1.00 35.65 O ATOM 2134 CB SER B 755 3.964 69.115 87.901 1.00 28.47 C ATOM 2135 OG SER B 755 4.945 68.191 87.472 1.00 44.33 O ATOM 2136 HG SER B 755 4.533 67.297 87.372 1.00 0.00 H ATOM 2137 H SER B 755 2.892 66.813 88.282 1.00 0.00 H ATOM 2138 N ALA B 756 1.054 69.465 89.014 1.00 33.67 N ATOM 2139 CA ALA B 756 -0.073 70.362 89.232 1.00 38.42 C ATOM 2140 C ALA B 756 -0.683 70.234 90.622 1.00 39.34 C ATOM 2141 O ALA B 756 -1.538 71.053 90.978 1.00 43.68 O ATOM 2142 CB ALA B 756 -1.148 70.112 88.174 1.00 26.13 C ATOM 2143 H ALA B 756 0.941 68.659 88.366 1.00 0.00 H ATOM 2144 N LEU B 757 -0.275 69.244 91.408 1.00 29.92 N ATOM 2145 CA LEU B 757 -0.818 69.028 92.741 1.00 37.87 C ATOM 2146 C LEU B 757 0.095 69.652 93.787 1.00 36.31 C ATOM 2147 O LEU B 757 1.321 69.547 93.696 1.00 48.58 O ATOM 2148 CB LEU B 757 -0.990 67.534 93.020 1.00 34.81 C ATOM 2149 CG LEU B 757 -1.957 66.784 92.102 1.00 33.83 C ATOM 2150 CD1 LEU B 757 -1.842 65.286 92.319 1.00 39.50 C ATOM 2151 CD2 LEU B 757 -3.384 67.251 92.336 1.00 36.40 C ATOM 2152 H LEU B 757 0.461 68.598 91.057 1.00 0.00 H ATOM 2153 N ASP B 758 -0.506 70.306 94.778 1.00 40.62 N ATOM 2154 CA ASP B 758 0.253 70.892 95.871 1.00 43.82 C ATOM 2155 C ASP B 758 0.468 69.837 96.957 1.00 41.45 C ATOM 2156 O ASP B 758 0.140 68.661 96.781 1.00 43.68 O ATOM 2157 CB ASP B 758 -0.450 72.138 96.405 1.00 45.05 C ATOM 2158 CG ASP B 758 -1.760 71.820 97.091 1.00 51.52 C ATOM 2159 OD1 ASP B 758 -2.548 71.030 96.533 1.00 55.38 O ATOM 2160 OD2 ASP B 758 -1.997 72.357 98.194 1.00 62.60 O ATOM 2161 H ASP B 758 -1.542 70.400 94.771 1.00 0.00 H ATOM 2162 N SER B 759 1.015 70.258 98.101 1.00 39.43 N ATOM 2163 CA SER B 759 1.394 69.310 99.147 1.00 37.62 C ATOM 2164 C SER B 759 0.195 68.511 99.643 1.00 48.00 C ATOM 2165 O SER B 759 0.249 67.278 99.730 1.00 51.95 O ATOM 2166 CB SER B 759 2.060 70.048 100.309 1.00 43.18 C ATOM 2167 OG SER B 759 3.440 70.253 100.064 1.00 50.00 O ATOM 2168 HG SER B 759 3.843 70.732 100.831 1.00 0.00 H ATOM 2169 H SER B 759 1.173 71.275 98.249 1.00 0.00 H ATOM 2170 N GLN B 760 -0.903 69.198 99.972 1.00 57.75 N ATOM 2171 CA GLN B 760 -2.041 68.518 100.583 1.00 47.81 C ATOM 2172 C GLN B 760 -2.780 67.637 99.586 1.00 43.34 C ATOM 2173 O GLN B 760 -3.354 66.614 99.975 1.00 39.82 O ATOM 2174 CB GLN B 760 -2.992 69.539 101.206 1.00 48.77 C ATOM 2175 CG GLN B 760 -3.274 69.290 102.684 1.00 62.29 C ATOM 2176 CD GLN B 760 -2.008 69.267 103.530 1.00 73.23 C ATOM 2177 OE1 GLN B 760 -0.987 69.850 103.165 1.00 72.10 O ATOM 2178 NE2 GLN B 760 -2.073 68.589 104.671 1.00 68.72 N ATOM 2179 HE22 GLN B 760 -2.956 68.111 104.942 1.00 0.00 H ATOM 2180 HE21 GLN B 760 -1.241 68.537 105.293 1.00 0.00 H ATOM 2181 H GLN B 760 -0.947 70.221 99.792 1.00 0.00 H ATOM 2182 N ARG B 761 -2.779 68.009 98.305 1.00 35.82 N ATOM 2183 CA ARG B 761 -3.363 67.148 97.287 1.00 38.44 C ATOM 2184 C ARG B 761 -2.437 66.003 96.900 1.00 50.48 C ATOM 2185 O ARG B 761 -2.895 65.030 96.291 1.00 46.76 O ATOM 2186 CB ARG B 761 -3.745 67.975 96.058 1.00 30.12 C ATOM 2187 CG ARG B 761 -4.951 68.867 96.309 1.00 50.67 C ATOM 2188 CD ARG B 761 -5.257 69.780 95.137 1.00 53.74 C ATOM 2189 NE ARG B 761 -6.333 70.711 95.465 1.00 61.78 N ATOM 2190 CZ ARG B 761 -6.759 71.681 94.662 1.00 72.37 C ATOM 2191 NH1 ARG B 761 -6.200 71.854 93.472 1.00 75.44 N ATOM 2192 NH2 ARG B 761 -7.744 72.479 95.050 1.00 57.43 N ATOM 2193 HE ARG B 761 -6.798 70.608 96.390 1.00 0.00 H ATOM 2194 HH12 ARG B 761 -6.535 72.614 92.846 1.00 0.00 H ATOM 2195 HH11 ARG B 761 -5.427 71.230 93.165 1.00 0.00 H ATOM 2196 HH22 ARG B 761 -8.077 73.238 94.421 1.00 0.00 H ATOM 2197 HH21 ARG B 761 -8.184 72.346 95.983 1.00 0.00 H ATOM 2198 H ARG B 761 -2.358 68.920 98.032 1.00 0.00 H ATOM 2199 N LYS B 762 -1.151 66.099 97.240 1.00 46.73 N ATOM 2200 CA LYS B 762 -0.272 64.941 97.149 1.00 40.60 C ATOM 2201 C LYS B 762 -0.519 63.981 98.305 1.00 51.53 C ATOM 2202 O LYS B 762 -0.496 62.759 98.119 1.00 47.22 O ATOM 2203 CB LYS B 762 1.189 65.388 97.122 1.00 39.79 C ATOM 2204 CG LYS B 762 1.610 66.048 95.821 1.00 39.50 C ATOM 2205 CD LYS B 762 2.981 66.688 95.946 1.00 33.35 C ATOM 2206 CE LYS B 762 3.407 67.334 94.640 1.00 38.06 C ATOM 2207 NZ LYS B 762 4.733 68.002 94.759 1.00 60.94 N ATOM 2208 HZ1 LYS B 762 4.683 68.742 95.488 1.00 0.00 H ATOM 2209 HZ2 LYS B 762 5.451 67.299 95.025 1.00 0.00 H ATOM 2210 HZ3 LYS B 762 4.987 68.430 93.846 1.00 0.00 H ATOM 2211 H LYS B 762 -0.772 67.009 97.573 1.00 0.00 H ATOM 2212 N LEU B 763 -0.755 64.518 99.505 1.00 45.85 N ATOM 2213 CA LEU B 763 -1.192 63.680 100.617 1.00 47.32 C ATOM 2214 C LEU B 763 -2.530 63.025 100.307 1.00 45.05 C ATOM 2215 O LEU B 763 -2.769 61.869 100.678 1.00 47.10 O ATOM 2216 CB LEU B 763 -1.284 64.512 101.895 1.00 40.45 C ATOM 2217 CG LEU B 763 -0.288 64.169 103.002 1.00 56.19 C ATOM 2218 CD1 LEU B 763 1.117 64.092 102.436 1.00 44.65 C ATOM 2219 CD2 LEU B 763 -0.363 65.196 104.122 1.00 60.58 C ATOM 2220 H LEU B 763 -0.626 65.540 99.648 1.00 0.00 H ATOM 2221 N GLN B 764 -3.418 63.754 99.625 1.00 52.01 N ATOM 2222 CA GLN B 764 -4.675 63.172 99.171 1.00 45.50 C ATOM 2223 C GLN B 764 -4.441 62.078 98.138 1.00 47.41 C ATOM 2224 O GLN B 764 -5.193 61.098 98.093 1.00 48.85 O ATOM 2225 CB GLN B 764 -5.572 64.271 98.596 1.00 41.47 C ATOM 2226 CG GLN B 764 -6.874 63.783 97.980 1.00 63.67 C ATOM 2227 CD GLN B 764 -7.891 63.347 99.016 1.00 65.64 C ATOM 2228 OE1 GLN B 764 -7.661 63.463 100.220 1.00 65.68 O ATOM 2229 NE2 GLN B 764 -9.029 62.846 98.550 1.00 77.02 N ATOM 2230 HE22 GLN B 764 -9.181 62.766 97.524 1.00 0.00 H ATOM 2231 HE21 GLN B 764 -9.769 62.533 99.211 1.00 0.00 H ATOM 2232 H GLN B 764 -3.209 64.751 99.415 1.00 0.00 H ATOM 2233 N PHE B 765 -3.402 62.226 97.312 1.00 44.28 N ATOM 2234 CA PHE B 765 -3.109 61.229 96.288 1.00 45.28 C ATOM 2235 C PHE B 765 -2.813 59.869 96.909 1.00 40.89 C ATOM 2236 O PHE B 765 -3.259 58.835 96.397 1.00 32.76 O ATOM 2237 CB PHE B 765 -1.934 61.705 95.431 1.00 36.78 C ATOM 2238 CG PHE B 765 -1.573 60.770 94.308 1.00 34.94 C ATOM 2239 CD1 PHE B 765 -0.646 59.758 94.499 1.00 28.47 C ATOM 2240 CD2 PHE B 765 -2.144 60.918 93.055 1.00 40.72 C ATOM 2241 CE1 PHE B 765 -0.308 58.903 93.468 1.00 32.76 C ATOM 2242 CE2 PHE B 765 -1.808 60.066 92.018 1.00 35.76 C ATOM 2243 CZ PHE B 765 -0.889 59.057 92.226 1.00 31.72 C ATOM 2244 H PHE B 765 -2.793 63.064 97.400 1.00 0.00 H ATOM 2245 N TYR B 766 -2.066 59.849 98.015 1.00 41.17 N ATOM 2246 CA TYR B 766 -1.714 58.585 98.652 1.00 38.21 C ATOM 2247 C TYR B 766 -2.893 57.977 99.402 1.00 49.41 C ATOM 2248 O TYR B 766 -3.115 56.763 99.326 1.00 63.15 O ATOM 2249 CB TYR B 766 -0.531 58.783 99.600 1.00 44.21 C ATOM 2250 CG TYR B 766 0.822 58.736 98.923 1.00 35.63 C ATOM 2251 CD1 TYR B 766 0.949 58.299 97.611 1.00 35.49 C ATOM 2252 CD2 TYR B 766 1.972 59.118 99.600 1.00 30.07 C ATOM 2253 CE1 TYR B 766 2.182 58.252 96.991 1.00 30.46 C ATOM 2254 CE2 TYR B 766 3.208 59.073 98.989 1.00 36.05 C ATOM 2255 CZ TYR B 766 3.308 58.639 97.685 1.00 33.66 C ATOM 2256 OH TYR B 766 4.540 58.594 97.074 1.00 31.26 O ATOM 2257 HH TYR B 766 5.135 57.985 97.579 1.00 0.00 H ATOM 2258 H TYR B 766 -1.732 60.744 98.427 1.00 0.00 H ATOM 2259 N GLU B 767 -3.655 58.798 100.130 1.00 56.33 N ATOM 2260 CA GLU B 767 -4.768 58.271 100.915 1.00 53.51 C ATOM 2261 C GLU B 767 -5.818 57.623 100.023 1.00 46.65 C ATOM 2262 O GLU B 767 -6.423 56.612 100.398 1.00 43.70 O ATOM 2263 CB GLU B 767 -5.391 59.382 101.760 1.00 57.85 C ATOM 2264 CG GLU B 767 -4.504 59.887 102.888 1.00 69.86 C ATOM 2265 CD GLU B 767 -4.115 58.793 103.866 1.00 84.45 C ATOM 2266 OE1 GLU B 767 -3.050 58.168 103.674 1.00 64.06 O ATOM 2267 OE2 GLU B 767 -4.880 58.553 104.825 1.00 92.17 O ATOM 2268 H GLU B 767 -3.454 59.818 100.138 1.00 0.00 H ATOM 2269 N ASP B 768 -6.046 58.185 98.838 1.00 43.88 N ATOM 2270 CA ASP B 768 -6.968 57.595 97.877 1.00 41.63 C ATOM 2271 C ASP B 768 -6.370 56.409 97.132 1.00 43.69 C ATOM 2272 O ASP B 768 -7.055 55.825 96.286 1.00 53.77 O ATOM 2273 CB ASP B 768 -7.433 58.656 96.876 1.00 41.46 C ATOM 2274 CG ASP B 768 -8.367 59.674 97.500 1.00 59.74 C ATOM 2275 OD1 ASP B 768 -8.773 59.475 98.664 1.00 59.58 O ATOM 2276 OD2 ASP B 768 -8.695 60.675 96.828 1.00 59.92 O ATOM 2277 H ASP B 768 -5.554 59.067 98.592 1.00 0.00 H ATOM 2278 N ARG B 769 -5.116 56.052 97.423 1.00 49.52 N ATOM 2279 CA ARG B 769 -4.461 54.877 96.842 1.00 38.67 C ATOM 2280 C ARG B 769 -4.408 54.956 95.317 1.00 40.20 C ATOM 2281 O ARG B 769 -4.562 53.952 94.619 1.00 39.59 O ATOM 2282 CB ARG B 769 -5.143 53.585 97.296 1.00 43.02 C ATOM 2283 CG ARG B 769 -5.180 53.398 98.806 1.00 57.36 C ATOM 2284 CD ARG B 769 -3.796 53.559 99.410 1.00 59.25 C ATOM 2285 NE ARG B 769 -3.730 53.071 100.785 1.00 66.31 N ATOM 2286 CZ ARG B 769 -3.406 51.825 101.117 1.00 68.47 C ATOM 2287 NH1 ARG B 769 -3.120 50.939 100.173 1.00 55.40 N ATOM 2288 NH2 ARG B 769 -3.369 51.465 102.393 1.00 81.60 N ATOM 2289 HE ARG B 769 -3.950 53.739 101.551 1.00 0.00 H ATOM 2290 HH12 ARG B 769 -2.867 49.965 100.434 1.00 0.00 H ATOM 2291 HH11 ARG B 769 -3.149 51.218 99.172 1.00 0.00 H ATOM 2292 HH22 ARG B 769 -3.115 50.490 102.651 1.00 0.00 H ATOM 2293 HH21 ARG B 769 -3.594 52.158 103.135 1.00 0.00 H ATOM 2294 H ARG B 769 -4.578 56.636 98.095 1.00 0.00 H ATOM 2295 N HIS B 770 -4.184 56.159 94.796 1.00 31.33 N ATOM 2296 CA HIS B 770 -4.087 56.353 93.359 1.00 31.37 C ATOM 2297 C HIS B 770 -2.700 55.963 92.851 1.00 47.24 C ATOM 2298 O HIS B 770 -1.751 55.776 93.617 1.00 34.96 O ATOM 2299 CB HIS B 770 -4.389 57.804 92.987 1.00 44.06 C ATOM 2300 CG HIS B 770 -5.848 58.096 92.824 1.00 54.32 C ATOM 2301 ND1 HIS B 770 -6.539 58.933 93.673 1.00 55.14 N ATOM 2302 CD2 HIS B 770 -6.746 57.664 91.907 1.00 53.91 C ATOM 2303 CE1 HIS B 770 -7.801 59.003 93.286 1.00 63.47 C ATOM 2304 NE2 HIS B 770 -7.952 58.242 92.218 1.00 52.31 N ATOM 2305 H HIS B 770 -4.076 56.977 95.429 1.00 0.00 H ATOM 2306 N GLN B 771 -2.594 55.847 91.531 1.00 43.03 N ATOM 2307 CA GLN B 771 -1.343 55.523 90.866 1.00 36.58 C ATOM 2308 C GLN B 771 -1.076 56.552 89.777 1.00 42.59 C ATOM 2309 O GLN B 771 -1.985 57.241 89.311 1.00 41.55 O ATOM 2310 CB GLN B 771 -1.377 54.109 90.270 1.00 37.24 C ATOM 2311 CG GLN B 771 -1.648 53.022 91.296 1.00 35.12 C ATOM 2312 CD GLN B 771 -1.762 51.646 90.673 1.00 67.06 C ATOM 2313 OE1 GLN B 771 -1.257 51.403 89.577 1.00 70.28 O ATOM 2314 NE2 GLN B 771 -2.433 50.736 91.370 1.00 82.00 N ATOM 2315 HE22 GLN B 771 -2.843 50.986 92.292 1.00 0.00 H ATOM 2316 HE21 GLN B 771 -2.548 49.773 90.993 1.00 0.00 H ATOM 2317 H GLN B 771 -3.443 55.994 90.949 1.00 0.00 H ATOM 2318 N LEU B 772 0.189 56.654 89.378 1.00 43.01 N ATOM 2319 CA LEU B 772 0.566 57.624 88.366 1.00 39.23 C ATOM 2320 C LEU B 772 -0.060 57.259 87.019 1.00 39.44 C ATOM 2321 O LEU B 772 -0.297 56.083 86.734 1.00 44.91 O ATOM 2322 CB LEU B 772 2.085 57.698 88.233 1.00 31.26 C ATOM 2323 CG LEU B 772 2.842 58.088 89.503 1.00 27.04 C ATOM 2324 CD1 LEU B 772 4.314 58.309 89.200 1.00 24.76 C ATOM 2325 CD2 LEU B 772 2.225 59.325 90.140 1.00 36.98 C ATOM 2326 H LEU B 772 0.913 56.034 89.794 1.00 0.00 H ATOM 2327 N PRO B 773 -0.351 58.254 86.181 1.00 45.27 N ATOM 2328 CA PRO B 773 -0.926 57.956 84.865 1.00 45.33 C ATOM 2329 C PRO B 773 0.052 57.182 83.996 1.00 37.26 C ATOM 2330 O PRO B 773 1.271 57.295 84.137 1.00 41.92 O ATOM 2331 CB PRO B 773 -1.219 59.344 84.282 1.00 37.72 C ATOM 2332 CG PRO B 773 -0.319 60.271 85.031 1.00 35.64 C ATOM 2333 CD PRO B 773 -0.226 59.702 86.414 1.00 38.20 C ATOM 2334 N ALA B 774 -0.501 56.383 83.096 1.00 43.86 N ATOM 2335 CA ALA B 774 0.319 55.612 82.171 1.00 51.50 C ATOM 2336 C ALA B 774 0.998 56.552 81.186 1.00 52.48 C ATOM 2337 O ALA B 774 0.307 57.324 80.506 1.00 58.25 O ATOM 2338 CB ALA B 774 -0.532 54.586 81.430 1.00 39.92 C ATOM 2339 H ALA B 774 -1.537 56.305 83.049 1.00 0.00 H ATOM 2340 N PRO B 775 2.325 56.541 81.082 1.00 59.62 N ATOM 2341 CA PRO B 775 2.992 57.413 80.109 1.00 71.07 C ATOM 2342 C PRO B 775 2.582 57.057 78.689 1.00 80.59 C ATOM 2343 O PRO B 775 2.196 55.922 78.399 1.00 72.46 O ATOM 2344 CB PRO B 775 4.482 57.140 80.346 1.00 60.18 C ATOM 2345 CG PRO B 775 4.554 56.564 81.726 1.00 62.81 C ATOM 2346 CD PRO B 775 3.287 55.784 81.900 1.00 50.17 C ATOM 2347 N LYS B 776 2.651 58.053 77.801 1.00 77.91 N ATOM 2348 CA LYS B 776 2.387 57.801 76.388 1.00 67.00 C ATOM 2349 C LYS B 776 3.300 56.705 75.857 1.00 78.62 C ATOM 2350 O LYS B 776 2.846 55.767 75.191 1.00 82.36 O ATOM 2351 CB LYS B 776 2.554 59.088 75.581 1.00 77.94 C ATOM 2352 CG LYS B 776 2.456 58.890 74.075 1.00 77.72 C ATOM 2353 CD LYS B 776 1.132 58.256 73.672 1.00 82.90 C ATOM 2354 CE LYS B 776 1.079 58.023 72.170 1.00 78.49 C ATOM 2355 NZ LYS B 776 -0.167 57.326 71.748 1.00 77.15 N ATOM 2356 HZ1 LYS B 776 -0.222 56.401 72.219 1.00 0.00 H ATOM 2357 HZ2 LYS B 776 -0.992 57.901 72.014 1.00 0.00 H ATOM 2358 HZ3 LYS B 776 -0.155 57.191 70.717 1.00 0.00 H ATOM 2359 H LYS B 776 2.894 59.013 78.119 1.00 0.00 H ATOM 2360 N ALA B 777 4.598 56.807 76.144 1.00 77.92 N ATOM 2361 CA ALA B 777 5.516 55.684 75.971 1.00 76.86 C ATOM 2362 C ALA B 777 5.186 54.678 77.069 1.00 78.43 C ATOM 2363 O ALA B 777 5.792 54.650 78.143 1.00 77.31 O ATOM 2364 CB ALA B 777 6.966 56.142 76.040 1.00 74.02 C ATOM 2365 H ALA B 777 4.967 57.711 76.501 1.00 0.00 H ATOM 2366 N ALA B 778 4.190 53.841 76.790 1.00 62.22 N ATOM 2367 CA ALA B 778 3.548 53.017 77.806 1.00 69.59 C ATOM 2368 C ALA B 778 4.177 51.640 77.970 1.00 63.43 C ATOM 2369 O ALA B 778 3.655 50.830 78.744 1.00 62.88 O ATOM 2370 CB ALA B 778 2.058 52.854 77.483 1.00 69.46 C ATOM 2371 H ALA B 778 3.856 53.772 75.807 1.00 0.00 H ATOM 2372 N GLU B 779 5.282 51.355 77.282 1.00 63.57 N ATOM 2373 CA GLU B 779 5.869 50.020 77.346 1.00 70.51 C ATOM 2374 C GLU B 779 6.469 49.692 78.708 1.00 64.19 C ATOM 2375 O GLU B 779 7.028 48.602 78.866 1.00 79.98 O ATOM 2376 CB GLU B 779 6.940 49.855 76.264 1.00 66.63 C ATOM 2377 CG GLU B 779 6.426 50.006 74.839 1.00 69.27 C ATOM 2378 CD GLU B 779 6.313 51.455 74.412 1.00 84.23 C ATOM 2379 OE1 GLU B 779 7.146 52.271 74.858 1.00 77.82 O ATOM 2380 OE2 GLU B 779 5.387 51.779 73.639 1.00 87.46 O ATOM 2381 H GLU B 779 5.729 52.088 76.696 1.00 0.00 H ATOM 2382 N LEU B 780 6.369 50.593 79.690 1.00 50.16 N ATOM 2383 CA LEU B 780 6.912 50.350 81.022 1.00 41.01 C ATOM 2384 C LEU B 780 5.937 50.757 82.121 1.00 34.98 C ATOM 2385 O LEU B 780 6.331 50.842 83.289 1.00 32.70 O ATOM 2386 CB LEU B 780 8.246 51.077 81.202 1.00 53.27 C ATOM 2387 CG LEU B 780 9.394 50.567 80.329 1.00 63.78 C ATOM 2388 CD1 LEU B 780 9.955 51.679 79.458 1.00 68.95 C ATOM 2389 CD2 LEU B 780 10.485 49.953 81.187 1.00 55.25 C ATOM 2390 H LEU B 780 5.889 51.496 79.499 1.00 0.00 H ATOM 2391 N ALA B 781 4.672 51.012 81.775 1.00 38.98 N ATOM 2392 CA ALA B 781 3.685 51.362 82.791 1.00 36.20 C ATOM 2393 C ALA B 781 3.400 50.192 83.724 1.00 37.31 C ATOM 2394 O ALA B 781 3.128 50.400 84.913 1.00 37.16 O ATOM 2395 CB ALA B 781 2.393 51.841 82.131 1.00 43.14 C ATOM 2396 H ALA B 781 4.389 50.961 80.776 1.00 0.00 H ATOM 2397 N ASN B 782 3.458 48.961 83.211 1.00 28.64 N ATOM 2398 CA ASN B 782 3.257 47.798 84.068 1.00 25.51 C ATOM 2399 C ASN B 782 4.379 47.667 85.090 1.00 32.29 C ATOM 2400 O ASN B 782 4.133 47.299 86.245 1.00 31.57 O ATOM 2401 CB ASN B 782 3.150 46.529 83.222 1.00 30.34 C ATOM 2402 CG ASN B 782 1.855 46.461 82.436 1.00 35.74 C ATOM 2403 OD1 ASN B 782 0.842 47.038 82.834 1.00 33.58 O ATOM 2404 ND2 ASN B 782 1.880 45.748 81.316 1.00 45.14 N ATOM 2405 HD22 ASN B 782 2.759 45.278 81.019 1.00 0.00 H ATOM 2406 HD21 ASN B 782 1.021 45.660 80.736 1.00 0.00 H ATOM 2407 H ASN B 782 3.647 48.831 82.197 1.00 0.00 H ATOM 2408 N LEU B 783 5.616 47.965 84.688 1.00 30.94 N ATOM 2409 CA LEU B 783 6.727 47.891 85.629 1.00 24.05 C ATOM 2410 C LEU B 783 6.701 49.049 86.616 1.00 28.81 C ATOM 2411 O LEU B 783 7.076 48.875 87.782 1.00 31.14 O ATOM 2412 CB LEU B 783 8.056 47.859 84.876 1.00 31.72 C ATOM 2413 CG LEU B 783 9.295 47.612 85.739 1.00 36.23 C ATOM 2414 CD1 LEU B 783 9.122 46.347 86.566 1.00 38.18 C ATOM 2415 CD2 LEU B 783 10.542 47.521 84.877 1.00 37.32 C ATOM 2416 H LEU B 783 5.788 48.250 83.703 1.00 0.00 H ATOM 2417 N ILE B 784 6.265 50.231 86.174 1.00 31.89 N ATOM 2418 CA ILE B 784 6.134 51.366 87.084 1.00 31.22 C ATOM 2419 C ILE B 784 5.113 51.053 88.170 1.00 29.87 C ATOM 2420 O ILE B 784 5.385 51.206 89.366 1.00 34.47 O ATOM 2421 CB ILE B 784 5.758 52.640 86.307 1.00 32.32 C ATOM 2422 CG1 ILE B 784 6.917 53.091 85.417 1.00 35.34 C ATOM 2423 CG2 ILE B 784 5.362 53.753 87.266 1.00 23.76 C ATOM 2424 CD1 ILE B 784 6.511 54.089 84.358 1.00 25.42 C ATOM 2425 H ILE B 784 6.016 50.345 85.171 1.00 0.00 H ATOM 2426 N ASN B 785 3.924 50.598 87.765 1.00 33.05 N ATOM 2427 CA ASN B 785 2.879 50.285 88.735 1.00 31.02 C ATOM 2428 C ASN B 785 3.271 49.121 89.637 1.00 29.57 C ATOM 2429 O ASN B 785 2.913 49.114 90.821 1.00 32.09 O ATOM 2430 CB ASN B 785 1.567 49.977 88.013 1.00 44.62 C ATOM 2431 CG ASN B 785 1.020 51.175 87.257 1.00 40.61 C ATOM 2432 OD1 ASN B 785 1.222 52.321 87.656 1.00 34.49 O ATOM 2433 ND2 ASN B 785 0.318 50.913 86.161 1.00 34.17 N ATOM 2434 HD22 ASN B 785 0.172 49.928 85.860 1.00 0.00 H ATOM 2435 HD21 ASN B 785 -0.086 51.692 85.603 1.00 0.00 H ATOM 2436 H ASN B 785 3.741 50.466 86.750 1.00 0.00 H ATOM 2437 N ASN B 786 3.998 48.135 89.107 1.00 26.50 N ATOM 2438 CA ASN B 786 4.425 47.012 89.937 1.00 28.62 C ATOM 2439 C ASN B 786 5.464 47.446 90.964 1.00 31.39 C ATOM 2440 O ASN B 786 5.455 46.966 92.103 1.00 28.72 O ATOM 2441 CB ASN B 786 4.970 45.883 89.062 1.00 26.23 C ATOM 2442 CG ASN B 786 3.872 45.108 88.357 1.00 36.37 C ATOM 2443 OD1 ASN B 786 2.713 45.134 88.772 1.00 32.41 O ATOM 2444 ND2 ASN B 786 4.235 44.407 87.289 1.00 36.20 N ATOM 2445 HD22 ASN B 786 5.226 44.415 86.974 1.00 0.00 H ATOM 2446 HD21 ASN B 786 3.528 43.851 86.767 1.00 0.00 H ATOM 2447 H ASN B 786 4.261 48.167 88.101 1.00 0.00 H ATOM 2448 N CYS B 787 6.369 48.350 90.582 1.00 39.08 N ATOM 2449 CA CYS B 787 7.323 48.884 91.548 1.00 28.85 C ATOM 2450 C CYS B 787 6.638 49.815 92.539 1.00 32.45 C ATOM 2451 O CYS B 787 6.916 49.763 93.743 1.00 34.63 O ATOM 2452 CB CYS B 787 8.457 49.609 90.824 1.00 33.62 C ATOM 2453 SG CYS B 787 9.525 48.533 89.844 1.00 38.27 S ATOM 2454 H CYS B 787 6.394 48.674 89.594 1.00 0.00 H ATOM 2455 N MET B 788 5.738 50.671 92.055 1.00 28.03 N ATOM 2456 CA MET B 788 4.995 51.589 92.919 1.00 29.16 C ATOM 2457 C MET B 788 3.794 50.854 93.517 1.00 34.63 C ATOM 2458 O MET B 788 2.630 51.122 93.214 1.00 30.82 O ATOM 2459 CB MET B 788 4.568 52.827 92.145 1.00 28.30 C ATOM 2460 CG MET B 788 5.708 53.553 91.458 1.00 19.38 C ATOM 2461 SD MET B 788 5.157 55.070 90.660 1.00 32.15 S ATOM 2462 CE MET B 788 4.778 56.077 92.093 1.00 28.31 C ATOM 2463 H MET B 788 5.558 50.687 91.031 1.00 0.00 H ATOM 2464 N ASP B 789 4.104 49.903 94.393 1.00 35.90 N ATOM 2465 CA ASP B 789 3.100 49.091 95.065 1.00 28.75 C ATOM 2466 C ASP B 789 2.879 49.632 96.471 1.00 33.20 C ATOM 2467 O ASP B 789 3.836 49.798 97.235 1.00 30.44 O ATOM 2468 CB ASP B 789 3.537 47.625 95.113 1.00 28.94 C ATOM 2469 CG ASP B 789 2.418 46.687 95.529 1.00 33.16 C ATOM 2470 OD1 ASP B 789 1.771 46.935 96.568 1.00 35.95 O ATOM 2471 OD2 ASP B 789 2.185 45.694 94.810 1.00 36.58 O ATOM 2472 H ASP B 789 5.107 49.732 94.607 1.00 0.00 H ATOM 2473 N TYR B 790 1.616 49.903 96.809 1.00 27.64 N ATOM 2474 CA TYR B 790 1.299 50.446 98.124 1.00 31.37 C ATOM 2475 C TYR B 790 1.599 49.464 99.248 1.00 28.05 C ATOM 2476 O TYR B 790 1.692 49.880 100.407 1.00 34.08 O ATOM 2477 CB TYR B 790 -0.166 50.879 98.177 1.00 29.67 C ATOM 2478 CG TYR B 790 -0.400 52.254 97.597 1.00 26.08 C ATOM 2479 CD1 TYR B 790 -0.577 52.433 96.232 1.00 21.88 C ATOM 2480 CD2 TYR B 790 -0.430 53.376 98.415 1.00 29.92 C ATOM 2481 CE1 TYR B 790 -0.785 53.690 95.699 1.00 26.11 C ATOM 2482 CE2 TYR B 790 -0.639 54.636 97.891 1.00 30.11 C ATOM 2483 CZ TYR B 790 -0.816 54.788 96.533 1.00 34.11 C ATOM 2484 OH TYR B 790 -1.023 56.043 96.009 1.00 33.76 O ATOM 2485 HH TYR B 790 -1.130 55.976 95.027 1.00 0.00 H ATOM 2486 H TYR B 790 0.851 49.725 96.127 1.00 0.00 H ATOM 2487 N GLU B 791 1.750 48.178 98.936 1.00 35.28 N ATOM 2488 CA GLU B 791 2.222 47.215 99.916 1.00 38.80 C ATOM 2489 C GLU B 791 3.723 47.050 99.747 1.00 39.71 C ATOM 2490 O GLU B 791 4.163 46.499 98.727 1.00 39.10 O ATOM 2491 CB GLU B 791 1.513 45.873 99.753 1.00 29.81 C ATOM 2492 CG GLU B 791 2.014 44.808 100.710 1.00 42.88 C ATOM 2493 CD GLU B 791 2.118 45.314 102.137 1.00 49.89 C ATOM 2494 OE1 GLU B 791 1.122 45.866 102.651 1.00 50.78 O ATOM 2495 OE2 GLU B 791 3.203 45.172 102.740 1.00 53.82 O ATOM 2496 H GLU B 791 1.526 47.857 97.972 1.00 0.00 H ATOM 2497 N PRO B 792 4.542 47.514 100.695 1.00 43.65 N ATOM 2498 CA PRO B 792 6.000 47.465 100.495 1.00 33.42 C ATOM 2499 C PRO B 792 6.551 46.061 100.324 1.00 37.78 C ATOM 2500 O PRO B 792 7.533 45.879 99.593 1.00 44.51 O ATOM 2501 CB PRO B 792 6.547 48.132 101.765 1.00 40.87 C ATOM 2502 CG PRO B 792 5.421 48.976 102.269 1.00 34.01 C ATOM 2503 CD PRO B 792 4.173 48.222 101.932 1.00 41.22 C ATOM 2504 N ASP B 793 5.953 45.062 100.969 1.00 43.76 N ATOM 2505 CA ASP B 793 6.460 43.698 100.891 1.00 41.61 C ATOM 2506 C ASP B 793 6.151 43.017 99.565 1.00 39.46 C ATOM 2507 O ASP B 793 6.606 41.889 99.349 1.00 46.56 O ATOM 2508 CB ASP B 793 5.895 42.861 102.042 1.00 47.39 C ATOM 2509 CG ASP B 793 6.302 43.391 103.402 1.00 62.22 C ATOM 2510 OD1 ASP B 793 6.967 44.447 103.454 1.00 68.99 O ATOM 2511 OD2 ASP B 793 5.957 42.753 104.419 1.00 74.41 O ATOM 2512 H ASP B 793 5.107 45.259 101.540 1.00 0.00 H ATOM 2513 N HIS B 794 5.397 43.664 98.676 1.00 29.14 N ATOM 2514 CA HIS B 794 5.052 43.082 97.388 1.00 36.81 C ATOM 2515 C HIS B 794 5.815 43.692 96.223 1.00 32.81 C ATOM 2516 O HIS B 794 5.662 43.220 95.091 1.00 35.75 O ATOM 2517 CB HIS B 794 3.544 43.217 97.132 1.00 35.28 C ATOM 2518 CG HIS B 794 2.698 42.454 98.104 1.00 35.20 C ATOM 2519 ND1 HIS B 794 1.322 42.532 98.116 1.00 30.48 N ATOM 2520 CD2 HIS B 794 3.035 41.596 99.096 1.00 25.36 C ATOM 2521 CE1 HIS B 794 0.848 41.755 99.074 1.00 39.43 C ATOM 2522 NE2 HIS B 794 1.867 41.176 99.683 1.00 38.89 N ATOM 2523 H HIS B 794 5.045 44.614 98.910 1.00 0.00 H ATOM 2524 N ARG B 795 6.623 44.713 96.463 1.00 29.48 N ATOM 2525 CA ARG B 795 7.402 45.313 95.389 1.00 31.41 C ATOM 2526 C ARG B 795 8.485 44.339 94.938 1.00 31.39 C ATOM 2527 O ARG B 795 9.159 43.736 95.780 1.00 34.65 O ATOM 2528 CB ARG B 795 8.017 46.628 95.856 1.00 31.96 C ATOM 2529 CG ARG B 795 6.971 47.664 96.220 1.00 31.12 C ATOM 2530 CD ARG B 795 7.536 48.803 97.044 1.00 27.74 C ATOM 2531 NE ARG B 795 6.462 49.637 97.573 1.00 31.68 N ATOM 2532 CZ ARG B 795 6.625 50.578 98.496 1.00 27.07 C ATOM 2533 NH1 ARG B 795 7.827 50.814 99.003 1.00 34.16 N ATOM 2534 NH2 ARG B 795 5.582 51.281 98.915 1.00 33.38 N ATOM 2535 HE ARG B 795 5.503 49.484 97.202 1.00 0.00 H ATOM 2536 HH12 ARG B 795 7.951 51.552 99.726 1.00 0.00 H ATOM 2537 HH11 ARG B 795 8.646 50.262 98.678 1.00 0.00 H ATOM 2538 HH22 ARG B 795 5.708 52.018 99.638 1.00 0.00 H ATOM 2539 HH21 ARG B 795 4.638 51.095 98.521 1.00 0.00 H ATOM 2540 H ARG B 795 6.702 45.090 97.429 1.00 0.00 H ATOM 2541 N PRO B 796 8.677 44.155 93.633 1.00 35.62 N ATOM 2542 CA PRO B 796 9.641 43.152 93.169 1.00 26.67 C ATOM 2543 C PRO B 796 11.068 43.553 93.497 1.00 30.77 C ATOM 2544 O PRO B 796 11.418 44.736 93.526 1.00 37.71 O ATOM 2545 CB PRO B 796 9.410 43.118 91.654 1.00 32.78 C ATOM 2546 CG PRO B 796 8.898 44.486 91.333 1.00 24.73 C ATOM 2547 CD PRO B 796 8.060 44.890 92.517 1.00 24.40 C ATOM 2548 N SER B 797 11.894 42.545 93.759 1.00 36.81 N ATOM 2549 CA SER B 797 13.315 42.793 93.924 1.00 42.40 C ATOM 2550 C SER B 797 13.911 43.276 92.607 1.00 33.18 C ATOM 2551 O SER B 797 13.401 42.986 91.521 1.00 36.11 O ATOM 2552 CB SER B 797 14.038 41.529 94.390 1.00 33.38 C ATOM 2553 OG SER B 797 14.256 40.644 93.305 1.00 49.89 O ATOM 2554 HG SER B 797 14.724 39.835 93.630 1.00 0.00 H ATOM 2555 H SER B 797 11.522 41.578 93.846 1.00 0.00 H ATOM 2556 N PHE B 798 15.007 44.027 92.709 1.00 33.45 N ATOM 2557 CA PHE B 798 15.653 44.518 91.500 1.00 35.06 C ATOM 2558 C PHE B 798 16.236 43.390 90.664 1.00 34.22 C ATOM 2559 O PHE B 798 16.543 43.603 89.487 1.00 39.18 O ATOM 2560 CB PHE B 798 16.723 45.547 91.854 1.00 28.02 C ATOM 2561 CG PHE B 798 16.160 46.897 92.179 1.00 28.27 C ATOM 2562 CD1 PHE B 798 15.848 47.788 91.166 1.00 30.35 C ATOM 2563 CD2 PHE B 798 15.916 47.266 93.491 1.00 21.63 C ATOM 2564 CE1 PHE B 798 15.316 49.028 91.455 1.00 25.33 C ATOM 2565 CE2 PHE B 798 15.386 48.506 93.787 1.00 27.78 C ATOM 2566 CZ PHE B 798 15.086 49.389 92.768 1.00 31.31 C ATOM 2567 H PHE B 798 15.398 44.260 93.644 1.00 0.00 H ATOM 2568 N ARG B 799 16.387 42.197 91.243 1.00 38.51 N ATOM 2569 CA ARG B 799 16.654 41.010 90.441 1.00 38.84 C ATOM 2570 C ARG B 799 15.560 40.812 89.401 1.00 44.27 C ATOM 2571 O ARG B 799 15.818 40.836 88.193 1.00 39.80 O ATOM 2572 CB ARG B 799 16.761 39.781 91.343 1.00 45.38 C ATOM 2573 CG ARG B 799 16.863 38.467 90.584 1.00 47.16 C ATOM 2574 CD ARG B 799 18.311 38.097 90.353 1.00 61.40 C ATOM 2575 NE ARG B 799 19.035 38.062 91.617 1.00 67.58 N ATOM 2576 CZ ARG B 799 20.330 37.795 91.733 1.00 64.77 C ATOM 2577 NH1 ARG B 799 21.057 37.534 90.654 1.00 68.80 N ATOM 2578 NH2 ARG B 799 20.898 37.791 92.929 1.00 73.43 N ATOM 2579 HE ARG B 799 18.501 38.260 92.487 1.00 0.00 H ATOM 2580 HH12 ARG B 799 22.071 37.325 90.748 1.00 0.00 H ATOM 2581 HH11 ARG B 799 20.612 37.538 89.714 1.00 0.00 H ATOM 2582 HH22 ARG B 799 21.913 37.582 93.022 1.00 0.00 H ATOM 2583 HH21 ARG B 799 20.330 37.997 93.775 1.00 0.00 H ATOM 2584 H ARG B 799 16.313 42.114 92.277 1.00 0.00 H ATOM 2585 N ALA B 800 14.319 40.633 89.863 1.00 34.87 N ATOM 2586 CA ALA B 800 13.204 40.396 88.952 1.00 35.30 C ATOM 2587 C ALA B 800 12.948 41.592 88.045 1.00 35.03 C ATOM 2588 O ALA B 800 12.480 41.420 86.913 1.00 42.45 O ATOM 2589 CB ALA B 800 11.943 40.054 89.745 1.00 30.10 C ATOM 2590 H ALA B 800 14.145 40.663 90.888 1.00 0.00 H ATOM 2591 N ILE B 801 13.237 42.806 88.521 1.00 39.98 N ATOM 2592 CA ILE B 801 13.057 43.991 87.687 1.00 32.58 C ATOM 2593 C ILE B 801 13.969 43.925 86.469 1.00 36.82 C ATOM 2594 O ILE B 801 13.561 44.257 85.349 1.00 40.27 O ATOM 2595 CB ILE B 801 13.302 45.269 88.511 1.00 40.02 C ATOM 2596 CG1 ILE B 801 12.288 45.373 89.651 1.00 26.94 C ATOM 2597 CG2 ILE B 801 13.233 46.501 87.623 1.00 31.14 C ATOM 2598 CD1 ILE B 801 12.514 46.559 90.562 1.00 26.54 C ATOM 2599 H ILE B 801 13.593 42.908 89.493 1.00 0.00 H ATOM 2600 N ILE B 802 15.213 43.481 86.664 1.00 34.15 N ATOM 2601 CA ILE B 802 16.149 43.370 85.549 1.00 39.20 C ATOM 2602 C ILE B 802 15.697 42.290 84.573 1.00 37.41 C ATOM 2603 O ILE B 802 15.744 42.484 83.352 1.00 42.42 O ATOM 2604 CB ILE B 802 17.573 43.108 86.073 1.00 40.15 C ATOM 2605 CG1 ILE B 802 18.090 44.327 86.839 1.00 31.79 C ATOM 2606 CG2 ILE B 802 18.513 42.775 84.929 1.00 29.05 C ATOM 2607 CD1 ILE B 802 19.392 44.083 87.565 1.00 26.40 C ATOM 2608 H ILE B 802 15.519 43.211 87.621 1.00 0.00 H ATOM 2609 N ARG B 803 15.252 41.139 85.089 1.00 42.20 N ATOM 2610 CA ARG B 803 14.733 40.088 84.216 1.00 45.32 C ATOM 2611 C ARG B 803 13.571 40.606 83.380 1.00 42.25 C ATOM 2612 O ARG B 803 13.534 40.420 82.158 1.00 53.72 O ATOM 2613 CB ARG B 803 14.283 38.878 85.039 1.00 57.15 C ATOM 2614 CG ARG B 803 15.113 38.570 86.271 1.00 54.53 C ATOM 2615 CD ARG B 803 16.341 37.734 85.963 1.00 56.43 C ATOM 2616 NE ARG B 803 16.740 36.947 87.128 1.00 63.83 N ATOM 2617 CZ ARG B 803 17.812 36.163 87.176 1.00 63.09 C ATOM 2618 NH1 ARG B 803 18.610 36.059 86.123 1.00 55.36 N ATOM 2619 NH2 ARG B 803 18.087 35.484 88.281 1.00 64.92 N ATOM 2620 HE ARG B 803 16.144 37.004 87.978 1.00 0.00 H ATOM 2621 HH12 ARG B 803 19.448 35.444 86.164 1.00 0.00 H ATOM 2622 HH11 ARG B 803 18.398 36.592 85.255 1.00 0.00 H ATOM 2623 HH22 ARG B 803 18.926 34.870 88.319 1.00 0.00 H ATOM 2624 HH21 ARG B 803 17.464 35.565 89.110 1.00 0.00 H ATOM 2625 H ARG B 803 15.275 40.991 86.118 1.00 0.00 H ATOM 2626 N ASP B 804 12.606 41.261 84.031 1.00 51.44 N ATOM 2627 CA ASP B 804 11.483 41.850 83.311 1.00 51.42 C ATOM 2628 C ASP B 804 11.940 42.961 82.374 1.00 49.10 C ATOM 2629 O ASP B 804 11.366 43.134 81.292 1.00 48.17 O ATOM 2630 CB ASP B 804 10.450 42.375 84.309 1.00 47.45 C ATOM 2631 CG ASP B 804 9.321 43.126 83.640 1.00 54.72 C ATOM 2632 OD1 ASP B 804 8.545 42.495 82.891 1.00 69.73 O ATOM 2633 OD2 ASP B 804 9.207 44.349 83.867 1.00 64.08 O ATOM 2634 H ASP B 804 12.656 41.352 85.066 1.00 0.00 H ATOM 2635 N LEU B 805 12.967 43.720 82.765 1.00 50.28 N ATOM 2636 CA LEU B 805 13.519 44.729 81.867 1.00 49.33 C ATOM 2637 C LEU B 805 14.228 44.087 80.681 1.00 52.40 C ATOM 2638 O LEU B 805 14.136 44.585 79.553 1.00 51.92 O ATOM 2639 CB LEU B 805 14.477 45.648 82.625 1.00 42.06 C ATOM 2640 CG LEU B 805 13.871 46.879 83.296 1.00 33.71 C ATOM 2641 CD1 LEU B 805 14.956 47.713 83.957 1.00 29.64 C ATOM 2642 CD2 LEU B 805 13.107 47.702 82.275 1.00 45.47 C ATOM 2643 H LEU B 805 13.375 43.591 83.713 1.00 0.00 H ATOM 2644 N ASN B 806 14.936 43.004 80.897 1.00 44.37 N ATOM 2645 CA ASN B 806 15.671 42.325 79.858 1.00 48.36 C ATOM 2646 C ASN B 806 14.805 41.544 78.952 1.00 50.85 C ATOM 2647 O ASN B 806 15.184 41.178 77.933 1.00 64.80 O ATOM 2648 CB ASN B 806 16.634 41.353 80.480 1.00 35.49 C ATOM 2649 CG ASN B 806 17.883 41.984 80.897 1.00 43.15 C ATOM 2650 OD1 ASN B 806 18.205 43.022 80.466 1.00 53.70 O ATOM 2651 ND2 ASN B 806 18.593 41.347 81.736 1.00 50.66 N ATOM 2652 HD22 ASN B 806 18.272 40.426 82.096 1.00 0.00 H ATOM 2653 HD21 ASN B 806 19.496 41.747 82.063 1.00 0.00 H ATOM 2654 H ASN B 806 14.969 42.617 81.862 1.00 0.00 H ATOM 2655 N SER B 807 13.565 41.332 79.286 1.00 54.31 N ATOM 2656 CA SER B 807 12.650 40.581 78.465 1.00 61.79 C ATOM 2657 C SER B 807 11.762 41.483 77.703 1.00 57.21 C ATOM 2658 O SER B 807 10.642 41.227 77.547 1.00 57.90 O ATOM 2659 CB SER B 807 11.789 39.734 79.374 1.00 47.31 C ATOM 2660 OG SER B 807 10.657 40.425 79.796 1.00 60.63 O ATOM 2661 HG SER B 807 10.118 40.686 79.008 1.00 0.00 H ATOM 2662 H SER B 807 13.219 41.722 80.186 1.00 0.00 H ATOM 2663 N LEU B 808 12.297 42.571 77.261 1.00 76.16 N ATOM 2664 CA LEU B 808 11.606 43.576 76.591 1.00 78.70 C ATOM 2665 C LEU B 808 12.422 43.839 75.370 1.00 90.18 C ATOM 2666 O LEU B 808 13.361 44.547 75.353 1.00 88.87 O ATOM 2667 CB LEU B 808 11.557 44.781 77.502 1.00 66.18 C ATOM 2668 CG LEU B 808 10.379 45.667 77.335 1.00 70.64 C ATOM 2669 CD1 LEU B 808 9.257 44.718 77.052 1.00 66.95 C ATOM 2670 CD2 LEU B 808 10.145 46.331 78.650 1.00 82.46 C ATOM 2671 H LEU B 808 13.316 42.706 77.416 1.00 0.00 H ATOM 2672 N PHE B 809 12.122 43.087 74.376 1.00 92.80 N ATOM 2673 CA PHE B 809 12.654 43.242 73.011 1.00 91.92 C ATOM 2674 C PHE B 809 13.997 43.972 72.873 1.00 89.74 C ATOM 2675 O PHE B 809 14.044 45.207 72.845 1.00 91.00 O ATOM 2676 CB PHE B 809 11.611 43.974 72.160 1.00 94.76 C ATOM 2677 CG PHE B 809 10.185 43.701 72.573 1.00 97.02 C ATOM 2678 CD1 PHE B 809 9.475 42.648 72.017 1.00 92.86 C ATOM 2679 CD2 PHE B 809 9.553 44.499 73.517 1.00 97.03 C ATOM 2680 CE1 PHE B 809 8.167 42.397 72.394 1.00 94.24 C ATOM 2681 CE2 PHE B 809 8.245 44.251 73.901 1.00 82.59 C ATOM 2682 CZ PHE B 809 7.552 43.199 73.336 1.00 89.85 C ATOM 2683 H PHE B 809 11.453 42.309 74.546 1.00 0.00 H TER 2684 PHE B 809 HETATM 2685 O HOH 1 16.122 44.737 76.772 1.00 60.85 O HETATM 2686 O HOH 2 12.382 64.995 84.984 1.00 47.76 O HETATM 2687 O HOH 3 22.744 36.164 89.939 1.00 49.13 O HETATM 2688 O HOH 4 28.243 53.072 102.269 1.00 53.49 O HETATM 2689 O HOH 5 13.540 64.304 89.565 1.00 36.99 O HETATM 2690 O HOH 6 21.553 69.137 84.581 1.00 47.60 O HETATM 2691 O HOH 7 -0.040 69.074 105.907 1.00 52.22 O HETATM 2692 O HOH 8 37.593 60.882 88.416 1.00 41.69 O HETATM 2693 O HOH 9 3.613 44.715 93.025 1.00 33.17 O HETATM 2694 O HOH 10 -2.977 71.757 92.914 1.00 39.66 O HETATM 2695 O HOH 11 -0.206 49.459 95.131 1.00 31.71 O HETATM 2696 O HOH 12 11.363 60.194 77.617 1.00 50.98 O HETATM 2697 O HOH 13 3.618 48.290 79.476 1.00 41.89 O HETATM 2698 O HOH 14 14.520 55.900 97.277 1.00 42.53 O HETATM 2699 O HOH 15 31.068 48.177 88.908 1.00 51.21 O HETATM 2700 O HOH 16 2.065 54.142 89.496 1.00 35.00 O HETATM 2701 O HOH 17 35.545 64.721 87.760 1.00 38.46 O HETATM 2702 O HOH 18 22.161 65.462 110.675 1.00 56.82 O HETATM 2703 O HOH 19 16.129 47.905 96.998 1.00 42.45 O HETATM 2704 O HOH 20 26.055 49.653 79.164 1.00 44.74 O HETATM 2705 O HOH 21 31.868 54.230 93.025 1.00 46.80 O HETATM 2706 C1 MOL A 22 27.257 67.399 87.353 1.00 0.17 C HETATM 2707 N1 MOL A 22 28.269 66.659 87.794 1.00 -0.30 N HETATM 2708 C4 MOL A 22 28.194 65.973 88.927 1.00 0.01 C HETATM 2709 C3 MOL A 22 26.979 66.044 89.682 1.00 0.12 C HETATM 2710 C2 MOL A 22 25.946 66.809 89.223 1.00 0.15 C HETATM 2711 N2 MOL A 22 26.115 67.481 88.035 1.00 -0.25 N HETATM 2712 N4 MOL A 22 24.782 66.881 89.945 1.00 -0.27 N HETATM 2713 C5 MOL A 22 23.669 67.687 89.448 1.00 0.04 C HETATM 2714 C6 MOL A 22 23.774 69.158 89.866 1.00 -0.03 C HETATM 2715 C7 MOL A 22 22.401 69.834 89.795 1.00 -0.04 C HETATM 2716 C11 MOL A 22 22.064 70.257 88.365 1.00 -0.06 C HETATM 2717 H3 MOL A 22 21.075 70.738 88.348 1.00 0.02 H HETATM 2718 H4 MOL A 22 22.052 69.371 87.714 1.00 0.02 H HETATM 2719 H5 MOL A 22 22.823 70.967 88.004 1.00 0.02 H HETATM 2720 C12 MOL A 22 22.316 71.018 90.755 1.00 -0.06 C HETATM 2721 H6 MOL A 22 22.563 70.683 91.773 1.00 0.02 H HETATM 2722 H7 MOL A 22 21.296 71.428 90.742 1.00 0.02 H HETATM 2723 H8 MOL A 22 23.028 71.796 90.442 1.00 0.02 H HETATM 2724 H20 MOL A 22 21.649 69.095 90.110 1.00 0.03 H HETATM 2725 H18 MOL A 22 24.469 69.678 89.190 1.00 0.03 H HETATM 2726 H19 MOL A 22 24.153 69.215 90.897 1.00 0.03 H HETATM 2727 H16 MOL A 22 22.730 67.274 89.845 1.00 0.06 H HETATM 2728 H17 MOL A 22 23.658 67.633 88.349 1.00 0.06 H HETATM 2729 C8 MOL A 22 24.659 66.205 91.090 1.00 0.06 C HETATM 2730 C9 MOL A 22 25.731 65.430 91.546 1.00 0.17 C HETATM 2731 O1 MOL A 22 25.615 64.723 92.745 1.00 -0.33 O HETATM 2732 H1 MOL A 22 24.756 64.876 93.120 1.00 0.24 H HETATM 2733 N5 MOL A 22 26.862 65.353 90.856 1.00 -0.26 N HETATM 2734 C13 MOL A 22 27.964 64.540 91.348 1.00 0.03 C HETATM 2735 H9 MOL A 22 28.808 64.602 90.645 1.00 0.05 H HETATM 2736 H10 MOL A 22 27.637 63.494 91.437 1.00 0.05 H HETATM 2737 H11 MOL A 22 28.281 64.910 92.334 1.00 0.05 H HETATM 2738 C10 MOL A 22 23.370 66.267 91.911 1.00 -0.03 C HETATM 2739 H21 MOL A 22 23.478 65.643 92.810 1.00 0.03 H HETATM 2740 H22 MOL A 22 22.531 65.895 91.305 1.00 0.03 H HETATM 2741 H23 MOL A 22 23.174 67.308 92.208 1.00 0.03 H HETATM 2742 H14 MOL A 22 29.030 65.375 89.272 1.00 0.06 H HETATM 2743 N3 MOL A 22 27.477 68.099 86.084 1.00 -0.26 N HETATM 2744 C14 MOL A 22 26.701 69.202 85.526 1.00 0.05 C HETATM 2745 C15 MOL A 22 25.762 69.911 86.262 1.00 -0.02 C HETATM 2746 C16 MOL A 22 25.059 70.953 85.669 1.00 0.15 C HETATM 2747 C17 MOL A 22 25.295 71.292 84.344 1.00 0.14 C HETATM 2748 O2 MOL A 22 24.586 72.344 83.746 1.00 -0.34 O HETATM 2749 H2 MOL A 22 24.867 72.442 82.844 1.00 0.24 H HETATM 2750 C18 MOL A 22 26.235 70.587 83.609 1.00 0.15 C HETATM 2751 C19 MOL A 22 26.935 69.550 84.202 1.00 -0.02 C HETATM 2752 H13 MOL A 22 27.674 69.004 83.627 1.00 0.05 H HETATM 2753 F2 MOL A 22 26.471 70.915 82.306 1.00 -0.19 F HETATM 2754 F1 MOL A 22 24.132 71.648 86.389 1.00 -0.19 F HETATM 2755 H12 MOL A 22 25.577 69.652 87.298 1.00 0.05 H HETATM 2756 H15 MOL A 22 28.274 67.774 85.519 1.00 0.21 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 2706 2707 2711 2743 CONECT 2707 2706 2708 CONECT 2708 2707 2709 2742 CONECT 2709 2708 2710 2733 CONECT 2710 2709 2711 2712 CONECT 2711 2706 2710 CONECT 2712 2710 2713 2729 CONECT 2713 2712 2714 2727 2728 CONECT 2714 2713 2715 2725 2726 CONECT 2715 2714 2716 2720 2724 CONECT 2716 2715 2717 2718 2719 CONECT 2717 2716 CONECT 2718 2716 CONECT 2719 2716 CONECT 2720 2715 2721 2722 2723 CONECT 2721 2720 CONECT 2722 2720 CONECT 2723 2720 CONECT 2724 2715 CONECT 2725 2714 CONECT 2726 2714 CONECT 2727 2713 CONECT 2728 2713 CONECT 2729 2712 2730 2738 CONECT 2730 2729 2731 2733 CONECT 2731 2730 2732 CONECT 2732 2731 CONECT 2733 2709 2730 2734 CONECT 2734 2733 2735 2736 2737 CONECT 2735 2734 CONECT 2736 2734 CONECT 2737 2734 CONECT 2738 2729 2739 2740 2741 CONECT 2739 2738 CONECT 2740 2738 CONECT 2741 2738 CONECT 2742 2708 CONECT 2743 2706 2744 2756 CONECT 2744 2743 2745 2751 CONECT 2745 2744 2746 2755 CONECT 2746 2745 2747 2754 CONECT 2747 2746 2748 2750 CONECT 2748 2747 2749 CONECT 2749 2748 CONECT 2750 2747 2751 2753 CONECT 2751 2744 2750 2752 CONECT 2752 2751 CONECT 2753 2750 CONECT 2754 2746 CONECT 2755 2745 CONECT 2756 2743 MASTER 0 0 0 0 0 0 0 0 2755 1 55 22 END
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Related entries of code: 5wik
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4fvq
RCSB PDB
PDBbind
289aa, >4FVQ_1|Chain... *
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RCSB PDB
PDBbind
289aa, >4FVR_1|Chain... at 99%
5usz
RCSB PDB
PDBbind
289aa, >5USZ_1|Chain... at 100%
5ut0
RCSB PDB
PDBbind
289aa, >5UT0_1|Chain... at 100%
5ut4
RCSB PDB
PDBbind
289aa, >5UT4_1|Chain... at 100%
5ut6
RCSB PDB
PDBbind
289aa, >5UT6_1|Chain... at 100%
6g3c
RCSB PDB
PDBbind
272aa, >6G3C_1|Chains... at 99%
5win
RCSB PDB
PDBbind
277aa, >5WIN_1|Chain... at 100%
5wij
RCSB PDB
PDBbind
277aa, >5WIJ_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5d9k
RCSB PDB
PDBbind
584
Entry Information
PDB ID
5wik
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK2
Ligand Name
584
EC.Number
E.C.2.7.10.2
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
Kd=620nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) ACS Chem. Biol. Vol. 14: pp. 587-593
Ligand Properties
Formula
C
1
9
H
2
3
F
2
N
5
O
2
Molecular Weight
391.415
Exact Mass
391.182
No. of atoms
51
No. of bonds
53
Polar Surface Area
88.13
LOGP Value
3.80 (
Computed with XLOGP3
)
4.19 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
CC(CCn1c(C)c(O)n(c2c1nc(nc2)Nc1cc(F)c(c(c1)F)O)C)C
InChI String
InChI=1S/C19H23F2N5O2/c1-10(2)5-6-26-11(3)18(28)25(4)15-9-22-19(24-17(15)26)23-12-7-13(20)16(27)14(21)8-12/h7-10,27-28H,5-6H2,1-4H3,(H,22,23,24)
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):
O60674
Entrez Gene ID
NCBI Entrez Gene ID:
3717
ASD
Information of known allosteric effects of PDB entries
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