Browse entries in the PDBbind-CN Database
HEADER 5AWU_COMPLEX COMPND 5AWU_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 75 THR LEU PRO VAL ALA ALA ALA PHE THR GLU THR VAL ASN SEQRES 2 A 75 ALA TYR PHE LYS GLY ALA ASP PRO SER LYS CYS ILE VAL SEQRES 3 A 75 LYS ILE THR GLY GLU MET VAL LEU SER PHE PRO ALA GLY SEQRES 4 A 75 ILE THR ARG HIS PHE ALA ASN ASN PRO SER PRO ALA ALA SEQRES 5 A 75 LEU THR PHE ARG VAL ILE ASN PHE SER ARG LEU GLU HIS SEQRES 6 A 75 VAL LEU PRO ASN PRO GLN LEU LEU CYS CYS SEQRES 1 A 190 ASP ALA ASN THR LYS GLU PHE TRP VAL ASN MET PRO ASN SEQRES 2 A 190 LEU MET THR HIS LEU LYS LYS VAL SER GLU GLN LYS PRO SEQRES 3 A 190 GLN ALA THR TYR TYR ASN VAL ASP MET LEU LYS TYR GLN SEQRES 4 A 190 VAL SER ALA GLN GLY ILE GLN SER THR PRO LEU ASN LEU SEQRES 5 A 190 ALA VAL ASN TRP ARG CYS GLU PRO SER SER THR ASP LEU SEQRES 6 A 190 ARG ILE ASP TYR LYS TYR ASN THR ASP ALA MET THR THR SEQRES 7 A 190 ALA VAL ALA LEU ASN ASN VAL GLN PHE LEU VAL PRO ILE SEQRES 8 A 190 ASP GLY GLY VAL THR LYS LEU GLN ALA VAL LEU PRO PRO SEQRES 9 A 190 ALA VAL TRP ASN ALA GLU GLN GLN ARG ILE LEU TRP LYS SEQRES 10 A 190 ILE PRO ASP ILE SER GLN LYS SER GLU ASN GLY GLY VAL SEQRES 11 A 190 GLY SER LEU LEU ALA ARG PHE GLN LEU SER GLU GLY PRO SEQRES 12 A 190 SER LYS PRO SER PRO LEU VAL VAL GLN PHE THR SER GLU SEQRES 13 A 190 GLY SER THR LEU SER GLY CYS ASP ILE GLU LEU VAL GLY SEQRES 14 A 190 ALA GLY TYR ARG PHE SER LEU ILE LYS LYS ARG PHE ALA SEQRES 15 A 190 ALA GLY LYS TYR LEU ALA ASP ASN HET ZN A 1 1 HET ZN A 2 1 HET ZN A 3 1 HET ZN A 4 1 HET TYR A 277 166 ATOM 1 N THR A 559 28.928 -12.929 118.601 1.00122.82 N ATOM 2 CA THR A 559 29.856 -12.057 117.880 1.00119.99 C ATOM 3 C THR A 559 29.721 -10.599 118.322 1.00119.90 C ATOM 4 O THR A 559 28.755 -10.231 118.992 1.00124.32 O ATOM 5 CB THR A 559 29.645 -12.119 116.349 1.00115.17 C ATOM 6 OG1 THR A 559 28.437 -11.429 116.002 1.00114.96 O ATOM 7 CG2 THR A 559 29.572 -13.563 115.871 1.00112.39 C ATOM 8 HG1 THR A 559 28.305 -11.470 115.022 1.00 0.00 H ATOM 9 HN3 THR A 559 27.952 -12.620 118.419 1.00 0.00 H ATOM 10 HN2 THR A 559 29.125 -12.876 119.621 1.00 0.00 H ATOM 11 HN1 THR A 559 29.050 -13.909 118.274 1.00 0.00 H ATOM 12 N LEU A 560 30.688 -9.774 117.928 1.00113.82 N ATOM 13 CA LEU A 560 30.689 -8.359 118.288 1.00106.52 C ATOM 14 C LEU A 560 30.004 -7.508 117.227 1.00104.63 C ATOM 15 O LEU A 560 30.276 -7.642 116.030 1.00106.14 O ATOM 16 CB LEU A 560 32.119 -7.856 118.524 1.00 99.90 C ATOM 17 CG LEU A 560 32.291 -6.468 119.155 1.00 95.39 C ATOM 18 CD1 LEU A 560 31.753 -6.425 120.581 1.00 98.60 C ATOM 19 CD2 LEU A 560 33.747 -6.051 119.140 1.00 86.49 C ATOM 20 H LEU A 560 31.465 -10.148 117.347 1.00 0.00 H ATOM 21 N PRO A 561 29.092 -6.635 117.666 1.00104.08 N ATOM 22 CA PRO A 561 28.508 -5.638 116.770 1.00102.68 C ATOM 23 C PRO A 561 29.492 -4.486 116.564 1.00103.98 C ATOM 24 O PRO A 561 30.277 -4.174 117.464 1.00103.58 O ATOM 25 CB PRO A 561 27.282 -5.160 117.541 1.00102.35 C ATOM 26 CG PRO A 561 27.657 -5.338 118.965 1.00102.82 C ATOM 27 CD PRO A 561 28.523 -6.564 119.022 1.00103.48 C ATOM 28 N VAL A 562 29.442 -3.885 115.378 1.00105.72 N ATOM 29 CA VAL A 562 30.314 -2.785 114.965 1.00 96.21 C ATOM 30 C VAL A 562 29.524 -1.904 113.966 1.00 87.40 C ATOM 31 O VAL A 562 28.560 -2.372 113.350 1.00 78.36 O ATOM 32 CB VAL A 562 31.608 -3.341 114.331 1.00 90.88 C ATOM 33 CG1 VAL A 562 31.296 -4.032 113.038 1.00 94.56 C ATOM 34 CG2 VAL A 562 32.628 -2.254 114.101 1.00 92.48 C ATOM 35 H VAL A 562 28.733 -4.221 114.696 1.00 0.00 H ATOM 36 N ALA A 563 29.886 -0.628 113.838 1.00 85.25 N ATOM 37 CA ALA A 563 29.213 0.262 112.880 1.00 80.02 C ATOM 38 C ALA A 563 30.193 0.929 111.911 1.00 80.10 C ATOM 39 O ALA A 563 31.399 0.977 112.168 1.00 84.42 O ATOM 40 CB ALA A 563 28.398 1.318 113.611 1.00 79.72 C ATOM 41 H ALA A 563 30.658 -0.255 114.426 1.00 0.00 H ATOM 42 N ALA A 564 29.674 1.448 110.801 1.00 76.56 N ATOM 43 CA ALA A 564 30.501 2.171 109.839 1.00 66.99 C ATOM 44 C ALA A 564 29.810 3.446 109.386 1.00 73.72 C ATOM 45 O ALA A 564 28.585 3.563 109.425 1.00 76.17 O ATOM 46 CB ALA A 564 30.851 1.295 108.648 1.00 60.08 C ATOM 47 H ALA A 564 28.657 1.336 110.615 1.00 0.00 H ATOM 48 N ALA A 565 30.613 4.407 108.959 1.00 76.39 N ATOM 49 CA ALA A 565 30.097 5.676 108.480 1.00 75.15 C ATOM 50 C ALA A 565 30.962 6.236 107.345 1.00 77.57 C ATOM 51 O ALA A 565 32.171 6.393 107.492 1.00 83.12 O ATOM 52 CB ALA A 565 30.020 6.651 109.617 1.00 70.67 C ATOM 53 H ALA A 565 31.641 4.249 108.967 1.00 0.00 H ATOM 54 N PHE A 566 30.344 6.508 106.203 1.00 76.10 N ATOM 55 CA PHE A 566 30.999 7.290 105.157 1.00 71.23 C ATOM 56 C PHE A 566 30.477 8.717 105.206 1.00 67.96 C ATOM 57 O PHE A 566 29.277 8.939 105.304 1.00 65.11 O ATOM 58 CB PHE A 566 30.736 6.686 103.784 1.00 66.87 C ATOM 59 CG PHE A 566 31.331 5.319 103.599 1.00 66.98 C ATOM 60 CD1 PHE A 566 30.597 4.181 103.891 1.00 69.92 C ATOM 61 CD2 PHE A 566 32.629 5.171 103.137 1.00 56.99 C ATOM 62 CE1 PHE A 566 31.146 2.916 103.712 1.00 74.60 C ATOM 63 CE2 PHE A 566 33.176 3.926 102.961 1.00 62.69 C ATOM 64 CZ PHE A 566 32.436 2.793 103.245 1.00 70.22 C ATOM 65 H PHE A 566 29.377 6.159 106.050 1.00 0.00 H ATOM 66 N THR A 567 31.381 9.684 105.165 1.00 70.79 N ATOM 67 CA THR A 567 30.981 11.085 105.195 1.00 72.04 C ATOM 68 C THR A 567 31.755 11.876 104.150 1.00 72.77 C ATOM 69 O THR A 567 32.967 12.062 104.269 1.00 76.25 O ATOM 70 CB THR A 567 31.233 11.744 106.555 1.00 75.52 C ATOM 71 OG1 THR A 567 30.732 10.915 107.610 1.00 74.92 O ATOM 72 CG2 THR A 567 30.546 13.087 106.590 1.00 79.94 C ATOM 73 HG1 THR A 567 30.902 11.353 108.481 1.00 0.00 H ATOM 74 H THR A 567 32.391 9.440 105.111 1.00 0.00 H ATOM 75 N GLU A 568 31.047 12.350 103.134 1.00 60.90 N ATOM 76 CA GLU A 568 31.677 13.086 102.044 1.00 66.14 C ATOM 77 C GLU A 568 31.307 14.563 102.067 1.00 65.73 C ATOM 78 O GLU A 568 30.165 14.928 102.343 1.00 65.66 O ATOM 79 CB GLU A 568 31.400 12.392 100.701 1.00 59.32 C ATOM 80 CG GLU A 568 32.214 11.094 100.613 1.00 76.70 C ATOM 81 CD GLU A 568 31.651 10.036 99.662 1.00 82.59 C ATOM 82 OE1 GLU A 568 30.797 10.353 98.798 1.00 83.00 O ATOM 83 OE2 GLU A 568 32.090 8.871 99.776 1.00 82.76 O ATOM 84 H GLU A 568 30.019 12.193 103.114 1.00 0.00 H ATOM 85 N THR A 569 32.306 15.407 101.841 1.00 65.18 N ATOM 86 CA THR A 569 32.100 16.838 101.721 1.00 67.15 C ATOM 87 C THR A 569 32.307 17.227 100.260 1.00 71.70 C ATOM 88 O THR A 569 33.299 16.827 99.638 1.00 75.08 O ATOM 89 CB THR A 569 33.120 17.577 102.532 1.00 65.12 C ATOM 90 OG1 THR A 569 33.142 17.011 103.843 1.00 75.73 O ATOM 91 CG2 THR A 569 32.765 19.046 102.611 1.00 66.89 C ATOM 92 HG1 THR A 569 33.812 17.487 104.396 1.00 0.00 H ATOM 93 H THR A 569 33.270 15.029 101.747 1.00 0.00 H ATOM 94 N VAL A 570 31.367 17.988 99.708 1.00 71.77 N ATOM 95 CA VAL A 570 31.481 18.430 98.328 1.00 67.60 C ATOM 96 C VAL A 570 31.746 19.918 98.271 1.00 66.85 C ATOM 97 O VAL A 570 31.059 20.712 98.920 1.00 65.90 O ATOM 98 CB VAL A 570 30.235 18.102 97.475 1.00 67.84 C ATOM 99 CG1 VAL A 570 28.967 18.639 98.123 1.00 72.44 C ATOM 100 CG2 VAL A 570 30.411 18.663 96.098 1.00 59.81 C ATOM 101 H VAL A 570 30.539 18.271 100.271 1.00 0.00 H ATOM 102 N ASN A 571 32.769 20.282 97.509 1.00 64.43 N ATOM 103 CA ASN A 571 33.075 21.673 97.274 1.00 66.19 C ATOM 104 C ASN A 571 32.884 21.974 95.793 1.00 71.23 C ATOM 105 O ASN A 571 33.297 21.195 94.932 1.00 67.99 O ATOM 106 CB ASN A 571 34.498 22.001 97.729 1.00 72.10 C ATOM 107 CG ASN A 571 34.850 21.385 99.098 1.00 79.41 C ATOM 108 OD1 ASN A 571 34.508 21.925 100.155 1.00 85.36 O ATOM 109 ND2 ASN A 571 35.538 20.256 99.070 1.00 72.92 N ATOM 110 HD22 ASN A 571 35.807 19.833 98.159 1.00 0.00 H ATOM 111 HD21 ASN A 571 35.810 19.791 99.959 1.00 0.00 H ATOM 112 H ASN A 571 33.363 19.549 97.071 1.00 0.00 H ATOM 113 N ALA A 572 32.209 23.079 95.503 1.00 71.38 N ATOM 114 CA ALA A 572 32.007 23.492 94.128 1.00 73.21 C ATOM 115 C ALA A 572 32.194 24.991 93.999 1.00 73.16 C ATOM 116 O ALA A 572 32.003 25.730 94.960 1.00 68.80 O ATOM 117 CB ALA A 572 30.621 23.071 93.620 1.00 65.75 C ATOM 118 H ALA A 572 31.819 23.658 96.274 1.00 0.00 H ATOM 119 N TYR A 573 32.579 25.424 92.804 1.00 71.06 N ATOM 120 CA TYR A 573 32.653 26.835 92.489 1.00 75.03 C ATOM 121 C TYR A 573 32.188 27.049 91.073 1.00 80.97 C ATOM 122 O TYR A 573 32.858 26.649 90.125 1.00 83.23 O ATOM 123 CB TYR A 573 34.071 27.358 92.622 1.00 82.93 C ATOM 124 CG TYR A 573 34.115 28.819 92.983 1.00100.70 C ATOM 125 CD1 TYR A 573 33.099 29.681 92.593 1.00101.95 C ATOM 126 CD2 TYR A 573 35.154 29.330 93.753 1.00113.88 C ATOM 127 CE1 TYR A 573 33.124 31.017 92.937 1.00110.59 C ATOM 128 CE2 TYR A 573 35.191 30.662 94.105 1.00120.60 C ATOM 129 CZ TYR A 573 34.177 31.504 93.695 1.00120.99 C ATOM 130 OH TYR A 573 34.222 32.833 94.049 1.00125.21 O ATOM 131 HH TYR A 573 33.429 33.298 93.681 1.00 0.00 H ATOM 132 H TYR A 573 32.835 24.729 92.073 1.00 0.00 H ATOM 133 N PHE A 574 31.044 27.703 90.950 1.00 75.34 N ATOM 134 CA PHE A 574 30.439 27.984 89.673 1.00 69.53 C ATOM 135 C PHE A 574 30.802 29.395 89.206 1.00 75.56 C ATOM 136 O PHE A 574 31.117 30.258 90.025 1.00 81.62 O ATOM 137 CB PHE A 574 28.927 27.841 89.793 1.00 64.61 C ATOM 138 CG PHE A 574 28.478 26.476 90.234 1.00 69.13 C ATOM 139 CD1 PHE A 574 28.517 26.115 91.577 1.00 75.50 C ATOM 140 CD2 PHE A 574 27.998 25.557 89.317 1.00 69.79 C ATOM 141 CE1 PHE A 574 28.097 24.871 91.994 1.00 70.01 C ATOM 142 CE2 PHE A 574 27.571 24.308 89.731 1.00 73.58 C ATOM 143 CZ PHE A 574 27.617 23.971 91.072 1.00 75.79 C ATOM 144 H PHE A 574 30.561 28.028 91.812 1.00 0.00 H ATOM 145 N LYS A 575 30.767 29.615 87.890 1.00 74.05 N ATOM 146 CA LYS A 575 31.089 30.912 87.291 1.00 70.96 C ATOM 147 C LYS A 575 29.981 31.262 86.307 1.00 72.58 C ATOM 148 O LYS A 575 29.873 30.653 85.249 1.00 74.61 O ATOM 149 CB LYS A 575 32.441 30.852 86.583 1.00 67.74 C ATOM 150 CG LYS A 575 33.529 30.106 87.370 1.00 73.89 C ATOM 151 CD LYS A 575 33.835 30.827 88.701 1.00 81.97 C ATOM 152 CE LYS A 575 34.962 30.149 89.506 1.00 81.86 C ATOM 153 NZ LYS A 575 35.292 30.974 90.705 1.00 82.38 N ATOM 154 HZ1 LYS A 575 35.606 31.917 90.400 1.00 0.00 H ATOM 155 HZ2 LYS A 575 34.447 31.066 91.304 1.00 0.00 H ATOM 156 HZ3 LYS A 575 36.052 30.512 91.244 1.00 0.00 H ATOM 157 H LYS A 575 30.499 28.830 87.262 1.00 0.00 H ATOM 158 N GLY A 576 29.145 32.229 86.669 1.00 75.17 N ATOM 159 CA GLY A 576 27.954 32.550 85.900 1.00 65.73 C ATOM 160 C GLY A 576 27.278 31.296 85.391 1.00 70.95 C ATOM 161 O GLY A 576 27.048 30.365 86.158 1.00 76.33 O ATOM 162 H GLY A 576 29.349 32.774 87.531 1.00 0.00 H ATOM 163 N ALA A 577 27.019 31.231 84.084 1.00 77.76 N ATOM 164 CA ALA A 577 26.265 30.106 83.540 1.00 66.58 C ATOM 165 C ALA A 577 27.123 29.082 82.794 1.00 67.34 C ATOM 166 O ALA A 577 26.583 28.145 82.192 1.00 71.50 O ATOM 167 CB ALA A 577 25.119 30.607 82.672 1.00 69.10 C ATOM 168 H ALA A 577 27.355 31.984 83.451 1.00 0.00 H ATOM 169 N ASP A 578 28.449 29.213 82.897 1.00 65.51 N ATOM 170 CA ASP A 578 29.377 28.355 82.148 1.00 71.35 C ATOM 171 C ASP A 578 29.891 27.105 82.903 1.00 75.65 C ATOM 172 O ASP A 578 30.919 27.170 83.614 1.00 70.88 O ATOM 173 CB ASP A 578 30.543 29.196 81.564 1.00 68.09 C ATOM 174 CG ASP A 578 31.607 28.348 80.815 1.00 81.19 C ATOM 175 OD1 ASP A 578 31.417 27.117 80.635 1.00 63.01 O ATOM 176 OD2 ASP A 578 32.641 28.936 80.392 1.00 92.17 O ATOM 177 H ASP A 578 28.836 29.945 83.527 1.00 0.00 H ATOM 178 N PRO A 579 29.251 25.941 82.627 1.00 84.41 N ATOM 179 CA PRO A 579 29.523 24.630 83.245 1.00 79.30 C ATOM 180 C PRO A 579 30.979 24.214 83.128 1.00 72.26 C ATOM 181 O PRO A 579 31.458 23.426 83.936 1.00 79.63 O ATOM 182 CB PRO A 579 28.693 23.649 82.396 1.00 83.95 C ATOM 183 CG PRO A 579 27.782 24.494 81.524 1.00 78.14 C ATOM 184 CD PRO A 579 28.484 25.803 81.366 1.00 81.20 C ATOM 185 N SER A 580 31.671 24.715 82.115 1.00 71.12 N ATOM 186 CA SER A 580 33.053 24.308 81.865 1.00 75.14 C ATOM 187 C SER A 580 33.944 24.943 82.901 1.00 77.82 C ATOM 188 O SER A 580 35.089 24.534 83.094 1.00 82.98 O ATOM 189 CB SER A 580 33.522 24.771 80.478 1.00 73.70 C ATOM 190 OG SER A 580 33.874 26.154 80.472 1.00 68.08 O ATOM 191 HG SER A 580 33.086 26.695 80.731 1.00 0.00 H ATOM 192 H SER A 580 31.223 25.411 81.486 1.00 0.00 H ATOM 193 N LYS A 581 33.425 25.974 83.550 1.00 71.95 N ATOM 194 CA LYS A 581 34.270 26.749 84.431 1.00 77.00 C ATOM 195 C LYS A 581 34.092 26.371 85.916 1.00 76.32 C ATOM 196 O LYS A 581 34.812 26.873 86.767 1.00 72.72 O ATOM 197 CB LYS A 581 34.065 28.238 84.159 1.00 80.46 C ATOM 198 CG LYS A 581 35.228 28.860 83.417 1.00 88.06 C ATOM 199 CD LYS A 581 34.783 30.072 82.610 1.00 95.61 C ATOM 200 CE LYS A 581 35.762 30.347 81.475 1.00100.92 C ATOM 201 NZ LYS A 581 36.012 29.129 80.651 1.00100.08 N ATOM 202 HZ1 LYS A 581 36.411 28.381 81.253 1.00 0.00 H ATOM 203 HZ2 LYS A 581 35.116 28.802 80.237 1.00 0.00 H ATOM 204 HZ3 LYS A 581 36.683 29.358 79.890 1.00 0.00 H ATOM 205 H LYS A 581 32.423 26.223 83.428 1.00 0.00 H ATOM 206 N CYS A 582 33.151 25.463 86.180 1.00 74.31 N ATOM 207 CA CYS A 582 32.845 24.954 87.513 1.00 83.53 C ATOM 208 C CYS A 582 33.894 24.007 88.098 1.00 82.54 C ATOM 209 O CYS A 582 34.048 22.885 87.622 1.00 81.57 O ATOM 210 CB CYS A 582 31.512 24.213 87.485 1.00 90.53 C ATOM 211 SG CYS A 582 31.100 23.429 89.066 1.00104.96 S ATOM 212 H CYS A 582 32.598 25.093 85.381 1.00 0.00 H ATOM 213 N ILE A 583 34.574 24.448 89.156 1.00 76.87 N ATOM 214 CA ILE A 583 35.603 23.647 89.801 1.00 77.13 C ATOM 215 C ILE A 583 35.054 22.823 90.996 1.00 88.57 C ATOM 216 O ILE A 583 34.395 23.362 91.891 1.00 93.39 O ATOM 217 CB ILE A 583 36.781 24.557 90.224 1.00 77.07 C ATOM 218 CG1 ILE A 583 37.549 25.016 88.974 1.00 73.11 C ATOM 219 CG2 ILE A 583 37.681 23.897 91.313 1.00 64.98 C ATOM 220 CD1 ILE A 583 38.699 25.983 89.257 1.00 76.41 C ATOM 221 H ILE A 583 34.362 25.394 89.532 1.00 0.00 H ATOM 222 N VAL A 584 35.340 21.522 91.013 1.00 77.25 N ATOM 223 CA VAL A 584 34.747 20.617 92.000 1.00 69.33 C ATOM 224 C VAL A 584 35.788 19.774 92.743 1.00 67.04 C ATOM 225 O VAL A 584 36.720 19.253 92.145 1.00 74.66 O ATOM 226 CB VAL A 584 33.707 19.686 91.333 1.00 66.28 C ATOM 227 CG1 VAL A 584 33.163 18.657 92.325 1.00 65.20 C ATOM 228 CG2 VAL A 584 32.568 20.496 90.758 1.00 67.15 C ATOM 229 H VAL A 584 36.001 21.139 90.307 1.00 0.00 H ATOM 230 N LYS A 585 35.621 19.622 94.053 1.00 64.26 N ATOM 231 CA LYS A 585 36.523 18.774 94.841 1.00 65.95 C ATOM 232 C LYS A 585 35.749 18.093 95.969 1.00 69.51 C ATOM 233 O LYS A 585 35.108 18.748 96.781 1.00 75.46 O ATOM 234 CB LYS A 585 37.703 19.575 95.390 1.00 64.06 C ATOM 235 CG LYS A 585 38.807 18.699 95.974 1.00 79.97 C ATOM 236 CD LYS A 585 39.785 19.484 96.891 1.00 89.63 C ATOM 237 CE LYS A 585 40.774 18.535 97.578 1.00 94.12 C ATOM 238 NZ LYS A 585 41.973 19.215 98.176 1.00 99.74 N ATOM 239 HZ1 LYS A 585 42.498 19.711 97.428 1.00 0.00 H ATOM 240 HZ2 LYS A 585 41.660 19.899 98.894 1.00 0.00 H ATOM 241 HZ3 LYS A 585 42.589 18.503 98.619 1.00 0.00 H ATOM 242 H LYS A 585 34.837 20.113 94.528 1.00 0.00 H ATOM 243 N ILE A 586 35.793 16.773 96.005 1.00 63.74 N ATOM 244 CA ILE A 586 35.014 16.020 96.970 1.00 60.13 C ATOM 245 C ILE A 586 35.974 15.252 97.865 1.00 77.52 C ATOM 246 O ILE A 586 36.847 14.523 97.376 1.00 60.59 O ATOM 247 CB ILE A 586 34.085 15.020 96.261 1.00 66.42 C ATOM 248 CG1 ILE A 586 33.091 15.755 95.349 1.00 65.52 C ATOM 249 CG2 ILE A 586 33.375 14.087 97.262 1.00 58.61 C ATOM 250 CD1 ILE A 586 32.375 14.830 94.417 1.00 57.75 C ATOM 251 H ILE A 586 36.397 16.264 95.329 1.00 0.00 H ATOM 252 N THR A 587 35.837 15.433 99.177 1.00 68.22 N ATOM 253 CA THR A 587 36.641 14.660 100.120 1.00 68.66 C ATOM 254 C THR A 587 35.707 13.782 100.916 1.00 72.67 C ATOM 255 O THR A 587 34.488 13.823 100.737 1.00 73.32 O ATOM 256 CB THR A 587 37.465 15.539 101.068 1.00 68.66 C ATOM 257 OG1 THR A 587 36.586 16.402 101.804 1.00 76.61 O ATOM 258 CG2 THR A 587 38.440 16.386 100.282 1.00 64.94 C ATOM 259 HG1 THR A 587 37.119 16.969 102.416 1.00 0.00 H ATOM 260 H THR A 587 35.152 16.130 99.533 1.00 0.00 H ATOM 261 N GLY A 588 36.268 12.992 101.808 1.00 61.07 N ATOM 262 CA GLY A 588 35.468 12.005 102.476 1.00 60.29 C ATOM 263 C GLY A 588 36.249 11.251 103.515 1.00 68.32 C ATOM 264 O GLY A 588 37.483 11.248 103.507 1.00 68.53 O ATOM 265 H GLY A 588 37.281 13.082 102.026 1.00 0.00 H ATOM 266 N GLU A 589 35.509 10.599 104.404 1.00 71.68 N ATOM 267 CA GLU A 589 36.084 9.994 105.585 1.00 67.35 C ATOM 268 C GLU A 589 35.298 8.735 105.912 1.00 62.70 C ATOM 269 O GLU A 589 34.082 8.705 105.783 1.00 64.06 O ATOM 270 CB GLU A 589 36.015 11.000 106.726 1.00 78.28 C ATOM 271 CG GLU A 589 36.900 10.686 107.909 1.00 98.44 C ATOM 272 CD GLU A 589 37.368 11.937 108.628 1.00113.24 C ATOM 273 OE1 GLU A 589 37.285 13.044 108.031 1.00108.39 O ATOM 274 OE2 GLU A 589 37.822 11.800 109.787 1.00122.65 O ATOM 275 H GLU A 589 34.484 10.521 104.246 1.00 0.00 H ATOM 276 N MET A 590 36.003 7.677 106.279 1.00 63.93 N ATOM 277 CA MET A 590 35.372 6.444 106.703 1.00 68.79 C ATOM 278 C MET A 590 35.711 6.178 108.168 1.00 71.82 C ATOM 279 O MET A 590 36.896 6.167 108.570 1.00 75.60 O ATOM 280 CB MET A 590 35.825 5.280 105.835 1.00 71.69 C ATOM 281 CG MET A 590 34.886 4.079 105.887 1.00 75.58 C ATOM 282 SD MET A 590 35.744 2.508 106.070 1.00119.20 S ATOM 283 CE MET A 590 35.909 2.483 107.864 1.00 60.04 C ATOM 284 H MET A 590 37.041 7.732 106.263 1.00 0.00 H ATOM 285 N VAL A 591 34.658 5.974 108.953 1.00 73.20 N ATOM 286 CA VAL A 591 34.777 5.770 110.391 1.00 79.32 C ATOM 287 C VAL A 591 34.164 4.438 110.814 1.00 77.55 C ATOM 288 O VAL A 591 33.091 4.054 110.357 1.00 75.68 O ATOM 289 CB VAL A 591 34.130 6.932 111.183 1.00 81.04 C ATOM 290 CG1 VAL A 591 33.970 6.575 112.643 1.00 82.20 C ATOM 291 CG2 VAL A 591 34.965 8.191 111.044 1.00 83.47 C ATOM 292 H VAL A 591 33.711 5.959 108.524 1.00 0.00 H ATOM 293 N LEU A 592 34.879 3.726 111.672 1.00 73.64 N ATOM 294 CA LEU A 592 34.377 2.509 112.280 1.00 72.16 C ATOM 295 C LEU A 592 34.040 2.797 113.738 1.00 77.59 C ATOM 296 O LEU A 592 34.761 3.522 114.432 1.00 75.77 O ATOM 297 CB LEU A 592 35.436 1.421 112.202 1.00 72.39 C ATOM 298 CG LEU A 592 35.125 0.259 111.269 1.00 74.13 C ATOM 299 CD1 LEU A 592 34.146 0.690 110.196 1.00 75.08 C ATOM 300 CD2 LEU A 592 36.414 -0.294 110.659 1.00 71.94 C ATOM 301 H LEU A 592 35.835 4.052 111.919 1.00 0.00 H ATOM 302 N SER A 593 32.939 2.235 114.206 1.00 75.60 N ATOM 303 CA SER A 593 32.501 2.498 115.566 1.00 81.03 C ATOM 304 C SER A 593 32.304 1.207 116.374 1.00 79.05 C ATOM 305 O SER A 593 31.778 0.218 115.861 1.00 73.13 O ATOM 306 CB SER A 593 31.217 3.317 115.541 1.00 84.01 C ATOM 307 OG SER A 593 30.865 3.694 116.850 1.00 89.42 O ATOM 308 HG SER A 593 31.593 4.238 117.242 1.00 0.00 H ATOM 309 H SER A 593 32.383 1.601 113.597 1.00 0.00 H ATOM 310 N PHE A 594 32.729 1.228 117.635 1.00 80.11 N ATOM 311 CA PHE A 594 32.613 0.070 118.530 1.00 84.07 C ATOM 312 C PHE A 594 31.771 0.385 119.784 1.00 82.54 C ATOM 313 O PHE A 594 31.869 1.487 120.328 1.00 80.61 O ATOM 314 CB PHE A 594 34.012 -0.372 118.945 1.00 83.89 C ATOM 315 CG PHE A 594 34.936 -0.592 117.791 1.00 85.85 C ATOM 316 CD1 PHE A 594 34.978 -1.819 117.149 1.00 83.51 C ATOM 317 CD2 PHE A 594 35.770 0.433 117.341 1.00 88.16 C ATOM 318 CE1 PHE A 594 35.842 -2.027 116.072 1.00 87.36 C ATOM 319 CE2 PHE A 594 36.635 0.234 116.279 1.00 84.00 C ATOM 320 CZ PHE A 594 36.670 -0.997 115.639 1.00 83.34 C ATOM 321 H PHE A 594 33.161 2.100 118.001 1.00 0.00 H ATOM 322 N PRO A 595 30.962 -0.588 120.265 1.00 84.03 N ATOM 323 CA PRO A 595 30.083 -0.397 121.446 1.00 81.66 C ATOM 324 C PRO A 595 30.865 -0.485 122.763 1.00 79.51 C ATOM 325 O PRO A 595 31.913 -1.131 122.776 1.00 81.95 O ATOM 326 CB PRO A 595 29.117 -1.573 121.343 1.00 74.87 C ATOM 327 CG PRO A 595 29.976 -2.676 120.730 1.00 76.27 C ATOM 328 CD PRO A 595 30.938 -1.983 119.779 1.00 78.62 C ATOM 329 N ALA A 596 30.378 0.140 123.838 1.00 89.84 N ATOM 330 CA ALA A 596 31.085 0.160 125.141 1.00 93.09 C ATOM 331 C ALA A 596 31.511 -1.227 125.628 1.00 90.32 C ATOM 332 O ALA A 596 32.656 -1.416 126.095 1.00 95.15 O ATOM 333 CB ALA A 596 30.250 0.857 126.203 1.00 92.28 C ATOM 334 H ALA A 596 29.466 0.633 123.758 1.00 0.00 H ATOM 335 N GLY A 597 30.589 -2.184 125.493 1.00 82.11 N ATOM 336 CA GLY A 597 30.847 -3.587 125.773 1.00 89.79 C ATOM 337 C GLY A 597 32.237 -4.121 125.449 1.00 96.14 C ATOM 338 O GLY A 597 32.747 -5.001 126.163 1.00 97.55 O ATOM 339 H GLY A 597 29.638 -1.912 125.171 1.00 0.00 H ATOM 340 N ILE A 598 32.855 -3.581 124.394 1.00 96.40 N ATOM 341 CA ILE A 598 34.166 -4.041 123.933 1.00 96.66 C ATOM 342 C ILE A 598 35.210 -4.084 125.044 1.00 94.24 C ATOM 343 O ILE A 598 36.070 -4.972 125.049 1.00 91.72 O ATOM 344 CB ILE A 598 34.706 -3.216 122.728 1.00116.84 C ATOM 345 CG1 ILE A 598 34.868 -1.734 123.088 1.00119.61 C ATOM 346 CG2 ILE A 598 33.801 -3.382 121.521 1.00115.40 C ATOM 347 CD1 ILE A 598 36.261 -1.339 123.533 1.00119.91 C ATOM 348 H ILE A 598 32.387 -2.806 123.882 1.00 0.00 H ATOM 349 N THR A 599 35.126 -3.132 125.975 1.00 95.75 N ATOM 350 CA THR A 599 36.030 -3.117 127.122 1.00105.63 C ATOM 351 C THR A 599 36.064 -4.512 127.766 1.00107.07 C ATOM 352 O THR A 599 37.124 -5.147 127.861 1.00101.12 O ATOM 353 CB THR A 599 35.583 -2.084 128.184 1.00113.95 C ATOM 354 OG1 THR A 599 35.222 -0.846 127.554 1.00118.37 O ATOM 355 CG2 THR A 599 36.691 -1.840 129.207 1.00113.05 C ATOM 356 HG1 THR A 599 34.476 -1.004 126.922 1.00 0.00 H ATOM 357 H THR A 599 34.405 -2.388 125.882 1.00 0.00 H ATOM 358 N ARG A 600 34.885 -4.990 128.168 1.00107.14 N ATOM 359 CA ARG A 600 34.749 -6.309 128.776 1.00100.22 C ATOM 360 C ARG A 600 35.023 -7.394 127.754 1.00102.11 C ATOM 361 O ARG A 600 35.618 -8.427 128.074 1.00104.25 O ATOM 362 CB ARG A 600 33.353 -6.494 129.384 1.00 91.37 C ATOM 363 CG ARG A 600 33.138 -5.691 130.653 1.00 87.26 C ATOM 364 CD ARG A 600 31.685 -5.664 131.043 1.00 96.36 C ATOM 365 NE ARG A 600 31.520 -5.447 132.478 1.00111.37 N ATOM 366 CZ ARG A 600 30.347 -5.423 133.106 1.00120.70 C ATOM 367 NH1 ARG A 600 29.220 -5.603 132.425 1.00122.22 N ATOM 368 NH2 ARG A 600 30.300 -5.221 134.420 1.00125.31 N ATOM 369 HE ARG A 600 32.378 -5.301 133.048 1.00 0.00 H ATOM 370 HH12 ARG A 600 28.305 -5.584 132.919 1.00 0.00 H ATOM 371 HH11 ARG A 600 29.253 -5.763 131.398 1.00 0.00 H ATOM 372 HH22 ARG A 600 29.383 -5.202 134.911 1.00 0.00 H ATOM 373 HH21 ARG A 600 31.180 -5.082 134.957 1.00 0.00 H ATOM 374 H ARG A 600 34.035 -4.403 128.044 1.00 0.00 H ATOM 375 N HIS A 601 34.611 -7.150 126.514 1.00 99.20 N ATOM 376 CA HIS A 601 34.776 -8.158 125.480 1.00 90.97 C ATOM 377 C HIS A 601 36.258 -8.413 125.153 1.00 83.68 C ATOM 378 O HIS A 601 36.671 -9.550 124.941 1.00 80.12 O ATOM 379 CB HIS A 601 33.992 -7.783 124.224 1.00 95.62 C ATOM 380 CG HIS A 601 34.062 -8.825 123.154 1.00 98.50 C ATOM 381 ND1 HIS A 601 33.252 -9.941 123.153 1.00 99.16 N ATOM 382 CD2 HIS A 601 34.880 -8.942 122.083 1.00 91.15 C ATOM 383 CE1 HIS A 601 33.556 -10.689 122.105 1.00 99.28 C ATOM 384 NE2 HIS A 601 34.536 -10.111 121.443 1.00 94.07 N ATOM 385 H HIS A 601 34.170 -6.237 126.283 1.00 0.00 H ATOM 386 N PHE A 602 37.065 -7.360 125.136 1.00114.18 N ATOM 387 CA PHE A 602 38.482 -7.527 124.855 1.00113.18 C ATOM 388 C PHE A 602 39.251 -7.902 126.101 1.00118.52 C ATOM 389 O PHE A 602 40.475 -7.865 126.114 1.00128.62 O ATOM 390 CB PHE A 602 39.072 -6.262 124.238 1.00112.71 C ATOM 391 CG PHE A 602 38.648 -6.032 122.821 1.00109.29 C ATOM 392 CD1 PHE A 602 38.245 -7.095 122.025 1.00113.12 C ATOM 393 CD2 PHE A 602 38.644 -4.751 122.285 1.00107.45 C ATOM 394 CE1 PHE A 602 37.845 -6.883 120.708 1.00116.61 C ATOM 395 CE2 PHE A 602 38.244 -4.526 120.978 1.00108.49 C ATOM 396 CZ PHE A 602 37.843 -5.594 120.184 1.00112.58 C ATOM 397 H PHE A 602 36.683 -6.411 125.324 1.00 0.00 H ATOM 398 N ALA A 603 38.533 -8.248 127.160 1.00116.48 N ATOM 399 CA ALA A 603 39.171 -8.751 128.366 1.00114.17 C ATOM 400 C ALA A 603 38.973 -10.251 128.385 1.00118.60 C ATOM 401 O ALA A 603 39.841 -10.998 128.831 1.00111.48 O ATOM 402 CB ALA A 603 38.568 -8.112 129.598 1.00113.33 C ATOM 403 H ALA A 603 37.497 -8.158 127.128 1.00 0.00 H ATOM 404 N ASN A 604 37.816 -10.675 127.882 1.00119.53 N ATOM 405 CA ASN A 604 37.481 -12.088 127.737 1.00128.22 C ATOM 406 C ASN A 604 38.056 -12.732 126.478 1.00132.16 C ATOM 407 O ASN A 604 37.793 -13.902 126.211 1.00134.98 O ATOM 408 CB ASN A 604 35.960 -12.267 127.702 1.00127.64 C ATOM 409 CG ASN A 604 35.312 -12.082 129.051 1.00135.77 C ATOM 410 OD1 ASN A 604 35.969 -11.750 130.039 1.00145.11 O ATOM 411 ND2 ASN A 604 34.003 -12.295 129.100 1.00135.86 N ATOM 412 HD22 ASN A 604 33.489 -12.574 128.240 1.00 0.00 H ATOM 413 HD21 ASN A 604 33.491 -12.183 129.998 1.00 0.00 H ATOM 414 H ASN A 604 37.118 -9.966 127.578 1.00 0.00 H ATOM 415 N ASN A 605 38.827 -11.981 125.696 1.00133.52 N ATOM 416 CA ASN A 605 39.178 -12.450 124.355 1.00139.54 C ATOM 417 C ASN A 605 40.649 -12.538 123.875 1.00146.88 C ATOM 418 O ASN A 605 41.020 -13.564 123.303 1.00147.93 O ATOM 419 CB ASN A 605 38.297 -11.752 123.306 1.00134.57 C ATOM 420 CG ASN A 605 36.841 -12.214 123.365 1.00135.61 C ATOM 421 OD1 ASN A 605 36.496 -13.283 122.860 1.00138.79 O ATOM 422 ND2 ASN A 605 35.984 -11.407 123.980 1.00133.15 N ATOM 423 HD22 ASN A 605 36.317 -10.513 124.393 1.00 0.00 H ATOM 424 HD21 ASN A 605 34.980 -11.669 124.048 1.00 0.00 H ATOM 425 H ASN A 605 39.179 -11.064 126.037 1.00 0.00 H ATOM 426 N PRO A 606 41.485 -11.500 124.126 1.00150.16 N ATOM 427 CA PRO A 606 42.750 -11.321 123.382 1.00147.14 C ATOM 428 C PRO A 606 43.641 -12.563 123.348 1.00150.28 C ATOM 429 O PRO A 606 43.964 -13.089 124.417 1.00158.85 O ATOM 430 CB PRO A 606 43.459 -10.209 124.159 1.00148.80 C ATOM 431 CG PRO A 606 42.917 -10.329 125.551 1.00154.26 C ATOM 432 CD PRO A 606 41.475 -10.694 125.361 1.00152.85 C ATOM 433 N SER A 607 44.043 -13.018 122.159 1.00142.82 N ATOM 434 CA SER A 607 43.787 -12.321 120.896 1.00134.30 C ATOM 435 C SER A 607 42.413 -12.594 120.255 1.00117.11 C ATOM 436 O SER A 607 42.021 -13.750 120.068 1.00118.26 O ATOM 437 CB SER A 607 44.883 -12.671 119.885 1.00144.84 C ATOM 438 OG SER A 607 44.784 -14.028 119.478 1.00152.40 O ATOM 439 HG SER A 607 43.901 -14.181 119.057 1.00 0.00 H ATOM 440 H SER A 607 44.566 -13.916 122.128 1.00 0.00 H ATOM 441 N PRO A 608 41.697 -11.518 119.885 1.00100.96 N ATOM 442 CA PRO A 608 40.369 -11.612 119.259 1.00 99.96 C ATOM 443 C PRO A 608 40.420 -11.997 117.778 1.00 99.04 C ATOM 444 O PRO A 608 41.505 -12.084 117.193 1.00102.16 O ATOM 445 CB PRO A 608 39.798 -10.199 119.427 1.00 89.09 C ATOM 446 CG PRO A 608 40.986 -9.310 119.503 1.00 82.58 C ATOM 447 CD PRO A 608 42.135 -10.121 120.065 1.00 88.96 C ATOM 448 N ALA A 609 39.248 -12.239 117.191 1.00 95.55 N ATOM 449 CA ALA A 609 39.145 -12.597 115.776 1.00 94.13 C ATOM 450 C ALA A 609 39.589 -11.415 114.920 1.00 85.91 C ATOM 451 O ALA A 609 39.222 -10.266 115.195 1.00 75.70 O ATOM 452 CB ALA A 609 37.722 -12.987 115.438 1.00 82.43 C ATOM 453 H ALA A 609 38.378 -12.171 117.757 1.00 0.00 H ATOM 454 N ALA A 610 40.393 -11.688 113.895 1.00 86.58 N ATOM 455 CA ALA A 610 40.899 -10.623 113.027 1.00 78.45 C ATOM 456 C ALA A 610 39.755 -9.821 112.411 1.00 73.52 C ATOM 457 O ALA A 610 38.825 -10.387 111.831 1.00 77.52 O ATOM 458 CB ALA A 610 41.806 -11.195 111.940 1.00 76.87 C ATOM 459 H ALA A 610 40.666 -12.674 113.708 1.00 0.00 H ATOM 460 N LEU A 611 39.825 -8.503 112.559 1.00 69.75 N ATOM 461 CA LEU A 611 38.839 -7.606 111.978 1.00 70.16 C ATOM 462 C LEU A 611 39.303 -7.243 110.572 1.00 76.16 C ATOM 463 O LEU A 611 40.180 -6.391 110.399 1.00 73.91 O ATOM 464 CB LEU A 611 38.736 -6.332 112.809 1.00 66.57 C ATOM 465 CG LEU A 611 37.456 -5.480 112.801 1.00 73.24 C ATOM 466 CD1 LEU A 611 37.769 -4.047 113.257 1.00 73.14 C ATOM 467 CD2 LEU A 611 36.676 -5.476 111.481 1.00 66.06 C ATOM 468 H LEU A 611 40.611 -8.099 113.108 1.00 0.00 H ATOM 469 N THR A 612 38.712 -7.879 109.567 1.00 78.15 N ATOM 470 CA THR A 612 39.051 -7.560 108.187 1.00 80.60 C ATOM 471 C THR A 612 37.816 -7.063 107.443 1.00 84.67 C ATOM 472 O THR A 612 36.738 -7.629 107.585 1.00 88.45 O ATOM 473 CB THR A 612 39.645 -8.777 107.472 1.00 77.99 C ATOM 474 OG1 THR A 612 38.648 -9.795 107.387 1.00 91.76 O ATOM 475 CG2 THR A 612 40.811 -9.332 108.264 1.00 75.85 C ATOM 476 HG1 THR A 612 37.871 -9.453 106.877 1.00 0.00 H ATOM 477 H THR A 612 38.001 -8.611 109.767 1.00 0.00 H ATOM 478 N PHE A 613 37.966 -5.995 106.665 1.00 83.65 N ATOM 479 CA PHE A 613 36.856 -5.536 105.822 1.00 86.45 C ATOM 480 C PHE A 613 37.237 -5.269 104.355 1.00 81.99 C ATOM 481 O PHE A 613 38.409 -5.203 104.000 1.00 77.54 O ATOM 482 CB PHE A 613 36.206 -4.293 106.423 1.00 77.41 C ATOM 483 CG PHE A 613 37.121 -3.119 106.502 1.00 78.92 C ATOM 484 CD1 PHE A 613 37.200 -2.203 105.456 1.00 78.44 C ATOM 485 CD2 PHE A 613 37.915 -2.927 107.624 1.00 78.83 C ATOM 486 CE1 PHE A 613 38.052 -1.103 105.536 1.00 79.78 C ATOM 487 CE2 PHE A 613 38.767 -1.834 107.718 1.00 78.83 C ATOM 488 CZ PHE A 613 38.834 -0.919 106.672 1.00 85.09 C ATOM 489 H PHE A 613 38.872 -5.484 106.654 1.00 0.00 H ATOM 490 N ARG A 614 36.245 -5.120 103.490 1.00 84.74 N ATOM 491 CA ARG A 614 36.530 -4.655 102.130 1.00 82.05 C ATOM 492 C ARG A 614 35.738 -3.404 101.803 1.00 79.53 C ATOM 493 O ARG A 614 34.565 -3.273 102.164 1.00 85.08 O ATOM 494 CB ARG A 614 36.335 -5.739 101.062 1.00 68.99 C ATOM 495 CG ARG A 614 34.926 -6.229 100.878 1.00 79.87 C ATOM 496 CD ARG A 614 34.826 -7.055 99.581 1.00 95.94 C ATOM 497 NE ARG A 614 35.710 -8.212 99.589 1.00101.51 N ATOM 498 CZ ARG A 614 35.346 -9.404 100.044 1.00107.37 C ATOM 499 NH1 ARG A 614 34.116 -9.576 100.513 1.00106.78 N ATOM 500 NH2 ARG A 614 36.200 -10.422 100.026 1.00110.92 N ATOM 501 HE ARG A 614 36.675 -8.098 99.219 1.00 0.00 H ATOM 502 HH12 ARG A 614 33.822 -10.507 100.872 1.00 0.00 H ATOM 503 HH11 ARG A 614 33.447 -8.780 100.522 1.00 0.00 H ATOM 504 HH22 ARG A 614 35.907 -11.353 100.385 1.00 0.00 H ATOM 505 HH21 ARG A 614 37.162 -10.288 99.653 1.00 0.00 H ATOM 506 H ARG A 614 35.268 -5.332 103.775 1.00 0.00 H ATOM 507 N VAL A 615 36.420 -2.461 101.168 1.00 72.93 N ATOM 508 CA VAL A 615 35.757 -1.305 100.604 1.00 73.71 C ATOM 509 C VAL A 615 35.484 -1.553 99.128 1.00 82.84 C ATOM 510 O VAL A 615 36.396 -1.908 98.339 1.00 82.60 O ATOM 511 CB VAL A 615 36.559 -0.027 100.799 1.00 70.32 C ATOM 512 CG1 VAL A 615 35.811 1.122 100.179 1.00 71.34 C ATOM 513 CG2 VAL A 615 36.788 0.239 102.301 1.00 55.11 C ATOM 514 H VAL A 615 37.452 -2.554 101.073 1.00 0.00 H ATOM 515 N ILE A 616 34.204 -1.403 98.793 1.00 89.56 N ATOM 516 CA ILE A 616 33.672 -1.636 97.454 1.00 96.77 C ATOM 517 C ILE A 616 33.680 -0.332 96.641 1.00 98.71 C ATOM 518 O ILE A 616 33.465 0.747 97.198 1.00 98.25 O ATOM 519 CB ILE A 616 32.237 -2.216 97.550 1.00 97.89 C ATOM 520 CG1 ILE A 616 32.275 -3.576 98.236 1.00 95.47 C ATOM 521 CG2 ILE A 616 31.598 -2.360 96.183 1.00108.51 C ATOM 522 CD1 ILE A 616 33.294 -4.529 97.606 1.00 91.77 C ATOM 523 H ILE A 616 33.540 -1.100 99.534 1.00 0.00 H ATOM 524 N ASN A 617 33.934 -0.441 95.335 1.00100.25 N ATOM 525 CA ASN A 617 34.035 0.714 94.429 1.00102.39 C ATOM 526 C ASN A 617 35.165 1.673 94.800 1.00 95.59 C ATOM 527 O ASN A 617 35.044 2.891 94.712 1.00 94.95 O ATOM 528 CB ASN A 617 32.693 1.434 94.267 1.00103.28 C ATOM 529 CG ASN A 617 31.676 0.590 93.527 1.00114.32 C ATOM 530 OD1 ASN A 617 30.707 0.112 94.118 1.00115.57 O ATOM 531 ND2 ASN A 617 31.893 0.397 92.221 1.00122.20 N ATOM 532 HD22 ASN A 617 32.726 0.821 91.764 1.00 0.00 H ATOM 533 HD21 ASN A 617 31.229 -0.177 91.663 1.00 0.00 H ATOM 534 H ASN A 617 34.068 -1.392 94.937 1.00 0.00 H ATOM 535 N PHE A 618 36.283 1.077 95.174 1.00 95.89 N ATOM 536 CA PHE A 618 37.478 1.780 95.596 1.00 96.05 C ATOM 537 C PHE A 618 38.162 2.475 94.415 1.00100.14 C ATOM 538 O PHE A 618 39.094 3.263 94.594 1.00 96.35 O ATOM 539 CB PHE A 618 38.406 0.740 96.207 1.00 94.02 C ATOM 540 CG PHE A 618 39.573 1.305 96.931 1.00 93.09 C ATOM 541 CD1 PHE A 618 39.443 1.748 98.231 1.00 94.32 C ATOM 542 CD2 PHE A 618 40.818 1.347 96.332 1.00 94.90 C ATOM 543 CE1 PHE A 618 40.533 2.251 98.913 1.00 92.06 C ATOM 544 CE2 PHE A 618 41.913 1.846 97.009 1.00 93.61 C ATOM 545 CZ PHE A 618 41.771 2.297 98.299 1.00 90.83 C ATOM 546 H PHE A 618 36.307 0.037 95.165 1.00 0.00 H ATOM 547 N SER A 619 37.697 2.165 93.208 1.00107.21 N ATOM 548 CA SER A 619 38.249 2.745 91.987 1.00109.82 C ATOM 549 C SER A 619 37.941 4.230 91.940 1.00101.29 C ATOM 550 O SER A 619 38.763 5.037 91.524 1.00 99.83 O ATOM 551 CB SER A 619 37.656 2.060 90.753 1.00123.39 C ATOM 552 OG SER A 619 36.290 2.403 90.557 1.00129.27 O ATOM 553 HG SER A 619 35.764 2.124 91.348 1.00 0.00 H ATOM 554 H SER A 619 36.913 1.486 93.131 1.00 0.00 H ATOM 555 N ARG A 620 36.742 4.570 92.393 1.00 99.84 N ATOM 556 CA ARG A 620 36.239 5.934 92.391 1.00102.75 C ATOM 557 C ARG A 620 37.013 6.881 93.348 1.00 88.20 C ATOM 558 O ARG A 620 36.869 8.105 93.282 1.00 91.13 O ATOM 559 CB ARG A 620 34.747 5.880 92.726 1.00107.68 C ATOM 560 CG ARG A 620 33.998 7.192 92.595 1.00113.91 C ATOM 561 CD ARG A 620 33.365 7.386 91.226 1.00111.78 C ATOM 562 NE ARG A 620 32.309 8.403 91.272 1.00116.27 N ATOM 563 CZ ARG A 620 32.528 9.716 91.214 1.00119.30 C ATOM 564 NH1 ARG A 620 33.771 10.167 91.112 1.00121.68 N ATOM 565 NH2 ARG A 620 31.516 10.582 91.260 1.00118.36 N ATOM 566 HE ARG A 620 31.325 8.078 91.355 1.00 0.00 H ATOM 567 HH12 ARG A 620 33.951 11.190 91.066 1.00 0.00 H ATOM 568 HH11 ARG A 620 34.566 9.497 91.078 1.00 0.00 H ATOM 569 HH22 ARG A 620 31.704 11.604 91.214 1.00 0.00 H ATOM 570 HH21 ARG A 620 30.539 10.236 91.342 1.00 0.00 H ATOM 571 H ARG A 620 36.128 3.820 92.770 1.00 0.00 H ATOM 572 N LEU A 621 37.863 6.315 94.202 1.00 77.32 N ATOM 573 CA LEU A 621 38.617 7.100 95.168 1.00 80.30 C ATOM 574 C LEU A 621 40.046 7.411 94.718 1.00 91.33 C ATOM 575 O LEU A 621 40.697 6.573 94.109 1.00 99.29 O ATOM 576 CB LEU A 621 38.673 6.366 96.515 1.00 76.97 C ATOM 577 CG LEU A 621 37.357 5.980 97.205 1.00 82.38 C ATOM 578 CD1 LEU A 621 37.543 5.801 98.735 1.00 70.36 C ATOM 579 CD2 LEU A 621 36.266 6.984 96.911 1.00 83.17 C ATOM 580 H LEU A 621 37.992 5.283 94.178 1.00 0.00 H ATOM 581 N GLU A 622 40.528 8.610 95.039 1.00 94.19 N ATOM 582 CA GLU A 622 41.938 8.979 94.864 1.00 96.80 C ATOM 583 C GLU A 622 42.504 9.606 96.159 1.00 97.12 C ATOM 584 O GLU A 622 41.735 10.030 97.028 1.00102.68 O ATOM 585 CB GLU A 622 42.146 9.908 93.640 1.00 77.84 C ATOM 586 CG GLU A 622 41.314 11.186 93.613 1.00101.89 C ATOM 587 CD GLU A 622 41.463 12.004 92.312 1.00115.60 C ATOM 588 OE1 GLU A 622 42.464 11.838 91.569 1.00119.57 O ATOM 589 OE2 GLU A 622 40.566 12.831 92.036 1.00119.88 O ATOM 590 H GLU A 622 39.875 9.318 95.432 1.00 0.00 H ATOM 591 N HIS A 623 43.833 9.656 96.289 1.00 94.21 N ATOM 592 CA HIS A 623 44.494 10.312 97.426 1.00 93.63 C ATOM 593 C HIS A 623 44.058 9.689 98.755 1.00 90.21 C ATOM 594 O HIS A 623 43.714 10.405 99.693 1.00 95.67 O ATOM 595 CB HIS A 623 44.199 11.827 97.443 1.00106.25 C ATOM 596 CG HIS A 623 44.889 12.609 96.365 1.00120.92 C ATOM 597 ND1 HIS A 623 45.953 13.454 96.619 1.00127.61 N ATOM 598 CD2 HIS A 623 44.657 12.699 95.032 1.00124.07 C ATOM 599 CE1 HIS A 623 46.351 14.012 95.493 1.00131.94 C ATOM 600 NE2 HIS A 623 45.581 13.571 94.511 1.00129.74 N ATOM 601 H HIS A 623 44.423 9.213 95.556 1.00 0.00 H ATOM 602 N VAL A 624 44.072 8.360 98.826 1.00 81.71 N ATOM 603 CA VAL A 624 43.596 7.626 100.002 1.00 78.09 C ATOM 604 C VAL A 624 44.652 7.500 101.112 1.00 78.29 C ATOM 605 O VAL A 624 45.733 6.948 100.887 1.00 77.48 O ATOM 606 CB VAL A 624 43.127 6.203 99.624 1.00 71.82 C ATOM 607 CG1 VAL A 624 42.837 5.370 100.882 1.00 70.06 C ATOM 608 CG2 VAL A 624 41.904 6.264 98.727 1.00 62.63 C ATOM 609 H VAL A 624 44.435 7.821 98.014 1.00 0.00 H ATOM 610 N LEU A 625 44.309 7.992 102.306 1.00 71.51 N ATOM 611 CA LEU A 625 45.189 7.975 103.484 1.00 67.61 C ATOM 612 C LEU A 625 44.610 7.059 104.568 1.00 61.10 C ATOM 613 O LEU A 625 43.625 7.421 105.226 1.00 58.88 O ATOM 614 CB LEU A 625 45.319 9.377 104.085 1.00 68.72 C ATOM 615 CG LEU A 625 45.722 10.543 103.203 1.00 76.01 C ATOM 616 CD1 LEU A 625 45.694 11.856 103.987 1.00 72.82 C ATOM 617 CD2 LEU A 625 47.103 10.284 102.628 1.00 82.49 C ATOM 618 H LEU A 625 43.363 8.412 102.408 1.00 0.00 H ATOM 619 N PRO A 626 45.198 5.865 104.749 1.00 84.37 N ATOM 620 CA PRO A 626 44.723 4.955 105.795 1.00 84.22 C ATOM 621 C PRO A 626 45.295 5.282 107.182 1.00 82.71 C ATOM 622 O PRO A 626 46.450 5.711 107.291 1.00 82.11 O ATOM 623 CB PRO A 626 45.195 3.580 105.307 1.00 81.62 C ATOM 624 CG PRO A 626 46.354 3.853 104.421 1.00 83.63 C ATOM 625 CD PRO A 626 46.230 5.252 103.897 1.00 82.00 C ATOM 626 N ASN A 627 44.485 5.099 108.223 1.00 78.36 N ATOM 627 CA ASN A 627 44.948 5.340 109.572 1.00 71.81 C ATOM 628 C ASN A 627 46.248 4.591 109.829 1.00 69.90 C ATOM 629 O ASN A 627 46.271 3.359 109.764 1.00 62.61 O ATOM 630 CB ASN A 627 43.890 4.927 110.599 1.00 70.37 C ATOM 631 CG ASN A 627 44.263 5.344 112.016 1.00 74.69 C ATOM 632 OD1 ASN A 627 45.259 4.855 112.588 1.00 60.77 O ATOM 633 ND2 ASN A 627 43.482 6.273 112.583 1.00 65.61 N ATOM 634 HD22 ASN A 627 42.663 6.650 112.065 1.00 0.00 H ATOM 635 HD21 ASN A 627 43.695 6.617 113.541 1.00 0.00 H ATOM 636 H ASN A 627 43.508 4.779 108.064 1.00 0.00 H ATOM 637 N PRO A 628 47.330 5.339 110.129 1.00 69.84 N ATOM 638 CA PRO A 628 48.698 4.795 110.203 1.00 69.14 C ATOM 639 C PRO A 628 48.927 3.894 111.399 1.00 78.81 C ATOM 640 O PRO A 628 49.820 3.049 111.341 1.00 80.34 O ATOM 641 CB PRO A 628 49.585 6.044 110.300 1.00 72.47 C ATOM 642 CG PRO A 628 48.676 7.135 110.781 1.00 74.19 C ATOM 643 CD PRO A 628 47.287 6.800 110.339 1.00 73.22 C ATOM 644 N GLN A 629 48.128 4.067 112.452 1.00 84.69 N ATOM 645 CA GLN A 629 48.233 3.257 113.661 1.00 84.97 C ATOM 646 C GLN A 629 47.451 1.954 113.493 1.00 78.12 C ATOM 647 O GLN A 629 47.812 0.905 114.051 1.00 71.91 O ATOM 648 CB GLN A 629 47.731 4.064 114.874 1.00 92.18 C ATOM 649 CG GLN A 629 47.854 3.375 116.229 1.00 97.00 C ATOM 650 CD GLN A 629 49.295 3.137 116.655 1.00 94.97 C ATOM 651 OE1 GLN A 629 50.232 3.651 116.042 1.00 95.18 O ATOM 652 NE2 GLN A 629 49.476 2.350 117.714 1.00 90.62 N ATOM 653 HE22 GLN A 629 48.655 1.937 118.201 1.00 0.00 H ATOM 654 HE21 GLN A 629 50.438 2.148 118.054 1.00 0.00 H ATOM 655 H GLN A 629 47.401 4.809 112.410 1.00 0.00 H ATOM 656 N LEU A 630 46.401 2.021 112.682 1.00 74.02 N ATOM 657 CA LEU A 630 45.538 0.866 112.478 1.00 69.26 C ATOM 658 C LEU A 630 45.619 0.120 111.122 1.00 65.77 C ATOM 659 O LEU A 630 45.046 -0.963 111.040 1.00 62.64 O ATOM 660 CB LEU A 630 44.081 1.233 112.798 1.00 69.20 C ATOM 661 CG LEU A 630 43.853 1.980 114.118 1.00 70.72 C ATOM 662 CD1 LEU A 630 42.392 2.272 114.312 1.00 68.76 C ATOM 663 CD2 LEU A 630 44.394 1.222 115.322 1.00 70.85 C ATOM 664 H LEU A 630 46.192 2.911 112.186 1.00 0.00 H ATOM 665 N LEU A 631 46.320 0.656 110.099 1.00 67.44 N ATOM 666 CA LEU A 631 46.289 0.097 108.702 1.00 68.01 C ATOM 667 C LEU A 631 47.533 0.245 107.738 1.00101.05 C ATOM 668 O LEU A 631 48.366 1.140 107.890 1.00 96.04 O ATOM 669 CB LEU A 631 45.037 0.618 107.966 1.00 63.81 C ATOM 670 CG LEU A 631 43.612 0.316 108.450 1.00 62.34 C ATOM 671 CD1 LEU A 631 42.537 0.996 107.602 1.00 64.22 C ATOM 672 CD2 LEU A 631 43.388 -1.186 108.492 1.00 61.22 C ATOM 673 H LEU A 631 46.908 1.493 110.285 1.00 0.00 H ATOM 674 N CYS A 632 47.618 -0.658 106.750 1.00114.26 N ATOM 675 CA CYS A 632 48.474 -0.562 105.522 1.00126.95 C ATOM 676 C CYS A 632 50.001 -0.665 105.669 1.00132.90 C ATOM 677 O CYS A 632 50.754 0.184 105.162 1.00138.72 O ATOM 678 CB CYS A 632 48.067 0.602 104.573 1.00 73.66 C ATOM 679 SG CYS A 632 48.875 0.619 102.906 1.00173.16 S ATOM 680 H CYS A 632 47.031 -1.511 106.845 1.00 0.00 H ATOM 681 N CYS A 633 50.429 -1.733 106.340 1.00128.23 N ATOM 682 CA CYS A 633 51.822 -2.162 106.350 1.00125.95 C ATOM 683 C CYS A 633 51.898 -3.572 106.895 1.00115.24 C ATOM 684 O CYS A 633 51.235 -4.460 106.366 1.00110.38 O ATOM 685 CB CYS A 633 52.715 -1.203 107.141 1.00126.41 C ATOM 686 SG CYS A 633 53.558 -0.026 106.052 1.00262.40 S ATOM 687 H CYS A 633 49.736 -2.287 106.883 1.00 0.00 H TER 688 CYS A 633 ATOM 689 N ASP A 639 42.996 -4.684 94.363 1.00139.61 N ATOM 690 CA ASP A 639 43.132 -4.981 92.943 1.00138.80 C ATOM 691 C ASP A 639 42.913 -3.727 92.106 1.00142.02 C ATOM 692 O ASP A 639 43.839 -2.943 91.903 1.00146.06 O ATOM 693 CB ASP A 639 42.145 -6.071 92.529 1.00136.03 C ATOM 694 CG ASP A 639 42.435 -6.620 91.149 1.00142.39 C ATOM 695 OD1 ASP A 639 43.140 -7.648 91.053 1.00139.10 O ATOM 696 OD2 ASP A 639 41.959 -6.022 90.161 1.00149.79 O ATOM 697 HN3 ASP A 639 42.041 -4.318 94.549 1.00 0.00 H ATOM 698 HN2 ASP A 639 43.701 -3.970 94.636 1.00 0.00 H ATOM 699 HN1 ASP A 639 43.149 -5.553 94.914 1.00 0.00 H ATOM 700 N ALA A 640 41.687 -3.535 91.626 1.00140.56 N ATOM 701 CA ALA A 640 41.374 -2.379 90.788 1.00142.40 C ATOM 702 C ALA A 640 40.053 -1.702 91.163 1.00138.54 C ATOM 703 O ALA A 640 39.836 -0.538 90.828 1.00139.08 O ATOM 704 CB ALA A 640 41.380 -2.770 89.310 1.00145.25 C ATOM 705 H ALA A 640 40.938 -4.220 91.851 1.00 0.00 H ATOM 706 N ASN A 641 39.176 -2.425 91.859 1.00133.22 N ATOM 707 CA ASN A 641 37.870 -1.880 92.238 1.00130.47 C ATOM 708 C ASN A 641 37.430 -2.274 93.653 1.00115.66 C ATOM 709 O ASN A 641 36.460 -1.744 94.189 1.00110.55 O ATOM 710 CB ASN A 641 36.803 -2.279 91.213 1.00137.27 C ATOM 711 CG ASN A 641 35.505 -1.506 91.390 1.00143.48 C ATOM 712 OD1 ASN A 641 35.428 -0.317 91.079 1.00149.00 O ATOM 713 ND2 ASN A 641 34.476 -2.183 91.890 1.00142.62 N ATOM 714 HD22 ASN A 641 34.586 -3.187 92.139 1.00 0.00 H ATOM 715 HD21 ASN A 641 33.561 -1.709 92.032 1.00 0.00 H ATOM 716 H ASN A 641 39.424 -3.396 92.139 1.00 0.00 H ATOM 717 N THR A 642 38.157 -3.207 94.253 1.00108.84 N ATOM 718 CA THR A 642 37.894 -3.647 95.617 1.00 96.17 C ATOM 719 C THR A 642 39.183 -3.542 96.411 1.00 92.96 C ATOM 720 O THR A 642 40.242 -3.929 95.906 1.00 98.46 O ATOM 721 CB THR A 642 37.410 -5.108 95.633 1.00 93.63 C ATOM 722 OG1 THR A 642 36.040 -5.141 95.239 1.00 94.51 O ATOM 723 CG2 THR A 642 37.534 -5.735 97.038 1.00 98.79 C ATOM 724 HG1 THR A 642 35.718 -6.077 95.246 1.00 0.00 H ATOM 725 H THR A 642 38.944 -3.641 93.730 1.00 0.00 H ATOM 726 N LYS A 643 39.121 -3.019 97.636 1.00 82.31 N ATOM 727 CA LYS A 643 40.317 -3.083 98.492 1.00 79.20 C ATOM 728 C LYS A 643 40.028 -3.776 99.822 1.00 79.13 C ATOM 729 O LYS A 643 39.018 -3.499 100.470 1.00 80.21 O ATOM 730 CB LYS A 643 40.921 -1.687 98.722 1.00 86.46 C ATOM 731 CG LYS A 643 42.281 -1.672 99.451 1.00 88.91 C ATOM 732 CD LYS A 643 43.478 -1.656 98.492 1.00 95.27 C ATOM 733 CE LYS A 643 44.829 -1.693 99.224 1.00 96.22 C ATOM 734 NZ LYS A 643 45.197 -0.420 99.930 1.00 96.74 N ATOM 735 HZ1 LYS A 643 45.251 0.355 99.239 1.00 0.00 H ATOM 736 HZ2 LYS A 643 44.474 -0.200 100.644 1.00 0.00 H ATOM 737 HZ3 LYS A 643 46.120 -0.537 100.394 1.00 0.00 H ATOM 738 H LYS A 643 38.246 -2.575 97.980 1.00 0.00 H ATOM 739 N GLU A 644 40.920 -4.669 100.236 1.00 76.96 N ATOM 740 CA GLU A 644 40.751 -5.373 101.508 1.00 72.05 C ATOM 741 C GLU A 644 41.733 -4.866 102.575 1.00 76.87 C ATOM 742 O GLU A 644 42.922 -4.618 102.302 1.00 73.06 O ATOM 743 CB GLU A 644 40.882 -6.889 101.311 1.00 75.96 C ATOM 744 CG GLU A 644 39.686 -7.539 100.633 1.00 92.33 C ATOM 745 CD GLU A 644 40.025 -8.873 99.970 1.00112.34 C ATOM 746 OE1 GLU A 644 40.904 -9.598 100.492 1.00118.32 O ATOM 747 OE2 GLU A 644 39.419 -9.187 98.916 1.00120.15 O ATOM 748 H GLU A 644 41.752 -4.871 99.646 1.00 0.00 H ATOM 749 N PHE A 645 41.225 -4.710 103.794 1.00 78.96 N ATOM 750 CA PHE A 645 42.033 -4.266 104.928 1.00 73.82 C ATOM 751 C PHE A 645 41.949 -5.201 106.132 1.00 75.84 C ATOM 752 O PHE A 645 40.857 -5.614 106.546 1.00 76.65 O ATOM 753 CB PHE A 645 41.581 -2.886 105.392 1.00 71.48 C ATOM 754 CG PHE A 645 41.748 -1.810 104.371 1.00 74.68 C ATOM 755 CD1 PHE A 645 40.743 -1.552 103.450 1.00 79.81 C ATOM 756 CD2 PHE A 645 42.900 -1.032 104.350 1.00 72.24 C ATOM 757 CE1 PHE A 645 40.885 -0.542 102.504 1.00 80.38 C ATOM 758 CE2 PHE A 645 43.048 -0.023 103.416 1.00 79.86 C ATOM 759 CZ PHE A 645 42.038 0.222 102.488 1.00 79.09 C ATOM 760 H PHE A 645 40.216 -4.911 103.946 1.00 0.00 H ATOM 761 N TRP A 646 43.111 -5.500 106.707 1.00 75.32 N ATOM 762 CA TRP A 646 43.227 -6.194 107.997 1.00 62.88 C ATOM 763 C TRP A 646 43.594 -5.170 109.079 1.00 66.58 C ATOM 764 O TRP A 646 44.755 -4.751 109.141 1.00 53.33 O ATOM 765 CB TRP A 646 44.335 -7.256 107.900 1.00 58.63 C ATOM 766 CG TRP A 646 44.460 -8.214 109.075 1.00 74.15 C ATOM 767 CD1 TRP A 646 43.897 -8.080 110.313 1.00 75.03 C ATOM 768 CD2 TRP A 646 45.196 -9.456 109.107 1.00 73.99 C ATOM 769 NE1 TRP A 646 44.240 -9.143 111.104 1.00 74.55 N ATOM 770 CE2 TRP A 646 45.032 -10.000 110.394 1.00 67.61 C ATOM 771 CE3 TRP A 646 45.974 -10.148 108.174 1.00 71.37 C ATOM 772 CZ2 TRP A 646 45.613 -11.206 110.771 1.00 69.52 C ATOM 773 CZ3 TRP A 646 46.553 -11.347 108.554 1.00 72.28 C ATOM 774 CH2 TRP A 646 46.370 -11.863 109.838 1.00 78.31 C ATOM 775 HE1 TRP A 646 43.944 -9.277 112.092 1.00 0.00 H ATOM 776 H TRP A 646 43.986 -5.227 106.216 1.00 0.00 H ATOM 777 N VAL A 647 42.632 -4.765 109.920 1.00 65.38 N ATOM 778 CA VAL A 647 42.925 -3.854 111.048 1.00 65.04 C ATOM 779 C VAL A 647 43.976 -4.428 112.019 1.00 67.64 C ATOM 780 O VAL A 647 43.959 -5.631 112.301 1.00 69.68 O ATOM 781 CB VAL A 647 41.671 -3.527 111.878 1.00 65.65 C ATOM 782 CG1 VAL A 647 41.997 -2.447 112.942 1.00 63.22 C ATOM 783 CG2 VAL A 647 40.506 -3.096 110.982 1.00 59.29 C ATOM 784 H VAL A 647 41.658 -5.099 109.776 1.00 0.00 H ATOM 785 N ASN A 648 44.898 -3.584 112.502 1.00 69.50 N ATOM 786 CA ASN A 648 45.857 -3.968 113.558 1.00 69.14 C ATOM 787 C ASN A 648 45.152 -4.046 114.925 1.00 68.39 C ATOM 788 O ASN A 648 44.784 -3.015 115.497 1.00 66.88 O ATOM 789 CB ASN A 648 47.028 -2.970 113.618 1.00 70.74 C ATOM 790 CG ASN A 648 48.120 -3.384 114.605 1.00 68.31 C ATOM 791 OD1 ASN A 648 47.839 -3.663 115.769 1.00 74.71 O ATOM 792 ND2 ASN A 648 49.372 -3.421 114.141 1.00 56.33 N ATOM 793 HD22 ASN A 648 49.566 -3.177 113.149 1.00 0.00 H ATOM 794 HD21 ASN A 648 50.153 -3.694 114.772 1.00 0.00 H ATOM 795 H ASN A 648 44.940 -2.619 112.117 1.00 0.00 H ATOM 796 N MET A 649 44.966 -5.262 115.434 1.00 73.85 N ATOM 797 CA MET A 649 44.169 -5.476 116.641 1.00 90.66 C ATOM 798 C MET A 649 44.793 -4.953 117.953 1.00 86.58 C ATOM 799 O MET A 649 44.104 -4.297 118.726 1.00 84.76 O ATOM 800 CB MET A 649 43.727 -6.949 116.766 1.00103.07 C ATOM 801 CG MET A 649 42.925 -7.444 115.569 1.00108.61 C ATOM 802 SD MET A 649 41.387 -6.525 115.360 1.00150.35 S ATOM 803 CE MET A 649 40.594 -6.799 116.960 1.00 65.03 C ATOM 804 H MET A 649 45.399 -6.081 114.961 1.00 0.00 H ATOM 805 N PRO A 650 46.083 -5.250 118.209 1.00 82.41 N ATOM 806 CA PRO A 650 46.742 -4.671 119.386 1.00 82.88 C ATOM 807 C PRO A 650 46.652 -3.144 119.520 1.00 83.57 C ATOM 808 O PRO A 650 46.499 -2.629 120.649 1.00 94.95 O ATOM 809 CB PRO A 650 48.192 -5.116 119.204 1.00 77.04 C ATOM 810 CG PRO A 650 48.062 -6.462 118.566 1.00 75.67 C ATOM 811 CD PRO A 650 46.916 -6.314 117.606 1.00 79.48 C ATOM 812 N ASN A 651 46.727 -2.426 118.403 1.00 64.26 N ATOM 813 CA ASN A 651 46.664 -0.973 118.477 1.00 66.73 C ATOM 814 C ASN A 651 45.232 -0.479 118.637 1.00 73.80 C ATOM 815 O ASN A 651 44.984 0.541 119.292 1.00 78.51 O ATOM 816 CB ASN A 651 47.314 -0.334 117.261 1.00 56.14 C ATOM 817 CG ASN A 651 48.733 -0.796 117.053 1.00 65.09 C ATOM 818 OD1 ASN A 651 49.279 -1.528 117.862 1.00 73.34 O ATOM 819 ND2 ASN A 651 49.334 -0.380 115.945 1.00 69.01 N ATOM 820 HD22 ASN A 651 48.830 0.244 115.283 1.00 0.00 H ATOM 821 HD21 ASN A 651 50.309 -0.678 115.739 1.00 0.00 H ATOM 822 H ASN A 651 46.830 -2.899 117.483 1.00 0.00 H ATOM 823 N LEU A 652 44.298 -1.217 118.038 1.00 69.43 N ATOM 824 CA LEU A 652 42.883 -0.904 118.132 1.00 69.83 C ATOM 825 C LEU A 652 42.489 -1.049 119.592 1.00 82.69 C ATOM 826 O LEU A 652 41.794 -0.203 120.144 1.00 85.62 O ATOM 827 CB LEU A 652 42.080 -1.887 117.300 1.00 65.05 C ATOM 828 CG LEU A 652 40.701 -1.530 116.742 1.00 66.48 C ATOM 829 CD1 LEU A 652 39.735 -2.669 117.004 1.00 66.61 C ATOM 830 CD2 LEU A 652 40.169 -0.216 117.284 1.00 74.25 C ATOM 831 H LEU A 652 44.593 -2.046 117.484 1.00 0.00 H ATOM 832 N MET A 653 42.940 -2.140 120.201 1.00 81.96 N ATOM 833 CA MET A 653 42.643 -2.442 121.591 1.00 88.78 C ATOM 834 C MET A 653 43.284 -1.424 122.524 1.00 94.73 C ATOM 835 O MET A 653 42.650 -0.979 123.475 1.00 98.28 O ATOM 836 CB MET A 653 43.144 -3.837 121.961 1.00 87.65 C ATOM 837 CG MET A 653 42.344 -4.999 121.423 1.00 85.16 C ATOM 838 SD MET A 653 43.179 -6.547 121.901 1.00112.27 S ATOM 839 CE MET A 653 41.802 -7.526 122.502 1.00163.60 C ATOM 840 H MET A 653 43.530 -2.805 119.661 1.00 0.00 H ATOM 841 N THR A 654 44.546 -1.075 122.268 1.00 90.87 N ATOM 842 CA THR A 654 45.218 -0.046 123.066 1.00 87.29 C ATOM 843 C THR A 654 44.425 1.261 123.054 1.00 87.50 C ATOM 844 O THR A 654 44.105 1.843 124.104 1.00101.13 O ATOM 845 CB THR A 654 46.643 0.209 122.557 1.00 76.01 C ATOM 846 OG1 THR A 654 47.526 -0.725 123.170 1.00 79.38 O ATOM 847 CG2 THR A 654 47.115 1.599 122.917 1.00 80.77 C ATOM 848 HG1 THR A 654 47.246 -1.645 122.935 1.00 0.00 H ATOM 849 H THR A 654 45.060 -1.539 121.492 1.00 0.00 H ATOM 850 N HIS A 655 44.111 1.704 121.846 1.00 73.76 N ATOM 851 CA HIS A 655 43.293 2.875 121.621 1.00 74.51 C ATOM 852 C HIS A 655 41.961 2.805 122.390 1.00 80.24 C ATOM 853 O HIS A 655 41.611 3.714 123.146 1.00 79.24 O ATOM 854 CB HIS A 655 43.012 2.990 120.127 1.00 68.56 C ATOM 855 CG HIS A 655 42.178 4.169 119.775 1.00 72.43 C ATOM 856 ND1 HIS A 655 42.701 5.442 119.698 1.00 80.53 N ATOM 857 CD2 HIS A 655 40.860 4.277 119.505 1.00 75.14 C ATOM 858 CE1 HIS A 655 41.734 6.283 119.385 1.00 87.77 C ATOM 859 NE2 HIS A 655 40.607 5.605 119.263 1.00 83.91 N ATOM 860 H HIS A 655 44.470 1.185 121.020 1.00 0.00 H ATOM 861 N LEU A 656 41.225 1.718 122.193 1.00 83.07 N ATOM 862 CA LEU A 656 39.880 1.592 122.740 1.00 88.14 C ATOM 863 C LEU A 656 39.895 1.552 124.267 1.00 99.13 C ATOM 864 O LEU A 656 38.997 2.094 124.916 1.00100.27 O ATOM 865 CB LEU A 656 39.144 0.379 122.149 1.00 84.89 C ATOM 866 CG LEU A 656 38.658 0.490 120.699 1.00 82.18 C ATOM 867 CD1 LEU A 656 37.774 -0.693 120.346 1.00 84.58 C ATOM 868 CD2 LEU A 656 37.914 1.794 120.450 1.00 78.39 C ATOM 869 H LEU A 656 41.619 0.935 121.633 1.00 0.00 H ATOM 870 N LYS A 657 40.922 0.918 124.829 1.00101.44 N ATOM 871 CA LYS A 657 41.132 0.914 126.271 1.00105.59 C ATOM 872 C LYS A 657 41.401 2.332 126.781 1.00109.68 C ATOM 873 O LYS A 657 40.848 2.750 127.815 1.00116.51 O ATOM 874 CB LYS A 657 42.266 -0.047 126.650 1.00106.31 C ATOM 875 CG LYS A 657 42.929 0.262 127.972 1.00118.98 C ATOM 876 CD LYS A 657 44.036 -0.734 128.293 1.00125.32 C ATOM 877 CE LYS A 657 43.578 -1.792 129.293 1.00134.38 C ATOM 878 NZ LYS A 657 43.131 -1.209 130.591 1.00116.71 N ATOM 879 HZ1 LYS A 657 43.918 -0.684 131.023 1.00 0.00 H ATOM 880 HZ2 LYS A 657 42.333 -0.564 130.423 1.00 0.00 H ATOM 881 HZ3 LYS A 657 42.832 -1.974 131.229 1.00 0.00 H ATOM 882 H LYS A 657 41.595 0.410 124.220 1.00 0.00 H ATOM 883 N LYS A 658 42.231 3.079 126.051 1.00103.58 N ATOM 884 CA LYS A 658 42.491 4.472 126.419 1.00104.94 C ATOM 885 C LYS A 658 41.215 5.323 126.426 1.00106.43 C ATOM 886 O LYS A 658 40.895 5.977 127.428 1.00120.26 O ATOM 887 CB LYS A 658 43.564 5.097 125.526 1.00104.13 C ATOM 888 CG LYS A 658 43.829 6.567 125.818 1.00114.63 C ATOM 889 CD LYS A 658 45.177 7.027 125.245 1.00121.96 C ATOM 890 CE LYS A 658 46.348 6.356 125.972 1.00128.97 C ATOM 891 NZ LYS A 658 47.693 6.939 125.657 1.00126.92 N ATOM 892 HZ1 LYS A 658 47.878 6.849 124.638 1.00 0.00 H ATOM 893 HZ2 LYS A 658 47.706 7.944 125.926 1.00 0.00 H ATOM 894 HZ3 LYS A 658 48.425 6.427 126.190 1.00 0.00 H ATOM 895 H LYS A 658 42.696 2.669 125.216 1.00 0.00 H ATOM 896 N VAL A 659 40.470 5.284 125.328 1.00 91.99 N ATOM 897 CA VAL A 659 39.241 6.071 125.234 1.00 96.77 C ATOM 898 C VAL A 659 38.154 5.640 126.244 1.00107.80 C ATOM 899 O VAL A 659 37.427 6.491 126.777 1.00114.59 O ATOM 900 CB VAL A 659 38.689 6.155 123.779 1.00 90.33 C ATOM 901 CG1 VAL A 659 39.690 6.852 122.872 1.00 85.77 C ATOM 902 CG2 VAL A 659 38.391 4.773 123.224 1.00 85.07 C ATOM 903 H VAL A 659 40.763 4.688 124.527 1.00 0.00 H ATOM 904 N SER A 660 38.058 4.341 126.536 1.00109.26 N ATOM 905 CA SER A 660 37.056 3.859 127.502 1.00110.23 C ATOM 906 C SER A 660 37.414 4.140 128.969 1.00120.70 C ATOM 907 O SER A 660 36.524 4.242 129.824 1.00127.82 O ATOM 908 CB SER A 660 36.735 2.374 127.297 1.00105.27 C ATOM 909 OG SER A 660 37.842 1.558 127.626 1.00108.23 O ATOM 910 HG SER A 660 38.610 1.797 127.049 1.00 0.00 H ATOM 911 H SER A 660 38.698 3.662 126.076 1.00 0.00 H ATOM 912 N GLU A 661 38.703 4.258 129.275 1.00120.10 N ATOM 913 CA GLU A 661 39.064 4.812 130.577 1.00120.91 C ATOM 914 C GLU A 661 38.755 6.304 130.590 1.00128.24 C ATOM 915 O GLU A 661 38.295 6.832 131.589 1.00136.60 O ATOM 916 CB GLU A 661 40.536 4.607 130.903 1.00119.47 C ATOM 917 CG GLU A 661 40.940 3.184 131.184 1.00124.29 C ATOM 918 CD GLU A 661 42.448 3.036 131.241 1.00127.88 C ATOM 919 OE1 GLU A 661 43.125 3.592 130.346 1.00128.01 O ATOM 920 OE2 GLU A 661 42.956 2.388 132.182 1.00128.54 O ATOM 921 H GLU A 661 39.438 3.962 128.601 1.00 0.00 H ATOM 922 N GLN A 662 39.008 6.992 129.479 1.00132.72 N ATOM 923 CA GLN A 662 38.819 8.444 129.469 1.00137.06 C ATOM 924 C GLN A 662 37.340 8.850 129.469 1.00133.20 C ATOM 925 O GLN A 662 36.947 9.776 130.173 1.00133.79 O ATOM 926 CB GLN A 662 39.596 9.106 128.319 1.00139.36 C ATOM 927 CG GLN A 662 39.728 10.639 128.430 1.00151.55 C ATOM 928 CD GLN A 662 40.616 11.114 129.595 1.00163.60 C ATOM 929 OE1 GLN A 662 41.434 10.360 130.122 1.00169.16 O ATOM 930 NE2 GLN A 662 40.453 12.378 129.989 1.00165.72 N ATOM 931 HE22 GLN A 662 39.751 12.983 129.518 1.00 0.00 H ATOM 932 HE21 GLN A 662 41.028 12.758 130.768 1.00 0.00 H ATOM 933 H GLN A 662 39.338 6.501 128.623 1.00 0.00 H ATOM 934 N LYS A 663 36.521 8.157 128.689 1.00131.70 N ATOM 935 CA LYS A 663 35.088 8.434 128.687 1.00134.72 C ATOM 936 C LYS A 663 34.324 7.171 129.052 1.00133.41 C ATOM 937 O LYS A 663 33.767 6.500 128.177 1.00126.10 O ATOM 938 CB LYS A 663 34.645 8.960 127.323 1.00134.57 C ATOM 939 CG LYS A 663 35.481 10.132 126.816 1.00136.45 C ATOM 940 CD LYS A 663 34.980 10.664 125.477 1.00136.20 C ATOM 941 CE LYS A 663 33.634 11.384 125.600 1.00141.40 C ATOM 942 NZ LYS A 663 33.718 12.657 126.376 1.00146.03 N ATOM 943 HZ1 LYS A 663 34.056 12.453 127.338 1.00 0.00 H ATOM 944 HZ2 LYS A 663 34.381 13.306 125.905 1.00 0.00 H ATOM 945 HZ3 LYS A 663 32.776 13.096 126.423 1.00 0.00 H ATOM 946 H LYS A 663 36.903 7.410 128.074 1.00 0.00 H ATOM 947 N PRO A 664 34.306 6.839 130.358 1.00136.33 N ATOM 948 CA PRO A 664 33.766 5.583 130.887 1.00135.64 C ATOM 949 C PRO A 664 32.274 5.508 130.693 1.00133.80 C ATOM 950 O PRO A 664 31.704 4.421 130.672 1.00125.65 O ATOM 951 CB PRO A 664 34.072 5.672 132.384 1.00143.52 C ATOM 952 CG PRO A 664 35.129 6.708 132.511 1.00144.80 C ATOM 953 CD PRO A 664 34.830 7.692 131.434 1.00141.78 C ATOM 954 N GLN A 665 31.650 6.667 130.552 1.00133.90 N ATOM 955 CA GLN A 665 30.210 6.727 130.419 1.00141.64 C ATOM 956 C GLN A 665 29.855 7.127 129.004 1.00132.51 C ATOM 957 O GLN A 665 29.049 8.027 128.772 1.00133.06 O ATOM 958 CB GLN A 665 29.624 7.705 131.435 1.00151.96 C ATOM 959 CG GLN A 665 30.410 8.984 131.536 1.00154.30 C ATOM 960 CD GLN A 665 30.133 9.708 132.812 1.00163.11 C ATOM 961 OE1 GLN A 665 29.256 9.317 133.576 1.00174.18 O ATOM 962 NE2 GLN A 665 30.884 10.770 133.065 1.00164.30 N ATOM 963 HE22 GLN A 665 31.616 11.063 132.386 1.00 0.00 H ATOM 964 HE21 GLN A 665 30.742 11.310 133.942 1.00 0.00 H ATOM 965 H GLN A 665 32.203 7.548 130.537 1.00 0.00 H ATOM 966 N ALA A 666 30.476 6.443 128.055 1.00126.60 N ATOM 967 CA ALA A 666 30.173 6.648 126.650 1.00121.86 C ATOM 968 C ALA A 666 29.641 5.344 126.061 1.00124.39 C ATOM 969 O ALA A 666 30.120 4.262 126.403 1.00134.12 O ATOM 970 CB ALA A 666 31.404 7.108 125.914 1.00105.37 C ATOM 971 H ALA A 666 31.197 5.743 128.322 1.00 0.00 H ATOM 972 N THR A 667 28.647 5.452 125.185 1.00118.22 N ATOM 973 CA THR A 667 27.968 4.282 124.630 1.00120.11 C ATOM 974 C THR A 667 28.646 3.689 123.378 1.00117.39 C ATOM 975 O THR A 667 28.432 2.526 123.033 1.00121.82 O ATOM 976 CB THR A 667 26.486 4.595 124.331 1.00126.02 C ATOM 977 OG1 THR A 667 26.155 4.127 123.017 1.00123.31 O ATOM 978 CG2 THR A 667 26.230 6.099 124.399 1.00127.45 C ATOM 979 HG1 THR A 667 25.205 4.328 122.826 1.00 0.00 H ATOM 980 H THR A 667 28.342 6.400 124.885 1.00 0.00 H ATOM 981 N TYR A 668 29.460 4.484 122.695 1.00108.16 N ATOM 982 CA TYR A 668 30.226 3.978 121.564 1.00101.51 C ATOM 983 C TYR A 668 31.510 4.767 121.375 1.00 96.41 C ATOM 984 O TYR A 668 31.646 5.875 121.878 1.00102.22 O ATOM 985 CB TYR A 668 29.397 3.994 120.269 1.00105.15 C ATOM 986 CG TYR A 668 28.777 5.335 119.915 1.00108.96 C ATOM 987 CD1 TYR A 668 27.492 5.659 120.336 1.00117.77 C ATOM 988 CD2 TYR A 668 29.465 6.270 119.149 1.00104.34 C ATOM 989 CE1 TYR A 668 26.910 6.877 120.013 1.00119.17 C ATOM 990 CE2 TYR A 668 28.890 7.496 118.824 1.00108.00 C ATOM 991 CZ TYR A 668 27.611 7.791 119.261 1.00114.78 C ATOM 992 OH TYR A 668 27.025 8.993 118.947 1.00116.93 O ATOM 993 HH TYR A 668 26.963 9.081 117.963 1.00 0.00 H ATOM 994 H TYR A 668 29.552 5.482 122.971 1.00 0.00 H ATOM 995 N TYR A 669 32.453 4.193 120.646 1.00 89.86 N ATOM 996 CA TYR A 669 33.686 4.893 120.324 1.00 90.32 C ATOM 997 C TYR A 669 33.896 4.911 118.803 1.00 89.77 C ATOM 998 O TYR A 669 33.931 3.858 118.167 1.00 92.05 O ATOM 999 CB TYR A 669 34.859 4.235 121.061 1.00 89.12 C ATOM 1000 CG TYR A 669 34.558 3.945 122.528 1.00100.80 C ATOM 1001 CD1 TYR A 669 34.796 4.895 123.517 1.00104.47 C ATOM 1002 CD2 TYR A 669 34.025 2.720 122.921 1.00105.52 C ATOM 1003 CE1 TYR A 669 34.511 4.628 124.857 1.00111.83 C ATOM 1004 CE2 TYR A 669 33.742 2.443 124.253 1.00108.63 C ATOM 1005 CZ TYR A 669 33.983 3.397 125.219 1.00114.03 C ATOM 1006 OH TYR A 669 33.694 3.113 126.548 1.00120.07 O ATOM 1007 HH TYR A 669 33.923 3.896 127.109 1.00 0.00 H ATOM 1008 H TYR A 669 32.310 3.224 120.297 1.00 0.00 H ATOM 1009 N ASN A 670 33.993 6.112 118.232 1.00 84.71 N ATOM 1010 CA ASN A 670 34.263 6.304 116.804 1.00 73.16 C ATOM 1011 C ASN A 670 35.759 6.290 116.492 1.00 66.74 C ATOM 1012 O ASN A 670 36.536 6.970 117.142 1.00 69.82 O ATOM 1013 CB ASN A 670 33.687 7.641 116.330 1.00 70.31 C ATOM 1014 CG ASN A 670 32.175 7.650 116.269 1.00 82.17 C ATOM 1015 OD1 ASN A 670 31.540 6.635 115.974 1.00 81.38 O ATOM 1016 ND2 ASN A 670 31.589 8.814 116.522 1.00 77.01 N ATOM 1017 HD22 ASN A 670 32.166 9.644 116.767 1.00 0.00 H ATOM 1018 HD21 ASN A 670 30.553 8.896 116.475 1.00 0.00 H ATOM 1019 H ASN A 670 33.871 6.954 118.829 1.00 0.00 H ATOM 1020 N VAL A 671 36.165 5.541 115.477 1.00 68.09 N ATOM 1021 CA VAL A 671 37.577 5.460 115.109 1.00 66.04 C ATOM 1022 C VAL A 671 37.809 5.849 113.625 1.00 78.14 C ATOM 1023 O VAL A 671 37.287 5.181 112.722 1.00 71.20 O ATOM 1024 CB VAL A 671 38.091 4.034 115.358 1.00 67.09 C ATOM 1025 CG1 VAL A 671 39.533 3.914 114.966 1.00 74.10 C ATOM 1026 CG2 VAL A 671 37.911 3.643 116.801 1.00 63.67 C ATOM 1027 H VAL A 671 35.464 5.000 114.931 1.00 0.00 H ATOM 1028 N ASP A 672 38.573 6.920 113.374 1.00 79.67 N ATOM 1029 CA ASP A 672 38.920 7.338 111.994 1.00 71.17 C ATOM 1030 C ASP A 672 39.717 6.273 111.294 1.00 68.09 C ATOM 1031 O ASP A 672 40.859 6.024 111.673 1.00 65.80 O ATOM 1032 CB ASP A 672 39.785 8.598 111.973 1.00 67.79 C ATOM 1033 CG ASP A 672 38.988 9.872 112.197 1.00 87.35 C ATOM 1034 OD1 ASP A 672 37.738 9.828 112.101 1.00 90.06 O ATOM 1035 OD2 ASP A 672 39.626 10.924 112.458 1.00 97.11 O ATOM 1036 H ASP A 672 38.935 7.477 114.174 1.00 0.00 H ATOM 1037 N MET A 673 39.133 5.657 110.266 1.00 67.44 N ATOM 1038 CA MET A 673 39.810 4.571 109.554 1.00 65.77 C ATOM 1039 C MET A 673 40.406 4.969 108.205 1.00 70.85 C ATOM 1040 O MET A 673 41.453 4.452 107.814 1.00 65.40 O ATOM 1041 CB MET A 673 38.866 3.398 109.332 1.00 70.80 C ATOM 1042 CG MET A 673 38.307 2.793 110.598 1.00 80.69 C ATOM 1043 SD MET A 673 39.572 2.095 111.680 1.00 98.90 S ATOM 1044 CE MET A 673 40.503 1.121 110.525 1.00 64.05 C ATOM 1045 H MET A 673 38.182 5.952 109.965 1.00 0.00 H ATOM 1046 N LEU A 674 39.738 5.874 107.491 1.00 75.66 N ATOM 1047 CA LEU A 674 40.130 6.166 106.109 1.00 62.20 C ATOM 1048 C LEU A 674 39.853 7.609 105.735 1.00 60.76 C ATOM 1049 O LEU A 674 38.760 8.103 105.971 1.00 60.07 O ATOM 1050 CB LEU A 674 39.327 5.275 105.172 1.00 63.23 C ATOM 1051 CG LEU A 674 39.999 4.286 104.220 1.00 61.97 C ATOM 1052 CD1 LEU A 674 41.440 4.013 104.564 1.00 56.74 C ATOM 1053 CD2 LEU A 674 39.217 2.983 104.220 1.00 65.68 C ATOM 1054 H LEU A 674 38.933 6.377 107.917 1.00 0.00 H ATOM 1055 N LYS A 675 40.828 8.301 105.159 1.00 54.38 N ATOM 1056 CA LYS A 675 40.546 9.625 104.624 1.00 64.00 C ATOM 1057 C LYS A 675 40.839 9.625 103.111 1.00 66.32 C ATOM 1058 O LYS A 675 41.778 8.966 102.650 1.00 64.61 O ATOM 1059 CB LYS A 675 41.336 10.708 105.366 1.00 64.83 C ATOM 1060 CG LYS A 675 40.866 10.987 106.777 1.00 74.38 C ATOM 1061 CD LYS A 675 41.971 11.640 107.624 1.00 81.40 C ATOM 1062 CE LYS A 675 41.526 11.935 109.043 1.00 81.57 C ATOM 1063 NZ LYS A 675 40.641 13.137 109.139 1.00 82.03 N ATOM 1064 HZ1 LYS A 675 41.152 13.972 108.787 1.00 0.00 H ATOM 1065 HZ2 LYS A 675 39.788 12.984 108.565 1.00 0.00 H ATOM 1066 HZ3 LYS A 675 40.370 13.288 110.132 1.00 0.00 H ATOM 1067 H LYS A 675 41.785 7.901 105.090 1.00 0.00 H ATOM 1068 N TYR A 676 40.040 10.358 102.339 1.00 62.83 N ATOM 1069 CA TYR A 676 40.120 10.224 100.894 1.00 60.11 C ATOM 1070 C TYR A 676 39.525 11.358 100.088 1.00 66.42 C ATOM 1071 O TYR A 676 38.685 12.127 100.549 1.00 67.01 O ATOM 1072 CB TYR A 676 39.465 8.905 100.447 1.00 60.32 C ATOM 1073 CG TYR A 676 38.008 8.777 100.831 1.00 60.88 C ATOM 1074 CD1 TYR A 676 37.004 9.375 100.066 1.00 53.40 C ATOM 1075 CD2 TYR A 676 37.633 8.063 101.978 1.00 56.76 C ATOM 1076 CE1 TYR A 676 35.669 9.258 100.419 1.00 65.58 C ATOM 1077 CE2 TYR A 676 36.295 7.938 102.346 1.00 54.49 C ATOM 1078 CZ TYR A 676 35.320 8.534 101.562 1.00 65.18 C ATOM 1079 OH TYR A 676 34.005 8.411 101.933 1.00 72.63 O ATOM 1080 HH TYR A 676 33.433 8.886 101.279 1.00 0.00 H ATOM 1081 H TYR A 676 39.363 11.022 102.767 1.00 0.00 H ATOM 1082 N GLN A 677 39.983 11.440 98.848 1.00 81.45 N ATOM 1083 CA GLN A 677 39.340 12.276 97.854 1.00 84.41 C ATOM 1084 C GLN A 677 38.510 11.399 96.914 1.00 77.18 C ATOM 1085 O GLN A 677 38.676 10.168 96.851 1.00 69.66 O ATOM 1086 CB GLN A 677 40.369 13.105 97.100 1.00 84.40 C ATOM 1087 CG GLN A 677 41.115 14.077 98.001 1.00 93.96 C ATOM 1088 CD GLN A 677 41.998 15.057 97.247 1.00106.89 C ATOM 1089 OE1 GLN A 677 41.578 15.667 96.250 1.00105.03 O ATOM 1090 NE2 GLN A 677 43.237 15.214 97.723 1.00111.74 N ATOM 1091 HE22 GLN A 677 43.543 14.681 98.562 1.00 0.00 H ATOM 1092 HE21 GLN A 677 43.895 15.870 97.255 1.00 0.00 H ATOM 1093 H GLN A 677 40.825 10.891 98.581 1.00 0.00 H ATOM 1094 N VAL A 678 37.580 12.040 96.228 1.00 74.27 N ATOM 1095 CA VAL A 678 36.714 11.377 95.264 1.00 77.17 C ATOM 1096 C VAL A 678 36.893 12.102 93.959 1.00 75.34 C ATOM 1097 O VAL A 678 36.632 13.308 93.882 1.00 83.42 O ATOM 1098 CB VAL A 678 35.233 11.489 95.674 1.00 82.72 C ATOM 1099 CG1 VAL A 678 34.320 11.161 94.491 1.00 73.31 C ATOM 1100 CG2 VAL A 678 34.926 10.619 96.916 1.00 64.54 C ATOM 1101 H VAL A 678 37.462 13.062 96.383 1.00 0.00 H ATOM 1102 N SER A 679 37.375 11.386 92.947 1.00 90.97 N ATOM 1103 CA SER A 679 37.515 11.939 91.597 1.00 90.53 C ATOM 1104 C SER A 679 36.178 12.492 91.143 1.00 90.38 C ATOM 1105 O SER A 679 35.162 11.812 91.210 1.00 82.17 O ATOM 1106 CB SER A 679 37.971 10.856 90.630 1.00 94.10 C ATOM 1107 OG SER A 679 37.045 9.785 90.627 1.00 95.59 O ATOM 1108 HG SER A 679 36.157 10.119 90.346 1.00 0.00 H ATOM 1109 H SER A 679 37.662 10.401 93.119 1.00 0.00 H ATOM 1110 N ALA A 680 36.164 13.744 90.717 1.00 95.37 N ATOM 1111 CA ALA A 680 34.914 14.383 90.334 1.00 96.29 C ATOM 1112 C ALA A 680 35.041 14.957 88.925 1.00105.94 C ATOM 1113 O ALA A 680 36.057 15.565 88.586 1.00107.92 O ATOM 1114 CB ALA A 680 34.570 15.466 91.325 1.00 94.39 C ATOM 1115 H ALA A 680 37.055 14.277 90.655 1.00 0.00 H ATOM 1116 N GLN A 681 34.017 14.749 88.101 1.00111.48 N ATOM 1117 CA GLN A 681 34.032 15.249 86.725 1.00109.32 C ATOM 1118 C GLN A 681 33.132 16.485 86.589 1.00 98.59 C ATOM 1119 O GLN A 681 32.034 16.406 86.035 1.00102.93 O ATOM 1120 CB GLN A 681 33.617 14.151 85.739 1.00113.89 C ATOM 1121 CG GLN A 681 33.740 14.532 84.256 1.00126.67 C ATOM 1122 CD GLN A 681 34.984 13.963 83.573 1.00133.50 C ATOM 1123 OE1 GLN A 681 36.108 14.403 83.828 1.00136.78 O ATOM 1124 NE2 GLN A 681 34.782 12.986 82.694 1.00132.19 N ATOM 1125 HE22 GLN A 681 33.817 12.644 82.509 1.00 0.00 H ATOM 1126 HE21 GLN A 681 35.589 12.563 82.192 1.00 0.00 H ATOM 1127 H GLN A 681 33.189 14.220 88.442 1.00 0.00 H ATOM 1128 N GLY A 682 33.599 17.613 87.123 1.00 82.28 N ATOM 1129 CA GLY A 682 32.936 18.883 86.932 1.00 73.49 C ATOM 1130 C GLY A 682 31.486 18.932 87.366 1.00 93.22 C ATOM 1131 O GLY A 682 31.082 18.251 88.306 1.00 94.22 O ATOM 1132 H GLY A 682 34.467 17.578 87.695 1.00 0.00 H ATOM 1133 N ILE A 683 30.707 19.749 86.669 1.00 91.03 N ATOM 1134 CA ILE A 683 29.317 20.028 87.015 1.00 84.08 C ATOM 1135 C ILE A 683 28.471 18.766 87.253 1.00 79.16 C ATOM 1136 O ILE A 683 27.555 18.780 88.069 1.00 74.62 O ATOM 1137 CB ILE A 683 28.672 20.956 85.944 1.00 96.56 C ATOM 1138 CG1 ILE A 683 28.319 22.311 86.551 1.00 89.70 C ATOM 1139 CG2 ILE A 683 27.444 20.319 85.292 1.00 91.78 C ATOM 1140 CD1 ILE A 683 26.869 22.426 86.943 1.00 90.17 C ATOM 1141 H ILE A 683 31.109 20.216 85.831 1.00 0.00 H ATOM 1142 N GLN A 684 28.797 17.675 86.563 1.00 80.61 N ATOM 1143 CA GLN A 684 28.055 16.420 86.704 1.00 84.64 C ATOM 1144 C GLN A 684 28.135 15.842 88.134 1.00 86.47 C ATOM 1145 O GLN A 684 27.167 15.260 88.633 1.00 81.60 O ATOM 1146 CB GLN A 684 28.534 15.391 85.665 1.00 89.91 C ATOM 1147 CG GLN A 684 28.816 15.996 84.272 1.00106.90 C ATOM 1148 CD GLN A 684 29.293 14.978 83.215 1.00121.85 C ATOM 1149 OE1 GLN A 684 28.694 13.912 83.029 1.00123.13 O ATOM 1150 NE2 GLN A 684 30.369 15.321 82.514 1.00127.46 N ATOM 1151 HE22 GLN A 684 30.844 16.227 82.701 1.00 0.00 H ATOM 1152 HE21 GLN A 684 30.735 14.684 81.779 1.00 0.00 H ATOM 1153 H GLN A 684 29.601 17.715 85.905 1.00 0.00 H ATOM 1154 N SER A 685 29.285 16.026 88.787 1.00 85.57 N ATOM 1155 CA SER A 685 29.545 15.479 90.120 1.00 79.45 C ATOM 1156 C SER A 685 28.991 16.340 91.239 1.00 77.78 C ATOM 1157 O SER A 685 29.332 16.145 92.395 1.00 87.39 O ATOM 1158 CB SER A 685 31.049 15.299 90.340 1.00 77.86 C ATOM 1159 OG SER A 685 31.591 14.356 89.432 1.00 77.79 O ATOM 1160 HG SER A 685 32.562 14.261 89.598 1.00 0.00 H ATOM 1161 H SER A 685 30.032 16.585 88.327 1.00 0.00 H ATOM 1162 N THR A 686 28.121 17.277 90.894 1.00 75.64 N ATOM 1163 CA THR A 686 27.649 18.288 91.834 1.00 75.78 C ATOM 1164 C THR A 686 26.160 18.084 92.146 1.00 72.75 C ATOM 1165 O THR A 686 25.336 18.030 91.251 1.00 77.46 O ATOM 1166 CB THR A 686 27.959 19.695 91.266 1.00 80.71 C ATOM 1167 OG1 THR A 686 29.142 20.222 91.885 1.00 79.40 O ATOM 1168 CG2 THR A 686 26.812 20.640 91.470 1.00 83.83 C ATOM 1169 HG1 THR A 686 29.333 21.121 91.517 1.00 0.00 H ATOM 1170 H THR A 686 27.761 17.293 89.918 1.00 0.00 H ATOM 1171 N PRO A 687 25.813 17.919 93.425 1.00 74.90 N ATOM 1172 CA PRO A 687 24.412 17.580 93.710 1.00 70.29 C ATOM 1173 C PRO A 687 23.441 18.756 93.597 1.00 66.11 C ATOM 1174 O PRO A 687 22.242 18.520 93.416 1.00 63.63 O ATOM 1175 CB PRO A 687 24.465 17.013 95.135 1.00 63.85 C ATOM 1176 CG PRO A 687 25.719 17.533 95.703 1.00 64.06 C ATOM 1177 CD PRO A 687 26.688 17.742 94.597 1.00 69.99 C ATOM 1178 N LEU A 688 23.937 19.987 93.680 1.00 67.24 N ATOM 1179 CA LEU A 688 23.092 21.155 93.399 1.00 72.47 C ATOM 1180 C LEU A 688 23.749 22.060 92.355 1.00 76.74 C ATOM 1181 O LEU A 688 24.627 22.863 92.693 1.00 77.89 O ATOM 1182 CB LEU A 688 22.842 21.972 94.667 1.00 65.62 C ATOM 1183 CG LEU A 688 21.415 22.355 95.069 1.00 63.13 C ATOM 1184 CD1 LEU A 688 21.420 23.453 96.162 1.00 64.67 C ATOM 1185 CD2 LEU A 688 20.627 22.795 93.911 1.00 58.63 C ATOM 1186 H LEU A 688 24.933 20.124 93.946 1.00 0.00 H ATOM 1187 N ASN A 689 23.339 21.931 91.093 1.00 75.13 N ATOM 1188 CA ASN A 689 23.793 22.847 90.047 1.00 73.99 C ATOM 1189 C ASN A 689 23.309 24.273 90.319 1.00 77.26 C ATOM 1190 O ASN A 689 22.140 24.488 90.650 1.00 79.33 O ATOM 1191 CB ASN A 689 23.293 22.387 88.675 1.00 76.21 C ATOM 1192 CG ASN A 689 23.992 21.121 88.180 1.00 82.85 C ATOM 1193 OD1 ASN A 689 24.862 20.565 88.860 1.00 79.39 O ATOM 1194 ND2 ASN A 689 23.607 20.661 86.984 1.00 87.82 N ATOM 1195 HD22 ASN A 689 22.871 21.162 86.447 1.00 0.00 H ATOM 1196 HD21 ASN A 689 24.044 19.803 86.592 1.00 0.00 H ATOM 1197 H ASN A 689 22.682 21.163 90.847 1.00 0.00 H ATOM 1198 N LEU A 690 24.208 25.243 90.176 1.00 73.40 N ATOM 1199 CA LEU A 690 23.891 26.635 90.462 1.00 73.59 C ATOM 1200 C LEU A 690 24.333 27.552 89.331 1.00 72.22 C ATOM 1201 O LEU A 690 25.373 27.334 88.727 1.00 70.85 O ATOM 1202 CB LEU A 690 24.598 27.068 91.753 1.00 77.64 C ATOM 1203 CG LEU A 690 24.204 26.435 93.092 1.00 77.88 C ATOM 1204 CD1 LEU A 690 25.235 26.757 94.171 1.00 79.07 C ATOM 1205 CD2 LEU A 690 22.825 26.906 93.527 1.00 72.06 C ATOM 1206 H LEU A 690 25.165 25.000 89.850 1.00 0.00 H ATOM 1207 N ALA A 691 23.551 28.587 89.053 1.00 72.29 N ATOM 1208 CA ALA A 691 23.981 29.648 88.137 1.00 72.76 C ATOM 1209 C ALA A 691 23.420 30.978 88.621 1.00 77.35 C ATOM 1210 O ALA A 691 22.222 31.087 88.869 1.00 83.73 O ATOM 1211 CB ALA A 691 23.514 29.367 86.731 1.00 65.27 C ATOM 1212 H ALA A 691 22.611 28.647 89.495 1.00 0.00 H ATOM 1213 N VAL A 692 24.283 31.982 88.768 1.00 71.45 N ATOM 1214 CA VAL A 692 23.853 33.260 89.321 1.00 73.76 C ATOM 1215 C VAL A 692 24.022 34.413 88.361 1.00 78.67 C ATOM 1216 O VAL A 692 25.047 34.543 87.700 1.00 86.45 O ATOM 1217 CB VAL A 692 24.630 33.604 90.590 1.00 72.79 C ATOM 1218 CG1 VAL A 692 24.165 34.926 91.146 1.00 65.56 C ATOM 1219 CG2 VAL A 692 24.425 32.524 91.605 1.00 77.97 C ATOM 1220 H VAL A 692 25.275 31.852 88.485 1.00 0.00 H ATOM 1221 N ASN A 693 23.014 35.267 88.288 1.00 78.55 N ATOM 1222 CA ASN A 693 23.142 36.435 87.456 1.00 87.45 C ATOM 1223 C ASN A 693 22.793 37.726 88.199 1.00 90.71 C ATOM 1224 O ASN A 693 21.820 37.774 88.962 1.00 92.66 O ATOM 1225 CB ASN A 693 22.317 36.262 86.182 1.00 88.29 C ATOM 1226 CG ASN A 693 22.667 37.270 85.129 1.00 86.53 C ATOM 1227 OD1 ASN A 693 23.838 37.618 84.950 1.00 87.00 O ATOM 1228 ND2 ASN A 693 21.648 37.769 84.436 1.00 83.76 N ATOM 1229 HD22 ASN A 693 20.680 37.441 84.626 1.00 0.00 H ATOM 1230 HD21 ASN A 693 21.819 38.487 83.704 1.00 0.00 H ATOM 1231 H ASN A 693 22.140 35.097 88.825 1.00 0.00 H ATOM 1232 N TRP A 694 23.611 38.756 87.971 1.00 88.39 N ATOM 1233 CA TRP A 694 23.450 40.061 88.591 1.00 88.59 C ATOM 1234 C TRP A 694 23.287 41.105 87.515 1.00 88.86 C ATOM 1235 O TRP A 694 24.074 41.157 86.574 1.00 93.66 O ATOM 1236 CB TRP A 694 24.705 40.448 89.381 1.00 92.16 C ATOM 1237 CG TRP A 694 25.063 39.594 90.568 1.00 89.52 C ATOM 1238 CD1 TRP A 694 25.312 38.258 90.573 1.00 91.60 C ATOM 1239 CD2 TRP A 694 25.265 40.044 91.911 1.00 91.58 C ATOM 1240 NE1 TRP A 694 25.637 37.838 91.841 1.00 92.11 N ATOM 1241 CE2 TRP A 694 25.609 38.916 92.683 1.00 89.39 C ATOM 1242 CE3 TRP A 694 25.170 41.288 92.540 1.00 92.10 C ATOM 1243 CZ2 TRP A 694 25.862 38.996 94.043 1.00 79.87 C ATOM 1244 CZ3 TRP A 694 25.420 41.367 93.882 1.00 90.12 C ATOM 1245 CH2 TRP A 694 25.766 40.226 94.624 1.00 87.78 C ATOM 1246 HE1 TRP A 694 25.866 36.861 92.115 1.00 0.00 H ATOM 1247 H TRP A 694 24.406 38.617 87.315 1.00 0.00 H ATOM 1248 N ARG A 695 22.287 41.959 87.672 1.00 91.05 N ATOM 1249 CA ARG A 695 22.162 43.143 86.834 1.00 94.65 C ATOM 1250 C ARG A 695 22.375 44.350 87.727 1.00 96.56 C ATOM 1251 O ARG A 695 21.557 44.636 88.603 1.00 96.20 O ATOM 1252 CB ARG A 695 20.780 43.192 86.184 1.00103.01 C ATOM 1253 CG ARG A 695 20.477 44.471 85.414 1.00111.39 C ATOM 1254 CD ARG A 695 18.999 44.528 85.027 1.00119.93 C ATOM 1255 NE ARG A 695 18.619 45.820 84.455 1.00131.91 N ATOM 1256 CZ ARG A 695 18.005 46.791 85.126 1.00138.02 C ATOM 1257 NH1 ARG A 695 17.690 46.626 86.405 1.00137.64 N ATOM 1258 NH2 ARG A 695 17.700 47.929 84.514 1.00142.35 N ATOM 1259 HE ARG A 695 18.845 45.991 83.454 1.00 0.00 H ATOM 1260 HH12 ARG A 695 17.210 47.388 86.925 1.00 0.00 H ATOM 1261 HH11 ARG A 695 17.923 45.734 86.887 1.00 0.00 H ATOM 1262 HH22 ARG A 695 17.220 48.689 85.038 1.00 0.00 H ATOM 1263 HH21 ARG A 695 17.941 48.061 83.511 1.00 0.00 H ATOM 1264 H ARG A 695 21.576 41.780 88.410 1.00 0.00 H ATOM 1265 N CYS A 696 23.484 45.052 87.522 1.00100.09 N ATOM 1266 CA CYS A 696 23.843 46.159 88.403 1.00 99.96 C ATOM 1267 C CYS A 696 23.617 47.519 87.766 1.00103.84 C ATOM 1268 O CYS A 696 24.445 47.991 86.989 1.00102.44 O ATOM 1269 CB CYS A 696 25.296 46.036 88.860 1.00 96.86 C ATOM 1270 SG CYS A 696 25.614 44.587 89.889 1.00100.93 S ATOM 1271 H CYS A 696 24.105 44.810 86.723 1.00 0.00 H ATOM 1272 N GLU A 697 22.482 48.129 88.106 1.00111.42 N ATOM 1273 CA GLU A 697 22.161 49.504 87.731 1.00118.48 C ATOM 1274 C GLU A 697 22.851 50.464 88.703 1.00116.15 C ATOM 1275 O GLU A 697 23.219 50.063 89.804 1.00106.20 O ATOM 1276 CB GLU A 697 20.645 49.725 87.792 1.00124.03 C ATOM 1277 CG GLU A 697 19.909 49.530 86.481 1.00130.71 C ATOM 1278 CD GLU A 697 18.648 50.384 86.406 1.00144.07 C ATOM 1279 OE1 GLU A 697 18.254 50.939 87.459 1.00147.90 O ATOM 1280 OE2 GLU A 697 18.066 50.513 85.300 1.00146.47 O ATOM 1281 H GLU A 697 21.787 47.598 88.669 1.00 0.00 H ATOM 1282 N PRO A 698 23.021 51.740 88.308 1.00121.31 N ATOM 1283 CA PRO A 698 23.630 52.708 89.231 1.00128.69 C ATOM 1284 C PRO A 698 22.830 52.862 90.524 1.00130.72 C ATOM 1285 O PRO A 698 23.397 53.098 91.591 1.00130.54 O ATOM 1286 CB PRO A 698 23.580 54.022 88.440 1.00133.56 C ATOM 1287 CG PRO A 698 23.513 53.611 87.023 1.00116.76 C ATOM 1288 CD PRO A 698 22.710 52.350 87.004 1.00117.69 C ATOM 1289 N SER A 699 21.515 52.714 90.417 1.00131.17 N ATOM 1290 CA SER A 699 20.621 53.001 91.523 1.00131.34 C ATOM 1291 C SER A 699 19.792 51.787 91.939 1.00128.09 C ATOM 1292 O SER A 699 18.828 51.917 92.695 1.00131.18 O ATOM 1293 CB SER A 699 19.696 54.154 91.136 1.00134.23 C ATOM 1294 OG SER A 699 18.705 54.355 92.121 1.00136.56 O ATOM 1295 HG SER A 699 18.165 53.531 92.217 1.00 0.00 H ATOM 1296 H SER A 699 21.115 52.383 89.516 1.00 0.00 H ATOM 1297 N SER A 700 20.172 50.609 91.456 1.00119.75 N ATOM 1298 CA SER A 700 19.364 49.412 91.673 1.00118.40 C ATOM 1299 C SER A 700 20.180 48.134 91.499 1.00113.82 C ATOM 1300 O SER A 700 21.305 48.168 90.996 1.00117.26 O ATOM 1301 CB SER A 700 18.173 49.407 90.709 1.00126.56 C ATOM 1302 OG SER A 700 17.490 48.164 90.717 1.00127.15 O ATOM 1303 HG SER A 700 16.730 48.202 90.083 1.00 0.00 H ATOM 1304 H SER A 700 21.058 50.538 90.916 1.00 0.00 H ATOM 1305 N THR A 701 19.615 47.005 91.919 1.00106.68 N ATOM 1306 CA THR A 701 20.285 45.714 91.741 1.00103.16 C ATOM 1307 C THR A 701 19.300 44.557 91.569 1.00103.64 C ATOM 1308 O THR A 701 18.375 44.393 92.364 1.00101.84 O ATOM 1309 CB THR A 701 21.263 45.402 92.898 1.00 99.93 C ATOM 1310 OG1 THR A 701 22.386 46.287 92.822 1.00108.54 O ATOM 1311 CG2 THR A 701 21.767 43.974 92.808 1.00 88.75 C ATOM 1312 HG1 THR A 701 23.012 46.088 93.562 1.00 0.00 H ATOM 1313 H THR A 701 18.684 47.039 92.381 1.00 0.00 H ATOM 1314 N ASP A 702 19.494 43.770 90.514 1.00106.68 N ATOM 1315 CA ASP A 702 18.650 42.607 90.265 1.00109.97 C ATOM 1316 C ASP A 702 19.478 41.342 90.480 1.00106.45 C ATOM 1317 O ASP A 702 20.561 41.197 89.906 1.00109.35 O ATOM 1318 CB ASP A 702 18.066 42.638 88.839 1.00120.60 C ATOM 1319 CG ASP A 702 16.982 43.713 88.650 1.00133.23 C ATOM 1320 OD1 ASP A 702 15.789 43.405 88.873 1.00136.81 O ATOM 1321 OD2 ASP A 702 17.316 44.858 88.261 1.00137.40 O ATOM 1322 H ASP A 702 20.265 43.989 89.852 1.00 0.00 H ATOM 1323 N LEU A 703 18.975 40.442 91.324 1.00100.87 N ATOM 1324 CA LEU A 703 19.639 39.165 91.590 1.00 94.16 C ATOM 1325 C LEU A 703 18.773 37.973 91.174 1.00 89.56 C ATOM 1326 O LEU A 703 17.582 37.889 91.539 1.00 88.91 O ATOM 1327 CB LEU A 703 20.018 39.037 93.076 1.00 92.61 C ATOM 1328 CG LEU A 703 20.656 37.713 93.530 1.00 89.89 C ATOM 1329 CD1 LEU A 703 22.043 37.510 92.925 1.00 89.72 C ATOM 1330 CD2 LEU A 703 20.726 37.595 95.042 1.00 91.09 C ATOM 1331 H LEU A 703 18.080 40.654 91.810 1.00 0.00 H ATOM 1332 N ARG A 704 19.385 37.056 90.420 1.00 86.85 N ATOM 1333 CA ARG A 704 18.742 35.806 90.021 1.00 88.57 C ATOM 1334 C ARG A 704 19.622 34.616 90.375 1.00 86.48 C ATOM 1335 O ARG A 704 20.794 34.565 90.026 1.00 84.62 O ATOM 1336 CB ARG A 704 18.423 35.795 88.518 1.00 91.41 C ATOM 1337 CG ARG A 704 18.019 34.416 87.973 1.00 94.12 C ATOM 1338 CD ARG A 704 17.442 34.481 86.555 1.00 98.30 C ATOM 1339 NE ARG A 704 15.978 34.444 86.557 1.00109.17 N ATOM 1340 CZ ARG A 704 15.248 33.361 86.297 1.00110.35 C ATOM 1341 NH1 ARG A 704 15.845 32.217 85.998 1.00110.11 N ATOM 1342 NH2 ARG A 704 13.921 33.423 86.323 1.00110.18 N ATOM 1343 HE ARG A 704 15.473 35.326 86.777 1.00 0.00 H ATOM 1344 HH12 ARG A 704 15.276 31.371 85.795 1.00 0.00 H ATOM 1345 HH11 ARG A 704 16.883 32.165 85.966 1.00 0.00 H ATOM 1346 HH22 ARG A 704 13.357 32.574 86.119 1.00 0.00 H ATOM 1347 HH21 ARG A 704 13.447 34.321 86.547 1.00 0.00 H ATOM 1348 H ARG A 704 20.359 37.239 90.104 1.00 0.00 H ATOM 1349 N ILE A 705 19.042 33.660 91.081 1.00 91.95 N ATOM 1350 CA ILE A 705 19.745 32.443 91.448 1.00 89.58 C ATOM 1351 C ILE A 705 18.986 31.272 90.846 1.00 90.60 C ATOM 1352 O ILE A 705 17.858 30.991 91.233 1.00 94.78 O ATOM 1353 CB ILE A 705 19.827 32.270 92.984 1.00 84.54 C ATOM 1354 CG1 ILE A 705 20.683 33.373 93.614 1.00 87.96 C ATOM 1355 CG2 ILE A 705 20.396 30.910 93.344 1.00 74.51 C ATOM 1356 CD1 ILE A 705 20.844 33.256 95.144 1.00 86.27 C ATOM 1357 H ILE A 705 18.054 33.783 91.382 1.00 0.00 H ATOM 1358 N ASP A 706 19.593 30.598 89.881 1.00 84.55 N ATOM 1359 CA ASP A 706 18.981 29.410 89.317 1.00 80.22 C ATOM 1360 C ASP A 706 19.637 28.172 89.907 1.00 75.89 C ATOM 1361 O ASP A 706 20.858 28.098 90.015 1.00 80.50 O ATOM 1362 CB ASP A 706 19.084 29.416 87.792 1.00 85.60 C ATOM 1363 CG ASP A 706 18.184 30.456 87.156 1.00 94.51 C ATOM 1364 OD1 ASP A 706 17.098 30.701 87.712 1.00101.14 O ATOM 1365 OD2 ASP A 706 18.554 31.033 86.106 1.00 96.27 O ATOM 1366 H ASP A 706 20.515 30.923 89.525 1.00 0.00 H ATOM 1367 N TYR A 707 18.825 27.197 90.293 1.00 67.22 N ATOM 1368 CA TYR A 707 19.365 25.979 90.856 1.00 70.44 C ATOM 1369 C TYR A 707 18.658 24.752 90.304 1.00 79.44 C ATOM 1370 O TYR A 707 17.496 24.822 89.886 1.00 82.15 O ATOM 1371 CB TYR A 707 19.310 26.006 92.399 1.00 72.03 C ATOM 1372 CG TYR A 707 17.926 25.871 92.989 1.00 75.47 C ATOM 1373 CD1 TYR A 707 17.386 24.622 93.253 1.00 78.48 C ATOM 1374 CD2 TYR A 707 17.163 26.989 93.297 1.00 79.48 C ATOM 1375 CE1 TYR A 707 16.126 24.487 93.796 1.00 80.66 C ATOM 1376 CE2 TYR A 707 15.895 26.862 93.835 1.00 81.46 C ATOM 1377 CZ TYR A 707 15.386 25.606 94.081 1.00 84.91 C ATOM 1378 OH TYR A 707 14.130 25.456 94.621 1.00 95.86 O ATOM 1379 HH TYR A 707 13.931 24.492 94.728 1.00 0.00 H ATOM 1380 H TYR A 707 17.796 27.309 90.190 1.00 0.00 H ATOM 1381 N LYS A 708 19.374 23.629 90.323 1.00 84.07 N ATOM 1382 CA LYS A 708 18.851 22.360 89.840 1.00 85.18 C ATOM 1383 C LYS A 708 19.374 21.209 90.691 1.00 80.87 C ATOM 1384 O LYS A 708 20.579 20.995 90.798 1.00 80.42 O ATOM 1385 CB LYS A 708 19.225 22.154 88.372 1.00 88.80 C ATOM 1386 CG LYS A 708 18.862 20.786 87.800 1.00 97.08 C ATOM 1387 CD LYS A 708 18.941 20.798 86.260 1.00100.68 C ATOM 1388 CE LYS A 708 18.654 19.431 85.649 1.00101.47 C ATOM 1389 NZ LYS A 708 19.674 18.438 86.078 1.00101.14 N ATOM 1390 HZ1 LYS A 708 20.615 18.754 85.768 1.00 0.00 H ATOM 1391 HZ2 LYS A 708 19.659 18.353 87.114 1.00 0.00 H ATOM 1392 HZ3 LYS A 708 19.459 17.515 85.650 1.00 0.00 H ATOM 1393 H LYS A 708 20.344 23.660 90.697 1.00 0.00 H ATOM 1394 N TYR A 709 18.453 20.486 91.313 1.00 77.99 N ATOM 1395 CA TYR A 709 18.781 19.239 91.977 1.00 81.30 C ATOM 1396 C TYR A 709 19.190 18.215 90.913 1.00 87.47 C ATOM 1397 O TYR A 709 18.508 18.044 89.893 1.00 87.32 O ATOM 1398 CB TYR A 709 17.575 18.743 92.769 1.00 84.32 C ATOM 1399 CG TYR A 709 17.722 17.350 93.332 1.00 86.64 C ATOM 1400 CD1 TYR A 709 18.346 17.139 94.549 1.00 83.95 C ATOM 1401 CD2 TYR A 709 17.219 16.247 92.651 1.00 87.83 C ATOM 1402 CE1 TYR A 709 18.475 15.869 95.071 1.00 89.72 C ATOM 1403 CE2 TYR A 709 17.342 14.976 93.163 1.00 89.89 C ATOM 1404 CZ TYR A 709 17.970 14.788 94.373 1.00 94.40 C ATOM 1405 OH TYR A 709 18.096 13.514 94.890 1.00 99.76 O ATOM 1406 HH TYR A 709 18.568 13.557 95.759 1.00 0.00 H ATOM 1407 H TYR A 709 17.469 20.822 91.325 1.00 0.00 H ATOM 1408 N ASN A 710 20.311 17.545 91.160 1.00 85.87 N ATOM 1409 CA ASN A 710 20.950 16.697 90.170 1.00 81.33 C ATOM 1410 C ASN A 710 21.173 15.306 90.743 1.00 89.29 C ATOM 1411 O ASN A 710 22.095 15.094 91.523 1.00 93.42 O ATOM 1412 CB ASN A 710 22.277 17.336 89.735 1.00 73.75 C ATOM 1413 CG ASN A 710 23.097 16.442 88.819 1.00 80.51 C ATOM 1414 OD1 ASN A 710 22.587 15.476 88.252 1.00 91.21 O ATOM 1415 ND2 ASN A 710 24.384 16.765 88.669 1.00 72.79 N ATOM 1416 HD22 ASN A 710 24.774 17.590 89.167 1.00 0.00 H ATOM 1417 HD21 ASN A 710 24.996 16.191 88.054 1.00 0.00 H ATOM 1418 H ASN A 710 20.748 17.632 92.100 1.00 0.00 H ATOM 1419 N THR A 711 20.334 14.358 90.338 1.00 94.26 N ATOM 1420 CA THR A 711 20.384 12.996 90.864 1.00 91.39 C ATOM 1421 C THR A 711 21.635 12.246 90.421 1.00 93.96 C ATOM 1422 O THR A 711 22.087 11.322 91.105 1.00101.14 O ATOM 1423 CB THR A 711 19.154 12.185 90.431 1.00 90.94 C ATOM 1424 OG1 THR A 711 19.478 11.410 89.272 1.00 96.25 O ATOM 1425 CG2 THR A 711 17.999 13.116 90.106 1.00 95.58 C ATOM 1426 HG1 THR A 711 19.751 12.015 88.537 1.00 0.00 H ATOM 1427 H THR A 711 19.617 14.594 89.622 1.00 0.00 H ATOM 1428 N ASP A 712 22.190 12.644 89.279 1.00 89.22 N ATOM 1429 CA ASP A 712 23.330 11.946 88.691 1.00 97.79 C ATOM 1430 C ASP A 712 24.598 11.984 89.575 1.00 95.07 C ATOM 1431 O ASP A 712 25.448 11.102 89.488 1.00 97.59 O ATOM 1432 CB ASP A 712 23.612 12.480 87.274 1.00109.53 C ATOM 1433 CG ASP A 712 22.502 12.128 86.269 1.00123.12 C ATOM 1434 OD1 ASP A 712 21.378 11.791 86.703 1.00126.57 O ATOM 1435 OD2 ASP A 712 22.753 12.193 85.041 1.00131.17 O ATOM 1436 H ASP A 712 21.801 13.476 88.791 1.00 0.00 H ATOM 1437 N ALA A 713 24.701 12.990 90.440 1.00 90.52 N ATOM 1438 CA ALA A 713 25.860 13.173 91.326 1.00 85.15 C ATOM 1439 C ALA A 713 25.925 12.188 92.490 1.00 90.23 C ATOM 1440 O ALA A 713 26.955 12.083 93.164 1.00 85.36 O ATOM 1441 CB ALA A 713 25.881 14.597 91.878 1.00 74.22 C ATOM 1442 H ALA A 713 23.924 13.680 90.492 1.00 0.00 H ATOM 1443 N MET A 714 24.826 11.480 92.728 1.00 93.83 N ATOM 1444 CA MET A 714 24.673 10.698 93.949 1.00 92.64 C ATOM 1445 C MET A 714 24.298 9.274 93.625 1.00 88.91 C ATOM 1446 O MET A 714 23.639 9.019 92.609 1.00 93.73 O ATOM 1447 CB MET A 714 23.609 11.335 94.836 1.00 94.81 C ATOM 1448 CG MET A 714 22.750 12.341 94.089 1.00102.74 C ATOM 1449 SD MET A 714 21.744 13.332 95.200 1.00113.35 S ATOM 1450 CE MET A 714 21.276 12.032 96.310 1.00 76.94 C ATOM 1451 H MET A 714 24.057 11.484 92.027 1.00 0.00 H ATOM 1452 N THR A 715 24.725 8.352 94.484 1.00 85.50 N ATOM 1453 CA THR A 715 24.558 6.924 94.226 1.00 96.68 C ATOM 1454 C THR A 715 23.094 6.576 94.011 1.00100.15 C ATOM 1455 O THR A 715 22.724 5.941 93.010 1.00105.67 O ATOM 1456 CB THR A 715 25.116 6.081 95.373 1.00 94.64 C ATOM 1457 OG1 THR A 715 26.455 6.500 95.651 1.00 95.20 O ATOM 1458 CG2 THR A 715 25.117 4.614 95.005 1.00 85.15 C ATOM 1459 HG1 THR A 715 26.454 7.456 95.909 1.00 0.00 H ATOM 1460 H THR A 715 25.190 8.656 95.363 1.00 0.00 H ATOM 1461 N THR A 716 22.271 7.003 94.962 1.00 92.46 N ATOM 1462 CA THR A 716 20.834 6.851 94.857 1.00 96.26 C ATOM 1463 C THR A 716 20.188 8.184 95.207 1.00 95.43 C ATOM 1464 O THR A 716 20.718 8.935 96.021 1.00 90.96 O ATOM 1465 CB THR A 716 20.330 5.749 95.785 1.00101.12 C ATOM 1466 OG1 THR A 716 20.820 5.989 97.107 1.00100.47 O ATOM 1467 CG2 THR A 716 20.821 4.377 95.301 1.00106.22 C ATOM 1468 HG1 THR A 716 20.493 6.868 97.425 1.00 0.00 H ATOM 1469 H THR A 716 22.670 7.460 95.807 1.00 0.00 H ATOM 1470 N ALA A 717 19.054 8.482 94.580 1.00 98.78 N ATOM 1471 CA ALA A 717 18.431 9.800 94.714 1.00 95.38 C ATOM 1472 C ALA A 717 17.840 10.058 96.097 1.00 92.61 C ATOM 1473 O ALA A 717 16.909 9.380 96.527 1.00 95.67 O ATOM 1474 CB ALA A 717 17.368 10.003 93.642 1.00 95.06 C ATOM 1475 H ALA A 717 18.600 7.763 93.981 1.00 0.00 H ATOM 1476 N VAL A 718 18.372 11.065 96.776 1.00 86.17 N ATOM 1477 CA VAL A 718 17.867 11.464 98.085 1.00 92.33 C ATOM 1478 C VAL A 718 17.892 12.994 98.254 1.00 93.70 C ATOM 1479 O VAL A 718 18.524 13.703 97.458 1.00 97.22 O ATOM 1480 CB VAL A 718 18.621 10.745 99.232 1.00 85.85 C ATOM 1481 CG1 VAL A 718 19.951 11.430 99.549 1.00 67.80 C ATOM 1482 CG2 VAL A 718 17.731 10.652 100.466 1.00 95.07 C ATOM 1483 H VAL A 718 19.172 11.585 96.363 1.00 0.00 H ATOM 1484 N ALA A 719 17.199 13.495 99.277 1.00 85.65 N ATOM 1485 CA ALA A 719 16.964 14.929 99.422 1.00 86.45 C ATOM 1486 C ALA A 719 18.174 15.717 99.955 1.00 89.01 C ATOM 1487 O ALA A 719 19.042 15.166 100.635 1.00 90.66 O ATOM 1488 CB ALA A 719 15.749 15.166 100.300 1.00 84.96 C ATOM 1489 H ALA A 719 16.815 12.846 99.993 1.00 0.00 H ATOM 1490 N LEU A 720 18.224 17.009 99.635 1.00 85.60 N ATOM 1491 CA LEU A 720 19.159 17.927 100.286 1.00 79.67 C ATOM 1492 C LEU A 720 18.414 18.675 101.413 1.00 79.53 C ATOM 1493 O LEU A 720 17.348 19.262 101.189 1.00 79.52 O ATOM 1494 CB LEU A 720 19.769 18.900 99.267 1.00 73.43 C ATOM 1495 CG LEU A 720 20.313 18.258 97.982 1.00 76.33 C ATOM 1496 CD1 LEU A 720 20.833 19.280 96.964 1.00 69.29 C ATOM 1497 CD2 LEU A 720 21.391 17.230 98.295 1.00 75.59 C ATOM 1498 H LEU A 720 17.582 17.375 98.903 1.00 0.00 H ATOM 1499 N ASN A 721 18.965 18.638 102.622 1.00 79.83 N ATOM 1500 CA ASN A 721 18.284 19.197 103.797 1.00 85.55 C ATOM 1501 C ASN A 721 18.926 20.478 104.288 1.00 82.17 C ATOM 1502 O ASN A 721 20.140 20.660 104.158 1.00 82.22 O ATOM 1503 CB ASN A 721 18.252 18.190 104.959 1.00 85.17 C ATOM 1504 CG ASN A 721 17.771 16.818 104.531 1.00 90.54 C ATOM 1505 OD1 ASN A 721 18.535 15.848 104.554 1.00 89.87 O ATOM 1506 ND2 ASN A 721 16.501 16.727 104.132 1.00 90.84 N ATOM 1507 HD22 ASN A 721 15.895 17.572 104.130 1.00 0.00 H ATOM 1508 HD21 ASN A 721 16.117 15.811 103.823 1.00 0.00 H ATOM 1509 H ASN A 721 19.902 18.202 102.739 1.00 0.00 H ATOM 1510 N ASN A 722 18.108 21.346 104.876 1.00 83.17 N ATOM 1511 CA ASN A 722 18.590 22.604 105.426 1.00 89.30 C ATOM 1512 C ASN A 722 19.400 23.367 104.378 1.00 89.04 C ATOM 1513 O ASN A 722 20.565 23.701 104.608 1.00 88.16 O ATOM 1514 CB ASN A 722 19.441 22.370 106.687 1.00 95.70 C ATOM 1515 CG ASN A 722 18.782 21.412 107.693 1.00101.81 C ATOM 1516 OD1 ASN A 722 17.552 21.373 107.836 1.00107.46 O ATOM 1517 ND2 ASN A 722 19.613 20.630 108.392 1.00 93.15 N ATOM 1518 HD22 ASN A 722 20.640 20.696 108.240 1.00 0.00 H ATOM 1519 HD21 ASN A 722 19.232 19.957 109.087 1.00 0.00 H ATOM 1520 H ASN A 722 17.095 21.119 104.945 1.00 0.00 H ATOM 1521 N VAL A 723 18.793 23.618 103.219 1.00 84.28 N ATOM 1522 CA VAL A 723 19.501 24.322 102.166 1.00 80.47 C ATOM 1523 C VAL A 723 19.445 25.808 102.416 1.00 76.88 C ATOM 1524 O VAL A 723 18.367 26.383 102.564 1.00 76.87 O ATOM 1525 CB VAL A 723 18.962 24.032 100.754 1.00 81.98 C ATOM 1526 CG1 VAL A 723 19.960 24.517 99.718 1.00 75.64 C ATOM 1527 CG2 VAL A 723 18.697 22.554 100.575 1.00 84.38 C ATOM 1528 H VAL A 723 17.811 23.309 103.069 1.00 0.00 H ATOM 1529 N GLN A 724 20.620 26.423 102.445 1.00 78.03 N ATOM 1530 CA GLN A 724 20.750 27.841 102.718 1.00 79.62 C ATOM 1531 C GLN A 724 21.475 28.530 101.586 1.00 79.45 C ATOM 1532 O GLN A 724 22.539 28.083 101.142 1.00 75.70 O ATOM 1533 CB GLN A 724 21.539 28.062 104.004 1.00 84.44 C ATOM 1534 CG GLN A 724 20.942 27.399 105.217 1.00 94.44 C ATOM 1535 CD GLN A 724 21.501 27.962 106.506 1.00 97.65 C ATOM 1536 OE1 GLN A 724 22.390 28.819 106.488 1.00 96.01 O ATOM 1537 NE2 GLN A 724 20.978 27.493 107.631 1.00 99.53 N ATOM 1538 HE22 GLN A 724 20.230 26.771 107.595 1.00 0.00 H ATOM 1539 HE21 GLN A 724 21.315 27.847 108.549 1.00 0.00 H ATOM 1540 H GLN A 724 21.480 25.867 102.265 1.00 0.00 H ATOM 1541 N PHE A 725 20.893 29.633 101.135 1.00 81.87 N ATOM 1542 CA PHE A 725 21.524 30.483 100.140 1.00 75.80 C ATOM 1543 C PHE A 725 21.809 31.841 100.778 1.00 76.90 C ATOM 1544 O PHE A 725 20.894 32.594 101.111 1.00 76.90 O ATOM 1545 CB PHE A 725 20.604 30.667 98.937 1.00 72.99 C ATOM 1546 CG PHE A 725 20.202 29.386 98.259 1.00 80.07 C ATOM 1547 CD1 PHE A 725 19.188 28.593 98.767 1.00 84.23 C ATOM 1548 CD2 PHE A 725 20.806 29.002 97.076 1.00 87.26 C ATOM 1549 CE1 PHE A 725 18.808 27.428 98.122 1.00 86.87 C ATOM 1550 CE2 PHE A 725 20.420 27.832 96.415 1.00 85.72 C ATOM 1551 CZ PHE A 725 19.422 27.049 96.942 1.00 84.39 C ATOM 1552 H PHE A 725 19.957 29.897 101.504 1.00 0.00 H ATOM 1553 N LEU A 726 23.083 32.148 100.960 1.00 72.40 N ATOM 1554 CA LEU A 726 23.470 33.395 101.596 1.00 74.17 C ATOM 1555 C LEU A 726 24.264 34.257 100.625 1.00 79.09 C ATOM 1556 O LEU A 726 25.274 33.815 100.089 1.00 77.25 O ATOM 1557 CB LEU A 726 24.327 33.104 102.829 1.00 73.70 C ATOM 1558 CG LEU A 726 24.883 34.304 103.587 1.00 72.65 C ATOM 1559 CD1 LEU A 726 23.739 35.088 104.203 1.00 76.17 C ATOM 1560 CD2 LEU A 726 25.878 33.858 104.643 1.00 70.70 C ATOM 1561 H LEU A 726 23.819 31.486 100.642 1.00 0.00 H ATOM 1562 N VAL A 727 23.824 35.491 100.408 1.00 79.21 N ATOM 1563 CA VAL A 727 24.577 36.402 99.547 1.00 76.02 C ATOM 1564 C VAL A 727 24.599 37.869 100.028 1.00 78.25 C ATOM 1565 O VAL A 727 23.545 38.489 100.251 1.00 78.00 O ATOM 1566 CB VAL A 727 24.140 36.286 98.058 1.00 81.25 C ATOM 1567 CG1 VAL A 727 22.652 36.056 97.947 1.00 83.27 C ATOM 1568 CG2 VAL A 727 24.561 37.505 97.275 1.00 80.83 C ATOM 1569 H VAL A 727 22.940 35.811 100.852 1.00 0.00 H ATOM 1570 N PRO A 728 25.816 38.418 100.203 1.00 74.96 N ATOM 1571 CA PRO A 728 26.083 39.818 100.563 1.00 75.36 C ATOM 1572 C PRO A 728 25.684 40.804 99.472 1.00 79.93 C ATOM 1573 O PRO A 728 26.058 40.639 98.306 1.00 86.00 O ATOM 1574 CB PRO A 728 27.610 39.855 100.726 1.00 67.19 C ATOM 1575 CG PRO A 728 27.980 38.491 101.050 1.00 68.53 C ATOM 1576 CD PRO A 728 27.051 37.620 100.225 1.00 71.39 C ATOM 1577 N ILE A 729 24.947 41.838 99.858 1.00 82.06 N ATOM 1578 CA ILE A 729 24.542 42.882 98.926 1.00 86.05 C ATOM 1579 C ILE A 729 25.224 44.211 99.250 1.00 92.70 C ATOM 1580 O ILE A 729 24.893 44.867 100.235 1.00 98.92 O ATOM 1581 CB ILE A 729 23.016 43.058 98.916 1.00 92.75 C ATOM 1582 CG1 ILE A 729 22.324 41.698 98.772 1.00 93.68 C ATOM 1583 CG2 ILE A 729 22.592 44.005 97.797 1.00 97.43 C ATOM 1584 CD1 ILE A 729 22.645 40.973 97.458 1.00 95.27 C ATOM 1585 H ILE A 729 24.651 41.905 100.853 1.00 0.00 H ATOM 1586 N ASP A 730 26.177 44.585 98.401 1.00100.43 N ATOM 1587 CA ASP A 730 26.969 45.809 98.519 1.00108.65 C ATOM 1588 C ASP A 730 26.131 47.017 98.078 1.00111.51 C ATOM 1589 O ASP A 730 25.061 46.843 97.488 1.00112.13 O ATOM 1590 CB ASP A 730 28.181 45.661 97.587 1.00117.07 C ATOM 1591 CG ASP A 730 29.381 46.487 98.020 1.00127.03 C ATOM 1592 OD1 ASP A 730 29.210 47.462 98.790 1.00136.51 O ATOM 1593 OD2 ASP A 730 30.502 46.159 97.565 1.00123.32 O ATOM 1594 H ASP A 730 26.374 43.961 97.593 1.00 0.00 H ATOM 1595 N GLY A 731 26.603 48.233 98.361 1.00112.96 N ATOM 1596 CA GLY A 731 26.044 49.425 97.734 1.00110.89 C ATOM 1597 C GLY A 731 25.194 50.353 98.581 1.00110.70 C ATOM 1598 O GLY A 731 24.925 51.488 98.180 1.00112.52 O ATOM 1599 H GLY A 731 27.384 48.332 99.041 1.00 0.00 H ATOM 1600 N GLY A 732 24.761 49.878 99.744 1.00109.63 N ATOM 1601 CA GLY A 732 23.960 50.701 100.632 1.00114.82 C ATOM 1602 C GLY A 732 22.480 50.424 100.470 1.00110.59 C ATOM 1603 O GLY A 732 21.701 51.305 100.104 1.00110.12 O ATOM 1604 H GLY A 732 24.999 48.904 100.022 1.00 0.00 H ATOM 1605 N VAL A 733 22.097 49.189 100.761 1.00106.72 N ATOM 1606 CA VAL A 733 20.726 48.737 100.574 1.00107.66 C ATOM 1607 C VAL A 733 19.712 49.539 101.376 1.00114.67 C ATOM 1608 O VAL A 733 19.953 49.923 102.530 1.00115.38 O ATOM 1609 CB VAL A 733 20.582 47.270 100.954 1.00106.89 C ATOM 1610 CG1 VAL A 733 19.312 46.704 100.357 1.00104.29 C ATOM 1611 CG2 VAL A 733 21.789 46.493 100.463 1.00109.84 C ATOM 1612 H VAL A 733 22.800 48.520 101.136 1.00 0.00 H ATOM 1613 N THR A 734 18.562 49.767 100.753 1.00117.23 N ATOM 1614 CA THR A 734 17.515 50.588 101.335 1.00121.97 C ATOM 1615 C THR A 734 16.196 49.834 101.406 1.00121.90 C ATOM 1616 O THR A 734 15.563 49.766 102.453 1.00122.63 O ATOM 1617 CB THR A 734 17.323 51.861 100.511 1.00121.23 C ATOM 1618 OG1 THR A 734 18.413 52.755 100.768 1.00122.03 O ATOM 1619 CG2 THR A 734 16.008 52.536 100.857 1.00120.93 C ATOM 1620 HG1 THR A 734 19.264 52.318 100.513 1.00 0.00 H ATOM 1621 H THR A 734 18.406 49.343 99.816 1.00 0.00 H ATOM 1622 N LYS A 735 15.792 49.258 100.283 1.00120.96 N ATOM 1623 CA LYS A 735 14.533 48.537 100.215 1.00118.78 C ATOM 1624 C LYS A 735 14.710 47.262 99.394 1.00116.73 C ATOM 1625 O LYS A 735 15.517 47.215 98.455 1.00111.31 O ATOM 1626 CB LYS A 735 13.454 49.426 99.591 1.00118.79 C ATOM 1627 CG LYS A 735 12.050 48.853 99.641 1.00119.86 C ATOM 1628 CD LYS A 735 11.106 49.577 98.685 1.00126.10 C ATOM 1629 CE LYS A 735 11.043 51.073 98.959 1.00132.89 C ATOM 1630 NZ LYS A 735 12.005 51.848 98.122 1.00133.76 N ATOM 1631 HZ1 LYS A 735 12.974 51.526 98.321 1.00 0.00 H ATOM 1632 HZ2 LYS A 735 11.788 51.697 97.116 1.00 0.00 H ATOM 1633 HZ3 LYS A 735 11.922 52.860 98.347 1.00 0.00 H ATOM 1634 H LYS A 735 16.388 49.324 99.433 1.00 0.00 H ATOM 1635 N LEU A 736 13.961 46.227 99.768 1.00116.50 N ATOM 1636 CA LEU A 736 13.932 44.983 99.015 1.00109.51 C ATOM 1637 C LEU A 736 12.569 44.825 98.351 1.00109.75 C ATOM 1638 O LEU A 736 11.545 44.752 99.028 1.00107.87 O ATOM 1639 CB LEU A 736 14.190 43.774 99.918 1.00104.40 C ATOM 1640 CG LEU A 736 15.270 43.788 101.004 1.00102.20 C ATOM 1641 CD1 LEU A 736 15.677 42.359 101.319 1.00102.33 C ATOM 1642 CD2 LEU A 736 16.478 44.602 100.619 1.00100.04 C ATOM 1643 H LEU A 736 13.378 46.311 100.625 1.00 0.00 H ATOM 1644 N GLN A 737 12.562 44.765 97.024 1.00112.07 N ATOM 1645 CA GLN A 737 11.339 44.543 96.273 1.00112.62 C ATOM 1646 C GLN A 737 11.410 43.224 95.509 1.00110.30 C ATOM 1647 O GLN A 737 12.493 42.645 95.358 1.00105.35 O ATOM 1648 CB GLN A 737 11.111 45.708 95.311 1.00115.14 C ATOM 1649 CG GLN A 737 11.101 47.068 96.001 1.00119.47 C ATOM 1650 CD GLN A 737 11.493 48.205 95.073 1.00121.83 C ATOM 1651 OE1 GLN A 737 12.354 48.043 94.202 1.00120.28 O ATOM 1652 NE2 GLN A 737 10.865 49.365 95.257 1.00122.46 N ATOM 1653 HE22 GLN A 737 10.147 49.455 96.004 1.00 0.00 H ATOM 1654 HE21 GLN A 737 11.093 50.181 94.654 1.00 0.00 H ATOM 1655 H GLN A 737 13.458 44.880 96.508 1.00 0.00 H ATOM 1656 N ALA A 738 10.247 42.760 95.052 1.00113.80 N ATOM 1657 CA ALA A 738 10.129 41.616 94.147 1.00110.68 C ATOM 1658 C ALA A 738 10.903 40.377 94.595 1.00111.74 C ATOM 1659 O ALA A 738 11.711 39.836 93.833 1.00110.27 O ATOM 1660 CB ALA A 738 10.552 42.020 92.742 1.00105.43 C ATOM 1661 H ALA A 738 9.375 43.238 95.356 1.00 0.00 H ATOM 1662 N VAL A 739 10.654 39.928 95.823 1.00113.86 N ATOM 1663 CA VAL A 739 11.347 38.753 96.361 1.00108.97 C ATOM 1664 C VAL A 739 10.481 37.494 96.296 1.00111.15 C ATOM 1665 O VAL A 739 9.341 37.483 96.767 1.00111.23 O ATOM 1666 CB VAL A 739 11.810 38.977 97.810 1.00100.01 C ATOM 1667 CG1 VAL A 739 12.566 37.768 98.310 1.00 99.20 C ATOM 1668 CG2 VAL A 739 12.678 40.211 97.896 1.00 94.33 C ATOM 1669 H VAL A 739 9.954 40.421 96.413 1.00 0.00 H ATOM 1670 N LEU A 740 11.034 36.438 95.706 1.00109.32 N ATOM 1671 CA LEU A 740 10.320 35.177 95.548 1.00107.54 C ATOM 1672 C LEU A 740 11.334 34.051 95.406 1.00102.22 C ATOM 1673 O LEU A 740 12.195 34.105 94.530 1.00106.58 O ATOM 1674 CB LEU A 740 9.439 35.231 94.306 1.00110.34 C ATOM 1675 CG LEU A 740 8.003 34.712 94.401 1.00116.73 C ATOM 1676 CD1 LEU A 740 7.363 34.713 93.020 1.00121.57 C ATOM 1677 CD2 LEU A 740 7.929 33.329 95.014 1.00116.01 C ATOM 1678 H LEU A 740 12.007 36.514 95.346 1.00 0.00 H ATOM 1679 N PRO A 741 11.268 33.040 96.285 1.00 95.56 N ATOM 1680 CA PRO A 741 10.396 32.881 97.454 1.00102.05 C ATOM 1681 C PRO A 741 10.828 33.829 98.584 1.00 98.67 C ATOM 1682 O PRO A 741 11.849 34.506 98.429 1.00 91.84 O ATOM 1683 CB PRO A 741 10.633 31.421 97.847 1.00 99.43 C ATOM 1684 CG PRO A 741 12.033 31.169 97.457 1.00 90.98 C ATOM 1685 CD PRO A 741 12.238 31.938 96.179 1.00 89.32 C ATOM 1686 N PRO A 742 10.052 33.901 99.685 1.00 99.71 N ATOM 1687 CA PRO A 742 10.434 34.797 100.788 1.00 94.83 C ATOM 1688 C PRO A 742 11.828 34.513 101.347 1.00 86.79 C ATOM 1689 O PRO A 742 12.237 33.352 101.504 1.00 85.10 O ATOM 1690 CB PRO A 742 9.371 34.511 101.845 1.00 91.51 C ATOM 1691 CG PRO A 742 8.171 34.130 101.051 1.00 96.55 C ATOM 1692 CD PRO A 742 8.704 33.335 99.888 1.00 99.24 C ATOM 1693 N ALA A 743 12.560 35.587 101.619 1.00 82.30 N ATOM 1694 CA ALA A 743 13.893 35.482 102.197 1.00 81.74 C ATOM 1695 C ALA A 743 13.998 36.315 103.475 1.00 83.79 C ATOM 1696 O ALA A 743 12.994 36.786 104.009 1.00 81.06 O ATOM 1697 CB ALA A 743 14.935 35.915 101.196 1.00 75.25 C ATOM 1698 H ALA A 743 12.171 36.529 101.414 1.00 0.00 H ATOM 1699 N VAL A 744 15.221 36.502 103.953 1.00 85.42 N ATOM 1700 CA VAL A 744 15.446 37.244 105.184 1.00 92.34 C ATOM 1701 C VAL A 744 16.567 38.263 105.022 1.00 95.22 C ATOM 1702 O VAL A 744 17.673 37.929 104.594 1.00101.21 O ATOM 1703 CB VAL A 744 15.760 36.289 106.355 1.00 91.48 C ATOM 1704 CG1 VAL A 744 16.538 36.997 107.460 1.00 89.15 C ATOM 1705 CG2 VAL A 744 14.476 35.690 106.904 1.00 88.42 C ATOM 1706 H VAL A 744 16.035 36.111 103.438 1.00 0.00 H ATOM 1707 N TRP A 745 16.274 39.509 105.369 1.00 94.57 N ATOM 1708 CA TRP A 745 17.265 40.568 105.269 1.00 93.28 C ATOM 1709 C TRP A 745 18.033 40.806 106.572 1.00 96.70 C ATOM 1710 O TRP A 745 17.444 41.170 107.592 1.00 99.30 O ATOM 1711 CB TRP A 745 16.608 41.871 104.817 1.00 93.04 C ATOM 1712 CG TRP A 745 17.593 42.983 104.653 1.00 93.55 C ATOM 1713 CD1 TRP A 745 17.622 44.158 105.342 1.00100.56 C ATOM 1714 CD2 TRP A 745 18.714 43.015 103.755 1.00 87.52 C ATOM 1715 NE1 TRP A 745 18.683 44.927 104.922 1.00101.08 N ATOM 1716 CE2 TRP A 745 19.367 44.247 103.950 1.00 91.53 C ATOM 1717 CE3 TRP A 745 19.223 42.121 102.807 1.00 83.42 C ATOM 1718 CZ2 TRP A 745 20.509 44.608 103.232 1.00 91.54 C ATOM 1719 CZ3 TRP A 745 20.353 42.480 102.092 1.00 83.97 C ATOM 1720 CH2 TRP A 745 20.985 43.712 102.308 1.00 90.35 C ATOM 1721 HE1 TRP A 745 18.926 45.871 105.284 1.00 0.00 H ATOM 1722 H TRP A 745 15.320 39.732 105.718 1.00 0.00 H ATOM 1723 N ASN A 746 19.347 40.596 106.526 1.00 93.41 N ATOM 1724 CA ASN A 746 20.232 40.995 107.616 1.00 90.31 C ATOM 1725 C ASN A 746 20.775 42.391 107.351 1.00 90.89 C ATOM 1726 O ASN A 746 21.667 42.572 106.511 1.00 96.54 O ATOM 1727 CB ASN A 746 21.397 40.013 107.767 1.00 89.63 C ATOM 1728 CG ASN A 746 22.202 40.245 109.042 1.00101.38 C ATOM 1729 OD1 ASN A 746 22.290 41.365 109.551 1.00100.30 O ATOM 1730 ND2 ASN A 746 22.793 39.176 109.564 1.00107.71 N ATOM 1731 HD22 ASN A 746 22.693 38.249 109.103 1.00 0.00 H ATOM 1732 HD21 ASN A 746 23.356 39.266 110.434 1.00 0.00 H ATOM 1733 H ASN A 746 19.755 40.134 105.688 1.00 0.00 H ATOM 1734 N ALA A 747 20.232 43.368 108.071 1.00 92.13 N ATOM 1735 CA ALA A 747 20.623 44.764 107.931 1.00 93.98 C ATOM 1736 C ALA A 747 22.028 45.067 108.465 1.00100.83 C ATOM 1737 O ALA A 747 22.777 45.797 107.825 1.00103.27 O ATOM 1738 CB ALA A 747 19.586 45.673 108.586 1.00 95.96 C ATOM 1739 H ALA A 747 19.496 43.125 108.764 1.00 0.00 H ATOM 1740 N GLU A 748 22.382 44.520 109.629 1.00108.07 N ATOM 1741 CA GLU A 748 23.701 44.769 110.230 1.00113.17 C ATOM 1742 C GLU A 748 24.835 44.215 109.352 1.00113.07 C ATOM 1743 O GLU A 748 25.917 44.803 109.268 1.00120.32 O ATOM 1744 CB GLU A 748 23.798 44.185 111.653 1.00110.55 C ATOM 1745 CG GLU A 748 22.941 44.878 112.707 1.00115.03 C ATOM 1746 CD GLU A 748 23.155 44.315 114.115 1.00126.57 C ATOM 1747 OE1 GLU A 748 23.257 43.078 114.263 1.00124.85 O ATOM 1748 OE2 GLU A 748 23.220 45.115 115.079 1.00138.19 O ATOM 1749 H GLU A 748 21.708 43.902 110.124 1.00 0.00 H ATOM 1750 N GLN A 749 24.581 43.082 108.706 1.00102.52 N ATOM 1751 CA GLN A 749 25.582 42.433 107.864 1.00103.94 C ATOM 1752 C GLN A 749 25.376 42.727 106.381 1.00105.02 C ATOM 1753 O GLN A 749 26.184 42.313 105.552 1.00100.69 O ATOM 1754 CB GLN A 749 25.559 40.916 108.072 1.00100.46 C ATOM 1755 CG GLN A 749 25.796 40.463 109.497 1.00103.86 C ATOM 1756 CD GLN A 749 27.143 40.896 110.017 1.00115.86 C ATOM 1757 OE1 GLN A 749 28.049 41.197 109.240 1.00121.32 O ATOM 1758 NE2 GLN A 749 27.285 40.941 111.339 1.00121.32 N ATOM 1759 HE22 GLN A 749 26.491 40.677 111.957 1.00 0.00 H ATOM 1760 HE21 GLN A 749 28.190 41.240 111.755 1.00 0.00 H ATOM 1761 H GLN A 749 23.642 42.645 108.803 1.00 0.00 H ATOM 1762 N GLN A 750 24.293 43.435 106.064 1.00109.24 N ATOM 1763 CA GLN A 750 23.933 43.787 104.689 1.00103.00 C ATOM 1764 C GLN A 750 23.980 42.574 103.768 1.00 93.76 C ATOM 1765 O GLN A 750 24.791 42.511 102.841 1.00 86.57 O ATOM 1766 CB GLN A 750 24.819 44.922 104.168 1.00106.35 C ATOM 1767 CG GLN A 750 24.602 46.244 104.900 1.00110.67 C ATOM 1768 CD GLN A 750 23.244 46.849 104.605 1.00114.61 C ATOM 1769 OE1 GLN A 750 22.927 47.158 103.456 1.00115.66 O ATOM 1770 NE2 GLN A 750 22.433 47.019 105.642 1.00117.47 N ATOM 1771 HE22 GLN A 750 22.743 46.743 106.596 1.00 0.00 H ATOM 1772 HE21 GLN A 750 21.487 47.428 105.501 1.00 0.00 H ATOM 1773 H GLN A 750 23.671 43.754 106.833 1.00 0.00 H ATOM 1774 N ARG A 751 23.112 41.604 104.040 1.00 91.10 N ATOM 1775 CA ARG A 751 23.118 40.378 103.251 1.00 86.95 C ATOM 1776 C ARG A 751 21.786 39.622 103.330 1.00 91.88 C ATOM 1777 O ARG A 751 21.054 39.721 104.322 1.00 94.90 O ATOM 1778 CB ARG A 751 24.285 39.481 103.671 1.00 84.54 C ATOM 1779 CG ARG A 751 24.049 38.787 104.974 1.00 94.40 C ATOM 1780 CD ARG A 751 25.309 38.179 105.541 1.00 98.89 C ATOM 1781 NE ARG A 751 25.019 37.439 106.766 1.00101.01 N ATOM 1782 CZ ARG A 751 25.940 36.816 107.490 1.00109.35 C ATOM 1783 NH1 ARG A 751 27.212 36.852 107.117 1.00112.17 N ATOM 1784 NH2 ARG A 751 25.590 36.163 108.589 1.00115.47 N ATOM 1785 HE ARG A 751 24.032 37.398 107.090 1.00 0.00 H ATOM 1786 HH12 ARG A 751 27.934 36.364 107.684 1.00 0.00 H ATOM 1787 HH11 ARG A 751 27.487 37.368 106.257 1.00 0.00 H ATOM 1788 HH22 ARG A 751 26.312 35.675 109.156 1.00 0.00 H ATOM 1789 HH21 ARG A 751 24.593 36.139 108.884 1.00 0.00 H ATOM 1790 H ARG A 751 22.429 41.720 104.816 1.00 0.00 H ATOM 1791 N ILE A 752 21.474 38.879 102.269 1.00 91.52 N ATOM 1792 CA ILE A 752 20.187 38.196 102.160 1.00 93.70 C ATOM 1793 C ILE A 752 20.324 36.681 102.219 1.00 91.46 C ATOM 1794 O ILE A 752 21.259 36.094 101.651 1.00 88.28 O ATOM 1795 CB ILE A 752 19.443 38.574 100.857 1.00 96.74 C ATOM 1796 CG1 ILE A 752 18.011 38.030 100.883 1.00 97.02 C ATOM 1797 CG2 ILE A 752 20.206 38.081 99.616 1.00 87.25 C ATOM 1798 CD1 ILE A 752 17.219 38.348 99.645 1.00 95.09 C ATOM 1799 H ILE A 752 22.165 38.783 101.498 1.00 0.00 H ATOM 1800 N LEU A 753 19.376 36.054 102.904 1.00 86.87 N ATOM 1801 CA LEU A 753 19.418 34.620 103.116 1.00 84.04 C ATOM 1802 C LEU A 753 18.082 33.961 102.792 1.00 83.78 C ATOM 1803 O LEU A 753 17.030 34.401 103.253 1.00 89.47 O ATOM 1804 CB LEU A 753 19.841 34.324 104.555 1.00 85.39 C ATOM 1805 CG LEU A 753 19.754 32.884 105.072 1.00 86.28 C ATOM 1806 CD1 LEU A 753 20.700 31.952 104.324 1.00 83.40 C ATOM 1807 CD2 LEU A 753 20.027 32.838 106.572 1.00 81.00 C ATOM 1808 H LEU A 753 18.585 36.603 103.298 1.00 0.00 H ATOM 1809 N TRP A 754 18.138 32.913 101.979 1.00 82.11 N ATOM 1810 CA TRP A 754 16.974 32.091 101.685 1.00 83.91 C ATOM 1811 C TRP A 754 17.182 30.741 102.343 1.00 81.32 C ATOM 1812 O TRP A 754 18.292 30.198 102.346 1.00 76.39 O ATOM 1813 CB TRP A 754 16.835 31.832 100.181 1.00 83.14 C ATOM 1814 CG TRP A 754 16.261 32.930 99.341 1.00 86.68 C ATOM 1815 CD1 TRP A 754 14.936 33.196 99.122 1.00 89.78 C ATOM 1816 CD2 TRP A 754 16.995 33.871 98.550 1.00 85.27 C ATOM 1817 NE1 TRP A 754 14.802 34.262 98.263 1.00 85.89 N ATOM 1818 CE2 TRP A 754 16.049 34.695 97.896 1.00 85.30 C ATOM 1819 CE3 TRP A 754 18.360 34.104 98.337 1.00 82.10 C ATOM 1820 CZ2 TRP A 754 16.425 35.736 97.044 1.00 84.41 C ATOM 1821 CZ3 TRP A 754 18.733 35.138 97.487 1.00 83.37 C ATOM 1822 CH2 TRP A 754 17.766 35.943 96.851 1.00 83.29 C ATOM 1823 HE1 TRP A 754 13.901 34.672 97.944 1.00 0.00 H ATOM 1824 H TRP A 754 19.047 32.671 101.536 1.00 0.00 H ATOM 1825 N LYS A 755 16.108 30.177 102.872 1.00 83.31 N ATOM 1826 CA LYS A 755 16.177 28.817 103.366 1.00 87.43 C ATOM 1827 C LYS A 755 15.103 27.954 102.719 1.00 89.23 C ATOM 1828 O LYS A 755 13.920 28.298 102.735 1.00 88.94 O ATOM 1829 CB LYS A 755 16.097 28.780 104.904 1.00 90.24 C ATOM 1830 CG LYS A 755 17.291 29.455 105.574 1.00 91.32 C ATOM 1831 CD LYS A 755 17.091 29.665 107.061 1.00102.44 C ATOM 1832 CE LYS A 755 17.674 28.520 107.879 1.00107.04 C ATOM 1833 NZ LYS A 755 17.451 28.725 109.342 1.00108.78 N ATOM 1834 HZ1 LYS A 755 17.908 29.610 109.640 1.00 0.00 H ATOM 1835 HZ2 LYS A 755 16.430 28.780 109.531 1.00 0.00 H ATOM 1836 HZ3 LYS A 755 17.860 27.927 109.869 1.00 0.00 H ATOM 1837 H LYS A 755 15.216 30.709 102.933 1.00 0.00 H ATOM 1838 N ILE A 756 15.541 26.852 102.113 1.00 93.44 N ATOM 1839 CA ILE A 756 14.637 25.804 101.639 1.00103.67 C ATOM 1840 C ILE A 756 14.921 24.548 102.453 1.00108.25 C ATOM 1841 O ILE A 756 16.042 24.032 102.431 1.00106.15 O ATOM 1842 CB ILE A 756 14.812 25.471 100.130 1.00 99.20 C ATOM 1843 CG1 ILE A 756 14.442 26.659 99.241 1.00 92.93 C ATOM 1844 CG2 ILE A 756 13.950 24.268 99.747 1.00102.84 C ATOM 1845 CD1 ILE A 756 15.562 27.617 98.987 1.00 86.57 C ATOM 1846 H ILE A 756 16.564 26.732 101.971 1.00 0.00 H ATOM 1847 N PRO A 757 13.908 24.055 103.180 1.00114.64 N ATOM 1848 CA PRO A 757 14.090 22.906 104.073 1.00118.28 C ATOM 1849 C PRO A 757 14.377 21.598 103.328 1.00121.70 C ATOM 1850 O PRO A 757 15.239 20.840 103.774 1.00122.64 O ATOM 1851 CB PRO A 757 12.752 22.824 104.817 1.00118.73 C ATOM 1852 CG PRO A 757 11.774 23.463 103.898 1.00121.34 C ATOM 1853 CD PRO A 757 12.529 24.567 103.212 1.00118.28 C ATOM 1854 N ASP A 758 13.680 21.340 102.222 1.00122.02 N ATOM 1855 CA ASP A 758 13.850 20.082 101.493 1.00119.41 C ATOM 1856 C ASP A 758 13.914 20.292 99.975 1.00108.74 C ATOM 1857 O ASP A 758 12.990 20.860 99.388 1.00109.77 O ATOM 1858 CB ASP A 758 12.725 19.090 101.853 1.00131.23 C ATOM 1859 CG ASP A 758 12.869 18.507 103.268 1.00140.74 C ATOM 1860 OD1 ASP A 758 14.015 18.257 103.697 1.00138.92 O ATOM 1861 OD2 ASP A 758 11.838 18.291 103.951 1.00148.61 O ATOM 1862 H ASP A 758 13.002 22.046 101.870 1.00 0.00 H ATOM 1863 N ILE A 759 15.011 19.849 99.352 1.00 97.57 N ATOM 1864 CA ILE A 759 15.124 19.825 97.889 1.00 88.73 C ATOM 1865 C ILE A 759 15.369 18.409 97.372 1.00 89.93 C ATOM 1866 O ILE A 759 16.400 17.799 97.667 1.00 90.75 O ATOM 1867 CB ILE A 759 16.261 20.725 97.350 1.00 81.74 C ATOM 1868 CG1 ILE A 759 16.050 22.182 97.739 1.00 79.08 C ATOM 1869 CG2 ILE A 759 16.327 20.648 95.835 1.00 85.32 C ATOM 1870 CD1 ILE A 759 17.049 23.134 97.111 1.00 74.03 C ATOM 1871 H ILE A 759 15.811 19.510 99.923 1.00 0.00 H ATOM 1872 N SER A 760 14.423 17.892 96.594 1.00 91.79 N ATOM 1873 CA SER A 760 14.554 16.560 96.007 1.00 98.75 C ATOM 1874 C SER A 760 13.641 16.416 94.796 1.00105.13 C ATOM 1875 O SER A 760 12.976 17.371 94.390 1.00104.43 O ATOM 1876 CB SER A 760 14.224 15.472 97.035 1.00102.30 C ATOM 1877 OG SER A 760 12.858 15.514 97.428 1.00106.54 O ATOM 1878 HG SER A 760 12.684 14.799 98.090 1.00 0.00 H ATOM 1879 H SER A 760 13.567 18.450 96.398 1.00 0.00 H ATOM 1880 N GLN A 761 13.606 15.219 94.224 1.00109.67 N ATOM 1881 CA GLN A 761 12.709 14.945 93.112 1.00116.24 C ATOM 1882 C GLN A 761 11.245 15.064 93.528 1.00120.35 C ATOM 1883 O GLN A 761 10.381 15.313 92.691 1.00126.37 O ATOM 1884 CB GLN A 761 12.984 13.561 92.534 1.00123.23 C ATOM 1885 CG GLN A 761 14.372 13.413 91.951 1.00124.32 C ATOM 1886 CD GLN A 761 14.681 11.986 91.568 1.00132.30 C ATOM 1887 OE1 GLN A 761 15.199 11.722 90.487 1.00136.74 O ATOM 1888 NE2 GLN A 761 14.360 11.053 92.456 1.00135.30 N ATOM 1889 HE22 GLN A 761 13.922 11.324 93.360 1.00 0.00 H ATOM 1890 HE21 GLN A 761 14.546 10.051 92.248 1.00 0.00 H ATOM 1891 H GLN A 761 14.230 14.465 94.576 1.00 0.00 H ATOM 1892 N LYS A 762 10.967 14.893 94.818 1.00119.71 N ATOM 1893 CA LYS A 762 9.599 15.006 95.322 1.00125.12 C ATOM 1894 C LYS A 762 9.216 16.458 95.612 1.00123.57 C ATOM 1895 O LYS A 762 8.123 16.728 96.106 1.00125.73 O ATOM 1896 CB LYS A 762 9.386 14.143 96.573 1.00127.78 C ATOM 1897 CG LYS A 762 9.643 12.656 96.369 1.00134.11 C ATOM 1898 CD LYS A 762 8.883 12.107 95.164 1.00143.30 C ATOM 1899 CE LYS A 762 7.386 11.993 95.422 1.00151.72 C ATOM 1900 NZ LYS A 762 7.050 10.887 96.363 1.00156.55 N ATOM 1901 HZ1 LYS A 762 7.376 9.983 95.965 1.00 0.00 H ATOM 1902 HZ2 LYS A 762 7.520 11.055 97.275 1.00 0.00 H ATOM 1903 HZ3 LYS A 762 6.020 10.854 96.503 1.00 0.00 H ATOM 1904 H LYS A 762 11.738 14.675 95.481 1.00 0.00 H ATOM 1905 N SER A 763 10.120 17.385 95.304 1.00121.11 N ATOM 1906 CA SER A 763 9.855 18.809 95.492 1.00122.15 C ATOM 1907 C SER A 763 9.209 19.384 94.242 1.00129.27 C ATOM 1908 O SER A 763 9.118 18.707 93.221 1.00132.45 O ATOM 1909 CB SER A 763 11.147 19.571 95.801 1.00116.47 C ATOM 1910 OG SER A 763 11.784 19.065 96.958 1.00114.74 O ATOM 1911 HG SER A 763 12.613 19.579 97.128 1.00 0.00 H ATOM 1912 H SER A 763 11.039 17.088 94.919 1.00 0.00 H ATOM 1913 N GLU A 764 8.771 20.636 94.329 1.00134.25 N ATOM 1914 CA GLU A 764 8.159 21.333 93.198 1.00139.94 C ATOM 1915 C GLU A 764 9.157 21.495 92.049 1.00138.89 C ATOM 1916 O GLU A 764 10.289 21.940 92.252 1.00135.96 O ATOM 1917 CB GLU A 764 7.621 22.705 93.640 1.00145.08 C ATOM 1918 CG GLU A 764 6.675 23.387 92.637 1.00154.12 C ATOM 1919 CD GLU A 764 6.048 24.687 93.167 1.00156.75 C ATOM 1920 OE1 GLU A 764 5.064 25.168 92.560 1.00159.22 O ATOM 1921 OE2 GLU A 764 6.537 25.231 94.182 1.00154.62 O ATOM 1922 H GLU A 764 8.867 21.138 95.235 1.00 0.00 H ATOM 1923 N ASN A 765 8.720 21.121 90.850 1.00145.96 N ATOM 1924 CA ASN A 765 9.524 21.180 89.621 1.00150.31 C ATOM 1925 C ASN A 765 10.709 20.210 89.589 1.00145.77 C ATOM 1926 O ASN A 765 11.591 20.322 88.733 1.00146.71 O ATOM 1927 CB ASN A 765 9.970 22.616 89.290 1.00149.71 C ATOM 1928 CG ASN A 765 9.841 22.946 87.798 1.00151.96 C ATOM 1929 OD1 ASN A 765 9.918 22.061 86.940 1.00153.54 O ATOM 1930 ND2 ASN A 765 9.645 24.227 87.491 1.00148.76 N ATOM 1931 HD22 ASN A 765 9.587 24.940 88.246 1.00 0.00 H ATOM 1932 HD21 ASN A 765 9.550 24.515 86.496 1.00 0.00 H ATOM 1933 H ASN A 765 7.746 20.764 90.777 1.00 0.00 H ATOM 1934 N GLY A 766 10.710 19.249 90.509 1.00138.49 N ATOM 1935 CA GLY A 766 11.736 18.223 90.542 1.00128.48 C ATOM 1936 C GLY A 766 13.091 18.777 90.929 1.00113.69 C ATOM 1937 O GLY A 766 14.118 18.375 90.379 1.00108.70 O ATOM 1938 H GLY A 766 9.955 19.233 91.224 1.00 0.00 H ATOM 1939 N GLY A 767 13.087 19.713 91.874 1.00104.61 N ATOM 1940 CA GLY A 767 14.314 20.282 92.391 1.00 97.17 C ATOM 1941 C GLY A 767 14.911 21.348 91.494 1.00 95.15 C ATOM 1942 O GLY A 767 16.081 21.704 91.625 1.00 98.50 O ATOM 1943 H GLY A 767 12.177 20.046 92.252 1.00 0.00 H ATOM 1944 N VAL A 768 14.105 21.867 90.583 1.00 92.77 N ATOM 1945 CA VAL A 768 14.552 22.918 89.683 1.00 93.69 C ATOM 1946 C VAL A 768 13.852 24.217 90.052 1.00 92.92 C ATOM 1947 O VAL A 768 12.626 24.287 90.004 1.00101.22 O ATOM 1948 CB VAL A 768 14.204 22.574 88.219 1.00 95.39 C ATOM 1949 CG1 VAL A 768 14.567 23.727 87.307 1.00 90.56 C ATOM 1950 CG2 VAL A 768 14.898 21.292 87.785 1.00 95.94 C ATOM 1951 H VAL A 768 13.129 21.515 90.509 1.00 0.00 H ATOM 1952 N GLY A 769 14.604 25.255 90.402 1.00 84.96 N ATOM 1953 CA GLY A 769 13.942 26.490 90.795 1.00 84.21 C ATOM 1954 C GLY A 769 14.757 27.768 90.765 1.00 82.24 C ATOM 1955 O GLY A 769 15.966 27.735 90.547 1.00 75.75 O ATOM 1956 H GLY A 769 15.642 25.186 90.395 1.00 0.00 H ATOM 1957 N SER A 770 14.094 28.901 90.996 1.00 87.57 N ATOM 1958 CA SER A 770 14.783 30.190 91.001 1.00 89.24 C ATOM 1959 C SER A 770 14.500 31.056 92.231 1.00 93.59 C ATOM 1960 O SER A 770 13.351 31.225 92.641 1.00 99.70 O ATOM 1961 CB SER A 770 14.441 30.977 89.740 1.00 89.58 C ATOM 1962 OG SER A 770 14.704 30.206 88.581 1.00 95.98 O ATOM 1963 HG SER A 770 15.664 29.965 88.557 1.00 0.00 H ATOM 1964 H SER A 770 13.070 28.867 91.176 1.00 0.00 H ATOM 1965 N LEU A 771 15.562 31.602 92.813 1.00 89.90 N ATOM 1966 CA LEU A 771 15.442 32.626 93.837 1.00 88.08 C ATOM 1967 C LEU A 771 15.590 33.991 93.150 1.00 92.38 C ATOM 1968 O LEU A 771 16.467 34.170 92.296 1.00 90.60 O ATOM 1969 CB LEU A 771 16.525 32.437 94.898 1.00 79.25 C ATOM 1970 CG LEU A 771 16.760 31.001 95.382 1.00 75.25 C ATOM 1971 CD1 LEU A 771 17.939 30.936 96.342 1.00 73.42 C ATOM 1972 CD2 LEU A 771 15.522 30.424 96.042 1.00 72.82 C ATOM 1973 H LEU A 771 16.511 31.286 92.526 1.00 0.00 H ATOM 1974 N LEU A 772 14.730 34.946 93.506 1.00 90.17 N ATOM 1975 CA LEU A 772 14.759 36.267 92.880 1.00 87.43 C ATOM 1976 C LEU A 772 14.723 37.404 93.897 1.00 89.62 C ATOM 1977 O LEU A 772 13.957 37.351 94.862 1.00 96.58 O ATOM 1978 CB LEU A 772 13.574 36.430 91.931 1.00 86.78 C ATOM 1979 CG LEU A 772 13.465 35.470 90.751 1.00 91.06 C ATOM 1980 CD1 LEU A 772 12.268 35.849 89.902 1.00 91.49 C ATOM 1981 CD2 LEU A 772 14.740 35.463 89.917 1.00 94.58 C ATOM 1982 H LEU A 772 14.024 34.747 94.244 1.00 0.00 H ATOM 1983 N ALA A 773 15.524 38.443 93.670 1.00 90.69 N ATOM 1984 CA ALA A 773 15.435 39.628 94.527 1.00102.03 C ATOM 1985 C ALA A 773 15.764 40.938 93.807 1.00107.16 C ATOM 1986 O ALA A 773 16.565 40.950 92.873 1.00110.50 O ATOM 1987 CB ALA A 773 16.322 39.463 95.766 1.00104.89 C ATOM 1988 H ALA A 773 16.209 38.414 92.888 1.00 0.00 H ATOM 1989 N ARG A 774 15.148 42.038 94.244 1.00109.15 N ATOM 1990 CA ARG A 774 15.513 43.369 93.746 1.00114.39 C ATOM 1991 C ARG A 774 15.851 44.316 94.909 1.00115.74 C ATOM 1992 O ARG A 774 15.185 44.304 95.946 1.00113.52 O ATOM 1993 CB ARG A 774 14.405 43.956 92.857 1.00120.98 C ATOM 1994 CG ARG A 774 14.867 45.096 91.942 1.00125.57 C ATOM 1995 CD ARG A 774 13.835 45.419 90.860 1.00131.84 C ATOM 1996 NE ARG A 774 14.432 46.137 89.733 1.00138.81 N ATOM 1997 CZ ARG A 774 13.838 46.321 88.557 1.00143.81 C ATOM 1998 NH1 ARG A 774 12.620 45.842 88.344 1.00145.47 N ATOM 1999 NH2 ARG A 774 14.463 46.983 87.590 1.00145.58 N ATOM 2000 HE ARG A 774 15.386 46.530 89.860 1.00 0.00 H ATOM 2001 HH12 ARG A 774 12.158 45.987 87.424 1.00 0.00 H ATOM 2002 HH11 ARG A 774 12.127 45.321 89.097 1.00 0.00 H ATOM 2003 HH22 ARG A 774 13.996 47.125 86.672 1.00 0.00 H ATOM 2004 HH21 ARG A 774 15.419 47.359 87.751 1.00 0.00 H ATOM 2005 H ARG A 774 14.392 41.950 94.953 1.00 0.00 H ATOM 2006 N PHE A 775 16.895 45.125 94.737 1.00115.50 N ATOM 2007 CA PHE A 775 17.368 46.005 95.805 1.00113.08 C ATOM 2008 C PHE A 775 17.462 47.453 95.349 1.00114.68 C ATOM 2009 O PHE A 775 17.957 47.734 94.251 1.00117.43 O ATOM 2010 CB PHE A 775 18.749 45.567 96.299 1.00111.67 C ATOM 2011 CG PHE A 775 18.817 44.132 96.723 1.00110.95 C ATOM 2012 CD1 PHE A 775 18.459 43.761 98.006 1.00112.01 C ATOM 2013 CD2 PHE A 775 19.247 43.149 95.839 1.00107.55 C ATOM 2014 CE1 PHE A 775 18.520 42.434 98.402 1.00110.37 C ATOM 2015 CE2 PHE A 775 19.310 41.821 96.225 1.00101.84 C ATOM 2016 CZ PHE A 775 18.949 41.462 97.506 1.00105.65 C ATOM 2017 H PHE A 775 17.386 45.131 93.820 1.00 0.00 H ATOM 2018 N GLN A 776 16.999 48.366 96.203 1.00113.41 N ATOM 2019 CA GLN A 776 17.203 49.793 95.981 1.00115.71 C ATOM 2020 C GLN A 776 18.479 50.286 96.679 1.00117.64 C ATOM 2021 O GLN A 776 18.717 49.968 97.846 1.00119.72 O ATOM 2022 CB GLN A 776 15.976 50.588 96.429 1.00118.55 C ATOM 2023 CG GLN A 776 14.782 50.436 95.497 1.00122.89 C ATOM 2024 CD GLN A 776 15.060 50.950 94.091 1.00128.43 C ATOM 2025 OE1 GLN A 776 15.809 51.910 93.904 1.00134.02 O ATOM 2026 NE2 GLN A 776 14.461 50.306 93.096 1.00126.71 N ATOM 2027 HE22 GLN A 776 13.836 49.500 93.300 1.00 0.00 H ATOM 2028 HE21 GLN A 776 14.617 50.608 92.113 1.00 0.00 H ATOM 2029 H GLN A 776 16.480 48.053 97.048 1.00 0.00 H ATOM 2030 N LEU A 777 19.294 51.058 95.960 1.00119.27 N ATOM 2031 CA LEU A 777 20.626 51.437 96.439 1.00122.86 C ATOM 2032 C LEU A 777 20.754 52.918 96.789 1.00136.01 C ATOM 2033 O LEU A 777 20.437 53.787 95.976 1.00143.22 O ATOM 2034 CB LEU A 777 21.690 51.065 95.404 1.00120.38 C ATOM 2035 CG LEU A 777 21.659 49.630 94.873 1.00113.07 C ATOM 2036 CD1 LEU A 777 22.823 49.376 93.923 1.00113.65 C ATOM 2037 CD2 LEU A 777 21.657 48.630 96.021 1.00104.97 C ATOM 2038 H LEU A 777 18.975 51.401 95.032 1.00 0.00 H ATOM 2039 N SER A 778 21.239 53.189 98.000 1.00140.18 N ATOM 2040 CA SER A 778 21.447 54.549 98.493 1.00143.05 C ATOM 2041 C SER A 778 22.672 55.178 97.840 1.00143.97 C ATOM 2042 O SER A 778 22.678 56.363 97.505 1.00145.93 O ATOM 2043 CB SER A 778 21.627 54.533 100.008 1.00143.59 C ATOM 2044 OG SER A 778 20.728 53.617 100.610 1.00140.68 O ATOM 2045 HG SER A 778 20.899 52.708 100.257 1.00 0.00 H ATOM 2046 H SER A 778 21.481 52.394 98.625 1.00 0.00 H ATOM 2047 N GLU A 779 23.720 54.380 97.677 1.00142.26 N ATOM 2048 CA GLU A 779 24.870 54.808 96.903 1.00147.74 C ATOM 2049 C GLU A 779 24.883 54.108 95.557 1.00148.15 C ATOM 2050 O GLU A 779 24.526 54.700 94.532 1.00154.75 O ATOM 2051 CB GLU A 779 26.168 54.532 97.651 1.00147.81 C ATOM 2052 CG GLU A 779 26.499 55.588 98.665 1.00153.77 C ATOM 2053 CD GLU A 779 26.630 55.010 100.045 1.00155.01 C ATOM 2054 OE1 GLU A 779 25.607 54.926 100.758 1.00153.52 O ATOM 2055 OE2 GLU A 779 27.760 54.628 100.410 1.00157.55 O ATOM 2056 H GLU A 779 23.717 53.435 98.110 1.00 0.00 H ATOM 2057 N GLY A 780 25.300 52.846 95.560 1.00137.73 N ATOM 2058 CA GLY A 780 25.369 52.082 94.332 1.00132.55 C ATOM 2059 C GLY A 780 26.476 52.564 93.413 1.00135.81 C ATOM 2060 O GLY A 780 27.016 53.657 93.601 1.00142.03 O ATOM 2061 H GLY A 780 25.581 52.401 96.457 1.00 0.00 H ATOM 2062 N PRO A 781 26.827 51.746 92.409 1.00132.44 N ATOM 2063 CA PRO A 781 26.213 50.441 92.143 1.00127.81 C ATOM 2064 C PRO A 781 26.876 49.352 92.985 1.00126.15 C ATOM 2065 O PRO A 781 27.944 49.602 93.544 1.00130.84 O ATOM 2066 CB PRO A 781 26.545 50.218 90.670 1.00124.80 C ATOM 2067 CG PRO A 781 27.895 50.848 90.522 1.00125.76 C ATOM 2068 CD PRO A 781 27.897 52.053 91.441 1.00132.37 C ATOM 2069 N SER A 782 26.265 48.172 93.075 1.00118.71 N ATOM 2070 CA SER A 782 26.848 47.072 93.851 1.00115.57 C ATOM 2071 C SER A 782 27.886 46.258 93.069 1.00114.71 C ATOM 2072 O SER A 782 27.775 46.110 91.853 1.00114.61 O ATOM 2073 CB SER A 782 25.757 46.140 94.397 1.00109.80 C ATOM 2074 OG SER A 782 24.497 46.425 93.823 1.00112.72 O ATOM 2075 HG SER A 782 23.819 45.808 94.196 1.00 0.00 H ATOM 2076 H SER A 782 25.358 48.028 92.586 1.00 0.00 H ATOM 2077 N LYS A 783 28.897 45.743 93.771 1.00112.00 N ATOM 2078 CA LYS A 783 29.828 44.794 93.176 1.00111.14 C ATOM 2079 C LYS A 783 29.405 43.398 93.596 1.00106.87 C ATOM 2080 O LYS A 783 29.288 43.122 94.790 1.00108.18 O ATOM 2081 CB LYS A 783 31.281 45.052 93.609 1.00118.96 C ATOM 2082 CG LYS A 783 32.323 44.329 92.721 1.00126.55 C ATOM 2083 CD LYS A 783 33.710 44.182 93.374 1.00131.59 C ATOM 2084 CE LYS A 783 33.853 42.852 94.128 1.00128.20 C ATOM 2085 NZ LYS A 783 35.228 42.609 94.663 1.00128.26 N ATOM 2086 HZ1 LYS A 783 35.907 42.594 93.876 1.00 0.00 H ATOM 2087 HZ2 LYS A 783 35.480 43.370 95.326 1.00 0.00 H ATOM 2088 HZ3 LYS A 783 35.249 41.695 95.159 1.00 0.00 H ATOM 2089 H LYS A 783 29.023 46.025 94.764 1.00 0.00 H ATOM 2090 N PRO A 784 29.177 42.514 92.610 1.00103.16 N ATOM 2091 CA PRO A 784 28.764 41.135 92.869 1.00 95.66 C ATOM 2092 C PRO A 784 29.687 40.450 93.864 1.00 89.30 C ATOM 2093 O PRO A 784 30.911 40.499 93.748 1.00 86.58 O ATOM 2094 CB PRO A 784 28.889 40.468 91.494 1.00 94.76 C ATOM 2095 CG PRO A 784 28.712 41.573 90.535 1.00 97.35 C ATOM 2096 CD PRO A 784 29.369 42.764 91.171 1.00102.15 C ATOM 2097 N SER A 785 29.080 39.822 94.857 1.00 85.01 N ATOM 2098 CA SER A 785 29.821 39.034 95.814 1.00 84.65 C ATOM 2099 C SER A 785 29.418 37.572 95.637 1.00 77.12 C ATOM 2100 O SER A 785 28.352 37.282 95.096 1.00 81.43 O ATOM 2101 CB SER A 785 29.497 39.521 97.223 1.00 91.99 C ATOM 2102 OG SER A 785 28.096 39.607 97.400 1.00 97.02 O ATOM 2103 HG SER A 785 27.899 39.924 98.317 1.00 0.00 H ATOM 2104 H SER A 785 28.047 39.897 94.951 1.00 0.00 H ATOM 2105 N PRO A 786 30.278 36.644 96.074 1.00 71.55 N ATOM 2106 CA PRO A 786 30.005 35.201 95.995 1.00 71.74 C ATOM 2107 C PRO A 786 28.748 34.746 96.748 1.00 77.57 C ATOM 2108 O PRO A 786 28.565 35.111 97.903 1.00 84.82 O ATOM 2109 CB PRO A 786 31.230 34.586 96.677 1.00 68.51 C ATOM 2110 CG PRO A 786 32.314 35.594 96.508 1.00 66.94 C ATOM 2111 CD PRO A 786 31.649 36.932 96.540 1.00 70.48 C ATOM 2112 N LEU A 787 27.917 33.929 96.112 1.00 77.56 N ATOM 2113 CA LEU A 787 26.823 33.250 96.800 1.00 77.12 C ATOM 2114 C LEU A 787 27.353 32.030 97.554 1.00 81.44 C ATOM 2115 O LEU A 787 27.988 31.161 96.963 1.00 85.02 O ATOM 2116 CB LEU A 787 25.787 32.794 95.775 1.00 75.50 C ATOM 2117 CG LEU A 787 24.887 31.589 96.063 1.00 74.83 C ATOM 2118 CD1 LEU A 787 23.953 31.831 97.263 1.00 72.58 C ATOM 2119 CD2 LEU A 787 24.100 31.198 94.781 1.00 57.14 C ATOM 2120 H LEU A 787 28.049 33.768 95.093 1.00 0.00 H ATOM 2121 N VAL A 788 27.103 31.964 98.857 1.00 74.87 N ATOM 2122 CA VAL A 788 27.493 30.797 99.644 1.00 72.02 C ATOM 2123 C VAL A 788 26.295 29.894 99.911 1.00 74.10 C ATOM 2124 O VAL A 788 25.223 30.373 100.281 1.00 79.70 O ATOM 2125 CB VAL A 788 28.117 31.180 101.000 1.00 67.04 C ATOM 2126 CG1 VAL A 788 28.868 29.984 101.586 1.00 54.58 C ATOM 2127 CG2 VAL A 788 29.062 32.343 100.832 1.00 58.77 C ATOM 2128 H VAL A 788 26.621 32.758 99.325 1.00 0.00 H ATOM 2129 N VAL A 789 26.495 28.588 99.758 1.00 70.46 N ATOM 2130 CA VAL A 789 25.410 27.621 99.911 1.00 73.75 C ATOM 2131 C VAL A 789 25.664 26.583 101.029 1.00 75.90 C ATOM 2132 O VAL A 789 26.813 26.222 101.347 1.00 72.35 O ATOM 2133 CB VAL A 789 25.102 26.965 98.549 1.00 72.99 C ATOM 2134 CG1 VAL A 789 24.110 25.804 98.683 1.00 75.72 C ATOM 2135 CG2 VAL A 789 24.559 28.016 97.602 1.00 70.24 C ATOM 2136 H VAL A 789 27.449 28.246 99.523 1.00 0.00 H ATOM 2137 N GLN A 790 24.592 26.108 101.645 1.00 71.15 N ATOM 2138 CA GLN A 790 24.766 25.078 102.646 1.00 71.39 C ATOM 2139 C GLN A 790 23.715 24.016 102.461 1.00 71.73 C ATOM 2140 O GLN A 790 22.578 24.311 102.095 1.00 77.92 O ATOM 2141 CB GLN A 790 24.685 25.665 104.052 1.00 70.07 C ATOM 2142 CG GLN A 790 25.934 25.427 104.867 1.00 85.03 C ATOM 2143 CD GLN A 790 27.039 26.431 104.588 1.00 91.64 C ATOM 2144 OE1 GLN A 790 26.803 27.644 104.573 1.00 96.45 O ATOM 2145 NE2 GLN A 790 28.264 25.927 104.376 1.00 87.83 N ATOM 2146 HE22 GLN A 790 28.414 24.898 104.398 1.00 0.00 H ATOM 2147 HE21 GLN A 790 29.064 26.565 104.189 1.00 0.00 H ATOM 2148 H GLN A 790 23.644 26.468 101.414 1.00 0.00 H ATOM 2149 N PHE A 791 24.110 22.774 102.684 1.00 65.29 N ATOM 2150 CA PHE A 791 23.167 21.672 102.701 1.00 65.54 C ATOM 2151 C PHE A 791 23.840 20.439 103.267 1.00 68.27 C ATOM 2152 O PHE A 791 25.065 20.280 103.174 1.00 71.59 O ATOM 2153 CB PHE A 791 22.541 21.389 101.313 1.00 71.78 C ATOM 2154 CG PHE A 791 23.541 21.055 100.221 1.00 72.43 C ATOM 2155 CD1 PHE A 791 24.134 19.803 100.158 1.00 70.46 C ATOM 2156 CD2 PHE A 791 23.841 21.981 99.230 1.00 73.44 C ATOM 2157 CE1 PHE A 791 25.046 19.483 99.146 1.00 73.68 C ATOM 2158 CE2 PHE A 791 24.747 21.671 98.207 1.00 76.98 C ATOM 2159 CZ PHE A 791 25.356 20.418 98.169 1.00 73.10 C ATOM 2160 H PHE A 791 25.119 22.583 102.851 1.00 0.00 H ATOM 2161 N THR A 792 23.019 19.590 103.876 1.00 68.55 N ATOM 2162 CA THR A 792 23.425 18.258 104.300 1.00 71.75 C ATOM 2163 C THR A 792 22.468 17.267 103.655 1.00 71.76 C ATOM 2164 O THR A 792 21.423 17.662 103.121 1.00 69.79 O ATOM 2165 CB THR A 792 23.382 18.086 105.841 1.00 77.14 C ATOM 2166 OG1 THR A 792 22.020 18.121 106.312 1.00 75.06 O ATOM 2167 CG2 THR A 792 24.227 19.168 106.522 1.00 72.52 C ATOM 2168 HG1 THR A 792 22.009 18.010 107.296 1.00 0.00 H ATOM 2169 H THR A 792 22.040 19.891 104.058 1.00 0.00 H ATOM 2170 N SER A 793 22.816 15.986 103.733 1.00 66.42 N ATOM 2171 CA SER A 793 22.069 14.937 103.061 1.00 73.46 C ATOM 2172 C SER A 793 22.409 13.624 103.729 1.00 77.24 C ATOM 2173 O SER A 793 23.574 13.338 103.967 1.00 83.33 O ATOM 2174 CB SER A 793 22.483 14.886 101.584 1.00 78.62 C ATOM 2175 OG SER A 793 21.911 13.786 100.902 1.00 83.30 O ATOM 2176 HG SER A 793 20.924 13.852 100.942 1.00 0.00 H ATOM 2177 H SER A 793 23.652 15.726 104.295 1.00 0.00 H ATOM 2178 N GLU A 794 21.404 12.815 104.025 1.00 82.41 N ATOM 2179 CA GLU A 794 21.647 11.514 104.641 1.00 93.85 C ATOM 2180 C GLU A 794 21.131 10.412 103.709 1.00 96.17 C ATOM 2181 O GLU A 794 20.138 10.610 102.993 1.00 98.59 O ATOM 2182 CB GLU A 794 20.966 11.417 106.023 1.00107.69 C ATOM 2183 CG GLU A 794 21.291 12.553 107.012 1.00120.52 C ATOM 2184 CD GLU A 794 20.541 12.435 108.358 1.00138.98 C ATOM 2185 OE1 GLU A 794 20.122 13.485 108.899 1.00143.87 O ATOM 2186 OE2 GLU A 794 20.378 11.305 108.881 1.00145.68 O ATOM 2187 H GLU A 794 20.429 13.110 103.816 1.00 0.00 H ATOM 2188 N GLY A 795 21.803 9.262 103.706 1.00 72.68 N ATOM 2189 CA GLY A 795 21.310 8.109 102.971 1.00 75.55 C ATOM 2190 C GLY A 795 22.108 7.665 101.753 1.00 84.39 C ATOM 2191 O GLY A 795 21.898 6.558 101.250 1.00 89.25 O ATOM 2192 H GLY A 795 22.694 9.188 104.238 1.00 0.00 H ATOM 2193 N SER A 796 23.013 8.515 101.269 1.00 82.91 N ATOM 2194 CA SER A 796 23.782 8.201 100.068 1.00 82.76 C ATOM 2195 C SER A 796 25.161 8.844 100.130 1.00 82.67 C ATOM 2196 O SER A 796 25.344 9.883 100.767 1.00 84.81 O ATOM 2197 CB SER A 796 23.042 8.681 98.808 1.00 84.22 C ATOM 2198 OG SER A 796 23.659 8.188 97.630 1.00 85.02 O ATOM 2199 HG SER A 796 24.594 8.510 97.589 1.00 0.00 H ATOM 2200 H SER A 796 23.175 9.420 101.756 1.00 0.00 H ATOM 2201 N THR A 797 26.130 8.207 99.485 1.00 81.98 N ATOM 2202 CA THR A 797 27.441 8.806 99.268 1.00 77.81 C ATOM 2203 C THR A 797 27.448 9.441 97.875 1.00 81.41 C ATOM 2204 O THR A 797 26.532 9.226 97.069 1.00 74.10 O ATOM 2205 CB THR A 797 28.567 7.755 99.317 1.00 72.90 C ATOM 2206 OG1 THR A 797 28.330 6.755 98.305 1.00 78.66 O ATOM 2207 CG2 THR A 797 28.623 7.092 100.664 1.00 70.66 C ATOM 2208 HG1 THR A 797 29.053 6.079 98.335 1.00 0.00 H ATOM 2209 H THR A 797 25.948 7.249 99.123 1.00 0.00 H ATOM 2210 N LEU A 798 28.495 10.210 97.594 1.00 79.63 N ATOM 2211 CA LEU A 798 28.714 10.731 96.261 1.00 72.74 C ATOM 2212 C LEU A 798 29.566 9.729 95.479 1.00 77.21 C ATOM 2213 O LEU A 798 29.473 9.636 94.257 1.00 82.22 O ATOM 2214 CB LEU A 798 29.380 12.108 96.343 1.00 64.20 C ATOM 2215 CG LEU A 798 28.482 13.141 97.037 1.00 65.74 C ATOM 2216 CD1 LEU A 798 29.134 14.513 97.241 1.00 71.61 C ATOM 2217 CD2 LEU A 798 27.186 13.274 96.283 1.00 64.06 C ATOM 2218 H LEU A 798 29.172 10.443 98.348 1.00 0.00 H ATOM 2219 N SER A 799 30.369 8.957 96.204 1.00 77.49 N ATOM 2220 CA SER A 799 31.330 8.042 95.600 1.00 79.75 C ATOM 2221 C SER A 799 30.729 6.731 95.105 1.00 83.94 C ATOM 2222 O SER A 799 31.167 6.187 94.093 1.00 89.00 O ATOM 2223 CB SER A 799 32.445 7.728 96.594 1.00 76.65 C ATOM 2224 OG SER A 799 31.924 7.033 97.708 1.00 78.29 O ATOM 2225 HG SER A 799 31.240 7.592 98.154 1.00 0.00 H ATOM 2226 H SER A 799 30.310 9.008 97.241 1.00 0.00 H ATOM 2227 N GLY A 800 29.741 6.211 95.820 1.00 83.51 N ATOM 2228 CA GLY A 800 29.236 4.885 95.516 1.00 85.30 C ATOM 2229 C GLY A 800 29.967 3.780 96.271 1.00 84.84 C ATOM 2230 O GLY A 800 29.719 2.599 96.033 1.00 87.45 O ATOM 2231 H GLY A 800 29.326 6.756 96.602 1.00 0.00 H ATOM 2232 N CYS A 801 30.871 4.161 97.173 1.00 79.93 N ATOM 2233 CA CYS A 801 31.548 3.204 98.063 1.00 86.28 C ATOM 2234 C CYS A 801 30.609 2.574 99.097 1.00 89.83 C ATOM 2235 O CYS A 801 29.781 3.264 99.695 1.00 92.38 O ATOM 2236 CB CYS A 801 32.700 3.887 98.820 1.00 83.56 C ATOM 2237 SG CYS A 801 34.102 4.370 97.779 1.00117.70 S ATOM 2238 H CYS A 801 31.107 5.171 97.251 1.00 0.00 H ATOM 2239 N ASP A 802 30.741 1.269 99.314 1.00 88.48 N ATOM 2240 CA ASP A 802 30.109 0.641 100.465 1.00 91.24 C ATOM 2241 C ASP A 802 31.185 -0.093 101.264 1.00 84.66 C ATOM 2242 O ASP A 802 32.375 0.003 100.957 1.00 80.63 O ATOM 2243 CB ASP A 802 28.971 -0.296 100.045 1.00 99.84 C ATOM 2244 CG ASP A 802 27.831 -0.336 101.067 1.00113.16 C ATOM 2245 OD1 ASP A 802 28.077 -0.018 102.253 1.00114.81 O ATOM 2246 OD2 ASP A 802 26.691 -0.694 100.689 1.00122.00 O ATOM 2247 H ASP A 802 31.301 0.691 98.655 1.00 0.00 H ATOM 2248 N ILE A 803 30.775 -0.812 102.296 1.00 80.20 N ATOM 2249 CA ILE A 803 31.731 -1.581 103.074 1.00 78.72 C ATOM 2250 C ILE A 803 31.169 -2.963 103.394 1.00 84.53 C ATOM 2251 O ILE A 803 29.954 -3.160 103.463 1.00 87.43 O ATOM 2252 CB ILE A 803 32.158 -0.840 104.354 1.00 74.54 C ATOM 2253 CG1 ILE A 803 33.385 -1.514 104.974 1.00 78.70 C ATOM 2254 CG2 ILE A 803 30.999 -0.744 105.332 1.00 72.09 C ATOM 2255 CD1 ILE A 803 33.843 -0.913 106.284 1.00 58.76 C ATOM 2256 H ILE A 803 29.767 -0.827 102.551 1.00 0.00 H ATOM 2257 N GLU A 804 32.061 -3.929 103.545 1.00 84.41 N ATOM 2258 CA GLU A 804 31.644 -5.294 103.781 1.00 84.88 C ATOM 2259 C GLU A 804 32.584 -5.904 104.799 1.00 89.02 C ATOM 2260 O GLU A 804 33.776 -5.624 104.791 1.00 84.06 O ATOM 2261 CB GLU A 804 31.696 -6.102 102.487 1.00 84.82 C ATOM 2262 CG GLU A 804 30.634 -5.743 101.467 1.00 94.07 C ATOM 2263 CD GLU A 804 30.540 -6.777 100.350 1.00101.93 C ATOM 2264 OE1 GLU A 804 31.510 -7.557 100.178 1.00 98.68 O ATOM 2265 OE2 GLU A 804 29.497 -6.819 99.657 1.00109.91 O ATOM 2266 H GLU A 804 33.075 -3.704 103.493 1.00 0.00 H ATOM 2267 N LEU A 805 32.053 -6.735 105.684 1.00 90.81 N ATOM 2268 CA LEU A 805 32.915 -7.459 106.599 1.00 90.79 C ATOM 2269 C LEU A 805 33.432 -8.719 105.936 1.00 95.44 C ATOM 2270 O LEU A 805 32.718 -9.379 105.177 1.00 95.52 O ATOM 2271 CB LEU A 805 32.183 -7.806 107.891 1.00 92.86 C ATOM 2272 CG LEU A 805 32.226 -6.675 108.909 1.00 86.01 C ATOM 2273 CD1 LEU A 805 31.293 -6.970 110.058 1.00 83.76 C ATOM 2274 CD2 LEU A 805 33.664 -6.449 109.389 1.00 77.38 C ATOM 2275 H LEU A 805 31.022 -6.868 105.722 1.00 0.00 H ATOM 2276 N VAL A 806 34.686 -9.038 106.218 1.00 94.99 N ATOM 2277 CA VAL A 806 35.299 -10.257 105.721 1.00 97.68 C ATOM 2278 C VAL A 806 35.756 -11.098 106.908 1.00 99.47 C ATOM 2279 O VAL A 806 36.494 -10.622 107.774 1.00103.86 O ATOM 2280 CB VAL A 806 36.487 -9.935 104.794 1.00 91.60 C ATOM 2281 CG1 VAL A 806 37.165 -11.200 104.347 1.00 78.97 C ATOM 2282 CG2 VAL A 806 36.021 -9.128 103.598 1.00 86.03 C ATOM 2283 H VAL A 806 35.248 -8.397 106.813 1.00 0.00 H ATOM 2284 N GLY A 807 35.303 -12.341 106.966 1.00 99.96 N ATOM 2285 CA GLY A 807 35.680 -13.213 108.065 1.00103.44 C ATOM 2286 C GLY A 807 34.747 -13.096 109.255 1.00103.08 C ATOM 2287 O GLY A 807 34.056 -12.089 109.429 1.00101.97 O ATOM 2288 H GLY A 807 34.672 -12.696 106.219 1.00 0.00 H ATOM 2289 N ALA A 808 34.739 -14.125 110.093 1.00105.39 N ATOM 2290 CA ALA A 808 33.777 -14.201 111.186 1.00107.15 C ATOM 2291 C ALA A 808 34.151 -13.327 112.387 1.00110.15 C ATOM 2292 O ALA A 808 35.248 -12.758 112.453 1.00108.10 O ATOM 2293 CB ALA A 808 33.582 -15.644 111.612 1.00104.11 C ATOM 2294 H ALA A 808 35.431 -14.891 109.968 1.00 0.00 H ATOM 2295 N GLY A 809 33.218 -13.213 113.328 1.00112.19 N ATOM 2296 CA GLY A 809 33.478 -12.524 114.574 1.00109.83 C ATOM 2297 C GLY A 809 32.787 -11.185 114.690 1.00105.80 C ATOM 2298 O GLY A 809 32.582 -10.679 115.797 1.00104.50 O ATOM 2299 H GLY A 809 32.279 -13.629 113.165 1.00 0.00 H ATOM 2300 N TYR A 810 32.427 -10.603 113.551 1.00100.76 N ATOM 2301 CA TYR A 810 31.900 -9.248 113.567 1.00 94.10 C ATOM 2302 C TYR A 810 30.665 -9.076 112.710 1.00 95.65 C ATOM 2303 O TYR A 810 30.517 -9.715 111.665 1.00 95.34 O ATOM 2304 CB TYR A 810 32.974 -8.256 113.147 1.00 85.60 C ATOM 2305 CG TYR A 810 34.226 -8.331 113.984 1.00 87.99 C ATOM 2306 CD1 TYR A 810 35.208 -9.269 113.707 1.00 93.80 C ATOM 2307 CD2 TYR A 810 34.430 -7.465 115.049 1.00 84.86 C ATOM 2308 CE1 TYR A 810 36.356 -9.348 114.462 1.00 94.03 C ATOM 2309 CE2 TYR A 810 35.584 -7.530 115.810 1.00 83.24 C ATOM 2310 CZ TYR A 810 36.548 -8.478 115.513 1.00 89.02 C ATOM 2311 OH TYR A 810 37.712 -8.566 116.253 1.00 86.90 O ATOM 2312 HH TYR A 810 38.275 -9.297 115.895 1.00 0.00 H ATOM 2313 H TYR A 810 32.522 -11.115 112.651 1.00 0.00 H ATOM 2314 N ARG A 811 29.782 -8.198 113.167 1.00 96.23 N ATOM 2315 CA ARG A 811 28.541 -7.930 112.462 1.00104.91 C ATOM 2316 C ARG A 811 28.342 -6.425 112.360 1.00104.72 C ATOM 2317 O ARG A 811 28.631 -5.702 113.307 1.00103.79 O ATOM 2318 CB ARG A 811 27.365 -8.569 113.202 1.00116.74 C ATOM 2319 CG ARG A 811 26.001 -8.100 112.723 1.00128.72 C ATOM 2320 CD ARG A 811 24.882 -8.746 113.517 1.00144.88 C ATOM 2321 NE ARG A 811 24.929 -8.420 114.942 1.00150.81 N ATOM 2322 CZ ARG A 811 24.311 -7.377 115.490 1.00152.23 C ATOM 2323 NH1 ARG A 811 23.606 -6.546 114.730 1.00151.70 N ATOM 2324 NH2 ARG A 811 24.401 -7.164 116.798 1.00150.22 N ATOM 2325 HE ARG A 811 25.480 -9.043 115.566 1.00 0.00 H ATOM 2326 HH12 ARG A 811 23.123 -5.731 115.160 1.00 0.00 H ATOM 2327 HH11 ARG A 811 23.537 -6.710 113.705 1.00 0.00 H ATOM 2328 HH22 ARG A 811 23.918 -6.349 117.227 1.00 0.00 H ATOM 2329 HH21 ARG A 811 24.954 -7.812 117.394 1.00 0.00 H ATOM 2330 H ARG A 811 29.983 -7.689 114.051 1.00 0.00 H ATOM 2331 N PHE A 812 27.869 -5.949 111.210 1.00101.59 N ATOM 2332 CA PHE A 812 27.538 -4.535 111.066 1.00 93.82 C ATOM 2333 C PHE A 812 26.128 -4.298 111.577 1.00 95.37 C ATOM 2334 O PHE A 812 25.198 -4.985 111.166 1.00104.74 O ATOM 2335 CB PHE A 812 27.658 -4.076 109.605 1.00 88.86 C ATOM 2336 CG PHE A 812 29.041 -3.606 109.228 1.00 80.56 C ATOM 2337 CD1 PHE A 812 29.739 -2.733 110.052 1.00 74.52 C ATOM 2338 CD2 PHE A 812 29.652 -4.052 108.059 1.00 76.87 C ATOM 2339 CE1 PHE A 812 31.035 -2.289 109.705 1.00 69.86 C ATOM 2340 CE2 PHE A 812 30.935 -3.630 107.716 1.00 74.81 C ATOM 2341 CZ PHE A 812 31.630 -2.746 108.543 1.00 69.02 C ATOM 2342 H PHE A 812 27.734 -6.593 110.404 1.00 0.00 H ATOM 2343 N SER A 813 25.968 -3.336 112.479 1.00 91.38 N ATOM 2344 CA SER A 813 24.647 -3.020 113.009 1.00101.00 C ATOM 2345 C SER A 813 24.048 -1.843 112.246 1.00102.62 C ATOM 2346 O SER A 813 22.826 -1.657 112.210 1.00109.07 O ATOM 2347 CB SER A 813 24.722 -2.726 114.509 1.00104.24 C ATOM 2348 OG SER A 813 25.796 -1.850 114.798 1.00103.50 O ATOM 2349 HG SER A 813 26.647 -2.267 114.512 1.00 0.00 H ATOM 2350 H SER A 813 26.796 -2.801 112.811 1.00 0.00 H ATOM 2351 N LEU A 814 24.921 -1.065 111.620 1.00 94.67 N ATOM 2352 CA LEU A 814 24.497 0.101 110.872 1.00 95.28 C ATOM 2353 C LEU A 814 25.642 0.611 110.017 1.00 96.08 C ATOM 2354 O LEU A 814 26.746 0.793 110.516 1.00 97.71 O ATOM 2355 CB LEU A 814 24.087 1.212 111.832 1.00 90.03 C ATOM 2356 CG LEU A 814 23.380 2.355 111.114 1.00 83.87 C ATOM 2357 CD1 LEU A 814 21.912 2.004 110.959 1.00 84.62 C ATOM 2358 CD2 LEU A 814 23.571 3.689 111.829 1.00 77.11 C ATOM 2359 H LEU A 814 25.934 -1.297 111.667 1.00 0.00 H ATOM 2360 N ILE A 815 25.385 0.848 108.735 1.00 93.18 N ATOM 2361 CA ILE A 815 26.344 1.559 107.900 1.00 86.09 C ATOM 2362 C ILE A 815 25.731 2.896 107.536 1.00 81.13 C ATOM 2363 O ILE A 815 24.805 2.949 106.732 1.00 84.08 O ATOM 2364 CB ILE A 815 26.639 0.802 106.600 1.00 86.15 C ATOM 2365 CG1 ILE A 815 27.193 -0.591 106.898 1.00 86.42 C ATOM 2366 CG2 ILE A 815 27.606 1.587 105.732 1.00 83.42 C ATOM 2367 CD1 ILE A 815 27.497 -1.393 105.645 1.00 84.71 C ATOM 2368 H ILE A 815 24.488 0.522 108.322 1.00 0.00 H ATOM 2369 N LYS A 816 26.222 3.982 108.120 1.00 75.60 N ATOM 2370 CA LYS A 816 25.632 5.274 107.793 1.00 80.14 C ATOM 2371 C LYS A 816 26.380 5.976 106.661 1.00 86.29 C ATOM 2372 O LYS A 816 27.593 6.152 106.725 1.00 90.53 O ATOM 2373 CB LYS A 816 25.521 6.177 109.020 1.00 79.94 C ATOM 2374 CG LYS A 816 24.406 7.207 108.896 1.00 90.05 C ATOM 2375 CD LYS A 816 23.856 7.604 110.257 1.00105.18 C ATOM 2376 CE LYS A 816 22.432 8.155 110.153 1.00116.95 C ATOM 2377 NZ LYS A 816 21.935 8.667 111.470 1.00123.14 N ATOM 2378 HZ1 LYS A 816 21.936 7.893 112.164 1.00 0.00 H ATOM 2379 HZ2 LYS A 816 22.558 9.431 111.801 1.00 0.00 H ATOM 2380 HZ3 LYS A 816 20.968 9.031 111.356 1.00 0.00 H ATOM 2381 H LYS A 816 27.010 3.913 108.796 1.00 0.00 H ATOM 2382 N LYS A 817 25.646 6.346 105.614 1.00 88.12 N ATOM 2383 CA LYS A 817 26.189 7.117 104.491 1.00 81.40 C ATOM 2384 C LYS A 817 25.562 8.518 104.494 1.00 78.49 C ATOM 2385 O LYS A 817 24.344 8.650 104.624 1.00 76.18 O ATOM 2386 CB LYS A 817 25.870 6.419 103.162 1.00 76.46 C ATOM 2387 CG LYS A 817 26.385 4.977 103.025 1.00 76.90 C ATOM 2388 CD LYS A 817 25.574 4.199 101.975 1.00 75.75 C ATOM 2389 CE LYS A 817 26.210 2.850 101.643 1.00 72.22 C ATOM 2390 NZ LYS A 817 25.192 1.875 101.178 1.00 75.59 N ATOM 2391 HZ1 LYS A 817 24.483 1.733 101.926 1.00 0.00 H ATOM 2392 HZ2 LYS A 817 24.727 2.242 100.323 1.00 0.00 H ATOM 2393 HZ3 LYS A 817 25.655 0.969 100.961 1.00 0.00 H ATOM 2394 H LYS A 817 24.642 6.076 105.591 1.00 0.00 H ATOM 2395 N ARG A 818 26.383 9.560 104.363 1.00 74.66 N ATOM 2396 CA ARG A 818 25.864 10.929 104.247 1.00 73.81 C ATOM 2397 C ARG A 818 26.839 11.886 103.548 1.00 73.92 C ATOM 2398 O ARG A 818 28.026 11.594 103.416 1.00 73.14 O ATOM 2399 CB ARG A 818 25.425 11.490 105.607 1.00 73.31 C ATOM 2400 CG ARG A 818 26.483 11.443 106.676 1.00 79.94 C ATOM 2401 CD ARG A 818 26.036 12.184 107.945 1.00 86.75 C ATOM 2402 NE ARG A 818 24.853 11.594 108.574 1.00 94.96 N ATOM 2403 CZ ARG A 818 24.495 11.804 109.839 1.00 98.88 C ATOM 2404 NH1 ARG A 818 25.235 12.584 110.616 1.00101.88 N ATOM 2405 NH2 ARG A 818 23.406 11.226 110.331 1.00 99.18 N ATOM 2406 HE ARG A 818 24.254 10.971 107.996 1.00 0.00 H ATOM 2407 HH12 ARG A 818 24.956 12.749 111.604 1.00 0.00 H ATOM 2408 HH11 ARG A 818 26.094 13.031 110.237 1.00 0.00 H ATOM 2409 HH22 ARG A 818 23.130 11.393 111.320 1.00 0.00 H ATOM 2410 HH21 ARG A 818 22.829 10.606 109.728 1.00 0.00 H ATOM 2411 H ARG A 818 27.410 9.401 104.343 1.00 0.00 H ATOM 2412 N PHE A 819 26.327 13.016 103.066 1.00 74.30 N ATOM 2413 CA PHE A 819 27.200 14.036 102.489 1.00 68.56 C ATOM 2414 C PHE A 819 26.754 15.463 102.792 1.00 71.33 C ATOM 2415 O PHE A 819 25.653 15.684 103.309 1.00 73.07 O ATOM 2416 CB PHE A 819 27.444 13.811 100.992 1.00 74.03 C ATOM 2417 CG PHE A 819 26.253 14.084 100.095 1.00 79.85 C ATOM 2418 CD1 PHE A 819 25.887 15.383 99.761 1.00 80.05 C ATOM 2419 CD2 PHE A 819 25.559 13.031 99.511 1.00 81.02 C ATOM 2420 CE1 PHE A 819 24.822 15.624 98.908 1.00 81.57 C ATOM 2421 CE2 PHE A 819 24.487 13.266 98.647 1.00 76.44 C ATOM 2422 CZ PHE A 819 24.122 14.560 98.347 1.00 76.94 C ATOM 2423 H PHE A 819 25.300 13.174 103.100 1.00 0.00 H ATOM 2424 N ALA A 820 27.616 16.429 102.491 1.00 64.21 N ATOM 2425 CA ALA A 820 27.327 17.809 102.838 1.00 65.98 C ATOM 2426 C ALA A 820 28.160 18.753 102.011 1.00 73.39 C ATOM 2427 O ALA A 820 29.283 18.416 101.622 1.00 76.08 O ATOM 2428 CB ALA A 820 27.578 18.045 104.320 1.00 60.51 C ATOM 2429 H ALA A 820 28.504 16.195 102.003 1.00 0.00 H ATOM 2430 N ALA A 821 27.610 19.932 101.740 1.00 71.12 N ATOM 2431 CA ALA A 821 28.406 20.983 101.137 1.00 63.99 C ATOM 2432 C ALA A 821 29.480 21.430 102.137 1.00 70.19 C ATOM 2433 O ALA A 821 29.257 21.459 103.361 1.00 70.03 O ATOM 2434 CB ALA A 821 27.534 22.139 100.735 1.00 57.96 C ATOM 2435 H ALA A 821 26.608 20.101 101.961 1.00 0.00 H ATOM 2436 N GLY A 822 30.654 21.748 101.601 1.00 70.05 N ATOM 2437 CA GLY A 822 31.717 22.399 102.349 1.00 64.92 C ATOM 2438 C GLY A 822 31.745 23.821 101.832 1.00 65.70 C ATOM 2439 O GLY A 822 30.810 24.563 102.081 1.00 72.23 O ATOM 2440 H GLY A 822 30.820 21.520 100.600 1.00 0.00 H ATOM 2441 N LYS A 823 32.789 24.196 101.094 1.00 66.27 N ATOM 2442 CA LYS A 823 32.799 25.483 100.403 1.00 70.50 C ATOM 2443 C LYS A 823 32.033 25.369 99.068 1.00 75.56 C ATOM 2444 O LYS A 823 32.578 24.918 98.047 1.00 79.92 O ATOM 2445 CB LYS A 823 34.226 25.963 100.135 1.00 78.22 C ATOM 2446 CG LYS A 823 35.118 26.044 101.352 1.00 92.18 C ATOM 2447 CD LYS A 823 36.498 26.595 100.985 1.00105.34 C ATOM 2448 CE LYS A 823 37.478 26.536 102.156 1.00110.95 C ATOM 2449 NZ LYS A 823 37.776 25.134 102.573 1.00110.08 N ATOM 2450 HZ1 LYS A 823 36.895 24.666 102.865 1.00 0.00 H ATOM 2451 HZ2 LYS A 823 38.196 24.618 101.774 1.00 0.00 H ATOM 2452 HZ3 LYS A 823 38.445 25.145 103.370 1.00 0.00 H ATOM 2453 H LYS A 823 33.609 23.563 101.009 1.00 0.00 H ATOM 2454 N TYR A 824 30.777 25.801 99.079 1.00 69.09 N ATOM 2455 CA TYR A 824 29.923 25.663 97.925 1.00 63.32 C ATOM 2456 C TYR A 824 29.518 27.039 97.380 1.00 68.17 C ATOM 2457 O TYR A 824 28.534 27.606 97.830 1.00 77.91 O ATOM 2458 CB TYR A 824 28.691 24.860 98.333 1.00 61.46 C ATOM 2459 CG TYR A 824 28.118 23.985 97.241 1.00 73.06 C ATOM 2460 CD1 TYR A 824 28.533 22.668 97.086 1.00 71.27 C ATOM 2461 CD2 TYR A 824 27.148 24.473 96.378 1.00 74.21 C ATOM 2462 CE1 TYR A 824 27.997 21.873 96.107 1.00 69.97 C ATOM 2463 CE2 TYR A 824 26.610 23.684 95.392 1.00 69.82 C ATOM 2464 CZ TYR A 824 27.042 22.391 95.258 1.00 70.84 C ATOM 2465 OH TYR A 824 26.492 21.621 94.268 1.00 71.35 O ATOM 2466 HH TYR A 824 26.668 22.041 93.389 1.00 0.00 H ATOM 2467 H TYR A 824 30.401 26.249 99.939 1.00 0.00 H ATOM 2468 N LEU A 825 30.263 27.559 96.407 1.00 69.13 N ATOM 2469 CA LEU A 825 30.105 28.953 95.962 1.00 69.26 C ATOM 2470 C LEU A 825 29.740 29.148 94.479 1.00 73.20 C ATOM 2471 O LEU A 825 29.969 28.276 93.631 1.00 76.08 O ATOM 2472 CB LEU A 825 31.385 29.746 96.232 1.00 72.79 C ATOM 2473 CG LEU A 825 32.109 29.549 97.561 1.00 79.08 C ATOM 2474 CD1 LEU A 825 33.466 30.217 97.495 1.00 84.80 C ATOM 2475 CD2 LEU A 825 31.294 30.125 98.706 1.00 72.45 C ATOM 2476 H LEU A 825 30.979 26.961 95.947 1.00 0.00 H ATOM 2477 N ALA A 826 29.212 30.329 94.177 1.00 70.49 N ATOM 2478 CA ALA A 826 28.842 30.697 92.818 1.00 72.18 C ATOM 2479 C ALA A 826 29.096 32.182 92.541 1.00 78.08 C ATOM 2480 O ALA A 826 28.537 33.044 93.229 1.00 84.44 O ATOM 2481 CB ALA A 826 27.389 30.375 92.582 1.00 63.96 C ATOM 2482 H ALA A 826 29.057 31.017 94.941 1.00 0.00 H ATOM 2483 N ASP A 827 29.926 32.487 91.536 1.00 76.30 N ATOM 2484 CA ASP A 827 30.142 33.886 91.140 1.00 73.74 C ATOM 2485 C ASP A 827 29.223 34.284 90.006 1.00 77.78 C ATOM 2486 O ASP A 827 28.607 33.431 89.364 1.00 80.94 O ATOM 2487 CB ASP A 827 31.584 34.141 90.705 1.00 73.44 C ATOM 2488 CG ASP A 827 32.581 34.012 91.836 1.00 90.63 C ATOM 2489 OD1 ASP A 827 32.220 34.254 93.009 1.00 90.75 O ATOM 2490 OD2 ASP A 827 33.748 33.667 91.539 1.00 91.28 O ATOM 2491 H ASP A 827 30.423 31.726 91.030 1.00 0.00 H ATOM 2492 N ASN A 828 29.141 35.589 89.765 1.00 86.77 N ATOM 2493 CA ASN A 828 28.484 36.131 88.580 1.00 91.42 C ATOM 2494 C ASN A 828 29.445 36.006 87.405 1.00 98.30 C ATOM 2495 O ASN A 828 30.571 35.523 87.579 1.00102.68 O ATOM 2496 CB ASN A 828 28.112 37.596 88.815 1.00 86.80 C ATOM 2497 CG ASN A 828 27.355 38.214 87.648 1.00 94.46 C ATOM 2498 OD1 ASN A 828 26.170 37.929 87.438 1.00 99.06 O ATOM 2499 ND2 ASN A 828 28.025 39.095 86.903 1.00 90.90 N ATOM 2500 HD22 ASN A 828 29.021 39.305 87.116 1.00 0.00 H ATOM 2501 HD21 ASN A 828 27.551 39.572 86.110 1.00 0.00 H ATOM 2502 H ASN A 828 29.562 36.250 90.449 1.00 0.00 H TER 2503 ASN A 828 HETATM 2504 ZN ZN A 1 44.868 5.848 119.820 1.00125.53 ZN HETATM 2505 ZN ZN A 2 42.458 -6.561 96.520 1.00170.69 ZN HETATM 2506 ZN ZN A 3 31.324 -10.285 123.431 1.00106.51 ZN HETATM 2507 ZN ZN A 4 36.909 12.443 112.065 1.00153.08 ZN HETATM 2508 O HOH 5 29.326 26.751 101.352 1.00 50.45 O HETATM 2509 O HOH 6 31.890 36.998 92.810 1.00 65.05 O HETATM 2510 O HOH 7 30.984 20.541 105.391 1.00 66.47 O HETATM 2511 O HOH 8 22.835 42.196 117.009 1.00 61.25 O HETATM 2512 O HOH 9 44.600 5.236 117.135 1.00 75.68 O HETATM 2513 O HOH 10 35.083 25.612 96.037 1.00 65.39 O HETATM 2514 O HOH 11 46.454 4.837 121.642 1.00 68.03 O HETATM 2515 N TYR A 12 33.304 16.005 115.623 1.00 0.24 N HETATM 2516 CA TYR A 12 32.189 15.679 114.736 1.00 0.07 C HETATM 2517 C TYR A 12 31.800 14.207 114.803 1.00 0.23 C HETATM 2518 O TYR A 12 32.609 13.334 114.494 1.00 -0.39 O HETATM 2519 N TYR A 12 30.556 13.934 115.180 1.00 -0.26 N HETATM 2520 CA TYR A 12 30.080 12.556 115.261 1.00 0.14 C HETATM 2521 C TYR A 12 29.068 12.221 114.168 1.00 0.21 C HETATM 2522 O TYR A 12 28.002 12.840 114.081 1.00 -0.39 O HETATM 2523 N TYR A 12 29.401 11.229 113.330 1.00 -0.25 N HETATM 2524 CA TYR A 12 28.535 10.868 112.201 1.00 0.13 C HETATM 2525 C TYR A 12 27.221 10.223 112.633 1.00 0.20 C HETATM 2526 O TYR A 12 26.238 10.287 111.887 1.00 -0.39 O HETATM 2527 N TYR A 12 27.200 9.621 113.820 1.00 -0.26 N HETATM 2528 CA TYR A 12 25.996 8.946 114.298 1.00 0.14 C HETATM 2529 C TYR A 12 25.111 9.824 115.172 1.00 0.21 C HETATM 2530 O TYR A 12 23.927 9.541 115.320 1.00 -0.39 O HETATM 2531 N TYR A 12 25.690 10.870 115.757 1.00 -0.26 N HETATM 2532 CA TYR A 12 24.985 11.716 116.723 1.00 0.13 C HETATM 2533 C TYR A 12 23.671 12.241 116.154 1.00 0.20 C HETATM 2534 O TYR A 12 23.635 12.747 115.030 1.00 -0.39 O HETATM 2535 N TYR A 12 22.593 12.110 116.926 1.00 -0.27 N HETATM 2536 CA TYR A 12 22.660 11.546 118.264 1.00 0.12 C HETATM 2537 C TYR A 12 22.174 10.112 118.375 1.00 0.20 C HETATM 2538 O TYR A 12 22.303 9.489 119.432 1.00 -0.39 O HETATM 2539 N TYR A 12 21.623 9.590 117.280 1.00 -0.26 N HETATM 2540 CA TYR A 12 21.052 8.244 117.247 1.00 0.15 C HETATM 2541 C TYR A 12 22.051 7.186 117.691 1.00 0.21 C HETATM 2542 O TYR A 12 23.263 7.391 117.632 1.00 -0.39 O HETATM 2543 N TYR A 12 21.534 6.050 118.139 1.00 -0.26 N HETATM 2544 CA TYR A 12 22.397 4.977 118.599 1.00 0.14 C HETATM 2545 C TYR A 12 22.492 3.865 117.566 1.00 0.21 C HETATM 2546 O TYR A 12 21.471 3.366 117.083 1.00 -0.39 O HETATM 2547 N TYR A 12 23.731 3.487 117.220 1.00 -0.25 N HETATM 2548 CA TYR A 12 24.067 2.422 116.266 1.00 0.13 C HETATM 2549 C TYR A 12 23.768 1.011 116.789 1.00 0.20 C HETATM 2550 O TYR A 12 23.556 0.096 115.992 1.00 -0.39 O HETATM 2551 N TYR A 12 23.757 0.832 118.105 1.00 -0.26 N HETATM 2552 CA TYR A 12 23.554 -0.500 118.671 1.00 0.14 C HETATM 2553 C TYR A 12 22.232 -0.587 119.445 1.00 0.21 C HETATM 2554 O TYR A 12 22.222 -0.755 120.665 1.00 -0.39 O HETATM 2555 N TYR A 12 21.121 -0.468 118.720 1.00 -0.27 N HETATM 2556 CA TYR A 12 19.790 -0.478 119.325 1.00 0.09 C HETATM 2557 C TYR A 12 18.756 -1.083 118.379 1.00 0.06 C HETATM 2558 O TYR A 12 19.009 -1.237 117.183 1.00 -0.57 O HETATM 2559 OXT TYR A 12 17.648 -1.429 118.793 1.00 -0.57 O HETATM 2560 CB TYR A 12 19.380 0.931 119.728 1.00 -0.03 C HETATM 2561 H75 TYR A 12 18.378 0.906 120.181 1.00 0.03 H HETATM 2562 H76 TYR A 12 19.364 1.577 118.838 1.00 0.03 H HETATM 2563 H77 TYR A 12 20.102 1.329 120.457 1.00 0.03 H HETATM 2564 H74 TYR A 12 19.830 -1.099 120.232 1.00 0.07 H HETATM 2565 H73 TYR A 12 21.200 -0.368 117.728 1.00 0.19 H HETATM 2566 CB TYR A 12 24.752 -0.897 119.546 1.00 0.02 C HETATM 2567 CG TYR A 12 26.093 -0.726 118.859 1.00 -0.04 C HETATM 2568 CD1 TYR A 12 26.515 -1.624 117.882 1.00 -0.06 C HETATM 2569 CE1 TYR A 12 27.747 -1.467 117.242 1.00 -0.07 C HETATM 2570 CZ TYR A 12 28.567 -0.412 117.581 1.00 -0.07 C HETATM 2571 CE2 TYR A 12 28.164 0.488 118.552 1.00 -0.07 C HETATM 2572 CD2 TYR A 12 26.932 0.329 119.190 1.00 -0.06 C HETATM 2573 H69 TYR A 12 26.628 1.037 119.952 1.00 0.06 H HETATM 2574 H71 TYR A 12 28.807 1.319 118.818 1.00 0.06 H HETATM 2575 H72 TYR A 12 29.525 -0.288 117.088 1.00 0.06 H HETATM 2576 H70 TYR A 12 28.057 -2.173 116.481 1.00 0.06 H HETATM 2577 H68 TYR A 12 25.877 -2.458 117.614 1.00 0.06 H HETATM 2578 H66 TYR A 12 24.640 -1.954 119.830 1.00 0.05 H HETATM 2579 H67 TYR A 12 24.743 -0.272 120.451 1.00 0.05 H HETATM 2580 H65 TYR A 12 23.497 -1.214 117.837 1.00 0.08 H HETATM 2581 H64 TYR A 12 23.889 1.615 118.713 1.00 0.19 H HETATM 2582 CB TYR A 12 25.581 2.587 116.070 1.00 -0.01 C HETATM 2583 CG TYR A 12 25.898 3.951 116.553 1.00 -0.03 C HETATM 2584 CD TYR A 12 24.922 4.241 117.642 1.00 0.04 C HETATM 2585 H62 TYR A 12 25.294 3.883 118.613 1.00 0.05 H HETATM 2586 H63 TYR A 12 24.707 5.318 117.706 1.00 0.05 H HETATM 2587 H60 TYR A 12 25.787 4.680 115.737 1.00 0.03 H HETATM 2588 H61 TYR A 12 26.926 3.989 116.942 1.00 0.03 H HETATM 2589 H58 TYR A 12 25.844 2.485 115.007 1.00 0.03 H HETATM 2590 H59 TYR A 12 26.129 1.835 116.657 1.00 0.03 H HETATM 2591 H57 TYR A 12 23.527 2.575 115.320 1.00 0.08 H HETATM 2592 CB TYR A 12 21.914 4.416 119.935 1.00 0.04 C HETATM 2593 CG TYR A 12 22.902 3.435 120.540 1.00 0.04 C HETATM 2594 OD1 TYR A 12 22.825 2.231 120.218 1.00 -0.57 O HETATM 2595 OD2 TYR A 12 23.763 3.869 121.333 1.00 -0.57 O HETATM 2596 H55 TYR A 12 20.956 3.900 119.776 1.00 0.05 H HETATM 2597 H56 TYR A 12 21.769 5.250 120.637 1.00 0.05 H HETATM 2598 H54 TYR A 12 23.404 5.393 118.747 1.00 0.08 H HETATM 2599 H53 TYR A 12 20.541 5.931 118.160 1.00 0.19 H HETATM 2600 CB TYR A 12 20.539 7.912 115.843 1.00 0.08 C HETATM 2601 OG TYR A 12 19.674 8.924 115.354 1.00 -0.39 O HETATM 2602 H52 TYR A 12 19.374 8.689 114.484 1.00 0.21 H HETATM 2603 H50 TYR A 12 19.990 6.959 115.879 1.00 0.06 H HETATM 2604 H51 TYR A 12 21.398 7.816 115.162 1.00 0.06 H HETATM 2605 H49 TYR A 12 20.200 8.221 117.942 1.00 0.08 H HETATM 2606 H48 TYR A 12 21.599 10.141 116.446 1.00 0.19 H HETATM 2607 H46 TYR A 12 22.044 12.169 118.929 1.00 0.08 H HETATM 2608 H47 TYR A 12 23.708 11.579 118.597 1.00 0.08 H HETATM 2609 H45 TYR A 12 21.707 12.410 116.573 1.00 0.19 H HETATM 2610 CB TYR A 12 25.869 12.889 117.169 1.00 -0.01 C HETATM 2611 CG TYR A 12 25.710 13.260 118.637 1.00 -0.04 C HETATM 2612 CD TYR A 12 25.936 12.045 119.542 1.00 -0.01 C HETATM 2613 CE TYR A 12 25.488 12.309 120.980 1.00 -0.04 C HETATM 2614 NZ TYR A 12 25.625 11.103 121.853 1.00 0.22 N HETATM 2615 H42 TYR A 12 25.318 11.328 122.787 1.00 0.20 H HETATM 2616 H43 TYR A 12 26.590 10.813 121.877 1.00 0.20 H HETATM 2617 H44 TYR A 12 25.059 10.355 121.484 1.00 0.20 H HETATM 2618 H40 TYR A 12 24.433 12.619 120.969 1.00 0.08 H HETATM 2619 H41 TYR A 12 26.104 13.119 121.398 1.00 0.08 H HETATM 2620 H38 TYR A 12 27.008 11.798 119.544 1.00 0.03 H HETATM 2621 H39 TYR A 12 25.365 11.194 119.143 1.00 0.03 H HETATM 2622 H36 TYR A 12 24.693 13.646 118.802 1.00 0.03 H HETATM 2623 H37 TYR A 12 26.444 14.039 118.892 1.00 0.03 H HETATM 2624 H34 TYR A 12 25.611 13.768 116.560 1.00 0.03 H HETATM 2625 H35 TYR A 12 26.920 12.617 116.993 1.00 0.03 H HETATM 2626 H33 TYR A 12 24.755 11.102 117.606 1.00 0.08 H HETATM 2627 H32 TYR A 12 26.640 11.086 115.529 1.00 0.19 H HETATM 2628 CB TYR A 12 26.362 7.684 115.075 1.00 0.02 C HETATM 2629 CG TYR A 12 27.221 6.736 114.308 1.00 -0.04 C HETATM 2630 CD1 TYR A 12 26.678 5.955 113.307 1.00 -0.06 C HETATM 2631 CE1 TYR A 12 27.463 5.081 112.581 1.00 -0.07 C HETATM 2632 CZ TYR A 12 28.794 4.977 112.854 1.00 -0.07 C HETATM 2633 CE2 TYR A 12 29.356 5.743 113.861 1.00 -0.07 C HETATM 2634 CD2 TYR A 12 28.570 6.620 114.583 1.00 -0.06 C HETATM 2635 H28 TYR A 12 29.014 7.220 115.369 1.00 0.06 H HETATM 2636 H30 TYR A 12 30.413 5.654 114.083 1.00 0.06 H HETATM 2637 H31 TYR A 12 29.413 4.295 112.283 1.00 0.06 H HETATM 2638 H29 TYR A 12 27.021 4.479 111.795 1.00 0.06 H HETATM 2639 H27 TYR A 12 25.619 6.029 113.088 1.00 0.06 H HETATM 2640 H25 TYR A 12 25.433 7.165 115.352 1.00 0.05 H HETATM 2641 H26 TYR A 12 26.901 7.981 115.987 1.00 0.05 H HETATM 2642 H24 TYR A 12 25.410 8.652 113.415 1.00 0.08 H HETATM 2643 H23 TYR A 12 28.020 9.631 114.392 1.00 0.19 H HETATM 2644 CB TYR A 12 29.390 9.876 111.400 1.00 -0.01 C HETATM 2645 CG TYR A 12 30.453 9.402 112.348 1.00 -0.03 C HETATM 2646 CD TYR A 12 30.697 10.528 113.294 1.00 0.04 C HETATM 2647 H21 TYR A 12 30.970 10.152 114.291 1.00 0.05 H HETATM 2648 H22 TYR A 12 31.493 11.190 112.921 1.00 0.05 H HETATM 2649 H19 TYR A 12 31.374 9.159 111.798 1.00 0.03 H HETATM 2650 H20 TYR A 12 30.107 8.512 112.895 1.00 0.03 H HETATM 2651 H17 TYR A 12 29.845 10.375 110.532 1.00 0.03 H HETATM 2652 H18 TYR A 12 28.776 9.030 111.057 1.00 0.03 H HETATM 2653 H16 TYR A 12 28.308 11.759 111.598 1.00 0.08 H HETATM 2654 CB TYR A 12 29.470 12.276 116.628 1.00 0.04 C HETATM 2655 CG TYR A 12 28.948 10.863 116.747 1.00 0.04 C HETATM 2656 OD1 TYR A 12 27.987 10.650 117.507 1.00 -0.57 O HETATM 2657 OD2 TYR A 12 29.499 9.961 116.081 1.00 -0.57 O HETATM 2658 H14 TYR A 12 28.637 12.975 116.793 1.00 0.05 H HETATM 2659 H15 TYR A 12 30.240 12.434 117.398 1.00 0.05 H HETATM 2660 H13 TYR A 12 30.949 11.895 115.130 1.00 0.08 H HETATM 2661 H12 TYR A 12 29.936 14.684 115.412 1.00 0.19 H HETATM 2662 CB TYR A 12 32.518 16.026 113.283 1.00 0.04 C HETATM 2663 CG TYR A 12 31.538 15.389 112.325 1.00 -0.05 C HETATM 2664 CD1 TYR A 12 31.884 14.265 111.587 1.00 -0.07 C HETATM 2665 CE1 TYR A 12 30.977 13.667 110.730 1.00 -0.04 C HETATM 2666 CZ TYR A 12 29.704 14.190 110.610 1.00 0.08 C HETATM 2667 CE2 TYR A 12 29.335 15.300 111.338 1.00 -0.04 C HETATM 2668 CD2 TYR A 12 30.247 15.888 112.191 1.00 -0.07 C HETATM 2669 H8 TYR A 12 29.951 16.756 112.768 1.00 0.05 H HETATM 2670 H10 TYR A 12 28.336 15.709 111.242 1.00 0.05 H HETATM 2671 OH TYR A 12 28.795 13.605 109.754 1.00 -0.34 O HETATM 2672 H11 TYR A 12 29.198 12.857 109.329 1.00 0.25 H HETATM 2673 H9 TYR A 12 31.264 12.793 110.156 1.00 0.05 H HETATM 2674 H7 TYR A 12 32.880 13.849 111.684 1.00 0.05 H HETATM 2675 H5 TYR A 12 33.531 15.666 113.050 1.00 0.05 H HETATM 2676 H6 TYR A 12 32.480 17.118 113.159 1.00 0.05 H HETATM 2677 H4 TYR A 12 31.323 16.279 115.052 1.00 0.11 H HETATM 2678 H1 TYR A 12 33.522 16.986 115.542 1.00 0.20 H HETATM 2679 H2 TYR A 12 34.111 15.459 115.363 1.00 0.20 H HETATM 2680 H3 TYR A 12 33.048 15.795 116.575 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 274 272 2507 CONECT 381 380 383 2506 CONECT 689 697 698 699 2505 CONECT 689 690 CONECT 697 689 CONECT 698 689 CONECT 699 689 CONECT 856 855 858 2504 CONECT 1034 1033 2507 CONECT 2504 856 CONECT 2505 689 CONECT 2506 381 CONECT 2507 274 1034 CONECT 2515 2516 2678 2679 2680 CONECT 2516 2515 2517 2662 2677 CONECT 2517 2516 2518 2519 CONECT 2518 2517 CONECT 2519 2517 2520 2661 CONECT 2520 2519 2521 2654 2660 CONECT 2521 2520 2522 2523 CONECT 2522 2521 CONECT 2523 2521 2524 2646 CONECT 2524 2523 2525 2644 2653 CONECT 2525 2524 2526 2527 CONECT 2526 2525 CONECT 2527 2525 2528 2643 CONECT 2528 2527 2529 2628 2642 CONECT 2529 2528 2530 2531 CONECT 2530 2529 CONECT 2531 2529 2532 2627 CONECT 2532 2531 2533 2610 2626 CONECT 2533 2532 2534 2535 CONECT 2534 2533 CONECT 2535 2533 2536 2609 CONECT 2536 2535 2537 2607 2608 CONECT 2537 2536 2538 2539 CONECT 2538 2537 CONECT 2539 2537 2540 2606 CONECT 2540 2539 2541 2600 2605 CONECT 2541 2540 2542 2543 CONECT 2542 2541 CONECT 2543 2541 2544 2599 CONECT 2544 2543 2545 2592 2598 CONECT 2545 2544 2546 2547 CONECT 2546 2545 CONECT 2547 2545 2548 2584 CONECT 2548 2547 2549 2582 2591 CONECT 2549 2548 2550 2551 CONECT 2550 2549 CONECT 2551 2549 2552 2581 CONECT 2552 2551 2553 2566 2580 CONECT 2553 2552 2554 2555 CONECT 2554 2553 CONECT 2555 2553 2556 2565 CONECT 2556 2555 2557 2560 2564 CONECT 2557 2556 2558 2559 CONECT 2558 2557 CONECT 2559 2557 CONECT 2560 2556 2561 2562 2563 CONECT 2561 2560 CONECT 2562 2560 CONECT 2563 2560 CONECT 2564 2556 CONECT 2565 2555 CONECT 2566 2552 2567 2578 2579 CONECT 2567 2566 2568 2572 CONECT 2568 2567 2569 2577 CONECT 2569 2568 2570 2576 CONECT 2570 2569 2571 2575 CONECT 2571 2570 2572 2574 CONECT 2572 2567 2571 2573 CONECT 2573 2572 CONECT 2574 2571 CONECT 2575 2570 CONECT 2576 2569 CONECT 2577 2568 CONECT 2578 2566 CONECT 2579 2566 CONECT 2580 2552 CONECT 2581 2551 CONECT 2582 2548 2583 2589 2590 CONECT 2583 2582 2584 2587 2588 CONECT 2584 2547 2583 2585 2586 CONECT 2585 2584 CONECT 2586 2584 CONECT 2587 2583 CONECT 2588 2583 CONECT 2589 2582 CONECT 2590 2582 CONECT 2591 2548 CONECT 2592 2544 2593 2596 2597 CONECT 2593 2592 2594 2595 CONECT 2594 2593 CONECT 2595 2593 CONECT 2596 2592 CONECT 2597 2592 CONECT 2598 2544 CONECT 2599 2543 CONECT 2600 2540 2601 2603 2604 CONECT 2601 2600 2602 CONECT 2602 2601 CONECT 2603 2600 CONECT 2604 2600 CONECT 2605 2540 CONECT 2606 2539 CONECT 2607 2536 CONECT 2608 2536 CONECT 2609 2535 CONECT 2610 2532 2611 2624 2625 CONECT 2611 2610 2612 2622 2623 CONECT 2612 2611 2613 2620 2621 CONECT 2613 2612 2614 2618 2619 CONECT 2614 2613 2615 2616 2617 CONECT 2615 2614 CONECT 2616 2614 CONECT 2617 2614 CONECT 2618 2613 CONECT 2619 2613 CONECT 2620 2612 CONECT 2621 2612 CONECT 2622 2611 CONECT 2623 2611 CONECT 2624 2610 CONECT 2625 2610 CONECT 2626 2532 CONECT 2627 2531 CONECT 2628 2528 2629 2640 2641 CONECT 2629 2628 2630 2634 CONECT 2630 2629 2631 2639 CONECT 2631 2630 2632 2638 CONECT 2632 2631 2633 2637 CONECT 2633 2632 2634 2636 CONECT 2634 2629 2633 2635 CONECT 2635 2634 CONECT 2636 2633 CONECT 2637 2632 CONECT 2638 2631 CONECT 2639 2630 CONECT 2640 2628 CONECT 2641 2628 CONECT 2642 2528 CONECT 2643 2527 CONECT 2644 2524 2645 2651 2652 CONECT 2645 2644 2646 2649 2650 CONECT 2646 2523 2645 2647 2648 CONECT 2647 2646 CONECT 2648 2646 CONECT 2649 2645 CONECT 2650 2645 CONECT 2651 2644 CONECT 2652 2644 CONECT 2653 2524 CONECT 2654 2520 2655 2658 2659 CONECT 2655 2654 2656 2657 CONECT 2656 2655 CONECT 2657 2655 CONECT 2658 2654 CONECT 2659 2654 CONECT 2660 2520 CONECT 2661 2519 CONECT 2662 2516 2663 2675 2676 CONECT 2663 2662 2664 2668 CONECT 2664 2663 2665 2674 CONECT 2665 2664 2666 2673 CONECT 2666 2665 2667 2671 CONECT 2667 2666 2668 2670 CONECT 2668 2663 2667 2669 CONECT 2669 2668 CONECT 2670 2667 CONECT 2671 2666 2672 CONECT 2672 2671 CONECT 2673 2665 CONECT 2674 2664 CONECT 2675 2662 CONECT 2676 2662 CONECT 2677 2516 CONECT 2678 2515 CONECT 2679 2515 CONECT 2680 2515 MASTER 0 0 0 0 0 0 0 0 2678 2 183 21 END
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Protein
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11-mer
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11-mer
1ff1
RCSB PDB
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11-mer
1h25
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11-mer
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11-mer
1h28
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11-mer
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11-mer
1irs
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11-mer
1jm4
RCSB PDB
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11-mer
1l2z
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PDBbind
11-mer
1lcj
RCSB PDB
PDBbind
11-mer
1mik
RCSB PDB
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11-mer
1om2
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PDBbind
11-mer
1ox9
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PDBbind
11-mer
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RCSB PDB
PDBbind
11-mer
1qnh
RCSB PDB
PDBbind
11-mer
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11-mer
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RCSB PDB
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11-mer
1ths
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11-mer
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PDBbind
11-mer
1ukh
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11-mer
1xn2
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PDBbind
11-mer
1zh7
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PDBbind
11-mer
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RCSB PDB
PDBbind
11-mer
2aof
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PDBbind
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RCSB PDB
PDBbind
11-mer
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RCSB PDB
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11-mer
2bz8
RCSB PDB
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PDBbind
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11-mer
2h2g
RCSB PDB
PDBbind
11-mer
2h2h
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PDBbind
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2h9m
RCSB PDB
PDBbind
11-mer
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11-mer
2h9p
RCSB PDB
PDBbind
11-mer
2hdx
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PDBbind
11-mer
2hmh
RCSB PDB
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RCSB PDB
PDBbind
11-mer
2kpl
RCSB PDB
PDBbind
11-mer
2ks9
RCSB PDB
PDBbind
11-mer
2ksa
RCSB PDB
PDBbind
11-mer
2ksb
RCSB PDB
PDBbind
11-mer
2l3r
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PDBbind
11-mer
2m0o
RCSB PDB
PDBbind
11-mer
2m3m
RCSB PDB
PDBbind
11-mer
2m3o
RCSB PDB
PDBbind
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11-mer
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2wfj
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2x2c
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2z6w
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3ax5
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3dpo
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3iiy
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RCSB PDB
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3m56
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PDBbind
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3m57
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3m59
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PDBbind
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RCSB PDB
PDBbind
11-mer
3mea
RCSB PDB
PDBbind
11-mer
3met
RCSB PDB
PDBbind
11-mer
3oap
RCSB PDB
PDBbind
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3odi
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PDBbind
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3odl
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3p4f
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11-mer
3p9h
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PDBbind
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3pqz
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PDBbind
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3qzv
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3rbq
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PDBbind
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3rl7
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PDBbind
11-mer
3rl8
RCSB PDB
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11-mer
3rwd
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11-mer
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RCSB PDB
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11-mer
3zke
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PDBbind
11-mer
3zkf
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PDBbind
11-mer
4aa2
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PDBbind
11-mer
4b8o
RCSB PDB
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11-mer
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RCSB PDB
PDBbind
11-mer
4ds1
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PDBbind
11-mer
4e9c
RCSB PDB
PDBbind
11-mer
4fgy
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PDBbind
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4g69
RCSB PDB
PDBbind
11-mer
4ht6
RCSB PDB
PDBbind
11-mer
4htp
RCSB PDB
PDBbind
11-mer
4hyb
RCSB PDB
PDBbind
11-mer
4j7i
RCSB PDB
PDBbind
11-mer
4j8g
RCSB PDB
PDBbind
11-mer
4jjm
RCSB PDB
PDBbind
11-mer
4ln2
RCSB PDB
PDBbind
11-mer
4n7g
RCSB PDB
PDBbind
11-mer
4n7y
RCSB PDB
PDBbind
11-mer
4o3t
RCSB PDB
PDBbind
11-mer
4o62
RCSB PDB
PDBbind
11-mer
4pl6
RCSB PDB
PDBbind
11-mer
4pli
RCSB PDB
PDBbind
11-mer
4pr5
RCSB PDB
PDBbind
11-mer
4pra
RCSB PDB
PDBbind
11-mer
4prb
RCSB PDB
PDBbind
11-mer
4prd
RCSB PDB
PDBbind
11-mer
4pre
RCSB PDB
PDBbind
11-mer
4prh
RCSB PDB
PDBbind
11-mer
4pri
RCSB PDB
PDBbind
11-mer
4prn
RCSB PDB
PDBbind
11-mer
4prp
RCSB PDB
PDBbind
11-mer
4pxf
RCSB PDB
PDBbind
11-mer
4qc1
RCSB PDB
PDBbind
11-mer
4qyo
RCSB PDB
PDBbind
11-mer
4tk1
RCSB PDB
PDBbind
11-mer
4tk2
RCSB PDB
PDBbind
11-mer
4tk3
RCSB PDB
PDBbind
11-mer
4tk4
RCSB PDB
PDBbind
11-mer
4tmp
RCSB PDB
PDBbind
11-mer
4u68
RCSB PDB
PDBbind
11-mer
4u91
RCSB PDB
PDBbind
11-mer
4w5a
RCSB PDB
PDBbind
11-mer
4wph
RCSB PDB
PDBbind
11-mer
4x6s
RCSB PDB
PDBbind
11-mer
4xc2
RCSB PDB
PDBbind
11-mer
4yje
RCSB PDB
PDBbind
11-mer
4yk6
RCSB PDB
PDBbind
11-mer
4yv9
RCSB PDB
PDBbind
11-mer
4yy6
RCSB PDB
PDBbind
11-mer
4yyi
RCSB PDB
PDBbind
11-mer
4yym
RCSB PDB
PDBbind
11-mer
4yyn
RCSB PDB
PDBbind
11-mer
5a0e
RCSB PDB
PDBbind
11-mer
5agu
RCSB PDB
PDBbind
11-mer
5agv
RCSB PDB
PDBbind
11-mer
5ah2
RCSB PDB
PDBbind
11-mer
5awt
RCSB PDB
PDBbind
11-mer
5b6c
RCSB PDB
PDBbind
11-mer
5c6v
RCSB PDB
PDBbind
11-mer
5c7e
RCSB PDB
PDBbind
11-mer
5c7f
RCSB PDB
PDBbind
11-mer
5csz
RCSB PDB
PDBbind
11-mer
5dah
RCSB PDB
PDBbind
11-mer
5ewz
RCSB PDB
PDBbind
11-mer
5ez0
RCSB PDB
PDBbind
11-mer
5hpm
RCSB PDB
PDBbind
11-mer
5ick
RCSB PDB
PDBbind
11-mer
5id0
RCSB PDB
PDBbind
11-mer
5igq
RCSB PDB
PDBbind
11-mer
5jin
RCSB PDB
PDBbind
11-mer
5jiy
RCSB PDB
PDBbind
11-mer
5jm4
RCSB PDB
PDBbind
11-mer
5kez
RCSB PDB
PDBbind
11-mer
5l3f
RCSB PDB
PDBbind
11-mer
5l3g
RCSB PDB
PDBbind
11-mer
5lgq
RCSB PDB
PDBbind
11-mer
5mlw
RCSB PDB
PDBbind
11-mer
5nne
RCSB PDB
PDBbind
11-mer
5svx
RCSB PDB
PDBbind
11-mer
5svy
RCSB PDB
PDBbind
11-mer
5tdr
RCSB PDB
PDBbind
11-mer
5tdw
RCSB PDB
PDBbind
11-mer
5tq1
RCSB PDB
PDBbind
11-mer
5tqs
RCSB PDB
PDBbind
11-mer
5vlk
RCSB PDB
PDBbind
11-mer
5xhz
RCSB PDB
PDBbind
11-mer
5ygd
RCSB PDB
PDBbind
11-mer
6au5
RCSB PDB
PDBbind
11-mer
6axj
RCSB PDB
PDBbind
11-mer
6axp
RCSB PDB
PDBbind
11-mer
6ayn
RCSB PDB
PDBbind
11-mer
6azk
RCSB PDB
PDBbind
11-mer
6azl
RCSB PDB
PDBbind
11-mer
6ct7
RCSB PDB
PDBbind
11-mer
6g0q
RCSB PDB
PDBbind
11-mer
6qzr
RCSB PDB
PDBbind
11-mer
6qtw
RCSB PDB
PDBbind
11-mer
6qs1
RCSB PDB
PDBbind
11-mer
6om2
RCSB PDB
PDBbind
11-mer
6i5n
RCSB PDB
PDBbind
11-mer
6i5j
RCSB PDB
PDBbind
11-mer
6i4x
RCSB PDB
PDBbind
11-mer
6hks
RCSB PDB
PDBbind
11-mer
6gy5
RCSB PDB
PDBbind
11-mer
6g8q
RCSB PDB
PDBbind
11-mer
6g8p
RCSB PDB
PDBbind
11-mer
6g8l
RCSB PDB
PDBbind
11-mer
6g8k
RCSB PDB
PDBbind
11-mer
6g8j
RCSB PDB
PDBbind
11-mer
6g8i
RCSB PDB
PDBbind
11-mer
6g6x
RCSB PDB
PDBbind
11-mer
Entry Information
PDB ID
5awu
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
SGIP1 mu homology domain
Ligand Name
11-mer
EC.Number
E.C.-.-.-.-
Resolution
2.7(Å)
Affinity (Kd/Ki/IC50)
Kd=22.4uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Sci Rep Vol. 6: pp. 19565-19565
Ligand Properties
Formula
C
5
9
H
8
0
N
1
2
O
1
8
Molecular Weight
1245.340
Exact Mass
1244.570
No. of atoms
169
No. of bonds
173
Polar Surface Area
481.06
LOGP Value
-2.45 (
Computed with XLOGP3
)
-2.02 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 12
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 43
No. of Nitrogen and Oxygen Atoms: 30
No. of Rings: 5
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)CC(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)O)Cc1ccccc1
InChI String
InChI=1S/C59H78N12O18/c1-33(59(88)89)63-52(81)40(27-34-12-4-2-5-13-34)66-55(84)45-17-11-25-71(45)58(87)43(30-49(77)78)69-54(83)44(32-72)64-47(74)31-62-51(80)39(16-8-9-23-60)65-53(82)41(28-35-14-6-3-7-15-35)67-56(85)46-18-10-24-70(46)57(86)42(29-48(75)76)68-50(79)38(61)26-36-19-21-37(73)22-20-36/h2-7,12-15,19-22,33,38-46,72-73H,8-11,16-18,23-32,60-61H2,1H3,(H,62,80)(H,63,81)(H,64,74)(H,65,82)(H,66,84)(H,67,85)(H,68,79)(H,69,83)(H,75,76)(H,77,78)(H,88,89)/p+2/t33-,38-,39-,40-,41-,42-,43-,44-,45-,46-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
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UniProtKB AC
UniProt accession number (AC):
P42566
Q9BQI5
Entrez Gene ID
NCBI Entrez Gene ID:
2060
84251
ASD
Information of known allosteric effects of PDB entries
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