Browse entries in the PDBbind-CN Database
HEADER 5AWT_COMPLEX COMPND 5AWT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 76 ASP THR LEU PRO VAL ALA ALA ALA PHE THR GLU THR VAL SEQRES 2 A 76 ASN ALA TYR PHE LYS GLY ALA ASP PRO SER LYS CYS ILE SEQRES 3 A 76 VAL LYS ILE THR GLY GLU MET VAL LEU SER PHE PRO ALA SEQRES 4 A 76 GLY ILE THR ARG HIS PHE ALA ASN ASN PRO SER PRO ALA SEQRES 5 A 76 ALA LEU THR PHE ARG VAL ILE ASN PHE SER ARG LEU GLU SEQRES 6 A 76 HIS 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 ZN A 5 1 HET ZN A 6 1 HET TYR A 308 152 ATOM 1 N ASP A 558 29.821 -15.005 121.557 1.00123.95 N ATOM 2 CA ASP A 558 28.886 -14.027 121.015 1.00124.35 C ATOM 3 C ASP A 558 29.472 -13.298 119.798 1.00115.28 C ATOM 4 O ASP A 558 30.688 -13.267 119.609 1.00111.74 O ATOM 5 CB ASP A 558 28.418 -13.033 122.106 1.00128.83 C ATOM 6 CG ASP A 558 29.558 -12.176 122.690 1.00126.61 C ATOM 7 OD1 ASP A 558 30.603 -12.738 123.100 1.00124.44 O ATOM 8 OD2 ASP A 558 29.391 -10.930 122.755 1.00124.35 O ATOM 9 HN3 ASP A 558 30.694 -14.522 121.852 1.00 0.00 H ATOM 10 HN2 ASP A 558 30.044 -15.711 120.827 1.00 0.00 H ATOM 11 HN1 ASP A 558 29.390 -15.477 122.378 1.00 0.00 H ATOM 12 N THR A 559 28.600 -12.733 118.967 1.00109.44 N ATOM 13 CA THR A 559 29.031 -11.976 117.787 1.00 96.89 C ATOM 14 C THR A 559 28.796 -10.477 118.008 1.00 90.98 C ATOM 15 O THR A 559 27.722 -10.077 118.460 1.00 90.45 O ATOM 16 CB THR A 559 28.325 -12.469 116.503 1.00 91.09 C ATOM 17 OG1 THR A 559 27.733 -11.360 115.822 1.00 80.75 O ATOM 18 CG2 THR A 559 27.241 -13.500 116.842 1.00100.32 C ATOM 19 HG1 THR A 559 27.070 -10.926 116.415 1.00 0.00 H ATOM 20 H THR A 559 27.583 -12.831 119.160 1.00 0.00 H ATOM 21 N LEU A 560 29.803 -9.656 117.707 1.00 85.51 N ATOM 22 CA LEU A 560 29.781 -8.243 118.098 1.00 83.00 C ATOM 23 C LEU A 560 29.075 -7.329 117.079 1.00 75.89 C ATOM 24 O LEU A 560 29.356 -7.366 115.877 1.00 74.14 O ATOM 25 CB LEU A 560 31.202 -7.734 118.365 1.00 83.27 C ATOM 26 CG LEU A 560 31.557 -6.876 119.591 1.00 86.68 C ATOM 27 CD1 LEU A 560 32.820 -6.064 119.308 1.00 81.64 C ATOM 28 CD2 LEU A 560 30.437 -5.958 120.061 1.00 88.56 C ATOM 29 H LEU A 560 30.622 -10.026 117.183 1.00 0.00 H ATOM 30 N PRO A 561 28.126 -6.522 117.561 1.00 74.13 N ATOM 31 CA PRO A 561 27.559 -5.478 116.708 1.00 72.89 C ATOM 32 C PRO A 561 28.540 -4.338 116.492 1.00 69.34 C ATOM 33 O PRO A 561 29.243 -3.914 117.411 1.00 74.22 O ATOM 34 CB PRO A 561 26.357 -4.978 117.515 1.00 74.73 C ATOM 35 CG PRO A 561 26.604 -5.438 118.929 1.00 76.08 C ATOM 36 CD PRO A 561 27.323 -6.735 118.776 1.00 77.25 C ATOM 37 N VAL A 562 28.568 -3.842 115.266 1.00 61.48 N ATOM 38 CA VAL A 562 29.440 -2.746 114.878 1.00 53.18 C ATOM 39 C VAL A 562 28.637 -1.849 113.940 1.00 52.40 C ATOM 40 O VAL A 562 27.665 -2.302 113.345 1.00 56.91 O ATOM 41 CB VAL A 562 30.697 -3.318 114.209 1.00 48.48 C ATOM 42 CG1 VAL A 562 31.376 -2.307 113.344 1.00 49.15 C ATOM 43 CG2 VAL A 562 31.653 -3.819 115.273 1.00 49.00 C ATOM 44 H VAL A 562 27.938 -4.254 114.548 1.00 0.00 H ATOM 45 N ALA A 563 28.985 -0.571 113.840 1.00 51.75 N ATOM 46 CA ALA A 563 28.252 0.333 112.948 1.00 50.55 C ATOM 47 C ALA A 563 29.209 1.068 112.047 1.00 55.49 C ATOM 48 O ALA A 563 30.408 1.128 112.311 1.00 53.94 O ATOM 49 CB ALA A 563 27.414 1.326 113.735 1.00 51.62 C ATOM 50 H ALA A 563 29.784 -0.209 114.399 1.00 0.00 H ATOM 51 N ALA A 564 28.666 1.647 110.983 1.00 57.64 N ATOM 52 CA ALA A 564 29.489 2.249 109.947 1.00 44.67 C ATOM 53 C ALA A 564 28.800 3.432 109.288 1.00 46.75 C ATOM 54 O ALA A 564 27.587 3.413 109.025 1.00 46.84 O ATOM 55 CB ALA A 564 29.841 1.218 108.925 1.00 35.40 C ATOM 56 H ALA A 564 27.631 1.670 110.889 1.00 0.00 H ATOM 57 N ALA A 565 29.589 4.463 109.011 1.00 48.71 N ATOM 58 CA ALA A 565 29.077 5.681 108.392 1.00 46.07 C ATOM 59 C ALA A 565 29.980 6.145 107.254 1.00 46.67 C ATOM 60 O ALA A 565 31.207 6.155 107.399 1.00 52.86 O ATOM 61 CB ALA A 565 28.928 6.775 109.440 1.00 37.16 C ATOM 62 H ALA A 565 30.601 4.401 109.242 1.00 0.00 H ATOM 63 N PHE A 566 29.384 6.490 106.112 1.00 45.48 N ATOM 64 CA PHE A 566 30.083 7.287 105.080 1.00 40.28 C ATOM 65 C PHE A 566 29.559 8.731 105.082 1.00 41.67 C ATOM 66 O PHE A 566 28.348 8.959 104.950 1.00 49.02 O ATOM 67 CB PHE A 566 29.863 6.704 103.690 1.00 34.40 C ATOM 68 CG PHE A 566 30.523 5.374 103.464 1.00 30.85 C ATOM 69 CD1 PHE A 566 29.870 4.187 103.788 1.00 35.16 C ATOM 70 CD2 PHE A 566 31.788 5.302 102.912 1.00 32.72 C ATOM 71 CE1 PHE A 566 30.475 2.940 103.571 1.00 38.54 C ATOM 72 CE2 PHE A 566 32.419 4.047 102.697 1.00 33.47 C ATOM 73 CZ PHE A 566 31.749 2.871 103.026 1.00 38.88 C ATOM 74 H PHE A 566 28.402 6.191 105.942 1.00 0.00 H ATOM 75 N THR A 567 30.455 9.705 105.209 1.00 40.68 N ATOM 76 CA THR A 567 30.036 11.115 105.295 1.00 41.70 C ATOM 77 C THR A 567 30.821 11.940 104.286 1.00 39.49 C ATOM 78 O THR A 567 32.047 12.082 104.427 1.00 43.02 O ATOM 79 CB THR A 567 30.318 11.700 106.690 1.00 43.78 C ATOM 80 OG1 THR A 567 29.726 10.867 107.691 1.00 48.75 O ATOM 81 CG2 THR A 567 29.762 13.099 106.809 1.00 45.12 C ATOM 82 HG1 THR A 567 29.910 11.247 108.586 1.00 0.00 H ATOM 83 H THR A 567 31.467 9.468 105.248 1.00 0.00 H ATOM 84 N GLU A 568 30.126 12.494 103.288 1.00 38.50 N ATOM 85 CA GLU A 568 30.789 13.205 102.187 1.00 34.54 C ATOM 86 C GLU A 568 30.397 14.671 102.074 1.00 38.40 C ATOM 87 O GLU A 568 29.253 15.064 102.273 1.00 37.39 O ATOM 88 CB GLU A 568 30.611 12.455 100.879 1.00 31.55 C ATOM 89 CG GLU A 568 31.246 11.093 100.967 1.00 41.25 C ATOM 90 CD GLU A 568 30.847 10.138 99.858 1.00 47.90 C ATOM 91 OE1 GLU A 568 30.019 10.511 99.001 1.00 51.24 O ATOM 92 OE2 GLU A 568 31.371 8.999 99.860 1.00 43.36 O ATOM 93 H GLU A 568 29.089 12.420 103.291 1.00 0.00 H ATOM 94 N THR A 569 31.399 15.474 101.775 1.00 45.09 N ATOM 95 CA THR A 569 31.262 16.904 101.641 1.00 43.63 C ATOM 96 C THR A 569 31.530 17.232 100.165 1.00 42.61 C ATOM 97 O THR A 569 32.550 16.821 99.606 1.00 46.42 O ATOM 98 CB THR A 569 32.303 17.596 102.500 1.00 42.17 C ATOM 99 OG1 THR A 569 32.294 17.014 103.818 1.00 42.27 O ATOM 100 CG2 THR A 569 32.026 19.056 102.554 1.00 27.45 C ATOM 101 HG1 THR A 569 32.973 17.464 104.381 1.00 0.00 H ATOM 102 H THR A 569 32.339 15.054 101.628 1.00 0.00 H ATOM 103 N VAL A 570 30.595 17.946 99.551 1.00 33.88 N ATOM 104 CA VAL A 570 30.742 18.373 98.192 1.00 37.38 C ATOM 105 C VAL A 570 31.032 19.863 98.151 1.00 38.63 C ATOM 106 O VAL A 570 30.229 20.664 98.572 1.00 37.16 O ATOM 107 CB VAL A 570 29.509 18.003 97.321 1.00 36.41 C ATOM 108 CG1 VAL A 570 28.211 18.629 97.848 1.00 41.87 C ATOM 109 CG2 VAL A 570 29.751 18.410 95.917 1.00 30.59 C ATOM 110 H VAL A 570 29.732 18.203 100.071 1.00 0.00 H ATOM 111 N ASN A 571 32.228 20.222 97.696 1.00 45.74 N ATOM 112 CA ASN A 571 32.556 21.617 97.402 1.00 39.43 C ATOM 113 C ASN A 571 32.366 21.880 95.898 1.00 39.16 C ATOM 114 O ASN A 571 32.703 21.051 95.043 1.00 41.15 O ATOM 115 CB ASN A 571 33.978 21.966 97.840 1.00 35.08 C ATOM 116 CG ASN A 571 34.311 21.457 99.249 1.00 40.70 C ATOM 117 OD1 ASN A 571 34.113 22.156 100.253 1.00 41.68 O ATOM 118 ND2 ASN A 571 34.828 20.229 99.321 1.00 38.09 N ATOM 119 HD22 ASN A 571 34.978 19.676 98.453 1.00 0.00 H ATOM 120 HD21 ASN A 571 35.081 19.825 100.245 1.00 0.00 H ATOM 121 H ASN A 571 32.951 19.490 97.545 1.00 0.00 H ATOM 122 N ALA A 572 31.797 23.025 95.571 1.00 35.74 N ATOM 123 CA ALA A 572 31.483 23.321 94.192 1.00 37.80 C ATOM 124 C ALA A 572 31.637 24.826 94.014 1.00 42.83 C ATOM 125 O ALA A 572 31.311 25.578 94.953 1.00 40.84 O ATOM 126 CB ALA A 572 30.067 22.894 93.886 1.00 29.38 C ATOM 127 H ALA A 572 31.573 23.720 96.312 1.00 0.00 H ATOM 128 N TYR A 573 32.180 25.249 92.862 1.00 39.32 N ATOM 129 CA TYR A 573 32.192 26.653 92.486 1.00 37.67 C ATOM 130 C TYR A 573 31.683 26.825 91.015 1.00 49.78 C ATOM 131 O TYR A 573 32.229 26.260 90.066 1.00 53.26 O ATOM 132 CB TYR A 573 33.573 27.300 92.743 1.00 45.69 C ATOM 133 CG TYR A 573 33.799 28.616 91.999 1.00 67.82 C ATOM 134 CD1 TYR A 573 34.171 28.618 90.625 1.00 71.63 C ATOM 135 CD2 TYR A 573 33.666 29.850 92.642 1.00 73.25 C ATOM 136 CE1 TYR A 573 34.380 29.793 89.909 1.00 71.66 C ATOM 137 CE2 TYR A 573 33.881 31.047 91.918 1.00 81.82 C ATOM 138 CZ TYR A 573 34.241 30.996 90.543 1.00 78.16 C ATOM 139 OH TYR A 573 34.467 32.118 89.779 1.00 84.12 O ATOM 140 HH TYR A 573 33.648 32.674 89.761 1.00 0.00 H ATOM 141 H TYR A 573 32.605 24.551 92.219 1.00 0.00 H ATOM 142 N PHE A 574 30.632 27.620 90.858 1.00 43.88 N ATOM 143 CA PHE A 574 29.992 27.889 89.584 1.00 45.17 C ATOM 144 C PHE A 574 30.376 29.280 89.080 1.00 50.57 C ATOM 145 O PHE A 574 30.535 30.200 89.886 1.00 49.51 O ATOM 146 CB PHE A 574 28.468 27.781 89.747 1.00 40.99 C ATOM 147 CG PHE A 574 28.008 26.413 90.203 1.00 41.09 C ATOM 148 CD1 PHE A 574 27.928 26.095 91.571 1.00 40.84 C ATOM 149 CD2 PHE A 574 27.683 25.421 89.275 1.00 37.88 C ATOM 150 CE1 PHE A 574 27.512 24.826 91.995 1.00 32.63 C ATOM 151 CE2 PHE A 574 27.278 24.150 89.702 1.00 39.21 C ATOM 152 CZ PHE A 574 27.197 23.860 91.081 1.00 43.29 C ATOM 153 H PHE A 574 30.241 28.081 91.704 1.00 0.00 H ATOM 154 N LYS A 575 30.543 29.437 87.756 1.00 50.39 N ATOM 155 CA LYS A 575 30.824 30.753 87.186 1.00 50.54 C ATOM 156 C LYS A 575 29.742 31.119 86.186 1.00 51.24 C ATOM 157 O LYS A 575 29.662 30.494 85.146 1.00 49.21 O ATOM 158 CB LYS A 575 32.213 30.768 86.547 1.00 61.63 C ATOM 159 CG LYS A 575 33.020 32.046 86.822 1.00 72.06 C ATOM 160 CD LYS A 575 32.261 33.293 86.386 1.00 72.39 C ATOM 161 CE LYS A 575 32.880 34.553 86.926 1.00 81.90 C ATOM 162 NZ LYS A 575 31.949 35.682 86.683 1.00 90.70 N ATOM 163 HZ1 LYS A 575 31.783 35.779 85.661 1.00 0.00 H ATOM 164 HZ2 LYS A 575 31.047 35.496 87.166 1.00 0.00 H ATOM 165 HZ3 LYS A 575 32.367 36.560 87.053 1.00 0.00 H ATOM 166 H LYS A 575 30.471 28.611 87.128 1.00 0.00 H ATOM 167 N GLY A 576 28.910 32.122 86.495 1.00 63.06 N ATOM 168 CA GLY A 576 27.752 32.479 85.665 1.00 51.78 C ATOM 169 C GLY A 576 26.987 31.253 85.179 1.00 49.12 C ATOM 170 O GLY A 576 26.730 30.342 85.943 1.00 53.15 O ATOM 171 H GLY A 576 29.092 32.671 87.359 1.00 0.00 H ATOM 172 N ALA A 577 26.692 31.181 83.882 1.00 60.98 N ATOM 173 CA ALA A 577 25.987 30.028 83.313 1.00 52.58 C ATOM 174 C ALA A 577 26.867 28.960 82.614 1.00 50.08 C ATOM 175 O ALA A 577 26.323 28.026 82.016 1.00 48.70 O ATOM 176 CB ALA A 577 24.909 30.513 82.383 1.00 51.80 C ATOM 177 H ALA A 577 26.969 31.964 83.256 1.00 0.00 H ATOM 178 N ASP A 578 28.198 29.064 82.735 1.00 50.20 N ATOM 179 CA ASP A 578 29.138 28.208 81.997 1.00 51.92 C ATOM 180 C ASP A 578 29.635 26.990 82.789 1.00 60.00 C ATOM 181 O ASP A 578 30.630 27.084 83.532 1.00 65.70 O ATOM 182 CB ASP A 578 30.325 29.056 81.503 1.00 53.15 C ATOM 183 CG ASP A 578 31.352 28.262 80.700 1.00 58.88 C ATOM 184 OD1 ASP A 578 31.356 27.016 80.755 1.00 50.49 O ATOM 185 OD2 ASP A 578 32.188 28.901 80.016 1.00 55.72 O ATOM 186 H ASP A 578 28.583 29.783 83.380 1.00 0.00 H ATOM 187 N PRO A 579 29.013 25.818 82.545 1.00 60.83 N ATOM 188 CA PRO A 579 29.342 24.545 83.219 1.00 49.63 C ATOM 189 C PRO A 579 30.812 24.152 83.130 1.00 50.89 C ATOM 190 O PRO A 579 31.350 23.482 83.989 1.00 55.13 O ATOM 191 CB PRO A 579 28.540 23.497 82.432 1.00 57.17 C ATOM 192 CG PRO A 579 27.867 24.195 81.262 1.00 44.62 C ATOM 193 CD PRO A 579 28.354 25.621 81.233 1.00 67.90 C ATOM 194 N SER A 580 31.473 24.533 82.058 1.00 56.48 N ATOM 195 CA SER A 580 32.875 24.138 81.911 1.00 60.55 C ATOM 196 C SER A 580 33.750 24.765 83.007 1.00 57.36 C ATOM 197 O SER A 580 34.871 24.332 83.224 1.00 59.27 O ATOM 198 CB SER A 580 33.387 24.543 80.529 1.00 50.83 C ATOM 199 OG SER A 580 33.618 25.937 80.481 1.00 52.70 O ATOM 200 HG SER A 580 32.772 26.417 80.667 1.00 0.00 H ATOM 201 H SER A 580 31.007 25.106 81.326 1.00 0.00 H ATOM 202 N LYS A 581 33.232 25.793 83.671 1.00 45.75 N ATOM 203 CA LYS A 581 34.052 26.616 84.525 1.00 52.13 C ATOM 204 C LYS A 581 33.773 26.251 85.985 1.00 54.84 C ATOM 205 O LYS A 581 34.319 26.840 86.908 1.00 59.10 O ATOM 206 CB LYS A 581 33.812 28.093 84.224 1.00 52.41 C ATOM 207 CG LYS A 581 34.409 28.493 82.909 1.00 55.42 C ATOM 208 CD LYS A 581 34.551 29.985 82.724 1.00 66.29 C ATOM 209 CE LYS A 581 35.284 30.252 81.412 1.00 77.04 C ATOM 210 NZ LYS A 581 36.371 29.237 81.175 1.00 80.64 N ATOM 211 HZ1 LYS A 581 37.059 29.280 81.953 1.00 0.00 H ATOM 212 HZ2 LYS A 581 35.952 28.286 81.133 1.00 0.00 H ATOM 213 HZ3 LYS A 581 36.849 29.447 80.276 1.00 0.00 H ATOM 214 H LYS A 581 32.219 26.007 83.573 1.00 0.00 H ATOM 215 N CYS A 582 32.924 25.243 86.142 1.00 52.83 N ATOM 216 CA CYS A 582 32.564 24.674 87.405 1.00 49.96 C ATOM 217 C CYS A 582 33.696 23.837 87.963 1.00 53.10 C ATOM 218 O CYS A 582 34.090 22.843 87.348 1.00 59.83 O ATOM 219 CB CYS A 582 31.333 23.777 87.231 1.00 51.35 C ATOM 220 SG CYS A 582 30.610 23.146 88.810 1.00 60.10 S ATOM 221 H CYS A 582 32.490 24.838 85.288 1.00 0.00 H ATOM 222 N ILE A 583 34.188 24.219 89.141 1.00 46.24 N ATOM 223 CA ILE A 583 35.198 23.450 89.843 1.00 43.08 C ATOM 224 C ILE A 583 34.553 22.695 91.003 1.00 47.57 C ATOM 225 O ILE A 583 33.821 23.280 91.811 1.00 50.89 O ATOM 226 CB ILE A 583 36.308 24.365 90.358 1.00 45.06 C ATOM 227 CG1 ILE A 583 37.042 24.983 89.180 1.00 52.21 C ATOM 228 CG2 ILE A 583 37.273 23.619 91.259 1.00 40.37 C ATOM 229 CD1 ILE A 583 38.004 26.064 89.621 1.00 64.26 C ATOM 230 H ILE A 583 33.836 25.098 89.572 1.00 0.00 H ATOM 231 N VAL A 584 34.830 21.396 91.075 1.00 45.76 N ATOM 232 CA VAL A 584 34.201 20.515 92.035 1.00 40.76 C ATOM 233 C VAL A 584 35.266 19.736 92.794 1.00 37.10 C ATOM 234 O VAL A 584 36.295 19.376 92.236 1.00 37.77 O ATOM 235 CB VAL A 584 33.225 19.541 91.341 1.00 42.23 C ATOM 236 CG1 VAL A 584 32.651 18.512 92.334 1.00 43.92 C ATOM 237 CG2 VAL A 584 32.104 20.309 90.729 1.00 45.42 C ATOM 238 H VAL A 584 35.527 20.997 90.414 1.00 0.00 H ATOM 239 N LYS A 585 35.021 19.513 94.083 1.00 36.58 N ATOM 240 CA LYS A 585 35.934 18.758 94.951 1.00 41.49 C ATOM 241 C LYS A 585 35.109 18.071 96.022 1.00 38.96 C ATOM 242 O LYS A 585 34.467 18.735 96.845 1.00 28.59 O ATOM 243 CB LYS A 585 36.960 19.672 95.610 1.00 42.05 C ATOM 244 CG LYS A 585 38.034 18.904 96.353 1.00 46.66 C ATOM 245 CD LYS A 585 38.641 19.738 97.456 1.00 53.45 C ATOM 246 CE LYS A 585 39.739 19.003 98.175 1.00 61.01 C ATOM 247 NZ LYS A 585 41.047 19.206 97.482 1.00 71.27 N ATOM 248 HZ1 LYS A 585 40.981 18.847 96.508 1.00 0.00 H ATOM 249 HZ2 LYS A 585 41.275 20.221 97.464 1.00 0.00 H ATOM 250 HZ3 LYS A 585 41.792 18.691 97.993 1.00 0.00 H ATOM 251 H LYS A 585 34.143 19.890 94.494 1.00 0.00 H ATOM 252 N ILE A 586 35.076 16.748 95.980 1.00 39.91 N ATOM 253 CA ILE A 586 34.320 15.999 96.968 1.00 36.13 C ATOM 254 C ILE A 586 35.276 15.222 97.855 1.00 33.78 C ATOM 255 O ILE A 586 36.224 14.566 97.369 1.00 27.21 O ATOM 256 CB ILE A 586 33.328 15.033 96.320 1.00 36.42 C ATOM 257 CG1 ILE A 586 32.387 15.808 95.394 1.00 33.62 C ATOM 258 CG2 ILE A 586 32.542 14.260 97.408 1.00 32.14 C ATOM 259 CD1 ILE A 586 31.685 14.957 94.364 1.00 26.35 C ATOM 260 H ILE A 586 35.595 16.242 95.234 1.00 0.00 H ATOM 261 N THR A 587 35.051 15.338 99.162 1.00 34.07 N ATOM 262 CA THR A 587 35.842 14.592 100.154 1.00 35.74 C ATOM 263 C THR A 587 34.906 13.786 101.023 1.00 34.44 C ATOM 264 O THR A 587 33.684 14.016 101.050 1.00 32.30 O ATOM 265 CB THR A 587 36.631 15.505 101.084 1.00 39.88 C ATOM 266 OG1 THR A 587 35.703 16.198 101.902 1.00 43.57 O ATOM 267 CG2 THR A 587 37.419 16.541 100.319 1.00 42.58 C ATOM 268 HG1 THR A 587 35.176 15.545 102.427 1.00 0.00 H ATOM 269 H THR A 587 34.296 15.973 99.491 1.00 0.00 H ATOM 270 N GLY A 588 35.472 12.844 101.754 1.00 38.02 N ATOM 271 CA GLY A 588 34.658 11.987 102.594 1.00 36.08 C ATOM 272 C GLY A 588 35.441 11.356 103.723 1.00 36.99 C ATOM 273 O GLY A 588 36.674 11.346 103.701 1.00 38.63 O ATOM 274 H GLY A 588 36.504 12.716 101.727 1.00 0.00 H ATOM 275 N GLU A 589 34.713 10.853 104.720 1.00 41.42 N ATOM 276 CA GLU A 589 35.280 10.049 105.799 1.00 40.66 C ATOM 277 C GLU A 589 34.480 8.758 105.884 1.00 32.66 C ATOM 278 O GLU A 589 33.248 8.772 105.761 1.00 32.22 O ATOM 279 CB GLU A 589 35.143 10.762 107.165 1.00 49.93 C ATOM 280 CG GLU A 589 36.196 11.810 107.549 1.00 68.01 C ATOM 281 CD GLU A 589 36.096 12.190 109.023 1.00 90.70 C ATOM 282 OE1 GLU A 589 36.958 12.964 109.514 1.00100.73 O ATOM 283 OE2 GLU A 589 35.147 11.700 109.695 1.00 94.29 O ATOM 284 H GLU A 589 33.690 11.043 104.730 1.00 0.00 H ATOM 285 N MET A 590 35.165 7.644 106.109 1.00 32.98 N ATOM 286 CA MET A 590 34.521 6.414 106.578 1.00 29.17 C ATOM 287 C MET A 590 34.834 6.220 108.090 1.00 44.76 C ATOM 288 O MET A 590 36.026 6.157 108.516 1.00 49.40 O ATOM 289 CB MET A 590 35.049 5.237 105.769 1.00 37.22 C ATOM 290 CG MET A 590 34.166 3.994 105.736 1.00 40.06 C ATOM 291 SD MET A 590 34.214 3.027 107.239 1.00 81.58 S ATOM 292 CE MET A 590 35.608 1.972 106.898 1.00 46.48 C ATOM 293 H MET A 590 36.192 7.644 105.947 1.00 0.00 H ATOM 294 N VAL A 591 33.759 6.105 108.875 1.00 40.23 N ATOM 295 CA VAL A 591 33.822 5.998 110.324 1.00 39.99 C ATOM 296 C VAL A 591 33.224 4.667 110.772 1.00 40.54 C ATOM 297 O VAL A 591 32.140 4.313 110.328 1.00 46.86 O ATOM 298 CB VAL A 591 33.006 7.141 110.992 1.00 46.38 C ATOM 299 CG1 VAL A 591 32.844 6.907 112.502 1.00 48.64 C ATOM 300 CG2 VAL A 591 33.661 8.498 110.749 1.00 42.60 C ATOM 301 H VAL A 591 32.822 6.091 108.423 1.00 0.00 H ATOM 302 N LEU A 592 33.921 3.924 111.629 1.00 36.60 N ATOM 303 CA LEU A 592 33.298 2.799 112.359 1.00 43.55 C ATOM 304 C LEU A 592 32.951 3.139 113.815 1.00 43.63 C ATOM 305 O LEU A 592 33.656 3.892 114.478 1.00 45.47 O ATOM 306 CB LEU A 592 34.202 1.571 112.400 1.00 41.99 C ATOM 307 CG LEU A 592 34.416 0.921 111.059 1.00 45.77 C ATOM 308 CD1 LEU A 592 35.407 -0.209 111.200 1.00 35.72 C ATOM 309 CD2 LEU A 592 33.087 0.430 110.562 1.00 48.75 C ATOM 310 H LEU A 592 34.926 4.140 111.789 1.00 0.00 H ATOM 311 N SER A 593 31.890 2.526 114.313 1.00 44.73 N ATOM 312 CA SER A 593 31.429 2.773 115.669 1.00 48.50 C ATOM 313 C SER A 593 31.258 1.454 116.437 1.00 50.58 C ATOM 314 O SER A 593 30.798 0.449 115.879 1.00 50.18 O ATOM 315 CB SER A 593 30.115 3.556 115.631 1.00 47.43 C ATOM 316 OG SER A 593 29.788 4.058 116.905 1.00 50.89 O ATOM 317 HG SER A 593 30.509 4.662 117.215 1.00 0.00 H ATOM 318 H SER A 593 31.371 1.849 113.718 1.00 0.00 H ATOM 319 N PHE A 594 31.629 1.467 117.716 1.00 50.53 N ATOM 320 CA PHE A 594 31.570 0.277 118.566 1.00 51.93 C ATOM 321 C PHE A 594 30.783 0.588 119.829 1.00 55.48 C ATOM 322 O PHE A 594 30.865 1.697 120.337 1.00 61.76 O ATOM 323 CB PHE A 594 32.990 -0.128 118.946 1.00 53.68 C ATOM 324 CG PHE A 594 33.869 -0.360 117.771 1.00 51.73 C ATOM 325 CD1 PHE A 594 33.984 -1.636 117.229 1.00 56.30 C ATOM 326 CD2 PHE A 594 34.556 0.694 117.175 1.00 48.81 C ATOM 327 CE1 PHE A 594 34.788 -1.869 116.111 1.00 55.55 C ATOM 328 CE2 PHE A 594 35.366 0.471 116.065 1.00 49.51 C ATOM 329 CZ PHE A 594 35.484 -0.814 115.530 1.00 53.66 C ATOM 330 H PHE A 594 31.974 2.358 118.127 1.00 0.00 H ATOM 331 N PRO A 595 30.021 -0.389 120.354 1.00 57.01 N ATOM 332 CA PRO A 595 29.236 -0.171 121.587 1.00 57.88 C ATOM 333 C PRO A 595 30.141 -0.302 122.796 1.00 62.77 C ATOM 334 O PRO A 595 31.113 -1.024 122.679 1.00 70.14 O ATOM 335 CB PRO A 595 28.245 -1.325 121.555 1.00 58.05 C ATOM 336 CG PRO A 595 28.997 -2.426 120.842 1.00 56.57 C ATOM 337 CD PRO A 595 29.780 -1.724 119.770 1.00 54.59 C ATOM 338 N ALA A 596 29.851 0.361 123.914 1.00 62.06 N ATOM 339 CA ALA A 596 30.664 0.225 125.139 1.00 66.36 C ATOM 340 C ALA A 596 31.061 -1.207 125.478 1.00 71.22 C ATOM 341 O ALA A 596 32.248 -1.481 125.751 1.00 78.30 O ATOM 342 CB ALA A 596 29.965 0.864 126.338 1.00 68.16 C ATOM 343 H ALA A 596 29.026 0.994 123.925 1.00 0.00 H ATOM 344 N GLY A 597 30.077 -2.110 125.445 1.00 69.56 N ATOM 345 CA GLY A 597 30.269 -3.496 125.849 1.00 69.32 C ATOM 346 C GLY A 597 31.601 -4.094 125.441 1.00 81.30 C ATOM 347 O GLY A 597 32.177 -4.903 126.186 1.00 77.36 O ATOM 348 H GLY A 597 29.136 -1.811 125.118 1.00 0.00 H ATOM 349 N ILE A 598 32.097 -3.642 124.278 1.00 80.03 N ATOM 350 CA ILE A 598 33.320 -4.149 123.653 1.00 78.12 C ATOM 351 C ILE A 598 34.499 -4.234 124.593 1.00 74.00 C ATOM 352 O ILE A 598 35.250 -5.206 124.543 1.00 73.80 O ATOM 353 CB ILE A 598 33.755 -3.308 122.432 1.00 85.86 C ATOM 354 CG1 ILE A 598 33.963 -1.839 122.808 1.00 92.88 C ATOM 355 CG2 ILE A 598 32.734 -3.397 121.342 1.00 86.31 C ATOM 356 CD1 ILE A 598 35.389 -1.445 123.108 1.00 97.73 C ATOM 357 H ILE A 598 31.579 -2.883 123.790 1.00 0.00 H ATOM 358 N THR A 599 34.666 -3.217 125.436 1.00 73.02 N ATOM 359 CA THR A 599 35.811 -3.196 126.325 1.00 77.42 C ATOM 360 C THR A 599 35.776 -4.494 127.092 1.00 74.87 C ATOM 361 O THR A 599 36.712 -5.292 126.963 1.00 75.43 O ATOM 362 CB THR A 599 35.798 -1.997 127.277 1.00 87.80 C ATOM 363 OG1 THR A 599 34.455 -1.745 127.722 1.00 93.49 O ATOM 364 CG2 THR A 599 36.340 -0.772 126.565 1.00 86.07 C ATOM 365 HG1 THR A 599 33.881 -1.549 126.940 1.00 0.00 H ATOM 366 H THR A 599 33.976 -2.439 125.457 1.00 0.00 H ATOM 367 N ARG A 600 34.658 -4.726 127.801 1.00 74.68 N ATOM 368 CA ARG A 600 34.426 -5.947 128.578 1.00 77.06 C ATOM 369 C ARG A 600 34.657 -7.161 127.709 1.00 87.96 C ATOM 370 O ARG A 600 35.359 -8.098 128.109 1.00 88.06 O ATOM 371 CB ARG A 600 32.994 -5.992 129.111 1.00 85.42 C ATOM 372 CG ARG A 600 32.646 -4.868 130.061 1.00 81.88 C ATOM 373 CD ARG A 600 31.297 -5.075 130.729 1.00 92.28 C ATOM 374 NE ARG A 600 31.185 -4.219 131.911 1.00103.18 N ATOM 375 CZ ARG A 600 30.217 -4.278 132.824 1.00112.34 C ATOM 376 NH1 ARG A 600 29.230 -5.163 132.724 1.00114.07 N ATOM 377 NH2 ARG A 600 30.246 -3.438 133.849 1.00118.20 N ATOM 378 HE ARG A 600 31.926 -3.502 132.050 1.00 0.00 H ATOM 379 HH12 ARG A 600 28.483 -5.193 133.447 1.00 0.00 H ATOM 380 HH11 ARG A 600 29.205 -5.825 131.922 1.00 0.00 H ATOM 381 HH22 ARG A 600 29.497 -3.472 134.570 1.00 0.00 H ATOM 382 HH21 ARG A 600 31.017 -2.745 133.932 1.00 0.00 H ATOM 383 H ARG A 600 33.915 -3.998 127.798 1.00 0.00 H ATOM 384 N HIS A 601 34.104 -7.109 126.495 1.00 86.33 N ATOM 385 CA HIS A 601 34.182 -8.221 125.559 1.00 72.26 C ATOM 386 C HIS A 601 35.630 -8.548 125.244 1.00 85.14 C ATOM 387 O HIS A 601 36.041 -9.717 125.250 1.00 74.02 O ATOM 388 CB HIS A 601 33.411 -7.897 124.277 1.00 79.43 C ATOM 389 CG HIS A 601 33.375 -9.030 123.307 1.00 87.02 C ATOM 390 ND1 HIS A 601 33.655 -8.875 121.963 1.00 86.74 N ATOM 391 CD2 HIS A 601 33.121 -10.351 123.490 1.00 97.48 C ATOM 392 CE1 HIS A 601 33.562 -10.047 121.363 1.00 92.64 C ATOM 393 NE2 HIS A 601 33.241 -10.962 122.267 1.00 98.04 N ATOM 394 H HIS A 601 33.601 -6.245 126.208 1.00 0.00 H ATOM 395 N PHE A 602 36.418 -7.501 125.021 1.00 69.21 N ATOM 396 CA PHE A 602 37.811 -7.692 124.663 1.00 71.57 C ATOM 397 C PHE A 602 38.644 -8.115 125.853 1.00 73.02 C ATOM 398 O PHE A 602 39.696 -8.725 125.692 1.00 82.79 O ATOM 399 CB PHE A 602 38.376 -6.441 124.013 1.00 71.57 C ATOM 400 CG PHE A 602 37.938 -6.265 122.592 1.00 75.50 C ATOM 401 CD1 PHE A 602 37.626 -7.380 121.811 1.00 78.11 C ATOM 402 CD2 PHE A 602 37.812 -4.994 122.034 1.00 79.84 C ATOM 403 CE1 PHE A 602 37.201 -7.234 120.484 1.00 74.77 C ATOM 404 CE2 PHE A 602 37.379 -4.827 120.691 1.00 78.02 C ATOM 405 CZ PHE A 602 37.077 -5.955 119.926 1.00 75.44 C ATOM 406 H PHE A 602 36.033 -6.538 125.104 1.00 0.00 H ATOM 407 N ALA A 603 38.153 -7.809 127.051 1.00 88.97 N ATOM 408 CA ALA A 603 38.805 -8.242 128.265 1.00 79.65 C ATOM 409 C ALA A 603 38.622 -9.738 128.320 1.00101.24 C ATOM 410 O ALA A 603 39.536 -10.473 128.714 1.00 85.18 O ATOM 411 CB ALA A 603 38.165 -7.580 129.454 1.00 81.87 C ATOM 412 H ALA A 603 37.281 -7.246 127.115 1.00 0.00 H ATOM 413 N ASN A 604 37.435 -10.187 127.906 1.00102.92 N ATOM 414 CA ASN A 604 37.117 -11.614 127.891 1.00107.92 C ATOM 415 C ASN A 604 38.141 -12.337 127.015 1.00109.08 C ATOM 416 O ASN A 604 38.747 -13.323 127.439 1.00111.83 O ATOM 417 CB ASN A 604 35.707 -11.829 127.328 1.00107.11 C ATOM 418 CG ASN A 604 34.774 -12.519 128.298 1.00108.63 C ATOM 419 OD1 ASN A 604 34.591 -13.732 128.230 1.00116.09 O ATOM 420 ND2 ASN A 604 34.155 -11.747 129.189 1.00104.07 N ATOM 421 HD22 ASN A 604 34.341 -10.724 129.209 1.00 0.00 H ATOM 422 HD21 ASN A 604 33.485 -12.167 129.865 1.00 0.00 H ATOM 423 H ASN A 604 36.718 -9.505 127.586 1.00 0.00 H ATOM 424 N ASN A 605 38.344 -11.806 125.807 1.00105.92 N ATOM 425 CA ASN A 605 39.214 -12.411 124.807 1.00106.57 C ATOM 426 C ASN A 605 40.364 -11.498 124.374 1.00106.26 C ATOM 427 O ASN A 605 40.135 -10.457 123.763 1.00100.72 O ATOM 428 CB ASN A 605 38.385 -12.791 123.576 1.00102.54 C ATOM 429 CG ASN A 605 38.826 -14.113 122.955 1.00104.79 C ATOM 430 OD1 ASN A 605 39.997 -14.509 123.043 1.00104.88 O ATOM 431 ND2 ASN A 605 37.882 -14.801 122.320 1.00104.89 N ATOM 432 HD22 ASN A 605 36.912 -14.430 122.271 1.00 0.00 H ATOM 433 HD21 ASN A 605 38.114 -15.710 121.872 1.00 0.00 H ATOM 434 H ASN A 605 37.858 -10.918 125.568 1.00 0.00 H ATOM 435 N PRO A 606 41.610 -11.900 124.675 1.00112.54 N ATOM 436 CA PRO A 606 42.798 -11.148 124.255 1.00113.19 C ATOM 437 C PRO A 606 43.242 -11.526 122.840 1.00110.78 C ATOM 438 O PRO A 606 44.229 -10.984 122.322 1.00111.53 O ATOM 439 CB PRO A 606 43.850 -11.605 125.265 1.00119.99 C ATOM 440 CG PRO A 606 43.489 -13.039 125.518 1.00123.32 C ATOM 441 CD PRO A 606 41.970 -13.082 125.483 1.00119.70 C ATOM 442 N SER A 607 42.514 -12.471 122.244 1.00106.92 N ATOM 443 CA SER A 607 42.702 -12.888 120.854 1.00 96.04 C ATOM 444 C SER A 607 41.352 -12.880 120.110 1.00 79.95 C ATOM 445 O SER A 607 40.865 -13.922 119.663 1.00 73.01 O ATOM 446 CB SER A 607 43.332 -14.290 120.813 1.00101.49 C ATOM 447 OG SER A 607 43.702 -14.669 119.495 1.00 99.72 O ATOM 448 HG SER A 607 42.899 -14.673 118.916 1.00 0.00 H ATOM 449 H SER A 607 41.769 -12.939 122.799 1.00 0.00 H ATOM 450 N PRO A 608 40.738 -11.696 119.968 1.00 71.07 N ATOM 451 CA PRO A 608 39.401 -11.649 119.345 1.00 72.93 C ATOM 452 C PRO A 608 39.387 -12.005 117.863 1.00 70.54 C ATOM 453 O PRO A 608 40.446 -12.138 117.250 1.00 70.99 O ATOM 454 CB PRO A 608 38.948 -10.199 119.552 1.00 59.46 C ATOM 455 CG PRO A 608 40.166 -9.437 119.874 1.00 58.35 C ATOM 456 CD PRO A 608 41.245 -10.359 120.330 1.00 62.60 C ATOM 457 N ALA A 609 38.192 -12.190 117.312 1.00 61.76 N ATOM 458 CA ALA A 609 38.051 -12.534 115.906 1.00 61.60 C ATOM 459 C ALA A 609 38.490 -11.336 115.095 1.00 58.71 C ATOM 460 O ALA A 609 38.202 -10.198 115.480 1.00 52.88 O ATOM 461 CB ALA A 609 36.615 -12.892 115.586 1.00 66.41 C ATOM 462 H ALA A 609 37.340 -12.087 117.899 1.00 0.00 H ATOM 463 N ALA A 610 39.189 -11.582 113.981 1.00 58.81 N ATOM 464 CA ALA A 610 39.713 -10.485 113.139 1.00 54.44 C ATOM 465 C ALA A 610 38.610 -9.570 112.594 1.00 48.58 C ATOM 466 O ALA A 610 37.677 -10.056 111.981 1.00 50.64 O ATOM 467 CB ALA A 610 40.538 -11.048 111.992 1.00 53.67 C ATOM 468 H ALA A 610 39.368 -12.567 113.701 1.00 0.00 H ATOM 469 N LEU A 611 38.707 -8.258 112.818 1.00 45.05 N ATOM 470 CA LEU A 611 37.801 -7.317 112.147 1.00 46.87 C ATOM 471 C LEU A 611 38.328 -7.046 110.732 1.00 52.62 C ATOM 472 O LEU A 611 39.318 -6.328 110.547 1.00 52.73 O ATOM 473 CB LEU A 611 37.701 -6.004 112.903 1.00 39.80 C ATOM 474 CG LEU A 611 36.408 -5.170 112.845 1.00 50.56 C ATOM 475 CD1 LEU A 611 36.654 -3.739 113.355 1.00 44.27 C ATOM 476 CD2 LEU A 611 35.718 -5.142 111.512 1.00 38.13 C ATOM 477 H LEU A 611 39.430 -7.899 113.473 1.00 0.00 H ATOM 478 N THR A 612 37.657 -7.616 109.740 1.00 54.22 N ATOM 479 CA THR A 612 38.065 -7.484 108.350 1.00 54.72 C ATOM 480 C THR A 612 36.893 -6.997 107.517 1.00 56.61 C ATOM 481 O THR A 612 35.815 -7.588 107.544 1.00 59.87 O ATOM 482 CB THR A 612 38.530 -8.831 107.779 1.00 46.37 C ATOM 483 OG1 THR A 612 37.737 -9.873 108.351 1.00 61.18 O ATOM 484 CG2 THR A 612 39.962 -9.087 108.151 1.00 47.35 C ATOM 485 HG1 THR A 612 36.785 -9.723 108.125 1.00 0.00 H ATOM 486 H THR A 612 36.810 -8.177 109.964 1.00 0.00 H ATOM 487 N PHE A 613 37.095 -5.938 106.745 1.00 58.42 N ATOM 488 CA PHE A 613 36.023 -5.515 105.829 1.00 56.52 C ATOM 489 C PHE A 613 36.469 -5.198 104.405 1.00 56.00 C ATOM 490 O PHE A 613 37.663 -5.104 104.118 1.00 53.41 O ATOM 491 CB PHE A 613 35.302 -4.305 106.387 1.00 51.49 C ATOM 492 CG PHE A 613 36.201 -3.130 106.615 1.00 50.43 C ATOM 493 CD1 PHE A 613 36.249 -2.093 105.703 1.00 45.51 C ATOM 494 CD2 PHE A 613 37.008 -3.067 107.739 1.00 51.08 C ATOM 495 CE1 PHE A 613 37.070 -1.008 105.911 1.00 46.13 C ATOM 496 CE2 PHE A 613 37.836 -1.992 107.952 1.00 51.29 C ATOM 497 CZ PHE A 613 37.872 -0.960 107.040 1.00 52.39 C ATOM 498 H PHE A 613 37.994 -5.416 106.786 1.00 0.00 H ATOM 499 N ARG A 614 35.493 -5.026 103.514 1.00 59.15 N ATOM 500 CA ARG A 614 35.755 -4.546 102.159 1.00 52.43 C ATOM 501 C ARG A 614 34.957 -3.275 101.834 1.00 50.23 C ATOM 502 O ARG A 614 33.780 -3.138 102.201 1.00 56.75 O ATOM 503 CB ARG A 614 35.491 -5.638 101.122 1.00 54.58 C ATOM 504 CG ARG A 614 34.020 -5.981 100.931 1.00 61.86 C ATOM 505 CD ARG A 614 33.771 -7.004 99.819 1.00 65.68 C ATOM 506 NE ARG A 614 33.912 -8.374 100.290 1.00 57.11 N ATOM 507 CZ ARG A 614 34.827 -9.208 99.826 1.00 94.29 C ATOM 508 NH1 ARG A 614 35.656 -8.803 98.870 1.00 99.32 N ATOM 509 NH2 ARG A 614 34.898 -10.446 100.293 1.00 95.64 N ATOM 510 HE ARG A 614 33.262 -8.713 101.027 1.00 0.00 H ATOM 511 HH12 ARG A 614 36.379 -9.452 98.499 1.00 0.00 H ATOM 512 HH11 ARG A 614 35.582 -7.837 98.493 1.00 0.00 H ATOM 513 HH22 ARG A 614 35.619 -11.100 99.926 1.00 0.00 H ATOM 514 HH21 ARG A 614 34.233 -10.764 101.027 1.00 0.00 H ATOM 515 H ARG A 614 34.514 -5.240 103.792 1.00 0.00 H ATOM 516 N VAL A 615 35.627 -2.333 101.179 1.00 44.33 N ATOM 517 CA VAL A 615 34.943 -1.223 100.522 1.00 45.99 C ATOM 518 C VAL A 615 34.642 -1.547 99.055 1.00 46.87 C ATOM 519 O VAL A 615 35.514 -2.035 98.304 1.00 48.48 O ATOM 520 CB VAL A 615 35.714 0.083 100.660 1.00 40.67 C ATOM 521 CG1 VAL A 615 34.879 1.217 100.175 1.00 38.72 C ATOM 522 CG2 VAL A 615 36.073 0.297 102.142 1.00 37.42 C ATOM 523 H VAL A 615 36.665 -2.388 101.133 1.00 0.00 H ATOM 524 N ILE A 616 33.373 -1.341 98.704 1.00 46.02 N ATOM 525 CA ILE A 616 32.833 -1.593 97.383 1.00 50.28 C ATOM 526 C ILE A 616 32.888 -0.259 96.644 1.00 53.79 C ATOM 527 O ILE A 616 32.833 0.795 97.282 1.00 56.51 O ATOM 528 CB ILE A 616 31.390 -2.143 97.509 1.00 57.94 C ATOM 529 CG1 ILE A 616 31.419 -3.655 97.710 1.00 63.13 C ATOM 530 CG2 ILE A 616 30.552 -1.863 96.302 1.00 59.69 C ATOM 531 CD1 ILE A 616 31.516 -4.066 99.150 1.00 66.07 C ATOM 532 H ILE A 616 32.724 -0.973 99.429 1.00 0.00 H ATOM 533 N ASN A 617 33.041 -0.296 95.319 1.00 56.14 N ATOM 534 CA ASN A 617 33.225 0.914 94.521 1.00 59.24 C ATOM 535 C ASN A 617 34.425 1.758 94.972 1.00 54.21 C ATOM 536 O ASN A 617 34.391 2.986 94.913 1.00 57.24 O ATOM 537 CB ASN A 617 31.941 1.742 94.483 1.00 56.29 C ATOM 538 CG ASN A 617 30.899 1.132 93.592 1.00 70.20 C ATOM 539 OD1 ASN A 617 31.229 0.514 92.584 1.00 73.37 O ATOM 540 ND2 ASN A 617 29.630 1.290 93.955 1.00 72.73 N ATOM 541 HD22 ASN A 617 29.398 1.822 94.818 1.00 0.00 H ATOM 542 HD21 ASN A 617 28.869 0.882 93.376 1.00 0.00 H ATOM 543 H ASN A 617 33.029 -1.218 94.838 1.00 0.00 H ATOM 544 N PHE A 618 35.485 1.087 95.404 1.00 51.46 N ATOM 545 CA PHE A 618 36.682 1.752 95.907 1.00 52.10 C ATOM 546 C PHE A 618 37.484 2.504 94.826 1.00 61.08 C ATOM 547 O PHE A 618 38.313 3.369 95.135 1.00 62.01 O ATOM 548 CB PHE A 618 37.574 0.708 96.551 1.00 47.36 C ATOM 549 CG PHE A 618 38.731 1.278 97.300 1.00 47.93 C ATOM 550 CD1 PHE A 618 38.538 1.905 98.527 1.00 45.08 C ATOM 551 CD2 PHE A 618 40.027 1.169 96.800 1.00 53.04 C ATOM 552 CE1 PHE A 618 39.625 2.431 99.244 1.00 44.40 C ATOM 553 CE2 PHE A 618 41.115 1.676 97.508 1.00 53.01 C ATOM 554 CZ PHE A 618 40.907 2.309 98.733 1.00 54.23 C ATOM 555 H PHE A 618 35.462 0.047 95.383 1.00 0.00 H ATOM 556 N SER A 619 37.258 2.163 93.562 1.00 59.37 N ATOM 557 CA SER A 619 38.010 2.784 92.498 1.00 59.67 C ATOM 558 C SER A 619 37.509 4.201 92.230 1.00 60.28 C ATOM 559 O SER A 619 38.184 4.999 91.573 1.00 59.79 O ATOM 560 CB SER A 619 37.908 1.934 91.240 1.00 73.31 C ATOM 561 OG SER A 619 36.568 1.872 90.771 1.00 79.61 O ATOM 562 HG SER A 619 35.993 1.473 91.471 1.00 0.00 H ATOM 563 H SER A 619 36.538 1.447 93.339 1.00 0.00 H ATOM 564 N ARG A 620 36.316 4.508 92.738 1.00 63.00 N ATOM 565 CA ARG A 620 35.735 5.850 92.634 1.00 56.89 C ATOM 566 C ARG A 620 36.438 6.849 93.588 1.00 55.95 C ATOM 567 O ARG A 620 36.133 8.046 93.593 1.00 54.45 O ATOM 568 CB ARG A 620 34.220 5.800 92.885 1.00 62.96 C ATOM 569 CG ARG A 620 33.430 4.877 91.917 1.00 85.15 C ATOM 570 CD ARG A 620 31.977 5.334 91.673 1.00 90.09 C ATOM 571 NE ARG A 620 31.164 4.264 91.085 1.00101.26 N ATOM 572 CZ ARG A 620 29.882 4.369 90.712 1.00109.32 C ATOM 573 NH1 ARG A 620 29.211 5.510 90.853 1.00113.04 N ATOM 574 NH2 ARG A 620 29.260 3.319 90.186 1.00110.87 N ATOM 575 HE ARG A 620 31.624 3.342 90.945 1.00 0.00 H ATOM 576 HH12 ARG A 620 28.216 5.568 90.556 1.00 0.00 H ATOM 577 HH11 ARG A 620 29.682 6.343 91.260 1.00 0.00 H ATOM 578 HH22 ARG A 620 28.265 3.396 89.895 1.00 0.00 H ATOM 579 HH21 ARG A 620 29.769 2.420 90.065 1.00 0.00 H ATOM 580 H ARG A 620 35.776 3.766 93.228 1.00 0.00 H ATOM 581 N LEU A 621 37.406 6.349 94.354 1.00 50.66 N ATOM 582 CA LEU A 621 38.142 7.180 95.299 1.00 50.66 C ATOM 583 C LEU A 621 39.590 7.428 94.885 1.00 50.85 C ATOM 584 O LEU A 621 40.334 6.492 94.586 1.00 51.47 O ATOM 585 CB LEU A 621 38.119 6.581 96.714 1.00 44.04 C ATOM 586 CG LEU A 621 36.791 6.001 97.221 1.00 52.71 C ATOM 587 CD1 LEU A 621 36.930 5.513 98.691 1.00 39.38 C ATOM 588 CD2 LEU A 621 35.630 6.978 97.074 1.00 44.38 C ATOM 589 H LEU A 621 37.643 5.339 94.276 1.00 0.00 H ATOM 590 N GLU A 622 39.977 8.701 94.866 1.00 51.26 N ATOM 591 CA GLU A 622 41.382 9.073 94.838 1.00 52.87 C ATOM 592 C GLU A 622 41.841 9.515 96.255 1.00 57.25 C ATOM 593 O GLU A 622 41.008 9.739 97.144 1.00 58.82 O ATOM 594 CB GLU A 622 41.677 10.134 93.745 1.00 56.50 C ATOM 595 CG GLU A 622 40.592 11.200 93.445 1.00 58.09 C ATOM 596 CD GLU A 622 40.887 12.072 92.189 1.00 94.05 C ATOM 597 OE1 GLU A 622 41.571 11.615 91.237 1.00 96.22 O ATOM 598 OE2 GLU A 622 40.423 13.235 92.150 1.00 96.36 O ATOM 599 H GLU A 622 39.255 9.450 94.871 1.00 0.00 H ATOM 600 N HIS A 623 43.151 9.596 96.468 1.00 54.53 N ATOM 601 CA HIS A 623 43.687 10.365 97.577 1.00 61.61 C ATOM 602 C HIS A 623 43.271 9.738 98.912 1.00 64.32 C ATOM 603 O HIS A 623 42.906 10.455 99.855 1.00 66.76 O ATOM 604 CB HIS A 623 43.195 11.830 97.511 1.00 67.86 C ATOM 605 CG HIS A 623 43.774 12.649 96.380 1.00 81.78 C ATOM 606 ND1 HIS A 623 43.761 12.237 95.063 1.00 87.88 N ATOM 607 CD2 HIS A 623 44.349 13.878 96.376 1.00 89.19 C ATOM 608 CE1 HIS A 623 44.312 13.166 94.299 1.00 94.56 C ATOM 609 NE2 HIS A 623 44.680 14.171 95.071 1.00 97.13 N ATOM 610 H HIS A 623 43.804 9.099 95.829 1.00 0.00 H ATOM 611 N VAL A 624 43.317 8.406 98.984 1.00 56.04 N ATOM 612 CA VAL A 624 42.850 7.689 100.161 1.00 43.51 C ATOM 613 C VAL A 624 43.882 7.556 101.244 1.00 46.69 C ATOM 614 O VAL A 624 44.952 6.964 101.022 1.00 45.10 O ATOM 615 CB VAL A 624 42.430 6.261 99.861 1.00 38.94 C ATOM 616 CG1 VAL A 624 41.996 5.571 101.210 1.00 35.97 C ATOM 617 CG2 VAL A 624 41.326 6.240 98.822 1.00 40.04 C ATOM 618 H VAL A 624 43.696 7.867 98.179 1.00 0.00 H ATOM 619 N LEU A 625 43.538 8.072 102.432 1.00 51.02 N ATOM 620 CA LEU A 625 44.382 7.964 103.646 1.00 50.44 C ATOM 621 C LEU A 625 43.747 7.022 104.644 1.00 41.77 C ATOM 622 O LEU A 625 42.707 7.331 105.210 1.00 39.77 O ATOM 623 CB LEU A 625 44.518 9.316 104.318 1.00 38.10 C ATOM 624 CG LEU A 625 45.274 10.318 103.505 1.00 41.34 C ATOM 625 CD1 LEU A 625 44.844 11.671 103.948 1.00 45.66 C ATOM 626 CD2 LEU A 625 46.737 10.094 103.757 1.00 49.98 C ATOM 627 H LEU A 625 42.631 8.575 102.506 1.00 0.00 H ATOM 628 N PRO A 626 44.344 5.855 104.835 1.00 39.22 N ATOM 629 CA PRO A 626 43.869 4.971 105.904 1.00 42.31 C ATOM 630 C PRO A 626 44.448 5.340 107.271 1.00 40.42 C ATOM 631 O PRO A 626 45.603 5.797 107.357 1.00 41.36 O ATOM 632 CB PRO A 626 44.368 3.588 105.471 1.00 45.18 C ATOM 633 CG PRO A 626 45.511 3.873 104.498 1.00 44.88 C ATOM 634 CD PRO A 626 45.310 5.217 103.926 1.00 38.10 C ATOM 635 N ASN A 627 43.636 5.149 108.312 1.00 37.17 N ATOM 636 CA ASN A 627 44.077 5.335 109.686 1.00 37.16 C ATOM 637 C ASN A 627 45.372 4.645 109.949 1.00 34.51 C ATOM 638 O ASN A 627 45.444 3.416 109.898 1.00 35.80 O ATOM 639 CB ASN A 627 43.058 4.809 110.671 1.00 38.98 C ATOM 640 CG ASN A 627 43.371 5.238 112.096 1.00 39.24 C ATOM 641 OD1 ASN A 627 44.317 4.744 112.733 1.00 44.99 O ATOM 642 ND2 ASN A 627 42.586 6.157 112.600 1.00 33.26 N ATOM 643 HD22 ASN A 627 41.806 6.543 112.031 1.00 0.00 H ATOM 644 HD21 ASN A 627 42.743 6.501 113.569 1.00 0.00 H ATOM 645 H ASN A 627 42.654 4.857 108.135 1.00 0.00 H ATOM 646 N PRO A 628 46.398 5.435 110.264 1.00 37.79 N ATOM 647 CA PRO A 628 47.779 4.931 110.324 1.00 39.57 C ATOM 648 C PRO A 628 47.995 3.990 111.470 1.00 48.97 C ATOM 649 O PRO A 628 48.907 3.168 111.431 1.00 52.04 O ATOM 650 CB PRO A 628 48.620 6.193 110.513 1.00 42.29 C ATOM 651 CG PRO A 628 47.635 7.295 110.899 1.00 40.99 C ATOM 652 CD PRO A 628 46.281 6.895 110.430 1.00 37.58 C ATOM 653 N GLN A 629 47.177 4.113 112.504 1.00 48.52 N ATOM 654 CA GLN A 629 47.360 3.285 113.691 1.00 48.77 C ATOM 655 C GLN A 629 46.581 1.988 113.564 1.00 44.41 C ATOM 656 O GLN A 629 46.912 0.982 114.198 1.00 42.33 O ATOM 657 CB GLN A 629 46.936 4.045 114.946 1.00 41.55 C ATOM 658 CG GLN A 629 47.112 3.274 116.222 1.00 50.44 C ATOM 659 CD GLN A 629 48.551 3.273 116.773 1.00 60.10 C ATOM 660 OE1 GLN A 629 49.490 3.736 116.125 1.00 63.48 O ATOM 661 NE2 GLN A 629 48.715 2.749 117.984 1.00 67.57 N ATOM 662 HE22 GLN A 629 47.897 2.368 118.501 1.00 0.00 H ATOM 663 HE21 GLN A 629 49.661 2.721 118.415 1.00 0.00 H ATOM 664 H GLN A 629 46.400 4.803 112.470 1.00 0.00 H ATOM 665 N LEU A 630 45.561 2.002 112.715 1.00 37.75 N ATOM 666 CA LEU A 630 44.718 0.818 112.560 1.00 38.00 C ATOM 667 C LEU A 630 44.782 0.071 111.192 1.00 55.01 C ATOM 668 O LEU A 630 44.243 -1.034 111.100 1.00 53.58 O ATOM 669 CB LEU A 630 43.261 1.167 112.957 1.00 38.54 C ATOM 670 CG LEU A 630 43.046 1.921 114.285 1.00 47.56 C ATOM 671 CD1 LEU A 630 41.620 2.382 114.503 1.00 33.33 C ATOM 672 CD2 LEU A 630 43.512 1.104 115.494 1.00 53.42 C ATOM 673 H LEU A 630 45.361 2.858 112.159 1.00 0.00 H ATOM 674 N LEU A 631 45.446 0.636 110.161 1.00 54.28 N ATOM 675 CA LEU A 631 45.490 0.030 108.795 1.00 40.35 C ATOM 676 C LEU A 631 46.755 0.221 107.882 1.00 81.22 C ATOM 677 O LEU A 631 47.761 0.812 108.268 1.00 78.20 O ATOM 678 CB LEU A 631 44.267 0.508 108.032 1.00 36.55 C ATOM 679 CG LEU A 631 42.821 0.375 108.547 1.00 33.91 C ATOM 680 CD1 LEU A 631 41.862 1.267 107.717 1.00 30.44 C ATOM 681 CD2 LEU A 631 42.385 -1.058 108.470 1.00 32.67 C ATOM 682 H LEU A 631 45.949 1.532 110.324 1.00 0.00 H ATOM 683 N CYS A 632 46.654 -0.300 106.656 1.00 92.85 N ATOM 684 CA CYS A 632 47.602 -0.093 105.528 1.00 99.38 C ATOM 685 C CYS A 632 49.008 -0.595 105.714 1.00103.36 C ATOM 686 O CYS A 632 49.942 0.203 105.755 1.00108.04 O ATOM 687 CB CYS A 632 47.679 1.372 105.048 1.00103.38 C ATOM 688 SG CYS A 632 48.790 1.709 103.573 1.00109.65 S ATOM 689 H CYS A 632 45.832 -0.910 106.472 1.00 0.00 H ATOM 690 N CYS A 633 49.147 -1.911 105.792 1.00101.44 N ATOM 691 CA CYS A 633 50.446 -2.567 105.740 1.00 99.61 C ATOM 692 C CYS A 633 50.243 -4.029 106.000 1.00 95.47 C ATOM 693 O CYS A 633 49.970 -4.414 107.120 1.00 92.53 O ATOM 694 CB CYS A 633 51.443 -1.989 106.753 1.00100.50 C ATOM 695 SG CYS A 633 52.715 -0.891 105.965 1.00220.78 S ATOM 696 H CYS A 633 48.295 -2.498 105.894 1.00 0.00 H TER 697 CYS A 633 ATOM 698 N ASP A 639 44.312 -4.485 93.452 1.00122.93 N ATOM 699 CA ASP A 639 42.952 -4.947 93.217 1.00125.07 C ATOM 700 C ASP A 639 42.201 -3.843 92.500 1.00118.96 C ATOM 701 O ASP A 639 42.545 -2.666 92.639 1.00116.37 O ATOM 702 CB ASP A 639 42.263 -5.288 94.543 1.00125.62 C ATOM 703 CG ASP A 639 42.985 -6.387 95.315 1.00130.85 C ATOM 704 OD1 ASP A 639 43.465 -7.351 94.673 1.00136.35 O ATOM 705 OD2 ASP A 639 43.078 -6.281 96.561 1.00127.76 O ATOM 706 HN3 ASP A 639 44.289 -3.626 94.038 1.00 0.00 H ATOM 707 HN2 ASP A 639 44.767 -4.273 92.541 1.00 0.00 H ATOM 708 HN1 ASP A 639 44.849 -5.227 93.944 1.00 0.00 H ATOM 709 N ALA A 640 41.180 -4.206 91.734 1.00115.31 N ATOM 710 CA ALA A 640 40.510 -3.207 90.916 1.00111.59 C ATOM 711 C ALA A 640 39.464 -2.364 91.665 1.00102.29 C ATOM 712 O ALA A 640 39.748 -1.232 92.070 1.00 96.43 O ATOM 713 CB ALA A 640 39.927 -3.838 89.642 1.00113.50 C ATOM 714 H ALA A 640 40.862 -5.196 91.719 1.00 0.00 H ATOM 715 N ASN A 641 38.266 -2.912 91.853 1.00 95.62 N ATOM 716 CA ASN A 641 37.128 -2.091 92.262 1.00 84.52 C ATOM 717 C ASN A 641 36.610 -2.327 93.686 1.00 78.28 C ATOM 718 O ASN A 641 35.582 -1.788 94.095 1.00 74.71 O ATOM 719 CB ASN A 641 35.996 -2.221 91.246 1.00 85.92 C ATOM 720 CG ASN A 641 34.994 -1.097 91.358 1.00 87.24 C ATOM 721 OD1 ASN A 641 35.363 0.077 91.436 1.00 85.79 O ATOM 722 ND2 ASN A 641 33.720 -1.448 91.413 1.00 91.32 N ATOM 723 HD22 ASN A 641 33.453 -2.451 91.343 1.00 0.00 H ATOM 724 HD21 ASN A 641 32.985 -0.721 91.526 1.00 0.00 H ATOM 725 H ASN A 641 38.138 -3.934 91.708 1.00 0.00 H ATOM 726 N THR A 642 37.352 -3.127 94.436 1.00 76.41 N ATOM 727 CA THR A 642 37.051 -3.440 95.819 1.00 63.60 C ATOM 728 C THR A 642 38.386 -3.300 96.524 1.00 58.24 C ATOM 729 O THR A 642 39.418 -3.602 95.916 1.00 58.98 O ATOM 730 CB THR A 642 36.550 -4.900 95.932 1.00 68.69 C ATOM 731 OG1 THR A 642 35.135 -4.934 95.771 1.00 66.92 O ATOM 732 CG2 THR A 642 36.866 -5.516 97.282 1.00 76.91 C ATOM 733 HG1 THR A 642 34.818 -5.869 95.844 1.00 0.00 H ATOM 734 H THR A 642 38.198 -3.555 94.009 1.00 0.00 H ATOM 735 N LYS A 643 38.401 -2.829 97.772 1.00 51.46 N ATOM 736 CA LYS A 643 39.620 -2.990 98.568 1.00 49.36 C ATOM 737 C LYS A 643 39.312 -3.607 99.921 1.00 50.23 C ATOM 738 O LYS A 643 38.292 -3.284 100.534 1.00 52.49 O ATOM 739 CB LYS A 643 40.420 -1.680 98.750 1.00 50.73 C ATOM 740 CG LYS A 643 41.896 -1.942 99.140 1.00 55.15 C ATOM 741 CD LYS A 643 42.664 -0.709 99.579 1.00 55.54 C ATOM 742 CE LYS A 643 44.191 -0.919 99.498 1.00 68.03 C ATOM 743 NZ LYS A 643 44.755 -2.119 100.222 1.00 76.05 N ATOM 744 HZ1 LYS A 643 44.535 -2.046 101.236 1.00 0.00 H ATOM 745 HZ2 LYS A 643 44.331 -2.986 99.835 1.00 0.00 H ATOM 746 HZ3 LYS A 643 45.786 -2.148 100.091 1.00 0.00 H ATOM 747 H LYS A 643 37.565 -2.357 98.171 1.00 0.00 H ATOM 748 N GLU A 644 40.201 -4.476 100.397 1.00 49.85 N ATOM 749 CA GLU A 644 39.981 -5.158 101.661 1.00 47.34 C ATOM 750 C GLU A 644 40.975 -4.719 102.735 1.00 44.52 C ATOM 751 O GLU A 644 42.155 -4.410 102.440 1.00 48.33 O ATOM 752 CB GLU A 644 39.993 -6.673 101.460 1.00 62.31 C ATOM 753 CG GLU A 644 38.915 -7.149 100.514 1.00 73.78 C ATOM 754 CD GLU A 644 38.976 -8.629 100.265 1.00 95.59 C ATOM 755 OE1 GLU A 644 39.395 -9.370 101.185 1.00100.91 O ATOM 756 OE2 GLU A 644 38.615 -9.055 99.139 1.00108.87 O ATOM 757 H GLU A 644 41.067 -4.670 99.855 1.00 0.00 H ATOM 758 N PHE A 645 40.485 -4.674 103.975 1.00 41.40 N ATOM 759 CA PHE A 645 41.288 -4.249 105.109 1.00 43.24 C ATOM 760 C PHE A 645 41.187 -5.194 106.300 1.00 46.87 C ATOM 761 O PHE A 645 40.092 -5.658 106.671 1.00 46.88 O ATOM 762 CB PHE A 645 40.835 -2.876 105.574 1.00 38.93 C ATOM 763 CG PHE A 645 40.959 -1.811 104.548 1.00 40.53 C ATOM 764 CD1 PHE A 645 39.879 -1.492 103.737 1.00 45.65 C ATOM 765 CD2 PHE A 645 42.146 -1.094 104.412 1.00 42.14 C ATOM 766 CE1 PHE A 645 39.977 -0.471 102.778 1.00 44.94 C ATOM 767 CE2 PHE A 645 42.257 -0.064 103.472 1.00 41.99 C ATOM 768 CZ PHE A 645 41.175 0.249 102.655 1.00 43.17 C ATOM 769 H PHE A 645 39.496 -4.952 104.135 1.00 0.00 H ATOM 770 N TRP A 646 42.339 -5.442 106.915 1.00 53.41 N ATOM 771 CA TRP A 646 42.443 -6.157 108.188 1.00 41.48 C ATOM 772 C TRP A 646 42.813 -5.118 109.214 1.00 39.38 C ATOM 773 O TRP A 646 43.898 -4.538 109.141 1.00 43.44 O ATOM 774 CB TRP A 646 43.555 -7.185 108.083 1.00 45.40 C ATOM 775 CG TRP A 646 43.674 -8.171 109.198 1.00 47.84 C ATOM 776 CD1 TRP A 646 43.138 -8.078 110.463 1.00 46.78 C ATOM 777 CD2 TRP A 646 44.392 -9.413 109.160 1.00 52.57 C ATOM 778 NE1 TRP A 646 43.484 -9.191 111.193 1.00 50.49 N ATOM 779 CE2 TRP A 646 44.253 -10.018 110.423 1.00 54.07 C ATOM 780 CE3 TRP A 646 45.153 -10.059 108.189 1.00 56.29 C ATOM 781 CZ2 TRP A 646 44.830 -11.237 110.729 1.00 59.09 C ATOM 782 CZ3 TRP A 646 45.722 -11.291 108.497 1.00 61.42 C ATOM 783 CH2 TRP A 646 45.556 -11.864 109.751 1.00 62.73 C ATOM 784 HE1 TRP A 646 43.204 -9.375 112.178 1.00 0.00 H ATOM 785 H TRP A 646 43.216 -5.109 106.466 1.00 0.00 H ATOM 786 N VAL A 647 41.905 -4.885 110.164 1.00 41.71 N ATOM 787 CA VAL A 647 42.106 -3.926 111.249 1.00 41.71 C ATOM 788 C VAL A 647 43.109 -4.418 112.277 1.00 39.10 C ATOM 789 O VAL A 647 43.124 -5.596 112.604 1.00 53.22 O ATOM 790 CB VAL A 647 40.790 -3.628 111.987 1.00 39.23 C ATOM 791 CG1 VAL A 647 41.024 -2.589 113.091 1.00 37.02 C ATOM 792 CG2 VAL A 647 39.743 -3.123 111.020 1.00 36.77 C ATOM 793 H VAL A 647 41.009 -5.412 110.131 1.00 0.00 H ATOM 794 N ASN A 648 43.952 -3.522 112.782 1.00 41.79 N ATOM 795 CA ASN A 648 44.901 -3.875 113.821 1.00 44.19 C ATOM 796 C ASN A 648 44.188 -3.954 115.172 1.00 50.85 C ATOM 797 O ASN A 648 43.827 -2.924 115.769 1.00 50.84 O ATOM 798 CB ASN A 648 46.044 -2.864 113.857 1.00 42.42 C ATOM 799 CG ASN A 648 47.192 -3.330 114.709 1.00 53.42 C ATOM 800 OD1 ASN A 648 47.002 -3.720 115.861 1.00 57.93 O ATOM 801 ND2 ASN A 648 48.395 -3.337 114.136 1.00 57.24 N ATOM 802 HD22 ASN A 648 48.508 -2.998 113.159 1.00 0.00 H ATOM 803 HD21 ASN A 648 49.221 -3.682 114.665 1.00 0.00 H ATOM 804 H ASN A 648 43.930 -2.546 112.424 1.00 0.00 H ATOM 805 N MET A 649 43.996 -5.175 115.662 1.00 48.35 N ATOM 806 CA MET A 649 43.191 -5.373 116.846 1.00 54.32 C ATOM 807 C MET A 649 43.871 -4.899 118.126 1.00 55.89 C ATOM 808 O MET A 649 43.230 -4.263 118.945 1.00 59.46 O ATOM 809 CB MET A 649 42.693 -6.822 116.928 1.00 62.90 C ATOM 810 CG MET A 649 41.987 -7.279 115.622 1.00 90.69 C ATOM 811 SD MET A 649 40.441 -6.397 115.246 1.00 93.90 S ATOM 812 CE MET A 649 39.683 -6.387 116.913 1.00 52.03 C ATOM 813 H MET A 649 44.429 -5.994 115.189 1.00 0.00 H ATOM 814 N PRO A 650 45.173 -5.181 118.303 1.00 54.43 N ATOM 815 CA PRO A 650 45.776 -4.614 119.519 1.00 56.08 C ATOM 816 C PRO A 650 45.736 -3.069 119.603 1.00 53.65 C ATOM 817 O PRO A 650 45.501 -2.519 120.685 1.00 56.42 O ATOM 818 CB PRO A 650 47.219 -5.140 119.471 1.00 54.98 C ATOM 819 CG PRO A 650 47.116 -6.437 118.734 1.00 51.64 C ATOM 820 CD PRO A 650 46.045 -6.200 117.683 1.00 55.09 C ATOM 821 N ASN A 651 45.941 -2.370 118.498 1.00 47.34 N ATOM 822 CA ASN A 651 45.862 -0.926 118.562 1.00 47.01 C ATOM 823 C ASN A 651 44.401 -0.442 118.756 1.00 58.93 C ATOM 824 O ASN A 651 44.160 0.622 119.328 1.00 62.24 O ATOM 825 CB ASN A 651 46.475 -0.295 117.329 1.00 43.87 C ATOM 826 CG ASN A 651 47.963 -0.578 117.163 1.00 44.54 C ATOM 827 OD1 ASN A 651 48.652 -1.022 118.070 1.00 47.67 O ATOM 828 ND2 ASN A 651 48.475 -0.273 115.963 1.00 41.91 N ATOM 829 HD22 ASN A 651 47.858 0.103 115.215 1.00 0.00 H ATOM 830 HD21 ASN A 651 49.489 -0.412 115.780 1.00 0.00 H ATOM 831 H ASN A 651 46.155 -2.849 117.600 1.00 0.00 H ATOM 832 N LEU A 652 43.430 -1.218 118.277 1.00 50.45 N ATOM 833 CA LEU A 652 42.023 -0.836 118.399 1.00 48.84 C ATOM 834 C LEU A 652 41.557 -1.064 119.819 1.00 53.09 C ATOM 835 O LEU A 652 40.874 -0.229 120.412 1.00 56.34 O ATOM 836 CB LEU A 652 41.136 -1.647 117.445 1.00 43.23 C ATOM 837 CG LEU A 652 39.617 -1.402 117.568 1.00 53.56 C ATOM 838 CD1 LEU A 652 39.208 -0.013 117.063 1.00 46.18 C ATOM 839 CD2 LEU A 652 38.756 -2.497 116.925 1.00 43.04 C ATOM 840 H LEU A 652 43.677 -2.112 117.807 1.00 0.00 H ATOM 841 N MET A 653 41.908 -2.220 120.352 1.00 55.82 N ATOM 842 CA MET A 653 41.603 -2.534 121.736 1.00 63.30 C ATOM 843 C MET A 653 42.226 -1.460 122.639 1.00 66.63 C ATOM 844 O MET A 653 41.520 -0.811 123.387 1.00 77.17 O ATOM 845 CB MET A 653 42.086 -3.938 122.088 1.00 64.46 C ATOM 846 CG MET A 653 41.354 -5.049 121.329 1.00 64.82 C ATOM 847 SD MET A 653 41.780 -6.758 121.829 1.00 88.60 S ATOM 848 CE MET A 653 43.573 -6.777 121.675 1.00 73.13 C ATOM 849 H MET A 653 42.412 -2.918 119.769 1.00 0.00 H ATOM 850 N THR A 654 43.531 -1.247 122.530 1.00 62.73 N ATOM 851 CA THR A 654 44.170 -0.118 123.200 1.00 63.04 C ATOM 852 C THR A 654 43.397 1.205 123.101 1.00 65.03 C ATOM 853 O THR A 654 42.987 1.775 124.128 1.00 70.80 O ATOM 854 CB THR A 654 45.593 0.083 122.674 1.00 59.75 C ATOM 855 OG1 THR A 654 46.354 -1.084 122.981 1.00 61.54 O ATOM 856 CG2 THR A 654 46.254 1.275 123.341 1.00 62.50 C ATOM 857 HG1 THR A 654 45.939 -1.871 122.546 1.00 0.00 H ATOM 858 H THR A 654 44.109 -1.895 121.958 1.00 0.00 H ATOM 859 N HIS A 655 43.207 1.688 121.876 1.00 56.01 N ATOM 860 CA HIS A 655 42.478 2.929 121.637 1.00 55.27 C ATOM 861 C HIS A 655 41.143 2.976 122.379 1.00 61.00 C ATOM 862 O HIS A 655 40.847 3.932 123.108 1.00 60.44 O ATOM 863 CB HIS A 655 42.202 3.085 120.159 1.00 50.61 C ATOM 864 CG HIS A 655 41.452 4.336 119.830 1.00 62.63 C ATOM 865 ND1 HIS A 655 42.029 5.584 119.907 1.00 67.42 N ATOM 866 CD2 HIS A 655 40.163 4.529 119.453 1.00 56.00 C ATOM 867 CE1 HIS A 655 41.128 6.500 119.579 1.00 65.27 C ATOM 868 NE2 HIS A 655 39.989 5.886 119.308 1.00 58.92 N ATOM 869 H HIS A 655 43.590 1.164 121.063 1.00 0.00 H ATOM 870 N LEU A 656 40.339 1.932 122.201 1.00 60.80 N ATOM 871 CA LEU A 656 38.997 1.876 122.778 1.00 59.22 C ATOM 872 C LEU A 656 39.007 1.810 124.313 1.00 71.60 C ATOM 873 O LEU A 656 38.126 2.378 124.990 1.00 75.84 O ATOM 874 CB LEU A 656 38.214 0.702 122.191 1.00 57.61 C ATOM 875 CG LEU A 656 37.745 0.870 120.745 1.00 58.66 C ATOM 876 CD1 LEU A 656 37.105 -0.404 120.221 1.00 55.79 C ATOM 877 CD2 LEU A 656 36.777 2.027 120.647 1.00 61.76 C ATOM 878 H LEU A 656 40.676 1.129 121.633 1.00 0.00 H ATOM 879 N LYS A 657 39.996 1.126 124.875 1.00 71.51 N ATOM 880 CA LYS A 657 40.193 1.192 126.316 1.00 82.12 C ATOM 881 C LYS A 657 40.420 2.645 126.757 1.00 85.64 C ATOM 882 O LYS A 657 39.729 3.133 127.652 1.00 90.08 O ATOM 883 CB LYS A 657 41.353 0.301 126.764 1.00 82.23 C ATOM 884 CG LYS A 657 40.970 -1.142 127.074 1.00 81.07 C ATOM 885 CD LYS A 657 42.073 -1.845 127.873 1.00 82.04 C ATOM 886 CE LYS A 657 42.429 -1.054 129.137 1.00 86.22 C ATOM 887 NZ LYS A 657 43.415 -1.732 130.042 1.00 90.86 N ATOM 888 HZ1 LYS A 657 43.025 -2.644 130.356 1.00 0.00 H ATOM 889 HZ2 LYS A 657 44.304 -1.893 129.526 1.00 0.00 H ATOM 890 HZ3 LYS A 657 43.597 -1.128 130.869 1.00 0.00 H ATOM 891 H LYS A 657 40.628 0.545 124.288 1.00 0.00 H ATOM 892 N LYS A 658 41.365 3.335 126.112 1.00 81.48 N ATOM 893 CA LYS A 658 41.682 4.717 126.489 1.00 81.70 C ATOM 894 C LYS A 658 40.464 5.643 126.454 1.00 83.32 C ATOM 895 O LYS A 658 40.177 6.373 127.432 1.00 88.53 O ATOM 896 CB LYS A 658 42.800 5.281 125.611 1.00 79.20 C ATOM 897 CG LYS A 658 43.684 6.302 126.329 1.00 88.21 C ATOM 898 CD LYS A 658 44.955 6.577 125.531 1.00 90.80 C ATOM 899 CE LYS A 658 45.620 5.274 125.071 1.00 90.09 C ATOM 900 NZ LYS A 658 46.300 4.527 126.180 1.00 90.91 N ATOM 901 HZ1 LYS A 658 47.041 5.126 126.596 1.00 0.00 H ATOM 902 HZ2 LYS A 658 45.601 4.281 126.910 1.00 0.00 H ATOM 903 HZ3 LYS A 658 46.727 3.658 125.800 1.00 0.00 H ATOM 904 H LYS A 658 41.884 2.886 125.331 1.00 0.00 H ATOM 905 N VAL A 659 39.747 5.631 125.331 1.00 80.33 N ATOM 906 CA VAL A 659 38.556 6.482 125.261 1.00 84.15 C ATOM 907 C VAL A 659 37.515 6.084 126.312 1.00 90.13 C ATOM 908 O VAL A 659 36.955 6.956 126.976 1.00 97.12 O ATOM 909 CB VAL A 659 37.940 6.607 123.837 1.00 64.97 C ATOM 910 CG1 VAL A 659 38.961 7.167 122.880 1.00 72.63 C ATOM 911 CG2 VAL A 659 37.420 5.284 123.327 1.00 62.61 C ATOM 912 H VAL A 659 40.025 5.034 124.526 1.00 0.00 H ATOM 913 N SER A 660 37.289 4.784 126.502 1.00 88.07 N ATOM 914 CA SER A 660 36.294 4.356 127.493 1.00 91.62 C ATOM 915 C SER A 660 36.632 4.867 128.909 1.00 96.56 C ATOM 916 O SER A 660 35.764 5.391 129.601 1.00101.77 O ATOM 917 CB SER A 660 36.068 2.834 127.467 1.00 91.46 C ATOM 918 OG SER A 660 37.113 2.132 128.123 1.00 96.29 O ATOM 919 HG SER A 660 37.973 2.326 127.672 1.00 0.00 H ATOM 920 H SER A 660 37.815 4.076 125.951 1.00 0.00 H ATOM 921 N GLU A 661 37.893 4.732 129.317 1.00 86.05 N ATOM 922 CA GLU A 661 38.382 5.315 130.569 1.00 91.87 C ATOM 923 C GLU A 661 38.232 6.839 130.671 1.00101.09 C ATOM 924 O GLU A 661 37.988 7.363 131.768 1.00106.72 O ATOM 925 CB GLU A 661 39.836 4.914 130.819 1.00 98.36 C ATOM 926 CG GLU A 661 40.017 3.433 131.093 1.00102.87 C ATOM 927 CD GLU A 661 41.464 2.974 130.992 1.00108.19 C ATOM 928 OE1 GLU A 661 42.284 3.672 130.353 1.00107.98 O ATOM 929 OE2 GLU A 661 41.779 1.899 131.546 1.00111.07 O ATOM 930 H GLU A 661 38.555 4.192 128.724 1.00 0.00 H ATOM 931 N GLN A 662 38.376 7.564 129.561 1.00 96.82 N ATOM 932 CA GLN A 662 38.173 9.018 129.655 1.00 99.96 C ATOM 933 C GLN A 662 36.697 9.427 129.461 1.00102.20 C ATOM 934 O GLN A 662 36.221 10.412 130.048 1.00 94.30 O ATOM 935 CB GLN A 662 39.152 9.807 128.760 1.00 93.01 C ATOM 936 CG GLN A 662 39.307 11.320 129.107 1.00103.14 C ATOM 937 CD GLN A 662 39.957 11.626 130.485 1.00110.33 C ATOM 938 OE1 GLN A 662 40.354 10.727 131.230 1.00109.78 O ATOM 939 NE2 GLN A 662 40.063 12.914 130.809 1.00113.83 N ATOM 940 HE22 GLN A 662 39.717 13.645 130.155 1.00 0.00 H ATOM 941 HE21 GLN A 662 40.492 13.188 131.716 1.00 0.00 H ATOM 942 H GLN A 662 38.624 7.115 128.656 1.00 0.00 H ATOM 943 N LYS A 663 35.962 8.642 128.681 1.00 86.58 N ATOM 944 CA LYS A 663 34.537 8.896 128.493 1.00 96.74 C ATOM 945 C LYS A 663 33.703 7.717 128.979 1.00 97.32 C ATOM 946 O LYS A 663 33.249 6.900 128.178 1.00 94.12 O ATOM 947 CB LYS A 663 34.226 9.208 127.021 1.00 90.90 C ATOM 948 CG LYS A 663 34.222 10.695 126.664 1.00 92.75 C ATOM 949 CD LYS A 663 33.353 11.496 127.660 1.00106.53 C ATOM 950 CE LYS A 663 31.890 11.027 127.686 1.00107.13 C ATOM 951 NZ LYS A 663 31.126 11.617 128.814 1.00110.85 N ATOM 952 HZ1 LYS A 663 31.569 11.340 129.713 1.00 0.00 H ATOM 953 HZ2 LYS A 663 31.130 12.654 128.729 1.00 0.00 H ATOM 954 HZ3 LYS A 663 30.146 11.269 128.787 1.00 0.00 H ATOM 955 H LYS A 663 36.408 7.836 128.198 1.00 0.00 H ATOM 956 N PRO A 664 33.493 7.628 130.301 1.00102.85 N ATOM 957 CA PRO A 664 32.974 6.398 130.905 1.00 97.34 C ATOM 958 C PRO A 664 31.479 6.284 130.738 1.00108.99 C ATOM 959 O PRO A 664 30.914 5.193 130.884 1.00 99.13 O ATOM 960 CB PRO A 664 33.314 6.566 132.387 1.00104.22 C ATOM 961 CG PRO A 664 34.248 7.743 132.457 1.00117.89 C ATOM 962 CD PRO A 664 33.849 8.617 131.327 1.00112.20 C ATOM 963 N GLN A 665 30.844 7.409 130.432 1.00 98.11 N ATOM 964 CA GLN A 665 29.395 7.427 130.313 1.00 99.57 C ATOM 965 C GLN A 665 29.035 7.386 128.842 1.00 93.60 C ATOM 966 O GLN A 665 27.879 7.544 128.468 1.00 93.97 O ATOM 967 CB GLN A 665 28.777 8.643 131.025 1.00104.58 C ATOM 968 CG GLN A 665 29.143 8.767 132.521 1.00111.24 C ATOM 969 CD GLN A 665 28.640 7.607 133.380 1.00117.82 C ATOM 970 OE1 GLN A 665 27.434 7.360 133.475 1.00121.28 O ATOM 971 NE2 GLN A 665 29.567 6.901 134.027 1.00118.35 N ATOM 972 HE22 GLN A 665 30.573 7.142 133.920 1.00 0.00 H ATOM 973 HE21 GLN A 665 29.284 6.109 134.639 1.00 0.00 H ATOM 974 H GLN A 665 31.386 8.283 130.276 1.00 0.00 H ATOM 975 N ALA A 666 30.030 7.149 128.004 1.00 88.45 N ATOM 976 CA ALA A 666 29.754 7.028 126.576 1.00 83.00 C ATOM 977 C ALA A 666 29.150 5.665 126.261 1.00 83.65 C ATOM 978 O ALA A 666 29.592 4.626 126.769 1.00 83.06 O ATOM 979 CB ALA A 666 31.012 7.298 125.715 1.00 78.10 C ATOM 980 H ALA A 666 31.002 7.050 128.360 1.00 0.00 H ATOM 981 N THR A 667 28.133 5.686 125.412 1.00 82.69 N ATOM 982 CA THR A 667 27.388 4.487 125.083 1.00 86.12 C ATOM 983 C THR A 667 27.935 3.816 123.828 1.00 78.25 C ATOM 984 O THR A 667 27.670 2.630 123.577 1.00 74.90 O ATOM 985 CB THR A 667 25.903 4.826 124.901 1.00 93.70 C ATOM 986 OG1 THR A 667 25.348 3.986 123.888 1.00 94.23 O ATOM 987 CG2 THR A 667 25.738 6.285 124.474 1.00 91.70 C ATOM 988 HG1 THR A 667 24.390 4.203 123.769 1.00 0.00 H ATOM 989 H THR A 667 27.862 6.587 124.970 1.00 0.00 H ATOM 990 N TYR A 668 28.714 4.588 123.063 1.00 75.83 N ATOM 991 CA TYR A 668 29.366 4.131 121.832 1.00 65.65 C ATOM 992 C TYR A 668 30.597 4.991 121.524 1.00 66.31 C ATOM 993 O TYR A 668 30.684 6.154 121.932 1.00 67.12 O ATOM 994 CB TYR A 668 28.388 4.196 120.661 1.00 63.72 C ATOM 995 CG TYR A 668 27.922 5.607 120.327 1.00 79.01 C ATOM 996 CD1 TYR A 668 28.400 6.275 119.208 1.00 74.94 C ATOM 997 CD2 TYR A 668 27.012 6.271 121.144 1.00 86.07 C ATOM 998 CE1 TYR A 668 27.982 7.559 118.911 1.00 78.25 C ATOM 999 CE2 TYR A 668 26.590 7.554 120.857 1.00 88.53 C ATOM 1000 CZ TYR A 668 27.079 8.191 119.736 1.00 85.51 C ATOM 1001 OH TYR A 668 26.655 9.468 119.454 1.00 88.22 O ATOM 1002 HH TYR A 668 27.093 9.784 118.624 1.00 0.00 H ATOM 1003 H TYR A 668 28.867 5.573 123.359 1.00 0.00 H ATOM 1004 N TYR A 669 31.533 4.425 120.771 1.00 61.40 N ATOM 1005 CA TYR A 669 32.768 5.111 120.399 1.00 60.10 C ATOM 1006 C TYR A 669 32.956 5.121 118.902 1.00 52.40 C ATOM 1007 O TYR A 669 33.054 4.060 118.288 1.00 51.74 O ATOM 1008 CB TYR A 669 33.960 4.407 121.049 1.00 62.09 C ATOM 1009 CG TYR A 669 33.716 4.125 122.517 1.00 70.70 C ATOM 1010 CD1 TYR A 669 33.804 5.137 123.471 1.00 71.70 C ATOM 1011 CD2 TYR A 669 33.377 2.853 122.951 1.00 73.77 C ATOM 1012 CE1 TYR A 669 33.570 4.880 124.810 1.00 77.04 C ATOM 1013 CE2 TYR A 669 33.143 2.586 124.291 1.00 76.60 C ATOM 1014 CZ TYR A 669 33.239 3.600 125.219 1.00 83.69 C ATOM 1015 OH TYR A 669 33.001 3.326 126.563 1.00 93.18 O ATOM 1016 HH TYR A 669 33.110 4.156 127.092 1.00 0.00 H ATOM 1017 H TYR A 669 31.381 3.454 120.432 1.00 0.00 H ATOM 1018 N ASN A 670 33.000 6.319 118.313 1.00 51.41 N ATOM 1019 CA ASN A 670 33.311 6.479 116.881 1.00 47.61 C ATOM 1020 C ASN A 670 34.829 6.447 116.668 1.00 45.61 C ATOM 1021 O ASN A 670 35.587 6.932 117.494 1.00 53.09 O ATOM 1022 CB ASN A 670 32.737 7.795 116.321 1.00 47.94 C ATOM 1023 CG ASN A 670 31.207 7.806 116.225 1.00 55.41 C ATOM 1024 OD1 ASN A 670 30.562 6.764 116.186 1.00 53.03 O ATOM 1025 ND2 ASN A 670 30.627 9.007 116.172 1.00 51.41 N ATOM 1026 HD22 ASN A 670 31.210 9.868 116.208 1.00 0.00 H ATOM 1027 HD21 ASN A 670 29.593 9.082 116.095 1.00 0.00 H ATOM 1028 H ASN A 670 32.808 7.167 118.884 1.00 0.00 H ATOM 1029 N VAL A 671 35.284 5.861 115.565 1.00 42.34 N ATOM 1030 CA VAL A 671 36.704 5.928 115.205 1.00 44.60 C ATOM 1031 C VAL A 671 36.891 6.181 113.686 1.00 49.83 C ATOM 1032 O VAL A 671 36.235 5.535 112.863 1.00 47.70 O ATOM 1033 CB VAL A 671 37.497 4.697 115.748 1.00 50.26 C ATOM 1034 CG1 VAL A 671 36.704 3.446 115.592 1.00 54.88 C ATOM 1035 CG2 VAL A 671 38.842 4.547 115.067 1.00 51.02 C ATOM 1036 H VAL A 671 34.623 5.347 114.948 1.00 0.00 H ATOM 1037 N ASP A 672 37.732 7.160 113.327 1.00 45.13 N ATOM 1038 CA ASP A 672 38.013 7.473 111.912 1.00 44.61 C ATOM 1039 C ASP A 672 38.860 6.381 111.278 1.00 44.14 C ATOM 1040 O ASP A 672 39.971 6.109 111.738 1.00 42.31 O ATOM 1041 CB ASP A 672 38.782 8.788 111.751 1.00 47.34 C ATOM 1042 CG ASP A 672 37.933 10.017 112.029 1.00 57.79 C ATOM 1043 OD1 ASP A 672 36.682 9.899 112.136 1.00 57.38 O ATOM 1044 OD2 ASP A 672 38.545 11.117 112.115 1.00 62.25 O ATOM 1045 H ASP A 672 38.202 7.717 114.069 1.00 0.00 H ATOM 1046 N MET A 673 38.354 5.773 110.210 1.00 37.98 N ATOM 1047 CA MET A 673 39.052 4.664 109.578 1.00 33.94 C ATOM 1048 C MET A 673 39.699 5.062 108.253 1.00 40.12 C ATOM 1049 O MET A 673 40.853 4.677 107.953 1.00 32.98 O ATOM 1050 CB MET A 673 38.105 3.482 109.404 1.00 36.08 C ATOM 1051 CG MET A 673 37.751 2.772 110.768 1.00 49.94 C ATOM 1052 SD MET A 673 39.126 1.765 111.351 1.00 54.16 S ATOM 1053 CE MET A 673 38.446 1.127 112.865 1.00109.76 C ATOM 1054 H MET A 673 37.445 6.095 109.820 1.00 0.00 H ATOM 1055 N LEU A 674 38.973 5.863 107.472 1.00 42.61 N ATOM 1056 CA LEU A 674 39.470 6.222 106.144 1.00 32.91 C ATOM 1057 C LEU A 674 39.134 7.655 105.822 1.00 34.17 C ATOM 1058 O LEU A 674 37.975 8.060 105.957 1.00 34.93 O ATOM 1059 CB LEU A 674 38.775 5.350 105.116 1.00 34.90 C ATOM 1060 CG LEU A 674 39.410 4.224 104.285 1.00 37.03 C ATOM 1061 CD1 LEU A 674 40.765 3.769 104.757 1.00 38.03 C ATOM 1062 CD2 LEU A 674 38.462 3.060 104.269 1.00 37.14 C ATOM 1063 H LEU A 674 38.059 6.230 107.805 1.00 0.00 H ATOM 1064 N LYS A 675 40.115 8.439 105.386 1.00 30.29 N ATOM 1065 CA LYS A 675 39.788 9.756 104.816 1.00 34.80 C ATOM 1066 C LYS A 675 40.038 9.755 103.290 1.00 36.42 C ATOM 1067 O LYS A 675 41.043 9.218 102.805 1.00 38.88 O ATOM 1068 CB LYS A 675 40.576 10.864 105.515 1.00 37.85 C ATOM 1069 CG LYS A 675 40.250 11.048 106.977 1.00 43.31 C ATOM 1070 CD LYS A 675 41.317 11.857 107.719 1.00 47.88 C ATOM 1071 CE LYS A 675 41.021 11.906 109.220 1.00 47.02 C ATOM 1072 NZ LYS A 675 39.853 12.782 109.478 1.00 54.71 N ATOM 1073 HZ1 LYS A 675 40.060 13.743 109.138 1.00 0.00 H ATOM 1074 HZ2 LYS A 675 39.022 12.407 108.977 1.00 0.00 H ATOM 1075 HZ3 LYS A 675 39.660 12.809 110.500 1.00 0.00 H ATOM 1076 H LYS A 675 41.104 8.125 105.447 1.00 0.00 H ATOM 1077 N TYR A 676 39.141 10.336 102.513 1.00 37.79 N ATOM 1078 CA TYR A 676 39.323 10.220 101.063 1.00 39.37 C ATOM 1079 C TYR A 676 38.750 11.346 100.224 1.00 38.73 C ATOM 1080 O TYR A 676 38.076 12.255 100.734 1.00 36.41 O ATOM 1081 CB TYR A 676 38.743 8.901 100.573 1.00 38.26 C ATOM 1082 CG TYR A 676 37.289 8.765 100.902 1.00 35.56 C ATOM 1083 CD1 TYR A 676 36.324 9.413 100.149 1.00 40.03 C ATOM 1084 CD2 TYR A 676 36.878 8.021 101.993 1.00 34.28 C ATOM 1085 CE1 TYR A 676 34.983 9.310 100.460 1.00 37.66 C ATOM 1086 CE2 TYR A 676 35.541 7.901 102.313 1.00 33.36 C ATOM 1087 CZ TYR A 676 34.603 8.545 101.542 1.00 36.89 C ATOM 1088 OH TYR A 676 33.273 8.425 101.871 1.00 41.77 O ATOM 1089 HH TYR A 676 32.727 8.942 101.227 1.00 0.00 H ATOM 1090 H TYR A 676 38.335 10.856 102.915 1.00 0.00 H ATOM 1091 N GLN A 677 39.050 11.263 98.928 1.00 42.52 N ATOM 1092 CA GLN A 677 38.485 12.151 97.915 1.00 42.28 C ATOM 1093 C GLN A 677 37.663 11.286 96.991 1.00 42.43 C ATOM 1094 O GLN A 677 37.921 10.065 96.868 1.00 37.29 O ATOM 1095 CB GLN A 677 39.567 12.835 97.113 1.00 45.41 C ATOM 1096 CG GLN A 677 39.735 14.322 97.433 1.00 61.29 C ATOM 1097 CD GLN A 677 40.083 15.184 96.206 1.00 72.34 C ATOM 1098 OE1 GLN A 677 39.777 14.836 95.061 1.00 72.59 O ATOM 1099 NE2 GLN A 677 40.711 16.326 96.456 1.00 81.58 N ATOM 1100 HE22 GLN A 677 40.952 16.584 97.434 1.00 0.00 H ATOM 1101 HE21 GLN A 677 40.963 16.963 95.674 1.00 0.00 H ATOM 1102 H GLN A 677 39.720 10.529 98.622 1.00 0.00 H ATOM 1103 N VAL A 678 36.665 11.902 96.370 1.00 37.36 N ATOM 1104 CA VAL A 678 35.848 11.247 95.359 1.00 38.05 C ATOM 1105 C VAL A 678 36.052 11.883 93.989 1.00 40.74 C ATOM 1106 O VAL A 678 35.825 13.083 93.813 1.00 47.13 O ATOM 1107 CB VAL A 678 34.398 11.369 95.715 1.00 45.72 C ATOM 1108 CG1 VAL A 678 33.548 10.735 94.632 1.00 40.52 C ATOM 1109 CG2 VAL A 678 34.162 10.724 97.078 1.00 37.03 C ATOM 1110 H VAL A 678 36.459 12.891 96.615 1.00 0.00 H ATOM 1111 N SER A 679 36.523 11.088 93.029 1.00 66.69 N ATOM 1112 CA SER A 679 36.708 11.566 91.651 1.00 58.28 C ATOM 1113 C SER A 679 35.419 12.161 91.133 1.00 55.62 C ATOM 1114 O SER A 679 34.373 11.509 91.097 1.00 57.93 O ATOM 1115 CB SER A 679 37.161 10.441 90.780 1.00 60.97 C ATOM 1116 OG SER A 679 38.487 10.099 91.149 1.00 72.08 O ATOM 1117 HG SER A 679 38.804 9.353 90.581 1.00 0.00 H ATOM 1118 H SER A 679 36.766 10.104 93.261 1.00 0.00 H ATOM 1119 N ALA A 680 35.490 13.436 90.798 1.00 53.90 N ATOM 1120 CA ALA A 680 34.316 14.176 90.420 1.00 53.90 C ATOM 1121 C ALA A 680 34.565 14.723 89.033 1.00 67.83 C ATOM 1122 O ALA A 680 35.642 15.255 88.754 1.00 71.07 O ATOM 1123 CB ALA A 680 34.109 15.292 91.378 1.00 51.38 C ATOM 1124 H ALA A 680 36.413 13.915 90.808 1.00 0.00 H ATOM 1125 N GLN A 681 33.579 14.579 88.154 1.00 76.06 N ATOM 1126 CA GLN A 681 33.701 15.095 86.795 1.00 79.33 C ATOM 1127 C GLN A 681 32.721 16.247 86.579 1.00 74.45 C ATOM 1128 O GLN A 681 31.584 16.048 86.146 1.00 76.27 O ATOM 1129 CB GLN A 681 33.491 13.982 85.764 1.00 90.40 C ATOM 1130 CG GLN A 681 34.089 14.277 84.369 1.00101.11 C ATOM 1131 CD GLN A 681 35.586 14.603 84.407 1.00105.21 C ATOM 1132 OE1 GLN A 681 35.982 15.736 84.710 1.00105.24 O ATOM 1133 NE2 GLN A 681 36.421 13.609 84.096 1.00105.63 N ATOM 1134 HE22 GLN A 681 36.044 12.672 83.847 1.00 0.00 H ATOM 1135 HE21 GLN A 681 37.448 13.772 84.102 1.00 0.00 H ATOM 1136 H GLN A 681 32.706 14.091 88.439 1.00 0.00 H ATOM 1137 N GLY A 682 33.169 17.449 86.925 1.00 68.77 N ATOM 1138 CA GLY A 682 32.413 18.668 86.699 1.00 61.15 C ATOM 1139 C GLY A 682 31.005 18.743 87.247 1.00 58.03 C ATOM 1140 O GLY A 682 30.681 18.148 88.276 1.00 60.21 O ATOM 1141 H GLY A 682 34.103 17.520 87.378 1.00 0.00 H ATOM 1142 N ILE A 683 30.156 19.488 86.545 1.00 58.32 N ATOM 1143 CA ILE A 683 28.821 19.811 87.044 1.00 50.82 C ATOM 1144 C ILE A 683 27.949 18.551 87.185 1.00 48.89 C ATOM 1145 O ILE A 683 26.985 18.521 87.940 1.00 53.20 O ATOM 1146 CB ILE A 683 28.151 20.938 86.184 1.00 72.14 C ATOM 1147 CG1 ILE A 683 26.972 21.561 86.926 1.00 72.71 C ATOM 1148 CG2 ILE A 683 27.737 20.445 84.813 1.00 46.83 C ATOM 1149 CD1 ILE A 683 26.297 22.659 86.186 1.00 76.35 C ATOM 1150 H ILE A 683 30.450 19.851 85.616 1.00 0.00 H ATOM 1151 N GLN A 684 28.327 17.484 86.505 1.00 52.38 N ATOM 1152 CA GLN A 684 27.582 16.244 86.614 1.00 59.17 C ATOM 1153 C GLN A 684 27.668 15.639 88.022 1.00 57.71 C ATOM 1154 O GLN A 684 26.757 14.940 88.451 1.00 58.06 O ATOM 1155 CB GLN A 684 28.055 15.249 85.548 1.00 66.30 C ATOM 1156 CG GLN A 684 26.926 14.550 84.821 1.00 78.88 C ATOM 1157 CD GLN A 684 27.435 13.674 83.697 1.00 94.67 C ATOM 1158 OE1 GLN A 684 28.645 13.481 83.550 1.00100.23 O ATOM 1159 NE2 GLN A 684 26.516 13.146 82.886 1.00 99.05 N ATOM 1160 HE22 GLN A 684 25.507 13.337 83.050 1.00 0.00 H ATOM 1161 HE21 GLN A 684 26.809 12.544 82.090 1.00 0.00 H ATOM 1162 H GLN A 684 29.163 17.533 85.888 1.00 0.00 H ATOM 1163 N SER A 685 28.744 15.936 88.749 1.00 57.37 N ATOM 1164 CA SER A 685 28.970 15.339 90.061 1.00 47.55 C ATOM 1165 C SER A 685 28.352 16.155 91.180 1.00 45.60 C ATOM 1166 O SER A 685 28.520 15.875 92.361 1.00 53.20 O ATOM 1167 CB SER A 685 30.473 15.192 90.302 1.00 45.60 C ATOM 1168 OG SER A 685 31.020 14.282 89.374 1.00 48.04 O ATOM 1169 HG SER A 685 31.993 14.192 89.536 1.00 0.00 H ATOM 1170 H SER A 685 29.440 16.610 88.372 1.00 0.00 H ATOM 1171 N THR A 686 27.593 17.155 90.796 1.00 49.50 N ATOM 1172 CA THR A 686 27.124 18.207 91.693 1.00 44.99 C ATOM 1173 C THR A 686 25.608 18.008 91.962 1.00 41.27 C ATOM 1174 O THR A 686 24.805 17.890 91.041 1.00 48.51 O ATOM 1175 CB THR A 686 27.537 19.558 91.009 1.00 46.84 C ATOM 1176 OG1 THR A 686 28.476 20.260 91.820 1.00 49.92 O ATOM 1177 CG2 THR A 686 26.379 20.453 90.595 1.00 46.39 C ATOM 1178 HG1 THR A 686 28.726 21.108 91.375 1.00 0.00 H ATOM 1179 H THR A 686 27.310 17.200 89.796 1.00 0.00 H ATOM 1180 N PRO A 687 25.218 17.873 93.226 1.00 42.88 N ATOM 1181 CA PRO A 687 23.803 17.533 93.468 1.00 45.15 C ATOM 1182 C PRO A 687 22.794 18.667 93.263 1.00 43.09 C ATOM 1183 O PRO A 687 21.619 18.397 93.021 1.00 47.75 O ATOM 1184 CB PRO A 687 23.807 17.030 94.934 1.00 37.01 C ATOM 1185 CG PRO A 687 25.045 17.490 95.490 1.00 35.63 C ATOM 1186 CD PRO A 687 26.050 17.571 94.401 1.00 44.25 C ATOM 1187 N LEU A 688 23.254 19.906 93.353 1.00 39.89 N ATOM 1188 CA LEU A 688 22.408 21.066 93.106 1.00 38.96 C ATOM 1189 C LEU A 688 23.136 21.935 92.100 1.00 43.10 C ATOM 1190 O LEU A 688 24.003 22.718 92.487 1.00 49.26 O ATOM 1191 CB LEU A 688 22.240 21.884 94.381 1.00 39.78 C ATOM 1192 CG LEU A 688 20.882 22.467 94.797 1.00 43.25 C ATOM 1193 CD1 LEU A 688 21.061 23.719 95.654 1.00 41.63 C ATOM 1194 CD2 LEU A 688 19.975 22.747 93.628 1.00 39.38 C ATOM 1195 H LEU A 688 24.251 20.055 93.608 1.00 0.00 H ATOM 1196 N ASN A 689 22.816 21.780 90.820 1.00 37.79 N ATOM 1197 CA ASN A 689 23.296 22.683 89.791 1.00 38.32 C ATOM 1198 C ASN A 689 22.819 24.092 90.091 1.00 45.99 C ATOM 1199 O ASN A 689 21.634 24.300 90.430 1.00 42.95 O ATOM 1200 CB ASN A 689 22.740 22.285 88.415 1.00 44.34 C ATOM 1201 CG ASN A 689 23.367 21.007 87.850 1.00 52.83 C ATOM 1202 OD1 ASN A 689 24.069 20.234 88.541 1.00 51.72 O ATOM 1203 ND2 ASN A 689 23.083 20.762 86.581 1.00 64.29 N ATOM 1204 HD22 ASN A 689 22.496 21.430 86.041 1.00 0.00 H ATOM 1205 HD21 ASN A 689 23.447 19.902 86.123 1.00 0.00 H ATOM 1206 H ASN A 689 22.202 20.986 90.547 1.00 0.00 H ATOM 1207 N LEU A 690 23.730 25.054 89.938 1.00 47.29 N ATOM 1208 CA LEU A 690 23.464 26.468 90.232 1.00 45.76 C ATOM 1209 C LEU A 690 23.869 27.380 89.064 1.00 45.49 C ATOM 1210 O LEU A 690 24.828 27.100 88.340 1.00 44.36 O ATOM 1211 CB LEU A 690 24.290 26.878 91.438 1.00 35.16 C ATOM 1212 CG LEU A 690 23.763 26.965 92.871 1.00 37.40 C ATOM 1213 CD1 LEU A 690 22.607 26.078 93.190 1.00 34.49 C ATOM 1214 CD2 LEU A 690 24.883 26.634 93.811 1.00 37.92 C ATOM 1215 H LEU A 690 24.675 24.790 89.594 1.00 0.00 H ATOM 1216 N ALA A 691 23.158 28.487 88.881 1.00 46.36 N ATOM 1217 CA ALA A 691 23.557 29.475 87.867 1.00 44.65 C ATOM 1218 C ALA A 691 22.990 30.835 88.262 1.00 48.04 C ATOM 1219 O ALA A 691 21.779 31.013 88.287 1.00 56.92 O ATOM 1220 CB ALA A 691 23.056 29.057 86.474 1.00 42.48 C ATOM 1221 H ALA A 691 22.311 28.657 89.460 1.00 0.00 H ATOM 1222 N VAL A 692 23.859 31.790 88.569 1.00 45.81 N ATOM 1223 CA VAL A 692 23.419 33.105 89.013 1.00 45.43 C ATOM 1224 C VAL A 692 23.621 34.213 87.972 1.00 50.20 C ATOM 1225 O VAL A 692 24.609 34.224 87.243 1.00 56.70 O ATOM 1226 CB VAL A 692 24.154 33.466 90.290 1.00 41.28 C ATOM 1227 CG1 VAL A 692 23.596 34.723 90.888 1.00 42.82 C ATOM 1228 CG2 VAL A 692 23.972 32.355 91.268 1.00 42.04 C ATOM 1229 H VAL A 692 24.877 31.595 88.491 1.00 0.00 H ATOM 1230 N ASN A 693 22.676 35.141 87.885 1.00 54.62 N ATOM 1231 CA ASN A 693 22.897 36.326 87.066 1.00 58.49 C ATOM 1232 C ASN A 693 22.520 37.632 87.784 1.00 59.67 C ATOM 1233 O ASN A 693 21.455 37.735 88.419 1.00 58.49 O ATOM 1234 CB ASN A 693 22.177 36.187 85.727 1.00 58.48 C ATOM 1235 CG ASN A 693 22.516 37.297 84.762 1.00 63.83 C ATOM 1236 OD1 ASN A 693 23.687 37.641 84.552 1.00 64.01 O ATOM 1237 ND2 ASN A 693 21.480 37.874 84.162 1.00 70.21 N ATOM 1238 HD22 ASN A 693 20.513 37.552 84.370 1.00 0.00 H ATOM 1239 HD21 ASN A 693 21.636 38.648 83.485 1.00 0.00 H ATOM 1240 H ASN A 693 21.780 35.023 88.400 1.00 0.00 H ATOM 1241 N TRP A 694 23.422 38.610 87.703 1.00 58.00 N ATOM 1242 CA TRP A 694 23.165 39.940 88.229 1.00 56.87 C ATOM 1243 C TRP A 694 22.960 40.915 87.073 1.00 63.09 C ATOM 1244 O TRP A 694 23.593 40.798 86.026 1.00 68.58 O ATOM 1245 CB TRP A 694 24.338 40.441 89.080 1.00 58.45 C ATOM 1246 CG TRP A 694 24.691 39.605 90.299 1.00 59.63 C ATOM 1247 CD1 TRP A 694 25.003 38.281 90.320 1.00 55.11 C ATOM 1248 CD2 TRP A 694 24.808 40.059 91.652 1.00 58.75 C ATOM 1249 NE1 TRP A 694 25.285 37.880 91.590 1.00 52.93 N ATOM 1250 CE2 TRP A 694 25.170 38.950 92.431 1.00 57.85 C ATOM 1251 CE3 TRP A 694 24.625 41.291 92.280 1.00 61.32 C ATOM 1252 CZ2 TRP A 694 25.360 39.034 93.813 1.00 59.49 C ATOM 1253 CZ3 TRP A 694 24.821 41.378 93.640 1.00 59.20 C ATOM 1254 CH2 TRP A 694 25.182 40.256 94.397 1.00 58.78 C ATOM 1255 HE1 TRP A 694 25.546 36.914 91.874 1.00 0.00 H ATOM 1256 H TRP A 694 24.337 38.415 87.250 1.00 0.00 H ATOM 1257 N ARG A 695 22.052 41.861 87.274 1.00 64.50 N ATOM 1258 CA ARG A 695 21.953 43.050 86.447 1.00 72.75 C ATOM 1259 C ARG A 695 22.041 44.233 87.434 1.00 71.42 C ATOM 1260 O ARG A 695 21.122 44.481 88.216 1.00 66.71 O ATOM 1261 CB ARG A 695 20.645 43.016 85.630 1.00 78.11 C ATOM 1262 CG ARG A 695 20.150 44.334 85.052 1.00 86.11 C ATOM 1263 CD ARG A 695 18.703 44.210 84.514 1.00 95.68 C ATOM 1264 NE ARG A 695 18.095 45.516 84.211 1.00108.47 N ATOM 1265 CZ ARG A 695 17.161 46.112 84.961 1.00112.91 C ATOM 1266 NH1 ARG A 695 16.714 45.517 86.060 1.00109.81 N ATOM 1267 NH2 ARG A 695 16.667 47.304 84.618 1.00115.51 N ATOM 1268 HE ARG A 695 18.414 46.010 83.353 1.00 0.00 H ATOM 1269 HH12 ARG A 695 15.988 45.980 86.643 1.00 0.00 H ATOM 1270 HH11 ARG A 695 17.090 44.588 86.338 1.00 0.00 H ATOM 1271 HH22 ARG A 695 15.941 47.756 85.210 1.00 0.00 H ATOM 1272 HH21 ARG A 695 17.008 47.780 83.759 1.00 0.00 H ATOM 1273 H ARG A 695 21.381 41.746 88.060 1.00 0.00 H ATOM 1274 N CYS A 696 23.180 44.923 87.423 1.00 72.51 N ATOM 1275 CA CYS A 696 23.471 45.985 88.379 1.00 69.64 C ATOM 1276 C CYS A 696 23.346 47.365 87.759 1.00 75.92 C ATOM 1277 O CYS A 696 24.200 47.765 86.972 1.00 75.61 O ATOM 1278 CB CYS A 696 24.900 45.827 88.898 1.00 68.16 C ATOM 1279 SG CYS A 696 25.247 44.267 89.729 1.00 73.41 S ATOM 1280 H CYS A 696 23.893 44.694 86.701 1.00 0.00 H ATOM 1281 N GLU A 697 22.297 48.097 88.131 1.00 84.74 N ATOM 1282 CA GLU A 697 22.088 49.471 87.665 1.00 92.06 C ATOM 1283 C GLU A 697 22.569 50.452 88.724 1.00 93.11 C ATOM 1284 O GLU A 697 22.744 50.067 89.877 1.00 96.03 O ATOM 1285 CB GLU A 697 20.605 49.713 87.363 1.00101.05 C ATOM 1286 CG GLU A 697 20.300 49.877 85.884 1.00111.18 C ATOM 1287 CD GLU A 697 19.966 48.561 85.238 1.00116.28 C ATOM 1288 OE1 GLU A 697 20.128 48.431 84.001 1.00118.26 O ATOM 1289 OE2 GLU A 697 19.534 47.657 85.985 1.00116.83 O ATOM 1290 H GLU A 697 21.599 47.677 88.777 1.00 0.00 H ATOM 1291 N PRO A 698 22.781 51.727 88.346 1.00 94.57 N ATOM 1292 CA PRO A 698 23.290 52.733 89.293 1.00 95.30 C ATOM 1293 C PRO A 698 22.489 52.851 90.586 1.00 97.55 C ATOM 1294 O PRO A 698 23.069 53.087 91.647 1.00101.10 O ATOM 1295 CB PRO A 698 23.168 54.032 88.507 1.00 92.07 C ATOM 1296 CG PRO A 698 23.319 53.610 87.097 1.00 91.48 C ATOM 1297 CD PRO A 698 22.643 52.288 86.989 1.00 91.23 C ATOM 1298 N SER A 699 21.175 52.705 90.502 1.00 95.56 N ATOM 1299 CA SER A 699 20.354 52.788 91.697 1.00 94.48 C ATOM 1300 C SER A 699 19.401 51.611 91.754 1.00 91.69 C ATOM 1301 O SER A 699 18.394 51.651 92.456 1.00 95.39 O ATOM 1302 CB SER A 699 19.570 54.098 91.723 1.00 96.50 C ATOM 1303 OG SER A 699 18.523 54.067 90.772 1.00 96.55 O ATOM 1304 HG SER A 699 17.909 53.320 90.983 1.00 0.00 H ATOM 1305 H SER A 699 20.730 52.531 89.578 1.00 0.00 H ATOM 1306 N SER A 700 19.721 50.558 91.012 1.00 85.21 N ATOM 1307 CA SER A 700 18.864 49.389 90.978 1.00 82.79 C ATOM 1308 C SER A 700 19.715 48.121 90.923 1.00 77.07 C ATOM 1309 O SER A 700 20.902 48.174 90.583 1.00 76.24 O ATOM 1310 CB SER A 700 17.931 49.469 89.769 1.00 91.40 C ATOM 1311 OG SER A 700 16.897 48.507 89.860 1.00 94.67 O ATOM 1312 HG SER A 700 16.309 48.580 89.067 1.00 0.00 H ATOM 1313 H SER A 700 20.595 50.572 90.449 1.00 0.00 H ATOM 1314 N THR A 701 19.122 46.984 91.283 1.00 72.42 N ATOM 1315 CA THR A 701 19.816 45.706 91.135 1.00 67.01 C ATOM 1316 C THR A 701 18.889 44.491 91.084 1.00 66.91 C ATOM 1317 O THR A 701 18.111 44.268 92.008 1.00 61.96 O ATOM 1318 CB THR A 701 20.894 45.528 92.211 1.00 66.59 C ATOM 1319 OG1 THR A 701 22.008 46.374 91.883 1.00 72.32 O ATOM 1320 CG2 THR A 701 21.348 44.100 92.265 1.00 55.24 C ATOM 1321 HG1 THR A 701 22.713 46.270 92.570 1.00 0.00 H ATOM 1322 H THR A 701 18.158 47.006 91.672 1.00 0.00 H ATOM 1323 N ASP A 702 18.967 43.727 89.984 1.00 70.96 N ATOM 1324 CA ASP A 702 18.183 42.501 89.816 1.00 70.94 C ATOM 1325 C ASP A 702 19.047 41.263 89.962 1.00 67.07 C ATOM 1326 O ASP A 702 20.119 41.167 89.357 1.00 69.26 O ATOM 1327 CB ASP A 702 17.475 42.477 88.466 1.00 76.66 C ATOM 1328 CG ASP A 702 16.387 43.532 88.359 1.00 92.90 C ATOM 1329 OD1 ASP A 702 15.196 43.153 88.337 1.00 97.81 O ATOM 1330 OD2 ASP A 702 16.721 44.741 88.301 1.00 99.50 O ATOM 1331 H ASP A 702 19.610 44.017 89.220 1.00 0.00 H ATOM 1332 N LEU A 703 18.565 40.319 90.768 1.00 63.88 N ATOM 1333 CA LEU A 703 19.277 39.077 91.057 1.00 61.46 C ATOM 1334 C LEU A 703 18.433 37.891 90.652 1.00 60.21 C ATOM 1335 O LEU A 703 17.219 37.832 90.946 1.00 62.19 O ATOM 1336 CB LEU A 703 19.525 38.957 92.552 1.00 60.10 C ATOM 1337 CG LEU A 703 20.738 38.235 93.167 1.00 56.29 C ATOM 1338 CD1 LEU A 703 20.304 37.374 94.372 1.00 51.99 C ATOM 1339 CD2 LEU A 703 21.586 37.458 92.185 1.00 46.65 C ATOM 1340 H LEU A 703 17.638 40.473 91.213 1.00 0.00 H ATOM 1341 N ARG A 704 19.084 36.933 90.005 1.00 58.14 N ATOM 1342 CA ARG A 704 18.418 35.695 89.636 1.00 56.04 C ATOM 1343 C ARG A 704 19.280 34.487 89.927 1.00 54.68 C ATOM 1344 O ARG A 704 20.458 34.450 89.573 1.00 57.42 O ATOM 1345 CB ARG A 704 18.052 35.691 88.163 1.00 54.58 C ATOM 1346 CG ARG A 704 17.142 34.545 87.819 1.00 56.97 C ATOM 1347 CD ARG A 704 17.016 34.301 86.332 1.00 57.23 C ATOM 1348 NE ARG A 704 16.005 33.275 86.113 1.00 62.29 N ATOM 1349 CZ ARG A 704 14.766 33.536 85.700 1.00 71.28 C ATOM 1350 NH1 ARG A 704 14.397 34.794 85.445 1.00 71.44 N ATOM 1351 NH2 ARG A 704 13.894 32.545 85.531 1.00 74.42 N ATOM 1352 HE ARG A 704 16.265 32.284 86.289 1.00 0.00 H ATOM 1353 HH12 ARG A 704 13.429 34.997 85.123 1.00 0.00 H ATOM 1354 HH11 ARG A 704 15.077 35.571 85.569 1.00 0.00 H ATOM 1355 HH22 ARG A 704 12.927 32.752 85.208 1.00 0.00 H ATOM 1356 HH21 ARG A 704 14.179 31.563 85.722 1.00 0.00 H ATOM 1357 H ARG A 704 20.085 37.070 89.758 1.00 0.00 H ATOM 1358 N ILE A 705 18.690 33.496 90.579 1.00 55.60 N ATOM 1359 CA ILE A 705 19.389 32.257 90.879 1.00 41.35 C ATOM 1360 C ILE A 705 18.589 31.131 90.261 1.00 52.48 C ATOM 1361 O ILE A 705 17.394 31.013 90.487 1.00 52.77 O ATOM 1362 CB ILE A 705 19.509 32.039 92.407 1.00 46.64 C ATOM 1363 CG1 ILE A 705 20.234 33.225 93.054 1.00 40.29 C ATOM 1364 CG2 ILE A 705 20.232 30.715 92.740 1.00 38.03 C ATOM 1365 CD1 ILE A 705 20.113 33.258 94.586 1.00 41.43 C ATOM 1366 H ILE A 705 17.702 33.607 90.884 1.00 0.00 H ATOM 1367 N ASP A 706 19.235 30.316 89.447 1.00 55.89 N ATOM 1368 CA ASP A 706 18.567 29.180 88.831 1.00 58.48 C ATOM 1369 C ASP A 706 19.181 27.920 89.402 1.00 54.69 C ATOM 1370 O ASP A 706 20.392 27.755 89.385 1.00 56.52 O ATOM 1371 CB ASP A 706 18.738 29.197 87.306 1.00 64.70 C ATOM 1372 CG ASP A 706 17.842 30.199 86.619 1.00 72.44 C ATOM 1373 OD1 ASP A 706 16.720 30.431 87.110 1.00 78.91 O ATOM 1374 OD2 ASP A 706 18.254 30.747 85.576 1.00 72.93 O ATOM 1375 H ASP A 706 20.240 30.490 89.243 1.00 0.00 H ATOM 1376 N TYR A 707 18.357 27.034 89.933 1.00 41.54 N ATOM 1377 CA TYR A 707 18.893 25.802 90.522 1.00 40.28 C ATOM 1378 C TYR A 707 18.162 24.619 89.923 1.00 50.04 C ATOM 1379 O TYR A 707 16.982 24.721 89.489 1.00 56.15 O ATOM 1380 CB TYR A 707 18.780 25.775 92.057 1.00 38.86 C ATOM 1381 CG TYR A 707 17.351 25.732 92.588 1.00 45.71 C ATOM 1382 CD1 TYR A 707 16.644 24.529 92.683 1.00 46.62 C ATOM 1383 CD2 TYR A 707 16.715 26.896 93.005 1.00 44.40 C ATOM 1384 CE1 TYR A 707 15.341 24.497 93.141 1.00 42.78 C ATOM 1385 CE2 TYR A 707 15.415 26.867 93.477 1.00 47.46 C ATOM 1386 CZ TYR A 707 14.735 25.662 93.535 1.00 51.14 C ATOM 1387 OH TYR A 707 13.446 25.619 94.016 1.00 57.21 O ATOM 1388 HH TYR A 707 13.115 24.686 93.987 1.00 0.00 H ATOM 1389 H TYR A 707 17.332 27.209 89.933 1.00 0.00 H ATOM 1390 N LYS A 708 18.866 23.499 89.890 1.00 47.13 N ATOM 1391 CA LYS A 708 18.296 22.268 89.372 1.00 52.47 C ATOM 1392 C LYS A 708 18.846 21.159 90.237 1.00 51.67 C ATOM 1393 O LYS A 708 20.057 21.014 90.380 1.00 50.63 O ATOM 1394 CB LYS A 708 18.637 22.068 87.881 1.00 57.22 C ATOM 1395 CG LYS A 708 18.513 20.627 87.352 1.00 65.40 C ATOM 1396 CD LYS A 708 18.913 20.528 85.851 1.00 80.31 C ATOM 1397 CE LYS A 708 18.597 19.156 85.228 1.00 79.87 C ATOM 1398 NZ LYS A 708 19.399 18.044 85.839 1.00 74.40 N ATOM 1399 HZ1 LYS A 708 20.412 18.232 85.700 1.00 0.00 H ATOM 1400 HZ2 LYS A 708 19.192 17.988 86.857 1.00 0.00 H ATOM 1401 HZ3 LYS A 708 19.146 17.144 85.382 1.00 0.00 H ATOM 1402 H LYS A 708 19.845 23.500 90.241 1.00 0.00 H ATOM 1403 N TYR A 709 17.939 20.426 90.867 1.00 51.80 N ATOM 1404 CA TYR A 709 18.282 19.224 91.594 1.00 54.36 C ATOM 1405 C TYR A 709 18.802 18.196 90.579 1.00 52.66 C ATOM 1406 O TYR A 709 18.194 18.003 89.540 1.00 53.32 O ATOM 1407 CB TYR A 709 17.026 18.754 92.315 1.00 56.94 C ATOM 1408 CG TYR A 709 17.099 17.381 92.906 1.00 57.48 C ATOM 1409 CD1 TYR A 709 17.604 17.177 94.180 1.00 54.86 C ATOM 1410 CD2 TYR A 709 16.639 16.284 92.193 1.00 60.32 C ATOM 1411 CE1 TYR A 709 17.658 15.915 94.725 1.00 53.64 C ATOM 1412 CE2 TYR A 709 16.693 15.026 92.722 1.00 62.57 C ATOM 1413 CZ TYR A 709 17.202 14.842 93.986 1.00 57.25 C ATOM 1414 OH TYR A 709 17.243 13.573 94.494 1.00 57.73 O ATOM 1415 HH TYR A 709 17.631 13.596 95.405 1.00 0.00 H ATOM 1416 H TYR A 709 16.944 20.726 90.837 1.00 0.00 H ATOM 1417 N ASN A 710 19.938 17.562 90.862 1.00 54.05 N ATOM 1418 CA ASN A 710 20.599 16.698 89.874 1.00 55.91 C ATOM 1419 C ASN A 710 20.837 15.269 90.370 1.00 56.02 C ATOM 1420 O ASN A 710 21.784 14.997 91.102 1.00 56.06 O ATOM 1421 CB ASN A 710 21.917 17.320 89.415 1.00 43.89 C ATOM 1422 CG ASN A 710 22.783 16.345 88.647 1.00 54.91 C ATOM 1423 OD1 ASN A 710 22.277 15.506 87.898 1.00 61.72 O ATOM 1424 ND2 ASN A 710 24.101 16.445 88.828 1.00 50.18 N ATOM 1425 HD22 ASN A 710 24.484 17.168 89.470 1.00 0.00 H ATOM 1426 HD21 ASN A 710 24.745 15.800 88.327 1.00 0.00 H ATOM 1427 H ASN A 710 20.367 17.681 91.802 1.00 0.00 H ATOM 1428 N THR A 711 19.976 14.359 89.937 1.00 62.44 N ATOM 1429 CA THR A 711 19.985 12.985 90.414 1.00 65.54 C ATOM 1430 C THR A 711 21.283 12.248 90.098 1.00 63.67 C ATOM 1431 O THR A 711 21.696 11.353 90.852 1.00 63.11 O ATOM 1432 CB THR A 711 18.832 12.199 89.791 1.00 73.95 C ATOM 1433 OG1 THR A 711 17.846 13.109 89.302 1.00 81.81 O ATOM 1434 CG2 THR A 711 18.211 11.327 90.822 1.00 76.53 C ATOM 1435 HG1 THR A 711 17.099 12.599 88.899 1.00 0.00 H ATOM 1436 H THR A 711 19.267 14.638 89.229 1.00 0.00 H ATOM 1437 N ASP A 712 21.913 12.623 88.985 1.00 61.05 N ATOM 1438 CA ASP A 712 23.081 11.910 88.463 1.00 65.68 C ATOM 1439 C ASP A 712 24.263 11.938 89.438 1.00 63.83 C ATOM 1440 O ASP A 712 25.160 11.092 89.393 1.00 70.82 O ATOM 1441 CB ASP A 712 23.479 12.486 87.095 1.00 71.94 C ATOM 1442 CG ASP A 712 22.454 12.179 86.009 1.00 83.60 C ATOM 1443 OD1 ASP A 712 21.759 11.149 86.147 1.00 87.43 O ATOM 1444 OD2 ASP A 712 22.339 12.952 85.022 1.00 89.87 O ATOM 1445 H ASP A 712 21.562 13.454 88.467 1.00 0.00 H ATOM 1446 N ALA A 713 24.223 12.913 90.336 1.00 57.55 N ATOM 1447 CA ALA A 713 25.308 13.212 91.255 1.00 50.37 C ATOM 1448 C ALA A 713 25.372 12.218 92.381 1.00 50.43 C ATOM 1449 O ALA A 713 26.422 12.107 93.049 1.00 44.34 O ATOM 1450 CB ALA A 713 25.111 14.588 91.843 1.00 44.51 C ATOM 1451 H ALA A 713 23.365 13.498 90.385 1.00 0.00 H ATOM 1452 N MET A 714 24.256 11.521 92.615 1.00 50.41 N ATOM 1453 CA MET A 714 24.144 10.646 93.787 1.00 53.68 C ATOM 1454 C MET A 714 23.725 9.225 93.449 1.00 57.94 C ATOM 1455 O MET A 714 23.029 9.002 92.444 1.00 61.54 O ATOM 1456 CB MET A 714 23.211 11.263 94.841 1.00 56.44 C ATOM 1457 CG MET A 714 21.748 11.353 94.451 1.00 56.15 C ATOM 1458 SD MET A 714 20.894 12.588 95.455 1.00 74.55 S ATOM 1459 CE MET A 714 21.417 14.084 94.599 1.00 46.80 C ATOM 1460 H MET A 714 23.455 11.600 91.956 1.00 0.00 H ATOM 1461 N THR A 715 24.145 8.268 94.287 1.00 59.78 N ATOM 1462 CA THR A 715 23.960 6.853 93.954 1.00 66.58 C ATOM 1463 C THR A 715 22.480 6.453 93.998 1.00 66.51 C ATOM 1464 O THR A 715 21.988 5.701 93.122 1.00 62.34 O ATOM 1465 CB THR A 715 24.885 5.915 94.786 1.00 62.03 C ATOM 1466 OG1 THR A 715 24.123 4.897 95.440 1.00 63.21 O ATOM 1467 CG2 THR A 715 25.625 6.694 95.822 1.00 59.82 C ATOM 1468 HG1 THR A 715 24.731 4.315 95.961 1.00 0.00 H ATOM 1469 H THR A 715 24.606 8.531 95.181 1.00 0.00 H ATOM 1470 N THR A 716 21.770 6.983 94.993 1.00 61.34 N ATOM 1471 CA THR A 716 20.326 6.786 95.063 1.00 63.80 C ATOM 1472 C THR A 716 19.625 8.133 95.233 1.00 61.84 C ATOM 1473 O THR A 716 20.142 9.016 95.896 1.00 60.22 O ATOM 1474 CB THR A 716 19.938 5.749 96.154 1.00 82.61 C ATOM 1475 OG1 THR A 716 18.674 6.094 96.726 1.00 80.59 O ATOM 1476 CG2 THR A 716 21.011 5.678 97.266 1.00 81.42 C ATOM 1477 HG1 THR A 716 18.434 5.429 97.419 1.00 0.00 H ATOM 1478 H THR A 716 22.250 7.543 95.727 1.00 0.00 H ATOM 1479 N ALA A 717 18.463 8.297 94.608 1.00 70.14 N ATOM 1480 CA ALA A 717 17.796 9.608 94.550 1.00 65.65 C ATOM 1481 C ALA A 717 17.181 9.971 95.880 1.00 61.29 C ATOM 1482 O ALA A 717 16.173 9.392 96.283 1.00 65.51 O ATOM 1483 CB ALA A 717 16.735 9.644 93.452 1.00 64.63 C ATOM 1484 H ALA A 717 18.014 7.479 94.149 1.00 0.00 H ATOM 1485 N VAL A 718 17.778 10.964 96.526 1.00 57.06 N ATOM 1486 CA VAL A 718 17.487 11.306 97.903 1.00 59.90 C ATOM 1487 C VAL A 718 17.267 12.822 97.993 1.00 55.87 C ATOM 1488 O VAL A 718 17.847 13.566 97.218 1.00 58.97 O ATOM 1489 CB VAL A 718 18.679 10.837 98.794 1.00 64.09 C ATOM 1490 CG1 VAL A 718 18.823 11.686 100.017 1.00 65.46 C ATOM 1491 CG2 VAL A 718 18.521 9.387 99.173 1.00 50.23 C ATOM 1492 H VAL A 718 18.491 11.525 96.018 1.00 0.00 H ATOM 1493 N ALA A 719 16.434 13.290 98.917 1.00 50.32 N ATOM 1494 CA ALA A 719 16.212 14.733 99.056 1.00 51.98 C ATOM 1495 C ALA A 719 17.418 15.517 99.585 1.00 51.16 C ATOM 1496 O ALA A 719 18.279 14.972 100.280 1.00 51.21 O ATOM 1497 CB ALA A 719 15.011 14.997 99.929 1.00 54.67 C ATOM 1498 H ALA A 719 15.936 12.628 99.546 1.00 0.00 H ATOM 1499 N LEU A 720 17.465 16.798 99.240 1.00 51.42 N ATOM 1500 CA LEU A 720 18.405 17.737 99.832 1.00 47.33 C ATOM 1501 C LEU A 720 17.612 18.510 100.885 1.00 53.70 C ATOM 1502 O LEU A 720 16.550 19.075 100.572 1.00 61.31 O ATOM 1503 CB LEU A 720 18.947 18.714 98.782 1.00 41.79 C ATOM 1504 CG LEU A 720 19.732 18.176 97.577 1.00 42.83 C ATOM 1505 CD1 LEU A 720 20.210 19.302 96.661 1.00 36.71 C ATOM 1506 CD2 LEU A 720 20.932 17.364 98.030 1.00 38.20 C ATOM 1507 H LEU A 720 16.803 17.144 98.517 1.00 0.00 H ATOM 1508 N ASN A 721 18.116 18.542 102.122 1.00 54.03 N ATOM 1509 CA ASN A 721 17.400 19.156 103.249 1.00 56.60 C ATOM 1510 C ASN A 721 18.032 20.456 103.710 1.00 56.73 C ATOM 1511 O ASN A 721 19.231 20.665 103.523 1.00 56.02 O ATOM 1512 CB ASN A 721 17.353 18.207 104.448 1.00 51.45 C ATOM 1513 CG ASN A 721 16.934 16.813 104.066 1.00 53.48 C ATOM 1514 OD1 ASN A 721 17.701 15.839 104.225 1.00 54.73 O ATOM 1515 ND2 ASN A 721 15.718 16.697 103.542 1.00 53.75 N ATOM 1516 HD22 ASN A 721 15.117 17.539 103.430 1.00 0.00 H ATOM 1517 HD21 ASN A 721 15.367 15.765 103.244 1.00 0.00 H ATOM 1518 H ASN A 721 19.049 18.117 102.294 1.00 0.00 H ATOM 1519 N ASN A 722 17.215 21.312 104.319 1.00 57.63 N ATOM 1520 CA ASN A 722 17.675 22.562 104.901 1.00 59.35 C ATOM 1521 C ASN A 722 18.517 23.367 103.936 1.00 51.55 C ATOM 1522 O ASN A 722 19.653 23.730 104.233 1.00 53.75 O ATOM 1523 CB ASN A 722 18.458 22.288 106.184 1.00 64.73 C ATOM 1524 CG ASN A 722 17.622 21.565 107.237 1.00 71.47 C ATOM 1525 OD1 ASN A 722 16.477 21.947 107.520 1.00 72.44 O ATOM 1526 ND2 ASN A 722 18.189 20.506 107.814 1.00 72.40 N ATOM 1527 HD22 ASN A 722 19.153 20.221 107.546 1.00 0.00 H ATOM 1528 HD21 ASN A 722 17.668 19.964 108.533 1.00 0.00 H ATOM 1529 H ASN A 722 16.204 21.076 104.381 1.00 0.00 H ATOM 1530 N VAL A 723 17.980 23.653 102.767 1.00 51.03 N ATOM 1531 CA VAL A 723 18.833 24.333 101.804 1.00 53.44 C ATOM 1532 C VAL A 723 18.742 25.852 101.941 1.00 52.08 C ATOM 1533 O VAL A 723 17.659 26.428 102.062 1.00 51.11 O ATOM 1534 CB VAL A 723 18.667 23.809 100.346 1.00 45.39 C ATOM 1535 CG1 VAL A 723 18.038 22.428 100.353 1.00 42.79 C ATOM 1536 CG2 VAL A 723 17.824 24.717 99.556 1.00 53.42 C ATOM 1537 H VAL A 723 16.995 23.405 102.544 1.00 0.00 H ATOM 1538 N GLN A 724 19.905 26.484 101.976 1.00 52.57 N ATOM 1539 CA GLN A 724 19.987 27.905 102.205 1.00 55.83 C ATOM 1540 C GLN A 724 20.762 28.536 101.093 1.00 52.37 C ATOM 1541 O GLN A 724 21.789 28.003 100.665 1.00 45.86 O ATOM 1542 CB GLN A 724 20.710 28.192 103.498 1.00 60.01 C ATOM 1543 CG GLN A 724 19.992 27.678 104.708 1.00 69.52 C ATOM 1544 CD GLN A 724 20.757 27.967 105.967 1.00 71.51 C ATOM 1545 OE1 GLN A 724 21.493 28.953 106.041 1.00 68.45 O ATOM 1546 NE2 GLN A 724 20.604 27.104 106.960 1.00 75.07 N ATOM 1547 HE22 GLN A 724 19.970 26.287 106.846 1.00 0.00 H ATOM 1548 HE21 GLN A 724 21.118 27.243 107.853 1.00 0.00 H ATOM 1549 H GLN A 724 20.781 25.942 101.835 1.00 0.00 H ATOM 1550 N PHE A 725 20.253 29.678 100.644 1.00 50.96 N ATOM 1551 CA PHE A 725 20.911 30.494 99.657 1.00 46.96 C ATOM 1552 C PHE A 725 21.134 31.860 100.265 1.00 48.16 C ATOM 1553 O PHE A 725 20.188 32.629 100.457 1.00 53.97 O ATOM 1554 CB PHE A 725 20.005 30.668 98.452 1.00 55.63 C ATOM 1555 CG PHE A 725 19.591 29.380 97.788 1.00 53.59 C ATOM 1556 CD1 PHE A 725 18.559 28.614 98.298 1.00 51.96 C ATOM 1557 CD2 PHE A 725 20.187 28.975 96.611 1.00 49.40 C ATOM 1558 CE1 PHE A 725 18.162 27.461 97.669 1.00 48.75 C ATOM 1559 CE2 PHE A 725 19.774 27.811 95.969 1.00 46.82 C ATOM 1560 CZ PHE A 725 18.769 27.052 96.505 1.00 43.36 C ATOM 1561 H PHE A 725 19.338 29.997 101.022 1.00 0.00 H ATOM 1562 N LEU A 726 22.384 32.163 100.572 1.00 46.38 N ATOM 1563 CA LEU A 726 22.758 33.444 101.165 1.00 47.14 C ATOM 1564 C LEU A 726 23.531 34.270 100.100 1.00 61.23 C ATOM 1565 O LEU A 726 24.464 33.768 99.465 1.00 58.77 O ATOM 1566 CB LEU A 726 23.646 33.123 102.362 1.00 52.51 C ATOM 1567 CG LEU A 726 24.001 33.966 103.591 1.00 55.48 C ATOM 1568 CD1 LEU A 726 25.187 34.852 103.292 1.00 61.35 C ATOM 1569 CD2 LEU A 726 22.811 34.775 104.062 1.00 58.40 C ATOM 1570 H LEU A 726 23.129 31.462 100.384 1.00 0.00 H ATOM 1571 N VAL A 727 23.139 35.517 99.861 1.00 56.57 N ATOM 1572 CA VAL A 727 23.975 36.393 99.023 1.00 47.28 C ATOM 1573 C VAL A 727 24.050 37.855 99.534 1.00 53.38 C ATOM 1574 O VAL A 727 23.009 38.502 99.759 1.00 52.50 O ATOM 1575 CB VAL A 727 23.581 36.302 97.516 1.00 50.27 C ATOM 1576 CG1 VAL A 727 22.147 35.839 97.341 1.00 54.95 C ATOM 1577 CG2 VAL A 727 23.834 37.610 96.783 1.00 48.50 C ATOM 1578 H VAL A 727 22.248 35.872 100.263 1.00 0.00 H ATOM 1579 N PRO A 728 25.286 38.357 99.776 1.00 56.17 N ATOM 1580 CA PRO A 728 25.523 39.755 100.198 1.00 57.26 C ATOM 1581 C PRO A 728 25.159 40.747 99.096 1.00 56.02 C ATOM 1582 O PRO A 728 25.504 40.494 97.943 1.00 57.81 O ATOM 1583 CB PRO A 728 27.039 39.816 100.426 1.00 50.07 C ATOM 1584 CG PRO A 728 27.489 38.426 100.544 1.00 44.27 C ATOM 1585 CD PRO A 728 26.525 37.555 99.792 1.00 50.04 C ATOM 1586 N ILE A 729 24.515 41.858 99.450 1.00 57.46 N ATOM 1587 CA ILE A 729 24.132 42.889 98.483 1.00 59.60 C ATOM 1588 C ILE A 729 24.728 44.282 98.778 1.00 64.96 C ATOM 1589 O ILE A 729 24.273 45.004 99.657 1.00 63.53 O ATOM 1590 CB ILE A 729 22.600 42.993 98.365 1.00 63.03 C ATOM 1591 CG1 ILE A 729 21.984 41.597 98.258 1.00 60.57 C ATOM 1592 CG2 ILE A 729 22.212 43.792 97.141 1.00 54.64 C ATOM 1593 CD1 ILE A 729 22.252 40.928 96.917 1.00 61.22 C ATOM 1594 H ILE A 729 24.275 41.999 100.452 1.00 0.00 H ATOM 1595 N ASP A 730 25.742 44.638 97.997 1.00 76.24 N ATOM 1596 CA ASP A 730 26.451 45.916 98.040 1.00 81.81 C ATOM 1597 C ASP A 730 25.537 47.092 97.694 1.00 83.99 C ATOM 1598 O ASP A 730 24.373 46.907 97.352 1.00 84.61 O ATOM 1599 CB ASP A 730 27.552 45.851 96.971 1.00 89.00 C ATOM 1600 CG ASP A 730 28.784 46.641 97.335 1.00101.52 C ATOM 1601 OD1 ASP A 730 29.118 46.675 98.536 1.00108.19 O ATOM 1602 OD2 ASP A 730 29.429 47.217 96.422 1.00104.41 O ATOM 1603 H ASP A 730 26.061 43.944 97.291 1.00 0.00 H ATOM 1604 N GLY A 731 26.076 48.304 97.765 1.00 85.59 N ATOM 1605 CA GLY A 731 25.454 49.443 97.117 1.00 84.22 C ATOM 1606 C GLY A 731 24.507 50.227 97.988 1.00 87.45 C ATOM 1607 O GLY A 731 23.930 51.227 97.541 1.00 92.35 O ATOM 1608 H GLY A 731 26.961 48.439 98.295 1.00 0.00 H ATOM 1609 N GLY A 732 24.345 49.779 99.230 1.00 83.42 N ATOM 1610 CA GLY A 732 23.513 50.488 100.189 1.00 84.15 C ATOM 1611 C GLY A 732 22.033 50.272 99.945 1.00 80.84 C ATOM 1612 O GLY A 732 21.308 51.205 99.601 1.00 78.82 O ATOM 1613 H GLY A 732 24.824 48.903 99.521 1.00 0.00 H ATOM 1614 N VAL A 733 21.584 49.035 100.130 1.00 75.58 N ATOM 1615 CA VAL A 733 20.185 48.685 99.892 1.00 74.88 C ATOM 1616 C VAL A 733 19.228 49.458 100.806 1.00 81.19 C ATOM 1617 O VAL A 733 19.443 49.568 102.023 1.00 78.22 O ATOM 1618 CB VAL A 733 19.946 47.167 100.047 1.00 71.49 C ATOM 1619 CG1 VAL A 733 18.472 46.827 99.843 1.00 70.85 C ATOM 1620 CG2 VAL A 733 20.800 46.389 99.048 1.00 70.24 C ATOM 1621 H VAL A 733 22.244 48.298 100.452 1.00 0.00 H ATOM 1622 N THR A 734 18.167 49.983 100.203 1.00 83.51 N ATOM 1623 CA THR A 734 17.186 50.784 100.922 1.00 91.53 C ATOM 1624 C THR A 734 15.816 50.103 101.000 1.00 95.24 C ATOM 1625 O THR A 734 15.041 50.358 101.920 1.00 98.20 O ATOM 1626 CB THR A 734 17.006 52.172 100.269 1.00 91.83 C ATOM 1627 OG1 THR A 734 16.245 52.038 99.063 1.00 91.65 O ATOM 1628 CG2 THR A 734 18.355 52.802 99.954 1.00 90.51 C ATOM 1629 HG1 THR A 734 16.723 51.438 98.437 1.00 0.00 H ATOM 1630 H THR A 734 18.033 49.817 99.185 1.00 0.00 H ATOM 1631 N LYS A 735 15.526 49.244 100.029 1.00 93.41 N ATOM 1632 CA LYS A 735 14.238 48.566 99.937 1.00 92.17 C ATOM 1633 C LYS A 735 14.348 47.431 98.930 1.00 92.08 C ATOM 1634 O LYS A 735 15.045 47.559 97.924 1.00 95.41 O ATOM 1635 CB LYS A 735 13.168 49.547 99.465 1.00 94.08 C ATOM 1636 CG LYS A 735 11.867 48.900 99.001 1.00 98.13 C ATOM 1637 CD LYS A 735 10.924 49.940 98.386 1.00108.23 C ATOM 1638 CE LYS A 735 9.561 49.348 98.029 1.00111.82 C ATOM 1639 NZ LYS A 735 8.867 48.767 99.214 1.00113.45 N ATOM 1640 HZ1 LYS A 735 9.452 48.008 99.619 1.00 0.00 H ATOM 1641 HZ2 LYS A 735 8.719 49.510 99.926 1.00 0.00 H ATOM 1642 HZ3 LYS A 735 7.948 48.379 98.920 1.00 0.00 H ATOM 1643 H LYS A 735 16.246 49.047 99.305 1.00 0.00 H ATOM 1644 N LEU A 736 13.669 46.320 99.185 1.00 87.74 N ATOM 1645 CA LEU A 736 13.571 45.292 98.164 1.00 85.11 C ATOM 1646 C LEU A 736 12.139 45.029 97.709 1.00 86.60 C ATOM 1647 O LEU A 736 11.205 44.999 98.506 1.00 86.71 O ATOM 1648 CB LEU A 736 14.257 43.992 98.590 1.00 84.79 C ATOM 1649 CG LEU A 736 14.093 43.444 100.002 1.00 82.45 C ATOM 1650 CD1 LEU A 736 14.052 41.932 99.942 1.00 78.56 C ATOM 1651 CD2 LEU A 736 15.258 43.897 100.864 1.00 82.03 C ATOM 1652 H LEU A 736 13.211 46.186 100.109 1.00 0.00 H ATOM 1653 N GLN A 737 11.982 44.854 96.403 1.00 90.19 N ATOM 1654 CA GLN A 737 10.694 44.534 95.814 1.00 93.42 C ATOM 1655 C GLN A 737 10.824 43.259 94.978 1.00 94.40 C ATOM 1656 O GLN A 737 11.943 42.773 94.714 1.00 94.93 O ATOM 1657 CB GLN A 737 10.235 45.688 94.933 1.00 96.58 C ATOM 1658 CG GLN A 737 10.704 47.050 95.422 1.00103.73 C ATOM 1659 CD GLN A 737 11.242 47.933 94.305 1.00108.96 C ATOM 1660 OE1 GLN A 737 11.818 47.443 93.333 1.00108.15 O ATOM 1661 NE2 GLN A 737 11.054 49.245 94.443 1.00113.32 N ATOM 1662 HE22 GLN A 737 10.562 49.614 95.281 1.00 0.00 H ATOM 1663 HE21 GLN A 737 11.400 49.900 93.712 1.00 0.00 H ATOM 1664 H GLN A 737 12.809 44.949 95.780 1.00 0.00 H ATOM 1665 N ALA A 738 9.673 42.728 94.575 1.00 95.14 N ATOM 1666 CA ALA A 738 9.594 41.577 93.684 1.00 94.42 C ATOM 1667 C ALA A 738 10.490 40.414 94.110 1.00 91.40 C ATOM 1668 O ALA A 738 11.359 39.954 93.351 1.00 90.85 O ATOM 1669 CB ALA A 738 9.886 41.994 92.245 1.00 95.17 C ATOM 1670 H ALA A 738 8.786 43.155 94.912 1.00 0.00 H ATOM 1671 N VAL A 739 10.268 39.943 95.329 1.00 87.43 N ATOM 1672 CA VAL A 739 10.938 38.740 95.796 1.00 83.37 C ATOM 1673 C VAL A 739 10.021 37.522 95.655 1.00 80.68 C ATOM 1674 O VAL A 739 8.841 37.569 96.035 1.00 78.26 O ATOM 1675 CB VAL A 739 11.377 38.893 97.249 1.00 82.48 C ATOM 1676 CG1 VAL A 739 12.192 37.681 97.687 1.00 77.17 C ATOM 1677 CG2 VAL A 739 12.175 40.167 97.397 1.00 83.42 C ATOM 1678 H VAL A 739 9.607 40.440 95.959 1.00 0.00 H ATOM 1679 N LEU A 740 10.566 36.437 95.111 1.00 76.94 N ATOM 1680 CA LEU A 740 9.781 35.236 94.871 1.00 79.35 C ATOM 1681 C LEU A 740 10.741 34.083 94.709 1.00 69.25 C ATOM 1682 O LEU A 740 11.636 34.151 93.883 1.00 65.83 O ATOM 1683 CB LEU A 740 8.941 35.398 93.601 1.00 88.89 C ATOM 1684 CG LEU A 740 7.918 34.299 93.310 1.00 94.58 C ATOM 1685 CD1 LEU A 740 6.897 34.214 94.446 1.00101.70 C ATOM 1686 CD2 LEU A 740 7.228 34.528 91.968 1.00 92.24 C ATOM 1687 H LEU A 740 11.573 36.448 94.852 1.00 0.00 H ATOM 1688 N PRO A 741 10.607 33.038 95.535 1.00 67.16 N ATOM 1689 CA PRO A 741 9.684 32.878 96.666 1.00 67.01 C ATOM 1690 C PRO A 741 10.112 33.804 97.815 1.00 69.81 C ATOM 1691 O PRO A 741 11.167 34.444 97.687 1.00 65.40 O ATOM 1692 CB PRO A 741 9.871 31.402 97.047 1.00 60.20 C ATOM 1693 CG PRO A 741 11.235 31.084 96.644 1.00 53.42 C ATOM 1694 CD PRO A 741 11.559 31.920 95.438 1.00 52.87 C ATOM 1695 N PRO A 742 9.308 33.900 98.898 1.00 72.73 N ATOM 1696 CA PRO A 742 9.662 34.815 99.996 1.00 72.14 C ATOM 1697 C PRO A 742 11.045 34.554 100.603 1.00 59.55 C ATOM 1698 O PRO A 742 11.450 33.395 100.788 1.00 58.22 O ATOM 1699 CB PRO A 742 8.564 34.552 101.029 1.00 66.77 C ATOM 1700 CG PRO A 742 7.392 34.096 100.212 1.00 69.00 C ATOM 1701 CD PRO A 742 8.000 33.253 99.136 1.00 75.61 C ATOM 1702 N ALA A 743 11.761 35.644 100.874 1.00 59.34 N ATOM 1703 CA ALA A 743 13.092 35.624 101.494 1.00 85.37 C ATOM 1704 C ALA A 743 13.127 36.402 102.840 1.00 71.49 C ATOM 1705 O ALA A 743 12.107 36.951 103.287 1.00 77.52 O ATOM 1706 CB ALA A 743 14.116 36.212 100.540 1.00 54.46 C ATOM 1707 H ALA A 743 11.351 36.568 100.631 1.00 0.00 H ATOM 1708 N VAL A 744 14.309 36.452 103.461 1.00 64.84 N ATOM 1709 CA VAL A 744 14.554 37.285 104.636 1.00 67.21 C ATOM 1710 C VAL A 744 15.711 38.256 104.370 1.00 63.99 C ATOM 1711 O VAL A 744 16.780 37.835 103.920 1.00 56.60 O ATOM 1712 CB VAL A 744 14.853 36.416 105.903 1.00 73.60 C ATOM 1713 CG1 VAL A 744 15.846 37.101 106.847 1.00 71.28 C ATOM 1714 CG2 VAL A 744 13.564 36.084 106.640 1.00 81.32 C ATOM 1715 H VAL A 744 15.089 35.872 103.092 1.00 0.00 H ATOM 1716 N TRP A 745 15.498 39.546 104.636 1.00 62.98 N ATOM 1717 CA TRP A 745 16.566 40.537 104.507 1.00 62.85 C ATOM 1718 C TRP A 745 17.245 40.784 105.840 1.00 71.06 C ATOM 1719 O TRP A 745 16.583 41.126 106.823 1.00 79.30 O ATOM 1720 CB TRP A 745 16.027 41.860 103.952 1.00 71.02 C ATOM 1721 CG TRP A 745 17.053 42.977 103.901 1.00 71.33 C ATOM 1722 CD1 TRP A 745 17.055 44.118 104.649 1.00 74.84 C ATOM 1723 CD2 TRP A 745 18.224 43.048 103.063 1.00 68.60 C ATOM 1724 NE1 TRP A 745 18.145 44.896 104.329 1.00 77.41 N ATOM 1725 CE2 TRP A 745 18.881 44.264 103.362 1.00 65.97 C ATOM 1726 CE3 TRP A 745 18.771 42.209 102.086 1.00 59.34 C ATOM 1727 CZ2 TRP A 745 20.059 44.656 102.731 1.00 64.65 C ATOM 1728 CZ3 TRP A 745 19.946 42.596 101.458 1.00 67.57 C ATOM 1729 CH2 TRP A 745 20.576 43.810 101.780 1.00 69.17 C ATOM 1730 HE1 TRP A 745 18.373 45.817 104.754 1.00 0.00 H ATOM 1731 H TRP A 745 14.553 39.853 104.942 1.00 0.00 H ATOM 1732 N ASN A 746 18.563 40.598 105.871 1.00 62.70 N ATOM 1733 CA ASN A 746 19.375 40.906 107.050 1.00 71.15 C ATOM 1734 C ASN A 746 20.061 42.259 106.845 1.00 72.87 C ATOM 1735 O ASN A 746 21.068 42.353 106.105 1.00 69.36 O ATOM 1736 CB ASN A 746 20.422 39.816 107.290 1.00 71.86 C ATOM 1737 CG ASN A 746 21.065 39.924 108.653 1.00 80.20 C ATOM 1738 OD1 ASN A 746 22.036 40.657 108.846 1.00 84.20 O ATOM 1739 ND2 ASN A 746 20.514 39.202 109.618 1.00 84.25 N ATOM 1740 HD22 ASN A 746 19.695 38.596 109.411 1.00 0.00 H ATOM 1741 HD21 ASN A 746 20.901 39.241 110.583 1.00 0.00 H ATOM 1742 H ASN A 746 19.034 40.219 105.025 1.00 0.00 H ATOM 1743 N ALA A 747 19.497 43.295 107.468 1.00 71.08 N ATOM 1744 CA ALA A 747 19.933 44.664 107.237 1.00 79.36 C ATOM 1745 C ALA A 747 21.307 44.879 107.838 1.00 81.04 C ATOM 1746 O ALA A 747 22.105 45.659 107.317 1.00 83.48 O ATOM 1747 CB ALA A 747 18.935 45.656 107.821 1.00 78.58 C ATOM 1748 H ALA A 747 18.722 43.119 108.139 1.00 0.00 H ATOM 1749 N GLU A 748 21.576 44.176 108.934 1.00 79.45 N ATOM 1750 CA GLU A 748 22.803 44.372 109.692 1.00 82.19 C ATOM 1751 C GLU A 748 24.024 43.881 108.916 1.00 81.04 C ATOM 1752 O GLU A 748 25.077 44.518 108.933 1.00 84.83 O ATOM 1753 CB GLU A 748 22.693 43.673 111.047 1.00 82.65 C ATOM 1754 CG GLU A 748 23.628 44.179 112.104 1.00 82.91 C ATOM 1755 CD GLU A 748 23.167 43.775 113.479 1.00 94.60 C ATOM 1756 OE1 GLU A 748 22.372 42.818 113.554 1.00 93.82 O ATOM 1757 OE2 GLU A 748 23.577 44.420 114.474 1.00 99.47 O ATOM 1758 H GLU A 748 20.890 43.465 109.259 1.00 0.00 H ATOM 1759 N GLN A 749 23.879 42.753 108.233 1.00 76.94 N ATOM 1760 CA GLN A 749 24.976 42.189 107.448 1.00 74.53 C ATOM 1761 C GLN A 749 24.863 42.588 105.984 1.00 83.03 C ATOM 1762 O GLN A 749 25.773 42.318 105.201 1.00 87.47 O ATOM 1763 CB GLN A 749 24.996 40.659 107.541 1.00 68.52 C ATOM 1764 CG GLN A 749 25.153 40.103 108.949 1.00 78.46 C ATOM 1765 CD GLN A 749 26.483 40.478 109.555 1.00 84.15 C ATOM 1766 OE1 GLN A 749 27.522 40.378 108.898 1.00 87.13 O ATOM 1767 NE2 GLN A 749 26.459 40.939 110.802 1.00 83.09 N ATOM 1768 HE22 GLN A 749 25.557 41.004 111.315 1.00 0.00 H ATOM 1769 HE21 GLN A 749 27.343 41.234 111.264 1.00 0.00 H ATOM 1770 H GLN A 749 22.964 42.259 108.256 1.00 0.00 H ATOM 1771 N GLN A 750 23.739 43.210 105.626 1.00 82.20 N ATOM 1772 CA GLN A 750 23.447 43.605 104.242 1.00 80.58 C ATOM 1773 C GLN A 750 23.337 42.415 103.272 1.00 70.98 C ATOM 1774 O GLN A 750 23.847 42.467 102.152 1.00 62.56 O ATOM 1775 CB GLN A 750 24.472 44.630 103.738 1.00 82.88 C ATOM 1776 CG GLN A 750 24.497 45.908 104.549 1.00 86.19 C ATOM 1777 CD GLN A 750 23.229 46.701 104.367 1.00 92.66 C ATOM 1778 OE1 GLN A 750 22.982 47.260 103.294 1.00 97.02 O ATOM 1779 NE2 GLN A 750 22.406 46.747 105.409 1.00 93.86 N ATOM 1780 HE22 GLN A 750 22.658 46.260 106.293 1.00 0.00 H ATOM 1781 HE21 GLN A 750 21.510 47.270 105.341 1.00 0.00 H ATOM 1782 H GLN A 750 23.036 43.426 106.362 1.00 0.00 H ATOM 1783 N ARG A 751 22.637 41.365 103.700 1.00 70.46 N ATOM 1784 CA ARG A 751 22.577 40.106 102.940 1.00 60.71 C ATOM 1785 C ARG A 751 21.146 39.591 102.795 1.00 60.92 C ATOM 1786 O ARG A 751 20.295 39.848 103.640 1.00 65.08 O ATOM 1787 CB ARG A 751 23.362 38.998 103.662 1.00 60.37 C ATOM 1788 CG ARG A 751 24.732 39.363 104.207 1.00 66.68 C ATOM 1789 CD ARG A 751 25.367 38.156 104.899 1.00 69.05 C ATOM 1790 NE ARG A 751 24.438 37.515 105.831 1.00 78.07 N ATOM 1791 CZ ARG A 751 24.797 36.862 106.940 1.00 85.77 C ATOM 1792 NH1 ARG A 751 26.080 36.751 107.275 1.00 86.65 N ATOM 1793 NH2 ARG A 751 23.864 36.327 107.724 1.00 85.81 N ATOM 1794 HE ARG A 751 23.423 37.572 105.614 1.00 0.00 H ATOM 1795 HH12 ARG A 751 26.349 36.241 108.140 1.00 0.00 H ATOM 1796 HH11 ARG A 751 26.814 37.175 106.672 1.00 0.00 H ATOM 1797 HH22 ARG A 751 24.140 35.818 108.588 1.00 0.00 H ATOM 1798 HH21 ARG A 751 22.859 36.418 107.473 1.00 0.00 H ATOM 1799 H ARG A 751 22.117 41.437 104.598 1.00 0.00 H ATOM 1800 N ILE A 752 20.884 38.819 101.748 1.00 59.50 N ATOM 1801 CA ILE A 752 19.584 38.148 101.625 1.00 59.19 C ATOM 1802 C ILE A 752 19.697 36.626 101.786 1.00 56.57 C ATOM 1803 O ILE A 752 20.710 36.017 101.396 1.00 56.47 O ATOM 1804 CB ILE A 752 18.891 38.483 100.285 1.00 60.19 C ATOM 1805 CG1 ILE A 752 17.456 37.943 100.264 1.00 58.59 C ATOM 1806 CG2 ILE A 752 19.713 37.975 99.089 1.00 49.73 C ATOM 1807 CD1 ILE A 752 16.672 38.371 99.061 1.00 58.63 C ATOM 1808 H ILE A 752 21.605 38.688 101.009 1.00 0.00 H ATOM 1809 N LEU A 753 18.661 36.027 102.373 1.00 55.15 N ATOM 1810 CA LEU A 753 18.641 34.599 102.663 1.00 57.07 C ATOM 1811 C LEU A 753 17.314 33.945 102.270 1.00 58.64 C ATOM 1812 O LEU A 753 16.238 34.325 102.770 1.00 54.79 O ATOM 1813 CB LEU A 753 18.901 34.351 104.159 1.00 62.13 C ATOM 1814 CG LEU A 753 18.865 32.878 104.593 1.00 61.52 C ATOM 1815 CD1 LEU A 753 20.142 32.118 104.132 1.00 49.29 C ATOM 1816 CD2 LEU A 753 18.594 32.696 106.091 1.00 51.01 C ATOM 1817 H LEU A 753 17.834 36.601 102.634 1.00 0.00 H ATOM 1818 N TRP A 754 17.401 32.964 101.368 1.00 57.70 N ATOM 1819 CA TRP A 754 16.255 32.129 101.014 1.00 56.02 C ATOM 1820 C TRP A 754 16.439 30.804 101.681 1.00 49.48 C ATOM 1821 O TRP A 754 17.540 30.262 101.643 1.00 51.70 O ATOM 1822 CB TRP A 754 16.218 31.849 99.504 1.00 54.64 C ATOM 1823 CG TRP A 754 15.522 32.881 98.671 1.00 51.09 C ATOM 1824 CD1 TRP A 754 14.173 33.061 98.525 1.00 49.00 C ATOM 1825 CD2 TRP A 754 16.151 33.858 97.855 1.00 50.42 C ATOM 1826 NE1 TRP A 754 13.932 34.113 97.675 1.00 56.14 N ATOM 1827 CE2 TRP A 754 15.137 34.613 97.243 1.00 53.80 C ATOM 1828 CE3 TRP A 754 17.484 34.173 97.580 1.00 52.66 C ATOM 1829 CZ2 TRP A 754 15.415 35.665 96.377 1.00 56.97 C ATOM 1830 CZ3 TRP A 754 17.760 35.212 96.702 1.00 50.75 C ATOM 1831 CH2 TRP A 754 16.737 35.944 96.120 1.00 52.35 C ATOM 1832 HE1 TRP A 754 12.994 34.471 97.404 1.00 0.00 H ATOM 1833 H TRP A 754 18.314 32.789 100.902 1.00 0.00 H ATOM 1834 N LYS A 755 15.371 30.264 102.261 1.00 51.26 N ATOM 1835 CA LYS A 755 15.402 28.915 102.823 1.00 52.23 C ATOM 1836 C LYS A 755 14.359 27.992 102.164 1.00 57.82 C ATOM 1837 O LYS A 755 13.177 28.306 102.134 1.00 63.34 O ATOM 1838 CB LYS A 755 15.191 28.976 104.337 1.00 58.78 C ATOM 1839 CG LYS A 755 16.339 29.631 105.097 1.00 64.95 C ATOM 1840 CD LYS A 755 16.020 29.823 106.588 1.00 75.20 C ATOM 1841 CE LYS A 755 16.084 28.509 107.367 1.00 80.42 C ATOM 1842 NZ LYS A 755 15.835 28.687 108.831 1.00 84.19 N ATOM 1843 HZ1 LYS A 755 16.553 29.327 109.228 1.00 0.00 H ATOM 1844 HZ2 LYS A 755 14.889 29.094 108.973 1.00 0.00 H ATOM 1845 HZ3 LYS A 755 15.891 27.763 109.306 1.00 0.00 H ATOM 1846 H LYS A 755 14.491 30.816 102.316 1.00 0.00 H ATOM 1847 N ILE A 756 14.801 26.853 101.637 1.00 61.23 N ATOM 1848 CA ILE A 756 13.887 25.831 101.113 1.00 63.58 C ATOM 1849 C ILE A 756 14.072 24.533 101.900 1.00 66.46 C ATOM 1850 O ILE A 756 15.181 23.983 101.954 1.00 66.17 O ATOM 1851 CB ILE A 756 14.140 25.567 99.616 1.00 57.32 C ATOM 1852 CG1 ILE A 756 14.080 26.877 98.840 1.00 48.84 C ATOM 1853 CG2 ILE A 756 13.144 24.542 99.071 1.00 60.80 C ATOM 1854 CD1 ILE A 756 14.313 26.698 97.378 1.00 46.38 C ATOM 1855 H ILE A 756 15.826 26.682 101.595 1.00 0.00 H ATOM 1856 N PRO A 757 12.996 24.049 102.531 1.00 72.16 N ATOM 1857 CA PRO A 757 13.140 22.924 103.465 1.00 76.88 C ATOM 1858 C PRO A 757 13.520 21.630 102.747 1.00 80.34 C ATOM 1859 O PRO A 757 14.279 20.816 103.301 1.00 81.54 O ATOM 1860 CB PRO A 757 11.739 22.798 104.086 1.00 72.91 C ATOM 1861 CG PRO A 757 11.123 24.142 103.899 1.00 73.66 C ATOM 1862 CD PRO A 757 11.639 24.611 102.555 1.00 73.05 C ATOM 1863 N ASP A 758 12.998 21.435 101.538 1.00 76.56 N ATOM 1864 CA ASP A 758 13.283 20.208 100.811 1.00 76.69 C ATOM 1865 C ASP A 758 13.346 20.451 99.322 1.00 71.70 C ATOM 1866 O ASP A 758 12.497 21.159 98.757 1.00 73.43 O ATOM 1867 CB ASP A 758 12.230 19.140 101.097 1.00 87.20 C ATOM 1868 CG ASP A 758 12.107 18.831 102.566 1.00100.70 C ATOM 1869 OD1 ASP A 758 13.014 18.152 103.095 1.00100.76 O ATOM 1870 OD2 ASP A 758 11.112 19.278 103.190 1.00108.97 O ATOM 1871 H ASP A 758 12.386 22.161 101.113 1.00 0.00 H ATOM 1872 N ILE A 759 14.369 19.867 98.702 1.00 59.35 N ATOM 1873 CA ILE A 759 14.446 19.794 97.257 1.00 53.68 C ATOM 1874 C ILE A 759 14.672 18.343 96.846 1.00 55.97 C ATOM 1875 O ILE A 759 15.647 17.728 97.277 1.00 57.81 O ATOM 1876 CB ILE A 759 15.587 20.659 96.706 1.00 47.26 C ATOM 1877 CG1 ILE A 759 15.512 22.077 97.274 1.00 43.78 C ATOM 1878 CG2 ILE A 759 15.527 20.699 95.200 1.00 47.38 C ATOM 1879 CD1 ILE A 759 16.413 23.061 96.582 1.00 40.59 C ATOM 1880 H ILE A 759 15.134 19.452 99.271 1.00 0.00 H ATOM 1881 N SER A 760 13.768 17.799 96.030 1.00 59.27 N ATOM 1882 CA SER A 760 13.890 16.428 95.499 1.00 62.71 C ATOM 1883 C SER A 760 13.095 16.278 94.191 1.00 62.79 C ATOM 1884 O SER A 760 12.499 17.246 93.708 1.00 61.33 O ATOM 1885 CB SER A 760 13.374 15.420 96.516 1.00 64.12 C ATOM 1886 OG SER A 760 11.988 15.631 96.764 1.00 66.85 O ATOM 1887 HG SER A 760 11.668 14.969 97.426 1.00 0.00 H ATOM 1888 H SER A 760 12.941 18.366 95.756 1.00 0.00 H ATOM 1889 N GLN A 761 13.081 15.084 93.608 1.00 66.70 N ATOM 1890 CA GLN A 761 12.249 14.868 92.417 1.00 75.27 C ATOM 1891 C GLN A 761 10.798 15.068 92.770 1.00 77.62 C ATOM 1892 O GLN A 761 10.001 15.476 91.930 1.00 79.19 O ATOM 1893 CB GLN A 761 12.390 13.454 91.870 1.00 78.04 C ATOM 1894 CG GLN A 761 13.712 13.145 91.240 1.00 79.81 C ATOM 1895 CD GLN A 761 13.878 11.659 91.051 1.00 89.85 C ATOM 1896 OE1 GLN A 761 13.002 10.867 91.434 1.00 97.87 O ATOM 1897 NE2 GLN A 761 14.996 11.263 90.462 1.00 86.89 N ATOM 1898 HE22 GLN A 761 15.701 11.965 90.159 1.00 0.00 H ATOM 1899 HE21 GLN A 761 15.169 10.250 90.303 1.00 0.00 H ATOM 1900 H GLN A 761 13.656 14.307 93.993 1.00 0.00 H ATOM 1901 N LYS A 762 10.471 14.749 94.020 1.00 79.22 N ATOM 1902 CA LYS A 762 9.109 14.847 94.527 1.00 86.46 C ATOM 1903 C LYS A 762 8.833 16.244 95.092 1.00 82.54 C ATOM 1904 O LYS A 762 7.885 16.427 95.849 1.00 77.47 O ATOM 1905 CB LYS A 762 8.844 13.775 95.598 1.00 90.96 C ATOM 1906 CG LYS A 762 9.214 12.343 95.192 1.00 95.62 C ATOM 1907 CD LYS A 762 8.654 11.964 93.819 1.00101.94 C ATOM 1908 CE LYS A 762 9.133 10.577 93.372 1.00103.45 C ATOM 1909 NZ LYS A 762 8.785 10.316 91.946 1.00105.02 N ATOM 1910 HZ1 LYS A 762 7.753 10.364 91.828 1.00 0.00 H ATOM 1911 HZ2 LYS A 762 9.237 11.033 91.343 1.00 0.00 H ATOM 1912 HZ3 LYS A 762 9.123 9.370 91.675 1.00 0.00 H ATOM 1913 H LYS A 762 11.219 14.416 94.661 1.00 0.00 H ATOM 1914 N SER A 763 9.663 17.219 94.709 1.00 83.96 N ATOM 1915 CA SER A 763 9.488 18.620 95.109 1.00 87.13 C ATOM 1916 C SER A 763 8.479 19.319 94.178 1.00 94.72 C ATOM 1917 O SER A 763 8.025 18.711 93.205 1.00 94.70 O ATOM 1918 CB SER A 763 10.838 19.348 95.108 1.00 83.42 C ATOM 1919 OG SER A 763 10.928 20.283 96.167 1.00 85.10 O ATOM 1920 HG SER A 763 11.810 20.732 96.135 1.00 0.00 H ATOM 1921 H SER A 763 10.469 16.974 94.100 1.00 0.00 H ATOM 1922 N GLU A 764 8.152 20.588 94.476 1.00101.61 N ATOM 1923 CA GLU A 764 7.024 21.335 93.857 1.00108.55 C ATOM 1924 C GLU A 764 7.101 21.382 92.326 1.00109.19 C ATOM 1925 O GLU A 764 6.084 21.556 91.643 1.00111.32 O ATOM 1926 CB GLU A 764 6.921 22.782 94.439 1.00139.88 C ATOM 1927 CG GLU A 764 5.597 23.589 94.136 1.00139.31 C ATOM 1928 CD GLU A 764 5.623 25.068 94.604 1.00125.48 C ATOM 1929 OE1 GLU A 764 6.725 25.633 94.768 1.00124.27 O ATOM 1930 OE2 GLU A 764 4.541 25.671 94.801 1.00126.72 O ATOM 1931 H GLU A 764 8.727 21.082 95.188 1.00 0.00 H ATOM 1932 N ASN A 765 8.310 21.184 91.802 1.00105.81 N ATOM 1933 CA ASN A 765 8.615 21.501 90.416 1.00103.45 C ATOM 1934 C ASN A 765 9.570 20.510 89.735 1.00 99.31 C ATOM 1935 O ASN A 765 10.061 20.776 88.635 1.00102.62 O ATOM 1936 CB ASN A 765 9.202 22.912 90.372 1.00103.47 C ATOM 1937 CG ASN A 765 9.872 23.315 91.701 1.00100.72 C ATOM 1938 OD1 ASN A 765 10.415 22.470 92.424 1.00 95.90 O ATOM 1939 ND2 ASN A 765 9.829 24.610 92.019 1.00100.43 N ATOM 1940 HD22 ASN A 765 9.362 25.287 91.382 1.00 0.00 H ATOM 1941 HD21 ASN A 765 10.262 24.943 92.904 1.00 0.00 H ATOM 1942 H ASN A 765 9.060 20.790 92.404 1.00 0.00 H ATOM 1943 N GLY A 766 9.834 19.377 90.386 1.00 88.59 N ATOM 1944 CA GLY A 766 10.740 18.385 89.838 1.00 77.70 C ATOM 1945 C GLY A 766 12.133 18.598 90.386 1.00 67.16 C ATOM 1946 O GLY A 766 13.055 17.811 90.139 1.00 67.75 O ATOM 1947 H GLY A 766 9.381 19.201 91.306 1.00 0.00 H ATOM 1948 N GLY A 767 12.280 19.680 91.140 1.00 60.38 N ATOM 1949 CA GLY A 767 13.534 19.991 91.796 1.00 55.11 C ATOM 1950 C GLY A 767 14.243 21.163 91.137 1.00 51.59 C ATOM 1951 O GLY A 767 15.342 21.560 91.549 1.00 46.35 O ATOM 1952 H GLY A 767 11.472 20.323 91.264 1.00 0.00 H ATOM 1953 N VAL A 768 13.588 21.711 90.118 1.00 55.45 N ATOM 1954 CA VAL A 768 14.134 22.740 89.250 1.00 57.04 C ATOM 1955 C VAL A 768 13.401 24.052 89.488 1.00 59.69 C ATOM 1956 O VAL A 768 12.194 24.121 89.254 1.00 62.11 O ATOM 1957 CB VAL A 768 13.854 22.366 87.767 1.00 75.03 C ATOM 1958 CG1 VAL A 768 14.127 23.538 86.846 1.00 50.87 C ATOM 1959 CG2 VAL A 768 14.651 21.153 87.359 1.00 73.97 C ATOM 1960 H VAL A 768 12.620 21.381 89.930 1.00 0.00 H ATOM 1961 N GLY A 769 14.093 25.109 89.909 1.00 59.77 N ATOM 1962 CA GLY A 769 13.383 26.370 90.133 1.00 54.72 C ATOM 1963 C GLY A 769 14.258 27.611 90.209 1.00 49.08 C ATOM 1964 O GLY A 769 15.491 27.496 90.168 1.00 44.56 O ATOM 1965 H GLY A 769 15.117 25.040 90.075 1.00 0.00 H ATOM 1966 N SER A 770 13.624 28.782 90.341 1.00 52.71 N ATOM 1967 CA SER A 770 14.329 30.074 90.383 1.00 57.44 C ATOM 1968 C SER A 770 14.072 30.897 91.646 1.00 55.95 C ATOM 1969 O SER A 770 12.964 30.906 92.166 1.00 64.08 O ATOM 1970 CB SER A 770 13.934 30.939 89.181 1.00 61.60 C ATOM 1971 OG SER A 770 14.456 30.420 87.971 1.00 65.77 O ATOM 1972 HG SER A 770 15.444 30.391 88.025 1.00 0.00 H ATOM 1973 H SER A 770 12.587 28.779 90.417 1.00 0.00 H ATOM 1974 N LEU A 771 15.090 31.619 92.103 1.00 50.84 N ATOM 1975 CA LEU A 771 14.917 32.630 93.137 1.00 52.99 C ATOM 1976 C LEU A 771 15.163 34.022 92.540 1.00 55.81 C ATOM 1977 O LEU A 771 16.241 34.261 91.978 1.00 56.40 O ATOM 1978 CB LEU A 771 15.895 32.379 94.285 1.00 51.49 C ATOM 1979 CG LEU A 771 16.056 30.933 94.767 1.00 50.03 C ATOM 1980 CD1 LEU A 771 17.263 30.817 95.669 1.00 40.11 C ATOM 1981 CD2 LEU A 771 14.786 30.423 95.459 1.00 44.49 C ATOM 1982 H LEU A 771 16.039 31.457 91.710 1.00 0.00 H ATOM 1983 N LEU A 772 14.182 34.927 92.675 1.00 58.62 N ATOM 1984 CA LEU A 772 14.240 36.289 92.103 1.00 62.60 C ATOM 1985 C LEU A 772 14.258 37.391 93.163 1.00 64.96 C ATOM 1986 O LEU A 772 13.563 37.291 94.178 1.00 66.17 O ATOM 1987 CB LEU A 772 13.023 36.554 91.222 1.00 67.14 C ATOM 1988 CG LEU A 772 12.834 35.817 89.889 1.00 74.86 C ATOM 1989 CD1 LEU A 772 14.142 35.791 89.097 1.00 73.12 C ATOM 1990 CD2 LEU A 772 12.261 34.401 90.085 1.00 76.59 C ATOM 1991 H LEU A 772 13.334 34.655 93.212 1.00 0.00 H ATOM 1992 N ALA A 773 15.010 38.466 92.915 1.00 66.68 N ATOM 1993 CA ALA A 773 14.908 39.638 93.798 1.00 67.12 C ATOM 1994 C ALA A 773 15.311 40.968 93.164 1.00 68.20 C ATOM 1995 O ALA A 773 16.296 41.022 92.430 1.00 71.45 O ATOM 1996 CB ALA A 773 15.722 39.412 95.069 1.00 66.55 C ATOM 1997 H ALA A 773 15.662 38.475 92.105 1.00 0.00 H ATOM 1998 N ARG A 774 14.586 42.047 93.474 1.00 69.56 N ATOM 1999 CA ARG A 774 15.028 43.382 93.046 1.00 78.55 C ATOM 2000 C ARG A 774 15.341 44.304 94.240 1.00 82.37 C ATOM 2001 O ARG A 774 14.603 44.333 95.230 1.00 81.40 O ATOM 2002 CB ARG A 774 13.984 44.034 92.129 1.00 89.60 C ATOM 2003 CG ARG A 774 14.498 45.199 91.272 1.00 95.71 C ATOM 2004 CD ARG A 774 13.353 45.863 90.508 1.00104.16 C ATOM 2005 NE ARG A 774 13.800 46.815 89.490 1.00113.12 N ATOM 2006 CZ ARG A 774 13.832 46.555 88.184 1.00120.15 C ATOM 2007 NH1 ARG A 774 13.450 45.365 87.735 1.00119.62 N ATOM 2008 NH2 ARG A 774 14.244 47.482 87.321 1.00125.05 N ATOM 2009 HE ARG A 774 14.113 47.755 89.807 1.00 0.00 H ATOM 2010 HH12 ARG A 774 13.475 45.161 86.715 1.00 0.00 H ATOM 2011 HH11 ARG A 774 13.126 44.637 88.403 1.00 0.00 H ATOM 2012 HH22 ARG A 774 14.266 47.271 86.303 1.00 0.00 H ATOM 2013 HH21 ARG A 774 14.544 48.417 87.665 1.00 0.00 H ATOM 2014 H ARG A 774 13.707 41.942 94.019 1.00 0.00 H ATOM 2015 N PHE A 775 16.434 45.060 94.137 1.00 85.91 N ATOM 2016 CA PHE A 775 16.871 45.979 95.194 1.00 82.61 C ATOM 2017 C PHE A 775 16.992 47.428 94.718 1.00 87.48 C ATOM 2018 O PHE A 775 17.526 47.713 93.638 1.00 90.85 O ATOM 2019 CB PHE A 775 18.223 45.546 95.764 1.00 73.14 C ATOM 2020 CG PHE A 775 18.277 44.105 96.166 1.00 67.70 C ATOM 2021 CD1 PHE A 775 17.883 43.713 97.427 1.00 66.20 C ATOM 2022 CD2 PHE A 775 18.730 43.135 95.285 1.00 63.41 C ATOM 2023 CE1 PHE A 775 17.935 42.390 97.798 1.00 61.38 C ATOM 2024 CE2 PHE A 775 18.780 41.789 95.664 1.00 54.90 C ATOM 2025 CZ PHE A 775 18.383 41.429 96.906 1.00 53.23 C ATOM 2026 H PHE A 775 17.002 44.996 93.269 1.00 0.00 H ATOM 2027 N GLN A 776 16.504 48.338 95.552 1.00 90.22 N ATOM 2028 CA GLN A 776 16.717 49.760 95.360 1.00 93.02 C ATOM 2029 C GLN A 776 17.942 50.220 96.139 1.00 86.57 C ATOM 2030 O GLN A 776 18.166 49.794 97.269 1.00 84.43 O ATOM 2031 CB GLN A 776 15.480 50.536 95.787 1.00105.23 C ATOM 2032 CG GLN A 776 14.335 50.399 94.803 1.00113.98 C ATOM 2033 CD GLN A 776 14.698 50.932 93.434 1.00119.69 C ATOM 2034 OE1 GLN A 776 15.379 51.955 93.319 1.00121.92 O ATOM 2035 NE2 GLN A 776 14.258 50.237 92.386 1.00120.79 N ATOM 2036 HE22 GLN A 776 13.687 49.380 92.533 1.00 0.00 H ATOM 2037 HE21 GLN A 776 14.486 50.551 91.421 1.00 0.00 H ATOM 2038 H GLN A 776 15.949 48.020 96.372 1.00 0.00 H ATOM 2039 N LEU A 777 18.736 51.090 95.520 1.00 89.19 N ATOM 2040 CA LEU A 777 20.022 51.508 96.074 1.00 91.39 C ATOM 2041 C LEU A 777 20.111 53.020 96.317 1.00 94.84 C ATOM 2042 O LEU A 777 19.362 53.807 95.719 1.00 95.89 O ATOM 2043 CB LEU A 777 21.155 51.072 95.142 1.00 93.21 C ATOM 2044 CG LEU A 777 21.606 49.610 95.163 1.00 90.76 C ATOM 2045 CD1 LEU A 777 20.543 48.648 94.649 1.00 83.93 C ATOM 2046 CD2 LEU A 777 22.867 49.481 94.337 1.00 94.23 C ATOM 2047 H LEU A 777 18.430 51.487 94.609 1.00 0.00 H ATOM 2048 N SER A 778 21.037 53.417 97.191 1.00 93.81 N ATOM 2049 CA SER A 778 21.249 54.828 97.510 1.00 98.85 C ATOM 2050 C SER A 778 22.713 55.213 97.295 1.00100.13 C ATOM 2051 O SER A 778 23.058 56.386 97.114 1.00 94.75 O ATOM 2052 CB SER A 778 20.840 55.111 98.955 1.00 92.61 C ATOM 2053 OG SER A 778 21.670 54.423 99.877 1.00 90.40 O ATOM 2054 HG SER A 778 21.601 53.448 99.717 1.00 0.00 H ATOM 2055 H SER A 778 21.627 52.700 97.660 1.00 0.00 H ATOM 2056 N GLU A 779 23.572 54.202 97.336 1.00 97.04 N ATOM 2057 CA GLU A 779 25.001 54.395 97.162 1.00 99.44 C ATOM 2058 C GLU A 779 25.462 53.320 96.187 1.00 94.79 C ATOM 2059 O GLU A 779 26.399 52.563 96.459 1.00 94.17 O ATOM 2060 CB GLU A 779 25.720 54.302 98.515 1.00101.99 C ATOM 2061 CG GLU A 779 24.985 55.072 99.618 1.00109.13 C ATOM 2062 CD GLU A 779 25.710 55.101 100.944 1.00112.29 C ATOM 2063 OE1 GLU A 779 25.566 56.116 101.682 1.00115.64 O ATOM 2064 OE2 GLU A 779 26.409 54.107 101.243 1.00108.49 O ATOM 2065 H GLU A 779 23.210 53.241 97.498 1.00 0.00 H ATOM 2066 N GLY A 780 24.770 53.257 95.050 1.00 91.62 N ATOM 2067 CA GLY A 780 25.044 52.271 94.025 1.00 86.47 C ATOM 2068 C GLY A 780 26.147 52.677 93.074 1.00 91.65 C ATOM 2069 O GLY A 780 26.670 53.791 93.165 1.00 95.94 O ATOM 2070 H GLY A 780 24.004 53.942 94.893 1.00 0.00 H ATOM 2071 N PRO A 781 26.491 51.780 92.130 1.00 93.29 N ATOM 2072 CA PRO A 781 25.816 50.495 91.887 1.00 90.85 C ATOM 2073 C PRO A 781 26.388 49.405 92.776 1.00 85.90 C ATOM 2074 O PRO A 781 27.407 49.649 93.419 1.00 89.20 O ATOM 2075 CB PRO A 781 26.200 50.191 90.445 1.00 87.77 C ATOM 2076 CG PRO A 781 27.610 50.697 90.364 1.00 86.80 C ATOM 2077 CD PRO A 781 27.642 51.958 91.223 1.00 91.84 C ATOM 2078 N SER A 782 25.773 48.227 92.813 1.00 81.05 N ATOM 2079 CA SER A 782 26.326 47.144 93.639 1.00 79.63 C ATOM 2080 C SER A 782 27.307 46.221 92.893 1.00 77.99 C ATOM 2081 O SER A 782 27.157 45.996 91.690 1.00 77.94 O ATOM 2082 CB SER A 782 25.228 46.343 94.384 1.00 72.75 C ATOM 2083 OG SER A 782 24.075 46.078 93.605 1.00 67.36 O ATOM 2084 HG SER A 782 23.668 46.934 93.318 1.00 0.00 H ATOM 2085 H SER A 782 24.905 48.072 92.261 1.00 0.00 H ATOM 2086 N LYS A 783 28.328 45.732 93.607 1.00 76.40 N ATOM 2087 CA LYS A 783 29.277 44.744 93.074 1.00 71.64 C ATOM 2088 C LYS A 783 28.778 43.335 93.363 1.00 71.34 C ATOM 2089 O LYS A 783 28.555 42.991 94.526 1.00 78.23 O ATOM 2090 CB LYS A 783 30.656 44.895 93.724 1.00 70.66 C ATOM 2091 CG LYS A 783 31.698 45.628 92.885 1.00 79.37 C ATOM 2092 CD LYS A 783 32.259 46.861 93.619 1.00 85.50 C ATOM 2093 CE LYS A 783 33.046 47.783 92.672 1.00 87.08 C ATOM 2094 NZ LYS A 783 33.661 48.973 93.363 1.00 87.96 N ATOM 2095 HZ1 LYS A 783 32.910 49.544 93.801 1.00 0.00 H ATOM 2096 HZ2 LYS A 783 34.321 48.644 94.097 1.00 0.00 H ATOM 2097 HZ3 LYS A 783 34.175 49.549 92.666 1.00 0.00 H ATOM 2098 H LYS A 783 28.456 46.066 94.583 1.00 0.00 H ATOM 2099 N PRO A 784 28.610 42.514 92.311 1.00 63.72 N ATOM 2100 CA PRO A 784 28.161 41.123 92.465 1.00 57.27 C ATOM 2101 C PRO A 784 28.980 40.373 93.507 1.00 58.71 C ATOM 2102 O PRO A 784 30.195 40.542 93.602 1.00 63.36 O ATOM 2103 CB PRO A 784 28.416 40.525 91.086 1.00 57.64 C ATOM 2104 CG PRO A 784 28.307 41.712 90.135 1.00 57.41 C ATOM 2105 CD PRO A 784 28.849 42.883 90.899 1.00 58.67 C ATOM 2106 N SER A 785 28.305 39.551 94.294 1.00 54.20 N ATOM 2107 CA SER A 785 28.951 38.810 95.355 1.00 51.76 C ATOM 2108 C SER A 785 28.662 37.340 95.181 1.00 54.06 C ATOM 2109 O SER A 785 27.717 36.962 94.482 1.00 64.25 O ATOM 2110 CB SER A 785 28.405 39.255 96.692 1.00 55.84 C ATOM 2111 OG SER A 785 29.375 40.056 97.307 1.00 72.92 O ATOM 2112 HG SER A 785 29.040 40.361 98.187 1.00 0.00 H ATOM 2113 H SER A 785 27.282 39.435 94.146 1.00 0.00 H ATOM 2114 N PRO A 786 29.494 36.498 95.790 1.00 46.78 N ATOM 2115 CA PRO A 786 29.268 35.055 95.693 1.00 47.15 C ATOM 2116 C PRO A 786 27.999 34.619 96.432 1.00 50.06 C ATOM 2117 O PRO A 786 27.806 34.949 97.605 1.00 54.38 O ATOM 2118 CB PRO A 786 30.497 34.461 96.407 1.00 39.27 C ATOM 2119 CG PRO A 786 31.536 35.543 96.378 1.00 40.21 C ATOM 2120 CD PRO A 786 30.800 36.836 96.398 1.00 44.96 C ATOM 2121 N LEU A 787 27.147 33.865 95.754 1.00 45.65 N ATOM 2122 CA LEU A 787 26.110 33.135 96.458 1.00 44.22 C ATOM 2123 C LEU A 787 26.710 31.953 97.216 1.00 44.90 C ATOM 2124 O LEU A 787 27.477 31.182 96.653 1.00 47.94 O ATOM 2125 CB LEU A 787 25.093 32.619 95.467 1.00 47.03 C ATOM 2126 CG LEU A 787 24.259 31.399 95.866 1.00 45.36 C ATOM 2127 CD1 LEU A 787 23.375 31.652 97.119 1.00 47.15 C ATOM 2128 CD2 LEU A 787 23.445 30.970 94.640 1.00 35.60 C ATOM 2129 H LEU A 787 27.221 33.796 94.719 1.00 0.00 H ATOM 2130 N VAL A 788 26.360 31.818 98.488 1.00 42.51 N ATOM 2131 CA VAL A 788 26.793 30.700 99.291 1.00 39.77 C ATOM 2132 C VAL A 788 25.590 29.817 99.554 1.00 43.96 C ATOM 2133 O VAL A 788 24.496 30.303 99.836 1.00 46.96 O ATOM 2134 CB VAL A 788 27.335 31.152 100.658 1.00 45.88 C ATOM 2135 CG1 VAL A 788 28.119 30.023 101.311 1.00 34.14 C ATOM 2136 CG2 VAL A 788 28.227 32.369 100.496 1.00 35.39 C ATOM 2137 H VAL A 788 25.753 32.543 98.922 1.00 0.00 H ATOM 2138 N VAL A 789 25.805 28.513 99.459 1.00 41.66 N ATOM 2139 CA VAL A 789 24.739 27.553 99.589 1.00 35.91 C ATOM 2140 C VAL A 789 25.026 26.525 100.686 1.00 42.00 C ATOM 2141 O VAL A 789 26.189 26.185 101.006 1.00 39.85 O ATOM 2142 CB VAL A 789 24.479 26.880 98.258 1.00 41.48 C ATOM 2143 CG1 VAL A 789 23.468 25.743 98.395 1.00 48.39 C ATOM 2144 CG2 VAL A 789 23.960 27.906 97.271 1.00 42.01 C ATOM 2145 H VAL A 789 26.772 28.172 99.285 1.00 0.00 H ATOM 2146 N GLN A 790 23.948 26.068 101.303 1.00 49.29 N ATOM 2147 CA GLN A 790 24.068 25.099 102.363 1.00 47.38 C ATOM 2148 C GLN A 790 22.967 24.096 102.123 1.00 47.00 C ATOM 2149 O GLN A 790 21.902 24.455 101.612 1.00 41.67 O ATOM 2150 CB GLN A 790 23.909 25.787 103.705 1.00 50.64 C ATOM 2151 CG GLN A 790 25.023 25.510 104.641 1.00 60.80 C ATOM 2152 CD GLN A 790 26.252 26.372 104.421 1.00 66.20 C ATOM 2153 OE1 GLN A 790 26.148 27.583 104.237 1.00 66.04 O ATOM 2154 NE2 GLN A 790 27.439 25.745 104.478 1.00 68.40 N ATOM 2155 HE22 GLN A 790 27.477 24.718 104.636 1.00 0.00 H ATOM 2156 HE21 GLN A 790 28.319 26.287 104.364 1.00 0.00 H ATOM 2157 H GLN A 790 23.007 26.411 101.021 1.00 0.00 H ATOM 2158 N PHE A 791 23.253 22.836 102.441 1.00 47.54 N ATOM 2159 CA PHE A 791 22.254 21.774 102.404 1.00 46.45 C ATOM 2160 C PHE A 791 22.874 20.505 102.945 1.00 43.29 C ATOM 2161 O PHE A 791 24.093 20.328 102.888 1.00 43.60 O ATOM 2162 CB PHE A 791 21.683 21.559 100.980 1.00 48.16 C ATOM 2163 CG PHE A 791 22.700 21.129 99.956 1.00 44.45 C ATOM 2164 CD1 PHE A 791 23.171 19.819 99.924 1.00 40.63 C ATOM 2165 CD2 PHE A 791 23.157 22.025 98.999 1.00 42.76 C ATOM 2166 CE1 PHE A 791 24.115 19.423 98.972 1.00 41.15 C ATOM 2167 CE2 PHE A 791 24.084 21.626 98.025 1.00 45.07 C ATOM 2168 CZ PHE A 791 24.567 20.329 98.018 1.00 43.86 C ATOM 2169 H PHE A 791 24.225 22.600 102.726 1.00 0.00 H ATOM 2170 N THR A 792 22.035 19.622 103.476 1.00 45.74 N ATOM 2171 CA THR A 792 22.489 18.310 103.963 1.00 43.82 C ATOM 2172 C THR A 792 21.626 17.224 103.340 1.00 45.00 C ATOM 2173 O THR A 792 20.641 17.520 102.656 1.00 41.78 O ATOM 2174 CB THR A 792 22.397 18.176 105.501 1.00 50.06 C ATOM 2175 OG1 THR A 792 21.046 18.370 105.903 1.00 45.57 O ATOM 2176 CG2 THR A 792 23.279 19.183 106.205 1.00 43.17 C ATOM 2177 HG1 THR A 792 20.980 18.285 106.887 1.00 0.00 H ATOM 2178 H THR A 792 21.027 19.866 103.550 1.00 0.00 H ATOM 2179 N SER A 793 21.978 15.969 103.597 1.00 44.92 N ATOM 2180 CA SER A 793 21.273 14.867 102.965 1.00 49.34 C ATOM 2181 C SER A 793 21.627 13.592 103.661 1.00 48.42 C ATOM 2182 O SER A 793 22.782 13.419 104.011 1.00 52.77 O ATOM 2183 CB SER A 793 21.688 14.783 101.480 1.00 47.56 C ATOM 2184 OG SER A 793 21.116 13.662 100.838 1.00 47.41 O ATOM 2185 HG SER A 793 20.129 13.726 100.882 1.00 0.00 H ATOM 2186 H SER A 793 22.761 15.775 104.253 1.00 0.00 H ATOM 2187 N GLU A 794 20.640 12.708 103.841 1.00 52.77 N ATOM 2188 CA GLU A 794 20.820 11.397 104.488 1.00 58.53 C ATOM 2189 C GLU A 794 20.308 10.300 103.546 1.00 61.89 C ATOM 2190 O GLU A 794 19.314 10.508 102.845 1.00 53.66 O ATOM 2191 CB GLU A 794 20.052 11.313 105.823 1.00 65.60 C ATOM 2192 CG GLU A 794 20.458 12.334 106.904 1.00 80.44 C ATOM 2193 CD GLU A 794 19.866 12.031 108.300 1.00101.95 C ATOM 2194 OE1 GLU A 794 18.987 11.142 108.426 1.00108.92 O ATOM 2195 OE2 GLU A 794 20.288 12.685 109.285 1.00108.96 O ATOM 2196 H GLU A 794 19.689 12.961 103.504 1.00 0.00 H ATOM 2197 N GLY A 795 20.968 9.139 103.536 1.00 45.37 N ATOM 2198 CA GLY A 795 20.484 8.008 102.769 1.00 46.87 C ATOM 2199 C GLY A 795 21.331 7.577 101.569 1.00 54.69 C ATOM 2200 O GLY A 795 21.168 6.462 101.038 1.00 57.97 O ATOM 2201 H GLY A 795 21.844 9.045 104.088 1.00 0.00 H ATOM 2202 N SER A 796 22.246 8.437 101.132 1.00 52.67 N ATOM 2203 CA SER A 796 22.979 8.149 99.920 1.00 52.61 C ATOM 2204 C SER A 796 24.371 8.770 99.946 1.00 51.67 C ATOM 2205 O SER A 796 24.575 9.794 100.587 1.00 56.00 O ATOM 2206 CB SER A 796 22.164 8.662 98.731 1.00 53.60 C ATOM 2207 OG SER A 796 22.900 8.628 97.531 1.00 50.64 O ATOM 2208 HG SER A 796 23.705 9.197 97.623 1.00 0.00 H ATOM 2209 H SER A 796 22.434 9.313 101.660 1.00 0.00 H ATOM 2210 N THR A 797 25.333 8.140 99.274 1.00 46.84 N ATOM 2211 CA THR A 797 26.656 8.748 99.105 1.00 41.60 C ATOM 2212 C THR A 797 26.695 9.514 97.792 1.00 41.77 C ATOM 2213 O THR A 797 25.735 9.513 97.024 1.00 38.84 O ATOM 2214 CB THR A 797 27.795 7.704 99.055 1.00 41.42 C ATOM 2215 OG1 THR A 797 27.402 6.592 98.239 1.00 48.46 O ATOM 2216 CG2 THR A 797 28.097 7.185 100.420 1.00 41.52 C ATOM 2217 HG1 THR A 797 26.591 6.173 98.622 1.00 0.00 H ATOM 2218 H THR A 797 25.143 7.204 98.863 1.00 0.00 H ATOM 2219 N LEU A 798 27.815 10.177 97.545 1.00 41.91 N ATOM 2220 CA LEU A 798 28.116 10.706 96.223 1.00 44.65 C ATOM 2221 C LEU A 798 29.038 9.720 95.510 1.00 48.69 C ATOM 2222 O LEU A 798 28.957 9.537 94.303 1.00 47.13 O ATOM 2223 CB LEU A 798 28.758 12.081 96.321 1.00 28.99 C ATOM 2224 CG LEU A 798 27.788 13.132 96.871 1.00 36.87 C ATOM 2225 CD1 LEU A 798 28.393 14.519 96.876 1.00 33.49 C ATOM 2226 CD2 LEU A 798 26.451 13.143 96.111 1.00 30.77 C ATOM 2227 H LEU A 798 28.497 10.323 98.316 1.00 0.00 H ATOM 2228 N SER A 799 29.875 9.046 96.288 1.00 54.58 N ATOM 2229 CA SER A 799 30.867 8.128 95.762 1.00 50.57 C ATOM 2230 C SER A 799 30.296 6.827 95.250 1.00 51.68 C ATOM 2231 O SER A 799 30.866 6.237 94.346 1.00 58.08 O ATOM 2232 CB SER A 799 31.877 7.797 96.852 1.00 50.97 C ATOM 2233 OG SER A 799 31.215 7.158 97.915 1.00 47.23 O ATOM 2234 HG SER A 799 30.518 7.760 98.278 1.00 0.00 H ATOM 2235 H SER A 799 29.817 9.182 97.318 1.00 0.00 H ATOM 2236 N GLY A 800 29.191 6.356 95.815 1.00 51.71 N ATOM 2237 CA GLY A 800 28.683 5.041 95.439 1.00 52.76 C ATOM 2238 C GLY A 800 29.306 3.897 96.246 1.00 51.11 C ATOM 2239 O GLY A 800 28.984 2.720 96.043 1.00 50.89 O ATOM 2240 H GLY A 800 28.687 6.924 96.526 1.00 0.00 H ATOM 2241 N CYS A 801 30.204 4.244 97.161 1.00 46.08 N ATOM 2242 CA CYS A 801 30.761 3.274 98.122 1.00 46.62 C ATOM 2243 C CYS A 801 29.740 2.632 99.053 1.00 49.69 C ATOM 2244 O CYS A 801 28.708 3.232 99.359 1.00 54.98 O ATOM 2245 CB CYS A 801 31.838 3.936 98.972 1.00 40.44 C ATOM 2246 SG CYS A 801 33.283 4.390 97.989 1.00 74.67 S ATOM 2247 H CYS A 801 30.525 5.232 97.201 1.00 0.00 H ATOM 2248 N ASP A 802 30.024 1.388 99.447 1.00 51.35 N ATOM 2249 CA ASP A 802 29.283 0.659 100.482 1.00 51.34 C ATOM 2250 C ASP A 802 30.333 -0.135 101.242 1.00 52.64 C ATOM 2251 O ASP A 802 31.518 -0.168 100.846 1.00 46.73 O ATOM 2252 CB ASP A 802 28.218 -0.270 99.903 1.00 52.71 C ATOM 2253 CG ASP A 802 26.943 -0.321 100.762 1.00 68.68 C ATOM 2254 OD1 ASP A 802 27.014 0.011 101.967 1.00 71.90 O ATOM 2255 OD2 ASP A 802 25.864 -0.700 100.232 1.00 77.72 O ATOM 2256 H ASP A 802 30.823 0.904 98.990 1.00 0.00 H ATOM 2257 N ILE A 803 29.928 -0.757 102.345 1.00 52.57 N ATOM 2258 CA ILE A 803 30.882 -1.567 103.097 1.00 46.70 C ATOM 2259 C ILE A 803 30.335 -2.941 103.446 1.00 50.96 C ATOM 2260 O ILE A 803 29.136 -3.113 103.706 1.00 56.22 O ATOM 2261 CB ILE A 803 31.414 -0.823 104.339 1.00 45.39 C ATOM 2262 CG1 ILE A 803 32.612 -1.571 104.934 1.00 42.68 C ATOM 2263 CG2 ILE A 803 30.300 -0.580 105.364 1.00 48.38 C ATOM 2264 CD1 ILE A 803 33.015 -1.112 106.328 1.00 36.20 C ATOM 2265 H ILE A 803 28.944 -0.668 102.668 1.00 0.00 H ATOM 2266 N GLU A 804 31.207 -3.935 103.394 1.00 51.44 N ATOM 2267 CA GLU A 804 30.779 -5.293 103.692 1.00 53.65 C ATOM 2268 C GLU A 804 31.745 -5.845 104.718 1.00 54.93 C ATOM 2269 O GLU A 804 32.928 -5.533 104.677 1.00 56.14 O ATOM 2270 CB GLU A 804 30.760 -6.169 102.429 1.00 56.96 C ATOM 2271 CG GLU A 804 29.562 -5.961 101.509 1.00 67.26 C ATOM 2272 CD GLU A 804 29.561 -6.925 100.322 1.00 82.25 C ATOM 2273 OE1 GLU A 804 30.496 -7.758 100.250 1.00 85.49 O ATOM 2274 OE2 GLU A 804 28.631 -6.851 99.467 1.00 87.07 O ATOM 2275 H GLU A 804 32.198 -3.745 103.140 1.00 0.00 H ATOM 2276 N LEU A 805 31.245 -6.634 105.659 1.00 59.10 N ATOM 2277 CA LEU A 805 32.123 -7.322 106.600 1.00 56.39 C ATOM 2278 C LEU A 805 32.579 -8.639 106.011 1.00 55.95 C ATOM 2279 O LEU A 805 31.742 -9.430 105.591 1.00 58.65 O ATOM 2280 CB LEU A 805 31.371 -7.633 107.890 1.00 54.73 C ATOM 2281 CG LEU A 805 31.353 -6.559 108.964 1.00 53.05 C ATOM 2282 CD1 LEU A 805 30.422 -7.024 110.060 1.00 58.44 C ATOM 2283 CD2 LEU A 805 32.774 -6.313 109.501 1.00 44.98 C ATOM 2284 H LEU A 805 30.215 -6.764 105.727 1.00 0.00 H ATOM 2285 N VAL A 806 33.883 -8.899 105.985 1.00 54.90 N ATOM 2286 CA VAL A 806 34.328 -10.240 105.599 1.00 59.91 C ATOM 2287 C VAL A 806 34.837 -11.052 106.791 1.00 63.39 C ATOM 2288 O VAL A 806 35.596 -10.566 107.619 1.00 70.49 O ATOM 2289 CB VAL A 806 35.283 -10.263 104.343 1.00 60.46 C ATOM 2290 CG1 VAL A 806 36.033 -8.965 104.180 1.00 60.78 C ATOM 2291 CG2 VAL A 806 36.222 -11.443 104.376 1.00 61.64 C ATOM 2292 H VAL A 806 34.574 -8.163 106.234 1.00 0.00 H ATOM 2293 N GLY A 807 34.379 -12.290 106.887 1.00 65.06 N ATOM 2294 CA GLY A 807 34.766 -13.152 107.985 1.00 64.44 C ATOM 2295 C GLY A 807 33.691 -13.136 109.050 1.00 68.90 C ATOM 2296 O GLY A 807 32.728 -12.379 108.940 1.00 70.53 O ATOM 2297 H GLY A 807 33.729 -12.651 106.160 1.00 0.00 H ATOM 2298 N ALA A 808 33.853 -13.955 110.082 1.00 72.32 N ATOM 2299 CA ALA A 808 32.854 -14.025 111.144 1.00 76.63 C ATOM 2300 C ALA A 808 33.250 -13.189 112.356 1.00 72.82 C ATOM 2301 O ALA A 808 34.382 -12.677 112.423 1.00 68.73 O ATOM 2302 CB ALA A 808 32.600 -15.475 111.545 1.00 80.45 C ATOM 2303 H ALA A 808 34.702 -14.554 110.135 1.00 0.00 H ATOM 2304 N GLY A 809 32.313 -13.036 113.297 1.00 73.11 N ATOM 2305 CA GLY A 809 32.596 -12.353 114.552 1.00 70.42 C ATOM 2306 C GLY A 809 31.920 -11.009 114.777 1.00 70.83 C ATOM 2307 O GLY A 809 31.844 -10.534 115.924 1.00 70.04 O ATOM 2308 H GLY A 809 31.359 -13.414 113.129 1.00 0.00 H ATOM 2309 N TYR A 810 31.447 -10.386 113.692 1.00 69.51 N ATOM 2310 CA TYR A 810 30.802 -9.075 113.758 1.00 63.77 C ATOM 2311 C TYR A 810 29.642 -8.984 112.784 1.00 66.39 C ATOM 2312 O TYR A 810 29.653 -9.613 111.727 1.00 70.44 O ATOM 2313 CB TYR A 810 31.796 -7.966 113.424 1.00 57.70 C ATOM 2314 CG TYR A 810 33.093 -8.026 114.212 1.00 65.24 C ATOM 2315 CD1 TYR A 810 34.152 -8.809 113.776 1.00 64.04 C ATOM 2316 CD2 TYR A 810 33.265 -7.302 115.387 1.00 67.58 C ATOM 2317 CE1 TYR A 810 35.335 -8.881 114.483 1.00 58.59 C ATOM 2318 CE2 TYR A 810 34.465 -7.368 116.103 1.00 64.44 C ATOM 2319 CZ TYR A 810 35.497 -8.163 115.637 1.00 57.78 C ATOM 2320 OH TYR A 810 36.702 -8.252 116.307 1.00 52.78 O ATOM 2321 HH TYR A 810 37.305 -8.866 115.818 1.00 0.00 H ATOM 2322 H TYR A 810 31.541 -10.851 112.767 1.00 0.00 H ATOM 2323 N ARG A 811 28.639 -8.191 113.132 1.00 65.42 N ATOM 2324 CA ARG A 811 27.593 -7.856 112.176 1.00 66.44 C ATOM 2325 C ARG A 811 27.444 -6.346 112.184 1.00 66.97 C ATOM 2326 O ARG A 811 27.709 -5.707 113.212 1.00 65.07 O ATOM 2327 CB ARG A 811 26.260 -8.512 112.537 1.00 71.68 C ATOM 2328 CG ARG A 811 25.676 -8.037 113.865 1.00 80.85 C ATOM 2329 CD ARG A 811 24.330 -8.687 114.153 1.00 93.43 C ATOM 2330 NE ARG A 811 23.860 -8.413 115.512 1.00101.40 N ATOM 2331 CZ ARG A 811 23.048 -7.408 115.831 1.00104.88 C ATOM 2332 NH1 ARG A 811 22.619 -6.576 114.882 1.00102.71 N ATOM 2333 NH2 ARG A 811 22.666 -7.231 117.093 1.00104.90 N ATOM 2334 HE ARG A 811 24.180 -9.043 116.275 1.00 0.00 H ATOM 2335 HH12 ARG A 811 21.984 -5.790 115.128 1.00 0.00 H ATOM 2336 HH11 ARG A 811 22.919 -6.713 113.896 1.00 0.00 H ATOM 2337 HH22 ARG A 811 22.031 -6.445 117.339 1.00 0.00 H ATOM 2338 HH21 ARG A 811 23.002 -7.879 117.834 1.00 0.00 H ATOM 2339 H ARG A 811 28.599 -7.804 114.097 1.00 0.00 H ATOM 2340 N PHE A 812 27.051 -5.782 111.040 1.00 64.85 N ATOM 2341 CA PHE A 812 26.642 -4.384 110.968 1.00 63.33 C ATOM 2342 C PHE A 812 25.230 -4.179 111.470 1.00 71.58 C ATOM 2343 O PHE A 812 24.289 -4.760 110.929 1.00 79.79 O ATOM 2344 CB PHE A 812 26.733 -3.873 109.541 1.00 61.85 C ATOM 2345 CG PHE A 812 28.118 -3.519 109.146 1.00 58.14 C ATOM 2346 CD1 PHE A 812 28.953 -2.861 110.043 1.00 54.17 C ATOM 2347 CD2 PHE A 812 28.619 -3.882 107.916 1.00 57.22 C ATOM 2348 CE1 PHE A 812 30.265 -2.552 109.701 1.00 49.42 C ATOM 2349 CE2 PHE A 812 29.925 -3.583 107.576 1.00 53.64 C ATOM 2350 CZ PHE A 812 30.745 -2.919 108.471 1.00 50.77 C ATOM 2351 H PHE A 812 27.036 -6.357 110.174 1.00 0.00 H ATOM 2352 N SER A 813 25.078 -3.355 112.502 1.00 70.62 N ATOM 2353 CA SER A 813 23.747 -3.031 112.998 1.00 79.58 C ATOM 2354 C SER A 813 23.129 -1.893 112.187 1.00 77.96 C ATOM 2355 O SER A 813 21.911 -1.720 112.167 1.00 81.24 O ATOM 2356 CB SER A 813 23.789 -2.663 114.483 1.00 86.30 C ATOM 2357 OG SER A 813 24.368 -1.387 114.681 1.00 88.70 O ATOM 2358 HG SER A 813 24.381 -1.178 115.649 1.00 0.00 H ATOM 2359 H SER A 813 25.915 -2.939 112.958 1.00 0.00 H ATOM 2360 N LEU A 814 23.975 -1.141 111.492 1.00 72.90 N ATOM 2361 CA LEU A 814 23.535 0.066 110.824 1.00 71.39 C ATOM 2362 C LEU A 814 24.668 0.573 109.960 1.00 64.13 C ATOM 2363 O LEU A 814 25.822 0.597 110.397 1.00 58.05 O ATOM 2364 CB LEU A 814 23.159 1.133 111.865 1.00 72.59 C ATOM 2365 CG LEU A 814 22.865 2.534 111.339 1.00 69.15 C ATOM 2366 CD1 LEU A 814 21.758 2.455 110.311 1.00 73.89 C ATOM 2367 CD2 LEU A 814 22.466 3.464 112.463 1.00 66.44 C ATOM 2368 H LEU A 814 24.973 -1.425 111.426 1.00 0.00 H ATOM 2369 N ILE A 815 24.343 0.956 108.728 1.00 61.19 N ATOM 2370 CA ILE A 815 25.301 1.628 107.873 1.00 51.46 C ATOM 2371 C ILE A 815 24.703 2.969 107.492 1.00 52.20 C ATOM 2372 O ILE A 815 23.749 3.023 106.705 1.00 52.78 O ATOM 2373 CB ILE A 815 25.594 0.839 106.593 1.00 49.66 C ATOM 2374 CG1 ILE A 815 26.097 -0.567 106.914 1.00 45.89 C ATOM 2375 CG2 ILE A 815 26.636 1.556 105.785 1.00 41.61 C ATOM 2376 CD1 ILE A 815 26.389 -1.403 105.686 1.00 46.31 C ATOM 2377 H ILE A 815 23.384 0.770 108.372 1.00 0.00 H ATOM 2378 N LYS A 816 25.255 4.049 108.048 1.00 49.65 N ATOM 2379 CA LYS A 816 24.766 5.384 107.735 1.00 50.54 C ATOM 2380 C LYS A 816 25.490 5.970 106.522 1.00 52.60 C ATOM 2381 O LYS A 816 26.721 6.097 106.533 1.00 56.23 O ATOM 2382 CB LYS A 816 24.946 6.315 108.926 1.00 48.29 C ATOM 2383 CG LYS A 816 24.221 7.647 108.802 1.00 55.02 C ATOM 2384 CD LYS A 816 22.733 7.473 109.076 1.00 72.54 C ATOM 2385 CE LYS A 816 21.918 8.737 108.824 1.00 78.72 C ATOM 2386 NZ LYS A 816 20.540 8.604 109.413 1.00 85.84 N ATOM 2387 HZ1 LYS A 816 20.054 7.796 108.975 1.00 0.00 H ATOM 2388 HZ2 LYS A 816 20.616 8.450 110.439 1.00 0.00 H ATOM 2389 HZ3 LYS A 816 20.001 9.475 109.231 1.00 0.00 H ATOM 2390 H LYS A 816 26.046 3.936 108.714 1.00 0.00 H ATOM 2391 N LYS A 817 24.728 6.328 105.485 1.00 43.43 N ATOM 2392 CA LYS A 817 25.254 7.082 104.356 1.00 38.79 C ATOM 2393 C LYS A 817 24.659 8.502 104.363 1.00 41.20 C ATOM 2394 O LYS A 817 23.459 8.668 104.598 1.00 44.73 O ATOM 2395 CB LYS A 817 24.892 6.358 103.045 1.00 42.96 C ATOM 2396 CG LYS A 817 25.338 4.895 102.981 1.00 47.86 C ATOM 2397 CD LYS A 817 24.661 4.133 101.843 1.00 53.85 C ATOM 2398 CE LYS A 817 25.002 2.640 101.868 1.00 57.10 C ATOM 2399 NZ LYS A 817 24.119 1.873 100.932 1.00 64.67 N ATOM 2400 HZ1 LYS A 817 23.126 1.994 101.217 1.00 0.00 H ATOM 2401 HZ2 LYS A 817 24.249 2.230 99.964 1.00 0.00 H ATOM 2402 HZ3 LYS A 817 24.371 0.865 100.968 1.00 0.00 H ATOM 2403 H LYS A 817 23.723 6.059 105.484 1.00 0.00 H ATOM 2404 N ARG A 818 25.472 9.525 104.094 1.00 42.62 N ATOM 2405 CA ARG A 818 24.955 10.908 104.026 1.00 47.49 C ATOM 2406 C ARG A 818 25.946 11.867 103.354 1.00 47.81 C ATOM 2407 O ARG A 818 27.143 11.567 103.291 1.00 44.17 O ATOM 2408 CB ARG A 818 24.554 11.435 105.421 1.00 49.16 C ATOM 2409 CG ARG A 818 25.691 11.568 106.398 1.00 54.95 C ATOM 2410 CD ARG A 818 25.301 12.277 107.719 1.00 66.78 C ATOM 2411 NE ARG A 818 24.221 11.625 108.468 1.00 78.26 N ATOM 2412 CZ ARG A 818 23.802 12.003 109.678 1.00 83.77 C ATOM 2413 NH1 ARG A 818 24.375 13.028 110.300 1.00 88.60 N ATOM 2414 NH2 ARG A 818 22.808 11.356 110.271 1.00 81.88 N ATOM 2415 HE ARG A 818 23.749 10.811 108.025 1.00 0.00 H ATOM 2416 HH12 ARG A 818 24.043 13.316 111.242 1.00 0.00 H ATOM 2417 HH11 ARG A 818 25.156 13.542 109.844 1.00 0.00 H ATOM 2418 HH22 ARG A 818 22.484 11.653 111.214 1.00 0.00 H ATOM 2419 HH21 ARG A 818 22.353 10.552 109.794 1.00 0.00 H ATOM 2420 H ARG A 818 26.483 9.347 103.930 1.00 0.00 H ATOM 2421 N PHE A 819 25.467 13.000 102.823 1.00 46.95 N ATOM 2422 CA PHE A 819 26.405 13.995 102.274 1.00 38.97 C ATOM 2423 C PHE A 819 25.970 15.417 102.580 1.00 36.26 C ATOM 2424 O PHE A 819 24.841 15.638 103.021 1.00 36.59 O ATOM 2425 CB PHE A 819 26.650 13.824 100.761 1.00 39.31 C ATOM 2426 CG PHE A 819 25.430 14.043 99.902 1.00 40.30 C ATOM 2427 CD1 PHE A 819 25.034 15.326 99.547 1.00 37.68 C ATOM 2428 CD2 PHE A 819 24.688 12.960 99.440 1.00 42.23 C ATOM 2429 CE1 PHE A 819 23.937 15.520 98.791 1.00 43.10 C ATOM 2430 CE2 PHE A 819 23.576 13.149 98.659 1.00 41.51 C ATOM 2431 CZ PHE A 819 23.195 14.424 98.334 1.00 46.79 C ATOM 2432 H PHE A 819 24.442 13.176 102.799 1.00 0.00 H ATOM 2433 N ALA A 820 26.853 16.384 102.338 1.00 33.74 N ATOM 2434 CA ALA A 820 26.520 17.767 102.658 1.00 39.47 C ATOM 2435 C ALA A 820 27.323 18.772 101.849 1.00 38.22 C ATOM 2436 O ALA A 820 28.497 18.539 101.530 1.00 36.71 O ATOM 2437 CB ALA A 820 26.701 18.025 104.140 1.00 33.27 C ATOM 2438 H ALA A 820 27.778 16.153 101.922 1.00 0.00 H ATOM 2439 N ALA A 821 26.683 19.890 101.522 1.00 32.11 N ATOM 2440 CA ALA A 821 27.401 21.003 100.920 1.00 37.19 C ATOM 2441 C ALA A 821 28.500 21.407 101.875 1.00 37.10 C ATOM 2442 O ALA A 821 28.253 21.568 103.071 1.00 45.69 O ATOM 2443 CB ALA A 821 26.468 22.166 100.690 1.00 37.00 C ATOM 2444 H ALA A 821 25.661 19.970 101.698 1.00 0.00 H ATOM 2445 N GLY A 822 29.714 21.552 101.360 1.00 35.95 N ATOM 2446 CA GLY A 822 30.798 22.114 102.146 1.00 32.04 C ATOM 2447 C GLY A 822 30.950 23.549 101.708 1.00 44.10 C ATOM 2448 O GLY A 822 30.147 24.392 102.069 1.00 43.77 O ATOM 2449 H GLY A 822 29.892 21.259 100.378 1.00 0.00 H ATOM 2450 N LYS A 823 31.959 23.833 100.895 1.00 42.48 N ATOM 2451 CA LYS A 823 32.155 25.177 100.358 1.00 37.39 C ATOM 2452 C LYS A 823 31.502 25.229 98.971 1.00 39.97 C ATOM 2453 O LYS A 823 32.048 24.704 98.001 1.00 37.56 O ATOM 2454 CB LYS A 823 33.651 25.463 100.268 1.00 38.17 C ATOM 2455 CG LYS A 823 34.022 26.899 99.999 1.00 54.95 C ATOM 2456 CD LYS A 823 35.555 27.105 100.090 1.00 69.72 C ATOM 2457 CE LYS A 823 36.091 28.184 99.102 1.00 84.73 C ATOM 2458 NZ LYS A 823 36.199 27.707 97.671 1.00 79.49 N ATOM 2459 HZ1 LYS A 823 36.850 26.897 97.625 1.00 0.00 H ATOM 2460 HZ2 LYS A 823 35.259 27.418 97.331 1.00 0.00 H ATOM 2461 HZ3 LYS A 823 36.562 28.479 97.076 1.00 0.00 H ATOM 2462 H LYS A 823 32.627 23.080 100.634 1.00 0.00 H ATOM 2463 N TYR A 824 30.332 25.859 98.867 1.00 40.42 N ATOM 2464 CA TYR A 824 29.492 25.716 97.686 1.00 40.41 C ATOM 2465 C TYR A 824 29.040 27.106 97.189 1.00 43.11 C ATOM 2466 O TYR A 824 28.142 27.711 97.769 1.00 45.82 O ATOM 2467 CB TYR A 824 28.292 24.867 98.078 1.00 36.45 C ATOM 2468 CG TYR A 824 27.656 23.985 97.004 1.00 41.52 C ATOM 2469 CD1 TYR A 824 27.995 22.632 96.885 1.00 35.98 C ATOM 2470 CD2 TYR A 824 26.660 24.481 96.169 1.00 38.93 C ATOM 2471 CE1 TYR A 824 27.383 21.812 95.940 1.00 37.61 C ATOM 2472 CE2 TYR A 824 26.030 23.665 95.231 1.00 39.67 C ATOM 2473 CZ TYR A 824 26.398 22.330 95.105 1.00 44.10 C ATOM 2474 OH TYR A 824 25.770 21.529 94.141 1.00 44.79 O ATOM 2475 HH TYR A 824 25.928 21.912 93.242 1.00 0.00 H ATOM 2476 H TYR A 824 30.011 26.467 99.648 1.00 0.00 H ATOM 2477 N LEU A 825 29.653 27.593 96.105 1.00 35.44 N ATOM 2478 CA LEU A 825 29.520 28.988 95.696 1.00 39.89 C ATOM 2479 C LEU A 825 29.146 29.198 94.214 1.00 41.32 C ATOM 2480 O LEU A 825 29.373 28.323 93.367 1.00 37.37 O ATOM 2481 CB LEU A 825 30.826 29.759 95.979 1.00 39.18 C ATOM 2482 CG LEU A 825 31.633 29.557 97.258 1.00 46.87 C ATOM 2483 CD1 LEU A 825 32.857 30.442 97.209 1.00 48.84 C ATOM 2484 CD2 LEU A 825 30.814 29.911 98.486 1.00 51.15 C ATOM 2485 H LEU A 825 30.245 26.956 95.534 1.00 0.00 H ATOM 2486 N ALA A 826 28.600 30.378 93.920 1.00 38.64 N ATOM 2487 CA ALA A 826 28.274 30.780 92.556 1.00 36.52 C ATOM 2488 C ALA A 826 28.619 32.239 92.318 1.00 43.70 C ATOM 2489 O ALA A 826 28.071 33.132 92.958 1.00 52.40 O ATOM 2490 CB ALA A 826 26.814 30.545 92.271 1.00 36.50 C ATOM 2491 H ALA A 826 28.398 31.040 94.696 1.00 0.00 H ATOM 2492 N ASP A 827 29.537 32.478 91.393 1.00 43.78 N ATOM 2493 CA ASP A 827 29.879 33.833 90.988 1.00 44.97 C ATOM 2494 C ASP A 827 28.985 34.268 89.829 1.00 54.08 C ATOM 2495 O ASP A 827 28.284 33.451 89.224 1.00 50.18 O ATOM 2496 CB ASP A 827 31.355 33.914 90.585 1.00 46.24 C ATOM 2497 CG ASP A 827 32.266 34.220 91.739 1.00 55.37 C ATOM 2498 OD1 ASP A 827 31.756 34.480 92.852 1.00 64.02 O ATOM 2499 OD2 ASP A 827 33.502 34.209 91.528 1.00 57.76 O ATOM 2500 H ASP A 827 30.026 31.677 90.945 1.00 0.00 H ATOM 2501 N ASN A 828 29.015 35.561 89.528 1.00 65.67 N ATOM 2502 CA ASN A 828 28.339 36.074 88.354 1.00 62.03 C ATOM 2503 C ASN A 828 29.058 35.595 87.085 1.00 62.18 C ATOM 2504 O ASN A 828 28.649 35.901 85.962 1.00 64.31 O ATOM 2505 CB ASN A 828 28.285 37.593 88.436 1.00 62.78 C ATOM 2506 CG ASN A 828 27.424 38.205 87.360 1.00 63.73 C ATOM 2507 OD1 ASN A 828 26.217 38.004 87.322 1.00 64.87 O ATOM 2508 ND2 ASN A 828 28.043 38.974 86.487 1.00 62.84 N ATOM 2509 HD22 ASN A 828 29.071 39.117 86.557 1.00 0.00 H ATOM 2510 HD21 ASN A 828 27.504 39.438 85.728 1.00 0.00 H ATOM 2511 H ASN A 828 29.533 36.217 90.146 1.00 0.00 H TER 2512 ASN A 828 HETATM 2513 ZN ZN A 1 30.987 -10.767 123.800 1.00 95.56 ZN HETATM 2514 ZN ZN A 2 36.215 12.646 111.694 1.00 85.57 ZN HETATM 2515 ZN ZN A 3 43.916 6.337 120.365 1.00 97.17 ZN HETATM 2516 ZN ZN A 4 41.157 -6.774 96.988 1.00170.15 ZN HETATM 2517 ZN ZN A 5 42.177 15.254 98.539 1.00154.07 ZN HETATM 2518 ZN ZN A 6 12.528 18.098 106.507 1.00129.60 ZN HETATM 2519 O HOH 7 24.044 45.112 116.438 1.00 47.42 O HETATM 2520 O HOH 8 26.565 35.928 93.011 1.00 49.71 O HETATM 2521 O HOH 9 36.390 27.749 86.651 1.00 48.85 O HETATM 2522 O HOH 10 43.305 -5.852 98.887 1.00 56.58 O HETATM 2523 O HOH 11 36.831 15.319 94.137 1.00 41.31 O HETATM 2524 O HOH 12 26.478 3.851 98.483 1.00 62.05 O HETATM 2525 O HOH 13 42.344 14.727 91.523 1.00 60.34 O HETATM 2526 O HOH 14 24.548 -1.860 102.062 1.00 61.73 O HETATM 2527 O HOH 15 32.255 -10.437 111.282 1.00 59.30 O HETATM 2528 O HOH 16 28.740 26.459 101.193 1.00 39.10 O HETATM 2529 O HOH 17 26.293 22.847 104.248 1.00 26.89 O HETATM 2530 O HOH 18 27.269 6.938 91.966 1.00 45.97 O HETATM 2531 O HOH 19 26.876 27.678 86.152 1.00 36.92 O HETATM 2532 O HOH 20 40.389 -11.898 101.290 1.00 45.09 O HETATM 2533 O HOH 21 21.906 22.184 84.578 1.00 54.06 O HETATM 2534 O HOH 22 15.201 11.479 100.549 1.00 60.76 O HETATM 2535 O HOH 23 35.380 15.701 104.581 1.00 47.78 O HETATM 2536 O HOH 24 35.872 18.938 101.947 1.00 38.98 O HETATM 2537 O HOH 25 26.555 31.008 88.605 1.00 43.75 O HETATM 2538 O HOH 26 17.899 13.486 102.609 1.00 48.36 O HETATM 2539 O HOH 27 33.386 28.372 77.487 1.00 56.88 O HETATM 2540 O HOH 28 30.576 37.091 92.094 1.00 53.64 O HETATM 2541 O HOH 29 35.044 22.698 103.018 1.00 53.97 O HETATM 2542 O HOH 30 33.291 8.846 119.898 1.00 46.46 O HETATM 2543 O HOH 31 19.680 7.635 106.672 1.00 53.54 O HETATM 2544 O HOH 32 21.697 5.848 105.555 1.00 49.15 O HETATM 2545 O HOH 33 24.489 30.051 103.473 1.00 57.73 O HETATM 2546 O HOH 34 27.602 8.752 91.308 1.00 61.28 O HETATM 2547 O HOH 35 40.393 14.138 102.638 1.00 53.70 O HETATM 2548 O HOH 36 24.926 47.192 116.251 1.00 61.03 O HETATM 2549 O HOH 37 45.301 4.798 121.514 1.00 45.62 O HETATM 2550 O HOH 38 35.555 13.187 114.153 1.00 52.38 O HETATM 2551 O HOH 39 24.670 22.435 106.267 1.00 52.45 O HETATM 2552 O HOH 40 35.389 20.230 103.985 1.00 56.28 O HETATM 2553 O HOH 41 17.425 7.613 106.043 1.00 69.09 O HETATM 2554 N TYR A 42 32.227 15.917 115.512 1.00 0.24 N HETATM 2555 CA TYR A 42 31.036 15.634 114.726 1.00 0.07 C HETATM 2556 C TYR A 42 30.679 14.149 114.740 1.00 0.23 C HETATM 2557 O TYR A 42 31.531 13.291 114.494 1.00 -0.39 O HETATM 2558 N TYR A 42 29.408 13.857 115.005 1.00 -0.26 N HETATM 2559 CA TYR A 42 28.930 12.487 115.113 1.00 0.14 C HETATM 2560 C TYR A 42 28.033 12.135 113.936 1.00 0.21 C HETATM 2561 O TYR A 42 26.910 12.636 113.815 1.00 -0.39 O HETATM 2562 N TYR A 42 28.526 11.248 113.064 1.00 -0.25 N HETATM 2563 CA TYR A 42 27.780 10.869 111.857 1.00 0.13 C HETATM 2564 C TYR A 42 26.501 10.089 112.165 1.00 0.20 C HETATM 2565 O TYR A 42 25.651 9.900 111.276 1.00 -0.39 O HETATM 2566 N TYR A 42 26.358 9.648 113.411 1.00 -0.26 N HETATM 2567 CA TYR A 42 25.180 8.884 113.776 1.00 0.14 C HETATM 2568 C TYR A 42 24.106 9.727 114.443 1.00 0.21 C HETATM 2569 O TYR A 42 22.987 9.259 114.631 1.00 -0.39 O HETATM 2570 N TYR A 42 24.450 10.969 114.782 1.00 -0.27 N HETATM 2571 CA TYR A 42 23.525 11.890 115.426 1.00 0.12 C HETATM 2572 C TYR A 42 22.779 11.228 116.563 1.00 0.20 C HETATM 2573 O TYR A 42 21.585 11.458 116.762 1.00 -0.39 O HETATM 2574 N TYR A 42 23.492 10.384 117.298 1.00 -0.27 N HETATM 2575 CA TYR A 42 22.888 9.569 118.336 1.00 0.12 C HETATM 2576 C TYR A 42 23.410 8.141 118.328 1.00 0.20 C HETATM 2577 O TYR A 42 24.319 7.805 117.568 1.00 -0.39 O HETATM 2578 N TYR A 42 22.826 7.301 119.180 1.00 -0.26 N HETATM 2579 CA TYR A 42 23.250 5.906 119.335 1.00 0.14 C HETATM 2580 C TYR A 42 22.750 5.025 118.181 1.00 0.21 C HETATM 2581 O TYR A 42 21.540 4.924 117.949 1.00 -0.39 O HETATM 2582 N TYR A 42 23.687 4.392 117.450 1.00 -0.25 N HETATM 2583 CA TYR A 42 23.355 3.472 116.358 1.00 0.13 C HETATM 2584 C TYR A 42 23.085 2.059 116.851 1.00 0.20 C HETATM 2585 O TYR A 42 22.758 1.188 116.048 1.00 -0.39 O HETATM 2586 N TYR A 42 23.231 1.825 118.152 1.00 -0.26 N HETATM 2587 CA TYR A 42 23.182 0.461 118.681 1.00 0.14 C HETATM 2588 C TYR A 42 21.883 0.128 119.430 1.00 0.21 C HETATM 2589 O TYR A 42 21.316 -0.951 119.240 1.00 -0.39 O HETATM 2590 N TYR A 42 21.420 1.054 120.269 1.00 -0.27 N HETATM 2591 CA TYR A 42 20.229 0.847 121.099 1.00 0.09 C HETATM 2592 C TYR A 42 20.365 -0.400 121.973 1.00 0.06 C HETATM 2593 O TYR A 42 21.479 -0.845 122.269 1.00 -0.57 O HETATM 2594 OXT TYR A 42 19.363 -0.985 122.399 1.00 -0.57 O HETATM 2595 CB TYR A 42 18.959 0.779 120.237 1.00 -0.02 C HETATM 2596 CG TYR A 42 18.799 1.950 119.254 1.00 -0.04 C HETATM 2597 CD TYR A 42 18.686 3.302 119.984 1.00 -0.01 C HETATM 2598 CE TYR A 42 18.668 4.480 118.994 1.00 -0.04 C HETATM 2599 NZ TYR A 42 18.618 5.822 119.667 1.00 0.22 N HETATM 2600 H68 TYR A 42 18.608 6.548 118.968 1.00 0.20 H HETATM 2601 H69 TYR A 42 19.429 5.933 120.256 1.00 0.20 H HETATM 2602 H70 TYR A 42 17.784 5.885 120.229 1.00 0.20 H HETATM 2603 H66 TYR A 42 17.783 4.380 118.349 1.00 0.08 H HETATM 2604 H67 TYR A 42 19.578 4.432 118.378 1.00 0.08 H HETATM 2605 H64 TYR A 42 19.547 3.416 120.659 1.00 0.03 H HETATM 2606 H65 TYR A 42 17.756 3.314 120.571 1.00 0.03 H HETATM 2607 H62 TYR A 42 17.889 1.791 118.657 1.00 0.03 H HETATM 2608 H63 TYR A 42 19.674 1.978 118.588 1.00 0.03 H HETATM 2609 H60 TYR A 42 18.087 0.771 120.908 1.00 0.03 H HETATM 2610 H61 TYR A 42 18.985 -0.156 119.658 1.00 0.03 H HETATM 2611 H59 TYR A 42 20.134 1.715 121.768 1.00 0.07 H HETATM 2612 H58 TYR A 42 21.905 1.926 120.335 1.00 0.19 H HETATM 2613 CB TYR A 42 24.428 0.154 119.540 1.00 0.02 C HETATM 2614 CG TYR A 42 25.721 0.105 118.750 1.00 -0.04 C HETATM 2615 CD1 TYR A 42 26.048 -1.011 117.996 1.00 -0.06 C HETATM 2616 CE1 TYR A 42 27.218 -1.055 117.280 1.00 -0.07 C HETATM 2617 CZ TYR A 42 28.083 0.022 117.306 1.00 -0.07 C HETATM 2618 CE2 TYR A 42 27.776 1.137 118.048 1.00 -0.07 C HETATM 2619 CD2 TYR A 42 26.606 1.178 118.763 1.00 -0.06 C HETATM 2620 H54 TYR A 42 26.368 2.060 119.347 1.00 0.06 H HETATM 2621 H56 TYR A 42 28.456 1.981 118.068 1.00 0.06 H HETATM 2622 H57 TYR A 42 29.006 -0.013 116.739 1.00 0.06 H HETATM 2623 H55 TYR A 42 27.463 -1.934 116.695 1.00 0.06 H HETATM 2624 H53 TYR A 42 25.372 -1.858 117.972 1.00 0.06 H HETATM 2625 H51 TYR A 42 24.282 -0.822 120.026 1.00 0.05 H HETATM 2626 H52 TYR A 42 24.521 0.936 120.308 1.00 0.05 H HETATM 2627 H50 TYR A 42 23.219 -0.212 117.811 1.00 0.08 H HETATM 2628 H49 TYR A 42 23.376 2.591 118.778 1.00 0.19 H HETATM 2629 CB TYR A 42 24.641 3.464 115.527 1.00 -0.01 C HETATM 2630 CG TYR A 42 25.715 3.632 116.544 1.00 -0.03 C HETATM 2631 CD TYR A 42 25.142 4.627 117.533 1.00 0.04 C HETATM 2632 H47 TYR A 42 25.515 4.431 118.549 1.00 0.05 H HETATM 2633 H48 TYR A 42 25.391 5.658 117.243 1.00 0.05 H HETATM 2634 H45 TYR A 42 26.632 4.027 116.081 1.00 0.03 H HETATM 2635 H46 TYR A 42 25.937 2.675 117.038 1.00 0.03 H HETATM 2636 H43 TYR A 42 24.648 4.295 114.807 1.00 0.03 H HETATM 2637 H44 TYR A 42 24.755 2.511 114.989 1.00 0.03 H HETATM 2638 H42 TYR A 42 22.494 3.838 115.779 1.00 0.08 H HETATM 2639 CB TYR A 42 22.737 5.355 120.671 1.00 0.04 C HETATM 2640 CG TYR A 42 23.643 4.273 121.266 1.00 0.04 C HETATM 2641 OD1 TYR A 42 23.797 4.247 122.504 1.00 -0.57 O HETATM 2642 OD2 TYR A 42 24.186 3.439 120.517 1.00 -0.57 O HETATM 2643 H40 TYR A 42 21.738 4.925 120.511 1.00 0.05 H HETATM 2644 H41 TYR A 42 22.668 6.186 121.388 1.00 0.05 H HETATM 2645 H39 TYR A 42 24.350 5.877 119.340 1.00 0.08 H HETATM 2646 H38 TYR A 42 22.066 7.636 119.738 1.00 0.19 H HETATM 2647 H36 TYR A 42 21.799 9.548 118.180 1.00 0.08 H HETATM 2648 H37 TYR A 42 23.110 10.021 119.314 1.00 0.08 H HETATM 2649 H35 TYR A 42 24.475 10.307 117.132 1.00 0.19 H HETATM 2650 H33 TYR A 42 22.798 12.244 114.681 1.00 0.08 H HETATM 2651 H34 TYR A 42 24.091 12.746 115.822 1.00 0.08 H HETATM 2652 H32 TYR A 42 25.380 11.280 114.586 1.00 0.19 H HETATM 2653 CB TYR A 42 25.582 7.703 114.642 1.00 0.02 C HETATM 2654 CG TYR A 42 26.508 6.765 113.951 1.00 -0.04 C HETATM 2655 CD1 TYR A 42 26.014 5.797 113.091 1.00 -0.06 C HETATM 2656 CE1 TYR A 42 26.867 4.932 112.429 1.00 -0.07 C HETATM 2657 CZ TYR A 42 28.227 5.035 112.617 1.00 -0.07 C HETATM 2658 CE2 TYR A 42 28.733 6.004 113.463 1.00 -0.07 C HETATM 2659 CD2 TYR A 42 27.873 6.869 114.121 1.00 -0.06 C HETATM 2660 H28 TYR A 42 28.276 7.634 114.775 1.00 0.06 H HETATM 2661 H30 TYR A 42 29.803 6.087 113.612 1.00 0.06 H HETATM 2662 H31 TYR A 42 28.899 4.358 112.103 1.00 0.06 H HETATM 2663 H29 TYR A 42 26.466 4.176 111.764 1.00 0.06 H HETATM 2664 H27 TYR A 42 24.944 5.716 112.935 1.00 0.06 H HETATM 2665 H25 TYR A 42 24.674 7.152 114.928 1.00 0.05 H HETATM 2666 H26 TYR A 42 26.079 8.084 115.546 1.00 0.05 H HETATM 2667 H24 TYR A 42 24.746 8.485 112.847 1.00 0.08 H HETATM 2668 H23 TYR A 42 27.061 9.842 114.095 1.00 0.19 H HETATM 2669 CB TYR A 42 28.774 9.989 111.082 1.00 -0.01 C HETATM 2670 CG TYR A 42 29.873 9.665 112.023 1.00 -0.03 C HETATM 2671 CD TYR A 42 29.914 10.757 113.044 1.00 0.04 C HETATM 2672 H21 TYR A 42 30.209 10.366 114.029 1.00 0.05 H HETATM 2673 H22 TYR A 42 30.610 11.553 112.743 1.00 0.05 H HETATM 2674 H19 TYR A 42 30.830 9.617 111.483 1.00 0.03 H HETATM 2675 H20 TYR A 42 29.679 8.699 112.512 1.00 0.03 H HETATM 2676 H17 TYR A 42 29.167 10.536 110.212 1.00 0.03 H HETATM 2677 H18 TYR A 42 28.280 9.066 110.743 1.00 0.03 H HETATM 2678 H16 TYR A 42 27.518 11.765 111.275 1.00 0.08 H HETATM 2679 CB TYR A 42 28.159 12.301 116.418 1.00 0.04 C HETATM 2680 CG TYR A 42 27.785 10.866 116.671 1.00 0.04 C HETATM 2681 OD1 TYR A 42 27.561 10.540 117.843 1.00 -0.57 O HETATM 2682 OD2 TYR A 42 27.722 10.056 115.716 1.00 -0.57 O HETATM 2683 H14 TYR A 42 27.239 12.902 116.372 1.00 0.05 H HETATM 2684 H15 TYR A 42 28.786 12.653 117.251 1.00 0.05 H HETATM 2685 H13 TYR A 42 29.797 11.810 115.112 1.00 0.08 H HETATM 2686 H12 TYR A 42 28.758 14.606 115.135 1.00 0.19 H HETATM 2687 CB TYR A 42 31.233 16.100 113.287 1.00 0.04 C HETATM 2688 CG TYR A 42 30.251 15.480 112.320 1.00 -0.05 C HETATM 2689 CD1 TYR A 42 30.622 14.407 111.509 1.00 -0.07 C HETATM 2690 CE1 TYR A 42 29.721 13.825 110.627 1.00 -0.04 C HETATM 2691 CZ TYR A 42 28.429 14.316 110.543 1.00 0.08 C HETATM 2692 CE2 TYR A 42 28.034 15.382 111.344 1.00 -0.04 C HETATM 2693 CD2 TYR A 42 28.944 15.953 112.228 1.00 -0.07 C HETATM 2694 H8 TYR A 42 28.631 16.780 112.856 1.00 0.05 H HETATM 2695 H10 TYR A 42 27.022 15.766 111.280 1.00 0.05 H HETATM 2696 OH TYR A 42 27.538 13.733 109.663 1.00 -0.34 O HETATM 2697 H11 TYR A 42 27.970 13.025 109.199 1.00 0.25 H HETATM 2698 H9 TYR A 42 30.028 12.990 110.007 1.00 0.05 H HETATM 2699 H7 TYR A 42 31.633 14.020 111.569 1.00 0.05 H HETATM 2700 H5 TYR A 42 32.252 15.833 112.970 1.00 0.05 H HETATM 2701 H6 TYR A 42 31.113 17.193 113.254 1.00 0.05 H HETATM 2702 H4 TYR A 42 30.196 16.194 115.164 1.00 0.11 H HETATM 2703 H1 TYR A 42 32.426 16.904 115.476 1.00 0.20 H HETATM 2704 H2 TYR A 42 33.008 15.403 115.136 1.00 0.20 H HETATM 2705 H3 TYR A 42 32.072 15.640 116.469 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 7 6 2513 CONECT 8 6 2513 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 282 281 2514 CONECT 283 281 2514 CONECT 393 391 392 2513 CONECT 698 699 706 707 708 CONECT 705 703 2516 CONECT 706 698 CONECT 707 698 CONECT 708 698 CONECT 865 864 867 2515 CONECT 1099 1097 1100 1101 2517 CONECT 2513 7 8 393 CONECT 2514 282 283 CONECT 2515 865 CONECT 2516 705 CONECT 2517 1099 CONECT 2554 2555 2703 2704 2705 CONECT 2555 2554 2556 2687 2702 CONECT 2556 2555 2557 2558 CONECT 2557 2556 CONECT 2558 2556 2559 2686 CONECT 2559 2558 2560 2679 2685 CONECT 2560 2559 2561 2562 CONECT 2561 2560 CONECT 2562 2560 2563 2671 CONECT 2563 2562 2564 2669 2678 CONECT 2564 2563 2565 2566 CONECT 2565 2564 CONECT 2566 2564 2567 2668 CONECT 2567 2566 2568 2653 2667 CONECT 2568 2567 2569 2570 CONECT 2569 2568 CONECT 2570 2568 2571 2652 CONECT 2571 2570 2572 2650 2651 CONECT 2572 2571 2573 2574 CONECT 2573 2572 CONECT 2574 2572 2575 2649 CONECT 2575 2574 2576 2647 2648 CONECT 2576 2575 2577 2578 CONECT 2577 2576 CONECT 2578 2576 2579 2646 CONECT 2579 2578 2580 2639 2645 CONECT 2580 2579 2581 2582 CONECT 2581 2580 CONECT 2582 2580 2583 2631 CONECT 2583 2582 2584 2629 2638 CONECT 2584 2583 2585 2586 CONECT 2585 2584 CONECT 2586 2584 2587 2628 CONECT 2587 2586 2588 2613 2627 CONECT 2588 2587 2589 2590 CONECT 2589 2588 CONECT 2590 2588 2591 2612 CONECT 2591 2590 2592 2595 2611 CONECT 2592 2591 2593 2594 CONECT 2593 2592 CONECT 2594 2592 CONECT 2595 2591 2596 2609 2610 CONECT 2596 2595 2597 2607 2608 CONECT 2597 2596 2598 2605 2606 CONECT 2598 2597 2599 2603 2604 CONECT 2599 2598 2600 2601 2602 CONECT 2600 2599 CONECT 2601 2599 CONECT 2602 2599 CONECT 2603 2598 CONECT 2604 2598 CONECT 2605 2597 CONECT 2606 2597 CONECT 2607 2596 CONECT 2608 2596 CONECT 2609 2595 CONECT 2610 2595 CONECT 2611 2591 CONECT 2612 2590 CONECT 2613 2587 2614 2625 2626 CONECT 2614 2613 2615 2619 CONECT 2615 2614 2616 2624 CONECT 2616 2615 2617 2623 CONECT 2617 2616 2618 2622 CONECT 2618 2617 2619 2621 CONECT 2619 2614 2618 2620 CONECT 2620 2619 CONECT 2621 2618 CONECT 2622 2617 CONECT 2623 2616 CONECT 2624 2615 CONECT 2625 2613 CONECT 2626 2613 CONECT 2627 2587 CONECT 2628 2586 CONECT 2629 2583 2630 2636 2637 CONECT 2630 2629 2631 2634 2635 CONECT 2631 2582 2630 2632 2633 CONECT 2632 2631 CONECT 2633 2631 CONECT 2634 2630 CONECT 2635 2630 CONECT 2636 2629 CONECT 2637 2629 CONECT 2638 2583 CONECT 2639 2579 2640 2643 2644 CONECT 2640 2639 2641 2642 CONECT 2641 2640 CONECT 2642 2640 CONECT 2643 2639 CONECT 2644 2639 CONECT 2645 2579 CONECT 2646 2578 CONECT 2647 2575 CONECT 2648 2575 CONECT 2649 2574 CONECT 2650 2571 CONECT 2651 2571 CONECT 2652 2570 CONECT 2653 2567 2654 2665 2666 CONECT 2654 2653 2655 2659 CONECT 2655 2654 2656 2664 CONECT 2656 2655 2657 2663 CONECT 2657 2656 2658 2662 CONECT 2658 2657 2659 2661 CONECT 2659 2654 2658 2660 CONECT 2660 2659 CONECT 2661 2658 CONECT 2662 2657 CONECT 2663 2656 CONECT 2664 2655 CONECT 2665 2653 CONECT 2666 2653 CONECT 2667 2567 CONECT 2668 2566 CONECT 2669 2563 2670 2676 2677 CONECT 2670 2669 2671 2674 2675 CONECT 2671 2562 2670 2672 2673 CONECT 2672 2671 CONECT 2673 2671 CONECT 2674 2670 CONECT 2675 2670 CONECT 2676 2669 CONECT 2677 2669 CONECT 2678 2563 CONECT 2679 2559 2680 2683 2684 CONECT 2680 2679 2681 2682 CONECT 2681 2680 CONECT 2682 2680 CONECT 2683 2679 CONECT 2684 2679 CONECT 2685 2559 CONECT 2686 2558 CONECT 2687 2555 2688 2700 2701 CONECT 2688 2687 2689 2693 CONECT 2689 2688 2690 2699 CONECT 2690 2689 2691 2698 CONECT 2691 2690 2692 2696 CONECT 2692 2691 2693 2695 CONECT 2693 2688 2692 2694 CONECT 2694 2693 CONECT 2695 2692 CONECT 2696 2691 2697 CONECT 2697 2696 CONECT 2698 2690 CONECT 2699 2689 CONECT 2700 2687 CONECT 2701 2687 CONECT 2702 2555 CONECT 2703 2554 CONECT 2704 2554 CONECT 2705 2554 MASTER 0 0 0 0 0 0 0 0 2703 2 173 21 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5awt
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PDB Code
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Ligand Name
1avp
RCSB PDB
PDBbind
11-mer
1bbz
RCSB PDB
PDBbind
11-mer
1c5f
RCSB PDB
PDBbind
11-mer
1cwb
RCSB PDB
PDBbind
11-mer
1cwc
RCSB PDB
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11-mer
1cyn
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PDBbind
11-mer
1d4t
RCSB PDB
PDBbind
11-mer
1d4w
RCSB PDB
PDBbind
11-mer
1d8e
RCSB PDB
PDBbind
11-mer
1ddm
RCSB PDB
PDBbind
11-mer
1ff1
RCSB PDB
PDBbind
11-mer
1h25
RCSB PDB
PDBbind
11-mer
1h26
RCSB PDB
PDBbind
11-mer
1h27
RCSB PDB
PDBbind
11-mer
1h28
RCSB PDB
PDBbind
11-mer
1h3h
RCSB PDB
PDBbind
11-mer
1h6e
RCSB PDB
PDBbind
11-mer
1iq1
RCSB PDB
PDBbind
11-mer
1irs
RCSB PDB
PDBbind
11-mer
1jm4
RCSB PDB
PDBbind
11-mer
1l2z
RCSB PDB
PDBbind
11-mer
1lcj
RCSB PDB
PDBbind
11-mer
1mik
RCSB PDB
PDBbind
11-mer
1om2
RCSB PDB
PDBbind
11-mer
1ox9
RCSB PDB
PDBbind
11-mer
1qng
RCSB PDB
PDBbind
11-mer
1qnh
RCSB PDB
PDBbind
11-mer
1s9v
RCSB PDB
PDBbind
11-mer
1sps
RCSB PDB
PDBbind
11-mer
1ths
RCSB PDB
PDBbind
11-mer
1uj0
RCSB PDB
PDBbind
11-mer
1ukh
RCSB PDB
PDBbind
11-mer
1xn2
RCSB PDB
PDBbind
11-mer
1zh7
RCSB PDB
PDBbind
11-mer
1zub
RCSB PDB
PDBbind
11-mer
2aof
RCSB PDB
PDBbind
11-mer
2aoi
RCSB PDB
PDBbind
11-mer
2bj4
RCSB PDB
PDBbind
11-mer
2bz8
RCSB PDB
PDBbind
11-mer
2cia
RCSB PDB
PDBbind
11-mer
2cv3
RCSB PDB
PDBbind
11-mer
2eh8
RCSB PDB
PDBbind
11-mer
2ez5
RCSB PDB
PDBbind
11-mer
2h2g
RCSB PDB
PDBbind
11-mer
2h2h
RCSB PDB
PDBbind
11-mer
2h9m
RCSB PDB
PDBbind
11-mer
2h9n
RCSB PDB
PDBbind
11-mer
2h9p
RCSB PDB
PDBbind
11-mer
2hdx
RCSB PDB
PDBbind
11-mer
2hmh
RCSB PDB
PDBbind
11-mer
2jdl
RCSB PDB
PDBbind
11-mer
2jkr
RCSB PDB
PDBbind
11-mer
2jkt
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
RCSB PDB
PDBbind
11-mer
2m0o
RCSB PDB
PDBbind
11-mer
2m3m
RCSB PDB
PDBbind
11-mer
2m3o
RCSB PDB
PDBbind
11-mer
2o9k
RCSB PDB
PDBbind
11-mer
2or9
RCSB PDB
PDBbind
11-mer
2qhr
RCSB PDB
PDBbind
11-mer
2r02
RCSB PDB
PDBbind
11-mer
2r05
RCSB PDB
PDBbind
11-mer
2w9r
RCSB PDB
PDBbind
11-mer
2wfj
RCSB PDB
PDBbind
11-mer
2x2c
RCSB PDB
PDBbind
11-mer
2z6w
RCSB PDB
PDBbind
11-mer
3asl
RCSB PDB
PDBbind
11-mer
3ax5
RCSB PDB
PDBbind
11-mer
3dpo
RCSB PDB
PDBbind
11-mer
3e8u
RCSB PDB
PDBbind
11-mer
3eov
RCSB PDB
PDBbind
11-mer
3eyf
RCSB PDB
PDBbind
11-mer
3gxz
RCSB PDB
PDBbind
11-mer
3i90
RCSB PDB
PDBbind
11-mer
3iiw
RCSB PDB
PDBbind
11-mer
3iiy
RCSB PDB
PDBbind
11-mer
3ij0
RCSB PDB
PDBbind
11-mer
3ij1
RCSB PDB
PDBbind
11-mer
3lgl
RCSB PDB
PDBbind
11-mer
3ll8
RCSB PDB
PDBbind
11-mer
3m53
RCSB PDB
PDBbind
11-mer
3m54
RCSB PDB
PDBbind
11-mer
3m55
RCSB PDB
PDBbind
11-mer
3m56
RCSB PDB
PDBbind
11-mer
3m57
RCSB PDB
PDBbind
11-mer
3m58
RCSB PDB
PDBbind
11-mer
3m59
RCSB PDB
PDBbind
11-mer
3m5a
RCSB PDB
PDBbind
11-mer
3me9
RCSB PDB
PDBbind
11-mer
3mea
RCSB PDB
PDBbind
11-mer
3met
RCSB PDB
PDBbind
11-mer
3oap
RCSB PDB
PDBbind
11-mer
3odi
RCSB PDB
PDBbind
11-mer
3odl
RCSB PDB
PDBbind
11-mer
3p4f
RCSB PDB
PDBbind
11-mer
3p9h
RCSB PDB
PDBbind
11-mer
3pqz
RCSB PDB
PDBbind
11-mer
3qzv
RCSB PDB
PDBbind
11-mer
3rbq
RCSB PDB
PDBbind
11-mer
3rl7
RCSB PDB
PDBbind
11-mer
3rl8
RCSB PDB
PDBbind
11-mer
3rwd
RCSB PDB
PDBbind
11-mer
3tg5
RCSB PDB
PDBbind
11-mer
3u0t
RCSB PDB
PDBbind
11-mer
3uvk
RCSB PDB
PDBbind
11-mer
3uvl
RCSB PDB
PDBbind
11-mer
3uvn
RCSB PDB
PDBbind
11-mer
3uvo
RCSB PDB
PDBbind
11-mer
3uvx
RCSB PDB
PDBbind
11-mer
3uw9
RCSB PDB
PDBbind
11-mer
3v2x
RCSB PDB
PDBbind
11-mer
3va4
RCSB PDB
PDBbind
11-mer
3zke
RCSB PDB
PDBbind
11-mer
3zkf
RCSB PDB
PDBbind
11-mer
4aa2
RCSB PDB
PDBbind
11-mer
4b8o
RCSB PDB
PDBbind
11-mer
4bd3
RCSB PDB
PDBbind
11-mer
4ds1
RCSB PDB
PDBbind
11-mer
4e9c
RCSB PDB
PDBbind
11-mer
4fgy
RCSB PDB
PDBbind
11-mer
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
5awu
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
5awt
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=30.2uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Sci Rep Vol. 6: pp. 19565-19565
Ligand Properties
Formula
C
5
5
H
7
3
N
1
1
O
1
6
Molecular Weight
1144.230
Exact Mass
1143.520
No. of atoms
155
No. of bonds
159
Polar Surface Area
431.73
LOGP Value
-1.54 (
Computed with XLOGP3
)
-1.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 38
No. of Nitrogen and Oxygen Atoms: 27
No. of Rings: 5
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)O)Cc1ccccc1)Cc1ccccc1
InChI String
InChI=1S/C55H71N11O16/c56-22-8-7-15-37(55(81)82)61-50(76)39(27-33-13-5-2-6-14-33)63-52(78)43-17-9-23-65(43)53(79)40(28-46(70)71)60-45(69)31-58-44(68)30-59-49(75)38(26-32-11-3-1-4-12-32)62-51(77)42-16-10-24-66(42)54(80)41(29-47(72)73)64-48(74)36(57)25-34-18-20-35(67)21-19-34/h1-6,11-14,18-21,36-43,67H,7-10,15-17,22-31,56-57H2,(H,58,68)(H,59,75)(H,60,69)(H,61,76)(H,62,77)(H,63,78)(H,64,74)(H,70,71)(H,72,73)(H,81,82)/p+2/t36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P42566
Q9BQI5
Entrez Gene ID
NCBI Entrez Gene ID:
2060
84251
ASD
Information of known allosteric effects of PDB entries
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