Browse entries in the PDBbind-CN Database
HEADER 6D3G_COMPLEX COMPND 6D3G_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 279 SER ALA GLN SER PRO LEU LEU LYS GLU GLN ILE GLU THR SEQRES 2 A 279 ILE VAL THR GLY LYS LYS ALA THR VAL GLY VAL ALA VAL SEQRES 3 A 279 TRP GLY PRO ASP ASP LEU GLU PRO LEU LEU LEU ASN PRO SEQRES 4 A 279 PHE GLU LYS PHE PRO MET GLN SER VAL PHE LYS LEU HIS SEQRES 5 A 279 LEU ALA MET LEU VAL LEU HIS GLN VAL ASP GLN GLY LYS SEQRES 6 A 279 LEU ASP LEU ASN GLN SER VAL THR VAL ASN ARG ALA ALA SEQRES 7 A 279 VAL LEU GLN ASN THR TRP SER PRO MET MET LYS ASP HIS SEQRES 8 A 279 GLN GLY ASP GLU PHE THR VAL ALA VAL GLN GLN LEU LEU SEQRES 9 A 279 GLN TYR SER VAL SER HIS SER ASP ASN VAL ALA CYS ASP SEQRES 10 A 279 LEU LEU PHE GLU LEU VAL GLY GLY PRO GLN ALA LEU HIS SEQRES 11 A 279 ALA TYR ILE GLN SER LEU GLY VAL LYS GLU ALA ALA VAL SEQRES 12 A 279 VAL ALA ASN GLU ALA GLN MET HIS ALA ASP ASP GLN VAL SEQRES 13 A 279 GLN TYR GLN ASN TRP THR SER MET LYS ALA ALA ALA GLN SEQRES 14 A 279 VAL LEU GLN LYS PHE GLU GLN LYS LYS GLN LEU SER GLU SEQRES 15 A 279 THR SER GLN ALA LEU LEU TRP LYS TRP MET VAL GLU THR SEQRES 16 A 279 THR THR GLY PRO GLN ARG LEU LYS GLY LEU LEU PRO ALA SEQRES 17 A 279 GLY THR ILE VAL ALA HIS LYS THR GLY THR SER GLY VAL SEQRES 18 A 279 ARG ALA GLY LYS THR ALA ALA THR ASN ASP ALA GLY VAL SEQRES 19 A 279 ILE MET LEU PRO ASP GLY ARG PRO LEU LEU VAL ALA VAL SEQRES 20 A 279 PHE VAL LYS ASP SER ALA GLU SER GLU ARG THR ASN GLU SEQRES 21 A 279 ALA ILE ILE ALA GLN VAL ALA GLN ALA ALA TYR GLN PHE SEQRES 22 A 279 GLU LEU LYS LYS LEU SER HET NXL A 306 30 ATOM 1 N SER A 23 130.206 27.964 169.127 1.00 90.73 N ATOM 2 CA SER A 23 129.210 28.657 169.950 1.00 92.89 C ATOM 3 C SER A 23 127.871 27.912 169.922 1.00 84.37 C ATOM 4 O SER A 23 127.147 27.954 168.925 1.00 81.92 O ATOM 5 CB SER A 23 129.034 30.110 169.479 1.00 82.59 C ATOM 6 OG SER A 23 130.248 30.831 169.598 1.00 79.84 O ATOM 7 HG SER A 23 130.109 31.761 169.289 1.00 0.00 H ATOM 8 HN3 SER A 23 129.868 27.915 168.145 1.00 0.00 H ATOM 9 HN2 SER A 23 130.348 27.002 169.494 1.00 0.00 H ATOM 10 HN1 SER A 23 131.105 28.486 169.160 1.00 0.00 H ATOM 11 N ALA A 24 127.558 27.230 171.024 1.00 85.41 N ATOM 12 CA ALA A 24 126.354 26.412 171.126 1.00 83.83 C ATOM 13 C ALA A 24 125.139 27.302 171.400 1.00 88.53 C ATOM 14 O ALA A 24 125.213 28.530 171.283 1.00 91.44 O ATOM 15 CB ALA A 24 126.532 25.347 172.207 1.00 74.53 C ATOM 16 H ALA A 24 128.197 27.283 171.843 1.00 0.00 H ATOM 17 N GLN A 25 123.996 26.677 171.748 1.00 88.89 N ATOM 18 CA GLN A 25 122.879 27.334 172.436 1.00 91.13 C ATOM 19 C GLN A 25 123.355 28.525 173.296 1.00100.59 C ATOM 20 O GLN A 25 124.182 28.364 174.204 1.00100.67 O ATOM 21 CB GLN A 25 122.118 26.288 173.286 1.00 81.53 C ATOM 22 CG GLN A 25 122.834 25.760 174.569 1.00 81.81 C ATOM 23 CD GLN A 25 122.541 26.570 175.812 1.00 89.14 C ATOM 24 OE1 GLN A 25 121.551 26.394 176.428 1.00 87.82 O ATOM 25 NE2 GLN A 25 123.406 27.462 176.167 1.00 91.39 N ATOM 26 HE22 GLN A 25 124.272 27.599 175.607 1.00 0.00 H ATOM 27 HE21 GLN A 25 123.236 28.043 177.012 1.00 0.00 H ATOM 28 H GLN A 25 123.900 25.668 171.515 1.00 0.00 H ATOM 29 N SER A 26 122.905 29.746 173.015 1.00 96.21 N ATOM 30 CA SER A 26 123.462 30.801 173.862 1.00 92.96 C ATOM 31 C SER A 26 122.312 31.735 174.251 1.00 94.38 C ATOM 32 O SER A 26 121.153 31.373 173.998 1.00 91.76 O ATOM 33 CB SER A 26 124.655 31.461 173.148 1.00 94.72 C ATOM 34 OG SER A 26 124.260 32.444 172.207 1.00 95.98 O ATOM 35 HG SER A 26 125.064 32.833 171.781 1.00 0.00 H ATOM 36 H SER A 26 122.217 29.934 172.258 1.00 0.00 H ATOM 37 N PRO A 27 122.537 32.927 174.907 1.00 95.81 N ATOM 38 CA PRO A 27 121.467 33.448 175.774 1.00 93.47 C ATOM 39 C PRO A 27 120.310 34.084 175.023 1.00 86.82 C ATOM 40 O PRO A 27 119.153 34.031 175.462 1.00 87.04 O ATOM 41 CB PRO A 27 122.200 34.465 176.662 1.00 91.04 C ATOM 42 CG PRO A 27 123.506 34.788 175.939 1.00 86.59 C ATOM 43 CD PRO A 27 123.509 34.014 174.646 1.00 90.89 C ATOM 44 N LEU A 28 120.573 34.689 173.900 1.00 81.75 N ATOM 45 CA LEU A 28 119.430 35.236 173.217 1.00 83.83 C ATOM 46 C LEU A 28 118.673 34.183 172.410 1.00 78.09 C ATOM 47 O LEU A 28 117.476 34.350 172.149 1.00 76.03 O ATOM 48 CB LEU A 28 119.905 36.371 172.361 1.00 89.19 C ATOM 49 CG LEU A 28 118.908 36.679 171.366 1.00 85.86 C ATOM 50 CD1 LEU A 28 117.752 37.484 171.768 1.00 91.13 C ATOM 51 CD2 LEU A 28 119.781 37.133 170.280 1.00 87.94 C ATOM 52 H LEU A 28 121.539 34.771 173.524 1.00 0.00 H ATOM 53 N LEU A 29 119.288 33.045 172.097 1.00 75.29 N ATOM 54 CA LEU A 29 118.469 32.002 171.494 1.00 71.48 C ATOM 55 C LEU A 29 117.451 31.485 172.513 1.00 70.76 C ATOM 56 O LEU A 29 116.254 31.376 172.208 1.00 62.73 O ATOM 57 CB LEU A 29 119.334 30.858 170.952 1.00 68.49 C ATOM 58 CG LEU A 29 118.529 29.692 170.332 1.00 60.74 C ATOM 59 CD1 LEU A 29 117.660 30.222 169.189 1.00 49.71 C ATOM 60 CD2 LEU A 29 119.387 28.554 169.827 1.00 53.81 C ATOM 61 H LEU A 29 120.303 32.907 172.274 1.00 0.00 H ATOM 62 N LYS A 30 117.894 31.209 173.751 1.00 76.22 N ATOM 63 CA LYS A 30 116.970 30.620 174.729 1.00 73.67 C ATOM 64 C LYS A 30 115.895 31.612 175.129 1.00 75.75 C ATOM 65 O LYS A 30 114.784 31.212 175.513 1.00 72.54 O ATOM 66 CB LYS A 30 117.720 30.128 175.967 1.00 79.73 C ATOM 67 CG LYS A 30 116.933 29.063 176.742 1.00 75.69 C ATOM 68 CD LYS A 30 117.816 28.280 177.693 1.00 82.17 C ATOM 69 CE LYS A 30 117.124 26.990 178.142 1.00 81.01 C ATOM 70 NZ LYS A 30 118.111 26.071 178.757 1.00 75.61 N ATOM 71 HZ1 LYS A 30 118.848 25.839 178.061 1.00 0.00 H ATOM 72 HZ2 LYS A 30 118.545 26.532 179.582 1.00 0.00 H ATOM 73 HZ3 LYS A 30 117.630 25.199 179.058 1.00 0.00 H ATOM 74 H LYS A 30 118.880 31.410 174.014 1.00 0.00 H ATOM 75 N GLU A 31 116.203 32.899 174.993 1.00 69.86 N ATOM 76 CA GLU A 31 115.296 33.984 175.288 1.00 68.48 C ATOM 77 C GLU A 31 114.297 34.275 174.162 1.00 67.90 C ATOM 78 O GLU A 31 113.128 34.621 174.450 1.00 58.39 O ATOM 79 CB GLU A 31 116.147 35.221 175.593 1.00 75.82 C ATOM 80 CG GLU A 31 115.442 36.236 176.424 1.00 84.89 C ATOM 81 CD GLU A 31 114.763 37.141 175.513 1.00 92.93 C ATOM 82 OE1 GLU A 31 114.949 36.973 174.290 1.00 93.74 O ATOM 83 OE2 GLU A 31 114.013 38.039 175.916 1.00 94.97 O ATOM 84 H GLU A 31 117.156 33.139 174.653 1.00 0.00 H ATOM 85 N GLN A 32 114.705 34.137 172.899 1.00 66.34 N ATOM 86 CA GLN A 32 113.764 34.197 171.791 1.00 64.48 C ATOM 87 C GLN A 32 112.737 33.090 171.946 1.00 55.62 C ATOM 88 O GLN A 32 111.547 33.305 171.715 1.00 50.68 O ATOM 89 CB GLN A 32 114.513 34.056 170.459 1.00 62.24 C ATOM 90 CG GLN A 32 115.292 35.272 170.044 1.00 69.91 C ATOM 91 CD GLN A 32 116.157 34.984 168.853 1.00 69.18 C ATOM 92 OE1 GLN A 32 117.126 34.239 168.961 1.00 70.14 O ATOM 93 NE2 GLN A 32 115.807 35.543 167.708 1.00 68.18 N ATOM 94 HE22 GLN A 32 114.977 36.168 167.667 1.00 0.00 H ATOM 95 HE21 GLN A 32 116.362 35.358 166.848 1.00 0.00 H ATOM 96 H GLN A 32 115.715 33.984 172.703 1.00 0.00 H ATOM 97 N ILE A 33 113.180 31.900 172.356 1.00 56.29 N ATOM 98 CA ILE A 33 112.260 30.779 172.519 1.00 57.58 C ATOM 99 C ILE A 33 111.318 31.044 173.669 1.00 56.04 C ATOM 100 O ILE A 33 110.134 30.664 173.653 1.00 55.72 O ATOM 101 CB ILE A 33 113.040 29.474 172.686 1.00 50.97 C ATOM 102 CG1 ILE A 33 113.671 29.099 171.370 1.00 51.60 C ATOM 103 CG2 ILE A 33 112.104 28.411 172.968 1.00 54.96 C ATOM 104 CD1 ILE A 33 114.531 27.897 171.485 1.00 53.42 C ATOM 105 H ILE A 33 114.191 31.770 172.561 1.00 0.00 H ATOM 106 N GLU A 34 111.833 31.759 174.644 1.00 59.70 N ATOM 107 CA GLU A 34 111.106 32.192 175.819 1.00 62.83 C ATOM 108 C GLU A 34 109.958 33.103 175.454 1.00 57.38 C ATOM 109 O GLU A 34 108.801 32.811 175.790 1.00 54.48 O ATOM 110 CB GLU A 34 112.209 32.831 176.686 1.00 67.14 C ATOM 111 CG GLU A 34 112.591 32.023 177.878 1.00 77.27 C ATOM 112 CD GLU A 34 113.237 32.836 178.974 1.00 90.49 C ATOM 113 OE1 GLU A 34 112.645 33.818 179.470 1.00 90.69 O ATOM 114 OE2 GLU A 34 114.273 32.337 179.476 1.00 93.55 O ATOM 115 H GLU A 34 112.833 32.033 174.566 1.00 0.00 H ATOM 116 N THR A 35 110.207 34.109 174.605 1.00 53.04 N ATOM 117 CA THR A 35 109.082 34.959 174.234 1.00 57.01 C ATOM 118 C THR A 35 108.118 34.292 173.262 1.00 54.21 C ATOM 119 O THR A 35 106.961 34.724 173.188 1.00 55.43 O ATOM 120 CB THR A 35 109.543 36.299 173.658 1.00 53.13 C ATOM 121 OG1 THR A 35 109.737 36.192 172.262 1.00 68.95 O ATOM 122 CG2 THR A 35 110.792 36.785 174.322 1.00 60.20 C ATOM 123 HG1 THR A 35 110.426 35.506 172.077 1.00 0.00 H ATOM 124 H THR A 35 111.161 34.276 174.227 1.00 0.00 H ATOM 125 N ILE A 36 108.553 33.268 172.519 1.00 51.01 N ATOM 126 CA ILE A 36 107.649 32.616 171.566 1.00 51.36 C ATOM 127 C ILE A 36 106.613 31.751 172.289 1.00 49.00 C ATOM 128 O ILE A 36 105.470 31.650 171.839 1.00 48.95 O ATOM 129 CB ILE A 36 108.450 31.818 170.515 1.00 44.35 C ATOM 130 CG1 ILE A 36 109.126 32.781 169.524 1.00 44.99 C ATOM 131 CG2 ILE A 36 107.553 30.890 169.784 1.00 43.02 C ATOM 132 CD1 ILE A 36 110.373 32.250 168.843 1.00 39.38 C ATOM 133 H ILE A 36 109.533 32.934 172.617 1.00 0.00 H ATOM 134 N VAL A 37 106.951 31.136 173.425 1.00 48.28 N ATOM 135 CA VAL A 37 105.975 30.243 174.050 1.00 46.82 C ATOM 136 C VAL A 37 105.266 30.837 175.271 1.00 52.31 C ATOM 137 O VAL A 37 104.119 30.439 175.554 1.00 47.07 O ATOM 138 CB VAL A 37 106.622 28.894 174.431 1.00 49.54 C ATOM 139 CG1 VAL A 37 107.480 28.376 173.283 1.00 48.70 C ATOM 140 CG2 VAL A 37 107.426 29.008 175.730 1.00 53.42 C ATOM 141 H VAL A 37 107.886 31.288 173.855 1.00 0.00 H ATOM 142 N THR A 38 105.871 31.822 175.956 1.00 49.11 N ATOM 143 CA THR A 38 105.313 32.279 177.226 1.00 50.04 C ATOM 144 C THR A 38 103.913 32.836 177.018 1.00 50.22 C ATOM 145 O THR A 38 103.674 33.641 176.112 1.00 46.85 O ATOM 146 CB THR A 38 106.233 33.326 177.876 1.00 52.71 C ATOM 147 OG1 THR A 38 107.513 32.727 178.078 1.00 59.23 O ATOM 148 CG2 THR A 38 105.735 33.737 179.266 1.00 44.42 C ATOM 149 HG1 THR A 38 107.884 32.441 177.206 1.00 0.00 H ATOM 150 H THR A 38 106.737 32.259 175.582 1.00 0.00 H ATOM 151 N GLY A 39 102.985 32.395 177.865 1.00 50.91 N ATOM 152 CA GLY A 39 101.593 32.790 177.762 1.00 49.24 C ATOM 153 C GLY A 39 100.779 32.081 176.696 1.00 47.23 C ATOM 154 O GLY A 39 99.587 32.375 176.554 1.00 47.94 O ATOM 155 H GLY A 39 103.268 31.745 178.626 1.00 0.00 H ATOM 156 N LYS A 40 101.365 31.161 175.944 1.00 45.84 N ATOM 157 CA LYS A 40 100.594 30.409 174.971 1.00 38.90 C ATOM 158 C LYS A 40 99.901 29.230 175.638 1.00 45.36 C ATOM 159 O LYS A 40 100.500 28.489 176.441 1.00 44.51 O ATOM 160 CB LYS A 40 101.493 29.945 173.826 1.00 42.11 C ATOM 161 CG LYS A 40 102.045 31.090 172.959 1.00 40.45 C ATOM 162 CD LYS A 40 100.981 31.704 172.113 1.00 39.77 C ATOM 163 CE LYS A 40 101.557 32.781 171.159 1.00 43.24 C ATOM 164 NZ LYS A 40 101.835 34.083 171.895 1.00 43.27 N ATOM 165 HZ1 LYS A 40 100.950 34.444 172.305 1.00 0.00 H ATOM 166 HZ2 LYS A 40 102.525 33.910 172.654 1.00 0.00 H ATOM 167 HZ3 LYS A 40 102.219 34.782 171.228 1.00 0.00 H ATOM 168 H LYS A 40 102.383 30.977 176.051 1.00 0.00 H ATOM 169 N LYS A 41 98.629 29.036 175.298 1.00 42.63 N ATOM 170 CA LYS A 41 97.845 28.002 175.975 1.00 42.74 C ATOM 171 C LYS A 41 98.149 26.645 175.331 1.00 44.50 C ATOM 172 O LYS A 41 97.300 25.962 174.756 1.00 43.87 O ATOM 173 CB LYS A 41 96.367 28.371 175.950 1.00 40.72 C ATOM 174 CG LYS A 41 96.154 29.814 176.436 1.00 49.68 C ATOM 175 CD LYS A 41 94.735 30.362 176.231 1.00 58.32 C ATOM 176 CE LYS A 41 94.643 31.901 176.514 1.00 67.38 C ATOM 177 NZ LYS A 41 95.080 32.867 175.375 1.00 59.57 N ATOM 178 HZ1 LYS A 41 96.076 32.690 175.135 1.00 0.00 H ATOM 179 HZ2 LYS A 41 94.486 32.704 174.537 1.00 0.00 H ATOM 180 HZ3 LYS A 41 94.969 33.850 175.695 1.00 0.00 H ATOM 181 H LYS A 41 98.193 29.617 174.554 1.00 0.00 H ATOM 182 N ALA A 42 99.385 26.207 175.555 1.00 39.07 N ATOM 183 CA ALA A 42 99.889 24.954 175.014 1.00 43.79 C ATOM 184 C ALA A 42 101.150 24.607 175.792 1.00 47.85 C ATOM 185 O ALA A 42 101.690 25.431 176.525 1.00 43.57 O ATOM 186 CB ALA A 42 100.181 25.052 173.503 1.00 41.96 C ATOM 187 H ALA A 42 100.019 26.786 176.143 1.00 0.00 H ATOM 188 N THR A 43 101.580 23.356 175.665 1.00 47.15 N ATOM 189 CA THR A 43 102.858 22.896 176.185 1.00 42.61 C ATOM 190 C THR A 43 103.766 22.645 174.979 1.00 49.68 C ATOM 191 O THR A 43 103.519 21.719 174.189 1.00 47.12 O ATOM 192 CB THR A 43 102.669 21.630 177.010 1.00 51.21 C ATOM 193 OG1 THR A 43 101.698 21.870 178.042 1.00 50.86 O ATOM 194 CG2 THR A 43 103.999 21.191 177.607 1.00 44.26 C ATOM 195 HG1 THR A 43 101.576 21.046 178.577 1.00 0.00 H ATOM 196 H THR A 43 100.973 22.672 175.169 1.00 0.00 H ATOM 197 N VAL A 44 104.819 23.445 174.837 1.00 44.70 N ATOM 198 CA VAL A 44 105.629 23.422 173.628 1.00 49.64 C ATOM 199 C VAL A 44 106.947 22.682 173.888 1.00 44.84 C ATOM 200 O VAL A 44 107.778 23.129 174.680 1.00 47.28 O ATOM 201 CB VAL A 44 105.867 24.848 173.115 1.00 48.22 C ATOM 202 CG1 VAL A 44 106.553 24.818 171.793 1.00 50.64 C ATOM 203 CG2 VAL A 44 104.525 25.578 172.971 1.00 44.63 C ATOM 204 H VAL A 44 105.069 24.100 175.605 1.00 0.00 H ATOM 205 N GLY A 45 107.164 21.568 173.192 1.00 47.48 N ATOM 206 CA GLY A 45 108.456 20.870 173.239 1.00 46.06 C ATOM 207 C GLY A 45 109.368 21.402 172.146 1.00 45.39 C ATOM 208 O GLY A 45 108.919 21.728 171.048 1.00 44.77 O ATOM 209 H GLY A 45 106.400 21.182 172.601 1.00 0.00 H ATOM 210 N VAL A 46 110.642 21.565 172.481 1.00 41.88 N ATOM 211 CA VAL A 46 111.597 22.141 171.537 1.00 45.36 C ATOM 212 C VAL A 46 112.904 21.363 171.613 1.00 49.67 C ATOM 213 O VAL A 46 113.381 21.046 172.712 1.00 49.44 O ATOM 214 CB VAL A 46 111.844 23.637 171.815 1.00 43.05 C ATOM 215 CG1 VAL A 46 112.980 24.181 170.949 1.00 48.90 C ATOM 216 CG2 VAL A 46 110.593 24.439 171.591 1.00 40.73 C ATOM 217 H VAL A 46 110.965 21.279 173.427 1.00 0.00 H ATOM 218 N ALA A 47 113.462 21.022 170.455 1.00 40.73 N ATOM 219 CA ALA A 47 114.822 20.507 170.375 1.00 44.88 C ATOM 220 C ALA A 47 115.549 21.253 169.261 1.00 51.80 C ATOM 221 O ALA A 47 115.132 21.208 168.103 1.00 46.25 O ATOM 222 CB ALA A 47 114.844 18.995 170.122 1.00 46.59 C ATOM 223 H ALA A 47 112.910 21.126 169.580 1.00 0.00 H ATOM 224 N VAL A 48 116.669 21.878 169.599 1.00 54.77 N ATOM 225 CA VAL A 48 117.493 22.606 168.649 1.00 49.58 C ATOM 226 C VAL A 48 118.909 22.088 168.803 1.00 56.71 C ATOM 227 O VAL A 48 119.465 22.124 169.907 1.00 57.11 O ATOM 228 CB VAL A 48 117.461 24.117 168.888 1.00 45.40 C ATOM 229 CG1 VAL A 48 118.522 24.789 168.042 1.00 45.83 C ATOM 230 CG2 VAL A 48 116.087 24.653 168.581 1.00 48.45 C ATOM 231 H VAL A 48 116.972 21.845 170.593 1.00 0.00 H ATOM 232 N TRP A 49 119.467 21.541 167.726 1.00 53.66 N ATOM 233 CA TRP A 49 120.813 20.977 167.744 1.00 52.79 C ATOM 234 C TRP A 49 121.556 21.536 166.535 1.00 55.02 C ATOM 235 O TRP A 49 121.497 20.959 165.442 1.00 57.81 O ATOM 236 CB TRP A 49 120.737 19.460 167.724 1.00 51.42 C ATOM 237 CG TRP A 49 121.917 18.805 168.351 1.00 56.75 C ATOM 238 CD1 TRP A 49 123.135 19.378 168.601 1.00 58.11 C ATOM 239 CD2 TRP A 49 122.002 17.447 168.832 1.00 53.87 C ATOM 240 NE1 TRP A 49 123.979 18.452 169.194 1.00 55.60 N ATOM 241 CE2 TRP A 49 123.306 17.268 169.355 1.00 56.95 C ATOM 242 CE3 TRP A 49 121.109 16.360 168.858 1.00 55.67 C ATOM 243 CZ2 TRP A 49 123.733 16.048 169.910 1.00 58.68 C ATOM 244 CZ3 TRP A 49 121.541 15.140 169.417 1.00 49.43 C ATOM 245 CH2 TRP A 49 122.837 15.000 169.924 1.00 48.78 C ATOM 246 HE1 TRP A 49 124.966 18.627 169.472 1.00 0.00 H ATOM 247 H TRP A 49 118.924 21.514 166.839 1.00 0.00 H ATOM 248 N GLY A 50 122.269 22.641 166.724 1.00 54.74 N ATOM 249 CA GLY A 50 123.050 23.198 165.648 1.00 52.08 C ATOM 250 C GLY A 50 124.337 22.426 165.450 1.00 56.66 C ATOM 251 O GLY A 50 124.816 21.746 166.367 1.00 55.66 O ATOM 252 H GLY A 50 122.264 23.107 167.654 1.00 0.00 H ATOM 253 N PRO A 51 124.972 22.587 164.279 1.00 52.54 N ATOM 254 CA PRO A 51 126.105 21.716 163.926 1.00 52.37 C ATOM 255 C PRO A 51 127.363 21.942 164.761 1.00 62.65 C ATOM 256 O PRO A 51 128.334 21.200 164.574 1.00 61.06 O ATOM 257 CB PRO A 51 126.350 22.050 162.454 1.00 59.34 C ATOM 258 CG PRO A 51 125.908 23.514 162.327 1.00 48.96 C ATOM 259 CD PRO A 51 124.751 23.653 163.275 1.00 49.44 C ATOM 260 N ASP A 52 127.399 22.952 165.637 1.00 64.23 N ATOM 261 CA ASP A 52 128.524 23.176 166.541 1.00 62.39 C ATOM 262 C ASP A 52 128.184 22.866 167.995 1.00 60.60 C ATOM 263 O ASP A 52 129.025 23.089 168.874 1.00 61.13 O ATOM 264 CB ASP A 52 129.022 24.628 166.429 1.00 62.76 C ATOM 265 CG ASP A 52 129.447 24.993 165.013 1.00 63.13 C ATOM 266 OD1 ASP A 52 130.073 24.142 164.350 1.00 62.30 O ATOM 267 OD2 ASP A 52 129.152 26.123 164.559 1.00 66.78 O ATOM 268 H ASP A 52 126.591 23.606 165.676 1.00 0.00 H ATOM 269 N ASP A 53 126.992 22.341 168.271 1.00 56.20 N ATOM 270 CA ASP A 53 126.545 22.099 169.643 1.00 59.17 C ATOM 271 C ASP A 53 126.962 20.702 170.077 1.00 61.83 C ATOM 272 O ASP A 53 126.836 19.745 169.301 1.00 59.47 O ATOM 273 CB ASP A 53 125.019 22.231 169.773 1.00 61.42 C ATOM 274 CG ASP A 53 124.478 23.576 169.272 1.00 62.68 C ATOM 275 OD1 ASP A 53 125.270 24.529 169.117 1.00 57.61 O ATOM 276 OD2 ASP A 53 123.248 23.668 169.027 1.00 60.07 O ATOM 277 H ASP A 53 126.357 22.095 167.485 1.00 0.00 H ATOM 278 N LEU A 54 127.510 20.590 171.296 1.00 62.99 N ATOM 279 CA LEU A 54 127.700 19.256 171.867 1.00 62.49 C ATOM 280 C LEU A 54 126.376 18.662 172.321 1.00 63.62 C ATOM 281 O LEU A 54 126.175 17.447 172.244 1.00 65.41 O ATOM 282 CB LEU A 54 128.695 19.282 173.041 1.00 64.73 C ATOM 283 CG LEU A 54 130.191 19.569 172.795 1.00 68.58 C ATOM 284 CD1 LEU A 54 130.942 19.650 174.117 1.00 71.71 C ATOM 285 CD2 LEU A 54 130.855 18.549 171.868 1.00 63.61 C ATOM 286 H LEU A 54 127.795 21.438 171.827 1.00 0.00 H ATOM 287 N GLU A 55 125.449 19.505 172.749 1.00 65.85 N ATOM 288 CA GLU A 55 124.170 19.061 173.263 1.00 63.55 C ATOM 289 C GLU A 55 123.028 19.870 172.667 1.00 51.73 C ATOM 290 O GLU A 55 123.177 21.065 172.390 1.00 57.70 O ATOM 291 CB GLU A 55 124.155 19.177 174.794 1.00 67.64 C ATOM 292 CG GLU A 55 124.569 17.880 175.474 1.00 79.86 C ATOM 293 CD GLU A 55 124.833 18.047 176.962 1.00 91.24 C ATOM 294 OE1 GLU A 55 124.639 19.176 177.484 1.00 90.76 O ATOM 295 OE2 GLU A 55 125.181 17.029 177.608 1.00 91.77 O ATOM 296 H GLU A 55 125.647 20.525 172.715 1.00 0.00 H ATOM 297 N PRO A 56 121.864 19.250 172.499 1.00 51.34 N ATOM 298 CA PRO A 56 120.700 20.004 172.030 1.00 52.29 C ATOM 299 C PRO A 56 120.213 20.983 173.096 1.00 49.27 C ATOM 300 O PRO A 56 120.240 20.697 174.296 1.00 54.98 O ATOM 301 CB PRO A 56 119.652 18.909 171.770 1.00 50.09 C ATOM 302 CG PRO A 56 120.068 17.747 172.723 1.00 42.34 C ATOM 303 CD PRO A 56 121.566 17.810 172.683 1.00 56.65 C ATOM 304 N LEU A 57 119.767 22.136 172.645 1.00 49.92 N ATOM 305 CA LEU A 57 118.909 22.980 173.461 1.00 50.13 C ATOM 306 C LEU A 57 117.511 22.372 173.509 1.00 52.08 C ATOM 307 O LEU A 57 116.887 22.139 172.463 1.00 53.69 O ATOM 308 CB LEU A 57 118.856 24.390 172.863 1.00 49.85 C ATOM 309 CG LEU A 57 117.870 25.358 173.524 1.00 54.30 C ATOM 310 CD1 LEU A 57 118.137 25.493 175.023 1.00 58.96 C ATOM 311 CD2 LEU A 57 117.945 26.706 172.862 1.00 52.50 C ATOM 312 H LEU A 57 120.033 22.449 171.689 1.00 0.00 H ATOM 313 N LEU A 59 116.993 22.167 174.718 1.00 46.60 N ATOM 314 CA LEU A 59 115.701 21.527 174.930 1.00 45.58 C ATOM 315 C LEU A 59 114.797 22.452 175.737 1.00 50.45 C ATOM 316 O LEU A 59 115.257 23.215 176.594 1.00 53.25 O ATOM 317 CB LEU A 59 115.835 20.174 175.665 1.00 42.02 C ATOM 318 CG LEU A 59 116.854 19.182 175.103 1.00 47.07 C ATOM 319 CD1 LEU A 59 116.929 17.961 175.989 1.00 46.43 C ATOM 320 CD2 LEU A 59 116.464 18.776 173.702 1.00 42.86 C ATOM 321 H LEU A 59 117.535 22.478 175.549 1.00 0.00 H ATOM 322 N LEU A 60 113.501 22.387 175.442 1.00 52.98 N ATOM 323 CA LEU A 60 112.481 23.106 176.188 1.00 51.54 C ATOM 324 C LEU A 60 111.386 22.105 176.489 1.00 48.34 C ATOM 325 O LEU A 60 111.062 21.271 175.638 1.00 49.81 O ATOM 326 CB LEU A 60 111.912 24.294 175.396 1.00 52.26 C ATOM 327 CG LEU A 60 111.293 25.336 176.324 1.00 53.82 C ATOM 328 CD1 LEU A 60 112.332 26.348 176.817 1.00 51.31 C ATOM 329 CD2 LEU A 60 110.051 25.986 175.713 1.00 55.89 C ATOM 330 H LEU A 60 113.204 21.794 174.641 1.00 0.00 H ATOM 331 N ASN A 61 110.847 22.160 177.701 1.00 51.00 N ATOM 332 CA ASN A 61 109.972 21.118 178.217 1.00 44.65 C ATOM 333 C ASN A 61 110.588 19.721 178.012 1.00 48.82 C ATOM 334 O ASN A 61 109.934 18.843 177.467 1.00 53.11 O ATOM 335 CB ASN A 61 108.594 21.201 177.574 1.00 45.19 C ATOM 336 CG ASN A 61 107.764 22.327 178.163 1.00 52.99 C ATOM 337 OD1 ASN A 61 107.559 22.354 179.369 1.00 57.07 O ATOM 338 ND2 ASN A 61 107.346 23.292 177.340 1.00 47.03 N ATOM 339 HD22 ASN A 61 107.543 23.228 176.321 1.00 0.00 H ATOM 340 HD21 ASN A 61 106.824 24.108 177.718 1.00 0.00 H ATOM 341 H ASN A 61 111.058 22.980 178.305 1.00 0.00 H ATOM 342 N PRO A 62 111.815 19.512 178.498 1.00 54.04 N ATOM 343 CA PRO A 62 112.469 18.196 178.301 1.00 50.97 C ATOM 344 C PRO A 62 111.828 17.044 179.081 1.00 52.13 C ATOM 345 O PRO A 62 112.140 15.871 178.799 1.00 49.82 O ATOM 346 CB PRO A 62 113.904 18.438 178.786 1.00 49.29 C ATOM 347 CG PRO A 62 113.757 19.465 179.824 1.00 47.94 C ATOM 348 CD PRO A 62 112.644 20.401 179.326 1.00 50.80 C ATOM 349 N PHE A 63 110.950 17.325 180.037 1.00 49.51 N ATOM 350 CA PHE A 63 110.379 16.274 180.873 1.00 51.46 C ATOM 351 C PHE A 63 108.956 15.904 180.495 1.00 48.93 C ATOM 352 O PHE A 63 108.350 15.069 181.165 1.00 57.73 O ATOM 353 CB PHE A 63 110.449 16.706 182.336 1.00 50.34 C ATOM 354 CG PHE A 63 111.821 17.094 182.765 1.00 48.21 C ATOM 355 CD1 PHE A 63 112.881 16.212 182.613 1.00 50.72 C ATOM 356 CD2 PHE A 63 112.088 18.371 183.201 1.00 49.56 C ATOM 357 CE1 PHE A 63 114.187 16.574 182.973 1.00 49.25 C ATOM 358 CE2 PHE A 63 113.395 18.737 183.554 1.00 52.38 C ATOM 359 CZ PHE A 63 114.441 17.832 183.436 1.00 46.12 C ATOM 360 H PHE A 63 110.664 18.313 180.193 1.00 0.00 H ATOM 361 N GLU A 64 108.417 16.483 179.440 1.00 50.39 N ATOM 362 CA GLU A 64 107.072 16.180 178.996 1.00 47.38 C ATOM 363 C GLU A 64 107.092 15.001 178.037 1.00 49.67 C ATOM 364 O GLU A 64 108.089 14.753 177.361 1.00 50.47 O ATOM 365 CB GLU A 64 106.479 17.421 178.327 1.00 55.21 C ATOM 366 CG GLU A 64 104.976 17.472 178.260 1.00 59.48 C ATOM 367 CD GLU A 64 104.311 17.837 179.583 1.00 59.67 C ATOM 368 OE1 GLU A 64 105.020 18.187 180.582 1.00 58.02 O ATOM 369 OE2 GLU A 64 103.057 17.746 179.596 1.00 55.63 O ATOM 370 H GLU A 64 108.976 17.181 178.909 1.00 0.00 H ATOM 371 N LYS A 65 105.979 14.283 177.978 1.00 48.39 N ATOM 372 CA LYS A 65 105.786 13.202 177.023 1.00 49.59 C ATOM 373 C LYS A 65 104.907 13.748 175.904 1.00 54.28 C ATOM 374 O LYS A 65 103.717 14.013 176.117 1.00 52.73 O ATOM 375 CB LYS A 65 105.103 11.997 177.669 1.00 51.87 C ATOM 376 CG LYS A 65 105.810 11.386 178.848 1.00 49.24 C ATOM 377 CD LYS A 65 105.038 10.147 179.261 1.00 55.61 C ATOM 378 CE LYS A 65 105.642 9.487 180.478 1.00 56.98 C ATOM 379 NZ LYS A 65 107.009 9.051 180.170 1.00 61.77 N ATOM 380 HZ1 LYS A 65 106.986 8.372 179.382 1.00 0.00 H ATOM 381 HZ2 LYS A 65 107.583 9.876 179.902 1.00 0.00 H ATOM 382 HZ3 LYS A 65 107.424 8.597 181.009 1.00 0.00 H ATOM 383 H LYS A 65 105.210 14.502 178.643 1.00 0.00 H ATOM 384 N PHE A 66 105.486 13.929 174.721 1.00 44.79 N ATOM 385 CA PHE A 66 104.758 14.559 173.643 1.00 42.72 C ATOM 386 C PHE A 66 104.197 13.497 172.705 1.00 48.66 C ATOM 387 O PHE A 66 104.967 12.662 172.183 1.00 44.50 O ATOM 388 CB PHE A 66 105.666 15.507 172.885 1.00 41.45 C ATOM 389 CG PHE A 66 106.063 16.703 173.666 1.00 47.62 C ATOM 390 CD1 PHE A 66 107.169 16.660 174.499 1.00 46.63 C ATOM 391 CD2 PHE A 66 105.317 17.884 173.595 1.00 47.59 C ATOM 392 CE1 PHE A 66 107.573 17.784 175.218 1.00 50.25 C ATOM 393 CE2 PHE A 66 105.705 19.030 174.338 1.00 47.38 C ATOM 394 CZ PHE A 66 106.822 18.967 175.156 1.00 48.86 C ATOM 395 H PHE A 66 106.466 13.616 174.571 1.00 0.00 H ATOM 396 N PRO A 67 102.887 13.489 172.464 1.00 44.60 N ATOM 397 CA PRO A 67 102.318 12.552 171.486 1.00 46.65 C ATOM 398 C PRO A 67 102.847 12.832 170.088 1.00 48.00 C ATOM 399 O PRO A 67 102.923 13.990 169.645 1.00 44.07 O ATOM 400 CB PRO A 67 100.805 12.793 171.598 1.00 48.69 C ATOM 401 CG PRO A 67 100.653 14.149 172.267 1.00 47.15 C ATOM 402 CD PRO A 67 101.879 14.370 173.089 1.00 48.16 C ATOM 403 N MET A 68 103.267 11.754 169.409 1.00 48.66 N ATOM 404 CA MET A 68 103.998 11.903 168.152 1.00 44.17 C ATOM 405 C MET A 68 103.094 12.045 166.937 1.00 45.98 C ATOM 406 O MET A 68 103.471 12.749 165.979 1.00 40.73 O ATOM 407 CB MET A 68 104.932 10.728 167.947 1.00 43.04 C ATOM 408 CG MET A 68 106.163 10.729 168.862 1.00 44.77 C ATOM 409 SD MET A 68 107.327 9.424 168.325 1.00 50.26 S ATOM 410 CE MET A 68 106.555 7.991 169.143 1.00 40.55 C ATOM 411 H MET A 68 103.071 10.803 169.781 1.00 0.00 H ATOM 412 N GLN A 69 101.926 11.381 166.953 1.00 44.98 N ATOM 413 CA GLN A 69 101.090 11.259 165.765 1.00 43.42 C ATOM 414 C GLN A 69 101.968 10.869 164.584 1.00 48.59 C ATOM 415 O GLN A 69 102.849 10.000 164.720 1.00 45.63 O ATOM 416 CB GLN A 69 100.346 12.569 165.467 1.00 52.07 C ATOM 417 CG GLN A 69 99.222 12.870 166.464 1.00 50.45 C ATOM 418 CD GLN A 69 98.058 11.909 166.381 1.00 49.43 C ATOM 419 OE1 GLN A 69 97.981 11.077 165.480 1.00 58.71 O ATOM 420 NE2 GLN A 69 97.172 11.978 167.360 1.00 49.77 N ATOM 421 HE22 GLN A 69 97.274 12.698 168.104 1.00 0.00 H ATOM 422 HE21 GLN A 69 96.373 11.313 167.386 1.00 0.00 H ATOM 423 H GLN A 69 101.609 10.941 167.840 1.00 0.00 H ATOM 424 N SER A 70 101.755 11.525 163.436 1.00 47.53 N ATOM 425 CA SER A 70 102.416 11.122 162.201 1.00 44.98 C ATOM 426 C SER A 70 103.939 11.214 162.260 1.00 48.30 C ATOM 427 O SER A 70 104.599 10.703 161.346 1.00 50.26 O ATOM 428 CB SER A 70 101.906 11.985 161.028 1.00 46.01 C ATOM 429 OG SER A 70 100.646 11.536 160.520 1.00 51.63 O ATOM 430 HG SER A 70 99.969 11.572 161.241 1.00 0.00 H ATOM 431 H SER A 70 101.106 12.337 163.426 1.00 0.00 H ATOM 432 N VAL A 71 104.526 11.846 163.284 1.00 44.90 N ATOM 433 CA VAL A 71 105.988 11.968 163.285 1.00 48.72 C ATOM 434 C VAL A 71 106.649 10.589 163.363 1.00 48.25 C ATOM 435 O VAL A 71 107.709 10.365 162.763 1.00 50.77 O ATOM 436 CB VAL A 71 106.478 12.902 164.412 1.00 49.35 C ATOM 437 CG1 VAL A 71 107.991 12.851 164.512 1.00 42.11 C ATOM 438 CG2 VAL A 71 106.002 14.330 164.169 1.00 42.93 C ATOM 439 H VAL A 71 103.959 12.241 164.061 1.00 0.00 H ATOM 440 N PHE A 72 105.991 9.620 163.991 1.00 43.46 N ATOM 441 CA PHE A 72 106.630 8.329 164.148 1.00 41.22 C ATOM 442 C PHE A 72 106.690 7.540 162.841 1.00 45.82 C ATOM 443 O PHE A 72 107.317 6.481 162.800 1.00 43.28 O ATOM 444 CB PHE A 72 105.954 7.531 165.279 1.00 40.93 C ATOM 445 CG PHE A 72 104.629 6.863 164.923 1.00 45.03 C ATOM 446 CD1 PHE A 72 103.839 7.277 163.853 1.00 48.84 C ATOM 447 CD2 PHE A 72 104.179 5.788 165.699 1.00 46.09 C ATOM 448 CE1 PHE A 72 102.634 6.637 163.561 1.00 41.59 C ATOM 449 CE2 PHE A 72 102.968 5.147 165.412 1.00 45.01 C ATOM 450 CZ PHE A 72 102.204 5.571 164.342 1.00 43.45 C ATOM 451 H PHE A 72 105.034 9.785 164.363 1.00 0.00 H ATOM 452 N LYS A 73 106.100 8.046 161.762 1.00 46.85 N ATOM 453 CA LYS A 73 106.349 7.441 160.458 1.00 48.95 C ATOM 454 C LYS A 73 107.811 7.577 160.019 1.00 51.49 C ATOM 455 O LYS A 73 108.269 6.761 159.203 1.00 46.55 O ATOM 456 CB LYS A 73 105.398 8.052 159.420 1.00 44.66 C ATOM 457 CG LYS A 73 103.959 7.580 159.643 1.00 44.76 C ATOM 458 CD LYS A 73 102.965 8.458 158.950 1.00 48.33 C ATOM 459 CE LYS A 73 101.559 8.015 159.268 1.00 49.55 C ATOM 460 NZ LYS A 73 100.638 9.164 159.061 1.00 55.67 N ATOM 461 HZ1 LYS A 73 100.913 9.945 159.690 1.00 0.00 H ATOM 462 HZ2 LYS A 73 100.694 9.478 158.071 1.00 0.00 H ATOM 463 HZ3 LYS A 73 99.664 8.870 159.278 1.00 0.00 H ATOM 464 H LYS A 73 105.466 8.866 161.847 1.00 0.00 H ATOM 465 N LEU A 74 108.563 8.553 160.576 1.00 48.66 N ATOM 466 CA LEU A 74 110.013 8.603 160.368 1.00 44.22 C ATOM 467 C LEU A 74 110.691 7.403 161.025 1.00 45.35 C ATOM 468 O LEU A 74 111.421 6.661 160.375 1.00 48.05 O ATOM 469 CB LEU A 74 110.594 9.887 160.957 1.00 43.74 C ATOM 470 CG LEU A 74 112.129 9.884 161.070 1.00 43.14 C ATOM 471 CD1 LEU A 74 112.785 9.786 159.673 1.00 46.71 C ATOM 472 CD2 LEU A 74 112.661 11.071 161.763 1.00 39.28 C ATOM 473 H LEU A 74 108.105 9.280 161.162 1.00 0.00 H ATOM 474 N HIS A 75 110.430 7.196 162.316 1.00 46.26 N ATOM 475 CA HIS A 75 110.928 6.033 163.043 1.00 43.42 C ATOM 476 C HIS A 75 110.559 4.740 162.323 1.00 49.20 C ATOM 477 O HIS A 75 111.382 3.830 162.193 1.00 44.00 O ATOM 478 CB HIS A 75 110.324 6.010 164.439 1.00 38.36 C ATOM 479 CG HIS A 75 110.463 7.303 165.201 1.00 47.75 C ATOM 480 ND1 HIS A 75 109.897 8.489 164.774 1.00 44.47 N ATOM 481 CD2 HIS A 75 111.029 7.571 166.401 1.00 42.86 C ATOM 482 CE1 HIS A 75 110.157 9.436 165.652 1.00 43.50 C ATOM 483 NE2 HIS A 75 110.843 8.907 166.645 1.00 44.44 N ATOM 484 H HIS A 75 109.848 7.891 162.825 1.00 0.00 H ATOM 485 N LEU A 76 109.296 4.631 161.890 1.00 47.68 N ATOM 486 CA LEU A 76 108.833 3.434 161.194 1.00 49.47 C ATOM 487 C LEU A 76 109.619 3.197 159.919 1.00 50.57 C ATOM 488 O LEU A 76 110.092 2.083 159.672 1.00 48.35 O ATOM 489 CB LEU A 76 107.348 3.557 160.880 1.00 49.17 C ATOM 490 CG LEU A 76 106.656 2.332 160.287 1.00 51.67 C ATOM 491 CD1 LEU A 76 106.867 1.127 161.147 1.00 46.70 C ATOM 492 CD2 LEU A 76 105.162 2.616 160.111 1.00 51.17 C ATOM 493 H LEU A 76 108.632 5.415 162.053 1.00 0.00 H ATOM 494 N ALA A 77 109.789 4.254 159.111 1.00 50.50 N ATOM 495 CA ALA A 77 110.537 4.144 157.867 1.00 49.26 C ATOM 496 C ALA A 77 111.971 3.705 158.119 1.00 48.16 C ATOM 497 O ALA A 77 112.521 2.896 157.362 1.00 54.20 O ATOM 498 CB ALA A 77 110.511 5.472 157.123 1.00 49.38 C ATOM 499 H ALA A 77 109.378 5.171 159.379 1.00 0.00 H ATOM 500 N MET A 78 112.603 4.237 159.160 1.00 46.11 N ATOM 501 CA MET A 78 113.967 3.819 159.467 1.00 51.64 C ATOM 502 C MET A 78 114.011 2.317 159.784 1.00 51.81 C ATOM 503 O MET A 78 114.914 1.601 159.335 1.00 50.48 O ATOM 504 CB MET A 78 114.499 4.651 160.637 1.00 45.44 C ATOM 505 CG MET A 78 114.767 6.115 160.325 1.00 44.29 C ATOM 506 SD MET A 78 115.491 7.006 161.756 1.00 49.62 S ATOM 507 CE MET A 78 117.109 6.209 161.918 1.00 47.42 C ATOM 508 H MET A 78 112.128 4.947 159.753 1.00 0.00 H ATOM 509 N LEU A 79 112.982 1.803 160.454 1.00 49.48 N ATOM 510 CA LEU A 79 112.954 0.378 160.743 1.00 52.46 C ATOM 511 C LEU A 79 112.642 -0.429 159.488 1.00 59.64 C ATOM 512 O LEU A 79 113.259 -1.476 159.248 1.00 58.72 O ATOM 513 CB LEU A 79 111.903 0.089 161.814 1.00 43.81 C ATOM 514 CG LEU A 79 111.488 -1.360 162.026 1.00 49.86 C ATOM 515 CD1 LEU A 79 112.690 -2.153 162.529 1.00 49.64 C ATOM 516 CD2 LEU A 79 110.328 -1.481 162.996 1.00 47.89 C ATOM 517 H LEU A 79 112.203 2.416 160.769 1.00 0.00 H ATOM 518 N VAL A 80 111.737 0.067 158.641 1.00 52.10 N ATOM 519 CA VAL A 80 111.447 -0.656 157.413 1.00 53.17 C ATOM 520 C VAL A 80 112.686 -0.697 156.535 1.00 55.69 C ATOM 521 O VAL A 80 113.052 -1.751 156.006 1.00 58.45 O ATOM 522 CB VAL A 80 110.230 -0.044 156.691 1.00 60.32 C ATOM 523 CG1 VAL A 80 110.124 -0.538 155.242 1.00 49.83 C ATOM 524 CG2 VAL A 80 108.937 -0.354 157.466 1.00 57.05 C ATOM 525 H VAL A 80 111.246 0.958 158.856 1.00 0.00 H ATOM 526 N LEU A 81 113.393 0.430 156.425 1.00 57.18 N ATOM 527 CA LEU A 81 114.579 0.437 155.592 1.00 55.65 C ATOM 528 C LEU A 81 115.743 -0.311 156.228 1.00 60.92 C ATOM 529 O LEU A 81 116.613 -0.798 155.497 1.00 57.04 O ATOM 530 CB LEU A 81 115.002 1.878 155.283 1.00 57.94 C ATOM 531 CG LEU A 81 114.147 2.665 154.275 1.00 56.85 C ATOM 532 CD1 LEU A 81 114.499 4.180 154.152 1.00 50.43 C ATOM 533 CD2 LEU A 81 114.238 1.989 152.923 1.00 52.92 C ATOM 534 H LEU A 81 113.097 1.290 156.929 1.00 0.00 H ATOM 535 N HIS A 82 115.755 -0.477 157.553 1.00 60.56 N ATOM 536 CA HIS A 82 116.808 -1.289 158.152 1.00 57.05 C ATOM 537 C HIS A 82 116.528 -2.763 157.918 1.00 63.43 C ATOM 538 O HIS A 82 117.461 -3.537 157.688 1.00 62.29 O ATOM 539 CB HIS A 82 116.934 -0.973 159.645 1.00 56.63 C ATOM 540 CG HIS A 82 117.935 -1.810 160.390 1.00 60.84 C ATOM 541 ND1 HIS A 82 119.291 -1.750 160.137 1.00 62.77 N ATOM 542 CD2 HIS A 82 117.788 -2.659 161.434 1.00 58.50 C ATOM 543 CE1 HIS A 82 119.931 -2.539 160.979 1.00 60.13 C ATOM 544 NE2 HIS A 82 119.042 -3.106 161.775 1.00 63.04 N ATOM 545 H HIS A 82 115.026 -0.035 158.148 1.00 0.00 H ATOM 546 N GLN A 83 115.251 -3.158 157.905 1.00 62.15 N ATOM 547 CA GLN A 83 114.939 -4.534 157.544 1.00 60.95 C ATOM 548 C GLN A 83 115.160 -4.774 156.052 1.00 62.16 C ATOM 549 O GLN A 83 115.546 -5.881 155.663 1.00 63.62 O ATOM 550 CB GLN A 83 113.503 -4.878 157.922 1.00 56.84 C ATOM 551 CG GLN A 83 113.282 -5.123 159.372 1.00 56.07 C ATOM 552 CD GLN A 83 111.870 -5.636 159.663 1.00 61.24 C ATOM 553 OE1 GLN A 83 111.074 -5.914 158.741 1.00 58.00 O ATOM 554 NE2 GLN A 83 111.557 -5.782 160.953 1.00 59.36 N ATOM 555 HE22 GLN A 83 112.252 -5.538 161.688 1.00 0.00 H ATOM 556 HE21 GLN A 83 110.619 -6.140 161.223 1.00 0.00 H ATOM 557 H GLN A 83 114.491 -2.492 158.149 1.00 0.00 H ATOM 558 N VAL A 84 114.956 -3.745 155.207 1.00 60.10 N ATOM 559 CA VAL A 84 115.372 -3.834 153.805 1.00 57.76 C ATOM 560 C VAL A 84 116.883 -4.036 153.712 1.00 61.02 C ATOM 561 O VAL A 84 117.356 -4.952 153.030 1.00 65.44 O ATOM 562 CB VAL A 84 114.920 -2.591 153.017 1.00 56.71 C ATOM 563 CG1 VAL A 84 115.564 -2.562 151.665 1.00 53.67 C ATOM 564 CG2 VAL A 84 113.419 -2.584 152.835 1.00 55.90 C ATOM 565 H VAL A 84 114.498 -2.878 155.554 1.00 0.00 H ATOM 566 N ASP A 85 117.658 -3.221 154.447 1.00 61.97 N ATOM 567 CA ASP A 85 119.120 -3.355 154.479 1.00 58.06 C ATOM 568 C ASP A 85 119.547 -4.724 155.005 1.00 58.95 C ATOM 569 O ASP A 85 120.651 -5.187 154.706 1.00 59.20 O ATOM 570 CB ASP A 85 119.771 -2.279 155.365 1.00 54.91 C ATOM 571 CG ASP A 85 119.775 -0.875 154.739 1.00 58.27 C ATOM 572 OD1 ASP A 85 119.457 -0.749 153.553 1.00 59.53 O ATOM 573 OD2 ASP A 85 120.119 0.122 155.443 1.00 58.69 O ATOM 574 H ASP A 85 117.208 -2.472 155.011 1.00 0.00 H ATOM 575 N GLN A 86 118.733 -5.361 155.832 1.00 58.71 N ATOM 576 CA GLN A 86 119.094 -6.686 156.301 1.00 67.33 C ATOM 577 C GLN A 86 118.510 -7.800 155.436 1.00 68.85 C ATOM 578 O GLN A 86 118.752 -8.974 155.722 1.00 74.63 O ATOM 579 CB GLN A 86 118.689 -6.871 157.760 1.00 69.90 C ATOM 580 CG GLN A 86 119.620 -6.166 158.727 1.00 73.93 C ATOM 581 CD GLN A 86 119.175 -6.320 160.178 1.00 81.02 C ATOM 582 OE1 GLN A 86 117.976 -6.462 160.456 1.00 76.33 O ATOM 583 NE2 GLN A 86 120.144 -6.310 161.111 1.00 76.64 N ATOM 584 HE22 GLN A 86 121.137 -6.188 160.828 1.00 0.00 H ATOM 585 HE21 GLN A 86 119.900 -6.425 162.115 1.00 0.00 H ATOM 586 H GLN A 86 117.845 -4.917 156.142 1.00 0.00 H ATOM 587 N GLY A 87 117.735 -7.466 154.408 1.00 66.22 N ATOM 588 CA GLY A 87 117.214 -8.448 153.481 1.00 61.37 C ATOM 589 C GLY A 87 115.871 -9.041 153.843 1.00 70.51 C ATOM 590 O GLY A 87 115.283 -9.725 153.001 1.00 72.93 O ATOM 591 H GLY A 87 117.495 -6.464 154.265 1.00 0.00 H ATOM 592 N LYS A 88 115.310 -8.728 155.024 1.00 69.72 N ATOM 593 CA LYS A 88 114.027 -9.320 155.398 1.00 65.74 C ATOM 594 C LYS A 88 112.918 -8.832 154.475 1.00 65.96 C ATOM 595 O LYS A 88 111.928 -9.538 154.243 1.00 65.56 O ATOM 596 CB LYS A 88 113.669 -8.954 156.844 1.00 64.14 C ATOM 597 CG LYS A 88 114.640 -9.435 157.884 1.00 67.83 C ATOM 598 CD LYS A 88 114.294 -8.831 159.236 1.00 71.59 C ATOM 599 CE LYS A 88 115.430 -9.016 160.234 1.00 76.80 C ATOM 600 NZ LYS A 88 116.476 -8.004 159.922 1.00 79.42 N ATOM 601 HZ1 LYS A 88 116.819 -8.150 158.951 1.00 0.00 H ATOM 602 HZ2 LYS A 88 116.070 -7.050 160.008 1.00 0.00 H ATOM 603 HZ3 LYS A 88 117.267 -8.107 160.590 1.00 0.00 H ATOM 604 H LYS A 88 115.787 -8.067 155.669 1.00 0.00 H ATOM 605 N LEU A 89 113.090 -7.653 153.902 1.00 59.50 N ATOM 606 CA LEU A 89 112.135 -7.106 152.975 1.00 60.29 C ATOM 607 C LEU A 89 112.891 -6.613 151.757 1.00 59.80 C ATOM 608 O LEU A 89 114.112 -6.481 151.779 1.00 62.12 O ATOM 609 CB LEU A 89 111.392 -5.930 153.617 1.00 62.91 C ATOM 610 CG LEU A 89 110.918 -6.067 155.070 1.00 62.00 C ATOM 611 CD1 LEU A 89 110.329 -4.757 155.563 1.00 61.36 C ATOM 612 CD2 LEU A 89 109.987 -7.240 155.297 1.00 60.53 C ATOM 613 H LEU A 89 113.943 -7.103 154.129 1.00 0.00 H ATOM 614 N ASP A 90 112.143 -6.216 150.735 1.00 56.65 N ATOM 615 CA ASP A 90 112.731 -5.658 149.531 1.00 58.18 C ATOM 616 C ASP A 90 111.923 -4.449 149.086 1.00 63.36 C ATOM 617 O ASP A 90 110.697 -4.435 149.225 1.00 62.43 O ATOM 618 CB ASP A 90 112.739 -6.690 148.385 1.00 59.47 C ATOM 619 CG ASP A 90 113.868 -7.671 148.491 1.00 65.38 C ATOM 620 OD1 ASP A 90 113.930 -8.489 149.443 1.00 71.31 O ATOM 621 OD2 ASP A 90 114.711 -7.628 147.592 1.00 76.13 O ATOM 622 H ASP A 90 111.109 -6.307 150.799 1.00 0.00 H ATOM 623 N LEU A 91 112.610 -3.439 148.536 1.00 61.79 N ATOM 624 CA LEU A 91 111.894 -2.253 148.089 1.00 57.05 C ATOM 625 C LEU A 91 110.953 -2.542 146.923 1.00 65.85 C ATOM 626 O LEU A 91 109.899 -1.898 146.813 1.00 62.01 O ATOM 627 CB LEU A 91 112.877 -1.155 147.667 1.00 58.77 C ATOM 628 CG LEU A 91 113.787 -0.590 148.762 1.00 58.26 C ATOM 629 CD1 LEU A 91 115.039 0.023 148.180 1.00 54.83 C ATOM 630 CD2 LEU A 91 113.010 0.432 149.566 1.00 54.95 C ATOM 631 H LEU A 91 113.643 -3.501 148.430 1.00 0.00 H ATOM 632 N ASN A 92 111.240 -3.541 146.084 1.00 67.47 N ATOM 633 CA ASN A 92 110.306 -3.792 144.996 1.00 65.71 C ATOM 634 C ASN A 92 109.381 -4.932 145.338 1.00 63.65 C ATOM 635 O ASN A 92 108.561 -5.324 144.503 1.00 71.54 O ATOM 636 CB ASN A 92 111.044 -4.063 143.679 1.00 69.00 C ATOM 637 CG ASN A 92 111.874 -5.364 143.694 1.00 77.50 C ATOM 638 OD1 ASN A 92 111.793 -6.199 144.616 1.00 70.83 O ATOM 639 ND2 ASN A 92 112.675 -5.543 142.637 1.00 81.15 N ATOM 640 HD22 ASN A 92 112.715 -4.823 141.887 1.00 0.00 H ATOM 641 HD21 ASN A 92 113.257 -6.402 142.565 1.00 0.00 H ATOM 642 H ASN A 92 112.098 -4.117 146.203 1.00 0.00 H ATOM 643 N GLN A 93 109.385 -5.333 146.605 1.00 58.68 N ATOM 644 CA GLN A 93 108.525 -6.397 147.082 1.00 59.01 C ATOM 645 C GLN A 93 107.107 -5.892 147.140 1.00 60.66 C ATOM 646 O GLN A 93 106.843 -4.772 147.598 1.00 58.17 O ATOM 647 CB GLN A 93 108.953 -6.863 148.462 1.00 56.95 C ATOM 648 CG GLN A 93 107.832 -7.500 149.234 1.00 60.40 C ATOM 649 CD GLN A 93 108.279 -7.961 150.606 1.00 58.27 C ATOM 650 OE1 GLN A 93 109.455 -7.832 150.946 1.00 61.89 O ATOM 651 NE2 GLN A 93 107.339 -8.477 151.411 1.00 46.43 N ATOM 652 HE22 GLN A 93 106.358 -8.565 151.076 1.00 0.00 H ATOM 653 HE21 GLN A 93 107.590 -8.789 152.371 1.00 0.00 H ATOM 654 H GLN A 93 110.027 -4.867 147.277 1.00 0.00 H ATOM 655 N SER A 94 106.198 -6.723 146.658 1.00 63.28 N ATOM 656 CA SER A 94 104.818 -6.328 146.501 1.00 58.07 C ATOM 657 C SER A 94 104.059 -6.638 147.770 1.00 60.74 C ATOM 658 O SER A 94 104.379 -7.588 148.497 1.00 62.04 O ATOM 659 CB SER A 94 104.207 -7.059 145.317 1.00 60.16 C ATOM 660 OG SER A 94 104.564 -6.374 144.134 1.00 64.26 O ATOM 661 HG SER A 94 104.172 -6.840 143.353 1.00 0.00 H ATOM 662 H SER A 94 106.484 -7.685 146.385 1.00 0.00 H ATOM 663 N VAL A 95 103.044 -5.813 148.022 1.00 61.95 N ATOM 664 CA VAL A 95 102.176 -5.891 149.192 1.00 56.92 C ATOM 665 C VAL A 95 100.741 -5.740 148.733 1.00 58.59 C ATOM 666 O VAL A 95 100.427 -4.827 147.961 1.00 56.58 O ATOM 667 CB VAL A 95 102.515 -4.778 150.222 1.00 56.04 C ATOM 668 CG1 VAL A 95 101.671 -4.918 151.478 1.00 50.69 C ATOM 669 CG2 VAL A 95 103.971 -4.852 150.605 1.00 56.17 C ATOM 670 H VAL A 95 102.856 -5.057 147.333 1.00 0.00 H ATOM 671 N THR A 96 99.852 -6.557 149.295 1.00 51.57 N ATOM 672 CA THR A 96 98.462 -6.539 148.867 1.00 62.76 C ATOM 673 C THR A 96 97.734 -5.406 149.583 1.00 62.01 C ATOM 674 O THR A 96 97.725 -5.350 150.814 1.00 59.70 O ATOM 675 CB THR A 96 97.774 -7.873 149.183 1.00 61.09 C ATOM 676 OG1 THR A 96 98.280 -8.910 148.327 1.00 60.92 O ATOM 677 CG2 THR A 96 96.262 -7.744 148.982 1.00 59.90 C ATOM 678 HG1 THR A 96 97.828 -9.764 148.542 1.00 0.00 H ATOM 679 H THR A 96 100.154 -7.212 150.045 1.00 0.00 H ATOM 680 N VAL A 97 97.086 -4.537 148.810 1.00 62.32 N ATOM 681 CA VAL A 97 96.307 -3.420 149.333 1.00 60.99 C ATOM 682 C VAL A 97 94.889 -3.708 148.875 1.00 64.16 C ATOM 683 O VAL A 97 94.568 -3.529 147.694 1.00 71.97 O ATOM 684 CB VAL A 97 96.775 -2.052 148.803 1.00 64.11 C ATOM 685 CG1 VAL A 97 96.008 -0.917 149.489 1.00 64.40 C ATOM 686 CG2 VAL A 97 98.295 -1.858 148.929 1.00 64.20 C ATOM 687 H VAL A 97 97.138 -4.661 147.779 1.00 0.00 H ATOM 688 N ASN A 98 94.013 -4.014 149.815 1.00 66.14 N ATOM 689 CA ASN A 98 92.623 -4.305 149.512 1.00 67.44 C ATOM 690 C ASN A 98 91.750 -3.192 150.074 1.00 66.05 C ATOM 691 O ASN A 98 91.743 -2.968 151.287 1.00 64.97 O ATOM 692 CB ASN A 98 92.203 -5.633 150.120 1.00 63.13 C ATOM 693 CG ASN A 98 90.795 -5.965 149.780 1.00 66.61 C ATOM 694 OD1 ASN A 98 89.870 -5.515 150.460 1.00 69.82 O ATOM 695 ND2 ASN A 98 90.605 -6.762 148.732 1.00 64.44 N ATOM 696 HD22 ASN A 98 91.421 -7.114 148.192 1.00 0.00 H ATOM 697 HD21 ASN A 98 89.640 -7.033 148.453 1.00 0.00 H ATOM 698 H ASN A 98 94.329 -4.048 150.805 1.00 0.00 H ATOM 699 N ARG A 99 91.012 -2.512 149.184 1.00 60.67 N ATOM 700 CA ARG A 99 90.333 -1.271 149.549 1.00 64.41 C ATOM 701 C ARG A 99 89.398 -1.469 150.736 1.00 68.68 C ATOM 702 O ARG A 99 89.308 -0.602 151.617 1.00 69.98 O ATOM 703 CB ARG A 99 89.585 -0.704 148.333 1.00 66.89 C ATOM 704 CG ARG A 99 88.714 0.491 148.653 1.00 62.44 C ATOM 705 CD ARG A 99 88.670 1.534 147.553 1.00 63.41 C ATOM 706 NE ARG A 99 89.412 1.205 146.334 1.00 70.31 N ATOM 707 CZ ARG A 99 90.291 2.012 145.739 1.00 67.50 C ATOM 708 NH1 ARG A 99 90.572 3.192 146.257 1.00 68.59 N ATOM 709 NH2 ARG A 99 90.899 1.639 144.624 1.00 74.68 N ATOM 710 HE ARG A 99 89.241 0.275 145.901 1.00 0.00 H ATOM 711 HH12 ARG A 99 91.259 3.816 145.787 1.00 0.00 H ATOM 712 HH11 ARG A 99 90.107 3.498 147.135 1.00 0.00 H ATOM 713 HH22 ARG A 99 91.583 2.275 144.167 1.00 0.00 H ATOM 714 HH21 ARG A 99 90.693 0.710 144.205 1.00 0.00 H ATOM 715 H ARG A 99 90.921 -2.876 148.214 1.00 0.00 H ATOM 716 N ALA A 100 88.743 -2.626 150.811 1.00 66.12 N ATOM 717 CA ALA A 100 87.811 -2.900 151.891 1.00 62.38 C ATOM 718 C ALA A 100 88.498 -3.408 153.155 1.00 69.46 C ATOM 719 O ALA A 100 87.962 -3.231 154.259 1.00 68.82 O ATOM 720 CB ALA A 100 86.766 -3.917 151.419 1.00 63.08 C ATOM 721 H ALA A 100 88.902 -3.349 150.081 1.00 0.00 H ATOM 722 N ALA A 101 89.683 -4.008 153.027 1.00 68.58 N ATOM 723 CA ALA A 101 90.337 -4.643 154.170 1.00 61.14 C ATOM 724 C ALA A 101 91.077 -3.644 155.048 1.00 67.23 C ATOM 725 O ALA A 101 91.144 -3.831 156.264 1.00 70.47 O ATOM 726 CB ALA A 101 91.311 -5.709 153.676 1.00 61.67 C ATOM 727 H ALA A 101 90.150 -4.024 152.098 1.00 0.00 H ATOM 728 N VAL A 102 91.754 -2.670 154.429 1.00 68.27 N ATOM 729 CA VAL A 102 92.604 -1.682 155.093 1.00 63.64 C ATOM 730 C VAL A 102 91.807 -0.749 155.997 1.00 64.04 C ATOM 731 O VAL A 102 90.576 -0.682 155.914 1.00 66.70 O ATOM 732 CB VAL A 102 93.413 -0.864 154.057 1.00 64.83 C ATOM 733 CG1 VAL A 102 94.412 -1.743 153.290 1.00 57.08 C ATOM 734 CG2 VAL A 102 92.503 -0.079 153.096 1.00 66.55 C ATOM 735 H VAL A 102 91.669 -2.611 153.394 1.00 0.00 H ATOM 736 N LEU A 103 92.521 -0.002 156.838 1.00 61.58 N ATOM 737 CA LEU A 103 91.956 1.059 157.669 1.00 62.95 C ATOM 738 C LEU A 103 91.080 2.011 156.862 1.00 62.61 C ATOM 739 O LEU A 103 91.547 2.661 155.925 1.00 56.29 O ATOM 740 CB LEU A 103 93.095 1.840 158.335 1.00 64.55 C ATOM 741 CG LEU A 103 92.687 3.053 159.176 1.00 67.27 C ATOM 742 CD1 LEU A 103 91.900 2.567 160.392 1.00 61.83 C ATOM 743 CD2 LEU A 103 93.922 3.863 159.582 1.00 63.70 C ATOM 744 H LEU A 103 93.542 -0.185 156.907 1.00 0.00 H ATOM 745 N GLN A 103A 89.821 2.115 157.262 1.00 64.61 N ATOM 746 CA GLN A 103A 88.810 2.885 156.560 1.00 61.51 C ATOM 747 C GLN A 103A 88.792 4.336 157.029 1.00 65.21 C ATOM 748 O GLN A 103A 89.254 4.664 158.121 1.00 65.67 O ATOM 749 CB GLN A 103A 87.426 2.264 156.796 1.00 66.91 C ATOM 750 CG GLN A 103A 87.284 0.852 156.278 1.00 65.99 C ATOM 751 CD GLN A 103A 87.689 0.783 154.832 1.00 65.20 C ATOM 752 OE1 GLN A 103A 87.194 1.544 154.003 1.00 60.65 O ATOM 753 NE2 GLN A 103A 88.638 -0.091 154.526 1.00 66.30 N ATOM 754 HE22 GLN A 103A 89.027 -0.715 155.261 1.00 0.00 H ATOM 755 HE21 GLN A 103A 88.993 -0.153 153.551 1.00 0.00 H ATOM 756 H GLN A 103A 89.541 1.616 158.130 1.00 0.00 H ATOM 757 N ASN A 103B 88.218 5.198 156.189 1.00 65.28 N ATOM 758 CA ASN A 103B 87.849 6.560 156.554 1.00 66.74 C ATOM 759 C ASN A 103B 89.019 7.257 157.244 1.00 72.69 C ATOM 760 O ASN A 103B 88.988 7.603 158.434 1.00 74.19 O ATOM 761 CB ASN A 103B 86.610 6.557 157.454 1.00 68.61 C ATOM 762 CG ASN A 103B 85.422 5.863 156.814 1.00 69.50 C ATOM 763 OD1 ASN A 103B 85.037 6.162 155.680 1.00 68.52 O ATOM 764 ND2 ASN A 103B 84.829 4.927 157.553 1.00 64.83 N ATOM 765 HD22 ASN A 103B 85.190 4.709 158.504 1.00 0.00 H ATOM 766 HD21 ASN A 103B 84.005 4.414 157.179 1.00 0.00 H ATOM 767 H ASN A 103B 88.022 4.880 155.218 1.00 0.00 H ATOM 768 N THR A 104 90.080 7.425 156.472 1.00 69.90 N ATOM 769 CA THR A 104 91.310 7.942 157.030 1.00 62.67 C ATOM 770 C THR A 104 92.072 8.664 155.932 1.00 63.80 C ATOM 771 O THR A 104 91.698 8.626 154.751 1.00 62.54 O ATOM 772 CB THR A 104 92.119 6.807 157.632 1.00 65.19 C ATOM 773 OG1 THR A 104 93.138 7.341 158.476 1.00 61.74 O ATOM 774 CG2 THR A 104 92.729 5.964 156.500 1.00 61.11 C ATOM 775 HG1 THR A 104 92.721 7.869 159.202 1.00 0.00 H ATOM 776 H THR A 104 90.030 7.185 155.461 1.00 0.00 H ATOM 777 N TRP A 105 93.136 9.353 156.331 1.00 58.35 N ATOM 778 CA TRP A 105 93.919 10.074 155.345 1.00 57.98 C ATOM 779 C TRP A 105 94.838 9.108 154.612 1.00 57.75 C ATOM 780 O TRP A 105 95.650 8.413 155.231 1.00 61.58 O ATOM 781 CB TRP A 105 94.682 11.216 155.989 1.00 51.89 C ATOM 782 CG TRP A 105 95.730 11.775 155.092 1.00 54.07 C ATOM 783 CD1 TRP A 105 97.038 11.401 155.079 1.00 52.81 C ATOM 784 CD2 TRP A 105 95.587 12.769 154.047 1.00 55.80 C ATOM 785 NE1 TRP A 105 97.730 12.122 154.131 1.00 54.69 N ATOM 786 CE2 TRP A 105 96.869 12.959 153.480 1.00 53.43 C ATOM 787 CE3 TRP A 105 94.510 13.535 153.554 1.00 56.43 C ATOM 788 CZ2 TRP A 105 97.107 13.861 152.434 1.00 61.43 C ATOM 789 CZ3 TRP A 105 94.756 14.445 152.504 1.00 53.72 C ATOM 790 CH2 TRP A 105 96.042 14.590 151.959 1.00 55.73 C ATOM 791 HE1 TRP A 105 98.749 12.042 153.941 1.00 0.00 H ATOM 792 H TRP A 105 93.404 9.375 157.336 1.00 0.00 H ATOM 793 N SER A 106 94.660 9.033 153.309 1.00 56.42 N ATOM 794 CA SER A 106 95.431 8.141 152.455 1.00 57.12 C ATOM 795 C SER A 106 95.411 8.641 151.016 1.00 58.00 C ATOM 796 O SER A 106 94.448 8.373 150.287 1.00 62.59 O ATOM 797 CB SER A 106 94.882 6.718 152.514 1.00 61.21 C ATOM 798 OG SER A 106 95.749 5.821 151.825 1.00 66.04 O ATOM 799 HG SER A 106 96.644 5.839 152.247 1.00 0.00 H ATOM 800 H SER A 106 93.936 9.638 152.871 1.00 0.00 H ATOM 801 N PRO A 107 96.429 9.384 150.576 1.00 55.74 N ATOM 802 CA PRO A 107 96.551 9.653 149.141 1.00 59.41 C ATOM 803 C PRO A 107 96.729 8.386 148.306 1.00 64.66 C ATOM 804 O PRO A 107 96.419 8.408 147.108 1.00 62.94 O ATOM 805 CB PRO A 107 97.782 10.572 149.049 1.00 56.07 C ATOM 806 CG PRO A 107 97.908 11.185 150.384 1.00 58.64 C ATOM 807 CD PRO A 107 97.268 10.287 151.392 1.00 54.77 C ATOM 808 N MET A 108 97.201 7.281 148.893 1.00 61.83 N ATOM 809 CA MET A 108 97.375 6.064 148.107 1.00 63.02 C ATOM 810 C MET A 108 96.032 5.483 147.676 1.00 67.54 C ATOM 811 O MET A 108 95.894 4.984 146.550 1.00 67.31 O ATOM 812 CB MET A 108 98.156 5.031 148.915 1.00 63.30 C ATOM 813 CG MET A 108 98.400 3.744 148.173 1.00 60.19 C ATOM 814 SD MET A 108 99.247 2.575 149.232 1.00 58.87 S ATOM 815 CE MET A 108 98.005 2.285 150.481 1.00 54.10 C ATOM 816 H MET A 108 97.443 7.289 149.904 1.00 0.00 H ATOM 817 N MET A 109 95.028 5.541 148.557 1.00 67.70 N ATOM 818 CA MET A 109 93.716 4.996 148.228 1.00 66.35 C ATOM 819 C MET A 109 92.876 5.923 147.353 1.00 70.33 C ATOM 820 O MET A 109 91.723 5.584 147.074 1.00 78.14 O ATOM 821 CB MET A 109 92.948 4.660 149.503 1.00 62.97 C ATOM 822 CG MET A 109 93.642 3.673 150.407 1.00 62.93 C ATOM 823 SD MET A 109 94.308 2.245 149.507 1.00 71.00 S ATOM 824 CE MET A 109 92.790 1.487 148.897 1.00 61.63 C ATOM 825 H MET A 109 95.184 5.980 149.487 1.00 0.00 H ATOM 826 N LYS A 110 93.400 7.087 146.949 1.00 63.96 N ATOM 827 CA LYS A 110 92.786 7.943 145.941 1.00 60.86 C ATOM 828 C LYS A 110 93.603 8.008 144.658 1.00 67.37 C ATOM 829 O LYS A 110 93.046 8.244 143.582 1.00 70.21 O ATOM 830 CB LYS A 110 92.586 9.374 146.481 1.00 71.79 C ATOM 831 CG LYS A 110 91.582 9.542 147.660 1.00 72.29 C ATOM 832 CD LYS A 110 90.981 10.974 147.686 1.00 73.99 C ATOM 833 CE LYS A 110 90.391 11.372 149.051 1.00 75.64 C ATOM 834 NZ LYS A 110 89.107 10.674 149.380 1.00 72.59 N ATOM 835 HZ1 LYS A 110 88.395 10.901 148.657 1.00 0.00 H ATOM 836 HZ2 LYS A 110 89.267 9.647 149.400 1.00 0.00 H ATOM 837 HZ3 LYS A 110 88.770 10.991 150.311 1.00 0.00 H ATOM 838 H LYS A 110 94.295 7.398 147.378 1.00 0.00 H ATOM 839 N ASP A 111 94.912 7.781 144.756 1.00 63.66 N ATOM 840 CA ASP A 111 95.780 7.698 143.588 1.00 64.10 C ATOM 841 C ASP A 111 95.547 6.420 142.781 1.00 75.89 C ATOM 842 O ASP A 111 95.649 6.440 141.546 1.00 76.52 O ATOM 843 CB ASP A 111 97.232 7.775 144.045 1.00 69.83 C ATOM 844 CG ASP A 111 97.712 9.208 144.246 1.00 71.87 C ATOM 845 OD1 ASP A 111 96.886 10.155 144.136 1.00 65.48 O ATOM 846 OD2 ASP A 111 98.912 9.363 144.570 1.00 68.81 O ATOM 847 H ASP A 111 95.330 7.659 145.700 1.00 0.00 H ATOM 848 N HIS A 112 95.227 5.308 143.442 1.00 71.19 N ATOM 849 CA HIS A 112 95.142 4.016 142.783 1.00 74.29 C ATOM 850 C HIS A 112 93.707 3.513 142.784 1.00 75.92 C ATOM 851 O HIS A 112 93.077 3.398 143.844 1.00 76.05 O ATOM 852 CB HIS A 112 96.077 3.013 143.452 1.00 68.92 C ATOM 853 CG HIS A 112 97.511 3.443 143.455 1.00 71.29 C ATOM 854 ND1 HIS A 112 98.059 4.208 144.462 1.00 77.66 N ATOM 855 CD2 HIS A 112 98.522 3.183 142.592 1.00 68.42 C ATOM 856 CE1 HIS A 112 99.339 4.422 144.207 1.00 69.89 C ATOM 857 NE2 HIS A 112 99.645 3.804 143.081 1.00 72.55 N ATOM 858 H HIS A 112 95.032 5.367 144.462 1.00 0.00 H ATOM 859 N GLN A 112A 93.203 3.223 141.584 1.00 75.64 N ATOM 860 CA GLN A 112A 91.861 2.709 141.356 1.00 74.72 C ATOM 861 C GLN A 112A 91.835 1.186 141.482 1.00 75.43 C ATOM 862 O GLN A 112A 92.866 0.499 141.421 1.00 72.91 O ATOM 863 CB GLN A 112A 91.364 3.121 139.971 1.00 80.12 C ATOM 864 CG GLN A 112A 91.930 4.451 139.469 1.00 82.78 C ATOM 865 CD GLN A 112A 91.140 5.652 139.958 1.00 90.90 C ATOM 866 OE1 GLN A 112A 89.990 5.870 139.549 1.00100.69 O ATOM 867 NE2 GLN A 112A 91.754 6.445 140.831 1.00 81.46 N ATOM 868 HE22 GLN A 112A 92.720 6.222 141.146 1.00 0.00 H ATOM 869 HE21 GLN A 112A 91.268 7.288 141.199 1.00 0.00 H ATOM 870 H GLN A 112A 93.811 3.375 140.754 1.00 0.00 H ATOM 871 N GLY A 112B 90.644 0.664 141.681 1.00 73.26 N ATOM 872 CA GLY A 112B 90.550 -0.778 141.713 1.00 73.50 C ATOM 873 C GLY A 112B 90.255 -1.297 143.106 1.00 71.34 C ATOM 874 O GLY A 112B 90.592 -0.671 144.119 1.00 68.42 O ATOM 875 H GLY A 112B 89.805 1.264 141.810 1.00 0.00 H ATOM 876 N ASP A 113 89.594 -2.458 143.159 1.00 67.14 N ATOM 877 CA ASP A 113 89.148 -2.994 144.438 1.00 69.73 C ATOM 878 C ASP A 113 90.298 -3.635 145.206 1.00 67.26 C ATOM 879 O ASP A 113 90.253 -3.696 146.440 1.00 66.80 O ATOM 880 CB ASP A 113 88.046 -4.034 144.215 1.00 71.17 C ATOM 881 CG ASP A 113 86.788 -3.435 143.639 1.00 75.26 C ATOM 882 OD1 ASP A 113 86.762 -2.207 143.422 1.00 86.73 O ATOM 883 OD2 ASP A 113 85.825 -4.197 143.395 1.00 84.29 O ATOM 884 H ASP A 113 89.397 -2.981 142.282 1.00 0.00 H ATOM 885 N GLU A 114 91.310 -4.131 144.485 1.00 66.41 N ATOM 886 CA GLU A 114 92.527 -4.704 145.040 1.00 65.73 C ATOM 887 C GLU A 114 93.679 -4.513 144.064 1.00 72.11 C ATOM 888 O GLU A 114 93.518 -4.625 142.842 1.00 72.86 O ATOM 889 CB GLU A 114 92.397 -6.197 145.375 1.00 64.12 C ATOM 890 CG GLU A 114 93.538 -6.689 146.261 1.00 69.68 C ATOM 891 CD GLU A 114 93.388 -8.129 146.696 1.00 73.01 C ATOM 892 OE1 GLU A 114 92.323 -8.437 147.254 1.00 73.94 O ATOM 893 OE2 GLU A 114 94.317 -8.949 146.498 1.00 74.81 O ATOM 894 H GLU A 114 91.220 -4.105 143.449 1.00 0.00 H ATOM 895 N PHE A 115 94.831 -4.181 144.627 1.00 70.49 N ATOM 896 CA PHE A 115 96.064 -3.966 143.890 1.00 66.92 C ATOM 897 C PHE A 115 97.213 -4.172 144.860 1.00 65.16 C ATOM 898 O PHE A 115 97.013 -4.237 146.074 1.00 69.29 O ATOM 899 CB PHE A 115 96.074 -2.592 143.232 1.00 66.91 C ATOM 900 CG PHE A 115 95.860 -1.464 144.200 1.00 72.70 C ATOM 901 CD1 PHE A 115 94.579 -0.979 144.426 1.00 66.67 C ATOM 902 CD2 PHE A 115 96.925 -0.889 144.885 1.00 69.74 C ATOM 903 CE1 PHE A 115 94.373 0.051 145.302 1.00 70.75 C ATOM 904 CE2 PHE A 115 96.724 0.141 145.766 1.00 66.64 C ATOM 905 CZ PHE A 115 95.455 0.617 145.981 1.00 69.73 C ATOM 906 H PHE A 115 94.854 -4.067 145.661 1.00 0.00 H ATOM 907 N THR A 116 98.399 -4.361 144.309 1.00 67.79 N ATOM 908 CA THR A 116 99.622 -4.495 145.080 1.00 62.48 C ATOM 909 C THR A 116 100.518 -3.319 144.749 1.00 64.61 C ATOM 910 O THR A 116 100.537 -2.842 143.611 1.00 70.79 O ATOM 911 CB THR A 116 100.393 -5.763 144.790 1.00 60.56 C ATOM 912 OG1 THR A 116 101.059 -5.584 143.535 1.00 65.17 O ATOM 913 CG2 THR A 116 99.490 -6.957 144.753 1.00 60.81 C ATOM 914 HG1 THR A 116 101.674 -4.811 143.597 1.00 0.00 H ATOM 915 H THR A 116 98.459 -4.416 143.272 1.00 0.00 H ATOM 916 N VAL A 117 101.175 -2.793 145.760 1.00 62.80 N ATOM 917 CA VAL A 117 102.169 -1.750 145.570 1.00 61.15 C ATOM 918 C VAL A 117 103.469 -2.216 146.214 1.00 57.92 C ATOM 919 O VAL A 117 103.473 -3.041 147.131 1.00 57.48 O ATOM 920 CB VAL A 117 101.680 -0.403 146.146 1.00 66.99 C ATOM 921 CG1 VAL A 117 101.722 -0.424 147.661 1.00 60.07 C ATOM 922 CG2 VAL A 117 102.478 0.701 145.586 1.00 66.96 C ATOM 923 H VAL A 117 100.977 -3.133 146.723 1.00 0.00 H ATOM 924 N ALA A 118 104.580 -1.695 145.722 1.00 59.79 N ATOM 925 CA ALA A 118 105.864 -2.057 146.296 1.00 60.79 C ATOM 926 C ALA A 118 106.074 -1.399 147.658 1.00 56.48 C ATOM 927 O ALA A 118 105.488 -0.363 147.967 1.00 61.78 O ATOM 928 CB ALA A 118 107.002 -1.659 145.351 1.00 59.27 C ATOM 929 H ALA A 118 104.535 -1.027 144.926 1.00 0.00 H ATOM 930 N VAL A 119 106.881 -2.058 148.492 1.00 54.43 N ATOM 931 CA VAL A 119 107.269 -1.511 149.783 1.00 51.24 C ATOM 932 C VAL A 119 107.815 -0.095 149.627 1.00 55.85 C ATOM 933 O VAL A 119 107.520 0.798 150.436 1.00 52.69 O ATOM 934 CB VAL A 119 108.281 -2.446 150.463 1.00 48.51 C ATOM 935 CG1 VAL A 119 108.959 -1.742 151.623 1.00 56.42 C ATOM 936 CG2 VAL A 119 107.562 -3.667 150.980 1.00 51.35 C ATOM 937 H VAL A 119 107.244 -2.991 148.210 1.00 0.00 H ATOM 938 N GLN A 120 108.623 0.130 148.594 1.00 51.38 N ATOM 939 CA GLN A 120 109.116 1.471 148.303 1.00 53.28 C ATOM 940 C GLN A 120 107.978 2.487 148.158 1.00 58.12 C ATOM 941 O GLN A 120 108.107 3.639 148.589 1.00 51.42 O ATOM 942 CB GLN A 120 109.964 1.456 147.033 1.00 55.99 C ATOM 943 CG GLN A 120 110.262 2.841 146.577 1.00 56.66 C ATOM 944 CD GLN A 120 111.517 2.948 145.792 1.00 61.55 C ATOM 945 OE1 GLN A 120 112.210 1.958 145.577 1.00 65.09 O ATOM 946 NE2 GLN A 120 111.839 4.165 145.357 1.00 60.58 N ATOM 947 HE22 GLN A 120 111.218 4.973 145.565 1.00 0.00 H ATOM 948 HE21 GLN A 120 112.711 4.307 144.809 1.00 0.00 H ATOM 949 H GLN A 120 108.907 -0.663 147.984 1.00 0.00 H ATOM 950 N GLN A 121 106.879 2.121 147.490 1.00 59.21 N ATOM 951 CA GLN A 121 105.835 3.131 147.413 1.00 60.96 C ATOM 952 C GLN A 121 105.066 3.254 148.724 1.00 57.96 C ATOM 953 O GLN A 121 104.542 4.343 149.017 1.00 54.13 O ATOM 954 CB GLN A 121 104.888 2.879 146.238 1.00 54.13 C ATOM 955 CG GLN A 121 105.458 3.130 144.860 1.00 59.24 C ATOM 956 CD GLN A 121 106.469 2.107 144.403 1.00 71.58 C ATOM 957 OE1 GLN A 121 106.149 0.922 144.254 1.00 76.71 O ATOM 958 NE2 GLN A 121 107.702 2.559 144.154 1.00 72.32 N ATOM 959 HE22 GLN A 121 107.925 3.565 144.294 1.00 0.00 H ATOM 960 HE21 GLN A 121 108.438 1.905 143.820 1.00 0.00 H ATOM 961 H GLN A 121 106.778 1.181 147.056 1.00 0.00 H ATOM 962 N LEU A 122 104.987 2.170 149.516 1.00 50.63 N ATOM 963 CA LEU A 122 104.421 2.288 150.862 1.00 55.50 C ATOM 964 C LEU A 122 105.231 3.275 151.699 1.00 53.14 C ATOM 965 O LEU A 122 104.666 4.059 152.461 1.00 51.24 O ATOM 966 CB LEU A 122 104.373 0.925 151.547 1.00 49.73 C ATOM 967 CG LEU A 122 103.340 -0.098 151.071 1.00 55.08 C ATOM 968 CD1 LEU A 122 103.367 -1.289 151.998 1.00 46.20 C ATOM 969 CD2 LEU A 122 101.924 0.483 151.009 1.00 51.27 C ATOM 970 H LEU A 122 105.327 1.249 149.173 1.00 0.00 H ATOM 971 N LEU A 123 106.564 3.191 151.618 1.00 48.91 N ATOM 972 CA LEU A 123 107.436 4.092 152.364 1.00 56.35 C ATOM 973 C LEU A 123 107.232 5.539 151.943 1.00 55.43 C ATOM 974 O LEU A 123 107.040 6.420 152.789 1.00 47.73 O ATOM 975 CB LEU A 123 108.900 3.671 152.182 1.00 55.21 C ATOM 976 CG LEU A 123 109.311 2.440 152.994 1.00 52.32 C ATOM 977 CD1 LEU A 123 110.623 1.853 152.511 1.00 52.46 C ATOM 978 CD2 LEU A 123 109.477 2.939 154.394 1.00 47.93 C ATOM 979 H LEU A 123 106.990 2.465 151.007 1.00 0.00 H ATOM 980 N GLN A 124 107.242 5.801 150.634 1.00 50.72 N ATOM 981 CA GLN A 124 107.097 7.182 150.182 1.00 53.87 C ATOM 982 C GLN A 124 105.755 7.773 150.589 1.00 53.30 C ATOM 983 O GLN A 124 105.669 8.958 150.934 1.00 52.13 O ATOM 984 CB GLN A 124 107.249 7.276 148.668 1.00 54.27 C ATOM 985 CG GLN A 124 106.560 8.494 148.137 1.00 57.50 C ATOM 986 CD GLN A 124 106.673 8.651 146.664 1.00 70.44 C ATOM 987 OE1 GLN A 124 106.787 7.662 145.929 1.00 70.91 O ATOM 988 NE2 GLN A 124 106.588 9.909 146.196 1.00 71.86 N ATOM 989 HE22 GLN A 124 106.493 10.705 146.859 1.00 0.00 H ATOM 990 HE21 GLN A 124 106.617 10.086 145.172 1.00 0.00 H ATOM 991 H GLN A 124 107.352 5.031 149.944 1.00 0.00 H ATOM 992 N TYR A 125 104.702 6.964 150.526 1.00 50.50 N ATOM 993 CA TYR A 125 103.380 7.401 150.934 1.00 53.59 C ATOM 994 C TYR A 125 103.313 7.723 152.419 1.00 50.04 C ATOM 995 O TYR A 125 102.645 8.693 152.825 1.00 44.75 O ATOM 996 CB TYR A 125 102.355 6.337 150.579 1.00 51.09 C ATOM 997 CG TYR A 125 101.796 6.553 149.209 1.00 58.16 C ATOM 998 CD1 TYR A 125 101.081 7.696 148.922 1.00 56.35 C ATOM 999 CD2 TYR A 125 101.978 5.619 148.196 1.00 58.65 C ATOM 1000 CE1 TYR A 125 100.558 7.916 147.657 1.00 58.82 C ATOM 1001 CE2 TYR A 125 101.455 5.835 146.922 1.00 64.20 C ATOM 1002 CZ TYR A 125 100.749 6.994 146.663 1.00 60.55 C ATOM 1003 OH TYR A 125 100.210 7.247 145.422 1.00 63.33 O ATOM 1004 HH TYR A 125 99.746 8.121 145.437 1.00 0.00 H ATOM 1005 H TYR A 125 104.829 5.993 150.175 1.00 0.00 H ATOM 1006 N SER A 126 103.942 6.887 153.239 1.00 48.39 N ATOM 1007 CA SER A 126 103.908 7.091 154.680 1.00 49.67 C ATOM 1008 C SER A 126 104.757 8.291 155.077 1.00 52.34 C ATOM 1009 O SER A 126 104.323 9.144 155.866 1.00 49.83 O ATOM 1010 CB SER A 126 104.396 5.828 155.378 1.00 47.56 C ATOM 1011 OG SER A 126 104.317 5.966 156.784 1.00 49.61 O ATOM 1012 HG SER A 126 104.639 5.135 157.215 1.00 0.00 H ATOM 1013 H SER A 126 104.464 6.078 152.847 1.00 0.00 H ATOM 1014 N VAL A 127 105.955 8.399 154.512 1.00 47.16 N ATOM 1015 CA VAL A 127 106.864 9.456 154.935 1.00 49.66 C ATOM 1016 C VAL A 127 106.480 10.788 154.306 1.00 46.98 C ATOM 1017 O VAL A 127 106.238 11.766 155.023 1.00 51.14 O ATOM 1018 CB VAL A 127 108.321 9.080 154.611 1.00 50.67 C ATOM 1019 CG1 VAL A 127 109.232 10.251 154.926 1.00 47.63 C ATOM 1020 CG2 VAL A 127 108.735 7.863 155.421 1.00 50.28 C ATOM 1021 H VAL A 127 106.243 7.730 153.769 1.00 0.00 H ATOM 1022 N SER A 128 106.382 10.834 152.966 1.00 47.76 N ATOM 1023 CA SER A 128 106.167 12.089 152.243 1.00 49.66 C ATOM 1024 C SER A 128 104.728 12.544 152.289 1.00 50.24 C ATOM 1025 O SER A 128 104.467 13.743 152.410 1.00 49.63 O ATOM 1026 CB SER A 128 106.553 11.968 150.774 1.00 48.19 C ATOM 1027 OG SER A 128 107.930 11.815 150.628 1.00 55.47 O ATOM 1028 HG SER A 128 108.391 12.602 151.013 1.00 0.00 H ATOM 1029 H SER A 128 106.462 9.949 152.425 1.00 0.00 H ATOM 1030 N HIS A 129 103.779 11.620 152.183 1.00 49.47 N ATOM 1031 CA HIS A 129 102.387 12.019 152.162 1.00 45.62 C ATOM 1032 C HIS A 129 101.674 11.721 153.464 1.00 45.78 C ATOM 1033 O HIS A 129 100.476 11.971 153.556 1.00 50.24 O ATOM 1034 CB HIS A 129 101.694 11.338 150.989 1.00 52.79 C ATOM 1035 CG HIS A 129 102.358 11.616 149.676 1.00 55.46 C ATOM 1036 ND1 HIS A 129 102.112 12.755 148.940 1.00 63.82 N ATOM 1037 CD2 HIS A 129 103.284 10.917 148.981 1.00 59.93 C ATOM 1038 CE1 HIS A 129 102.849 12.741 147.845 1.00 60.48 C ATOM 1039 NE2 HIS A 129 103.568 11.636 147.844 1.00 63.45 N ATOM 1040 H HIS A 129 104.035 10.614 152.115 1.00 0.00 H ATOM 1041 N SER A 130 102.379 11.200 154.474 1.00 45.85 N ATOM 1042 CA SER A 130 101.818 10.966 155.802 1.00 44.35 C ATOM 1043 C SER A 130 100.614 10.041 155.742 1.00 48.12 C ATOM 1044 O SER A 130 99.666 10.180 156.517 1.00 47.84 O ATOM 1045 CB SER A 130 101.449 12.285 156.482 1.00 49.76 C ATOM 1046 OG SER A 130 101.428 12.129 157.897 1.00 51.49 O ATOM 1047 HG SER A 130 101.188 12.992 158.319 1.00 0.00 H ATOM 1048 H SER A 130 103.374 10.950 154.306 1.00 0.00 H ATOM 1049 N ASP A 131 100.707 9.011 154.899 1.00 52.84 N ATOM 1050 CA ASP A 131 99.553 8.196 154.541 1.00 50.21 C ATOM 1051 C ASP A 131 99.310 7.165 155.626 1.00 49.05 C ATOM 1052 O ASP A 131 100.232 6.450 156.023 1.00 52.71 O ATOM 1053 CB ASP A 131 99.818 7.509 153.193 1.00 54.12 C ATOM 1054 CG ASP A 131 98.620 6.707 152.648 1.00 53.67 C ATOM 1055 OD1 ASP A 131 98.223 5.665 153.209 1.00 53.38 O ATOM 1056 OD2 ASP A 131 98.108 7.104 151.591 1.00 60.05 O ATOM 1057 H ASP A 131 101.633 8.782 154.484 1.00 0.00 H ATOM 1058 N ASN A 132 98.063 7.081 156.102 1.00 51.76 N ATOM 1059 CA ASN A 132 97.770 6.234 157.255 1.00 53.51 C ATOM 1060 C ASN A 132 97.626 4.761 156.866 1.00 53.52 C ATOM 1061 O ASN A 132 98.010 3.869 157.639 1.00 52.15 O ATOM 1062 CB ASN A 132 96.516 6.742 157.983 1.00 54.47 C ATOM 1063 CG ASN A 132 96.808 7.925 158.901 1.00 57.08 C ATOM 1064 OD1 ASN A 132 97.929 8.068 159.411 1.00 52.24 O ATOM 1065 ND2 ASN A 132 95.803 8.777 159.125 1.00 55.81 N ATOM 1066 HD22 ASN A 132 94.878 8.619 158.677 1.00 0.00 H ATOM 1067 HD21 ASN A 132 95.946 9.598 159.748 1.00 0.00 H ATOM 1068 H ASN A 132 97.299 7.621 155.649 1.00 0.00 H ATOM 1069 N VAL A 133 97.043 4.482 155.702 1.00 54.46 N ATOM 1070 CA VAL A 133 96.924 3.095 155.246 1.00 54.91 C ATOM 1071 C VAL A 133 98.306 2.515 154.954 1.00 50.87 C ATOM 1072 O VAL A 133 98.679 1.455 155.473 1.00 48.34 O ATOM 1073 CB VAL A 133 95.999 3.021 154.012 1.00 55.30 C ATOM 1074 CG1 VAL A 133 95.932 1.597 153.453 1.00 52.63 C ATOM 1075 CG2 VAL A 133 94.621 3.480 154.395 1.00 56.76 C ATOM 1076 H VAL A 133 96.670 5.254 155.113 1.00 0.00 H ATOM 1077 N ALA A 134 99.099 3.223 154.147 1.00 53.76 N ATOM 1078 CA ALA A 134 100.448 2.759 153.837 1.00 55.81 C ATOM 1079 C ALA A 134 101.248 2.525 155.117 1.00 53.98 C ATOM 1080 O ALA A 134 101.954 1.508 155.252 1.00 49.59 O ATOM 1081 CB ALA A 134 101.131 3.755 152.899 1.00 46.30 C ATOM 1082 H ALA A 134 98.753 4.113 153.735 1.00 0.00 H ATOM 1083 N CYS A 135 101.124 3.446 156.077 1.00 52.38 N ATOM 1084 CA CYS A 135 101.822 3.310 157.351 1.00 49.60 C ATOM 1085 C CYS A 135 101.409 2.035 158.086 1.00 49.77 C ATOM 1086 O CYS A 135 102.259 1.305 158.609 1.00 50.95 O ATOM 1087 CB CYS A 135 101.577 4.557 158.203 1.00 54.41 C ATOM 1088 SG CYS A 135 101.928 4.331 159.958 1.00 52.72 S ATOM 1089 H CYS A 135 100.519 4.276 155.913 1.00 0.00 H ATOM 1090 N ASP A 136 100.099 1.761 158.165 1.00 55.73 N ATOM 1091 CA ASP A 136 99.639 0.555 158.865 1.00 55.01 C ATOM 1092 C ASP A 136 100.032 -0.736 158.139 1.00 51.55 C ATOM 1093 O ASP A 136 100.217 -1.778 158.784 1.00 54.64 O ATOM 1094 CB ASP A 136 98.124 0.589 159.090 1.00 48.58 C ATOM 1095 CG ASP A 136 97.757 1.071 160.488 1.00 59.88 C ATOM 1096 OD1 ASP A 136 98.626 1.673 161.177 1.00 57.10 O ATOM 1097 OD2 ASP A 136 96.617 0.778 160.928 1.00 60.44 O ATOM 1098 H ASP A 136 99.407 2.404 157.730 1.00 0.00 H ATOM 1099 N LEU A 137 100.134 -0.712 156.813 1.00 50.73 N ATOM 1100 CA LEU A 137 100.626 -1.907 156.120 1.00 53.43 C ATOM 1101 C LEU A 137 102.100 -2.142 156.423 1.00 52.35 C ATOM 1102 O LEU A 137 102.515 -3.288 156.621 1.00 53.91 O ATOM 1103 CB LEU A 137 100.398 -1.817 154.610 1.00 53.16 C ATOM 1104 CG LEU A 137 98.969 -1.637 154.079 1.00 57.26 C ATOM 1105 CD1 LEU A 137 98.916 -1.431 152.555 1.00 49.04 C ATOM 1106 CD2 LEU A 137 98.196 -2.895 154.454 1.00 47.59 C ATOM 1107 H LEU A 137 99.870 0.139 156.277 1.00 0.00 H ATOM 1108 N LEU A 138 102.909 -1.071 156.483 1.00 54.57 N ATOM 1109 CA LEU A 138 104.300 -1.271 156.864 1.00 48.55 C ATOM 1110 C LEU A 138 104.437 -1.782 158.291 1.00 50.87 C ATOM 1111 O LEU A 138 105.324 -2.595 158.560 1.00 52.66 O ATOM 1112 CB LEU A 138 105.110 -0.006 156.669 1.00 47.40 C ATOM 1113 CG LEU A 138 105.146 0.557 155.258 1.00 50.60 C ATOM 1114 CD1 LEU A 138 105.621 1.996 155.302 1.00 51.18 C ATOM 1115 CD2 LEU A 138 106.071 -0.289 154.422 1.00 49.28 C ATOM 1116 H LEU A 138 102.550 -0.120 156.262 1.00 0.00 H ATOM 1117 N PHE A 139 103.541 -1.383 159.197 1.00 50.72 N ATOM 1118 CA PHE A 139 103.530 -1.976 160.532 1.00 49.55 C ATOM 1119 C PHE A 139 103.306 -3.490 160.471 1.00 55.08 C ATOM 1120 O PHE A 139 103.968 -4.251 161.183 1.00 50.78 O ATOM 1121 CB PHE A 139 102.478 -1.295 161.404 1.00 50.84 C ATOM 1122 CG PHE A 139 103.049 -0.224 162.316 1.00 54.07 C ATOM 1123 CD1 PHE A 139 104.186 -0.482 163.097 1.00 52.12 C ATOM 1124 CD2 PHE A 139 102.486 1.054 162.354 1.00 47.61 C ATOM 1125 CE1 PHE A 139 104.736 0.504 163.919 1.00 50.31 C ATOM 1126 CE2 PHE A 139 103.031 2.047 163.178 1.00 52.16 C ATOM 1127 CZ PHE A 139 104.156 1.776 163.961 1.00 49.89 C ATOM 1128 H PHE A 139 102.848 -0.647 158.951 1.00 0.00 H ATOM 1129 N GLU A 140 102.400 -3.956 159.614 1.00 58.20 N ATOM 1130 CA GLU A 140 102.210 -5.401 159.516 1.00 59.33 C ATOM 1131 C GLU A 140 103.494 -6.113 159.090 1.00 59.34 C ATOM 1132 O GLU A 140 103.869 -7.133 159.687 1.00 58.64 O ATOM 1133 CB GLU A 140 101.078 -5.738 158.552 1.00 61.02 C ATOM 1134 CG GLU A 140 99.707 -5.338 159.039 1.00 59.80 C ATOM 1135 CD GLU A 140 98.662 -5.567 157.980 1.00 67.62 C ATOM 1136 OE1 GLU A 140 97.499 -5.128 158.161 1.00 71.94 O ATOM 1137 OE2 GLU A 140 99.009 -6.191 156.951 1.00 75.31 O ATOM 1138 H GLU A 140 101.840 -3.305 159.027 1.00 0.00 H ATOM 1139 N LEU A 141 104.227 -5.550 158.120 1.00 58.99 N ATOM 1140 CA LEU A 141 105.385 -6.254 157.577 1.00 51.94 C ATOM 1141 C LEU A 141 106.563 -6.296 158.552 1.00 60.44 C ATOM 1142 O LEU A 141 107.458 -7.142 158.395 1.00 63.67 O ATOM 1143 CB LEU A 141 105.858 -5.591 156.284 1.00 59.33 C ATOM 1144 CG LEU A 141 104.867 -5.409 155.113 1.00 57.71 C ATOM 1145 CD1 LEU A 141 105.537 -4.627 153.987 1.00 57.51 C ATOM 1146 CD2 LEU A 141 104.216 -6.703 154.602 1.00 60.39 C ATOM 1147 H LEU A 141 103.971 -4.611 157.754 1.00 0.00 H ATOM 1148 N VAL A 142 106.582 -5.460 159.593 1.00 54.94 N ATOM 1149 CA VAL A 142 107.764 -5.407 160.452 1.00 54.39 C ATOM 1150 C VAL A 142 107.511 -5.992 161.823 1.00 57.47 C ATOM 1151 O VAL A 142 108.480 -6.217 162.567 1.00 54.02 O ATOM 1152 CB VAL A 142 108.312 -3.970 160.580 1.00 55.29 C ATOM 1153 CG1 VAL A 142 108.697 -3.440 159.229 1.00 52.39 C ATOM 1154 CG2 VAL A 142 107.315 -3.042 161.303 1.00 54.66 C ATOM 1155 H VAL A 142 105.762 -4.851 159.791 1.00 0.00 H ATOM 1156 N GLY A 143 106.272 -6.360 162.129 1.00 58.32 N ATOM 1157 CA GLY A 143 105.921 -6.903 163.409 1.00 56.07 C ATOM 1158 C GLY A 143 105.237 -5.950 164.354 1.00 58.28 C ATOM 1159 O GLY A 143 105.451 -6.058 165.566 1.00 65.03 O ATOM 1160 H GLY A 143 105.527 -6.250 161.412 1.00 0.00 H ATOM 1161 N GLY A 144 104.448 -5.007 163.843 1.00 56.37 N ATOM 1162 CA GLY A 144 103.610 -4.157 164.660 1.00 53.97 C ATOM 1163 C GLY A 144 104.338 -3.086 165.449 1.00 53.15 C ATOM 1164 O GLY A 144 105.562 -2.895 165.349 1.00 52.92 O ATOM 1165 H GLY A 144 104.434 -4.876 162.811 1.00 0.00 H ATOM 1166 N PRO A 145 103.564 -2.317 166.207 1.00 48.84 N ATOM 1167 CA PRO A 145 104.166 -1.287 167.072 1.00 54.43 C ATOM 1168 C PRO A 145 105.295 -1.807 167.942 1.00 53.89 C ATOM 1169 O PRO A 145 106.302 -1.096 168.132 1.00 54.09 O ATOM 1170 CB PRO A 145 102.966 -0.789 167.899 1.00 52.42 C ATOM 1171 CG PRO A 145 101.810 -0.939 166.964 1.00 51.87 C ATOM 1172 CD PRO A 145 102.097 -2.208 166.148 1.00 53.38 C ATOM 1173 N GLN A 146 105.167 -3.039 168.454 1.00 54.92 N ATOM 1174 CA GLN A 146 106.216 -3.597 169.305 1.00 62.13 C ATOM 1175 C GLN A 146 107.523 -3.774 168.538 1.00 51.80 C ATOM 1176 O GLN A 146 108.612 -3.625 169.102 1.00 52.74 O ATOM 1177 CB GLN A 146 105.739 -4.918 169.931 1.00 63.96 C ATOM 1178 CG GLN A 146 105.027 -4.719 171.291 1.00 72.02 C ATOM 1179 CD GLN A 146 104.339 -5.981 171.835 1.00 88.02 C ATOM 1180 OE1 GLN A 146 103.698 -6.733 171.086 1.00 85.86 O ATOM 1181 NE2 GLN A 146 104.470 -6.212 173.151 1.00 85.91 N ATOM 1182 HE22 GLN A 146 105.017 -5.554 173.742 1.00 0.00 H ATOM 1183 HE21 GLN A 146 104.024 -7.049 173.579 1.00 0.00 H ATOM 1184 H GLN A 146 104.317 -3.601 168.245 1.00 0.00 H ATOM 1185 N ALA A 147 107.451 -4.068 167.252 1.00 50.88 N ATOM 1186 CA ALA A 147 108.691 -4.089 166.494 1.00 53.26 C ATOM 1187 C ALA A 147 109.320 -2.705 166.464 1.00 55.39 C ATOM 1188 O ALA A 147 110.532 -2.564 166.670 1.00 49.56 O ATOM 1189 CB ALA A 147 108.439 -4.588 165.082 1.00 55.18 C ATOM 1190 H ALA A 147 106.539 -4.277 166.798 1.00 0.00 H ATOM 1191 N LEU A 148 108.502 -1.661 166.256 1.00 55.85 N ATOM 1192 CA LEU A 148 109.086 -0.330 166.136 1.00 52.43 C ATOM 1193 C LEU A 148 109.536 0.185 167.490 1.00 53.00 C ATOM 1194 O LEU A 148 110.589 0.831 167.582 1.00 57.96 O ATOM 1195 CB LEU A 148 108.106 0.640 165.466 1.00 51.65 C ATOM 1196 CG LEU A 148 108.443 2.138 165.489 1.00 52.26 C ATOM 1197 CD1 LEU A 148 109.726 2.378 164.670 1.00 46.77 C ATOM 1198 CD2 LEU A 148 107.291 2.983 164.902 1.00 47.83 C ATOM 1199 H LEU A 148 107.474 -1.798 166.182 1.00 0.00 H ATOM 1200 N HIS A 149 108.811 -0.157 168.565 1.00 55.98 N ATOM 1201 CA HIS A 149 109.271 0.216 169.906 1.00 55.20 C ATOM 1202 C HIS A 149 110.652 -0.370 170.210 1.00 58.41 C ATOM 1203 O HIS A 149 111.535 0.322 170.737 1.00 53.43 O ATOM 1204 CB HIS A 149 108.258 -0.222 170.971 1.00 57.21 C ATOM 1205 CG HIS A 149 108.654 0.170 172.367 1.00 55.46 C ATOM 1206 ND1 HIS A 149 108.328 1.391 172.918 1.00 50.19 N ATOM 1207 CD2 HIS A 149 109.357 -0.496 173.318 1.00 52.34 C ATOM 1208 CE1 HIS A 149 108.833 1.472 174.138 1.00 53.10 C ATOM 1209 NE2 HIS A 149 109.452 0.335 174.407 1.00 59.61 N ATOM 1210 H HIS A 149 107.923 -0.686 168.448 1.00 0.00 H ATOM 1211 N ALA A 150 110.854 -1.656 169.892 1.00 60.70 N ATOM 1212 CA ALA A 150 112.168 -2.266 170.096 1.00 61.51 C ATOM 1213 C ALA A 150 113.245 -1.584 169.258 1.00 61.35 C ATOM 1214 O ALA A 150 114.357 -1.348 169.747 1.00 62.42 O ATOM 1215 CB ALA A 150 112.112 -3.758 169.771 1.00 64.02 C ATOM 1216 H ALA A 150 110.075 -2.222 169.499 1.00 0.00 H ATOM 1217 N TYR A 151 112.930 -1.243 167.997 1.00 53.85 N ATOM 1218 CA TYR A 151 113.915 -0.590 167.135 1.00 55.54 C ATOM 1219 C TYR A 151 114.334 0.767 167.691 1.00 57.75 C ATOM 1220 O TYR A 151 115.512 1.132 167.624 1.00 61.39 O ATOM 1221 CB TYR A 151 113.379 -0.431 165.702 1.00 55.77 C ATOM 1222 CG TYR A 151 114.306 0.373 164.793 1.00 54.74 C ATOM 1223 CD1 TYR A 151 115.439 -0.221 164.219 1.00 58.88 C ATOM 1224 CD2 TYR A 151 114.067 1.734 164.521 1.00 53.09 C ATOM 1225 CE1 TYR A 151 116.319 0.516 163.387 1.00 55.52 C ATOM 1226 CE2 TYR A 151 114.937 2.484 163.702 1.00 51.29 C ATOM 1227 CZ TYR A 151 116.061 1.865 163.134 1.00 58.10 C ATOM 1228 OH TYR A 151 116.932 2.576 162.316 1.00 55.03 O ATOM 1229 HH TYR A 151 117.659 1.977 162.011 1.00 0.00 H ATOM 1230 H TYR A 151 111.978 -1.445 167.631 1.00 0.00 H ATOM 1231 N ILE A 152 113.383 1.549 168.200 1.00 57.57 N ATOM 1232 CA ILE A 152 113.729 2.855 168.753 1.00 55.22 C ATOM 1233 C ILE A 152 114.695 2.683 169.915 1.00 55.67 C ATOM 1234 O ILE A 152 115.701 3.396 170.032 1.00 58.83 O ATOM 1235 CB ILE A 152 112.458 3.615 169.186 1.00 51.84 C ATOM 1236 CG1 ILE A 152 111.618 4.006 167.982 1.00 49.45 C ATOM 1237 CG2 ILE A 152 112.841 4.834 169.989 1.00 53.57 C ATOM 1238 CD1 ILE A 152 110.192 4.372 168.270 1.00 46.51 C ATOM 1239 H ILE A 152 112.394 1.229 168.203 1.00 0.00 H ATOM 1240 N GLN A 153 114.397 1.732 170.798 1.00 60.17 N ATOM 1241 CA GLN A 153 115.297 1.453 171.914 1.00 59.98 C ATOM 1242 C GLN A 153 116.655 0.981 171.419 1.00 58.94 C ATOM 1243 O GLN A 153 117.691 1.417 171.933 1.00 57.73 O ATOM 1244 CB GLN A 153 114.674 0.400 172.836 1.00 56.07 C ATOM 1245 CG GLN A 153 113.366 0.831 173.513 1.00 60.96 C ATOM 1246 CD GLN A 153 113.564 2.007 174.495 1.00 63.98 C ATOM 1247 OE1 GLN A 153 114.563 2.068 175.235 1.00 66.88 O ATOM 1248 NE2 GLN A 153 112.599 2.937 174.514 1.00 59.27 N ATOM 1249 HE22 GLN A 153 111.780 2.849 173.879 1.00 0.00 H ATOM 1250 HE21 GLN A 153 112.669 3.746 175.163 1.00 0.00 H ATOM 1251 H GLN A 153 113.519 1.185 170.693 1.00 0.00 H ATOM 1252 N SER A 154 116.665 0.164 170.356 1.00 59.28 N ATOM 1253 CA SER A 154 117.903 -0.393 169.832 1.00 57.77 C ATOM 1254 C SER A 154 118.835 0.689 169.303 1.00 59.78 C ATOM 1255 O SER A 154 120.044 0.453 169.221 1.00 63.18 O ATOM 1256 CB SER A 154 117.601 -1.439 168.747 1.00 60.30 C ATOM 1257 OG SER A 154 117.610 -0.905 167.437 1.00 55.96 O ATOM 1258 HG SER A 154 116.924 -0.195 167.367 1.00 0.00 H ATOM 1259 H SER A 154 115.765 -0.078 169.894 1.00 0.00 H ATOM 1260 N LEU A 155 118.325 1.882 168.976 1.00 55.90 N ATOM 1261 CA LEU A 155 119.221 2.977 168.622 1.00 55.79 C ATOM 1262 C LEU A 155 119.774 3.678 169.855 1.00 63.80 C ATOM 1263 O LEU A 155 120.399 4.745 169.738 1.00 62.03 O ATOM 1264 CB LEU A 155 118.517 4.017 167.738 1.00 56.17 C ATOM 1265 CG LEU A 155 117.812 3.689 166.413 1.00 63.50 C ATOM 1266 CD1 LEU A 155 117.054 4.926 165.909 1.00 55.56 C ATOM 1267 CD2 LEU A 155 118.763 3.173 165.311 1.00 62.14 C ATOM 1268 H LEU A 155 117.295 2.028 168.974 1.00 0.00 H ATOM 1269 N GLY A 156 119.541 3.124 171.041 1.00 57.93 N ATOM 1270 CA GLY A 156 119.990 3.797 172.225 1.00 51.12 C ATOM 1271 C GLY A 156 119.124 4.957 172.633 1.00 57.62 C ATOM 1272 O GLY A 156 119.559 5.751 173.465 1.00 53.79 O ATOM 1273 H GLY A 156 119.040 2.215 171.109 1.00 0.00 H ATOM 1274 N VAL A 157 117.933 5.104 172.051 1.00 58.30 N ATOM 1275 CA VAL A 157 116.976 6.132 172.461 1.00 59.47 C ATOM 1276 C VAL A 157 116.053 5.553 173.530 1.00 56.72 C ATOM 1277 O VAL A 157 115.289 4.623 173.256 1.00 59.31 O ATOM 1278 CB VAL A 157 116.158 6.646 171.265 1.00 57.15 C ATOM 1279 CG1 VAL A 157 115.218 7.731 171.727 1.00 54.09 C ATOM 1280 CG2 VAL A 157 117.061 7.182 170.152 1.00 57.37 C ATOM 1281 H VAL A 157 117.674 4.462 171.275 1.00 0.00 H ATOM 1282 N LYS A 158 116.082 6.117 174.738 1.00 56.02 N ATOM 1283 CA LYS A 158 115.299 5.515 175.819 1.00 60.47 C ATOM 1284 C LYS A 158 113.951 6.194 176.045 1.00 61.14 C ATOM 1285 O LYS A 158 112.930 5.505 176.158 1.00 60.85 O ATOM 1286 CB LYS A 158 116.085 5.504 177.146 1.00 63.68 C ATOM 1287 CG LYS A 158 115.167 5.416 178.387 1.00 70.53 C ATOM 1288 CD LYS A 158 115.762 4.600 179.541 1.00 74.90 C ATOM 1289 CE LYS A 158 115.935 5.475 180.797 1.00 81.64 C ATOM 1290 NZ LYS A 158 116.465 4.707 181.977 1.00 79.70 N ATOM 1291 HZ1 LYS A 158 115.805 3.939 182.214 1.00 0.00 H ATOM 1292 HZ2 LYS A 158 117.395 4.306 181.739 1.00 0.00 H ATOM 1293 HZ3 LYS A 158 116.560 5.347 182.791 1.00 0.00 H ATOM 1294 H LYS A 158 116.651 6.970 174.910 1.00 0.00 H ATOM 1295 N GLU A 159 113.922 7.527 176.126 1.00 55.97 N ATOM 1296 CA GLU A 159 112.717 8.256 176.524 1.00 53.52 C ATOM 1297 C GLU A 159 111.782 8.454 175.318 1.00 57.30 C ATOM 1298 O GLU A 159 111.537 9.562 174.832 1.00 49.72 O ATOM 1299 CB GLU A 159 113.122 9.569 177.190 1.00 58.31 C ATOM 1300 CG GLU A 159 114.033 9.388 178.461 1.00 58.98 C ATOM 1301 CD GLU A 159 113.254 8.987 179.763 1.00 68.24 C ATOM 1302 OE1 GLU A 159 112.038 8.712 179.683 1.00 60.60 O ATOM 1303 OE2 GLU A 159 113.858 8.952 180.885 1.00 71.35 O ATOM 1304 H GLU A 159 114.783 8.064 175.899 1.00 0.00 H ATOM 1305 N ALA A 160 111.232 7.332 174.844 1.00 49.84 N ATOM 1306 CA ALA A 160 110.167 7.336 173.848 1.00 49.25 C ATOM 1307 C ALA A 160 109.454 5.990 173.887 1.00 48.08 C ATOM 1308 O ALA A 160 109.996 5.000 174.370 1.00 51.10 O ATOM 1309 CB ALA A 160 110.707 7.619 172.443 1.00 53.00 C ATOM 1310 H ALA A 160 111.578 6.418 175.200 1.00 0.00 H ATOM 1311 N ALA A 161 108.222 5.962 173.390 1.00 51.36 N ATOM 1312 CA ALA A 161 107.462 4.716 173.388 1.00 48.85 C ATOM 1313 C ALA A 161 106.518 4.688 172.193 1.00 48.27 C ATOM 1314 O ALA A 161 105.948 5.719 171.812 1.00 46.60 O ATOM 1315 CB ALA A 161 106.653 4.539 174.690 1.00 43.98 C ATOM 1316 H ALA A 161 107.799 6.829 173.002 1.00 0.00 H ATOM 1317 N VAL A 162 106.345 3.503 171.616 1.00 48.34 N ATOM 1318 CA VAL A 162 105.356 3.283 170.570 1.00 50.22 C ATOM 1319 C VAL A 162 104.625 1.991 170.901 1.00 55.13 C ATOM 1320 O VAL A 162 105.251 0.931 170.969 1.00 61.75 O ATOM 1321 CB VAL A 162 105.984 3.181 169.171 1.00 52.32 C ATOM 1322 CG1 VAL A 162 104.928 2.684 168.157 1.00 44.99 C ATOM 1323 CG2 VAL A 162 106.694 4.535 168.748 1.00 43.99 C ATOM 1324 H VAL A 162 106.937 2.705 171.922 1.00 0.00 H ATOM 1325 N VAL A 163 103.315 2.081 171.139 1.00 59.12 N ATOM 1326 CA VAL A 163 102.483 0.925 171.476 1.00 53.33 C ATOM 1327 C VAL A 163 101.291 0.749 170.531 1.00 56.62 C ATOM 1328 O VAL A 163 100.612 -0.285 170.606 1.00 61.67 O ATOM 1329 CB VAL A 163 101.986 1.000 172.933 1.00 54.11 C ATOM 1330 CG1 VAL A 163 103.139 0.787 173.906 1.00 50.73 C ATOM 1331 CG2 VAL A 163 101.305 2.324 173.180 1.00 53.00 C ATOM 1332 H VAL A 163 102.864 3.016 171.082 1.00 0.00 H ATOM 1333 N ALA A 164 100.937 1.752 169.724 1.00 52.83 N ATOM 1334 CA ALA A 164 99.730 1.748 168.915 1.00 53.36 C ATOM 1335 C ALA A 164 100.059 2.048 167.461 1.00 58.91 C ATOM 1336 O ALA A 164 101.017 2.772 167.160 1.00 52.48 O ATOM 1337 CB ALA A 164 98.731 2.827 169.390 1.00 55.92 C ATOM 1338 H ALA A 164 101.560 2.583 169.671 1.00 0.00 H ATOM 1339 N ASN A 165 99.205 1.562 166.562 1.00 57.40 N ATOM 1340 CA ASN A 165 99.271 1.927 165.159 1.00 57.13 C ATOM 1341 C ASN A 165 98.232 3.001 164.826 1.00 55.71 C ATOM 1342 O ASN A 165 97.545 3.544 165.699 1.00 56.45 O ATOM 1343 CB ASN A 165 99.099 0.682 164.287 1.00 56.97 C ATOM 1344 CG ASN A 165 97.682 0.123 164.330 1.00 63.29 C ATOM 1345 OD1 ASN A 165 96.851 0.503 165.171 1.00 59.59 O ATOM 1346 ND2 ASN A 165 97.401 -0.800 163.416 1.00 65.61 N ATOM 1347 HD22 ASN A 165 98.127 -1.090 162.730 1.00 0.00 H ATOM 1348 HD21 ASN A 165 96.456 -1.232 163.387 1.00 0.00 H ATOM 1349 H ASN A 165 98.467 0.900 166.876 1.00 0.00 H ATOM 1350 N GLU A 166 98.110 3.305 163.533 1.00 59.21 N ATOM 1351 CA GLU A 166 97.182 4.338 163.100 1.00 57.90 C ATOM 1352 C GLU A 166 95.741 3.936 163.381 1.00 58.18 C ATOM 1353 O GLU A 166 94.936 4.769 163.804 1.00 58.78 O ATOM 1354 CB GLU A 166 97.368 4.610 161.604 1.00 60.05 C ATOM 1355 CG GLU A 166 98.665 5.333 161.279 1.00 60.00 C ATOM 1356 CD GLU A 166 98.749 6.718 161.891 1.00 59.22 C ATOM 1357 OE1 GLU A 166 97.732 7.190 162.463 1.00 57.81 O ATOM 1358 OE2 GLU A 166 99.833 7.339 161.775 1.00 59.84 O ATOM 1359 H GLU A 166 98.683 2.799 162.828 1.00 0.00 H ATOM 1360 N ALA A 167 95.406 2.659 163.161 1.00 58.32 N ATOM 1361 CA ALA A 167 94.036 2.188 163.363 1.00 61.77 C ATOM 1362 C ALA A 167 93.607 2.309 164.819 1.00 57.08 C ATOM 1363 O ALA A 167 92.456 2.658 165.106 1.00 56.65 O ATOM 1364 CB ALA A 167 93.898 0.738 162.900 1.00 52.93 C ATOM 1365 H ALA A 167 96.134 1.989 162.840 1.00 0.00 H ATOM 1366 N GLN A 168 94.479 1.918 165.745 1.00 54.30 N ATOM 1367 CA GLN A 168 94.167 2.061 167.160 1.00 57.39 C ATOM 1368 C GLN A 168 94.102 3.520 167.582 1.00 58.81 C ATOM 1369 O GLN A 168 93.351 3.873 168.499 1.00 53.23 O ATOM 1370 CB GLN A 168 95.199 1.314 167.988 1.00 53.15 C ATOM 1371 CG GLN A 168 95.035 -0.143 167.901 1.00 57.13 C ATOM 1372 CD GLN A 168 96.226 -0.907 168.425 1.00 65.06 C ATOM 1373 OE1 GLN A 168 97.373 -0.477 168.271 1.00 65.10 O ATOM 1374 NE2 GLN A 168 95.953 -2.012 169.127 1.00 65.55 N ATOM 1375 HE22 GLN A 168 94.969 -2.334 169.228 1.00 0.00 H ATOM 1376 HE21 GLN A 168 96.724 -2.549 169.572 1.00 0.00 H ATOM 1377 H GLN A 168 95.390 1.507 165.456 1.00 0.00 H ATOM 1378 N MET A 169 94.885 4.377 166.942 1.00 54.02 N ATOM 1379 CA MET A 169 94.803 5.785 167.306 1.00 59.14 C ATOM 1380 C MET A 169 93.519 6.400 166.779 1.00 58.22 C ATOM 1381 O MET A 169 92.929 7.265 167.435 1.00 60.44 O ATOM 1382 CB MET A 169 96.036 6.543 166.808 1.00 51.99 C ATOM 1383 CG MET A 169 97.296 6.219 167.620 1.00 56.28 C ATOM 1384 SD MET A 169 98.630 7.408 167.380 1.00 61.43 S ATOM 1385 CE MET A 169 99.013 7.009 165.672 1.00 49.34 C ATOM 1386 H MET A 169 95.539 4.053 166.201 1.00 0.00 H ATOM 1387 N HIS A 170 93.056 5.939 165.621 1.00 57.95 N ATOM 1388 CA HIS A 170 91.807 6.444 165.083 1.00 63.08 C ATOM 1389 C HIS A 170 90.626 5.950 165.892 1.00 54.94 C ATOM 1390 O HIS A 170 89.612 6.644 165.992 1.00 61.31 O ATOM 1391 CB HIS A 170 91.670 6.008 163.626 1.00 60.84 C ATOM 1392 CG HIS A 170 92.544 6.784 162.692 1.00 69.04 C ATOM 1393 ND1 HIS A 170 93.920 6.811 162.819 1.00 65.87 N ATOM 1394 CD2 HIS A 170 92.247 7.562 161.622 1.00 68.99 C ATOM 1395 CE1 HIS A 170 94.430 7.569 161.864 1.00 66.89 C ATOM 1396 NE2 HIS A 170 93.436 8.045 161.131 1.00 64.47 N ATOM 1397 H HIS A 170 93.590 5.215 165.100 1.00 0.00 H ATOM 1398 N ALA A 171 90.768 4.797 166.534 1.00 54.23 N ATOM 1399 CA ALA A 171 89.668 4.214 167.294 1.00 57.71 C ATOM 1400 C ALA A 171 89.491 4.876 168.646 1.00 60.79 C ATOM 1401 O ALA A 171 88.377 4.883 169.176 1.00 63.35 O ATOM 1402 CB ALA A 171 89.879 2.707 167.477 1.00 51.81 C ATOM 1403 H ALA A 171 91.681 4.300 166.494 1.00 0.00 H ATOM 1404 N ASP A 172 90.579 5.370 169.236 1.00 62.41 N ATOM 1405 CA ASP A 172 90.586 5.937 170.582 1.00 64.26 C ATOM 1406 C ASP A 172 91.498 7.161 170.575 1.00 63.44 C ATOM 1407 O ASP A 172 92.704 7.039 170.333 1.00 63.71 O ATOM 1408 CB ASP A 172 91.073 4.906 171.593 1.00 65.52 C ATOM 1409 CG ASP A 172 90.969 5.390 173.012 1.00 61.72 C ATOM 1410 OD1 ASP A 172 90.577 6.560 173.231 1.00 63.71 O ATOM 1411 OD2 ASP A 172 91.328 4.598 173.906 1.00 63.62 O ATOM 1412 H ASP A 172 91.475 5.351 168.708 1.00 0.00 H ATOM 1413 N ASP A 173 90.922 8.347 170.773 1.00 64.76 N ATOM 1414 CA ASP A 173 91.721 9.571 170.768 1.00 64.61 C ATOM 1415 C ASP A 173 92.640 9.717 171.991 1.00 58.94 C ATOM 1416 O ASP A 173 93.480 10.627 172.011 1.00 54.46 O ATOM 1417 CB ASP A 173 90.821 10.797 170.543 1.00 71.11 C ATOM 1418 CG ASP A 173 89.766 10.974 171.614 1.00 75.27 C ATOM 1419 OD1 ASP A 173 90.084 10.832 172.822 1.00 77.74 O ATOM 1420 OD2 ASP A 173 88.611 11.268 171.230 1.00 75.34 O ATOM 1421 H ASP A 173 89.896 8.402 170.932 1.00 0.00 H ATOM 1422 N GLN A 174 92.479 8.911 173.034 1.00 54.38 N ATOM 1423 CA GLN A 174 93.400 9.042 174.158 1.00 58.69 C ATOM 1424 C GLN A 174 94.609 8.138 173.991 1.00 60.30 C ATOM 1425 O GLN A 174 95.627 8.342 174.668 1.00 57.88 O ATOM 1426 CB GLN A 174 92.697 8.688 175.486 1.00 51.52 C ATOM 1427 CG GLN A 174 91.555 9.641 175.818 1.00 56.09 C ATOM 1428 CD GLN A 174 92.036 11.057 176.051 1.00 59.66 C ATOM 1429 OE1 GLN A 174 92.913 11.299 176.888 1.00 62.20 O ATOM 1430 NE2 GLN A 174 91.510 11.992 175.274 1.00 61.71 N ATOM 1431 HE22 GLN A 174 90.774 11.741 174.584 1.00 0.00 H ATOM 1432 HE21 GLN A 174 91.833 12.977 175.354 1.00 0.00 H ATOM 1433 H GLN A 174 91.716 8.204 173.049 1.00 0.00 H ATOM 1434 N VAL A 175 94.579 7.270 172.982 1.00 60.27 N ATOM 1435 CA VAL A 175 95.660 6.322 172.767 1.00 55.78 C ATOM 1436 C VAL A 175 96.885 7.028 172.207 1.00 56.43 C ATOM 1437 O VAL A 175 98.023 6.612 172.476 1.00 50.48 O ATOM 1438 CB VAL A 175 95.126 5.210 171.831 1.00 58.06 C ATOM 1439 CG1 VAL A 175 96.220 4.536 171.080 1.00 55.47 C ATOM 1440 CG2 VAL A 175 94.316 4.185 172.641 1.00 66.90 C ATOM 1441 H VAL A 175 93.765 7.270 172.334 1.00 0.00 H ATOM 1442 N GLN A 176 96.673 8.164 171.513 1.00 58.17 N ATOM 1443 CA GLN A 176 97.771 8.937 170.929 1.00 52.75 C ATOM 1444 C GLN A 176 98.809 9.331 171.969 1.00 52.41 C ATOM 1445 O GLN A 176 99.995 9.450 171.646 1.00 49.71 O ATOM 1446 CB GLN A 176 97.252 10.200 170.248 1.00 54.62 C ATOM 1447 CG GLN A 176 96.645 11.234 171.187 1.00 56.31 C ATOM 1448 CD GLN A 176 96.082 12.425 170.454 1.00 56.79 C ATOM 1449 OE1 GLN A 176 96.812 13.139 169.764 1.00 60.39 O ATOM 1450 NE2 GLN A 176 94.774 12.643 170.585 1.00 53.10 N ATOM 1451 HE22 GLN A 176 94.199 12.012 171.179 1.00 0.00 H ATOM 1452 HE21 GLN A 176 94.328 13.444 170.093 1.00 0.00 H ATOM 1453 H GLN A 176 95.698 8.503 171.388 1.00 0.00 H ATOM 1454 N TYR A 177 98.387 9.564 173.213 1.00 54.07 N ATOM 1455 CA TYR A 177 99.344 10.005 174.209 1.00 53.17 C ATOM 1456 C TYR A 177 100.355 8.932 174.562 1.00 55.21 C ATOM 1457 O TYR A 177 101.400 9.254 175.124 1.00 54.31 O ATOM 1458 CB TYR A 177 98.629 10.480 175.456 1.00 53.76 C ATOM 1459 CG TYR A 177 97.823 11.730 175.247 1.00 51.80 C ATOM 1460 CD1 TYR A 177 98.430 12.970 175.344 1.00 52.70 C ATOM 1461 CD2 TYR A 177 96.459 11.678 174.969 1.00 50.33 C ATOM 1462 CE1 TYR A 177 97.705 14.139 175.165 1.00 49.75 C ATOM 1463 CE2 TYR A 177 95.728 12.831 174.796 1.00 48.66 C ATOM 1464 CZ TYR A 177 96.364 14.063 174.904 1.00 48.69 C ATOM 1465 OH TYR A 177 95.689 15.235 174.751 1.00 45.31 O ATOM 1466 HH TYR A 177 96.316 15.993 174.865 1.00 0.00 H ATOM 1467 H TYR A 177 97.387 9.431 173.465 1.00 0.00 H ATOM 1468 N GLN A 178 100.103 7.677 174.221 1.00 53.22 N ATOM 1469 CA GLN A 178 101.086 6.661 174.542 1.00 50.81 C ATOM 1470 C GLN A 178 102.088 6.411 173.434 1.00 53.77 C ATOM 1471 O GLN A 178 103.074 5.709 173.676 1.00 53.51 O ATOM 1472 CB GLN A 178 100.399 5.362 174.951 1.00 61.51 C ATOM 1473 CG GLN A 178 99.503 5.545 176.159 1.00 66.51 C ATOM 1474 CD GLN A 178 98.233 4.755 176.056 1.00 73.57 C ATOM 1475 OE1 GLN A 178 97.194 5.174 176.528 1.00 81.64 O ATOM 1476 NE2 GLN A 178 98.313 3.617 175.425 1.00 73.32 N ATOM 1477 HE22 GLN A 178 99.225 3.300 175.038 1.00 0.00 H ATOM 1478 HE21 GLN A 178 97.465 3.026 175.309 1.00 0.00 H ATOM 1479 H GLN A 178 99.219 7.426 173.734 1.00 0.00 H ATOM 1480 N ASN A 179 101.858 6.931 172.227 1.00 54.06 N ATOM 1481 CA ASN A 179 102.912 6.993 171.213 1.00 49.13 C ATOM 1482 C ASN A 179 103.586 8.352 171.401 1.00 48.55 C ATOM 1483 O ASN A 179 103.211 9.368 170.803 1.00 44.37 O ATOM 1484 CB ASN A 179 102.328 6.809 169.819 1.00 48.53 C ATOM 1485 CG ASN A 179 101.923 5.361 169.518 1.00 51.50 C ATOM 1486 OD1 ASN A 179 102.055 4.460 170.346 1.00 53.29 O ATOM 1487 ND2 ASN A 179 101.416 5.142 168.313 1.00 53.25 N ATOM 1488 HD22 ASN A 179 101.319 5.928 167.639 1.00 0.00 H ATOM 1489 HD21 ASN A 179 101.115 4.184 168.042 1.00 0.00 H ATOM 1490 H ASN A 179 100.912 7.299 172.002 1.00 0.00 H ATOM 1491 N TRP A 180 104.535 8.392 172.337 1.00 47.28 N ATOM 1492 CA TRP A 180 105.113 9.654 172.783 1.00 45.40 C ATOM 1493 C TRP A 180 106.627 9.619 172.653 1.00 45.98 C ATOM 1494 O TRP A 180 107.254 8.548 172.586 1.00 47.70 O ATOM 1495 CB TRP A 180 104.722 9.999 174.253 1.00 47.28 C ATOM 1496 CG TRP A 180 105.276 9.026 175.231 1.00 51.41 C ATOM 1497 CD1 TRP A 180 104.672 7.888 175.691 1.00 49.26 C ATOM 1498 CD2 TRP A 180 106.565 9.080 175.862 1.00 48.67 C ATOM 1499 NE1 TRP A 180 105.507 7.229 176.550 1.00 51.82 N ATOM 1500 CE2 TRP A 180 106.675 7.936 176.678 1.00 48.59 C ATOM 1501 CE3 TRP A 180 107.630 9.974 175.809 1.00 45.97 C ATOM 1502 CZ2 TRP A 180 107.804 7.673 177.454 1.00 46.40 C ATOM 1503 CZ3 TRP A 180 108.752 9.701 176.556 1.00 48.59 C ATOM 1504 CH2 TRP A 180 108.832 8.554 177.380 1.00 46.30 C ATOM 1505 HE1 TRP A 180 105.290 6.333 177.031 1.00 0.00 H ATOM 1506 H TRP A 180 104.871 7.502 172.759 1.00 0.00 H ATOM 1507 N THR A 181 107.205 10.822 172.666 1.00 46.09 N ATOM 1508 CA THR A 181 108.640 11.012 172.666 1.00 43.36 C ATOM 1509 C THR A 181 108.973 12.165 173.584 1.00 46.55 C ATOM 1510 O THR A 181 108.166 13.081 173.800 1.00 48.46 O ATOM 1511 CB THR A 181 109.204 11.317 171.256 1.00 47.79 C ATOM 1512 OG1 THR A 181 110.627 11.437 171.328 1.00 47.50 O ATOM 1513 CG2 THR A 181 108.614 12.654 170.671 1.00 43.25 C ATOM 1514 HG1 THR A 181 110.864 12.174 171.945 1.00 0.00 H ATOM 1515 H THR A 181 106.595 11.664 172.677 1.00 0.00 H ATOM 1516 N SER A 182 110.171 12.116 174.121 1.00 47.01 N ATOM 1517 CA SER A 182 110.718 13.286 174.772 1.00 46.06 C ATOM 1518 C SER A 182 111.475 14.112 173.736 1.00 51.40 C ATOM 1519 O SER A 182 111.780 13.646 172.624 1.00 48.97 O ATOM 1520 CB SER A 182 111.613 12.856 175.915 1.00 46.44 C ATOM 1521 OG SER A 182 112.796 12.276 175.400 1.00 48.37 O ATOM 1522 HG SER A 182 112.563 11.487 174.850 1.00 0.00 H ATOM 1523 H SER A 182 110.725 11.237 174.078 1.00 0.00 H ATOM 1524 N MET A 183 111.795 15.346 174.114 1.00 41.99 N ATOM 1525 CA MET A 183 112.533 16.209 173.208 1.00 43.18 C ATOM 1526 C MET A 183 113.960 15.722 172.993 1.00 47.31 C ATOM 1527 O MET A 183 114.493 15.827 171.882 1.00 53.97 O ATOM 1528 CB MET A 183 112.481 17.633 173.726 1.00 39.64 C ATOM 1529 CG MET A 183 111.047 18.184 173.682 1.00 44.91 C ATOM 1530 SD MET A 183 110.322 18.046 171.992 1.00 45.67 S ATOM 1531 CE MET A 183 109.294 16.662 172.187 1.00 47.61 C ATOM 1532 H MET A 183 111.518 15.692 175.055 1.00 0.00 H ATOM 1533 N LYS A 184 114.586 15.171 174.028 1.00 48.25 N ATOM 1534 CA LYS A 184 115.889 14.534 173.862 1.00 51.34 C ATOM 1535 C LYS A 184 115.799 13.421 172.833 1.00 48.84 C ATOM 1536 O LYS A 184 116.555 13.401 171.857 1.00 45.26 O ATOM 1537 CB LYS A 184 116.360 13.985 175.211 1.00 47.70 C ATOM 1538 CG LYS A 184 117.663 13.216 175.197 1.00 55.31 C ATOM 1539 CD LYS A 184 117.618 12.147 176.328 1.00 61.60 C ATOM 1540 CE LYS A 184 118.980 11.543 176.674 1.00 64.05 C ATOM 1541 NZ LYS A 184 119.448 11.954 178.054 1.00 66.75 N ATOM 1542 HZ1 LYS A 184 119.531 12.990 178.096 1.00 0.00 H ATOM 1543 HZ2 LYS A 184 118.759 11.631 178.763 1.00 0.00 H ATOM 1544 HZ3 LYS A 184 120.374 11.523 178.247 1.00 0.00 H ATOM 1545 H LYS A 184 114.142 15.194 174.968 1.00 0.00 H ATOM 1546 N ALA A 185 114.838 12.508 173.031 1.00 42.69 N ATOM 1547 CA ALA A 185 114.593 11.427 172.086 1.00 45.83 C ATOM 1548 C ALA A 185 114.244 11.939 170.700 1.00 48.20 C ATOM 1549 O ALA A 185 114.552 11.266 169.710 1.00 56.24 O ATOM 1550 CB ALA A 185 113.461 10.530 172.589 1.00 46.47 C ATOM 1551 H ALA A 185 114.249 12.573 173.886 1.00 0.00 H ATOM 1552 N ALA A 186 113.582 13.100 170.587 1.00 46.62 N ATOM 1553 CA ALA A 186 113.344 13.631 169.243 1.00 50.56 C ATOM 1554 C ALA A 186 114.652 14.048 168.589 1.00 45.76 C ATOM 1555 O ALA A 186 114.907 13.701 167.434 1.00 47.90 O ATOM 1556 CB ALA A 186 112.358 14.796 169.268 1.00 43.67 C ATOM 1557 H ALA A 186 113.247 13.609 171.430 1.00 0.00 H ATOM 1558 N ALA A 187 115.522 14.741 169.333 1.00 46.19 N ATOM 1559 CA ALA A 187 116.835 15.104 168.791 1.00 47.06 C ATOM 1560 C ALA A 187 117.652 13.873 168.381 1.00 50.27 C ATOM 1561 O ALA A 187 118.277 13.874 167.319 1.00 56.70 O ATOM 1562 CB ALA A 187 117.613 15.949 169.795 1.00 46.76 C ATOM 1563 H ALA A 187 115.266 15.023 170.300 1.00 0.00 H ATOM 1564 N GLN A 188 117.644 12.812 169.193 1.00 44.97 N ATOM 1565 CA GLN A 188 118.497 11.656 168.927 1.00 52.99 C ATOM 1566 C GLN A 188 118.094 10.932 167.638 1.00 47.70 C ATOM 1567 O GLN A 188 118.958 10.526 166.860 1.00 52.38 O ATOM 1568 CB GLN A 188 118.457 10.692 170.117 1.00 50.16 C ATOM 1569 CG GLN A 188 118.968 11.261 171.424 1.00 47.07 C ATOM 1570 CD GLN A 188 118.784 10.297 172.601 1.00 54.81 C ATOM 1571 OE1 GLN A 188 117.674 9.785 172.854 1.00 50.10 O ATOM 1572 NE2 GLN A 188 119.870 10.049 173.326 1.00 53.68 N ATOM 1573 HE22 GLN A 188 120.775 10.498 173.078 1.00 0.00 H ATOM 1574 HE21 GLN A 188 119.815 9.406 174.141 1.00 0.00 H ATOM 1575 H GLN A 188 117.022 12.809 170.026 1.00 0.00 H ATOM 1576 N VAL A 189 116.798 10.733 167.409 1.00 47.21 N ATOM 1577 CA VAL A 189 116.364 10.115 166.159 1.00 52.54 C ATOM 1578 C VAL A 189 116.678 11.021 164.954 1.00 49.07 C ATOM 1579 O VAL A 189 117.145 10.548 163.904 1.00 48.52 O ATOM 1580 CB VAL A 189 114.865 9.758 166.235 1.00 43.28 C ATOM 1581 CG1 VAL A 189 114.390 9.215 164.893 1.00 41.03 C ATOM 1582 CG2 VAL A 189 114.625 8.725 167.307 1.00 38.92 C ATOM 1583 H VAL A 189 116.095 11.018 168.120 1.00 0.00 H ATOM 1584 N LEU A 190 116.479 12.331 165.091 1.00 45.53 N ATOM 1585 CA LEU A 190 116.821 13.226 163.981 1.00 51.25 C ATOM 1586 C LEU A 190 118.316 13.170 163.694 1.00 53.24 C ATOM 1587 O LEU A 190 118.742 13.193 162.530 1.00 54.58 O ATOM 1588 CB LEU A 190 116.399 14.660 164.291 1.00 47.99 C ATOM 1589 CG LEU A 190 114.911 15.005 164.245 1.00 44.60 C ATOM 1590 CD1 LEU A 190 114.780 16.433 164.646 1.00 45.93 C ATOM 1591 CD2 LEU A 190 114.310 14.775 162.882 1.00 49.13 C ATOM 1592 H LEU A 190 116.086 12.714 165.974 1.00 0.00 H ATOM 1593 N GLN A 191 119.125 13.080 164.752 1.00 55.18 N ATOM 1594 CA GLN A 191 120.569 12.937 164.602 1.00 55.30 C ATOM 1595 C GLN A 191 120.943 11.598 163.993 1.00 53.40 C ATOM 1596 O GLN A 191 121.828 11.530 163.127 1.00 54.21 O ATOM 1597 CB GLN A 191 121.250 13.048 165.952 1.00 53.10 C ATOM 1598 CG GLN A 191 122.693 12.675 165.842 1.00 61.74 C ATOM 1599 CD GLN A 191 123.426 12.878 167.115 1.00 63.10 C ATOM 1600 OE1 GLN A 191 124.168 13.842 167.249 1.00 65.02 O ATOM 1601 NE2 GLN A 191 123.218 11.964 168.083 1.00 62.16 N ATOM 1602 HE22 GLN A 191 122.576 11.164 167.913 1.00 0.00 H ATOM 1603 HE21 GLN A 191 123.700 12.059 169.000 1.00 0.00 H ATOM 1604 H GLN A 191 118.715 13.113 165.707 1.00 0.00 H ATOM 1605 N LYS A 192 120.296 10.513 164.437 1.00 50.77 N ATOM 1606 CA LYS A 192 120.664 9.222 163.876 1.00 54.04 C ATOM 1607 C LYS A 192 120.204 9.076 162.433 1.00 47.96 C ATOM 1608 O LYS A 192 120.882 8.413 161.646 1.00 52.87 O ATOM 1609 CB LYS A 192 120.149 8.095 164.764 1.00 57.95 C ATOM 1610 CG LYS A 192 120.883 8.111 166.072 1.00 59.52 C ATOM 1611 CD LYS A 192 120.751 6.842 166.848 1.00 67.60 C ATOM 1612 CE LYS A 192 121.691 6.890 168.045 1.00 64.07 C ATOM 1613 NZ LYS A 192 122.868 5.978 167.832 1.00 67.83 N ATOM 1614 HZ1 LYS A 192 122.531 5.002 167.707 1.00 0.00 H ATOM 1615 HZ2 LYS A 192 123.388 6.278 166.983 1.00 0.00 H ATOM 1616 HZ3 LYS A 192 123.496 6.026 168.659 1.00 0.00 H ATOM 1617 H LYS A 192 119.553 10.591 165.161 1.00 0.00 H ATOM 1618 N PHE A 193 119.143 9.786 162.042 1.00 56.05 N ATOM 1619 CA PHE A 193 118.758 9.848 160.635 1.00 54.43 C ATOM 1620 C PHE A 193 119.764 10.678 159.860 1.00 56.94 C ATOM 1621 O PHE A 193 120.374 10.181 158.899 1.00 50.83 O ATOM 1622 CB PHE A 193 117.327 10.409 160.505 1.00 47.49 C ATOM 1623 CG PHE A 193 117.026 11.104 159.189 1.00 44.32 C ATOM 1624 CD1 PHE A 193 117.149 10.451 157.972 1.00 53.19 C ATOM 1625 CD2 PHE A 193 116.521 12.400 159.185 1.00 52.09 C ATOM 1626 CE1 PHE A 193 116.850 11.104 156.781 1.00 47.92 C ATOM 1627 CE2 PHE A 193 116.217 13.070 158.006 1.00 47.64 C ATOM 1628 CZ PHE A 193 116.370 12.420 156.798 1.00 50.51 C ATOM 1629 H PHE A 193 118.583 10.302 162.750 1.00 0.00 H ATOM 1630 N GLU A 194 120.044 11.899 160.357 1.00 50.41 N ATOM 1631 CA GLU A 194 120.850 12.867 159.617 1.00 52.94 C ATOM 1632 C GLU A 194 122.283 12.396 159.406 1.00 55.49 C ATOM 1633 O GLU A 194 122.927 12.788 158.428 1.00 57.72 O ATOM 1634 CB GLU A 194 120.848 14.208 160.352 1.00 55.60 C ATOM 1635 CG GLU A 194 121.484 15.359 159.592 1.00 56.90 C ATOM 1636 CD GLU A 194 122.978 15.328 159.702 1.00 62.90 C ATOM 1637 OE1 GLU A 194 123.666 15.540 158.682 1.00 67.50 O ATOM 1638 OE2 GLU A 194 123.461 15.042 160.813 1.00 65.81 O ATOM 1639 H GLU A 194 119.676 12.160 161.294 1.00 0.00 H ATOM 1640 N GLN A 195 122.824 11.615 160.336 1.00 58.52 N ATOM 1641 CA GLN A 195 124.240 11.283 160.290 1.00 55.73 C ATOM 1642 C GLN A 195 124.565 10.142 159.333 1.00 56.75 C ATOM 1643 O GLN A 195 125.745 9.856 159.126 1.00 58.04 O ATOM 1644 CB GLN A 195 124.750 10.954 161.699 1.00 51.30 C ATOM 1645 CG GLN A 195 124.837 12.198 162.528 1.00 54.57 C ATOM 1646 CD GLN A 195 125.621 12.056 163.794 1.00 56.75 C ATOM 1647 OE1 GLN A 195 125.730 10.972 164.396 1.00 62.21 O ATOM 1648 NE2 GLN A 195 126.210 13.161 164.205 1.00 60.23 N ATOM 1649 HE22 GLN A 195 126.090 14.044 163.669 1.00 0.00 H ATOM 1650 HE21 GLN A 195 126.795 13.150 165.065 1.00 0.00 H ATOM 1651 H GLN A 195 122.230 11.238 161.102 1.00 0.00 H ATOM 1652 N LYS A 196 123.564 9.500 158.743 1.00 57.57 N ATOM 1653 CA LYS A 196 123.682 8.532 157.644 1.00 57.13 C ATOM 1654 C LYS A 196 124.204 7.166 158.077 1.00 56.30 C ATOM 1655 O LYS A 196 124.383 6.307 157.200 1.00 63.19 O ATOM 1656 CB LYS A 196 124.565 9.077 156.510 1.00 54.03 C ATOM 1657 CG LYS A 196 123.978 10.341 155.868 1.00 59.30 C ATOM 1658 CD LYS A 196 124.903 10.929 154.802 1.00 60.08 C ATOM 1659 CE LYS A 196 124.426 12.302 154.403 1.00 64.24 C ATOM 1660 NZ LYS A 196 124.358 13.106 155.676 1.00 65.95 N ATOM 1661 HZ1 LYS A 196 123.693 12.654 156.335 1.00 0.00 H ATOM 1662 HZ2 LYS A 196 125.303 13.148 156.109 1.00 0.00 H ATOM 1663 HZ3 LYS A 196 124.032 14.070 155.459 1.00 0.00 H ATOM 1664 H LYS A 196 122.605 9.701 159.092 1.00 0.00 H ATOM 1665 N LYS A 197 124.402 6.908 159.382 1.00 54.15 N ATOM 1666 CA LYS A 197 125.035 5.678 159.850 1.00 54.38 C ATOM 1667 C LYS A 197 124.058 4.535 160.132 1.00 63.02 C ATOM 1668 O LYS A 197 124.506 3.408 160.372 1.00 60.34 O ATOM 1669 CB LYS A 197 125.848 5.916 161.130 1.00 56.34 C ATOM 1670 CG LYS A 197 126.922 6.991 161.056 1.00 57.62 C ATOM 1671 CD LYS A 197 127.865 6.655 159.945 1.00 74.42 C ATOM 1672 CE LYS A 197 128.025 7.709 158.825 1.00 73.71 C ATOM 1673 NZ LYS A 197 128.565 7.073 157.534 1.00 76.30 N ATOM 1674 HZ1 LYS A 197 129.494 6.645 157.722 1.00 0.00 H ATOM 1675 HZ2 LYS A 197 127.904 6.340 157.207 1.00 0.00 H ATOM 1676 HZ3 LYS A 197 128.661 7.806 156.802 1.00 0.00 H ATOM 1677 H LYS A 197 124.093 7.610 160.084 1.00 0.00 H ATOM 1678 N GLN A 198 122.751 4.777 160.158 1.00 60.48 N ATOM 1679 CA GLN A 198 121.834 3.696 160.498 1.00 51.99 C ATOM 1680 C GLN A 198 121.323 2.941 159.280 1.00 49.32 C ATOM 1681 O GLN A 198 120.583 1.965 159.433 1.00 58.57 O ATOM 1682 CB GLN A 198 120.644 4.236 161.283 1.00 51.84 C ATOM 1683 CG GLN A 198 121.032 5.124 162.431 1.00 53.08 C ATOM 1684 CD GLN A 198 121.901 4.395 163.415 1.00 59.85 C ATOM 1685 OE1 GLN A 198 121.654 3.225 163.742 1.00 60.51 O ATOM 1686 NE2 GLN A 198 122.929 5.076 163.899 1.00 61.96 N ATOM 1687 HE22 GLN A 198 123.094 6.056 163.593 1.00 0.00 H ATOM 1688 HE21 GLN A 198 123.571 4.630 164.585 1.00 0.00 H ATOM 1689 H GLN A 198 122.387 5.726 159.938 1.00 0.00 H ATOM 1690 N LEU A 199 121.687 3.362 158.078 1.00 54.83 N ATOM 1691 CA LEU A 199 121.087 2.780 156.890 1.00 60.48 C ATOM 1692 C LEU A 199 122.125 2.727 155.777 1.00 56.21 C ATOM 1693 O LEU A 199 123.104 3.474 155.785 1.00 60.68 O ATOM 1694 CB LEU A 199 119.852 3.592 156.455 1.00 59.23 C ATOM 1695 CG LEU A 199 118.661 3.717 157.419 1.00 57.68 C ATOM 1696 CD1 LEU A 199 117.687 4.723 156.886 1.00 51.44 C ATOM 1697 CD2 LEU A 199 118.005 2.386 157.742 1.00 56.30 C ATOM 1698 H LEU A 199 122.403 4.110 157.985 1.00 0.00 H ATOM 1699 N SER A 200 121.895 1.842 154.811 1.00 53.23 N ATOM 1700 CA SER A 200 122.734 1.817 153.613 1.00 53.01 C ATOM 1701 C SER A 200 122.640 3.135 152.850 1.00 56.16 C ATOM 1702 O SER A 200 121.696 3.905 153.014 1.00 62.19 O ATOM 1703 CB SER A 200 122.294 0.705 152.673 1.00 53.13 C ATOM 1704 OG SER A 200 120.995 0.996 152.178 1.00 55.87 O ATOM 1705 HG SER A 200 120.361 1.061 152.936 1.00 0.00 H ATOM 1706 H SER A 200 121.113 1.163 154.908 1.00 0.00 H ATOM 1707 N GLU A 201 123.605 3.370 151.952 1.00 58.88 N ATOM 1708 CA GLU A 201 123.573 4.618 151.189 1.00 60.58 C ATOM 1709 C GLU A 201 122.335 4.713 150.323 1.00 57.35 C ATOM 1710 O GLU A 201 121.759 5.793 150.189 1.00 62.10 O ATOM 1711 CB GLU A 201 124.850 4.810 150.372 1.00 58.07 C ATOM 1712 CG GLU A 201 126.046 4.972 151.291 1.00 72.20 C ATOM 1713 CD GLU A 201 127.301 5.426 150.581 1.00 78.42 C ATOM 1714 OE1 GLU A 201 127.281 5.433 149.335 1.00 76.19 O ATOM 1715 OE2 GLU A 201 128.271 5.843 151.276 1.00 81.75 O ATOM 1716 H GLU A 201 124.365 2.677 151.799 1.00 0.00 H ATOM 1717 N THR A 202 121.907 3.603 149.722 1.00 60.24 N ATOM 1718 CA THR A 202 120.676 3.632 148.930 1.00 58.19 C ATOM 1719 C THR A 202 119.455 3.869 149.817 1.00 57.15 C ATOM 1720 O THR A 202 118.546 4.624 149.443 1.00 61.08 O ATOM 1721 CB THR A 202 120.525 2.340 148.128 1.00 62.37 C ATOM 1722 OG1 THR A 202 121.493 2.313 147.068 1.00 65.83 O ATOM 1723 CG2 THR A 202 119.126 2.240 147.514 1.00 60.81 C ATOM 1724 HG1 THR A 202 121.392 1.475 146.551 1.00 0.00 H ATOM 1725 H THR A 202 122.446 2.719 149.815 1.00 0.00 H ATOM 1726 N SER A 203 119.394 3.232 150.988 1.00 53.45 N ATOM 1727 CA SER A 203 118.233 3.417 151.851 1.00 55.25 C ATOM 1728 C SER A 203 118.207 4.824 152.446 1.00 51.56 C ATOM 1729 O SER A 203 117.156 5.475 152.459 1.00 52.86 O ATOM 1730 CB SER A 203 118.219 2.369 152.956 1.00 54.73 C ATOM 1731 OG SER A 203 117.978 1.121 152.406 1.00 53.21 O ATOM 1732 HG SER A 203 117.969 0.441 153.125 1.00 0.00 H ATOM 1733 H SER A 203 120.171 2.607 151.284 1.00 0.00 H ATOM 1734 N GLN A 204 119.348 5.288 152.972 1.00 54.22 N ATOM 1735 CA GLN A 204 119.489 6.669 153.444 1.00 51.48 C ATOM 1736 C GLN A 204 119.003 7.662 152.398 1.00 52.72 C ATOM 1737 O GLN A 204 118.173 8.531 152.681 1.00 53.49 O ATOM 1738 CB GLN A 204 120.955 6.946 153.785 1.00 46.97 C ATOM 1739 CG GLN A 204 121.280 8.276 154.502 1.00 53.54 C ATOM 1740 CD GLN A 204 120.644 8.391 155.911 1.00 57.32 C ATOM 1741 OE1 GLN A 204 120.786 7.487 156.751 1.00 53.10 O ATOM 1742 NE2 GLN A 204 120.037 9.533 156.191 1.00 47.62 N ATOM 1743 HE22 GLN A 204 119.940 10.264 155.457 1.00 0.00 H ATOM 1744 HE21 GLN A 204 119.657 9.700 157.145 1.00 0.00 H ATOM 1745 H GLN A 204 120.163 4.646 153.048 1.00 0.00 H ATOM 1746 N ALA A 205 119.462 7.509 151.158 1.00 53.73 N ATOM 1747 CA ALA A 205 119.142 8.525 150.166 1.00 51.05 C ATOM 1748 C ALA A 205 117.664 8.533 149.825 1.00 49.11 C ATOM 1749 O ALA A 205 117.115 9.584 149.492 1.00 51.40 O ATOM 1750 CB ALA A 205 119.965 8.314 148.912 1.00 45.94 C ATOM 1751 H ALA A 205 120.037 6.681 150.903 1.00 0.00 H ATOM 1752 N LEU A 206 116.982 7.396 149.944 1.00 53.38 N ATOM 1753 CA LEU A 206 115.553 7.420 149.666 1.00 50.00 C ATOM 1754 C LEU A 206 114.802 8.135 150.791 1.00 52.19 C ATOM 1755 O LEU A 206 113.916 8.959 150.527 1.00 51.80 O ATOM 1756 CB LEU A 206 115.026 5.999 149.486 1.00 49.34 C ATOM 1757 CG LEU A 206 115.376 5.271 148.201 1.00 52.52 C ATOM 1758 CD1 LEU A 206 115.131 3.797 148.380 1.00 50.55 C ATOM 1759 CD2 LEU A 206 114.590 5.848 147.047 1.00 59.36 C ATOM 1760 H LEU A 206 117.457 6.515 150.228 1.00 0.00 H ATOM 1761 N LEU A 207 115.182 7.864 152.047 1.00 45.18 N ATOM 1762 CA LEU A 207 114.521 8.487 153.186 1.00 51.51 C ATOM 1763 C LEU A 207 114.700 10.013 153.176 1.00 50.67 C ATOM 1764 O LEU A 207 113.745 10.753 153.444 1.00 50.49 O ATOM 1765 CB LEU A 207 115.043 7.855 154.491 1.00 49.24 C ATOM 1766 CG LEU A 207 114.310 8.278 155.777 1.00 48.63 C ATOM 1767 CD1 LEU A 207 112.814 8.126 155.677 1.00 41.06 C ATOM 1768 CD2 LEU A 207 114.827 7.511 156.970 1.00 46.25 C ATOM 1769 H LEU A 207 115.963 7.197 152.212 1.00 0.00 H ATOM 1770 N TRP A 208 115.916 10.498 152.879 1.00 47.14 N ATOM 1771 CA TRP A 208 116.155 11.939 152.766 1.00 52.38 C ATOM 1772 C TRP A 208 115.281 12.559 151.677 1.00 51.93 C ATOM 1773 O TRP A 208 114.665 13.613 151.879 1.00 51.76 O ATOM 1774 CB TRP A 208 117.642 12.215 152.494 1.00 51.01 C ATOM 1775 CG TRP A 208 117.959 13.665 152.390 1.00 50.58 C ATOM 1776 CD1 TRP A 208 117.996 14.436 151.235 1.00 48.81 C ATOM 1777 CD2 TRP A 208 118.281 14.551 153.473 1.00 48.01 C ATOM 1778 NE1 TRP A 208 118.317 15.743 151.557 1.00 48.33 N ATOM 1779 CE2 TRP A 208 118.501 15.839 152.914 1.00 50.71 C ATOM 1780 CE3 TRP A 208 118.406 14.383 154.862 1.00 45.67 C ATOM 1781 CZ2 TRP A 208 118.828 16.947 153.700 1.00 52.81 C ATOM 1782 CZ3 TRP A 208 118.737 15.488 155.641 1.00 51.53 C ATOM 1783 CH2 TRP A 208 118.943 16.754 155.058 1.00 48.47 C ATOM 1784 HE1 TRP A 208 118.405 16.527 150.879 1.00 0.00 H ATOM 1785 H TRP A 208 116.704 9.837 152.726 1.00 0.00 H ATOM 1786 N LYS A 209 115.207 11.906 150.514 1.00 51.99 N ATOM 1787 CA LYS A 209 114.349 12.372 149.423 1.00 51.11 C ATOM 1788 C LYS A 209 112.890 12.481 149.867 1.00 48.39 C ATOM 1789 O LYS A 209 112.240 13.515 149.676 1.00 56.64 O ATOM 1790 CB LYS A 209 114.493 11.416 148.232 1.00 52.84 C ATOM 1791 CG LYS A 209 113.737 11.810 146.985 1.00 52.37 C ATOM 1792 CD LYS A 209 113.927 10.714 145.921 1.00 59.89 C ATOM 1793 CE LYS A 209 113.108 10.992 144.665 1.00 62.59 C ATOM 1794 NZ LYS A 209 113.650 12.188 143.953 1.00 56.57 N ATOM 1795 HZ1 LYS A 209 113.603 13.015 144.582 1.00 0.00 H ATOM 1796 HZ2 LYS A 209 114.639 12.011 143.684 1.00 0.00 H ATOM 1797 HZ3 LYS A 209 113.084 12.368 143.099 1.00 0.00 H ATOM 1798 H LYS A 209 115.774 11.044 150.380 1.00 0.00 H ATOM 1799 N TRP A 210 112.355 11.414 150.454 1.00 50.03 N ATOM 1800 CA TRP A 210 110.974 11.428 150.930 1.00 53.96 C ATOM 1801 C TRP A 210 110.753 12.537 151.974 1.00 53.64 C ATOM 1802 O TRP A 210 109.722 13.226 151.957 1.00 49.63 O ATOM 1803 CB TRP A 210 110.625 10.039 151.501 1.00 41.49 C ATOM 1804 CG TRP A 210 110.747 8.923 150.459 1.00 51.42 C ATOM 1805 CD1 TRP A 210 110.535 9.040 149.109 1.00 51.27 C ATOM 1806 CD2 TRP A 210 111.098 7.543 150.685 1.00 51.59 C ATOM 1807 NE1 TRP A 210 110.757 7.844 148.491 1.00 53.47 N ATOM 1808 CE2 TRP A 210 111.082 6.900 149.427 1.00 54.55 C ATOM 1809 CE3 TRP A 210 111.436 6.798 151.823 1.00 45.38 C ATOM 1810 CZ2 TRP A 210 111.384 5.555 149.272 1.00 47.73 C ATOM 1811 CZ3 TRP A 210 111.722 5.487 151.677 1.00 48.88 C ATOM 1812 CH2 TRP A 210 111.698 4.864 150.397 1.00 50.88 C ATOM 1813 HE1 TRP A 210 110.690 7.676 147.467 1.00 0.00 H ATOM 1814 H TRP A 210 112.929 10.556 150.576 1.00 0.00 H ATOM 1815 N MET A 211 111.741 12.778 152.843 1.00 48.48 N ATOM 1816 CA MET A 211 111.569 13.809 153.867 1.00 52.75 C ATOM 1817 C MET A 211 111.742 15.214 153.281 1.00 50.60 C ATOM 1818 O MET A 211 111.055 16.160 153.708 1.00 48.68 O ATOM 1819 CB MET A 211 112.595 13.602 155.000 1.00 48.27 C ATOM 1820 CG MET A 211 112.449 12.299 155.828 1.00 41.95 C ATOM 1821 SD MET A 211 111.237 12.438 157.164 1.00 48.19 S ATOM 1822 CE MET A 211 112.148 13.492 158.304 1.00 44.00 C ATOM 1823 H MET A 211 112.627 12.235 152.791 1.00 0.00 H ATOM 1824 N VAL A 212 112.571 15.363 152.242 1.00 50.23 N ATOM 1825 CA VAL A 212 112.672 16.683 151.630 1.00 51.19 C ATOM 1826 C VAL A 212 111.465 16.964 150.752 1.00 50.76 C ATOM 1827 O VAL A 212 110.949 18.086 150.724 1.00 53.47 O ATOM 1828 CB VAL A 212 113.983 16.816 150.830 1.00 49.95 C ATOM 1829 CG1 VAL A 212 114.018 18.181 150.118 1.00 45.53 C ATOM 1830 CG2 VAL A 212 115.217 16.634 151.740 1.00 47.46 C ATOM 1831 H VAL A 212 113.127 14.562 151.881 1.00 0.00 H ATOM 1832 N GLU A 213 110.944 15.948 150.084 1.00 50.60 N ATOM 1833 CA GLU A 213 109.992 16.223 149.020 1.00 56.13 C ATOM 1834 C GLU A 213 108.555 16.306 149.488 1.00 51.36 C ATOM 1835 O GLU A 213 107.680 16.596 148.676 1.00 65.67 O ATOM 1836 CB GLU A 213 110.152 15.211 147.871 1.00 53.00 C ATOM 1837 CG GLU A 213 111.481 15.420 147.123 1.00 55.47 C ATOM 1838 CD GLU A 213 111.735 14.482 145.927 1.00 65.37 C ATOM 1839 OE1 GLU A 213 111.087 13.411 145.774 1.00 63.65 O ATOM 1840 OE2 GLU A 213 112.607 14.852 145.119 1.00 65.42 O ATOM 1841 H GLU A 213 111.211 14.970 150.316 1.00 0.00 H ATOM 1842 N THR A 214 108.285 16.077 150.757 1.00 54.74 N ATOM 1843 CA THR A 214 106.940 16.267 151.272 1.00 49.04 C ATOM 1844 C THR A 214 106.460 17.702 151.041 1.00 52.56 C ATOM 1845 O THR A 214 107.240 18.663 151.038 1.00 49.55 O ATOM 1846 CB THR A 214 106.929 15.959 152.760 1.00 45.42 C ATOM 1847 OG1 THR A 214 105.593 16.048 153.263 1.00 47.32 O ATOM 1848 CG2 THR A 214 107.830 16.986 153.503 1.00 45.95 C ATOM 1849 HG1 THR A 214 105.019 15.396 152.789 1.00 0.00 H ATOM 1850 H THR A 214 109.041 15.757 151.395 1.00 0.00 H ATOM 1851 N THR A 215 105.154 17.850 150.855 1.00 52.87 N ATOM 1852 CA THR A 215 104.538 19.169 150.858 1.00 47.70 C ATOM 1853 C THR A 215 103.689 19.395 152.109 1.00 51.29 C ATOM 1854 O THR A 215 102.857 20.326 152.126 1.00 48.45 O ATOM 1855 CB THR A 215 103.672 19.375 149.619 1.00 49.98 C ATOM 1856 OG1 THR A 215 102.489 18.577 149.748 1.00 50.73 O ATOM 1857 CG2 THR A 215 104.426 18.922 148.374 1.00 52.28 C ATOM 1858 HG1 THR A 215 101.991 18.855 150.557 1.00 0.00 H ATOM 1859 H THR A 215 104.561 17.009 150.705 1.00 0.00 H ATOM 1860 N THR A 216 103.800 18.516 153.111 1.00 45.16 N ATOM 1861 CA THR A 216 103.092 18.702 154.377 1.00 44.87 C ATOM 1862 C THR A 216 103.672 19.884 155.149 1.00 46.21 C ATOM 1863 O THR A 216 104.822 20.291 154.954 1.00 47.20 O ATOM 1864 CB THR A 216 103.191 17.457 155.267 1.00 44.93 C ATOM 1865 OG1 THR A 216 104.564 17.197 155.570 1.00 45.06 O ATOM 1866 CG2 THR A 216 102.643 16.201 154.558 1.00 45.69 C ATOM 1867 HG1 THR A 216 104.627 16.393 156.145 1.00 0.00 H ATOM 1868 H THR A 216 104.405 17.679 152.987 1.00 0.00 H ATOM 1869 N GLY A 217 102.837 20.457 156.013 1.00 50.33 N ATOM 1870 CA GLY A 217 103.259 21.471 156.954 1.00 45.44 C ATOM 1871 C GLY A 217 104.161 22.563 156.415 1.00 45.24 C ATOM 1872 O GLY A 217 105.212 22.840 157.002 1.00 48.52 O ATOM 1873 H GLY A 217 101.839 20.163 156.011 1.00 0.00 H ATOM 1874 N PRO A 218 103.797 23.198 155.293 1.00 47.43 N ATOM 1875 CA PRO A 218 104.631 24.320 154.815 1.00 47.07 C ATOM 1876 C PRO A 218 104.738 25.487 155.797 1.00 46.08 C ATOM 1877 O PRO A 218 105.731 26.227 155.757 1.00 43.37 O ATOM 1878 CB PRO A 218 103.944 24.743 153.497 1.00 40.14 C ATOM 1879 CG PRO A 218 102.525 24.293 153.632 1.00 38.42 C ATOM 1880 CD PRO A 218 102.640 22.965 154.387 1.00 39.98 C ATOM 1881 N GLN A 219 103.762 25.689 156.675 1.00 47.93 N ATOM 1882 CA GLN A 219 103.831 26.797 157.630 1.00 43.48 C ATOM 1883 C GLN A 219 104.469 26.379 158.947 1.00 47.45 C ATOM 1884 O GLN A 219 104.380 27.117 159.931 1.00 37.99 O ATOM 1885 CB GLN A 219 102.444 27.350 157.925 1.00 44.29 C ATOM 1886 CG GLN A 219 101.747 27.840 156.716 1.00 51.08 C ATOM 1887 CD GLN A 219 102.598 28.829 155.983 1.00 56.60 C ATOM 1888 OE1 GLN A 219 103.229 29.717 156.585 1.00 57.74 O ATOM 1889 NE2 GLN A 219 102.601 28.712 154.667 1.00 61.71 N ATOM 1890 HE22 GLN A 219 102.057 27.952 154.211 1.00 0.00 H ATOM 1891 HE21 GLN A 219 103.148 29.380 154.087 1.00 0.00 H ATOM 1892 H GLN A 219 102.939 25.053 156.684 1.00 0.00 H ATOM 1893 N ARG A 220 105.098 25.203 159.000 1.00 43.57 N ATOM 1894 CA ARG A 220 105.685 24.813 160.277 1.00 45.82 C ATOM 1895 C ARG A 220 107.179 25.114 160.223 1.00 43.88 C ATOM 1896 O ARG A 220 107.534 26.294 160.169 1.00 47.06 O ATOM 1897 CB ARG A 220 105.329 23.370 160.595 1.00 41.16 C ATOM 1898 CG ARG A 220 103.784 23.235 160.751 1.00 39.59 C ATOM 1899 CD ARG A 220 103.314 21.791 161.073 1.00 38.53 C ATOM 1900 NE ARG A 220 101.858 21.685 160.977 1.00 40.78 N ATOM 1901 CZ ARG A 220 101.126 20.656 161.411 1.00 44.04 C ATOM 1902 NH1 ARG A 220 101.680 19.586 162.000 1.00 38.41 N ATOM 1903 NH2 ARG A 220 99.815 20.693 161.241 1.00 47.09 N ATOM 1904 HE ARG A 220 101.351 22.477 160.534 1.00 0.00 H ATOM 1905 HH12 ARG A 220 101.079 18.802 162.326 1.00 0.00 H ATOM 1906 HH11 ARG A 220 102.711 19.540 162.131 1.00 0.00 H ATOM 1907 HH22 ARG A 220 99.225 19.903 161.571 1.00 0.00 H ATOM 1908 HH21 ARG A 220 99.374 21.513 160.777 1.00 0.00 H ATOM 1909 H ARG A 220 105.167 24.589 158.164 1.00 0.00 H ATOM 1910 N LEU A 221 108.061 24.108 160.242 1.00 41.55 N ATOM 1911 CA LEU A 221 109.493 24.405 160.229 1.00 38.74 C ATOM 1912 C LEU A 221 109.881 25.285 159.037 1.00 44.98 C ATOM 1913 O LEU A 221 110.771 26.144 159.160 1.00 44.85 O ATOM 1914 CB LEU A 221 110.313 23.124 160.241 1.00 37.96 C ATOM 1915 CG LEU A 221 110.310 22.293 161.538 1.00 43.19 C ATOM 1916 CD1 LEU A 221 111.076 20.982 161.347 1.00 45.51 C ATOM 1917 CD2 LEU A 221 110.840 23.047 162.770 1.00 40.02 C ATOM 1918 H LEU A 221 107.731 23.122 160.266 1.00 0.00 H ATOM 1919 N LYS A 222 109.259 25.076 157.871 1.00 42.05 N ATOM 1920 CA LYS A 222 109.632 25.894 156.717 1.00 45.77 C ATOM 1921 C LYS A 222 108.960 27.269 156.694 1.00 43.99 C ATOM 1922 O LYS A 222 109.282 28.071 155.819 1.00 43.53 O ATOM 1923 CB LYS A 222 109.355 25.180 155.378 1.00 45.48 C ATOM 1924 CG LYS A 222 110.043 23.802 155.179 1.00 56.11 C ATOM 1925 CD LYS A 222 109.903 23.210 153.732 1.00 54.27 C ATOM 1926 CE LYS A 222 108.718 23.735 152.939 1.00 70.18 C ATOM 1927 NZ LYS A 222 108.081 22.714 152.040 1.00 74.02 N ATOM 1928 HZ1 LYS A 222 108.783 22.373 151.353 1.00 0.00 H ATOM 1929 HZ2 LYS A 222 107.738 21.916 152.612 1.00 0.00 H ATOM 1930 HZ3 LYS A 222 107.282 23.149 151.535 1.00 0.00 H ATOM 1931 H LYS A 222 108.524 24.345 157.787 1.00 0.00 H ATOM 1932 N GLY A 223 108.085 27.590 157.645 1.00 44.37 N ATOM 1933 CA GLY A 223 107.171 28.707 157.456 1.00 42.19 C ATOM 1934 C GLY A 223 107.832 30.079 157.388 1.00 43.14 C ATOM 1935 O GLY A 223 107.331 30.980 156.720 1.00 44.01 O ATOM 1936 H GLY A 223 108.054 27.040 158.527 1.00 0.00 H ATOM 1937 N LEU A 224 108.915 30.292 158.130 1.00 42.34 N ATOM 1938 CA LEU A 224 109.556 31.603 158.111 1.00 43.91 C ATOM 1939 C LEU A 224 110.999 31.521 157.641 1.00 46.50 C ATOM 1940 O LEU A 224 111.792 32.409 157.979 1.00 44.84 O ATOM 1941 CB LEU A 224 109.460 32.297 159.473 1.00 38.89 C ATOM 1942 CG LEU A 224 108.022 32.763 159.754 1.00 39.35 C ATOM 1943 CD1 LEU A 224 107.798 33.056 161.220 1.00 41.59 C ATOM 1944 CD2 LEU A 224 107.632 33.939 158.927 1.00 33.77 C ATOM 1945 H LEU A 224 109.303 29.529 158.720 1.00 0.00 H ATOM 1946 N LEU A 225 111.366 30.421 156.826 1.00 42.97 N ATOM 1947 CA LEU A 225 112.680 30.294 156.224 1.00 36.05 C ATOM 1948 C LEU A 225 112.625 30.805 154.811 1.00 42.48 C ATOM 1949 O LEU A 225 111.558 30.817 154.186 1.00 42.10 O ATOM 1950 CB LEU A 225 113.170 28.837 156.236 1.00 37.76 C ATOM 1951 CG LEU A 225 113.113 28.140 157.620 1.00 46.65 C ATOM 1952 CD1 LEU A 225 113.637 26.693 157.645 1.00 31.92 C ATOM 1953 CD2 LEU A 225 113.750 28.993 158.708 1.00 41.65 C ATOM 1954 H LEU A 225 110.664 29.674 156.652 1.00 0.00 H ATOM 1955 N PRO A 226 113.752 31.260 154.273 1.00 46.50 N ATOM 1956 CA PRO A 226 113.751 31.738 152.884 1.00 45.65 C ATOM 1957 C PRO A 226 113.260 30.646 151.947 1.00 49.36 C ATOM 1958 O PRO A 226 113.495 29.448 152.169 1.00 47.60 O ATOM 1959 CB PRO A 226 115.217 32.105 152.619 1.00 46.96 C ATOM 1960 CG PRO A 226 115.840 32.286 153.973 1.00 44.55 C ATOM 1961 CD PRO A 226 115.058 31.448 154.940 1.00 44.43 C ATOM 1962 N ALA A 227 112.511 31.074 150.936 1.00 51.55 N ATOM 1963 CA ALA A 227 111.984 30.170 149.929 1.00 50.05 C ATOM 1964 C ALA A 227 113.101 29.322 149.345 1.00 54.47 C ATOM 1965 O ALA A 227 114.178 29.831 149.017 1.00 57.50 O ATOM 1966 CB ALA A 227 111.292 30.976 148.819 1.00 53.96 C ATOM 1967 H ALA A 227 112.295 32.089 150.864 1.00 0.00 H ATOM 1968 N GLY A 228 112.851 28.019 149.233 1.00 43.79 N ATOM 1969 CA GLY A 228 113.853 27.146 148.697 1.00 47.01 C ATOM 1970 C GLY A 228 114.800 26.543 149.705 1.00 55.60 C ATOM 1971 O GLY A 228 115.631 25.707 149.307 1.00 54.29 O ATOM 1972 H GLY A 228 111.932 27.636 149.533 1.00 0.00 H ATOM 1973 N THR A 229 114.708 26.927 150.989 1.00 48.98 N ATOM 1974 CA THR A 229 115.534 26.288 152.018 1.00 49.62 C ATOM 1975 C THR A 229 115.216 24.800 152.095 1.00 44.31 C ATOM 1976 O THR A 229 114.053 24.407 152.183 1.00 45.47 O ATOM 1977 CB THR A 229 115.293 26.913 153.394 1.00 45.00 C ATOM 1978 OG1 THR A 229 115.489 28.324 153.329 1.00 45.55 O ATOM 1979 CG2 THR A 229 116.268 26.312 154.416 1.00 45.51 C ATOM 1980 HG1 THR A 229 114.854 28.714 152.677 1.00 0.00 H ATOM 1981 H THR A 229 114.046 27.683 151.255 1.00 0.00 H ATOM 1982 N ILE A 230 116.252 23.974 152.076 1.00 47.73 N ATOM 1983 CA ILE A 230 116.072 22.528 152.077 1.00 44.64 C ATOM 1984 C ILE A 230 115.803 22.074 153.507 1.00 49.14 C ATOM 1985 O ILE A 230 116.619 22.300 154.405 1.00 49.02 O ATOM 1986 CB ILE A 230 117.295 21.817 151.486 1.00 48.75 C ATOM 1987 CG1 ILE A 230 117.508 22.239 150.028 1.00 48.73 C ATOM 1988 CG2 ILE A 230 117.173 20.257 151.625 1.00 48.92 C ATOM 1989 CD1 ILE A 230 116.402 21.852 149.149 1.00 54.82 C ATOM 1990 H ILE A 230 117.215 24.366 152.060 1.00 0.00 H ATOM 1991 N VAL A 231 114.647 21.448 153.728 1.00 46.14 N ATOM 1992 CA VAL A 231 114.270 20.975 155.045 1.00 42.83 C ATOM 1993 C VAL A 231 113.738 19.559 154.909 1.00 44.11 C ATOM 1994 O VAL A 231 112.671 19.356 154.323 1.00 48.55 O ATOM 1995 CB VAL A 231 113.222 21.878 155.720 1.00 45.95 C ATOM 1996 CG1 VAL A 231 112.920 21.336 157.088 1.00 39.79 C ATOM 1997 CG2 VAL A 231 113.702 23.344 155.819 1.00 43.65 C ATOM 1998 H VAL A 231 113.996 21.294 152.931 1.00 0.00 H ATOM 1999 N ALA A 232 114.442 18.582 155.507 1.00 46.14 N ATOM 2000 CA ALA A 232 113.941 17.209 155.578 1.00 46.87 C ATOM 2001 C ALA A 232 113.206 17.058 156.895 1.00 46.17 C ATOM 2002 O ALA A 232 113.829 17.151 157.960 1.00 52.17 O ATOM 2003 CB ALA A 232 115.061 16.176 155.472 1.00 39.96 C ATOM 2004 H ALA A 232 115.365 18.808 155.929 1.00 0.00 H ATOM 2005 N HIS A 233 111.894 16.816 156.830 1.00 44.73 N ATOM 2006 CA HIS A 233 111.072 16.898 158.033 1.00 45.03 C ATOM 2007 C HIS A 233 109.857 15.996 157.924 1.00 46.57 C ATOM 2008 O HIS A 233 109.445 15.620 156.830 1.00 44.40 O ATOM 2009 CB HIS A 233 110.593 18.319 158.280 1.00 44.80 C ATOM 2010 CG HIS A 233 109.630 18.819 157.242 1.00 41.72 C ATOM 2011 ND1 HIS A 233 108.285 19.001 157.497 1.00 40.39 N ATOM 2012 CD2 HIS A 233 109.826 19.213 155.963 1.00 39.31 C ATOM 2013 CE1 HIS A 233 107.691 19.480 156.418 1.00 39.80 C ATOM 2014 NE2 HIS A 233 108.603 19.607 155.469 1.00 45.61 N ATOM 2015 H HIS A 233 111.457 16.568 155.919 1.00 0.00 H ATOM 2016 N LYS A 234 109.295 15.664 159.090 1.00 46.99 N ATOM 2017 CA LYS A 234 108.058 14.895 159.225 1.00 45.69 C ATOM 2018 C LYS A 234 107.118 15.628 160.182 1.00 50.62 C ATOM 2019 O LYS A 234 107.458 15.866 161.358 1.00 47.24 O ATOM 2020 CB LYS A 234 108.318 13.471 159.752 1.00 45.56 C ATOM 2021 CG LYS A 234 107.060 12.583 159.758 1.00 48.12 C ATOM 2022 CD LYS A 234 106.597 12.337 158.319 1.00 49.95 C ATOM 2023 CE LYS A 234 105.153 11.944 158.254 1.00 47.48 C ATOM 2024 NZ LYS A 234 104.351 13.186 158.382 1.00 50.94 N ATOM 2025 HZ1 LYS A 234 104.565 13.643 159.291 1.00 0.00 H ATOM 2026 HZ2 LYS A 234 104.589 13.833 157.603 1.00 0.00 H ATOM 2027 HZ3 LYS A 234 103.339 12.950 158.341 1.00 0.00 H ATOM 2028 H LYS A 234 109.770 15.974 159.962 1.00 0.00 H ATOM 2029 N THR A 235 105.920 15.911 159.695 1.00 48.92 N ATOM 2030 CA THR A 235 104.850 16.561 160.417 1.00 46.34 C ATOM 2031 C THR A 235 104.007 15.528 161.123 1.00 44.49 C ATOM 2032 O THR A 235 104.051 14.337 160.816 1.00 48.16 O ATOM 2033 CB THR A 235 103.959 17.325 159.453 1.00 45.37 C ATOM 2034 OG1 THR A 235 103.459 16.397 158.467 1.00 46.75 O ATOM 2035 CG2 THR A 235 104.744 18.426 158.801 1.00 36.87 C ATOM 2036 HG1 THR A 235 104.220 15.993 157.980 1.00 0.00 H ATOM 2037 H THR A 235 105.733 15.642 158.708 1.00 0.00 H ATOM 2038 N GLY A 236 103.186 16.012 162.040 1.00 46.49 N ATOM 2039 CA GLY A 236 102.178 15.201 162.688 1.00 41.88 C ATOM 2040 C GLY A 236 101.165 16.134 163.300 1.00 46.01 C ATOM 2041 O GLY A 236 101.537 17.209 163.809 1.00 45.44 O ATOM 2042 H GLY A 236 103.268 17.014 162.306 1.00 0.00 H ATOM 2043 N THR A 237 99.888 15.741 163.253 1.00 48.43 N ATOM 2044 CA THR A 237 98.784 16.548 163.764 1.00 48.49 C ATOM 2045 C THR A 237 97.649 15.657 164.264 1.00 49.43 C ATOM 2046 O THR A 237 97.204 14.746 163.558 1.00 47.87 O ATOM 2047 CB THR A 237 98.255 17.513 162.680 1.00 47.10 C ATOM 2048 OG1 THR A 237 99.354 18.129 161.981 1.00 42.44 O ATOM 2049 CG2 THR A 237 97.384 18.595 163.318 1.00 44.86 C ATOM 2050 HG1 THR A 237 99.904 17.428 161.550 1.00 0.00 H ATOM 2051 H THR A 237 99.671 14.815 162.832 1.00 0.00 H ATOM 2052 N SER A 238 97.142 15.953 165.458 1.00 43.07 N ATOM 2053 CA SER A 238 95.928 15.282 165.878 1.00 47.86 C ATOM 2054 C SER A 238 94.701 16.048 165.369 1.00 44.37 C ATOM 2055 O SER A 238 94.806 17.119 164.753 1.00 45.06 O ATOM 2056 CB SER A 238 95.927 15.097 167.396 1.00 47.79 C ATOM 2057 OG SER A 238 95.712 16.320 168.069 1.00 49.38 O ATOM 2058 HG SER A 238 94.836 16.695 167.799 1.00 0.00 H ATOM 2059 H SER A 238 97.606 16.650 166.075 1.00 0.00 H ATOM 2060 N GLY A 239 93.520 15.474 165.589 1.00 40.56 N ATOM 2061 CA GLY A 239 92.287 16.212 165.402 1.00 42.92 C ATOM 2062 C GLY A 239 92.010 17.113 166.591 1.00 47.20 C ATOM 2063 O GLY A 239 92.721 17.118 167.596 1.00 56.36 O ATOM 2064 H GLY A 239 93.482 14.482 165.899 1.00 0.00 H ATOM 2065 N VAL A 240 90.937 17.881 166.502 1.00 54.22 N ATOM 2066 CA VAL A 240 90.582 18.771 167.595 1.00 50.29 C ATOM 2067 C VAL A 240 89.543 18.090 168.467 1.00 53.89 C ATOM 2068 O VAL A 240 88.814 17.192 168.035 1.00 52.14 O ATOM 2069 CB VAL A 240 90.054 20.134 167.119 1.00 57.53 C ATOM 2070 CG1 VAL A 240 91.071 20.831 166.226 1.00 54.05 C ATOM 2071 CG2 VAL A 240 88.699 19.945 166.421 1.00 54.66 C ATOM 2072 H VAL A 240 90.345 17.848 165.647 1.00 0.00 H ATOM 2073 N ARG A 240A 89.495 18.518 169.728 1.00 51.47 N ATOM 2074 CA ARG A 240A 88.491 18.047 170.669 1.00 56.96 C ATOM 2075 C ARG A 240A 88.224 19.177 171.635 1.00 55.63 C ATOM 2076 O ARG A 240A 89.163 19.645 172.278 1.00 57.06 O ATOM 2077 CB ARG A 240A 88.964 16.812 171.442 1.00 58.32 C ATOM 2078 CG ARG A 240A 89.270 15.607 170.582 1.00 66.10 C ATOM 2079 CD ARG A 240A 88.118 14.613 170.657 1.00 72.53 C ATOM 2080 NE ARG A 240A 88.141 13.661 169.554 1.00 79.50 N ATOM 2081 CZ ARG A 240A 87.129 12.852 169.258 1.00 83.66 C ATOM 2082 NH1 ARG A 240A 86.018 12.877 169.995 1.00 81.34 N ATOM 2083 NH2 ARG A 240A 87.217 12.001 168.233 1.00 78.67 N ATOM 2084 HE ARG A 240A 88.997 13.612 168.966 1.00 0.00 H ATOM 2085 HH12 ARG A 240A 85.226 12.244 169.763 1.00 0.00 H ATOM 2086 HH11 ARG A 240A 85.943 13.530 170.801 1.00 0.00 H ATOM 2087 HH22 ARG A 240A 86.420 11.372 168.009 1.00 0.00 H ATOM 2088 HH21 ARG A 240A 88.083 11.967 167.658 1.00 0.00 H ATOM 2089 H ARG A 240A 90.199 19.212 170.050 1.00 0.00 H ATOM 2090 N ALA A 240B 86.964 19.584 171.765 1.00 56.29 N ATOM 2091 CA ALA A 240B 86.596 20.616 172.738 1.00 58.18 C ATOM 2092 C ALA A 240B 87.504 21.833 172.603 1.00 53.41 C ATOM 2093 O ALA A 240B 88.016 22.364 173.582 1.00 54.14 O ATOM 2094 CB ALA A 240B 86.627 20.076 174.164 1.00 57.88 C ATOM 2095 H ALA A 240B 86.227 19.162 171.165 1.00 0.00 H ATOM 2096 N GLY A 240C 87.743 22.244 171.360 1.00 59.45 N ATOM 2097 CA GLY A 240C 88.578 23.400 171.098 1.00 60.07 C ATOM 2098 C GLY A 240C 90.029 23.239 171.491 1.00 56.64 C ATOM 2099 O GLY A 240C 90.720 24.237 171.727 1.00 51.99 O ATOM 2100 H GLY A 240C 87.323 21.726 170.562 1.00 0.00 H ATOM 2101 N LYS A 240D 90.526 22.012 171.544 1.00 47.19 N ATOM 2102 CA LYS A 240D 91.941 21.817 171.789 1.00 47.46 C ATOM 2103 C LYS A 240D 92.526 20.858 170.769 1.00 49.19 C ATOM 2104 O LYS A 240D 91.840 19.980 170.239 1.00 51.73 O ATOM 2105 CB LYS A 240D 92.194 21.329 173.205 1.00 47.74 C ATOM 2106 CG LYS A 240D 91.840 22.414 174.216 1.00 52.01 C ATOM 2107 CD LYS A 240D 92.417 22.117 175.577 1.00 59.97 C ATOM 2108 CE LYS A 240D 92.116 23.245 176.554 1.00 62.64 C ATOM 2109 NZ LYS A 240D 90.690 23.654 176.440 1.00 65.04 N ATOM 2110 HZ1 LYS A 240D 90.501 23.982 175.471 1.00 0.00 H ATOM 2111 HZ2 LYS A 240D 90.079 22.841 176.658 1.00 0.00 H ATOM 2112 HZ3 LYS A 240D 90.497 24.424 177.112 1.00 0.00 H ATOM 2113 H LYS A 240D 89.902 21.191 171.410 1.00 0.00 H ATOM 2114 N THR A 241 93.801 21.065 170.483 1.00 46.43 N ATOM 2115 CA THR A 241 94.570 20.195 169.621 1.00 50.21 C ATOM 2116 C THR A 241 95.653 19.528 170.446 1.00 44.85 C ATOM 2117 O THR A 241 96.569 20.201 170.943 1.00 49.54 O ATOM 2118 CB THR A 241 95.162 20.981 168.455 1.00 48.15 C ATOM 2119 OG1 THR A 241 94.102 21.695 167.826 1.00 40.81 O ATOM 2120 CG2 THR A 241 95.842 20.026 167.433 1.00 44.93 C ATOM 2121 HG1 THR A 241 94.462 22.214 167.064 1.00 0.00 H ATOM 2122 H THR A 241 94.273 21.893 170.898 1.00 0.00 H ATOM 2123 N ALA A 242 95.566 18.210 170.552 1.00 37.07 N ATOM 2124 CA ALA A 242 96.498 17.482 171.406 1.00 44.59 C ATOM 2125 C ALA A 242 97.930 17.604 170.909 1.00 47.12 C ATOM 2126 O ALA A 242 98.855 17.664 171.723 1.00 54.67 O ATOM 2127 CB ALA A 242 96.108 16.014 171.507 1.00 42.58 C ATOM 2128 H ALA A 242 94.832 17.694 170.026 1.00 0.00 H ATOM 2129 N ALA A 243 98.142 17.628 169.592 1.00 42.31 N ATOM 2130 CA ALA A 243 99.483 17.619 169.005 1.00 46.64 C ATOM 2131 C ALA A 243 99.498 18.342 167.667 1.00 43.84 C ATOM 2132 O ALA A 243 98.674 18.061 166.795 1.00 45.61 O ATOM 2133 CB ALA A 243 100.025 16.187 168.787 1.00 43.85 C ATOM 2134 H ALA A 243 97.320 17.654 168.956 1.00 0.00 H ATOM 2135 N THR A 244 100.444 19.261 167.516 1.00 41.06 N ATOM 2136 CA THR A 244 100.774 19.891 166.241 1.00 41.23 C ATOM 2137 C THR A 244 102.295 19.861 166.167 1.00 43.06 C ATOM 2138 O THR A 244 102.947 20.679 166.818 1.00 45.12 O ATOM 2139 CB THR A 244 100.244 21.323 166.170 1.00 43.36 C ATOM 2140 OG1 THR A 244 98.821 21.361 166.410 1.00 36.74 O ATOM 2141 CG2 THR A 244 100.571 21.925 164.815 1.00 44.99 C ATOM 2142 HG1 THR A 244 98.504 22.297 166.359 1.00 0.00 H ATOM 2143 H THR A 244 100.983 19.550 168.357 1.00 0.00 H ATOM 2144 N ASN A 245 102.870 18.950 165.381 1.00 43.09 N ATOM 2145 CA ASN A 245 104.294 18.642 165.476 1.00 44.10 C ATOM 2146 C ASN A 245 105.013 18.847 164.142 1.00 45.88 C ATOM 2147 O ASN A 245 104.408 18.782 163.064 1.00 42.38 O ATOM 2148 CB ASN A 245 104.495 17.195 165.937 1.00 42.01 C ATOM 2149 CG ASN A 245 103.699 16.859 167.210 1.00 47.92 C ATOM 2150 OD1 ASN A 245 103.435 17.729 168.074 1.00 49.79 O ATOM 2151 ND2 ASN A 245 103.300 15.605 167.325 1.00 42.53 N ATOM 2152 HD22 ASN A 245 103.540 14.913 166.586 1.00 0.00 H ATOM 2153 HD21 ASN A 245 102.746 15.309 168.154 1.00 0.00 H ATOM 2154 H ASN A 245 102.289 18.445 164.682 1.00 0.00 H ATOM 2155 N ASP A 246 106.332 19.059 164.223 1.00 41.41 N ATOM 2156 CA ASP A 246 107.187 19.020 163.034 1.00 45.25 C ATOM 2157 C ASP A 246 108.630 18.830 163.472 1.00 41.57 C ATOM 2158 O ASP A 246 109.107 19.530 164.355 1.00 43.88 O ATOM 2159 CB ASP A 246 107.047 20.283 162.168 1.00 39.84 C ATOM 2160 CG ASP A 246 107.581 20.089 160.740 1.00 43.54 C ATOM 2161 OD1 ASP A 246 107.794 18.940 160.282 1.00 44.38 O ATOM 2162 OD2 ASP A 246 107.755 21.105 160.047 1.00 45.44 O ATOM 2163 H ASP A 246 106.759 19.256 165.150 1.00 0.00 H ATOM 2164 N ALA A 247 109.315 17.877 162.859 1.00 45.11 N ATOM 2165 CA ALA A 247 110.639 17.473 163.298 1.00 44.02 C ATOM 2166 C ALA A 247 111.460 17.268 162.043 1.00 43.04 C ATOM 2167 O ALA A 247 111.039 16.535 161.138 1.00 44.93 O ATOM 2168 CB ALA A 247 110.569 16.183 164.146 1.00 36.47 C ATOM 2169 H ALA A 247 108.891 17.402 162.036 1.00 0.00 H ATOM 2170 N GLY A 248 112.607 17.929 161.973 1.00 38.86 N ATOM 2171 CA GLY A 248 113.339 17.856 160.727 1.00 41.45 C ATOM 2172 C GLY A 248 114.736 18.422 160.798 1.00 44.08 C ATOM 2173 O GLY A 248 115.181 18.960 161.820 1.00 47.85 O ATOM 2174 H GLY A 248 112.966 18.477 162.780 1.00 0.00 H ATOM 2175 N VAL A 249 115.403 18.314 159.658 1.00 45.43 N ATOM 2176 CA VAL A 249 116.787 18.715 159.453 1.00 45.66 C ATOM 2177 C VAL A 249 116.763 19.884 158.501 1.00 45.55 C ATOM 2178 O VAL A 249 116.345 19.729 157.350 1.00 51.18 O ATOM 2179 CB VAL A 249 117.627 17.567 158.855 1.00 48.72 C ATOM 2180 CG1 VAL A 249 119.046 18.051 158.538 1.00 49.29 C ATOM 2181 CG2 VAL A 249 117.682 16.361 159.803 1.00 51.44 C ATOM 2182 H VAL A 249 114.897 17.910 158.844 1.00 0.00 H ATOM 2183 N ILE A 250 117.250 21.036 158.944 1.00 47.84 N ATOM 2184 CA ILE A 250 117.361 22.202 158.069 1.00 44.68 C ATOM 2185 C ILE A 250 118.770 22.229 157.493 1.00 41.96 C ATOM 2186 O ILE A 250 119.745 22.232 158.239 1.00 48.16 O ATOM 2187 CB ILE A 250 117.081 23.494 158.844 1.00 40.34 C ATOM 2188 CG1 ILE A 250 115.723 23.423 159.524 1.00 38.63 C ATOM 2189 CG2 ILE A 250 117.252 24.722 157.922 1.00 39.50 C ATOM 2190 CD1 ILE A 250 115.497 24.547 160.593 1.00 40.97 C ATOM 2191 H ILE A 250 117.559 21.111 159.934 1.00 0.00 H ATOM 2192 N MET A 251 118.894 22.282 156.176 1.00 51.36 N ATOM 2193 CA MET A 251 120.213 22.451 155.573 1.00 52.55 C ATOM 2194 C MET A 251 120.557 23.929 155.560 1.00 47.64 C ATOM 2195 O MET A 251 119.882 24.711 154.898 1.00 50.33 O ATOM 2196 CB MET A 251 120.265 21.893 154.155 1.00 45.80 C ATOM 2197 CG MET A 251 120.958 20.515 154.054 1.00 71.54 C ATOM 2198 SD MET A 251 121.237 19.891 152.348 1.00 76.81 S ATOM 2199 CE MET A 251 121.716 21.381 151.472 1.00 49.19 C ATOM 2200 H MET A 251 118.052 22.203 155.571 1.00 0.00 H ATOM 2201 N LEU A 252 121.606 24.298 156.286 1.00 44.91 N ATOM 2202 CA LEU A 252 122.106 25.655 156.323 1.00 47.66 C ATOM 2203 C LEU A 252 122.769 26.011 154.992 1.00 47.03 C ATOM 2204 O LEU A 252 123.032 25.129 154.164 1.00 46.89 O ATOM 2205 CB LEU A 252 123.105 25.799 157.491 1.00 47.91 C ATOM 2206 CG LEU A 252 122.562 25.423 158.882 1.00 52.15 C ATOM 2207 CD1 LEU A 252 123.665 25.130 159.889 1.00 47.14 C ATOM 2208 CD2 LEU A 252 121.634 26.514 159.403 1.00 42.32 C ATOM 2209 H LEU A 252 122.092 23.576 156.856 1.00 0.00 H ATOM 2210 N PRO A 253 123.036 27.303 154.751 1.00 49.21 N ATOM 2211 CA PRO A 253 123.637 27.705 153.449 1.00 50.48 C ATOM 2212 C PRO A 253 125.034 27.147 153.204 1.00 49.45 C ATOM 2213 O PRO A 253 125.459 27.098 152.050 1.00 55.63 O ATOM 2214 CB PRO A 253 123.663 29.239 153.512 1.00 43.70 C ATOM 2215 CG PRO A 253 122.642 29.613 154.560 1.00 51.20 C ATOM 2216 CD PRO A 253 122.659 28.470 155.576 1.00 51.59 C ATOM 2217 N ASP A 255 125.764 26.740 154.240 1.00 49.76 N ATOM 2218 CA ASP A 255 127.064 26.100 154.072 1.00 55.19 C ATOM 2219 C ASP A 255 126.957 24.580 153.862 1.00 55.05 C ATOM 2220 O ASP A 255 127.986 23.905 153.768 1.00 56.59 O ATOM 2221 CB ASP A 255 127.964 26.423 155.293 1.00 51.35 C ATOM 2222 CG ASP A 255 127.453 25.796 156.613 1.00 54.04 C ATOM 2223 OD1 ASP A 255 126.349 25.193 156.629 1.00 53.05 O ATOM 2224 OD2 ASP A 255 128.160 25.925 157.649 1.00 55.62 O ATOM 2225 H ASP A 255 125.395 26.883 155.202 1.00 0.00 H ATOM 2226 N GLY A 256 125.742 24.037 153.730 1.00 50.11 N ATOM 2227 CA GLY A 256 125.522 22.609 153.614 1.00 48.61 C ATOM 2228 C GLY A 256 125.436 21.817 154.924 1.00 48.16 C ATOM 2229 O GLY A 256 125.117 20.633 154.876 1.00 51.34 O ATOM 2230 H GLY A 256 124.916 24.669 153.710 1.00 0.00 H ATOM 2231 N ARG A 257 125.611 22.442 156.090 1.00 46.21 N ATOM 2232 CA ARG A 257 125.601 21.713 157.347 1.00 49.72 C ATOM 2233 C ARG A 257 124.195 21.592 157.912 1.00 49.52 C ATOM 2234 O ARG A 257 123.303 22.377 157.572 1.00 53.82 O ATOM 2235 CB ARG A 257 126.535 22.385 158.357 1.00 53.64 C ATOM 2236 CG ARG A 257 127.999 22.115 158.039 1.00 57.42 C ATOM 2237 CD ARG A 257 128.879 22.294 159.251 1.00 50.28 C ATOM 2238 NE ARG A 257 128.841 23.685 159.607 1.00 59.86 N ATOM 2239 CZ ARG A 257 129.153 24.170 160.796 1.00 61.54 C ATOM 2240 NH1 ARG A 257 129.539 23.351 161.776 1.00 59.11 N ATOM 2241 NH2 ARG A 257 129.057 25.483 160.989 1.00 56.90 N ATOM 2242 HE ARG A 257 128.546 24.361 158.874 1.00 0.00 H ATOM 2243 HH12 ARG A 257 129.784 23.737 162.710 1.00 0.00 H ATOM 2244 HH11 ARG A 257 129.595 22.327 161.606 1.00 0.00 H ATOM 2245 HH22 ARG A 257 129.296 25.891 161.915 1.00 0.00 H ATOM 2246 HH21 ARG A 257 128.743 26.101 160.214 1.00 0.00 H ATOM 2247 H ARG A 257 125.757 23.472 156.099 1.00 0.00 H ATOM 2248 N PRO A 258 123.946 20.574 158.742 1.00 52.74 N ATOM 2249 CA PRO A 258 122.583 20.328 159.232 1.00 50.91 C ATOM 2250 C PRO A 258 122.267 21.085 160.509 1.00 52.39 C ATOM 2251 O PRO A 258 123.117 21.261 161.385 1.00 55.02 O ATOM 2252 CB PRO A 258 122.586 18.816 159.479 1.00 56.59 C ATOM 2253 CG PRO A 258 123.971 18.513 159.848 1.00 52.99 C ATOM 2254 CD PRO A 258 124.875 19.520 159.182 1.00 51.71 C ATOM 2255 N LEU A 259 121.030 21.584 160.587 1.00 46.42 N ATOM 2256 CA LEU A 259 120.490 22.169 161.810 1.00 43.65 C ATOM 2257 C LEU A 259 119.233 21.396 162.156 1.00 46.35 C ATOM 2258 O LEU A 259 118.233 21.509 161.449 1.00 46.46 O ATOM 2259 CB LEU A 259 120.189 23.661 161.630 1.00 43.87 C ATOM 2260 CG LEU A 259 119.259 24.318 162.673 1.00 43.86 C ATOM 2261 CD1 LEU A 259 119.827 24.286 164.092 1.00 41.73 C ATOM 2262 CD2 LEU A 259 118.851 25.741 162.299 1.00 41.82 C ATOM 2263 H LEU A 259 120.427 21.554 159.740 1.00 0.00 H ATOM 2264 N LEU A 260 119.274 20.623 163.246 1.00 49.01 N ATOM 2265 CA LEU A 260 118.137 19.817 163.685 1.00 44.49 C ATOM 2266 C LEU A 260 117.216 20.654 164.565 1.00 48.46 C ATOM 2267 O LEU A 260 117.680 21.345 165.475 1.00 49.32 O ATOM 2268 CB LEU A 260 118.582 18.615 164.497 1.00 53.07 C ATOM 2269 CG LEU A 260 119.745 17.745 164.051 1.00 57.05 C ATOM 2270 CD1 LEU A 260 119.867 16.631 165.081 1.00 50.60 C ATOM 2271 CD2 LEU A 260 119.594 17.252 162.608 1.00 48.33 C ATOM 2272 H LEU A 260 120.151 20.594 163.804 1.00 0.00 H ATOM 2273 N VAL A 261 115.926 20.635 164.251 1.00 45.74 N ATOM 2274 CA VAL A 261 114.887 21.344 164.988 1.00 43.35 C ATOM 2275 C VAL A 261 113.667 20.432 165.051 1.00 46.07 C ATOM 2276 O VAL A 261 113.198 19.953 164.011 1.00 44.17 O ATOM 2277 CB VAL A 261 114.492 22.685 164.320 1.00 44.84 C ATOM 2278 CG1 VAL A 261 113.367 23.338 165.080 1.00 39.91 C ATOM 2279 CG2 VAL A 261 115.677 23.640 164.188 1.00 39.59 C ATOM 2280 H VAL A 261 115.637 20.076 163.423 1.00 0.00 H ATOM 2281 N ALA A 262 113.152 20.203 166.255 1.00 42.85 N ATOM 2282 CA ALA A 262 111.875 19.550 166.468 1.00 37.64 C ATOM 2283 C ALA A 262 111.038 20.449 167.369 1.00 43.93 C ATOM 2284 O ALA A 262 111.533 20.979 168.381 1.00 38.76 O ATOM 2285 CB ALA A 262 112.033 18.181 167.109 1.00 39.08 C ATOM 2286 H ALA A 262 113.694 20.508 167.088 1.00 0.00 H ATOM 2287 N VAL A 263 109.772 20.632 166.996 1.00 40.99 N ATOM 2288 CA VAL A 263 108.830 21.389 167.804 1.00 42.73 C ATOM 2289 C VAL A 263 107.545 20.582 167.897 1.00 41.50 C ATOM 2290 O VAL A 263 106.969 20.208 166.871 1.00 47.39 O ATOM 2291 CB VAL A 263 108.548 22.790 167.234 1.00 40.01 C ATOM 2292 CG1 VAL A 263 107.781 23.586 168.259 1.00 42.49 C ATOM 2293 CG2 VAL A 263 109.830 23.516 166.830 1.00 39.89 C ATOM 2294 H VAL A 263 109.447 20.220 166.098 1.00 0.00 H ATOM 2295 N PHE A 264 107.107 20.311 169.122 1.00 42.29 N ATOM 2296 CA PHE A 264 105.889 19.559 169.418 1.00 45.42 C ATOM 2297 C PHE A 264 105.004 20.452 170.275 1.00 45.18 C ATOM 2298 O PHE A 264 105.318 20.692 171.447 1.00 45.85 O ATOM 2299 CB PHE A 264 106.187 18.227 170.159 1.00 41.81 C ATOM 2300 CG PHE A 264 106.968 17.174 169.322 1.00 43.53 C ATOM 2301 CD1 PHE A 264 108.291 17.380 168.922 1.00 50.33 C ATOM 2302 CD2 PHE A 264 106.374 15.981 168.959 1.00 47.50 C ATOM 2303 CE1 PHE A 264 109.009 16.410 168.164 1.00 43.47 C ATOM 2304 CE2 PHE A 264 107.075 15.007 168.195 1.00 47.90 C ATOM 2305 CZ PHE A 264 108.394 15.236 167.794 1.00 39.84 C ATOM 2306 H PHE A 264 107.669 20.658 169.925 1.00 0.00 H ATOM 2307 N VAL A 265 103.889 20.911 169.708 1.00 40.27 N ATOM 2308 CA VAL A 265 102.913 21.731 170.420 1.00 37.74 C ATOM 2309 C VAL A 265 101.822 20.812 170.947 1.00 45.80 C ATOM 2310 O VAL A 265 100.983 20.325 170.177 1.00 43.00 O ATOM 2311 CB VAL A 265 102.302 22.806 169.521 1.00 42.86 C ATOM 2312 CG1 VAL A 265 101.304 23.663 170.363 1.00 39.73 C ATOM 2313 CG2 VAL A 265 103.403 23.641 168.822 1.00 38.10 C ATOM 2314 H VAL A 265 103.705 20.674 168.712 1.00 0.00 H ATOM 2315 N LYS A 266 101.794 20.633 172.268 1.00 44.79 N ATOM 2316 CA LYS A 266 100.951 19.647 172.911 1.00 42.79 C ATOM 2317 C LYS A 266 99.793 20.319 173.636 1.00 45.33 C ATOM 2318 O LYS A 266 99.976 21.357 174.278 1.00 43.55 O ATOM 2319 CB LYS A 266 101.780 18.807 173.885 1.00 44.26 C ATOM 2320 CG LYS A 266 100.999 17.762 174.638 1.00 41.92 C ATOM 2321 CD LYS A 266 101.900 17.066 175.645 1.00 45.72 C ATOM 2322 CE LYS A 266 101.144 15.963 176.388 1.00 48.75 C ATOM 2323 NZ LYS A 266 102.011 15.349 177.424 1.00 50.56 N ATOM 2324 HZ1 LYS A 266 102.852 14.938 176.971 1.00 0.00 H ATOM 2325 HZ2 LYS A 266 102.304 16.078 178.106 1.00 0.00 H ATOM 2326 HZ3 LYS A 266 101.482 14.602 177.919 1.00 0.00 H ATOM 2327 H LYS A 266 102.405 21.228 172.863 1.00 0.00 H ATOM 2328 N ASP A 267 98.599 19.733 173.492 1.00 46.92 N ATOM 2329 CA ASP A 267 97.381 20.127 174.203 1.00 48.01 C ATOM 2330 C ASP A 267 97.207 21.645 174.174 1.00 46.91 C ATOM 2331 O ASP A 267 97.248 22.340 175.193 1.00 46.31 O ATOM 2332 CB ASP A 267 97.363 19.574 175.635 1.00 42.56 C ATOM 2333 CG ASP A 267 97.240 18.060 175.668 1.00 50.27 C ATOM 2334 OD1 ASP A 267 96.643 17.501 174.728 1.00 52.71 O ATOM 2335 OD2 ASP A 267 97.712 17.414 176.629 1.00 58.91 O ATOM 2336 H ASP A 267 98.531 18.938 172.825 1.00 0.00 H ATOM 2337 N SER A 268 97.013 22.139 172.965 1.00 43.37 N ATOM 2338 CA SER A 268 96.951 23.560 172.706 1.00 44.53 C ATOM 2339 C SER A 268 95.518 24.032 172.624 1.00 45.24 C ATOM 2340 O SER A 268 94.676 23.397 171.982 1.00 49.78 O ATOM 2341 CB SER A 268 97.649 23.922 171.396 1.00 41.49 C ATOM 2342 OG SER A 268 97.529 25.303 171.212 1.00 38.54 O ATOM 2343 HG SER A 268 97.975 25.562 170.367 1.00 0.00 H ATOM 2344 H SER A 268 96.900 21.480 172.168 1.00 0.00 H ATOM 2345 N ALA A 269 95.255 25.166 173.255 1.00 41.65 N ATOM 2346 CA ALA A 269 94.013 25.889 173.053 1.00 43.04 C ATOM 2347 C ALA A 269 94.161 27.016 172.032 1.00 44.29 C ATOM 2348 O ALA A 269 93.193 27.744 171.782 1.00 53.91 O ATOM 2349 CB ALA A 269 93.530 26.460 174.387 1.00 41.03 C ATOM 2350 H ALA A 269 95.960 25.550 173.916 1.00 0.00 H ATOM 2351 N GLU A 270 95.336 27.181 171.431 1.00 44.33 N ATOM 2352 CA GLU A 270 95.487 28.233 170.432 1.00 42.82 C ATOM 2353 C GLU A 270 94.904 27.757 169.108 1.00 50.32 C ATOM 2354 O GLU A 270 94.587 26.577 168.921 1.00 50.66 O ATOM 2355 CB GLU A 270 96.959 28.607 170.231 1.00 39.99 C ATOM 2356 CG GLU A 270 97.686 28.975 171.560 1.00 43.86 C ATOM 2357 CD GLU A 270 97.307 30.350 172.088 1.00 45.53 C ATOM 2358 OE1 GLU A 270 96.699 31.137 171.324 1.00 42.83 O ATOM 2359 OE2 GLU A 270 97.572 30.615 173.288 1.00 48.84 O ATOM 2360 H GLU A 270 96.139 26.566 171.671 1.00 0.00 H ATOM 2361 N SER A 271 94.757 28.697 168.186 1.00 48.39 N ATOM 2362 CA SER A 271 94.317 28.370 166.855 1.00 42.99 C ATOM 2363 C SER A 271 95.413 27.585 166.145 1.00 46.14 C ATOM 2364 O SER A 271 96.586 27.571 166.568 1.00 45.24 O ATOM 2365 CB SER A 271 94.006 29.640 166.079 1.00 37.57 C ATOM 2366 OG SER A 271 95.236 30.271 165.813 1.00 42.98 O ATOM 2367 HG SER A 271 95.688 30.484 166.668 1.00 0.00 H ATOM 2368 H SER A 271 94.963 29.687 168.428 1.00 0.00 H ATOM 2369 N GLU A 272 95.026 26.930 165.046 1.00 43.57 N ATOM 2370 CA GLU A 272 96.010 26.162 164.289 1.00 45.04 C ATOM 2371 C GLU A 272 97.080 27.079 163.741 1.00 39.18 C ATOM 2372 O GLU A 272 98.268 26.727 163.705 1.00 45.63 O ATOM 2373 CB GLU A 272 95.349 25.378 163.146 1.00 44.82 C ATOM 2374 CG GLU A 272 96.387 24.688 162.223 1.00 53.78 C ATOM 2375 CD GLU A 272 95.818 24.152 160.907 1.00 62.31 C ATOM 2376 OE1 GLU A 272 94.996 24.844 160.264 1.00 67.57 O ATOM 2377 OE2 GLU A 272 96.207 23.033 160.501 1.00 70.29 O ATOM 2378 H GLU A 272 94.035 26.967 164.734 1.00 0.00 H ATOM 2379 N ARG A 273 96.674 28.268 163.323 1.00 41.63 N ATOM 2380 CA ARG A 273 97.599 29.246 162.759 1.00 42.30 C ATOM 2381 C ARG A 273 98.630 29.684 163.788 1.00 43.72 C ATOM 2382 O ARG A 273 99.794 29.920 163.449 1.00 47.86 O ATOM 2383 CB ARG A 273 96.791 30.424 162.230 1.00 47.59 C ATOM 2384 CG ARG A 273 97.565 31.481 161.514 1.00 59.98 C ATOM 2385 CD ARG A 273 96.637 32.325 160.654 1.00 57.33 C ATOM 2386 NE ARG A 273 97.334 33.469 160.077 1.00 60.14 N ATOM 2387 CZ ARG A 273 96.955 34.061 158.942 1.00 67.96 C ATOM 2388 NH1 ARG A 273 95.904 33.573 158.282 1.00 59.53 N ATOM 2389 NH2 ARG A 273 97.620 35.127 158.458 1.00 66.47 N ATOM 2390 HE ARG A 273 98.168 33.842 160.574 1.00 0.00 H ATOM 2391 HH12 ARG A 273 95.593 34.020 157.396 1.00 0.00 H ATOM 2392 HH11 ARG A 273 95.395 32.745 158.653 1.00 0.00 H ATOM 2393 HH22 ARG A 273 97.310 35.575 157.572 1.00 0.00 H ATOM 2394 HH21 ARG A 273 98.444 35.502 158.970 1.00 0.00 H ATOM 2395 H ARG A 273 95.666 28.512 163.399 1.00 0.00 H ATOM 2396 N THR A 274 98.223 29.789 165.048 1.00 41.26 N ATOM 2397 CA THR A 274 99.166 30.096 166.120 1.00 42.45 C ATOM 2398 C THR A 274 100.059 28.891 166.417 1.00 44.82 C ATOM 2399 O THR A 274 101.275 29.054 166.594 1.00 40.60 O ATOM 2400 CB THR A 274 98.411 30.483 167.390 1.00 39.63 C ATOM 2401 OG1 THR A 274 97.725 31.707 167.195 1.00 45.74 O ATOM 2402 CG2 THR A 274 99.329 30.621 168.562 1.00 42.54 C ATOM 2403 HG1 THR A 274 97.080 31.607 166.451 1.00 0.00 H ATOM 2404 H THR A 274 97.217 29.650 165.275 1.00 0.00 H ATOM 2405 N ASN A 275 99.480 27.673 166.482 1.00 36.71 N ATOM 2406 CA ASN A 275 100.327 26.501 166.736 1.00 43.03 C ATOM 2407 C ASN A 275 101.426 26.373 165.675 1.00 41.84 C ATOM 2408 O ASN A 275 102.577 26.066 165.992 1.00 45.69 O ATOM 2409 CB ASN A 275 99.506 25.206 166.793 1.00 36.63 C ATOM 2410 CG ASN A 275 98.465 25.218 167.885 1.00 41.65 C ATOM 2411 OD1 ASN A 275 98.622 25.876 168.939 1.00 46.89 O ATOM 2412 ND2 ASN A 275 97.386 24.484 167.658 1.00 42.02 N ATOM 2413 HD22 ASN A 275 97.296 23.953 166.768 1.00 0.00 H ATOM 2414 HD21 ASN A 275 96.629 24.439 168.369 1.00 0.00 H ATOM 2415 H ASN A 275 98.453 27.567 166.355 1.00 0.00 H ATOM 2416 N GLU A 276 101.100 26.606 164.413 1.00 40.94 N ATOM 2417 CA GLU A 276 102.130 26.454 163.386 1.00 46.44 C ATOM 2418 C GLU A 276 103.112 27.612 163.416 1.00 40.30 C ATOM 2419 O GLU A 276 104.302 27.445 163.104 1.00 41.13 O ATOM 2420 CB GLU A 276 101.498 26.346 162.005 1.00 44.46 C ATOM 2421 CG GLU A 276 100.566 25.137 161.915 1.00 50.95 C ATOM 2422 CD GLU A 276 100.178 24.837 160.471 1.00 53.67 C ATOM 2423 OE1 GLU A 276 99.653 25.750 159.777 1.00 41.38 O ATOM 2424 OE2 GLU A 276 100.445 23.676 160.045 1.00 51.55 O ATOM 2425 H GLU A 276 100.133 26.891 164.158 1.00 0.00 H ATOM 2426 N ALA A 277 102.614 28.805 163.729 1.00 43.33 N ATOM 2427 CA ALA A 277 103.487 29.955 163.873 1.00 35.74 C ATOM 2428 C ALA A 277 104.489 29.714 164.982 1.00 38.31 C ATOM 2429 O ALA A 277 105.652 30.121 164.873 1.00 41.58 O ATOM 2430 CB ALA A 277 102.640 31.210 164.144 1.00 31.18 C ATOM 2431 H ALA A 277 101.590 28.915 163.872 1.00 0.00 H ATOM 2432 N ILE A 278 104.087 29.003 166.035 1.00 42.26 N ATOM 2433 CA ILE A 278 105.040 28.723 167.104 1.00 42.71 C ATOM 2434 C ILE A 278 106.160 27.856 166.574 1.00 43.34 C ATOM 2435 O ILE A 278 107.346 28.182 166.728 1.00 44.57 O ATOM 2436 CB ILE A 278 104.341 28.078 168.315 1.00 45.36 C ATOM 2437 CG1 ILE A 278 103.571 29.137 169.111 1.00 41.68 C ATOM 2438 CG2 ILE A 278 105.341 27.234 169.170 1.00 37.52 C ATOM 2439 CD1 ILE A 278 102.593 28.496 170.092 1.00 39.17 C ATOM 2440 H ILE A 278 103.109 28.653 166.094 1.00 0.00 H ATOM 2441 N ILE A 279 105.797 26.810 165.829 1.00 42.02 N ATOM 2442 CA ILE A 279 106.816 25.955 165.236 1.00 43.25 C ATOM 2443 C ILE A 279 107.704 26.772 164.327 1.00 39.36 C ATOM 2444 O ILE A 279 108.938 26.705 164.406 1.00 41.31 O ATOM 2445 CB ILE A 279 106.172 24.790 164.468 1.00 43.29 C ATOM 2446 CG1 ILE A 279 105.333 23.943 165.414 1.00 37.61 C ATOM 2447 CG2 ILE A 279 107.254 23.975 163.737 1.00 41.90 C ATOM 2448 CD1 ILE A 279 104.520 22.946 164.704 1.00 37.17 C ATOM 2449 H ILE A 279 104.789 26.606 165.672 1.00 0.00 H ATOM 2450 N ALA A 280 107.086 27.574 163.470 1.00 36.94 N ATOM 2451 CA ALA A 280 107.855 28.309 162.487 1.00 41.10 C ATOM 2452 C ALA A 280 108.815 29.269 163.166 1.00 41.42 C ATOM 2453 O ALA A 280 109.969 29.405 162.743 1.00 44.82 O ATOM 2454 CB ALA A 280 106.913 29.065 161.535 1.00 39.16 C ATOM 2455 H ALA A 280 106.051 27.675 163.504 1.00 0.00 H ATOM 2456 N GLN A 281 108.358 29.935 164.227 1.00 39.58 N ATOM 2457 CA GLN A 281 109.177 30.969 164.857 1.00 44.42 C ATOM 2458 C GLN A 281 110.384 30.365 165.546 1.00 44.29 C ATOM 2459 O GLN A 281 111.458 30.963 165.530 1.00 42.03 O ATOM 2460 CB GLN A 281 108.368 31.759 165.876 1.00 42.64 C ATOM 2461 CG GLN A 281 107.339 32.706 165.333 1.00 36.66 C ATOM 2462 CD GLN A 281 106.507 33.237 166.468 1.00 43.35 C ATOM 2463 OE1 GLN A 281 106.899 34.212 167.129 1.00 40.32 O ATOM 2464 NE2 GLN A 281 105.369 32.587 166.729 1.00 37.45 N ATOM 2465 HE22 GLN A 281 105.088 31.775 166.143 1.00 0.00 H ATOM 2466 HE21 GLN A 281 104.765 32.893 167.518 1.00 0.00 H ATOM 2467 H GLN A 281 107.415 29.718 164.608 1.00 0.00 H ATOM 2468 N VAL A 282 110.229 29.183 166.164 1.00 41.59 N ATOM 2469 CA VAL A 282 111.386 28.542 166.775 1.00 43.20 C ATOM 2470 C VAL A 282 112.406 28.195 165.699 1.00 44.98 C ATOM 2471 O VAL A 282 113.599 28.503 165.819 1.00 45.24 O ATOM 2472 CB VAL A 282 110.972 27.279 167.549 1.00 40.80 C ATOM 2473 CG1 VAL A 282 112.227 26.488 167.972 1.00 37.77 C ATOM 2474 CG2 VAL A 282 110.120 27.609 168.720 1.00 40.14 C ATOM 2475 H VAL A 282 109.294 28.730 166.206 1.00 0.00 H ATOM 2476 N ALA A 283 111.942 27.577 164.614 1.00 43.64 N ATOM 2477 CA ALA A 283 112.860 27.171 163.547 1.00 41.46 C ATOM 2478 C ALA A 283 113.587 28.370 162.975 1.00 43.95 C ATOM 2479 O ALA A 283 114.785 28.294 162.697 1.00 46.18 O ATOM 2480 CB ALA A 283 112.104 26.428 162.449 1.00 42.44 C ATOM 2481 H ALA A 283 110.924 27.382 164.524 1.00 0.00 H ATOM 2482 N GLN A 284 112.879 29.489 162.796 1.00 45.92 N ATOM 2483 CA GLN A 284 113.513 30.719 162.307 1.00 48.74 C ATOM 2484 C GLN A 284 114.583 31.239 163.278 1.00 47.06 C ATOM 2485 O GLN A 284 115.647 31.711 162.857 1.00 49.15 O ATOM 2486 CB GLN A 284 112.462 31.803 162.076 1.00 39.81 C ATOM 2487 CG GLN A 284 113.060 33.202 161.916 1.00 47.58 C ATOM 2488 CD GLN A 284 111.989 34.284 161.725 1.00 46.06 C ATOM 2489 OE1 GLN A 284 111.661 34.681 160.617 1.00 42.74 O ATOM 2490 NE2 GLN A 284 111.380 34.684 162.825 1.00 46.37 N ATOM 2491 HE22 GLN A 284 111.688 34.323 163.751 1.00 0.00 H ATOM 2492 HE21 GLN A 284 110.592 35.360 162.767 1.00 0.00 H ATOM 2493 H GLN A 284 111.861 29.488 163.007 1.00 0.00 H ATOM 2494 N ALA A 285 114.305 31.207 164.577 1.00 52.27 N ATOM 2495 CA ALA A 285 115.260 31.752 165.549 1.00 51.63 C ATOM 2496 C ALA A 285 116.542 30.929 165.561 1.00 48.02 C ATOM 2497 O ALA A 285 117.654 31.482 165.545 1.00 48.57 O ATOM 2498 CB ALA A 285 114.613 31.785 166.938 1.00 43.25 C ATOM 2499 H ALA A 285 113.409 30.795 164.906 1.00 0.00 H ATOM 2500 N ALA A 286 116.390 29.603 165.541 1.00 46.57 N ATOM 2501 CA ALA A 286 117.528 28.693 165.467 1.00 45.18 C ATOM 2502 C ALA A 286 118.275 28.894 164.169 1.00 46.08 C ATOM 2503 O ALA A 286 119.510 28.889 164.134 1.00 52.67 O ATOM 2504 CB ALA A 286 117.032 27.240 165.572 1.00 40.41 C ATOM 2505 H ALA A 286 115.430 29.206 165.579 1.00 0.00 H ATOM 2506 N TYR A 287 117.535 29.084 163.093 1.00 43.13 N ATOM 2507 CA TYR A 287 118.147 29.287 161.798 1.00 46.77 C ATOM 2508 C TYR A 287 118.978 30.556 161.792 1.00 50.19 C ATOM 2509 O TYR A 287 120.161 30.549 161.415 1.00 49.72 O ATOM 2510 CB TYR A 287 117.047 29.365 160.748 1.00 44.62 C ATOM 2511 CG TYR A 287 117.515 29.435 159.354 1.00 41.70 C ATOM 2512 CD1 TYR A 287 118.072 28.321 158.742 1.00 44.43 C ATOM 2513 CD2 TYR A 287 117.355 30.588 158.616 1.00 46.12 C ATOM 2514 CE1 TYR A 287 118.485 28.354 157.399 1.00 43.25 C ATOM 2515 CE2 TYR A 287 117.750 30.637 157.295 1.00 48.81 C ATOM 2516 CZ TYR A 287 118.319 29.519 156.690 1.00 44.02 C ATOM 2517 OH TYR A 287 118.725 29.584 155.374 1.00 46.60 O ATOM 2518 HH TYR A 287 119.104 28.710 155.103 1.00 0.00 H ATOM 2519 H TYR A 287 116.498 29.088 163.177 1.00 0.00 H ATOM 2520 N GLN A 288 118.366 31.668 162.204 1.00 51.24 N ATOM 2521 CA GLN A 288 119.073 32.938 162.146 1.00 51.14 C ATOM 2522 C GLN A 288 120.218 32.959 163.138 1.00 53.08 C ATOM 2523 O GLN A 288 121.245 33.598 162.881 1.00 55.53 O ATOM 2524 CB GLN A 288 118.112 34.095 162.395 1.00 50.68 C ATOM 2525 CG GLN A 288 117.065 34.244 161.317 1.00 51.42 C ATOM 2526 CD GLN A 288 117.670 34.590 159.965 1.00 51.47 C ATOM 2527 OE1 GLN A 288 118.789 35.108 159.883 1.00 58.55 O ATOM 2528 NE2 GLN A 288 116.921 34.331 158.895 1.00 54.00 N ATOM 2529 HE22 GLN A 288 115.984 33.894 159.009 1.00 0.00 H ATOM 2530 HE21 GLN A 288 117.273 34.566 157.945 1.00 0.00 H ATOM 2531 H GLN A 288 117.391 31.627 162.564 1.00 0.00 H ATOM 2532 N PHE A 289 120.089 32.232 164.248 1.00 48.98 N ATOM 2533 CA PHE A 289 121.234 32.100 165.145 1.00 53.69 C ATOM 2534 C PHE A 289 122.444 31.509 164.422 1.00 57.98 C ATOM 2535 O PHE A 289 123.576 31.966 164.618 1.00 59.23 O ATOM 2536 CB PHE A 289 120.851 31.244 166.340 1.00 57.61 C ATOM 2537 CG PHE A 289 122.025 30.787 167.165 1.00 64.86 C ATOM 2538 CD1 PHE A 289 122.571 31.622 168.144 1.00 61.43 C ATOM 2539 CD2 PHE A 289 122.565 29.512 166.979 1.00 62.63 C ATOM 2540 CE1 PHE A 289 123.633 31.199 168.911 1.00 70.23 C ATOM 2541 CE2 PHE A 289 123.639 29.074 167.748 1.00 69.10 C ATOM 2542 CZ PHE A 289 124.169 29.917 168.717 1.00 79.23 C ATOM 2543 H PHE A 289 119.187 31.766 164.472 1.00 0.00 H ATOM 2544 N GLU A 290 122.223 30.470 163.611 1.00 51.88 N ATOM 2545 CA GLU A 290 123.287 29.834 162.846 1.00 47.49 C ATOM 2546 C GLU A 290 123.752 30.694 161.686 1.00 53.97 C ATOM 2547 O GLU A 290 124.913 30.591 161.294 1.00 61.24 O ATOM 2548 CB GLU A 290 122.822 28.485 162.288 1.00 48.66 C ATOM 2549 CG GLU A 290 122.521 27.434 163.330 1.00 51.63 C ATOM 2550 CD GLU A 290 123.758 26.955 164.062 1.00 57.69 C ATOM 2551 OE1 GLU A 290 124.883 27.112 163.526 1.00 63.50 O ATOM 2552 OE2 GLU A 290 123.606 26.405 165.169 1.00 53.75 O ATOM 2553 H GLU A 290 121.254 30.102 163.523 1.00 0.00 H ATOM 2554 N LEU A 291 122.857 31.477 161.061 1.00 53.67 N ATOM 2555 CA LEU A 291 123.287 32.281 159.916 1.00 57.24 C ATOM 2556 C LEU A 291 124.275 33.371 160.287 1.00 60.08 C ATOM 2557 O LEU A 291 125.076 33.780 159.436 1.00 65.36 O ATOM 2558 CB LEU A 291 122.103 32.907 159.161 1.00 48.04 C ATOM 2559 CG LEU A 291 121.713 32.165 157.876 1.00 56.53 C ATOM 2560 CD1 LEU A 291 121.424 30.663 158.064 1.00 48.88 C ATOM 2561 CD2 LEU A 291 120.574 32.871 157.142 1.00 53.75 C ATOM 2562 H LEU A 291 121.870 31.511 161.387 1.00 0.00 H ATOM 2563 N LYS A 292 124.231 33.890 161.508 1.00 60.08 N ATOM 2564 CA LYS A 292 125.130 35.012 161.779 1.00 65.64 C ATOM 2565 C LYS A 292 126.560 34.544 161.957 1.00 59.95 C ATOM 2566 O LYS A 292 127.492 35.320 161.754 1.00 62.90 O ATOM 2567 CB LYS A 292 124.667 35.794 162.992 1.00 66.73 C ATOM 2568 CG LYS A 292 124.002 34.941 163.999 1.00 71.24 C ATOM 2569 CD LYS A 292 123.242 35.793 165.013 1.00 76.27 C ATOM 2570 CE LYS A 292 123.352 35.155 166.399 1.00 82.13 C ATOM 2571 NZ LYS A 292 122.395 35.760 167.350 1.00 79.69 N ATOM 2572 HZ1 LYS A 292 122.592 36.777 167.438 1.00 0.00 H ATOM 2573 HZ2 LYS A 292 121.426 35.623 166.999 1.00 0.00 H ATOM 2574 HZ3 LYS A 292 122.497 35.304 168.279 1.00 0.00 H ATOM 2575 H LYS A 292 123.589 33.517 162.236 1.00 0.00 H ATOM 2576 N LYS A 293 126.746 33.268 162.258 1.00 65.50 N ATOM 2577 CA LYS A 293 128.053 32.637 162.299 1.00 66.14 C ATOM 2578 C LYS A 293 128.740 32.527 160.924 1.00 64.63 C ATOM 2579 O LYS A 293 129.842 31.986 160.897 1.00 67.77 O ATOM 2580 CB LYS A 293 127.910 31.265 162.965 1.00 59.59 C ATOM 2581 CG LYS A 293 127.753 31.383 164.474 1.00 61.12 C ATOM 2582 CD LYS A 293 127.084 30.176 165.145 1.00 65.72 C ATOM 2583 CE LYS A 293 127.683 28.870 164.721 1.00 61.86 C ATOM 2584 NZ LYS A 293 127.106 27.764 165.510 1.00 64.34 N ATOM 2585 HZ1 LYS A 293 127.305 27.919 166.519 1.00 0.00 H ATOM 2586 HZ2 LYS A 293 126.077 27.732 165.359 1.00 0.00 H ATOM 2587 HZ3 LYS A 293 127.530 26.865 165.206 1.00 0.00 H ATOM 2588 H LYS A 293 125.912 32.687 162.477 1.00 0.00 H ATOM 2589 N LEU A 294 128.170 33.006 159.820 1.00 64.30 N ATOM 2590 CA LEU A 294 128.804 32.833 158.506 1.00 64.88 C ATOM 2591 C LEU A 294 128.388 33.967 157.563 1.00 74.05 C ATOM 2592 O LEU A 294 127.935 35.031 157.997 1.00 78.66 O ATOM 2593 CB LEU A 294 128.455 31.453 157.930 1.00 71.31 C ATOM 2594 CG LEU A 294 127.004 30.975 158.065 1.00 69.00 C ATOM 2595 CD1 LEU A 294 126.066 31.783 157.202 1.00 74.35 C ATOM 2596 CD2 LEU A 294 126.876 29.534 157.697 1.00 61.17 C ATOM 2597 H LEU A 294 127.263 33.510 159.889 1.00 0.00 H ATOM 2598 N SER A 295 128.584 33.743 156.264 1.00 80.13 N ATOM 2599 CA SER A 295 128.028 34.590 155.207 1.00 76.72 C ATOM 2600 C SER A 295 128.014 33.801 153.894 1.00 88.09 C ATOM 2601 O SER A 295 129.000 33.140 153.543 1.00 83.88 O ATOM 2602 CB SER A 295 128.830 35.866 155.025 1.00 73.84 C ATOM 2603 OG SER A 295 129.785 35.706 153.980 1.00 79.50 O ATOM 2604 HG SER A 295 130.402 34.966 154.209 1.00 0.00 H ATOM 2605 H SER A 295 129.162 32.924 155.987 1.00 0.00 H TER 2606 SER A 295 HETATM 2607 O HOH 1 93.117 16.961 170.083 1.00 50.39 O HETATM 2608 O HOH 2 125.516 25.146 166.290 1.00 57.26 O HETATM 2609 O HOH 3 97.157 22.929 165.227 1.00 43.71 O HETATM 2610 O HOH 4 114.020 15.624 177.005 1.00 52.14 O HETATM 2611 O HOH 5 104.102 34.102 173.218 1.00 50.28 O HETATM 2612 O HOH 6 128.752 21.450 153.210 1.00 54.82 O HETATM 2613 O HOH 7 105.451 15.016 156.758 1.00 40.79 O HETATM 2614 O HOH 8 98.624 21.208 169.319 1.00 42.58 O HETATM 2615 O HOH 9 101.877 11.767 175.927 1.00 51.77 O HETATM 2616 O HOH 10 100.571 9.666 168.534 1.00 47.29 O HETATM 2617 O HOH 11 106.970 5.004 157.601 1.00 46.73 O HETATM 2618 O HOH 12 110.555 16.439 176.343 1.00 46.11 O HETATM 2619 O HOH 13 114.460 33.217 158.525 1.00 47.61 O HETATM 2620 O HOH 14 102.992 16.578 170.509 1.00 38.73 O HETATM 2621 O HOH 15 110.205 28.761 160.094 1.00 40.54 O HETATM 2622 O HOH 16 126.551 25.039 150.556 1.00 55.17 O HETATM 2623 O HOH 17 126.217 15.374 160.554 1.00 55.91 O HETATM 2624 O HOH 18 97.710 33.187 174.372 1.00 52.24 O HETATM 2625 O HOH 19 111.993 10.266 168.850 1.00 41.06 O HETATM 2626 O HOH 20 105.275 25.661 176.589 1.00 47.56 O HETATM 2627 O HOH 21 102.144 8.167 166.820 1.00 43.13 O HETATM 2628 O HOH 22 109.278 19.583 181.126 1.00 55.67 O HETATM 2629 O HOH 23 99.840 28.520 179.415 1.00 54.75 O HETATM 2630 O HOH 24 115.290 4.535 184.946 1.00 61.03 O HETATM 2631 O HOH 25 90.875 28.155 169.368 1.00 57.60 O HETATM 2632 O HOH 26 128.873 23.612 172.672 1.00 55.87 O HETATM 2633 OAC NXL A 27 99.809 12.909 162.099 1.00 -0.38 O HETATM 2634 CAN NXL A 27 99.632 12.413 160.968 1.00 0.17 C HETATM 2635 N NXL A 27 98.330 12.311 160.401 1.00 -0.25 N HETATM 2636 CAJ NXL A 27 98.078 11.773 159.096 1.00 0.08 C HETATM 2637 CAO NXL A 27 97.596 12.869 158.170 1.00 0.03 C HETATM 2638 CAH NXL A 27 96.424 13.644 158.786 1.00 -0.00 C HETATM 2639 CB NXL A 27 96.450 13.847 160.301 1.00 -0.01 C HETATM 2640 CA NXL A 27 97.186 12.783 161.116 1.00 0.13 C HETATM 2641 C NXL A 27 96.313 11.581 161.545 1.00 0.20 C HETATM 2642 O NXL A 27 96.726 10.432 161.467 1.00 -0.39 O HETATM 2643 NAA NXL A 27 95.015 11.755 162.061 1.00 -0.30 N HETATM 2644 H5 NXL A 27 94.473 10.959 162.330 1.00 0.18 H HETATM 2645 H6 NXL A 27 94.635 12.675 162.158 1.00 0.18 H HETATM 2646 H4 NXL A 27 97.539 13.271 162.036 1.00 0.08 H HETATM 2647 H7 NXL A 27 96.933 14.815 160.501 1.00 0.03 H HETATM 2648 H8 NXL A 27 95.408 13.877 160.653 1.00 0.03 H HETATM 2649 H9 NXL A 27 96.401 14.639 158.318 1.00 0.03 H HETATM 2650 H10 NXL A 27 95.500 13.101 158.539 1.00 0.03 H HETATM 2651 NAK NXL A 27 98.671 13.794 157.834 1.00 0.41 N HETATM 2652 OAL NXL A 27 98.683 14.958 158.644 1.00 -0.20 O HETATM 2653 SAR NXL A 27 100.081 15.486 158.957 1.00 -0.03 S HETATM 2654 OAD NXL A 27 100.078 16.331 160.217 1.00 -0.46 O HETATM 2655 OAE NXL A 27 100.725 16.325 157.826 1.00 -0.46 O HETATM 2656 OAG NXL A 27 101.024 14.377 159.331 1.00 -0.46 O HETATM 2657 H12 NXL A 27 98.562 14.075 156.872 1.00 0.24 H HETATM 2658 H13 NXL A 27 99.551 13.316 157.947 1.00 0.24 H HETATM 2659 H11 NXL A 27 97.246 12.396 157.240 1.00 0.09 H HETATM 2660 H2 NXL A 27 97.308 10.991 159.167 1.00 0.06 H HETATM 2661 H3 NXL A 27 99.006 11.339 158.695 1.00 0.06 H HETATM 2662 H1 NXL A 27 100.490 12.051 160.404 1.00 0.15 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 2633 2634 CONECT 2634 2633 2635 2662 CONECT 2635 2634 2636 2640 CONECT 2636 2635 2637 2660 2661 CONECT 2637 2636 2638 2651 2659 CONECT 2638 2637 2639 2649 2650 CONECT 2639 2638 2640 2647 2648 CONECT 2640 2635 2639 2641 2646 CONECT 2641 2640 2642 2643 CONECT 2642 2641 CONECT 2643 2641 2644 2645 CONECT 2644 2643 CONECT 2645 2643 CONECT 2646 2640 CONECT 2647 2639 CONECT 2648 2639 CONECT 2649 2638 CONECT 2650 2638 CONECT 2651 2637 2652 2657 2658 CONECT 2652 2651 2653 CONECT 2653 2652 2654 2655 2656 CONECT 2654 2653 CONECT 2655 2653 CONECT 2656 2653 CONECT 2657 2651 CONECT 2658 2651 CONECT 2659 2637 CONECT 2660 2636 CONECT 2661 2636 CONECT 2662 2634 MASTER 0 0 0 0 0 0 0 0 2661 1 34 22 END
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Structure:
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Protein
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Related entries of code: 6d3g
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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PDBbind
NXL
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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NXL
Entry Information
PDB ID
6d3g
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Beta-lactamase
Ligand Name
NXL
EC.Number
E.C.-.-.-.-
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Ki=20uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Antimicrob.Agents Chemother. Vol. 63: pp. -
Ligand Properties
Formula
C
7
H
1
6
N
3
O
6
S
Molecular Weight
270.283
Exact Mass
270.076
No. of atoms
33
No. of bonds
33
Polar Surface Area
175.23
LOGP Value
-4.23 (
Computed with XLOGP3
)
-0.63 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 1
Canonical SMILES
O=CN1C[C@@H](CC[C@H]1C(=O)N)[NH2+]OS(O)(O)O
InChI String
InChI=1S/C7H15N3O6S/c8-7(12)6-2-1-5(3-10(6)4-11)9-16-17(13,14)15/h4-6,9,13-15H,1-3H2,(H2,8,12)/p+1/t5-,6+/m1/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):
A2RP81
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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