Browse entries in the PDBbind-CN Database
HEADER 5EVK_COMPLEX COMPND 5EVK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 266 GLU VAL PRO LEU PRO GLN LEU ARG ALA TYR THR VAL ASP SEQRES 2 A 266 ALA SER TRP LEU GLN PRO MET ALA PRO LEU GLN ILE ALA SEQRES 3 A 266 ASP HIS THR TRP GLN ILE GLY THR GLU ASP LEU THR ALA SEQRES 4 A 266 LEU LEU VAL GLN THR PRO ASP GLY ALA VAL LEU LEU ASP SEQRES 5 A 266 GLY GLY MET PRO GLN MET ALA SER HIS LEU LEU ASP ASN SEQRES 6 A 266 MET LYS ALA ARG GLY VAL THR PRO ARG ASP LEU ARG LEU SEQRES 7 A 266 ILE LEU LEU SER HIS ALA HIS ALA ASP HIS ALA GLY PRO SEQRES 8 A 266 VAL ALA GLU LEU LYS ARG ARG THR GLY ALA LYS VAL ALA SEQRES 9 A 266 ALA ASN ALA GLU SER ALA VAL LEU LEU ALA ARG GLY GLY SEQRES 10 A 266 SER ASP ASP LEU HIS PHE GLY ASP GLY ILE THR TYR PRO SEQRES 11 A 266 PRO ALA ASN ALA ASP ARG ILE VAL MET ASP GLY GLU VAL SEQRES 12 A 266 ILE THR VAL GLY GLY ILE VAL PHE THR ALA HIS PHE MET SEQRES 13 A 266 ALA GLY HIS THR PRO GLY SER THR ALA TRP THR TRP THR SEQRES 14 A 266 ASP THR ARG ASN GLY LYS PRO VAL ARG ILE ALA TYR ALA SEQRES 15 A 266 ASP SER LEU SER ALA PRO GLY TYR GLN LEU GLN GLY ASN SEQRES 16 A 266 PRO ARG TYR PRO HIS LEU ILE GLU ASP TYR ARG ARG SER SEQRES 17 A 266 PHE ALA THR VAL ARG ALA LEU PRO CYS ASP VAL LEU LEU SEQRES 18 A 266 THR PRO HIS PRO GLY ALA SER ASN TRP ASP TYR ALA ALA SEQRES 19 A 266 GLY ALA ARG ALA GLY ALA LYS ALA LEU THR CYS LYS ALA SEQRES 20 A 266 TYR ALA ASP ALA ALA GLU GLN LYS PHE ASP GLY GLN LEU SEQRES 21 A 266 ALA LYS GLU THR ALA GLY HET ZN A 1 1 HET ZN A 2 1 HET UNN A 602 24 SSBOND 1 CYS A 256 CYS A 296 ATOM 1 N GLU A 24 69.692 69.550 -5.457 1.00 62.78 N ATOM 2 CA GLU A 24 70.978 70.159 -5.725 1.00 62.36 C ATOM 3 C GLU A 24 71.033 71.485 -5.027 1.00 49.50 C ATOM 4 O GLU A 24 70.262 72.377 -5.263 1.00 47.25 O ATOM 5 CB GLU A 24 71.220 70.325 -7.230 1.00 68.82 C ATOM 6 CG GLU A 24 72.052 69.211 -7.854 1.00 78.44 C ATOM 7 CD GLU A 24 72.415 69.484 -9.291 1.00 87.68 C ATOM 8 OE1 GLU A 24 71.729 70.317 -9.905 1.00 89.53 O ATOM 9 OE2 GLU A 24 73.374 68.855 -9.798 1.00 91.35 O ATOM 10 HN3 GLU A 24 68.936 70.170 -5.812 1.00 0.00 H ATOM 11 HN2 GLU A 24 69.580 69.416 -4.432 1.00 0.00 H ATOM 12 HN1 GLU A 24 69.640 68.628 -5.936 1.00 0.00 H ATOM 13 N VAL A 25 72.026 71.538 -4.187 1.00 47.44 N ATOM 14 CA VAL A 25 72.246 72.707 -3.357 1.00 39.14 C ATOM 15 C VAL A 25 73.600 73.271 -3.663 1.00 35.74 C ATOM 16 O VAL A 25 74.604 72.591 -3.471 1.00 37.89 O ATOM 17 CB VAL A 25 72.175 72.353 -1.868 1.00 38.57 C ATOM 18 CG1 VAL A 25 72.211 73.578 -0.996 1.00 37.83 C ATOM 19 CG2 VAL A 25 70.887 71.529 -1.607 1.00 41.09 C ATOM 20 H VAL A 25 72.673 70.728 -4.110 1.00 0.00 H ATOM 21 N PRO A 26 73.646 74.519 -4.153 1.00 33.21 N ATOM 22 CA PRO A 26 74.991 75.039 -4.423 1.00 31.57 C ATOM 23 C PRO A 26 75.639 75.552 -3.176 1.00 33.86 C ATOM 24 O PRO A 26 74.974 75.806 -2.169 1.00 32.27 O ATOM 25 CB PRO A 26 74.727 76.193 -5.392 1.00 32.46 C ATOM 26 CG PRO A 26 73.418 76.757 -4.887 1.00 37.92 C ATOM 27 CD PRO A 26 72.597 75.502 -4.483 1.00 36.34 C ATOM 28 N LEU A 27 76.948 75.751 -3.261 1.00 30.45 N ATOM 29 CA LEU A 27 77.658 76.406 -2.175 1.00 30.15 C ATOM 30 C LEU A 27 77.046 77.791 -1.960 1.00 29.27 C ATOM 31 O LEU A 27 76.524 78.400 -2.917 1.00 28.51 O ATOM 32 CB LEU A 27 79.164 76.488 -2.512 1.00 29.29 C ATOM 33 CG LEU A 27 79.806 75.148 -2.914 1.00 34.50 C ATOM 34 CD1 LEU A 27 81.257 75.340 -3.434 1.00 30.15 C ATOM 35 CD2 LEU A 27 79.828 74.162 -1.693 1.00 38.35 C ATOM 36 H LEU A 27 77.467 75.438 -4.106 1.00 0.00 H ATOM 37 N PRO A 28 77.117 78.327 -0.735 1.00 29.48 N ATOM 38 CA PRO A 28 76.547 79.657 -0.469 1.00 28.77 C ATOM 39 C PRO A 28 77.270 80.754 -1.212 1.00 28.81 C ATOM 40 O PRO A 28 78.474 80.619 -1.439 1.00 26.55 O ATOM 41 CB PRO A 28 76.742 79.841 1.044 1.00 32.55 C ATOM 42 CG PRO A 28 77.963 78.965 1.354 1.00 36.94 C ATOM 43 CD PRO A 28 77.734 77.739 0.483 1.00 30.55 C ATOM 44 N GLN A 29 76.570 81.831 -1.545 1.00 29.05 N ATOM 45 CA GLN A 29 77.239 83.017 -2.075 1.00 29.66 C ATOM 46 C GLN A 29 78.160 83.606 -1.035 1.00 29.22 C ATOM 47 O GLN A 29 77.937 83.475 0.188 1.00 29.15 O ATOM 48 CB GLN A 29 76.204 84.051 -2.506 1.00 25.16 C ATOM 49 CG GLN A 29 75.238 83.510 -3.564 1.00 28.85 C ATOM 50 CD GLN A 29 75.836 83.519 -4.976 1.00 28.51 C ATOM 51 OE1 GLN A 29 76.858 84.180 -5.233 1.00 27.07 O ATOM 52 NE2 GLN A 29 75.215 82.780 -5.876 1.00 28.81 N ATOM 53 HE22 GLN A 29 74.363 82.245 -5.612 1.00 0.00 H ATOM 54 HE21 GLN A 29 75.577 82.733 -6.850 1.00 0.00 H ATOM 55 H GLN A 29 75.537 81.831 -1.428 1.00 0.00 H ATOM 56 N LEU A 30 79.186 84.312 -1.499 1.00 25.83 N ATOM 57 CA LEU A 30 79.952 85.107 -0.550 1.00 25.90 C ATOM 58 C LEU A 30 79.049 86.168 0.106 1.00 28.32 C ATOM 59 O LEU A 30 78.128 86.714 -0.541 1.00 30.36 O ATOM 60 CB LEU A 30 81.132 85.773 -1.250 1.00 31.39 C ATOM 61 CG LEU A 30 82.173 84.790 -1.809 1.00 32.92 C ATOM 62 CD1 LEU A 30 83.075 85.524 -2.789 1.00 33.35 C ATOM 63 CD2 LEU A 30 82.956 84.065 -0.724 1.00 35.04 C ATOM 64 H LEU A 30 79.434 84.297 -2.509 1.00 0.00 H ATOM 65 N ARG A 31 79.303 86.443 1.382 1.00 33.74 N ATOM 66 CA ARG A 31 78.518 87.421 2.124 1.00 34.82 C ATOM 67 C ARG A 31 79.360 88.637 2.403 1.00 35.68 C ATOM 68 O ARG A 31 80.470 88.539 2.918 1.00 35.95 O ATOM 69 CB ARG A 31 78.004 86.852 3.436 1.00 48.31 C ATOM 70 CG ARG A 31 77.156 87.803 4.258 1.00 63.14 C ATOM 71 CD ARG A 31 76.482 87.035 5.403 1.00 75.25 C ATOM 72 NE ARG A 31 75.941 87.937 6.430 1.00 82.74 N ATOM 73 CZ ARG A 31 76.070 87.751 7.745 1.00 88.55 C ATOM 74 NH1 ARG A 31 76.733 86.698 8.210 1.00 89.85 N ATOM 75 NH2 ARG A 31 75.540 88.620 8.598 1.00 89.50 N ATOM 76 HE ARG A 31 75.421 88.779 6.109 1.00 0.00 H ATOM 77 HH12 ARG A 31 76.831 86.557 9.236 1.00 0.00 H ATOM 78 HH11 ARG A 31 77.154 86.015 7.548 1.00 0.00 H ATOM 79 HH22 ARG A 31 75.643 88.472 9.622 1.00 0.00 H ATOM 80 HH21 ARG A 31 75.022 89.449 8.242 1.00 0.00 H ATOM 81 H ARG A 31 80.081 85.948 1.862 1.00 0.00 H ATOM 82 N ALA A 32 78.829 89.795 2.079 1.00 34.89 N ATOM 83 CA ALA A 32 79.616 90.992 2.235 1.00 36.42 C ATOM 84 C ALA A 32 79.622 91.370 3.683 1.00 31.81 C ATOM 85 O ALA A 32 78.730 91.015 4.444 1.00 33.70 O ATOM 86 CB ALA A 32 79.063 92.126 1.378 1.00 40.91 C ATOM 87 H ALA A 32 77.856 89.846 1.716 1.00 0.00 H ATOM 88 N TYR A 33 80.643 92.117 4.066 1.00 35.73 N ATOM 89 CA TYR A 33 80.748 92.629 5.413 1.00 35.65 C ATOM 90 C TYR A 33 79.889 93.884 5.547 1.00 29.36 C ATOM 91 O TYR A 33 80.305 94.972 5.171 1.00 31.37 O ATOM 92 CB TYR A 33 82.213 92.914 5.736 1.00 29.87 C ATOM 93 CG TYR A 33 82.450 93.563 7.071 1.00 32.32 C ATOM 94 CD1 TYR A 33 81.891 93.043 8.227 1.00 31.96 C ATOM 95 CD2 TYR A 33 83.255 94.685 7.178 1.00 34.15 C ATOM 96 CE1 TYR A 33 82.112 93.634 9.443 1.00 31.25 C ATOM 97 CE2 TYR A 33 83.483 95.278 8.390 1.00 34.43 C ATOM 98 CZ TYR A 33 82.913 94.749 9.521 1.00 31.97 C ATOM 99 OH TYR A 33 83.142 95.344 10.731 1.00 33.03 O ATOM 100 HH TYR A 33 82.663 94.844 11.439 1.00 0.00 H ATOM 101 H TYR A 33 81.391 92.342 3.379 1.00 0.00 H ATOM 102 N THR A 34 78.683 93.710 6.075 1.00 29.90 N ATOM 103 CA THR A 34 77.742 94.816 6.244 1.00 37.59 C ATOM 104 C THR A 34 77.692 95.260 7.701 1.00 35.53 C ATOM 105 O THR A 34 77.931 94.457 8.614 1.00 33.76 O ATOM 106 CB THR A 34 76.347 94.431 5.813 1.00 38.92 C ATOM 107 OG1 THR A 34 75.925 93.355 6.636 1.00 40.15 O ATOM 108 CG2 THR A 34 76.342 93.990 4.336 1.00 35.46 C ATOM 109 HG1 THR A 34 75.927 93.645 7.583 1.00 0.00 H ATOM 110 H THR A 34 78.399 92.757 6.378 1.00 0.00 H ATOM 111 N VAL A 35 77.395 96.540 7.899 1.00 29.84 N ATOM 112 CA VAL A 35 77.549 97.200 9.196 1.00 25.62 C ATOM 113 C VAL A 35 76.348 98.140 9.436 1.00 25.62 C ATOM 114 O VAL A 35 75.586 98.449 8.519 1.00 25.19 O ATOM 115 CB VAL A 35 78.867 98.022 9.271 1.00 24.37 C ATOM 116 CG1 VAL A 35 80.088 97.119 9.095 1.00 22.34 C ATOM 117 CG2 VAL A 35 78.920 99.055 8.157 1.00 23.43 C ATOM 118 H VAL A 35 77.037 97.097 7.097 1.00 0.00 H ATOM 119 N ASP A 36 76.199 98.579 10.679 1.00 25.98 N ATOM 120 CA ASP A 36 75.166 99.559 11.018 1.00 26.51 C ATOM 121 C ASP A 36 75.308 100.809 10.184 1.00 26.00 C ATOM 122 O ASP A 36 76.413 101.295 9.925 1.00 24.71 O ATOM 123 CB ASP A 36 75.246 99.965 12.508 1.00 26.15 C ATOM 124 CG ASP A 36 74.771 98.886 13.450 1.00 33.34 C ATOM 125 OD1 ASP A 36 74.205 97.861 13.005 1.00 35.74 O ATOM 126 OD2 ASP A 36 74.929 99.099 14.660 1.00 34.95 O ATOM 127 H ASP A 36 76.827 98.220 11.426 1.00 0.00 H ATOM 128 N ALA A 37 74.185 101.390 9.794 1.00 26.86 N ATOM 129 CA ALA A 37 74.236 102.563 8.927 1.00 25.83 C ATOM 130 C ALA A 37 75.027 103.709 9.536 1.00 25.08 C ATOM 131 O ALA A 37 75.704 104.431 8.808 1.00 23.72 O ATOM 132 CB ALA A 37 72.812 103.014 8.589 1.00 27.85 C ATOM 133 H ALA A 37 73.268 101.011 10.105 1.00 0.00 H ATOM 134 N SER A 38 74.976 103.863 10.868 1.00 24.21 N ATOM 135 CA SER A 38 75.720 104.967 11.503 1.00 23.68 C ATOM 136 C SER A 38 77.225 104.845 11.269 1.00 22.48 C ATOM 137 O SER A 38 77.923 105.853 11.232 1.00 23.00 O ATOM 138 CB SER A 38 75.460 105.049 13.017 1.00 23.99 C ATOM 139 OG SER A 38 75.832 103.854 13.668 1.00 26.10 O ATOM 140 HG SER A 38 75.653 103.938 14.638 1.00 0.00 H ATOM 141 H SER A 38 74.415 103.208 11.449 1.00 0.00 H ATOM 142 N TRP A 39 77.716 103.629 11.083 1.00 22.02 N ATOM 143 CA TRP A 39 79.130 103.426 10.810 1.00 22.33 C ATOM 144 C TRP A 39 79.513 104.027 9.466 1.00 21.04 C ATOM 145 O TRP A 39 80.673 104.304 9.209 1.00 20.60 O ATOM 146 CB TRP A 39 79.475 101.946 10.770 1.00 21.24 C ATOM 147 CG TRP A 39 79.368 101.216 12.061 1.00 21.25 C ATOM 148 CD1 TRP A 39 78.577 101.523 13.121 1.00 21.86 C ATOM 149 CD2 TRP A 39 80.086 100.040 12.422 1.00 21.19 C ATOM 150 NE1 TRP A 39 78.754 100.604 14.123 1.00 25.39 N ATOM 151 CE2 TRP A 39 79.679 99.682 13.715 1.00 22.23 C ATOM 152 CE3 TRP A 39 81.036 99.251 11.773 1.00 21.38 C ATOM 153 CZ2 TRP A 39 80.191 98.572 14.372 1.00 25.08 C ATOM 154 CZ3 TRP A 39 81.538 98.151 12.425 1.00 21.20 C ATOM 155 CH2 TRP A 39 81.115 97.820 13.708 1.00 24.30 C ATOM 156 HE1 TRP A 39 78.266 100.607 15.041 1.00 0.00 H ATOM 157 H TRP A 39 77.081 102.807 11.133 1.00 0.00 H ATOM 158 N LEU A 40 78.519 104.210 8.611 1.00 21.69 N ATOM 159 CA LEU A 40 78.772 104.639 7.235 1.00 23.95 C ATOM 160 C LEU A 40 78.204 106.027 6.983 1.00 23.09 C ATOM 161 O LEU A 40 78.106 106.468 5.824 1.00 27.41 O ATOM 162 CB LEU A 40 78.146 103.666 6.236 1.00 22.16 C ATOM 163 CG LEU A 40 78.808 102.285 6.230 1.00 24.11 C ATOM 164 CD1 LEU A 40 78.038 101.341 5.334 1.00 26.05 C ATOM 165 CD2 LEU A 40 80.262 102.433 5.736 1.00 25.75 C ATOM 166 H LEU A 40 77.541 104.046 8.923 1.00 0.00 H ATOM 167 N GLN A 41 77.785 106.689 8.055 1.00 23.93 N ATOM 168 CA GLN A 41 77.156 108.014 7.915 1.00 23.99 C ATOM 169 C GLN A 41 78.197 109.142 7.927 1.00 25.46 C ATOM 170 O GLN A 41 78.796 109.440 8.960 1.00 23.27 O ATOM 171 CB GLN A 41 76.122 108.224 9.051 1.00 24.56 C ATOM 172 CG GLN A 41 75.407 109.574 9.011 1.00 25.82 C ATOM 173 CD GLN A 41 74.737 109.796 7.649 1.00 35.71 C ATOM 174 OE1 GLN A 41 75.045 110.758 6.925 1.00 41.50 O ATOM 175 NE2 GLN A 41 73.862 108.874 7.282 1.00 31.50 N ATOM 176 HE22 GLN A 41 73.636 108.087 7.923 1.00 0.00 H ATOM 177 HE21 GLN A 41 73.400 108.937 6.352 1.00 0.00 H ATOM 178 H GLN A 41 77.902 106.270 9.000 1.00 0.00 H ATOM 179 N PRO A 42 78.446 109.769 6.771 1.00 26.10 N ATOM 180 CA PRO A 42 79.423 110.857 6.731 1.00 26.72 C ATOM 181 C PRO A 42 79.115 111.998 7.708 1.00 27.05 C ATOM 182 O PRO A 42 77.944 112.325 7.930 1.00 29.30 O ATOM 183 CB PRO A 42 79.303 111.355 5.278 1.00 28.01 C ATOM 184 CG PRO A 42 78.872 110.140 4.508 1.00 28.34 C ATOM 185 CD PRO A 42 77.830 109.558 5.447 1.00 29.51 C ATOM 186 N MET A 43 80.166 112.601 8.271 1.00 25.30 N ATOM 187 CA MET A 43 80.055 113.826 9.079 1.00 26.31 C ATOM 188 C MET A 43 81.145 114.798 8.629 1.00 29.32 C ATOM 189 O MET A 43 82.200 114.383 8.146 1.00 27.48 O ATOM 190 CB MET A 43 80.193 113.551 10.582 1.00 25.52 C ATOM 191 CG MET A 43 81.554 112.889 10.911 1.00 27.26 C ATOM 192 SD MET A 43 81.777 112.537 12.695 1.00 25.21 S ATOM 193 CE MET A 43 82.063 114.231 13.241 1.00 23.83 C ATOM 194 H MET A 43 81.109 112.184 8.131 1.00 0.00 H ATOM 195 N ALA A 44 80.887 116.087 8.795 1.00 28.22 N ATOM 196 CA ALA A 44 81.930 117.082 8.599 1.00 32.82 C ATOM 197 C ALA A 44 82.978 116.973 9.683 1.00 31.38 C ATOM 198 O ALA A 44 82.730 116.375 10.735 1.00 28.75 O ATOM 199 CB ALA A 44 81.329 118.486 8.599 1.00 29.91 C ATOM 200 H ALA A 44 79.930 116.390 9.068 1.00 0.00 H ATOM 201 N PRO A 45 84.144 117.578 9.445 1.00 27.46 N ATOM 202 CA PRO A 45 85.224 117.534 10.428 1.00 26.07 C ATOM 203 C PRO A 45 84.818 118.132 11.781 1.00 25.73 C ATOM 204 O PRO A 45 84.184 119.196 11.851 1.00 27.18 O ATOM 205 CB PRO A 45 86.351 118.354 9.749 1.00 27.31 C ATOM 206 CG PRO A 45 86.076 118.241 8.270 1.00 29.80 C ATOM 207 CD PRO A 45 84.535 118.231 8.192 1.00 28.53 C ATOM 208 N LEU A 46 85.117 117.406 12.845 1.00 24.48 N ATOM 209 CA LEU A 46 84.808 117.830 14.216 1.00 27.63 C ATOM 210 C LEU A 46 86.134 118.048 14.942 1.00 24.93 C ATOM 211 O LEU A 46 86.942 117.100 15.068 1.00 23.15 O ATOM 212 CB LEU A 46 83.971 116.771 14.941 1.00 23.18 C ATOM 213 CG LEU A 46 83.793 116.898 16.455 1.00 25.96 C ATOM 214 CD1 LEU A 46 82.822 118.068 16.720 1.00 27.41 C ATOM 215 CD2 LEU A 46 83.259 115.596 17.080 1.00 24.46 C ATOM 216 H LEU A 46 85.593 116.492 12.704 1.00 0.00 H ATOM 217 N GLN A 47 86.403 119.291 15.341 1.00 25.12 N ATOM 218 CA GLN A 47 87.651 119.555 16.045 1.00 28.24 C ATOM 219 C GLN A 47 87.712 118.964 17.464 1.00 24.31 C ATOM 220 O GLN A 47 86.769 119.137 18.282 1.00 26.86 O ATOM 221 CB GLN A 47 87.903 121.080 16.098 1.00 26.07 C ATOM 222 CG GLN A 47 89.318 121.400 16.485 1.00 27.70 C ATOM 223 CD GLN A 47 89.653 122.835 16.167 1.00 33.80 C ATOM 224 OE1 GLN A 47 88.752 123.646 16.052 1.00 34.64 O ATOM 225 NE2 GLN A 47 90.935 123.137 15.982 1.00 33.54 N ATOM 226 HE22 GLN A 47 91.663 122.403 16.094 1.00 0.00 H ATOM 227 HE21 GLN A 47 91.209 124.107 15.726 1.00 0.00 H ATOM 228 H GLN A 47 85.731 120.062 15.152 1.00 0.00 H ATOM 229 N ILE A 48 88.812 118.235 17.751 1.00 23.00 N ATOM 230 CA ILE A 48 89.088 117.704 19.074 1.00 23.38 C ATOM 231 C ILE A 48 90.069 118.573 19.876 1.00 24.84 C ATOM 232 O ILE A 48 89.882 118.775 21.066 1.00 24.53 O ATOM 233 CB ILE A 48 89.704 116.286 18.983 1.00 25.17 C ATOM 234 CG1 ILE A 48 88.908 115.364 18.046 1.00 31.10 C ATOM 235 CG2 ILE A 48 89.904 115.670 20.351 1.00 21.87 C ATOM 236 CD1 ILE A 48 87.458 115.256 18.362 1.00 30.42 C ATOM 237 H ILE A 48 89.493 118.045 16.989 1.00 0.00 H ATOM 238 N ALA A 49 91.119 119.047 19.210 1.00 24.91 N ATOM 239 CA ALA A 49 92.077 119.974 19.824 1.00 25.93 C ATOM 240 C ALA A 49 92.714 120.819 18.717 1.00 28.83 C ATOM 241 O ALA A 49 92.286 120.737 17.592 1.00 27.46 O ATOM 242 CB ALA A 49 93.142 119.229 20.634 1.00 24.85 C ATOM 243 H ALA A 49 91.265 118.751 18.224 1.00 0.00 H ATOM 244 N ASP A 50 93.716 121.658 19.028 1.00 29.70 N ATOM 245 CA ASP A 50 94.149 122.651 18.042 1.00 29.33 C ATOM 246 C ASP A 50 94.556 122.047 16.696 1.00 28.94 C ATOM 247 O ASP A 50 94.356 122.678 15.638 1.00 35.89 O ATOM 248 CB ASP A 50 95.301 123.514 18.601 1.00 29.50 C ATOM 249 CG ASP A 50 94.846 124.510 19.683 1.00 31.45 C ATOM 250 OD1 ASP A 50 93.633 124.773 19.860 1.00 30.11 O ATOM 251 OD2 ASP A 50 95.760 125.035 20.361 1.00 35.22 O ATOM 252 H ASP A 50 94.179 121.603 19.958 1.00 0.00 H ATOM 253 N HIS A 51 95.136 120.839 16.715 1.00 28.41 N ATOM 254 CA HIS A 51 95.677 120.253 15.501 1.00 29.16 C ATOM 255 C HIS A 51 94.948 118.957 15.099 1.00 27.85 C ATOM 256 O HIS A 51 95.291 118.362 14.104 1.00 28.30 O ATOM 257 CB HIS A 51 97.205 119.914 15.633 1.00 30.22 C ATOM 258 CG HIS A 51 98.074 121.060 16.092 1.00 34.11 C ATOM 259 ND1 HIS A 51 98.254 121.376 17.423 1.00 43.82 N ATOM 260 CD2 HIS A 51 98.865 121.918 15.397 1.00 47.11 C ATOM 261 CE1 HIS A 51 99.075 122.409 17.527 1.00 50.90 C ATOM 262 NE2 HIS A 51 99.471 122.746 16.313 1.00 47.69 N ATOM 263 H HIS A 51 95.200 120.314 17.611 1.00 0.00 H ATOM 264 N THR A 52 93.923 118.570 15.858 1.00 26.40 N ATOM 265 CA THR A 52 93.372 117.213 15.784 1.00 25.22 C ATOM 266 C THR A 52 91.879 117.223 15.499 1.00 24.62 C ATOM 267 O THR A 52 91.139 117.876 16.236 1.00 24.96 O ATOM 268 CB THR A 52 93.608 116.474 17.081 1.00 24.44 C ATOM 269 OG1 THR A 52 95.017 116.369 17.337 1.00 25.32 O ATOM 270 CG2 THR A 52 93.020 115.029 17.028 1.00 23.44 C ATOM 271 HG1 THR A 52 95.408 117.276 17.403 1.00 0.00 H ATOM 272 H THR A 52 93.502 119.250 16.522 1.00 0.00 H ATOM 273 N TRP A 53 91.459 116.518 14.449 1.00 24.85 N ATOM 274 CA TRP A 53 90.066 116.510 13.992 1.00 23.97 C ATOM 275 C TRP A 53 89.543 115.120 13.732 1.00 23.07 C ATOM 276 O TRP A 53 90.238 114.260 13.222 1.00 23.07 O ATOM 277 CB TRP A 53 89.902 117.290 12.704 1.00 25.15 C ATOM 278 CG TRP A 53 90.290 118.711 12.785 1.00 26.35 C ATOM 279 CD1 TRP A 53 91.562 119.226 12.877 1.00 32.20 C ATOM 280 CD2 TRP A 53 89.406 119.821 12.701 1.00 28.38 C ATOM 281 NE1 TRP A 53 91.500 120.606 12.911 1.00 32.86 N ATOM 282 CE2 TRP A 53 90.190 120.983 12.792 1.00 29.99 C ATOM 283 CE3 TRP A 53 88.017 119.942 12.568 1.00 27.46 C ATOM 284 CZ2 TRP A 53 89.633 122.264 12.750 1.00 30.45 C ATOM 285 CZ3 TRP A 53 87.452 121.238 12.517 1.00 28.49 C ATOM 286 CH2 TRP A 53 88.263 122.361 12.613 1.00 33.09 C ATOM 287 HE1 TRP A 53 92.311 121.249 13.010 1.00 0.00 H ATOM 288 H TRP A 53 92.154 115.945 13.928 1.00 0.00 H ATOM 289 N GLN A 54 88.278 114.892 14.100 1.00 22.61 N ATOM 290 CA GLN A 54 87.610 113.686 13.667 1.00 21.86 C ATOM 291 C GLN A 54 87.049 113.906 12.280 1.00 24.22 C ATOM 292 O GLN A 54 86.272 114.852 12.068 1.00 23.26 O ATOM 293 CB GLN A 54 86.508 113.304 14.684 1.00 21.23 C ATOM 294 CG GLN A 54 85.335 112.476 14.141 1.00 21.03 C ATOM 295 CD GLN A 54 85.695 111.094 13.620 1.00 24.81 C ATOM 296 OE1 GLN A 54 86.836 110.640 13.805 1.00 20.96 O ATOM 297 NE2 GLN A 54 84.733 110.417 12.994 1.00 20.57 N ATOM 298 HE22 GLN A 54 83.794 110.846 12.866 1.00 0.00 H ATOM 299 HE21 GLN A 54 84.921 109.460 12.633 1.00 0.00 H ATOM 300 H GLN A 54 87.776 115.581 14.696 1.00 0.00 H ATOM 301 N ILE A 55 87.428 113.067 11.314 1.00 21.09 N ATOM 302 CA ILE A 55 86.993 113.320 9.911 1.00 22.35 C ATOM 303 C ILE A 55 86.339 112.070 9.290 1.00 22.65 C ATOM 304 O ILE A 55 86.075 112.010 8.083 1.00 24.06 O ATOM 305 CB ILE A 55 88.179 113.824 9.033 1.00 22.05 C ATOM 306 CG1 ILE A 55 89.307 112.757 8.946 1.00 19.80 C ATOM 307 CG2 ILE A 55 88.670 115.155 9.631 1.00 21.68 C ATOM 308 CD1 ILE A 55 90.150 112.989 7.660 1.00 22.60 C ATOM 309 H ILE A 55 88.022 112.243 11.538 1.00 0.00 H ATOM 310 N GLY A 56 86.012 111.103 10.142 1.00 22.07 N ATOM 311 CA GLY A 56 85.394 109.886 9.641 1.00 20.06 C ATOM 312 C GLY A 56 83.870 109.980 9.578 1.00 23.43 C ATOM 313 O GLY A 56 83.307 110.955 9.032 1.00 24.02 O ATOM 314 H GLY A 56 86.197 111.216 11.159 1.00 0.00 H ATOM 315 N THR A 57 83.219 108.939 10.090 1.00 20.20 N ATOM 316 CA THR A 57 81.756 108.890 10.060 1.00 24.00 C ATOM 317 C THR A 57 81.206 109.055 11.466 1.00 22.86 C ATOM 318 O THR A 57 81.964 109.123 12.420 1.00 21.19 O ATOM 319 CB THR A 57 81.256 107.567 9.496 1.00 20.31 C ATOM 320 OG1 THR A 57 81.917 106.515 10.213 1.00 19.99 O ATOM 321 CG2 THR A 57 81.508 107.444 7.966 1.00 21.23 C ATOM 322 HG1 THR A 57 81.611 105.639 9.868 1.00 0.00 H ATOM 323 H THR A 57 83.753 108.154 10.515 1.00 0.00 H ATOM 324 N GLU A 67 79.880 109.083 11.609 1.00 22.39 N ATOM 325 CA GLU A 67 79.294 109.266 12.933 1.00 20.75 C ATOM 326 C GLU A 67 79.809 108.226 13.924 1.00 23.46 C ATOM 327 O GLU A 67 80.063 108.548 15.098 1.00 22.53 O ATOM 328 CB GLU A 67 77.766 109.196 12.861 1.00 24.04 C ATOM 329 CG GLU A 67 77.209 110.356 12.149 1.00 36.82 C ATOM 330 CD GLU A 67 75.708 110.521 12.386 1.00 45.36 C ATOM 331 OE1 GLU A 67 75.083 109.579 12.950 1.00 36.19 O ATOM 332 OE2 GLU A 67 75.193 111.598 11.991 1.00 50.22 O ATOM 333 H GLU A 67 79.264 108.975 10.778 1.00 0.00 H ATOM 334 N ASP A 68 79.996 106.990 13.463 1.00 20.43 N ATOM 335 CA ASP A 68 80.321 105.883 14.423 1.00 17.88 C ATOM 336 C ASP A 68 81.619 105.169 14.098 1.00 17.59 C ATOM 337 O ASP A 68 81.887 104.098 14.687 1.00 19.61 O ATOM 338 CB ASP A 68 79.171 104.874 14.483 1.00 18.44 C ATOM 339 CG ASP A 68 78.338 105.035 15.727 1.00 29.25 C ATOM 340 OD1 ASP A 68 78.831 105.614 16.722 1.00 32.75 O ATOM 341 OD2 ASP A 68 77.190 104.552 15.739 1.00 30.04 O ATOM 342 H ASP A 68 79.917 106.794 12.445 1.00 0.00 H ATOM 343 N LEU A 69 82.463 105.736 13.203 1.00 18.54 N ATOM 344 CA LEU A 69 83.851 105.232 13.102 1.00 17.63 C ATOM 345 C LEU A 69 84.836 106.395 13.128 1.00 20.46 C ATOM 346 O LEU A 69 84.701 107.361 12.344 1.00 20.10 O ATOM 347 CB LEU A 69 84.098 104.373 11.839 1.00 17.80 C ATOM 348 CG LEU A 69 83.317 103.021 11.757 1.00 17.05 C ATOM 349 CD1 LEU A 69 83.409 102.407 10.373 1.00 16.25 C ATOM 350 CD2 LEU A 69 83.880 101.980 12.772 1.00 18.93 C ATOM 351 H LEU A 69 82.140 106.515 12.595 1.00 0.00 H ATOM 352 N THR A 70 85.828 106.280 14.013 1.00 18.33 N ATOM 353 CA THR A 70 86.864 107.308 14.166 1.00 17.25 C ATOM 354 C THR A 70 87.864 107.272 13.029 1.00 17.88 C ATOM 355 O THR A 70 88.309 106.191 12.602 1.00 19.88 O ATOM 356 CB THR A 70 87.577 107.103 15.522 1.00 16.14 C ATOM 357 OG1 THR A 70 86.587 107.204 16.549 1.00 18.40 O ATOM 358 CG2 THR A 70 88.693 108.137 15.724 1.00 18.45 C ATOM 359 HG1 THR A 70 86.165 108.099 16.512 1.00 0.00 H ATOM 360 H THR A 70 85.868 105.433 14.615 1.00 0.00 H ATOM 361 N ALA A 71 88.208 108.469 12.547 1.00 18.24 N ATOM 362 CA ALA A 71 89.361 108.610 11.653 1.00 19.03 C ATOM 363 C ALA A 71 89.906 109.960 12.016 1.00 21.30 C ATOM 364 O ALA A 71 89.250 110.966 11.789 1.00 20.80 O ATOM 365 CB ALA A 71 88.975 108.554 10.184 1.00 20.58 C ATOM 366 H ALA A 71 87.653 109.309 12.808 1.00 0.00 H ATOM 367 N LEU A 72 91.081 109.985 12.594 1.00 19.31 N ATOM 368 CA LEU A 72 91.594 111.229 13.166 1.00 17.22 C ATOM 369 C LEU A 72 92.614 111.856 12.224 1.00 20.80 C ATOM 370 O LEU A 72 93.565 111.219 11.803 1.00 21.61 O ATOM 371 CB LEU A 72 92.280 110.956 14.512 1.00 19.27 C ATOM 372 CG LEU A 72 91.288 110.512 15.581 1.00 17.88 C ATOM 373 CD1 LEU A 72 92.090 110.048 16.801 1.00 21.54 C ATOM 374 CD2 LEU A 72 90.266 111.549 15.887 1.00 24.62 C ATOM 375 H LEU A 72 91.651 109.117 12.646 1.00 0.00 H ATOM 376 N LEU A 73 92.415 113.122 11.950 1.00 19.79 N ATOM 377 CA LEU A 73 93.366 113.865 11.134 1.00 19.76 C ATOM 378 C LEU A 73 94.158 114.786 12.061 1.00 25.01 C ATOM 379 O LEU A 73 93.570 115.587 12.800 1.00 25.21 O ATOM 380 CB LEU A 73 92.623 114.675 10.039 1.00 20.73 C ATOM 381 CG LEU A 73 93.524 115.500 9.102 1.00 23.47 C ATOM 382 CD1 LEU A 73 94.257 114.564 8.159 1.00 24.56 C ATOM 383 CD2 LEU A 73 92.653 116.516 8.329 1.00 27.08 C ATOM 384 H LEU A 73 91.569 113.601 12.319 1.00 0.00 H ATOM 385 N VAL A 74 95.491 114.680 12.009 1.00 21.03 N ATOM 386 CA VAL A 74 96.316 115.602 12.789 1.00 21.57 C ATOM 387 C VAL A 74 97.099 116.438 11.796 1.00 24.08 C ATOM 388 O VAL A 74 97.853 115.875 11.009 1.00 23.24 O ATOM 389 CB VAL A 74 97.285 114.834 13.749 1.00 21.14 C ATOM 390 CG1 VAL A 74 98.210 115.845 14.485 1.00 25.48 C ATOM 391 CG2 VAL A 74 96.512 113.930 14.757 1.00 22.55 C ATOM 392 H VAL A 74 95.936 113.948 11.419 1.00 0.00 H ATOM 393 N GLN A 75 96.859 117.756 11.799 1.00 23.97 N ATOM 394 CA GLN A 75 97.508 118.719 10.876 1.00 25.54 C ATOM 395 C GLN A 75 98.693 119.445 11.514 1.00 30.36 C ATOM 396 O GLN A 75 98.522 120.082 12.570 1.00 29.19 O ATOM 397 CB GLN A 75 96.478 119.761 10.416 1.00 32.45 C ATOM 398 CG GLN A 75 95.273 119.164 9.789 1.00 36.07 C ATOM 399 CD GLN A 75 94.238 120.209 9.444 1.00 36.78 C ATOM 400 OE1 GLN A 75 93.116 120.176 9.990 1.00 34.76 O ATOM 401 NE2 GLN A 75 94.578 121.114 8.512 1.00 34.43 N ATOM 402 HE22 GLN A 75 95.528 121.094 8.090 1.00 0.00 H ATOM 403 HE21 GLN A 75 93.891 121.835 8.212 1.00 0.00 H ATOM 404 H GLN A 75 96.176 118.127 12.490 1.00 0.00 H ATOM 405 N THR A 76 99.855 119.425 10.856 1.00 27.59 N ATOM 406 CA THR A 76 101.042 120.095 11.349 1.00 28.93 C ATOM 407 C THR A 76 101.593 120.996 10.271 1.00 30.74 C ATOM 408 O THR A 76 101.126 120.919 9.132 1.00 32.11 O ATOM 409 CB THR A 76 102.114 119.038 11.761 1.00 36.99 C ATOM 410 OG1 THR A 76 102.858 118.658 10.599 1.00 34.47 O ATOM 411 CG2 THR A 76 101.438 117.798 12.302 1.00 35.99 C ATOM 412 HG1 THR A 76 102.243 118.269 9.928 1.00 0.00 H ATOM 413 H THR A 76 99.910 118.909 9.955 1.00 0.00 H ATOM 414 N PRO A 77 102.545 121.901 10.607 1.00 34.13 N ATOM 415 CA PRO A 77 103.141 122.731 9.568 1.00 35.50 C ATOM 416 C PRO A 77 104.013 121.939 8.626 1.00 36.80 C ATOM 417 O PRO A 77 104.596 122.539 7.748 1.00 39.76 O ATOM 418 CB PRO A 77 104.001 123.730 10.339 1.00 40.25 C ATOM 419 CG PRO A 77 103.450 123.684 11.756 1.00 44.66 C ATOM 420 CD PRO A 77 102.951 122.326 11.959 1.00 40.36 C ATOM 421 N ASP A 78 104.130 120.637 8.839 1.00 34.48 N ATOM 422 CA ASP A 78 105.023 119.830 8.004 1.00 41.54 C ATOM 423 C ASP A 78 104.269 118.578 7.586 1.00 39.98 C ATOM 424 O ASP A 78 104.844 117.478 7.579 1.00 42.82 O ATOM 425 CB ASP A 78 106.315 119.519 8.789 1.00 49.58 C ATOM 426 CG ASP A 78 107.454 119.055 7.911 1.00 62.17 C ATOM 427 OD1 ASP A 78 107.483 119.405 6.702 1.00 70.79 O ATOM 428 OD2 ASP A 78 108.332 118.330 8.452 1.00 60.55 O ATOM 429 H ASP A 78 103.586 120.186 9.602 1.00 0.00 H ATOM 430 N GLY A 79 102.981 118.742 7.255 1.00 35.24 N ATOM 431 CA GLY A 79 102.174 117.661 6.713 1.00 35.28 C ATOM 432 C GLY A 79 101.147 117.131 7.693 1.00 32.09 C ATOM 433 O GLY A 79 101.161 117.532 8.860 1.00 30.84 O ATOM 434 H GLY A 79 102.543 119.676 7.391 1.00 0.00 H ATOM 435 N ALA A 80 100.294 116.221 7.213 1.00 29.85 N ATOM 436 CA ALA A 80 99.239 115.634 8.044 1.00 25.98 C ATOM 437 C ALA A 80 99.383 114.155 8.273 1.00 27.87 C ATOM 438 O ALA A 80 100.001 113.430 7.476 1.00 26.64 O ATOM 439 CB ALA A 80 97.859 115.917 7.440 1.00 28.27 C ATOM 440 H ALA A 80 100.381 115.921 6.221 1.00 0.00 H ATOM 441 N VAL A 81 98.790 113.726 9.377 1.00 22.33 N ATOM 442 CA VAL A 81 98.752 112.311 9.812 1.00 21.02 C ATOM 443 C VAL A 81 97.299 111.905 9.879 1.00 21.29 C ATOM 444 O VAL A 81 96.457 112.682 10.340 1.00 22.63 O ATOM 445 CB VAL A 81 99.452 112.101 11.195 1.00 23.87 C ATOM 446 CG1 VAL A 81 99.439 110.624 11.658 1.00 21.16 C ATOM 447 CG2 VAL A 81 100.924 112.677 11.131 1.00 22.32 C ATOM 448 H VAL A 81 98.319 114.431 9.979 1.00 0.00 H ATOM 449 N LEU A 82 97.011 110.699 9.392 1.00 19.28 N ATOM 450 CA LEU A 82 95.700 110.108 9.589 1.00 19.49 C ATOM 451 C LEU A 82 95.838 108.902 10.511 1.00 20.80 C ATOM 452 O LEU A 82 96.687 108.021 10.268 1.00 18.63 O ATOM 453 CB LEU A 82 95.123 109.674 8.225 1.00 20.24 C ATOM 454 CG LEU A 82 93.751 109.007 8.360 1.00 20.22 C ATOM 455 CD1 LEU A 82 92.703 110.074 8.667 1.00 21.85 C ATOM 456 CD2 LEU A 82 93.409 108.307 7.021 1.00 22.95 C ATOM 457 H LEU A 82 97.736 110.173 8.863 1.00 0.00 H ATOM 458 N LEU A 83 95.009 108.834 11.546 1.00 18.20 N ATOM 459 CA LEU A 83 94.972 107.647 12.406 1.00 18.35 C ATOM 460 C LEU A 83 93.631 106.979 12.162 1.00 17.30 C ATOM 461 O LEU A 83 92.564 107.510 12.564 1.00 19.94 O ATOM 462 CB LEU A 83 95.168 108.005 13.886 1.00 20.63 C ATOM 463 CG LEU A 83 96.500 108.748 14.204 1.00 18.37 C ATOM 464 CD1 LEU A 83 96.313 110.276 14.172 1.00 19.69 C ATOM 465 CD2 LEU A 83 97.008 108.227 15.583 1.00 22.17 C ATOM 466 H LEU A 83 94.377 109.634 11.750 1.00 0.00 H ATOM 467 N ASP A 84 93.728 105.816 11.514 1.00 18.32 N ATOM 468 CA ASP A 84 92.601 104.994 11.009 1.00 18.68 C ATOM 469 C ASP A 84 91.830 105.683 9.851 1.00 20.41 C ATOM 470 O ASP A 84 91.781 106.915 9.727 1.00 19.63 O ATOM 471 CB ASP A 84 91.591 104.636 12.100 1.00 18.41 C ATOM 472 CG ASP A 84 92.106 103.599 13.086 1.00 18.99 C ATOM 473 OD1 ASP A 84 93.159 102.974 12.806 1.00 20.00 O ATOM 474 OD2 ASP A 84 91.386 103.376 14.093 1.00 18.54 O ATOM 475 H ASP A 84 94.687 105.451 11.347 1.00 0.00 H ATOM 476 N GLY A 85 91.190 104.858 9.031 1.00 19.70 N ATOM 477 CA GLY A 85 90.363 105.336 7.915 1.00 20.98 C ATOM 478 C GLY A 85 88.936 104.804 7.946 1.00 19.42 C ATOM 479 O GLY A 85 88.119 105.222 7.141 1.00 20.94 O ATOM 480 H GLY A 85 91.278 103.833 9.185 1.00 0.00 H ATOM 481 N GLY A 86 88.641 103.880 8.855 1.00 18.44 N ATOM 482 CA GLY A 86 87.304 103.322 8.870 1.00 16.74 C ATOM 483 C GLY A 86 87.123 102.207 7.853 1.00 19.08 C ATOM 484 O GLY A 86 87.998 101.354 7.680 1.00 17.65 O ATOM 485 H GLY A 86 89.355 103.564 9.542 1.00 0.00 H ATOM 486 N MET A 87 85.941 102.134 7.266 1.00 18.50 N ATOM 487 CA MET A 87 85.576 101.136 6.262 1.00 19.68 C ATOM 488 C MET A 87 86.133 101.390 4.884 1.00 17.32 C ATOM 489 O MET A 87 86.481 102.530 4.544 1.00 18.66 O ATOM 490 CB MET A 87 84.029 101.078 6.140 1.00 21.11 C ATOM 491 CG MET A 87 83.343 100.492 7.421 1.00 23.02 C ATOM 492 SD MET A 87 83.434 98.705 7.504 1.00 22.00 S ATOM 493 CE MET A 87 82.213 98.294 6.246 1.00 26.31 C ATOM 494 H MET A 87 85.221 102.834 7.537 1.00 0.00 H ATOM 495 N PRO A 89 86.198 100.354 4.039 1.00 19.19 N ATOM 496 CA PRO A 89 86.809 100.530 2.709 1.00 19.19 C ATOM 497 C PRO A 89 86.146 101.629 1.869 1.00 21.40 C ATOM 498 O PRO A 89 86.791 102.404 1.143 1.00 21.90 O ATOM 499 CB PRO A 89 86.600 99.149 2.044 1.00 21.19 C ATOM 500 CG PRO A 89 86.666 98.206 3.184 1.00 20.64 C ATOM 501 CD PRO A 89 85.840 98.940 4.279 1.00 19.12 C ATOM 502 N GLN A 90 84.835 101.774 2.034 1.00 20.44 N ATOM 503 CA GLN A 90 84.156 102.673 1.123 1.00 21.12 C ATOM 504 C GLN A 90 84.249 104.135 1.600 1.00 21.71 C ATOM 505 O GLN A 90 83.688 105.028 0.963 1.00 24.65 O ATOM 506 CB GLN A 90 82.697 102.197 0.896 1.00 27.72 C ATOM 507 CG GLN A 90 81.794 102.056 2.083 1.00 25.67 C ATOM 508 CD GLN A 90 81.818 100.674 2.768 1.00 24.13 C ATOM 509 OE1 GLN A 90 82.876 100.215 3.199 1.00 20.37 O ATOM 510 NE2 GLN A 90 80.620 100.020 2.927 1.00 21.30 N ATOM 511 HE22 GLN A 90 79.745 100.438 2.550 1.00 0.00 H ATOM 512 HE21 GLN A 90 80.588 99.107 3.425 1.00 0.00 H ATOM 513 H GLN A 90 84.321 101.266 2.782 1.00 0.00 H ATOM 514 N MET A 91 84.950 104.376 2.713 1.00 21.25 N ATOM 515 CA MET A 91 85.130 105.761 3.223 1.00 21.48 C ATOM 516 C MET A 91 86.285 106.570 2.583 1.00 23.79 C ATOM 517 O MET A 91 86.490 107.729 2.943 1.00 22.33 O ATOM 518 CB MET A 91 85.316 105.714 4.755 1.00 19.04 C ATOM 519 CG MET A 91 84.001 105.435 5.500 1.00 20.94 C ATOM 520 SD MET A 91 84.170 105.076 7.255 1.00 21.52 S ATOM 521 CE MET A 91 85.241 106.438 7.866 1.00 23.72 C ATOM 522 H MET A 91 85.377 103.581 3.231 1.00 0.00 H ATOM 523 N ALA A 92 87.049 105.973 1.647 1.00 21.68 N ATOM 524 CA ALA A 92 88.222 106.678 1.140 1.00 21.25 C ATOM 525 C ALA A 92 87.898 108.070 0.589 1.00 22.52 C ATOM 526 O ALA A 92 88.581 109.043 0.901 1.00 23.92 O ATOM 527 CB ALA A 92 88.951 105.835 0.028 1.00 22.84 C ATOM 528 H ALA A 92 86.807 105.026 1.292 1.00 0.00 H ATOM 529 N SER A 93 86.891 108.160 -0.265 1.00 23.59 N ATOM 530 CA SER A 93 86.643 109.447 -0.893 1.00 24.99 C ATOM 531 C SER A 93 86.120 110.463 0.118 1.00 26.52 C ATOM 532 O SER A 93 86.431 111.647 0.038 1.00 27.55 O ATOM 533 CB SER A 93 85.674 109.300 -2.054 1.00 26.36 C ATOM 534 OG SER A 93 86.371 108.716 -3.153 1.00 32.09 O ATOM 535 HG SER A 93 86.719 107.828 -2.887 1.00 0.00 H ATOM 536 H SER A 93 86.295 107.335 -0.480 1.00 0.00 H ATOM 537 N HIS A 94 85.307 110.008 1.062 1.00 26.79 N ATOM 538 CA HIS A 94 84.807 110.931 2.074 1.00 26.02 C ATOM 539 C HIS A 94 85.973 111.506 2.913 1.00 24.70 C ATOM 540 O HIS A 94 86.014 112.679 3.225 1.00 25.80 O ATOM 541 CB HIS A 94 83.793 110.208 2.978 1.00 23.47 C ATOM 542 CG HIS A 94 83.514 110.917 4.256 1.00 24.97 C ATOM 543 ND1 HIS A 94 82.808 112.098 4.303 1.00 27.26 N ATOM 544 CD2 HIS A 94 83.903 110.654 5.524 1.00 24.73 C ATOM 545 CE1 HIS A 94 82.719 112.492 5.566 1.00 25.76 C ATOM 546 NE2 HIS A 94 83.399 111.656 6.319 1.00 25.26 N ATOM 547 H HIS A 94 85.030 109.006 1.080 1.00 0.00 H ATOM 548 N LEU A 95 86.933 110.645 3.283 1.00 22.18 N ATOM 549 CA LEU A 95 88.108 111.077 4.003 1.00 21.88 C ATOM 550 C LEU A 95 88.866 112.141 3.204 1.00 22.82 C ATOM 551 O LEU A 95 89.278 113.155 3.764 1.00 24.07 O ATOM 552 CB LEU A 95 89.047 109.904 4.254 1.00 21.37 C ATOM 553 CG LEU A 95 88.501 108.907 5.258 1.00 20.63 C ATOM 554 CD1 LEU A 95 89.406 107.643 5.157 1.00 19.67 C ATOM 555 CD2 LEU A 95 88.355 109.429 6.740 1.00 19.58 C ATOM 556 H LEU A 95 86.828 109.638 3.045 1.00 0.00 H ATOM 557 N LEU A 96 89.077 111.866 1.930 1.00 23.57 N ATOM 558 CA LEU A 96 89.769 112.838 1.064 1.00 24.90 C ATOM 559 C LEU A 96 89.014 114.167 0.948 1.00 27.73 C ATOM 560 O LEU A 96 89.639 115.214 0.964 1.00 28.90 O ATOM 561 CB LEU A 96 90.011 112.238 -0.330 1.00 25.65 C ATOM 562 CG LEU A 96 90.994 111.080 -0.267 1.00 30.81 C ATOM 563 CD1 LEU A 96 91.007 110.336 -1.606 1.00 29.38 C ATOM 564 CD2 LEU A 96 92.376 111.616 0.057 1.00 31.41 C ATOM 565 H LEU A 96 88.754 110.960 1.536 1.00 0.00 H ATOM 566 N ASP A 97 87.682 114.115 0.906 1.00 26.35 N ATOM 567 CA ASP A 97 86.891 115.344 0.915 1.00 27.53 C ATOM 568 C ASP A 97 87.095 116.138 2.191 1.00 27.46 C ATOM 569 O ASP A 97 87.198 117.372 2.155 1.00 28.59 O ATOM 570 CB ASP A 97 85.390 115.045 0.788 1.00 31.19 C ATOM 571 CG ASP A 97 85.000 114.526 -0.579 1.00 38.99 C ATOM 572 OD1 ASP A 97 85.747 114.749 -1.535 1.00 42.75 O ATOM 573 OD2 ASP A 97 83.929 113.879 -0.676 1.00 50.11 O ATOM 574 H ASP A 97 87.203 113.193 0.867 1.00 0.00 H ATOM 575 N ASN A 98 87.044 115.443 3.342 1.00 26.14 N ATOM 576 CA ASN A 98 87.220 116.137 4.602 1.00 26.97 C ATOM 577 C ASN A 98 88.634 116.702 4.743 1.00 29.12 C ATOM 578 O ASN A 98 88.789 117.798 5.255 1.00 27.92 O ATOM 579 CB ASN A 98 86.874 115.226 5.790 1.00 25.33 C ATOM 580 CG ASN A 98 85.400 115.329 6.176 1.00 27.62 C ATOM 581 OD1 ASN A 98 84.648 116.182 5.681 1.00 28.01 O ATOM 582 ND2 ASN A 98 84.988 114.479 7.097 1.00 25.14 N ATOM 583 HD22 ASN A 98 85.648 113.777 7.489 1.00 0.00 H ATOM 584 HD21 ASN A 98 84.004 114.511 7.431 1.00 0.00 H ATOM 585 H ASN A 98 86.880 114.416 3.328 1.00 0.00 H ATOM 586 N MET A 99 89.651 115.972 4.292 1.00 26.33 N ATOM 587 CA MET A 99 91.016 116.522 4.290 1.00 27.06 C ATOM 588 C MET A 99 91.065 117.835 3.490 1.00 28.18 C ATOM 589 O MET A 99 91.634 118.835 3.937 1.00 29.98 O ATOM 590 CB MET A 99 92.034 115.501 3.723 1.00 25.22 C ATOM 591 CG MET A 99 92.251 114.359 4.703 1.00 24.80 C ATOM 592 SD MET A 99 93.178 113.039 3.891 1.00 28.62 S ATOM 593 CE MET A 99 92.850 111.694 4.993 1.00 39.60 C ATOM 594 H MET A 99 89.480 115.009 3.939 1.00 0.00 H ATOM 595 N LYS A 100 90.440 117.811 2.333 1.00 28.47 N ATOM 596 CA LYS A 100 90.419 118.989 1.448 1.00 32.01 C ATOM 597 C LYS A 100 89.746 120.143 2.166 1.00 35.72 C ATOM 598 O LYS A 100 90.254 121.278 2.145 1.00 33.58 O ATOM 599 CB LYS A 100 89.732 118.649 0.138 1.00 30.67 C ATOM 600 CG LYS A 100 89.685 119.823 -0.867 1.00 41.69 C ATOM 601 CD LYS A 100 89.007 119.411 -2.152 1.00 48.69 C ATOM 602 CE LYS A 100 88.888 120.607 -3.121 1.00 57.67 C ATOM 603 NZ LYS A 100 90.240 121.059 -3.543 1.00 60.65 N ATOM 604 HZ1 LYS A 100 90.784 121.350 -2.706 1.00 0.00 H ATOM 605 HZ2 LYS A 100 90.731 120.278 -4.023 1.00 0.00 H ATOM 606 HZ3 LYS A 100 90.147 121.864 -4.195 1.00 0.00 H ATOM 607 H LYS A 100 89.950 116.943 2.037 1.00 0.00 H ATOM 608 N ALA A 101 88.621 119.865 2.829 1.00 31.72 N ATOM 609 CA ALA A 101 87.909 120.892 3.605 1.00 31.85 C ATOM 610 C ALA A 101 88.785 121.504 4.695 1.00 33.24 C ATOM 611 O ALA A 101 88.634 122.689 5.048 1.00 35.08 O ATOM 612 CB ALA A 101 86.647 120.303 4.219 1.00 32.63 C ATOM 613 H ALA A 101 88.239 118.898 2.796 1.00 0.00 H ATOM 614 N ARG A 102 89.711 120.707 5.215 1.00 28.85 N ATOM 615 CA ARG A 102 90.673 121.130 6.213 1.00 28.69 C ATOM 616 C ARG A 102 91.944 121.797 5.684 1.00 29.75 C ATOM 617 O ARG A 102 92.764 122.276 6.467 1.00 34.11 O ATOM 618 CB ARG A 102 91.090 119.914 7.049 1.00 30.43 C ATOM 619 CG ARG A 102 89.978 119.446 7.958 1.00 30.48 C ATOM 620 CD ARG A 102 90.096 120.096 9.313 1.00 36.31 C ATOM 621 NE ARG A 102 89.567 121.418 9.292 1.00 35.89 N ATOM 622 CZ ARG A 102 90.237 122.526 9.614 1.00 38.82 C ATOM 623 NH1 ARG A 102 91.498 122.474 10.015 1.00 36.53 N ATOM 624 NH2 ARG A 102 89.622 123.697 9.576 1.00 33.53 N ATOM 625 HE ARG A 102 88.575 121.529 9.001 1.00 0.00 H ATOM 626 HH12 ARG A 102 92.002 123.350 10.261 1.00 0.00 H ATOM 627 HH11 ARG A 102 91.984 121.557 10.084 1.00 0.00 H ATOM 628 HH22 ARG A 102 90.139 124.564 9.826 1.00 0.00 H ATOM 629 HH21 ARG A 102 88.622 123.750 9.296 1.00 0.00 H ATOM 630 H ARG A 102 89.748 119.721 4.887 1.00 0.00 H ATOM 631 N GLY A 103 92.107 121.839 4.383 1.00 30.72 N ATOM 632 CA GLY A 103 93.303 122.427 3.799 1.00 32.46 C ATOM 633 C GLY A 103 94.393 121.433 3.442 1.00 31.34 C ATOM 634 O GLY A 103 95.480 121.819 3.000 1.00 33.58 O ATOM 635 H GLY A 103 91.372 121.447 3.761 1.00 0.00 H ATOM 636 N VAL A 104 94.088 120.144 3.548 1.00 31.29 N ATOM 637 CA VAL A 104 95.073 119.088 3.362 1.00 35.78 C ATOM 638 C VAL A 104 94.865 118.442 1.998 1.00 34.50 C ATOM 639 O VAL A 104 93.849 117.789 1.756 1.00 31.16 O ATOM 640 CB VAL A 104 94.980 118.011 4.474 1.00 31.34 C ATOM 641 CG1 VAL A 104 95.971 116.865 4.199 1.00 35.45 C ATOM 642 CG2 VAL A 104 95.186 118.628 5.864 1.00 31.16 C ATOM 643 H VAL A 104 93.108 119.879 3.773 1.00 0.00 H ATOM 644 N THR A 105 95.795 118.668 1.070 1.00 35.93 N ATOM 645 CA THR A 105 95.720 117.997 -0.215 1.00 31.53 C ATOM 646 C THR A 105 96.280 116.560 -0.132 1.00 29.98 C ATOM 647 O THR A 105 96.938 116.168 0.853 1.00 34.74 O ATOM 648 CB THR A 105 96.503 118.733 -1.275 1.00 35.99 C ATOM 649 OG1 THR A 105 97.878 118.606 -0.923 1.00 34.81 O ATOM 650 CG2 THR A 105 96.096 120.226 -1.279 1.00 38.86 C ATOM 651 HG1 THR A 105 98.434 119.076 -1.594 1.00 0.00 H ATOM 652 H THR A 105 96.576 119.326 1.267 1.00 0.00 H ATOM 653 N PRO A 106 96.050 115.776 -1.179 1.00 35.75 N ATOM 654 CA PRO A 106 96.582 114.394 -1.147 1.00 33.67 C ATOM 655 C PRO A 106 98.101 114.368 -0.940 1.00 32.89 C ATOM 656 O PRO A 106 98.631 113.485 -0.227 1.00 35.55 O ATOM 657 CB PRO A 106 96.206 113.860 -2.520 1.00 34.55 C ATOM 658 CG PRO A 106 94.919 114.597 -2.848 1.00 38.24 C ATOM 659 CD PRO A 106 95.161 116.004 -2.326 1.00 34.57 C ATOM 660 N ARG A 107 98.812 115.321 -1.502 1.00 36.04 N ATOM 661 CA ARG A 107 100.226 115.278 -1.300 1.00 36.45 C ATOM 662 C ARG A 107 100.646 115.667 0.092 1.00 37.35 C ATOM 663 O ARG A 107 101.689 115.311 0.545 1.00 40.26 O ATOM 664 CB ARG A 107 100.903 116.148 -2.406 1.00 53.77 C ATOM 665 CG ARG A 107 102.161 116.904 -2.038 1.00 60.46 C ATOM 666 CD ARG A 107 103.049 117.167 -3.277 1.00 67.61 C ATOM 667 NE ARG A 107 104.273 117.895 -2.955 1.00 72.27 N ATOM 668 CZ ARG A 107 104.756 118.907 -3.664 1.00 73.22 C ATOM 669 NH1 ARG A 107 105.855 119.508 -3.262 1.00 75.28 N ATOM 670 NH2 ARG A 107 104.148 119.323 -4.779 1.00 70.32 N ATOM 671 HE ARG A 107 104.803 117.600 -2.111 1.00 0.00 H ATOM 672 HH12 ARG A 107 106.243 120.302 -3.809 1.00 0.00 H ATOM 673 HH11 ARG A 107 106.336 119.189 -2.397 1.00 0.00 H ATOM 674 HH22 ARG A 107 104.543 120.118 -5.321 1.00 0.00 H ATOM 675 HH21 ARG A 107 103.280 118.852 -5.105 1.00 0.00 H ATOM 676 H ARG A 107 98.366 116.071 -2.067 1.00 0.00 H ATOM 677 N ASP A 108 99.786 116.339 0.842 1.00 30.71 N ATOM 678 CA ASP A 108 100.100 116.772 2.202 1.00 32.62 C ATOM 679 C ASP A 108 99.926 115.657 3.233 1.00 33.81 C ATOM 680 O ASP A 108 100.426 115.767 4.343 1.00 30.20 O ATOM 681 CB ASP A 108 99.192 117.914 2.653 1.00 30.38 C ATOM 682 CG ASP A 108 99.383 119.219 1.836 1.00 44.48 C ATOM 683 OD1 ASP A 108 100.510 119.482 1.367 1.00 43.53 O ATOM 684 OD2 ASP A 108 98.391 119.989 1.712 1.00 46.89 O ATOM 685 H ASP A 108 98.851 116.567 0.448 1.00 0.00 H ATOM 686 N LEU A 109 99.204 114.604 2.880 1.00 30.00 N ATOM 687 CA LEU A 109 99.037 113.533 3.825 1.00 27.02 C ATOM 688 C LEU A 109 100.298 112.650 3.853 1.00 28.46 C ATOM 689 O LEU A 109 100.675 112.009 2.841 1.00 29.55 O ATOM 690 CB LEU A 109 97.787 112.711 3.496 1.00 25.65 C ATOM 691 CG LEU A 109 97.496 111.570 4.499 1.00 26.13 C ATOM 692 CD1 LEU A 109 97.048 112.145 5.847 1.00 26.95 C ATOM 693 CD2 LEU A 109 96.442 110.648 3.959 1.00 23.97 C ATOM 694 H LEU A 109 98.767 114.553 1.938 1.00 0.00 H ATOM 695 N ARG A 110 100.993 112.660 4.976 1.00 25.58 N ATOM 696 CA ARG A 110 102.316 112.027 5.029 1.00 25.77 C ATOM 697 C ARG A 110 102.326 110.634 5.622 1.00 24.62 C ATOM 698 O ARG A 110 103.158 109.793 5.247 1.00 25.54 O ATOM 699 CB ARG A 110 103.310 112.886 5.830 1.00 36.78 C ATOM 700 CG ARG A 110 103.633 114.242 5.198 1.00 43.49 C ATOM 701 CD ARG A 110 104.801 114.941 5.914 1.00 56.85 C ATOM 702 NE ARG A 110 105.916 114.051 6.262 1.00 64.72 N ATOM 703 CZ ARG A 110 106.884 114.371 7.126 1.00 68.05 C ATOM 704 NH1 ARG A 110 106.882 115.563 7.721 1.00 65.40 N ATOM 705 NH2 ARG A 110 107.855 113.507 7.401 1.00 68.48 N ATOM 706 HE ARG A 110 105.955 113.116 5.809 1.00 0.00 H ATOM 707 HH12 ARG A 110 107.636 115.810 8.393 1.00 0.00 H ATOM 708 HH11 ARG A 110 106.126 116.247 7.513 1.00 0.00 H ATOM 709 HH22 ARG A 110 108.604 113.764 8.075 1.00 0.00 H ATOM 710 HH21 ARG A 110 107.866 112.574 6.943 1.00 0.00 H ATOM 711 H ARG A 110 100.602 113.117 5.824 1.00 0.00 H ATOM 712 N LEU A 111 101.404 110.383 6.544 1.00 24.08 N ATOM 713 CA LEU A 111 101.539 109.218 7.409 1.00 23.68 C ATOM 714 C LEU A 111 100.146 108.708 7.758 1.00 20.94 C ATOM 715 O LEU A 111 99.265 109.502 8.046 1.00 23.48 O ATOM 716 CB LEU A 111 102.326 109.590 8.662 1.00 24.83 C ATOM 717 CG LEU A 111 102.462 108.540 9.753 1.00 24.55 C ATOM 718 CD1 LEU A 111 103.252 107.342 9.240 1.00 26.36 C ATOM 719 CD2 LEU A 111 103.094 109.180 10.970 1.00 27.32 C ATOM 720 H LEU A 111 100.586 111.017 6.649 1.00 0.00 H ATOM 721 N ILE A 112 99.966 107.396 7.647 1.00 19.51 N ATOM 722 CA ILE A 112 98.788 106.710 8.175 1.00 19.58 C ATOM 723 C ILE A 112 99.251 105.802 9.298 1.00 21.60 C ATOM 724 O ILE A 112 100.194 105.012 9.110 1.00 21.79 O ATOM 725 CB ILE A 112 98.072 105.853 7.089 1.00 20.82 C ATOM 726 CG1 ILE A 112 97.443 106.775 6.013 1.00 23.56 C ATOM 727 CG2 ILE A 112 97.002 104.995 7.743 1.00 20.54 C ATOM 728 CD1 ILE A 112 97.012 106.031 4.759 1.00 25.57 C ATOM 729 H ILE A 112 100.695 106.833 7.164 1.00 0.00 H ATOM 730 N LEU A 113 98.620 105.940 10.454 1.00 19.15 N ATOM 731 CA LEU A 113 98.783 105.061 11.634 1.00 18.24 C ATOM 732 C LEU A 113 97.501 104.305 11.850 1.00 20.62 C ATOM 733 O LEU A 113 96.437 104.785 11.451 1.00 18.67 O ATOM 734 CB LEU A 113 99.100 105.877 12.879 1.00 18.91 C ATOM 735 CG LEU A 113 100.346 106.744 12.712 1.00 19.44 C ATOM 736 CD1 LEU A 113 100.601 107.557 13.999 1.00 23.34 C ATOM 737 CD2 LEU A 113 101.593 105.854 12.339 1.00 20.53 C ATOM 738 H LEU A 113 97.953 106.733 10.540 1.00 0.00 H ATOM 739 N LEU A 114 97.575 103.134 12.502 1.00 17.78 N ATOM 740 CA LEU A 114 96.362 102.319 12.692 1.00 17.58 C ATOM 741 C LEU A 114 96.205 101.906 14.146 1.00 17.47 C ATOM 742 O LEU A 114 97.214 101.586 14.817 1.00 19.82 O ATOM 743 CB LEU A 114 96.404 101.040 11.836 1.00 18.88 C ATOM 744 CG LEU A 114 96.465 101.357 10.320 1.00 21.88 C ATOM 745 CD1 LEU A 114 96.744 100.059 9.548 1.00 22.77 C ATOM 746 CD2 LEU A 114 95.120 101.916 9.883 1.00 21.95 C ATOM 747 H LEU A 114 98.488 102.802 12.873 1.00 0.00 H ATOM 748 N SER A 115 94.953 101.799 14.610 1.00 17.10 N ATOM 749 CA SER A 115 94.670 101.189 15.907 1.00 14.86 C ATOM 750 C SER A 115 94.796 99.656 15.765 1.00 18.63 C ATOM 751 O SER A 115 95.656 99.014 16.417 1.00 17.88 O ATOM 752 CB SER A 115 93.261 101.566 16.359 1.00 16.94 C ATOM 753 OG SER A 115 92.325 101.157 15.395 1.00 17.49 O ATOM 754 HG SER A 115 92.523 101.604 14.534 1.00 0.00 H ATOM 755 H SER A 115 94.165 102.158 14.034 1.00 0.00 H ATOM 756 N HIS A 116 93.980 99.071 14.895 1.00 16.07 N ATOM 757 CA HIS A 116 94.174 97.679 14.487 1.00 15.76 C ATOM 758 C HIS A 116 93.684 97.417 13.063 1.00 17.07 C ATOM 759 O HIS A 116 92.847 98.141 12.548 1.00 18.47 O ATOM 760 CB HIS A 116 93.541 96.705 15.483 1.00 14.04 C ATOM 761 CG HIS A 116 92.049 96.700 15.473 1.00 15.28 C ATOM 762 ND1 HIS A 116 91.299 97.599 16.195 1.00 16.16 N ATOM 763 CD2 HIS A 116 91.167 95.886 14.853 1.00 14.43 C ATOM 764 CE1 HIS A 116 90.018 97.348 16.006 1.00 13.52 C ATOM 765 NE2 HIS A 116 89.912 96.315 15.194 1.00 15.15 N ATOM 766 H HIS A 116 93.187 99.613 14.496 1.00 0.00 H ATOM 767 N ALA A 117 94.215 96.374 12.435 1.00 14.35 N ATOM 768 CA ALA A 117 93.994 96.163 11.017 1.00 17.84 C ATOM 769 C ALA A 117 92.805 95.279 10.689 1.00 13.97 C ATOM 770 O ALA A 117 92.876 94.337 9.881 1.00 16.37 O ATOM 771 CB ALA A 117 95.300 95.583 10.362 1.00 14.86 C ATOM 772 H ALA A 117 94.798 95.698 12.968 1.00 0.00 H ATOM 773 N HIS A 118 91.668 95.639 11.269 1.00 15.76 N ATOM 774 CA HIS A 118 90.388 95.099 10.836 1.00 16.82 C ATOM 775 C HIS A 118 89.765 95.977 9.759 1.00 17.17 C ATOM 776 O HIS A 118 90.122 97.132 9.606 1.00 18.63 O ATOM 777 CB HIS A 118 89.418 94.953 12.006 1.00 16.64 C ATOM 778 CG HIS A 118 89.619 93.705 12.804 1.00 15.67 C ATOM 779 ND1 HIS A 118 89.113 93.542 14.073 1.00 17.75 N ATOM 780 CD2 HIS A 118 90.267 92.556 12.507 1.00 16.33 C ATOM 781 CE1 HIS A 118 89.444 92.349 14.526 1.00 17.11 C ATOM 782 NE2 HIS A 118 90.143 91.729 13.596 1.00 16.85 N ATOM 783 H HIS A 118 91.692 96.323 12.052 1.00 0.00 H ATOM 784 N ALA A 119 88.818 95.405 9.032 1.00 15.34 N ATOM 785 CA ALA A 119 88.235 96.065 7.849 1.00 16.35 C ATOM 786 C ALA A 119 87.545 97.398 8.155 1.00 16.52 C ATOM 787 O ALA A 119 87.399 98.235 7.251 1.00 16.92 O ATOM 788 CB ALA A 119 87.210 95.124 7.193 1.00 17.74 C ATOM 789 H ALA A 119 88.475 94.462 9.303 1.00 0.00 H ATOM 790 N ASP A 120 87.065 97.552 9.382 1.00 18.21 N ATOM 791 CA ASP A 120 86.290 98.727 9.739 1.00 15.05 C ATOM 792 C ASP A 120 87.156 99.847 10.281 1.00 16.19 C ATOM 793 O ASP A 120 86.654 100.860 10.734 1.00 18.45 O ATOM 794 CB ASP A 120 85.133 98.387 10.697 1.00 16.29 C ATOM 795 CG ASP A 120 85.597 97.762 12.003 1.00 19.56 C ATOM 796 OD1 ASP A 120 86.610 97.046 12.003 1.00 16.28 O ATOM 797 OD2 ASP A 120 84.918 97.988 13.021 1.00 17.83 O ATOM 798 H ASP A 120 87.246 96.821 10.099 1.00 0.00 H ATOM 799 N HIS A 121 88.464 99.654 10.210 1.00 15.89 N ATOM 800 CA HIS A 121 89.401 100.661 10.659 1.00 18.09 C ATOM 801 C HIS A 121 90.523 100.863 9.653 1.00 18.29 C ATOM 802 O HIS A 121 90.993 101.978 9.473 1.00 18.93 O ATOM 803 CB HIS A 121 89.955 100.307 12.036 1.00 17.22 C ATOM 804 CG HIS A 121 88.890 99.993 13.037 1.00 15.87 C ATOM 805 ND1 HIS A 121 88.053 100.954 13.560 1.00 17.22 N ATOM 806 CD2 HIS A 121 88.503 98.820 13.586 1.00 17.00 C ATOM 807 CE1 HIS A 121 87.206 100.386 14.396 1.00 17.12 C ATOM 808 NE2 HIS A 121 87.462 99.094 14.434 1.00 17.08 N ATOM 809 H HIS A 121 88.826 98.759 9.823 1.00 0.00 H ATOM 810 N ALA A 122 90.946 99.785 9.001 1.00 16.81 N ATOM 811 CA ALA A 122 92.007 99.906 8.005 1.00 16.83 C ATOM 812 C ALA A 122 91.445 99.752 6.601 1.00 14.95 C ATOM 813 O ALA A 122 92.194 99.674 5.626 1.00 17.80 O ATOM 814 CB ALA A 122 93.124 98.840 8.284 1.00 18.68 C ATOM 815 H ALA A 122 90.522 98.856 9.200 1.00 0.00 H ATOM 816 N GLY A 123 90.111 99.681 6.491 1.00 18.02 N ATOM 817 CA GLY A 123 89.504 99.355 5.220 1.00 18.09 C ATOM 818 C GLY A 123 90.012 100.086 3.978 1.00 16.30 C ATOM 819 O GLY A 123 90.230 99.469 2.939 1.00 19.28 O ATOM 820 H GLY A 123 89.511 99.861 7.322 1.00 0.00 H ATOM 821 N PRO A 124 90.144 101.446 4.039 1.00 16.63 N ATOM 822 CA PRO A 124 90.491 102.203 2.835 1.00 17.80 C ATOM 823 C PRO A 124 91.978 102.480 2.712 1.00 17.85 C ATOM 824 O PRO A 124 92.341 103.278 1.856 1.00 19.49 O ATOM 825 CB PRO A 124 89.753 103.554 3.041 1.00 21.07 C ATOM 826 CG PRO A 124 89.826 103.735 4.516 1.00 19.03 C ATOM 827 CD PRO A 124 89.723 102.321 5.164 1.00 16.93 C ATOM 828 N VAL A 125 92.787 101.823 3.565 1.00 16.92 N ATOM 829 CA VAL A 125 94.205 102.181 3.559 1.00 18.36 C ATOM 830 C VAL A 125 94.880 101.977 2.203 1.00 20.02 C ATOM 831 O VAL A 125 95.675 102.841 1.752 1.00 19.95 O ATOM 832 CB VAL A 125 94.955 101.415 4.670 1.00 19.17 C ATOM 833 CG1 VAL A 125 96.474 101.547 4.499 1.00 20.99 C ATOM 834 CG2 VAL A 125 94.497 102.010 6.022 1.00 19.02 C ATOM 835 H VAL A 125 92.418 101.090 4.203 1.00 0.00 H ATOM 836 N ALA A 126 94.601 100.847 1.537 1.00 16.87 N ATOM 837 CA ALA A 126 95.250 100.609 0.231 1.00 18.30 C ATOM 838 C ALA A 126 94.925 101.715 -0.753 1.00 17.90 C ATOM 839 O ALA A 126 95.797 102.219 -1.453 1.00 21.14 O ATOM 840 CB ALA A 126 94.834 99.246 -0.341 1.00 19.11 C ATOM 841 H ALA A 126 93.939 100.150 1.933 1.00 0.00 H ATOM 842 N GLU A 127 93.655 102.108 -0.774 1.00 19.38 N ATOM 843 CA GLU A 127 93.229 103.119 -1.722 1.00 18.79 C ATOM 844 C GLU A 127 93.813 104.496 -1.376 1.00 21.04 C ATOM 845 O GLU A 127 94.183 105.280 -2.266 1.00 20.99 O ATOM 846 CB GLU A 127 91.678 103.181 -1.747 1.00 18.15 C ATOM 847 CG GLU A 127 91.179 104.347 -2.583 1.00 18.99 C ATOM 848 CD GLU A 127 89.684 104.306 -2.795 1.00 24.12 C ATOM 849 OE1 GLU A 127 89.041 103.350 -2.301 1.00 23.43 O ATOM 850 OE2 GLU A 127 89.137 105.208 -3.455 1.00 26.57 O ATOM 851 H GLU A 127 92.969 101.691 -0.112 1.00 0.00 H ATOM 852 N LEU A 128 93.863 104.804 -0.077 1.00 19.05 N ATOM 853 CA LEU A 128 94.457 106.078 0.363 1.00 21.22 C ATOM 854 C LEU A 128 95.929 106.143 -0.066 1.00 19.82 C ATOM 855 O LEU A 128 96.388 107.228 -0.478 1.00 21.95 O ATOM 856 CB LEU A 128 94.336 106.267 1.868 1.00 20.23 C ATOM 857 CG LEU A 128 92.888 106.548 2.286 1.00 20.66 C ATOM 858 CD1 LEU A 128 92.796 106.391 3.818 1.00 21.90 C ATOM 859 CD2 LEU A 128 92.408 107.963 1.812 1.00 21.61 C ATOM 860 H LEU A 128 93.481 104.141 0.627 1.00 0.00 H ATOM 861 N LYS A 129 96.638 105.005 0.011 1.00 18.60 N ATOM 862 CA LYS A 129 98.051 104.986 -0.421 1.00 20.02 C ATOM 863 C LYS A 129 98.148 105.259 -1.915 1.00 24.64 C ATOM 864 O LYS A 129 99.082 105.944 -2.358 1.00 25.77 O ATOM 865 CB LYS A 129 98.744 103.658 -0.080 1.00 20.34 C ATOM 866 CG LYS A 129 98.952 103.473 1.427 1.00 20.51 C ATOM 867 CD LYS A 129 99.870 102.274 1.769 1.00 22.85 C ATOM 868 CE LYS A 129 101.286 102.589 1.345 1.00 28.10 C ATOM 869 NZ LYS A 129 102.239 101.468 1.435 1.00 21.97 N ATOM 870 HZ1 LYS A 129 102.293 101.139 2.420 1.00 0.00 H ATOM 871 HZ2 LYS A 129 101.916 100.690 0.826 1.00 0.00 H ATOM 872 HZ3 LYS A 129 103.178 101.787 1.123 1.00 0.00 H ATOM 873 H LYS A 129 96.193 104.138 0.374 1.00 0.00 H ATOM 874 N ARG A 130 97.226 104.725 -2.703 1.00 20.97 N ATOM 875 CA ARG A 130 97.233 104.955 -4.156 1.00 23.63 C ATOM 876 C ARG A 130 96.943 106.425 -4.502 1.00 23.33 C ATOM 877 O ARG A 130 97.476 106.952 -5.494 1.00 25.52 O ATOM 878 CB ARG A 130 96.231 104.046 -4.866 1.00 22.74 C ATOM 879 CG ARG A 130 96.620 102.565 -4.756 1.00 26.85 C ATOM 880 CD ARG A 130 95.878 101.716 -5.792 1.00 27.74 C ATOM 881 NE ARG A 130 94.435 101.919 -5.701 1.00 28.22 N ATOM 882 CZ ARG A 130 93.613 101.203 -4.917 1.00 26.93 C ATOM 883 NH1 ARG A 130 94.062 100.245 -4.149 1.00 26.30 N ATOM 884 NH2 ARG A 130 92.313 101.476 -4.914 1.00 29.02 N ATOM 885 HE ARG A 130 94.014 102.671 -6.284 1.00 0.00 H ATOM 886 HH12 ARG A 130 93.403 99.706 -3.551 1.00 0.00 H ATOM 887 HH11 ARG A 130 95.078 100.022 -4.136 1.00 0.00 H ATOM 888 HH22 ARG A 130 91.668 100.927 -4.310 1.00 0.00 H ATOM 889 HH21 ARG A 130 91.940 102.238 -5.515 1.00 0.00 H ATOM 890 H ARG A 130 96.482 104.131 -2.285 1.00 0.00 H ATOM 891 N ARG A 131 96.108 107.080 -3.690 1.00 21.58 N ATOM 892 CA ARG A 131 95.548 108.380 -4.045 1.00 24.14 C ATOM 893 C ARG A 131 96.227 109.531 -3.304 1.00 27.51 C ATOM 894 O ARG A 131 95.899 110.677 -3.543 1.00 30.11 O ATOM 895 CB ARG A 131 94.032 108.382 -3.778 1.00 23.94 C ATOM 896 CG ARG A 131 93.281 107.349 -4.617 1.00 23.79 C ATOM 897 CD ARG A 131 91.793 107.388 -4.330 1.00 23.68 C ATOM 898 NE ARG A 131 91.169 108.674 -4.670 1.00 26.49 N ATOM 899 CZ ARG A 131 89.892 108.947 -4.398 1.00 29.93 C ATOM 900 NH1 ARG A 131 89.131 108.034 -3.752 1.00 25.20 N ATOM 901 NH2 ARG A 131 89.375 110.147 -4.705 1.00 33.27 N ATOM 902 HE ARG A 131 91.746 109.400 -5.141 1.00 0.00 H ATOM 903 HH12 ARG A 131 88.135 108.244 -3.539 1.00 0.00 H ATOM 904 HH11 ARG A 131 89.542 107.122 -3.469 1.00 0.00 H ATOM 905 HH22 ARG A 131 88.379 110.354 -4.491 1.00 0.00 H ATOM 906 HH21 ARG A 131 89.971 110.870 -5.157 1.00 0.00 H ATOM 907 H ARG A 131 95.850 106.651 -2.779 1.00 0.00 H ATOM 908 N THR A 132 97.169 109.234 -2.420 1.00 23.96 N ATOM 909 CA THR A 132 97.850 110.271 -1.668 1.00 25.45 C ATOM 910 C THR A 132 99.330 110.003 -1.550 1.00 28.61 C ATOM 911 O THR A 132 99.839 108.927 -1.947 1.00 25.71 O ATOM 912 CB THR A 132 97.314 110.406 -0.227 1.00 23.58 C ATOM 913 OG1 THR A 132 97.691 109.240 0.491 1.00 24.75 O ATOM 914 CG2 THR A 132 95.785 110.486 -0.166 1.00 26.52 C ATOM 915 HG1 THR A 132 97.300 108.443 0.053 1.00 0.00 H ATOM 916 H THR A 132 97.425 108.238 -2.262 1.00 0.00 H ATOM 917 N GLY A 133 100.031 110.933 -0.913 1.00 31.23 N ATOM 918 CA GLY A 133 101.422 110.681 -0.570 1.00 31.40 C ATOM 919 C GLY A 133 101.694 109.809 0.655 1.00 29.73 C ATOM 920 O GLY A 133 102.846 109.581 1.045 1.00 30.25 O ATOM 921 H GLY A 133 99.587 111.839 -0.660 1.00 0.00 H ATOM 922 N ALA A 134 100.646 109.271 1.253 1.00 23.88 N ATOM 923 CA ALA A 134 100.794 108.723 2.580 1.00 25.32 C ATOM 924 C ALA A 134 101.544 107.396 2.606 1.00 23.14 C ATOM 925 O ALA A 134 101.376 106.520 1.743 1.00 23.99 O ATOM 926 CB ALA A 134 99.419 108.555 3.245 1.00 24.63 C ATOM 927 H ALA A 134 99.724 109.243 0.773 1.00 0.00 H ATOM 928 N LYS A 135 102.322 107.252 3.652 1.00 20.89 N ATOM 929 CA LYS A 135 103.012 105.980 3.916 1.00 20.71 C ATOM 930 C LYS A 135 102.442 105.459 5.215 1.00 21.97 C ATOM 931 O LYS A 135 102.009 106.264 6.045 1.00 22.64 O ATOM 932 CB LYS A 135 104.499 106.197 4.005 1.00 21.85 C ATOM 933 CG LYS A 135 105.034 106.539 2.602 1.00 26.18 C ATOM 934 CD LYS A 135 106.498 106.595 2.542 1.00 28.70 C ATOM 935 CE LYS A 135 106.943 106.820 1.101 1.00 26.30 C ATOM 936 NZ LYS A 135 108.431 106.643 0.997 1.00 24.90 N ATOM 937 HZ1 LYS A 135 108.905 107.331 1.616 1.00 0.00 H ATOM 938 HZ2 LYS A 135 108.685 105.678 1.290 1.00 0.00 H ATOM 939 HZ3 LYS A 135 108.729 106.797 0.013 1.00 0.00 H ATOM 940 H LYS A 135 102.453 108.050 4.306 1.00 0.00 H ATOM 941 N VAL A 136 102.422 104.145 5.393 1.00 19.43 N ATOM 942 CA VAL A 136 101.878 103.490 6.580 1.00 18.81 C ATOM 943 C VAL A 136 102.970 103.072 7.564 1.00 19.38 C ATOM 944 O VAL A 136 103.948 102.443 7.162 1.00 19.85 O ATOM 945 CB VAL A 136 101.078 102.230 6.170 1.00 19.76 C ATOM 946 CG1 VAL A 136 100.741 101.382 7.424 1.00 21.15 C ATOM 947 CG2 VAL A 136 99.797 102.693 5.435 1.00 19.44 C ATOM 948 H VAL A 136 102.818 103.544 4.642 1.00 0.00 H ATOM 949 N ALA A 137 102.811 103.399 8.852 1.00 17.52 N ATOM 950 CA ALA A 137 103.708 102.860 9.902 1.00 17.05 C ATOM 951 C ALA A 137 102.855 101.992 10.813 1.00 16.22 C ATOM 952 O ALA A 137 101.828 102.436 11.285 1.00 18.54 O ATOM 953 CB ALA A 137 104.366 103.961 10.733 1.00 19.09 C ATOM 954 H ALA A 137 102.042 104.045 9.122 1.00 0.00 H ATOM 955 N ALA A 138 103.324 100.785 11.092 1.00 18.17 N ATOM 956 CA ALA A 138 102.581 99.882 11.943 1.00 16.78 C ATOM 957 C ALA A 138 103.517 98.868 12.562 1.00 18.00 C ATOM 958 O ALA A 138 104.616 98.658 12.078 1.00 18.27 O ATOM 959 CB ALA A 138 101.515 99.163 11.159 1.00 20.55 C ATOM 960 H ALA A 138 104.237 100.483 10.695 1.00 0.00 H ATOM 961 N ASN A 139 103.050 98.209 13.618 1.00 19.10 N ATOM 962 CA ASN A 139 103.856 97.122 14.171 1.00 18.25 C ATOM 963 C ASN A 139 103.774 95.864 13.301 1.00 16.55 C ATOM 964 O ASN A 139 103.013 95.805 12.330 1.00 16.23 O ATOM 965 CB ASN A 139 103.482 96.859 15.645 1.00 17.44 C ATOM 966 CG ASN A 139 102.047 96.394 15.871 1.00 18.31 C ATOM 967 OD1 ASN A 139 101.374 95.866 15.000 1.00 18.73 O ATOM 968 ND2 ASN A 139 101.584 96.605 17.102 1.00 19.66 N ATOM 969 HD22 ASN A 139 102.190 97.058 17.815 1.00 0.00 H ATOM 970 HD21 ASN A 139 100.616 96.317 17.350 1.00 0.00 H ATOM 971 H ASN A 139 102.134 98.461 14.040 1.00 0.00 H ATOM 972 N ALA A 140 104.663 94.907 13.561 1.00 15.33 N ATOM 973 CA ALA A 140 104.751 93.757 12.689 1.00 14.86 C ATOM 974 C ALA A 140 103.450 92.976 12.582 1.00 17.15 C ATOM 975 O ALA A 140 103.092 92.514 11.481 1.00 16.71 O ATOM 976 CB ALA A 140 105.863 92.818 13.177 1.00 16.06 C ATOM 977 H ALA A 140 105.290 94.986 14.387 1.00 0.00 H ATOM 978 N GLU A 141 102.768 92.836 13.711 1.00 16.69 N ATOM 979 CA GLU A 141 101.530 92.071 13.707 1.00 16.03 C ATOM 980 C GLU A 141 100.506 92.780 12.819 1.00 16.05 C ATOM 981 O GLU A 141 99.831 92.143 12.011 1.00 17.81 O ATOM 982 CB GLU A 141 100.985 91.901 15.117 1.00 17.92 C ATOM 983 CG GLU A 141 101.721 90.820 15.952 1.00 16.17 C ATOM 984 CD GLU A 141 101.409 89.391 15.534 1.00 20.28 C ATOM 985 OE1 GLU A 141 100.657 89.148 14.567 1.00 20.55 O ATOM 986 OE2 GLU A 141 101.975 88.492 16.195 1.00 21.69 O ATOM 987 H GLU A 141 103.115 93.269 14.591 1.00 0.00 H ATOM 988 N SER A 142 100.348 94.086 13.008 1.00 16.42 N ATOM 989 CA SER A 142 99.401 94.785 12.144 1.00 16.57 C ATOM 990 C SER A 142 99.815 94.796 10.686 1.00 17.83 C ATOM 991 O SER A 142 98.972 94.692 9.802 1.00 17.52 O ATOM 992 CB SER A 142 99.191 96.209 12.671 1.00 16.42 C ATOM 993 OG SER A 142 98.563 96.194 13.959 1.00 18.92 O ATOM 994 HG SER A 142 97.682 95.748 13.890 1.00 0.00 H ATOM 995 H SER A 142 100.880 94.592 13.745 1.00 0.00 H ATOM 996 N ALA A 143 101.118 94.878 10.403 1.00 15.39 N ATOM 997 CA ALA A 143 101.585 94.873 9.037 1.00 15.83 C ATOM 998 C ALA A 143 101.231 93.562 8.355 1.00 17.64 C ATOM 999 O ALA A 143 100.869 93.570 7.177 1.00 19.45 O ATOM 1000 CB ALA A 143 103.112 95.065 8.936 1.00 16.78 C ATOM 1001 H ALA A 143 101.807 94.947 11.179 1.00 0.00 H ATOM 1002 N VAL A 144 101.418 92.420 9.054 1.00 16.72 N ATOM 1003 CA VAL A 144 101.181 91.153 8.347 1.00 16.67 C ATOM 1004 C VAL A 144 99.673 90.960 8.137 1.00 16.77 C ATOM 1005 O VAL A 144 99.293 90.429 7.086 1.00 19.64 O ATOM 1006 CB VAL A 144 101.778 89.917 9.054 1.00 20.96 C ATOM 1007 CG1 VAL A 144 103.290 90.092 9.178 1.00 20.06 C ATOM 1008 CG2 VAL A 144 101.140 89.623 10.373 1.00 22.27 C ATOM 1009 H VAL A 144 101.717 92.437 10.050 1.00 0.00 H ATOM 1010 N LEU A 145 98.858 91.462 9.054 1.00 16.34 N ATOM 1011 CA LEU A 145 97.409 91.294 8.886 1.00 15.70 C ATOM 1012 C LEU A 145 96.910 92.243 7.785 1.00 16.92 C ATOM 1013 O LEU A 145 96.092 91.857 6.946 1.00 17.59 O ATOM 1014 CB LEU A 145 96.680 91.552 10.218 1.00 17.27 C ATOM 1015 CG LEU A 145 95.144 91.409 10.218 1.00 15.36 C ATOM 1016 CD1 LEU A 145 94.710 89.949 9.772 1.00 16.37 C ATOM 1017 CD2 LEU A 145 94.605 91.718 11.620 1.00 15.97 C ATOM 1018 H LEU A 145 99.239 91.967 9.880 1.00 0.00 H ATOM 1019 N LEU A 146 97.455 93.462 7.770 1.00 15.70 N ATOM 1020 CA LEU A 146 97.133 94.440 6.726 1.00 15.31 C ATOM 1021 C LEU A 146 97.515 93.898 5.321 1.00 18.43 C ATOM 1022 O LEU A 146 96.763 94.025 4.359 1.00 17.35 O ATOM 1023 CB LEU A 146 97.888 95.753 7.045 1.00 15.79 C ATOM 1024 CG LEU A 146 97.608 96.933 6.099 1.00 17.59 C ATOM 1025 CD1 LEU A 146 96.190 97.516 6.327 1.00 18.79 C ATOM 1026 CD2 LEU A 146 98.630 98.044 6.364 1.00 19.12 C ATOM 1027 H LEU A 146 98.126 93.725 8.519 1.00 0.00 H ATOM 1028 N ALA A 147 98.686 93.258 5.229 1.00 16.43 N ATOM 1029 CA ALA A 147 99.187 92.746 3.975 1.00 19.64 C ATOM 1030 C ALA A 147 98.362 91.586 3.465 1.00 18.66 C ATOM 1031 O ALA A 147 98.420 91.295 2.272 1.00 21.16 O ATOM 1032 CB ALA A 147 100.661 92.327 4.144 1.00 21.02 C ATOM 1033 H ALA A 147 99.255 93.125 6.089 1.00 0.00 H ATOM 1034 N ARG A 148 97.612 90.905 4.350 1.00 17.06 N ATOM 1035 CA ARG A 148 96.746 89.883 3.805 1.00 18.21 C ATOM 1036 C ARG A 148 95.267 90.371 3.773 1.00 18.76 C ATOM 1037 O ARG A 148 94.320 89.554 3.616 1.00 19.07 O ATOM 1038 CB ARG A 148 96.961 88.561 4.560 1.00 25.02 C ATOM 1039 CG ARG A 148 96.506 88.442 5.933 1.00 24.24 C ATOM 1040 CD ARG A 148 96.928 86.979 6.475 1.00 20.92 C ATOM 1041 NE ARG A 148 96.423 86.773 7.824 1.00 21.22 N ATOM 1042 CZ ARG A 148 97.137 86.717 8.940 1.00 25.64 C ATOM 1043 NH1 ARG A 148 98.473 86.888 8.920 1.00 26.41 N ATOM 1044 NH2 ARG A 148 96.505 86.457 10.092 1.00 22.89 N ATOM 1045 HE ARG A 148 95.394 86.658 7.923 1.00 0.00 H ATOM 1046 HH12 ARG A 148 99.017 86.841 9.805 1.00 0.00 H ATOM 1047 HH11 ARG A 148 98.961 87.067 8.019 1.00 0.00 H ATOM 1048 HH22 ARG A 148 97.043 86.408 10.981 1.00 0.00 H ATOM 1049 HH21 ARG A 148 95.476 86.304 10.098 1.00 0.00 H ATOM 1050 H ARG A 148 97.653 91.103 5.370 1.00 0.00 H ATOM 1051 N GLY A 149 95.088 91.688 3.867 1.00 17.49 N ATOM 1052 CA GLY A 149 93.737 92.280 3.793 1.00 17.44 C ATOM 1053 C GLY A 149 92.766 91.722 4.835 1.00 17.11 C ATOM 1054 O GLY A 149 91.539 91.571 4.577 1.00 19.42 O ATOM 1055 H GLY A 149 95.913 92.309 3.994 1.00 0.00 H ATOM 1056 N GLY A 150 93.294 91.393 6.016 1.00 16.13 N ATOM 1057 CA GLY A 150 92.449 90.885 7.103 1.00 17.40 C ATOM 1058 C GLY A 150 91.975 89.446 6.920 1.00 16.90 C ATOM 1059 O GLY A 150 91.213 88.954 7.740 1.00 17.75 O ATOM 1060 H GLY A 150 94.317 91.498 6.168 1.00 0.00 H ATOM 1061 N SER A 151 92.462 88.761 5.898 1.00 16.21 N ATOM 1062 CA SER A 151 92.091 87.365 5.717 1.00 20.02 C ATOM 1063 C SER A 151 92.837 86.485 6.699 1.00 17.56 C ATOM 1064 O SER A 151 93.798 86.933 7.332 1.00 19.43 O ATOM 1065 CB SER A 151 92.381 86.896 4.290 1.00 20.37 C ATOM 1066 OG SER A 151 93.777 86.912 4.043 1.00 20.53 O ATOM 1067 HG SER A 151 94.121 87.833 4.158 1.00 0.00 H ATOM 1068 H SER A 151 93.109 89.219 5.225 1.00 0.00 H ATOM 1069 N ASP A 152 92.327 85.272 6.852 1.00 18.52 N ATOM 1070 CA ASP A 152 92.857 84.302 7.866 1.00 19.98 C ATOM 1071 C ASP A 152 93.024 84.986 9.234 1.00 19.01 C ATOM 1072 O ASP A 152 94.066 84.908 9.903 1.00 19.82 O ATOM 1073 CB ASP A 152 94.205 83.716 7.406 1.00 18.83 C ATOM 1074 CG ASP A 152 94.661 82.543 8.297 1.00 30.74 C ATOM 1075 OD1 ASP A 152 93.791 81.825 8.837 1.00 29.26 O ATOM 1076 OD2 ASP A 152 95.873 82.377 8.419 1.00 31.48 O ATOM 1077 H ASP A 152 91.531 84.982 6.248 1.00 0.00 H ATOM 1078 N ASP A 153 92.007 85.752 9.613 1.00 17.80 N ATOM 1079 CA ASP A 153 91.913 86.338 10.924 1.00 18.42 C ATOM 1080 C ASP A 153 91.865 85.263 12.013 1.00 21.37 C ATOM 1081 O ASP A 153 91.269 84.206 11.812 1.00 21.11 O ATOM 1082 CB ASP A 153 90.659 87.209 10.976 1.00 19.04 C ATOM 1083 CG ASP A 153 90.573 88.003 12.262 1.00 16.73 C ATOM 1084 OD1 ASP A 153 91.158 89.136 12.312 1.00 17.49 O ATOM 1085 OD2 ASP A 153 90.003 87.492 13.241 1.00 19.40 O ATOM 1086 H ASP A 153 91.244 85.937 8.931 1.00 0.00 H ATOM 1087 N LEU A 154 92.498 85.514 13.156 1.00 18.88 N ATOM 1088 CA LEU A 154 92.577 84.457 14.165 1.00 16.87 C ATOM 1089 C LEU A 154 91.208 84.017 14.635 1.00 20.30 C ATOM 1090 O LEU A 154 91.029 82.863 15.027 1.00 22.08 O ATOM 1091 CB LEU A 154 93.338 84.920 15.392 1.00 19.02 C ATOM 1092 CG LEU A 154 94.766 85.397 15.165 1.00 19.79 C ATOM 1093 CD1 LEU A 154 95.483 85.617 16.521 1.00 18.67 C ATOM 1094 CD2 LEU A 154 95.569 84.472 14.206 1.00 20.57 C ATOM 1095 H LEU A 154 92.929 86.445 13.329 1.00 0.00 H ATOM 1096 N HIS A 155 90.231 84.931 14.573 1.00 19.55 N ATOM 1097 CA HIS A 155 88.887 84.616 15.045 1.00 22.53 C ATOM 1098 C HIS A 155 87.777 84.614 13.978 1.00 23.31 C ATOM 1099 O HIS A 155 86.810 83.876 14.106 1.00 24.38 O ATOM 1100 CB HIS A 155 88.473 85.609 16.123 1.00 18.33 C ATOM 1101 CG HIS A 155 89.476 85.736 17.214 1.00 18.34 C ATOM 1102 ND1 HIS A 155 89.605 84.812 18.237 1.00 18.99 N ATOM 1103 CD2 HIS A 155 90.453 86.652 17.395 1.00 20.61 C ATOM 1104 CE1 HIS A 155 90.625 85.172 19.000 1.00 18.56 C ATOM 1105 NE2 HIS A 155 91.141 86.290 18.521 1.00 18.38 N ATOM 1106 H HIS A 155 90.432 85.874 14.185 1.00 0.00 H ATOM 1107 N PHE A 156 87.935 85.458 12.959 1.00 21.37 N ATOM 1108 CA PHE A 156 86.905 85.694 11.945 1.00 20.78 C ATOM 1109 C PHE A 156 87.127 84.908 10.675 1.00 26.32 C ATOM 1110 O PHE A 156 86.270 84.886 9.804 1.00 25.87 O ATOM 1111 CB PHE A 156 86.881 87.160 11.530 1.00 23.20 C ATOM 1112 CG PHE A 156 86.589 88.095 12.638 1.00 28.66 C ATOM 1113 CD1 PHE A 156 85.792 87.704 13.683 1.00 37.53 C ATOM 1114 CD2 PHE A 156 87.111 89.372 12.637 1.00 34.87 C ATOM 1115 CE1 PHE A 156 85.519 88.559 14.704 1.00 36.47 C ATOM 1116 CE2 PHE A 156 86.835 90.229 13.658 1.00 39.23 C ATOM 1117 CZ PHE A 156 86.037 89.814 14.696 1.00 34.08 C ATOM 1118 H PHE A 156 88.834 85.975 12.880 1.00 0.00 H ATOM 1119 N GLY A 157 88.295 84.310 10.544 1.00 23.01 N ATOM 1120 CA GLY A 157 88.617 83.592 9.309 1.00 24.01 C ATOM 1121 C GLY A 157 88.716 84.545 8.130 1.00 21.25 C ATOM 1122 O GLY A 157 89.442 85.563 8.237 1.00 21.83 O ATOM 1123 H GLY A 157 88.988 84.348 11.318 1.00 0.00 H ATOM 1124 N ASP A 160 87.931 84.272 7.076 1.00 22.26 N ATOM 1125 CA ASP A 160 87.871 85.194 5.918 1.00 23.53 C ATOM 1126 C ASP A 160 86.594 85.985 5.864 1.00 25.13 C ATOM 1127 O ASP A 160 86.189 86.441 4.783 1.00 27.73 O ATOM 1128 CB ASP A 160 88.014 84.420 4.603 1.00 21.30 C ATOM 1129 CG ASP A 160 89.404 83.827 4.414 1.00 27.73 C ATOM 1130 OD1 ASP A 160 90.372 84.291 5.084 1.00 27.09 O ATOM 1131 OD2 ASP A 160 89.543 82.910 3.579 1.00 30.64 O ATOM 1132 H ASP A 160 87.359 83.404 7.072 1.00 0.00 H ATOM 1133 N GLY A 161 85.939 86.139 7.006 1.00 25.34 N ATOM 1134 CA GLY A 161 84.631 86.761 7.005 1.00 25.15 C ATOM 1135 C GLY A 161 84.638 88.260 6.869 1.00 26.54 C ATOM 1136 O GLY A 161 83.619 88.860 6.511 1.00 26.48 O ATOM 1137 H GLY A 161 86.362 85.815 7.899 1.00 0.00 H ATOM 1138 N ILE A 162 85.758 88.880 7.197 1.00 22.60 N ATOM 1139 CA ILE A 162 85.832 90.322 7.214 1.00 22.04 C ATOM 1140 C ILE A 162 87.156 90.728 6.579 1.00 28.68 C ATOM 1141 O ILE A 162 88.133 90.969 7.270 1.00 36.49 O ATOM 1142 CB ILE A 162 85.674 90.862 8.655 1.00 33.44 C ATOM 1143 CG1 ILE A 162 84.420 90.259 9.297 1.00 39.23 C ATOM 1144 CG2 ILE A 162 85.561 92.351 8.661 1.00 43.07 C ATOM 1145 CD1 ILE A 162 84.067 90.772 10.667 1.00 41.73 C ATOM 1146 H ILE A 162 86.599 88.321 7.447 1.00 0.00 H ATOM 1147 N THR A 163 87.179 90.764 5.252 1.00 25.92 N ATOM 1148 CA THR A 163 88.416 91.068 4.498 1.00 25.02 C ATOM 1149 C THR A 163 88.300 92.439 3.824 1.00 24.86 C ATOM 1150 O THR A 163 87.194 92.994 3.704 1.00 26.46 O ATOM 1151 CB THR A 163 88.714 90.028 3.430 1.00 26.13 C ATOM 1152 OG1 THR A 163 87.619 89.943 2.504 1.00 27.66 O ATOM 1153 CG2 THR A 163 88.879 88.630 4.047 1.00 28.77 C ATOM 1154 HG1 THR A 163 86.797 89.684 2.990 1.00 0.00 H ATOM 1155 H THR A 163 86.302 90.573 4.727 1.00 0.00 H ATOM 1156 N TYR A 164 89.423 92.958 3.350 1.00 19.86 N ATOM 1157 CA TYR A 164 89.433 94.278 2.738 1.00 19.56 C ATOM 1158 C TYR A 164 90.665 94.326 1.854 1.00 17.05 C ATOM 1159 O TYR A 164 91.496 93.403 1.892 1.00 18.91 O ATOM 1160 CB TYR A 164 89.450 95.368 3.807 1.00 22.07 C ATOM 1161 CG TYR A 164 90.612 95.262 4.768 1.00 18.29 C ATOM 1162 CD1 TYR A 164 90.520 94.475 5.903 1.00 17.49 C ATOM 1163 CD2 TYR A 164 91.797 95.939 4.534 1.00 21.09 C ATOM 1164 CE1 TYR A 164 91.595 94.340 6.796 1.00 18.08 C ATOM 1165 CE2 TYR A 164 92.849 95.848 5.402 1.00 23.94 C ATOM 1166 CZ TYR A 164 92.743 95.060 6.552 1.00 18.85 C ATOM 1167 OH TYR A 164 93.793 94.953 7.416 1.00 23.68 O ATOM 1168 HH TYR A 164 93.541 94.360 8.168 1.00 0.00 H ATOM 1169 H TYR A 164 90.308 92.416 3.416 1.00 0.00 H ATOM 1170 N PRO A 165 90.818 95.364 1.017 1.00 18.01 N ATOM 1171 CA PRO A 165 91.972 95.373 0.105 1.00 18.12 C ATOM 1172 C PRO A 165 93.330 95.404 0.824 1.00 16.59 C ATOM 1173 O PRO A 165 93.543 96.214 1.722 1.00 19.20 O ATOM 1174 CB PRO A 165 91.782 96.683 -0.696 1.00 16.50 C ATOM 1175 CG PRO A 165 90.251 96.863 -0.665 1.00 19.62 C ATOM 1176 CD PRO A 165 89.885 96.490 0.789 1.00 17.78 C ATOM 1177 N PRO A 166 94.232 94.498 0.470 1.00 16.83 N ATOM 1178 CA PRO A 166 95.492 94.480 1.245 1.00 17.11 C ATOM 1179 C PRO A 166 96.381 95.686 1.002 1.00 18.79 C ATOM 1180 O PRO A 166 96.325 96.289 -0.079 1.00 20.03 O ATOM 1181 CB PRO A 166 96.208 93.216 0.755 1.00 20.27 C ATOM 1182 CG PRO A 166 95.570 92.839 -0.508 1.00 22.81 C ATOM 1183 CD PRO A 166 94.136 93.407 -0.509 1.00 18.68 C ATOM 1184 N ALA A 168 97.228 95.991 1.988 1.00 16.97 N ATOM 1185 CA ALA A 168 98.178 97.096 1.804 1.00 17.54 C ATOM 1186 C ALA A 168 99.452 96.741 2.505 1.00 20.24 C ATOM 1187 O ALA A 168 99.460 95.941 3.452 1.00 20.22 O ATOM 1188 CB ALA A 168 97.595 98.441 2.387 1.00 21.46 C ATOM 1189 H ALA A 168 97.215 95.452 2.877 1.00 0.00 H ATOM 1190 N ASN A 169 100.537 97.360 2.040 1.00 21.53 N ATOM 1191 CA ASN A 169 101.848 97.125 2.642 1.00 21.65 C ATOM 1192 C ASN A 169 102.199 98.244 3.615 1.00 23.52 C ATOM 1193 O ASN A 169 101.903 99.401 3.336 1.00 25.11 O ATOM 1194 CB ASN A 169 102.905 97.076 1.554 1.00 28.66 C ATOM 1195 CG ASN A 169 102.759 95.856 0.683 1.00 33.30 C ATOM 1196 OD1 ASN A 169 102.516 94.775 1.195 1.00 33.20 O ATOM 1197 ND2 ASN A 169 102.881 96.025 -0.623 1.00 36.44 N ATOM 1198 HD22 ASN A 169 103.089 96.968 -1.008 1.00 0.00 H ATOM 1199 HD21 ASN A 169 102.769 95.214 -1.265 1.00 0.00 H ATOM 1200 H ASN A 169 100.450 98.018 1.239 1.00 0.00 H ATOM 1201 N ALA A 170 102.799 97.897 4.756 1.00 24.13 N ATOM 1202 CA ALA A 170 103.390 98.910 5.649 1.00 23.23 C ATOM 1203 C ALA A 170 104.714 99.391 5.095 1.00 22.88 C ATOM 1204 O ALA A 170 105.478 98.610 4.525 1.00 23.73 O ATOM 1205 CB ALA A 170 103.594 98.325 7.068 1.00 20.75 C ATOM 1206 H ALA A 170 102.850 96.892 5.020 1.00 0.00 H ATOM 1207 N ASP A 171 105.016 100.679 5.270 1.00 19.84 N ATOM 1208 CA ASP A 171 106.272 101.257 4.815 1.00 20.71 C ATOM 1209 C ASP A 171 107.333 101.336 5.918 1.00 23.54 C ATOM 1210 O ASP A 171 108.533 101.435 5.648 1.00 25.40 O ATOM 1211 CB ASP A 171 105.984 102.654 4.296 1.00 20.36 C ATOM 1212 CG ASP A 171 105.040 102.611 3.157 1.00 25.02 C ATOM 1213 OD1 ASP A 171 105.489 102.369 2.026 1.00 34.07 O ATOM 1214 OD2 ASP A 171 103.869 102.820 3.370 1.00 21.76 O ATOM 1215 H ASP A 171 104.328 101.293 5.750 1.00 0.00 H ATOM 1216 N ARG A 172 106.866 101.294 7.164 1.00 19.67 N ATOM 1217 CA ARG A 172 107.730 101.369 8.329 1.00 20.82 C ATOM 1218 C ARG A 172 107.161 100.451 9.387 1.00 19.79 C ATOM 1219 O ARG A 172 105.959 100.498 9.633 1.00 19.52 O ATOM 1220 CB ARG A 172 107.780 102.814 8.860 1.00 20.44 C ATOM 1221 CG ARG A 172 108.588 102.960 10.136 1.00 21.16 C ATOM 1222 CD ARG A 172 108.682 104.446 10.530 1.00 21.87 C ATOM 1223 NE ARG A 172 109.407 104.599 11.779 1.00 22.34 N ATOM 1224 CZ ARG A 172 109.693 105.792 12.330 1.00 22.70 C ATOM 1225 NH1 ARG A 172 109.414 106.955 11.686 1.00 22.57 N ATOM 1226 NH2 ARG A 172 110.378 105.804 13.469 1.00 24.38 N ATOM 1227 HE ARG A 172 109.722 103.740 12.274 1.00 0.00 H ATOM 1228 HH12 ARG A 172 109.645 107.865 12.133 1.00 0.00 H ATOM 1229 HH11 ARG A 172 108.970 106.935 10.746 1.00 0.00 H ATOM 1230 HH22 ARG A 172 110.617 106.709 13.923 1.00 0.00 H ATOM 1231 HH21 ARG A 172 110.675 104.909 13.906 1.00 0.00 H ATOM 1232 H ARG A 172 105.840 101.204 7.309 1.00 0.00 H ATOM 1233 N ILE A 173 108.018 99.657 10.021 1.00 19.22 N ATOM 1234 CA ILE A 173 107.596 98.800 11.145 1.00 17.94 C ATOM 1235 C ILE A 173 107.981 99.487 12.461 1.00 19.90 C ATOM 1236 O ILE A 173 109.128 99.930 12.595 1.00 20.62 O ATOM 1237 CB ILE A 173 108.291 97.429 11.069 1.00 20.08 C ATOM 1238 CG1 ILE A 173 107.873 96.730 9.774 1.00 20.46 C ATOM 1239 CG2 ILE A 173 107.926 96.566 12.291 1.00 18.83 C ATOM 1240 CD1 ILE A 173 106.356 96.438 9.683 1.00 21.75 C ATOM 1241 H ILE A 173 109.012 99.640 9.717 1.00 0.00 H ATOM 1242 N VAL A 174 107.031 99.643 13.377 1.00 19.21 N ATOM 1243 CA VAL A 174 107.352 100.266 14.668 1.00 20.60 C ATOM 1244 C VAL A 174 107.343 99.234 15.812 1.00 20.82 C ATOM 1245 O VAL A 174 106.662 98.193 15.748 1.00 19.28 O ATOM 1246 CB VAL A 174 106.400 101.411 15.015 1.00 25.85 C ATOM 1247 CG1 VAL A 174 106.590 102.604 14.042 1.00 30.03 C ATOM 1248 CG2 VAL A 174 105.027 100.980 14.963 1.00 21.03 C ATOM 1249 H VAL A 174 106.061 99.324 13.180 1.00 0.00 H ATOM 1250 N MET A 175 108.169 99.539 16.814 1.00 18.88 N ATOM 1251 CA MET A 175 108.314 98.725 18.009 1.00 18.33 C ATOM 1252 C MET A 175 107.563 99.369 19.158 1.00 19.76 C ATOM 1253 O MET A 175 107.221 100.548 19.079 1.00 20.91 O ATOM 1254 CB MET A 175 109.782 98.569 18.371 1.00 19.36 C ATOM 1255 CG MET A 175 110.533 97.696 17.365 1.00 19.34 C ATOM 1256 SD MET A 175 110.057 95.959 17.540 1.00 20.74 S ATOM 1257 CE MET A 175 110.929 95.535 19.065 1.00 19.83 C ATOM 1258 H MET A 175 108.739 100.405 16.736 1.00 0.00 H ATOM 1259 N ASP A 176 107.340 98.603 20.220 1.00 17.60 N ATOM 1260 CA ASP A 176 106.553 99.145 21.341 1.00 19.30 C ATOM 1261 C ASP A 176 107.304 100.321 21.950 1.00 19.07 C ATOM 1262 O ASP A 176 108.499 100.228 22.239 1.00 20.24 O ATOM 1263 CB ASP A 176 106.335 98.042 22.379 1.00 20.72 C ATOM 1264 CG ASP A 176 105.202 98.357 23.338 1.00 21.68 C ATOM 1265 OD1 ASP A 176 104.517 99.410 23.217 1.00 17.90 O ATOM 1266 OD2 ASP A 176 105.014 97.509 24.228 1.00 22.98 O ATOM 1267 H ASP A 176 107.716 97.634 20.259 1.00 0.00 H ATOM 1268 N GLY A 177 106.582 101.426 22.137 1.00 20.23 N ATOM 1269 CA GLY A 177 107.165 102.598 22.770 1.00 21.19 C ATOM 1270 C GLY A 177 107.905 103.471 21.795 1.00 19.87 C ATOM 1271 O GLY A 177 108.414 104.526 22.195 1.00 21.46 O ATOM 1272 H GLY A 177 105.590 101.450 21.826 1.00 0.00 H ATOM 1273 N GLU A 178 107.997 103.047 20.531 1.00 19.54 N ATOM 1274 CA GLU A 178 108.691 103.894 19.536 1.00 19.45 C ATOM 1275 C GLU A 178 107.903 105.161 19.180 1.00 23.83 C ATOM 1276 O GLU A 178 106.640 105.164 19.218 1.00 21.64 O ATOM 1277 CB GLU A 178 108.965 103.055 18.265 1.00 21.14 C ATOM 1278 CG GLU A 178 109.660 103.851 17.145 1.00 22.77 C ATOM 1279 CD GLU A 178 110.254 102.922 16.069 1.00 23.73 C ATOM 1280 OE1 GLU A 178 110.014 101.696 16.119 1.00 21.11 O ATOM 1281 OE2 GLU A 178 110.985 103.416 15.170 1.00 23.81 O ATOM 1282 H GLU A 178 107.586 102.134 20.250 1.00 0.00 H ATOM 1283 N VAL A 179 108.634 106.237 18.858 1.00 21.07 N ATOM 1284 CA VAL A 179 107.997 107.542 18.539 1.00 23.47 C ATOM 1285 C VAL A 179 108.124 107.845 17.061 1.00 31.60 C ATOM 1286 O VAL A 179 109.109 107.457 16.380 1.00 28.84 O ATOM 1287 CB VAL A 179 108.559 108.688 19.337 1.00 32.14 C ATOM 1288 CG1 VAL A 179 108.565 108.354 20.799 1.00 27.39 C ATOM 1289 CG2 VAL A 179 109.943 109.067 18.828 1.00 37.13 C ATOM 1290 H VAL A 179 109.671 106.157 18.831 1.00 0.00 H ATOM 1291 N ILE A 180 107.095 108.490 16.535 1.00 25.71 N ATOM 1292 CA ILE A 180 107.174 109.036 15.202 1.00 26.58 C ATOM 1293 C ILE A 180 106.800 110.483 15.320 1.00 29.57 C ATOM 1294 O ILE A 180 105.802 110.831 15.967 1.00 27.58 O ATOM 1295 CB ILE A 180 106.231 108.355 14.219 1.00 28.80 C ATOM 1296 CG1 ILE A 180 106.580 106.875 14.152 1.00 30.67 C ATOM 1297 CG2 ILE A 180 106.348 109.012 12.840 1.00 33.51 C ATOM 1298 CD1 ILE A 180 105.660 106.080 13.318 1.00 32.76 C ATOM 1299 H ILE A 180 106.221 108.604 17.088 1.00 0.00 H ATOM 1300 N THR A 181 107.619 111.327 14.736 1.00 30.32 N ATOM 1301 CA THR A 181 107.392 112.755 14.838 1.00 32.57 C ATOM 1302 C THR A 181 107.019 113.349 13.490 1.00 34.36 C ATOM 1303 O THR A 181 107.713 113.127 12.500 1.00 33.45 O ATOM 1304 CB THR A 181 108.650 113.447 15.398 1.00 43.40 C ATOM 1305 OG1 THR A 181 108.848 113.056 16.771 1.00 43.69 O ATOM 1306 CG2 THR A 181 108.477 114.961 15.323 1.00 39.00 C ATOM 1307 HG1 THR A 181 109.657 113.503 17.127 1.00 0.00 H ATOM 1308 H THR A 181 108.434 110.969 14.198 1.00 0.00 H ATOM 1309 N VAL A 182 105.946 114.145 13.431 1.00 34.27 N ATOM 1310 CA VAL A 182 105.574 114.761 12.173 1.00 31.25 C ATOM 1311 C VAL A 182 105.241 116.218 12.437 1.00 34.81 C ATOM 1312 O VAL A 182 104.448 116.501 13.365 1.00 32.51 O ATOM 1313 CB VAL A 182 104.344 114.124 11.523 1.00 30.30 C ATOM 1314 CG1 VAL A 182 103.928 114.895 10.268 1.00 29.00 C ATOM 1315 CG2 VAL A 182 104.559 112.644 11.220 1.00 30.08 C ATOM 1316 H VAL A 182 105.380 114.321 14.285 1.00 0.00 H ATOM 1317 N GLY A 183 105.878 117.124 11.664 1.00 36.59 N ATOM 1318 CA GLY A 183 105.632 118.554 11.761 1.00 38.59 C ATOM 1319 C GLY A 183 105.717 118.947 13.213 1.00 32.84 C ATOM 1320 O GLY A 183 104.969 119.798 13.670 1.00 41.43 O ATOM 1321 H GLY A 183 106.574 116.785 10.970 1.00 0.00 H ATOM 1322 N GLY A 184 106.595 118.278 13.942 1.00 43.73 N ATOM 1323 CA GLY A 184 106.711 118.433 15.381 1.00 41.51 C ATOM 1324 C GLY A 184 105.630 117.965 16.343 1.00 49.12 C ATOM 1325 O GLY A 184 105.636 118.374 17.504 1.00 52.77 O ATOM 1326 H GLY A 184 107.232 117.610 13.462 1.00 0.00 H ATOM 1327 N ILE A 185 104.671 117.149 15.896 1.00 40.14 N ATOM 1328 CA ILE A 185 103.783 116.467 16.841 1.00 35.00 C ATOM 1329 C ILE A 185 104.377 115.060 17.061 1.00 32.07 C ATOM 1330 O ILE A 185 104.715 114.386 16.087 1.00 34.49 O ATOM 1331 CB ILE A 185 102.304 116.363 16.315 1.00 31.77 C ATOM 1332 CG1 ILE A 185 101.655 117.754 16.269 1.00 36.15 C ATOM 1333 CG2 ILE A 185 101.446 115.555 17.225 1.00 31.30 C ATOM 1334 CD1 ILE A 185 101.328 118.378 17.706 1.00 47.31 C ATOM 1335 H ILE A 185 104.554 116.997 14.874 1.00 0.00 H ATOM 1336 N VAL A 186 104.503 114.646 18.319 1.00 33.27 N ATOM 1337 CA VAL A 186 105.207 113.378 18.629 1.00 34.03 C ATOM 1338 C VAL A 186 104.171 112.302 18.984 1.00 31.47 C ATOM 1339 O VAL A 186 103.530 112.401 20.072 1.00 29.18 O ATOM 1340 CB VAL A 186 106.165 113.527 19.816 1.00 36.15 C ATOM 1341 CG1 VAL A 186 106.960 112.231 20.021 1.00 40.92 C ATOM 1342 CG2 VAL A 186 107.085 114.730 19.625 1.00 38.32 C ATOM 1343 H VAL A 186 104.104 115.217 19.092 1.00 0.00 H ATOM 1344 N PHE A 187 104.101 111.261 18.144 1.00 27.00 N ATOM 1345 CA PHE A 187 103.208 110.118 18.360 1.00 25.23 C ATOM 1346 C PHE A 187 103.968 108.946 18.965 1.00 26.86 C ATOM 1347 O PHE A 187 104.983 108.542 18.394 1.00 27.40 O ATOM 1348 CB PHE A 187 102.581 109.648 17.051 1.00 25.65 C ATOM 1349 CG PHE A 187 101.794 110.685 16.364 1.00 23.09 C ATOM 1350 CD1 PHE A 187 102.378 111.538 15.457 1.00 23.00 C ATOM 1351 CD2 PHE A 187 100.405 110.827 16.630 1.00 22.16 C ATOM 1352 CE1 PHE A 187 101.678 112.512 14.858 1.00 27.73 C ATOM 1353 CE2 PHE A 187 99.700 111.800 16.004 1.00 24.22 C ATOM 1354 CZ PHE A 187 100.287 112.616 15.109 1.00 25.30 C ATOM 1355 H PHE A 187 104.708 111.263 17.300 1.00 0.00 H ATOM 1356 N THR A 188 103.456 108.370 20.056 1.00 25.35 N ATOM 1357 CA THR A 188 104.091 107.229 20.701 1.00 26.35 C ATOM 1358 C THR A 188 103.187 106.017 20.592 1.00 23.51 C ATOM 1359 O THR A 188 101.996 106.111 20.937 1.00 21.84 O ATOM 1360 CB THR A 188 104.406 107.458 22.204 1.00 26.77 C ATOM 1361 OG1 THR A 188 105.208 108.648 22.372 1.00 27.65 O ATOM 1362 CG2 THR A 188 105.137 106.246 22.807 1.00 29.85 C ATOM 1363 HG1 THR A 188 105.401 108.781 23.334 1.00 0.00 H ATOM 1364 H THR A 188 102.575 108.749 20.458 1.00 0.00 H ATOM 1365 N ALA A 189 103.766 104.900 20.159 1.00 23.93 N ATOM 1366 CA ALA A 189 103.045 103.619 20.123 1.00 21.75 C ATOM 1367 C ALA A 189 103.046 102.910 21.444 1.00 21.43 C ATOM 1368 O ALA A 189 104.096 102.773 22.080 1.00 23.64 O ATOM 1369 CB ALA A 189 103.650 102.707 19.081 1.00 20.40 C ATOM 1370 H ALA A 189 104.755 104.934 19.838 1.00 0.00 H ATOM 1371 N HIS A 190 101.861 102.415 21.871 1.00 20.55 N ATOM 1372 CA HIS A 190 101.814 101.610 23.085 1.00 20.03 C ATOM 1373 C HIS A 190 101.097 100.318 22.709 1.00 20.22 C ATOM 1374 O HIS A 190 99.860 100.327 22.489 1.00 20.26 O ATOM 1375 CB HIS A 190 101.054 102.285 24.234 1.00 19.86 C ATOM 1376 CG HIS A 190 101.481 103.701 24.526 1.00 20.49 C ATOM 1377 ND1 HIS A 190 102.153 104.053 25.671 1.00 27.40 N ATOM 1378 CD2 HIS A 190 101.273 104.849 23.836 1.00 22.17 C ATOM 1379 CE1 HIS A 190 102.333 105.368 25.688 1.00 24.91 C ATOM 1380 NE2 HIS A 190 101.838 105.866 24.570 1.00 25.12 N ATOM 1381 H HIS A 190 100.990 102.608 21.337 1.00 0.00 H ATOM 1382 N PHE A 191 101.815 99.203 22.665 1.00 18.72 N ATOM 1383 CA PHE A 191 101.138 97.989 22.220 1.00 19.40 C ATOM 1384 C PHE A 191 100.136 97.536 23.266 1.00 16.48 C ATOM 1385 O PHE A 191 100.439 97.596 24.476 1.00 19.72 O ATOM 1386 CB PHE A 191 102.168 96.874 21.995 1.00 20.01 C ATOM 1387 CG PHE A 191 103.076 97.069 20.796 1.00 19.27 C ATOM 1388 CD1 PHE A 191 103.093 98.247 20.031 1.00 22.04 C ATOM 1389 CD2 PHE A 191 103.901 95.992 20.407 1.00 22.44 C ATOM 1390 CE1 PHE A 191 103.961 98.369 18.914 1.00 23.38 C ATOM 1391 CE2 PHE A 191 104.771 96.130 19.293 1.00 23.53 C ATOM 1392 CZ PHE A 191 104.785 97.303 18.559 1.00 22.28 C ATOM 1393 H PHE A 191 102.819 99.195 22.936 1.00 0.00 H ATOM 1394 N MET A 193 98.980 97.063 22.802 1.00 16.79 N ATOM 1395 CA MET A 193 97.912 96.574 23.673 1.00 16.28 C ATOM 1396 C MET A 193 97.218 95.417 22.994 1.00 17.94 C ATOM 1397 O MET A 193 96.023 95.455 22.687 1.00 17.80 O ATOM 1398 CB MET A 193 96.925 97.717 24.024 1.00 15.48 C ATOM 1399 CG MET A 193 96.489 98.515 22.834 1.00 16.88 C ATOM 1400 SD MET A 193 95.252 99.728 23.310 1.00 18.62 S ATOM 1401 CE MET A 193 93.894 98.599 23.637 1.00 16.36 C ATOM 1402 H MET A 193 98.830 97.041 21.773 1.00 0.00 H ATOM 1403 N ALA A 194 98.021 94.381 22.786 1.00 16.87 N ATOM 1404 CA ALA A 194 97.554 93.176 22.118 1.00 16.28 C ATOM 1405 C ALA A 194 96.326 92.576 22.772 1.00 16.76 C ATOM 1406 O ALA A 194 96.249 92.493 23.990 1.00 17.26 O ATOM 1407 CB ALA A 194 98.680 92.128 22.144 1.00 16.63 C ATOM 1408 H ALA A 194 99.008 94.432 23.108 1.00 0.00 H ATOM 1409 N GLY A 195 95.446 92.035 21.952 1.00 16.64 N ATOM 1410 CA GLY A 195 94.335 91.221 22.491 1.00 17.22 C ATOM 1411 C GLY A 195 93.239 91.203 21.430 1.00 16.42 C ATOM 1412 O GLY A 195 92.969 90.205 20.773 1.00 18.34 O ATOM 1413 H GLY A 195 95.533 92.181 20.926 1.00 0.00 H ATOM 1414 N HIS A 196 92.614 92.353 21.211 1.00 13.82 N ATOM 1415 CA HIS A 196 91.597 92.448 20.166 1.00 12.90 C ATOM 1416 C HIS A 196 92.123 91.970 18.803 1.00 16.21 C ATOM 1417 O HIS A 196 91.462 91.218 18.105 1.00 16.05 O ATOM 1418 CB HIS A 196 91.019 93.855 20.071 1.00 16.46 C ATOM 1419 CG HIS A 196 89.915 93.975 19.072 1.00 16.77 C ATOM 1420 ND1 HIS A 196 88.618 93.618 19.354 1.00 17.98 N ATOM 1421 CD2 HIS A 196 89.921 94.389 17.785 1.00 17.67 C ATOM 1422 CE1 HIS A 196 87.870 93.817 18.287 1.00 17.40 C ATOM 1423 NE2 HIS A 196 88.637 94.281 17.320 1.00 18.43 N ATOM 1424 H HIS A 196 92.848 93.188 21.784 1.00 0.00 H ATOM 1425 N THR A 197 93.316 92.429 18.447 1.00 16.41 N ATOM 1426 CA THR A 197 94.167 91.756 17.485 1.00 16.10 C ATOM 1427 C THR A 197 95.533 91.681 18.116 1.00 15.90 C ATOM 1428 O THR A 197 95.841 92.446 19.063 1.00 16.24 O ATOM 1429 CB THR A 197 94.292 92.508 16.162 1.00 17.44 C ATOM 1430 OG1 THR A 197 94.943 93.766 16.399 1.00 15.86 O ATOM 1431 CG2 THR A 197 92.930 92.778 15.524 1.00 15.45 C ATOM 1432 HG1 THR A 197 95.027 94.259 15.545 1.00 0.00 H ATOM 1433 H THR A 197 93.656 93.312 18.878 1.00 0.00 H ATOM 1434 N PRO A 198 96.380 90.769 17.614 1.00 17.39 N ATOM 1435 CA PRO A 198 97.743 90.724 18.154 1.00 17.28 C ATOM 1436 C PRO A 198 98.476 92.057 18.047 1.00 17.52 C ATOM 1437 O PRO A 198 99.340 92.358 18.886 1.00 19.50 O ATOM 1438 CB PRO A 198 98.445 89.645 17.284 1.00 15.29 C ATOM 1439 CG PRO A 198 97.271 88.681 16.921 1.00 17.68 C ATOM 1440 CD PRO A 198 96.102 89.660 16.663 1.00 16.79 C ATOM 1441 N GLY A 199 98.145 92.801 17.004 1.00 15.79 N ATOM 1442 CA GLY A 199 98.872 94.039 16.704 1.00 13.75 C ATOM 1443 C GLY A 199 98.153 95.277 17.226 1.00 15.87 C ATOM 1444 O GLY A 199 98.576 96.390 16.895 1.00 17.29 O ATOM 1445 H GLY A 199 97.360 92.504 16.390 1.00 0.00 H ATOM 1446 N SER A 200 97.116 95.136 18.043 1.00 16.38 N ATOM 1447 CA SER A 200 96.398 96.335 18.605 1.00 14.08 C ATOM 1448 C SER A 200 97.347 97.314 19.297 1.00 16.64 C ATOM 1449 O SER A 200 98.237 96.904 20.042 1.00 18.90 O ATOM 1450 CB SER A 200 95.335 95.833 19.563 1.00 15.26 C ATOM 1451 OG SER A 200 94.232 95.329 18.796 1.00 16.04 O ATOM 1452 HG SER A 200 93.864 96.055 18.233 1.00 0.00 H ATOM 1453 H SER A 200 96.794 94.181 18.299 1.00 0.00 H ATOM 1454 N THR A 201 97.178 98.609 18.984 1.00 16.73 N ATOM 1455 CA THR A 201 98.121 99.642 19.417 1.00 17.74 C ATOM 1456 C THR A 201 97.309 100.830 19.940 1.00 19.84 C ATOM 1457 O THR A 201 96.292 101.177 19.302 1.00 20.50 O ATOM 1458 CB THR A 201 99.008 100.133 18.240 1.00 20.67 C ATOM 1459 OG1 THR A 201 99.742 99.034 17.685 1.00 22.09 O ATOM 1460 CG2 THR A 201 100.001 101.220 18.722 1.00 23.76 C ATOM 1461 HG1 THR A 201 99.108 98.350 17.352 1.00 0.00 H ATOM 1462 H THR A 201 96.352 98.887 18.417 1.00 0.00 H ATOM 1463 N ALA A 202 97.713 101.429 21.069 1.00 17.75 N ATOM 1464 CA ALA A 202 97.239 102.793 21.395 1.00 17.78 C ATOM 1465 C ALA A 202 98.272 103.790 20.871 1.00 21.53 C ATOM 1466 O ALA A 202 99.460 103.549 20.924 1.00 22.90 O ATOM 1467 CB ALA A 202 97.071 102.968 22.861 1.00 18.72 C ATOM 1468 H ALA A 202 98.360 100.935 21.716 1.00 0.00 H ATOM 1469 N TRP A 203 97.802 104.907 20.339 1.00 16.79 N ATOM 1470 CA TRP A 203 98.694 105.986 19.949 1.00 17.69 C ATOM 1471 C TRP A 203 98.459 107.181 20.848 1.00 20.04 C ATOM 1472 O TRP A 203 97.309 107.538 21.095 1.00 18.33 O ATOM 1473 CB TRP A 203 98.434 106.367 18.505 1.00 20.03 C ATOM 1474 CG TRP A 203 98.991 105.335 17.539 1.00 17.69 C ATOM 1475 CD1 TRP A 203 98.290 104.349 16.885 1.00 18.33 C ATOM 1476 CD2 TRP A 203 100.338 105.210 17.129 1.00 18.90 C ATOM 1477 NE1 TRP A 203 99.138 103.647 16.059 1.00 20.33 N ATOM 1478 CE2 TRP A 203 100.405 104.127 16.203 1.00 20.99 C ATOM 1479 CE3 TRP A 203 101.517 105.909 17.442 1.00 22.46 C ATOM 1480 CZ2 TRP A 203 101.593 103.732 15.603 1.00 22.67 C ATOM 1481 CZ3 TRP A 203 102.716 105.485 16.838 1.00 23.76 C ATOM 1482 CH2 TRP A 203 102.722 104.409 15.923 1.00 23.62 C ATOM 1483 HE1 TRP A 203 98.856 102.872 15.425 1.00 0.00 H ATOM 1484 H TRP A 203 96.777 105.014 20.198 1.00 0.00 H ATOM 1485 N THR A 204 99.541 107.782 21.338 1.00 20.35 N ATOM 1486 CA THR A 204 99.364 108.988 22.171 1.00 20.91 C ATOM 1487 C THR A 204 100.171 110.150 21.610 1.00 24.64 C ATOM 1488 O THR A 204 101.250 109.979 21.003 1.00 24.15 O ATOM 1489 CB THR A 204 99.769 108.756 23.638 1.00 25.10 C ATOM 1490 OG1 THR A 204 101.187 108.407 23.731 1.00 23.02 O ATOM 1491 CG2 THR A 204 98.926 107.682 24.290 1.00 21.46 C ATOM 1492 HG1 THR A 204 101.732 109.145 23.360 1.00 0.00 H ATOM 1493 H THR A 204 100.491 107.410 21.138 1.00 0.00 H ATOM 1494 N TRP A 205 99.621 111.366 21.787 1.00 20.73 N ATOM 1495 CA TRP A 205 100.346 112.593 21.424 1.00 23.86 C ATOM 1496 C TRP A 205 99.812 113.743 22.225 1.00 27.22 C ATOM 1497 O TRP A 205 98.734 113.658 22.808 1.00 25.40 O ATOM 1498 CB TRP A 205 100.251 112.922 19.919 1.00 25.77 C ATOM 1499 CG TRP A 205 98.831 113.155 19.374 1.00 24.23 C ATOM 1500 CD1 TRP A 205 98.284 114.350 19.023 1.00 24.86 C ATOM 1501 CD2 TRP A 205 97.835 112.146 19.073 1.00 19.52 C ATOM 1502 NE1 TRP A 205 96.987 114.164 18.543 1.00 25.47 N ATOM 1503 CE2 TRP A 205 96.698 112.828 18.566 1.00 21.95 C ATOM 1504 CE3 TRP A 205 97.790 110.740 19.182 1.00 19.12 C ATOM 1505 CZ2 TRP A 205 95.539 112.149 18.165 1.00 21.82 C ATOM 1506 CZ3 TRP A 205 96.628 110.071 18.793 1.00 20.71 C ATOM 1507 CH2 TRP A 205 95.526 110.792 18.276 1.00 21.84 C ATOM 1508 HE1 TRP A 205 96.346 114.917 18.221 1.00 0.00 H ATOM 1509 H TRP A 205 98.664 111.439 22.188 1.00 0.00 H ATOM 1510 N THR A 206 100.594 114.816 22.251 1.00 23.60 N ATOM 1511 CA THR A 206 100.189 116.001 23.002 1.00 24.64 C ATOM 1512 C THR A 206 99.869 117.087 22.019 1.00 26.63 C ATOM 1513 O THR A 206 100.735 117.526 21.262 1.00 30.01 O ATOM 1514 CB THR A 206 101.286 116.424 23.980 1.00 26.22 C ATOM 1515 OG1 THR A 206 101.498 115.360 24.911 1.00 25.96 O ATOM 1516 CG2 THR A 206 100.891 117.698 24.783 1.00 27.56 C ATOM 1517 HG1 THR A 206 102.207 115.620 25.552 1.00 0.00 H ATOM 1518 H THR A 206 101.497 114.812 21.735 1.00 0.00 H ATOM 1519 N ASP A 207 98.622 117.575 22.081 1.00 25.86 N ATOM 1520 CA ASP A 207 98.161 118.715 21.308 1.00 25.81 C ATOM 1521 C ASP A 207 97.935 119.860 22.304 1.00 27.17 C ATOM 1522 O ASP A 207 98.397 119.790 23.442 1.00 29.76 O ATOM 1523 CB ASP A 207 96.880 118.295 20.546 1.00 25.91 C ATOM 1524 CG ASP A 207 96.562 119.171 19.373 1.00 30.54 C ATOM 1525 OD1 ASP A 207 97.098 120.292 19.274 1.00 30.11 O ATOM 1526 OD2 ASP A 207 95.752 118.753 18.515 1.00 29.68 O ATOM 1527 H ASP A 207 97.945 117.110 22.720 1.00 0.00 H ATOM 1528 N THR A 208 97.261 120.901 21.872 1.00 28.04 N ATOM 1529 CA THR A 208 96.976 122.027 22.731 1.00 29.51 C ATOM 1530 C THR A 208 95.552 122.471 22.612 1.00 32.49 C ATOM 1531 O THR A 208 94.920 122.237 21.642 1.00 29.29 O ATOM 1532 CB THR A 208 97.830 123.280 22.350 1.00 31.40 C ATOM 1533 OG1 THR A 208 97.669 123.615 20.991 1.00 32.96 O ATOM 1534 CG2 THR A 208 99.233 123.084 22.631 1.00 35.13 C ATOM 1535 HG1 THR A 208 96.716 123.816 20.813 1.00 0.00 H ATOM 1536 H THR A 208 96.924 120.915 20.888 1.00 0.00 H ATOM 1537 N ARG A 209 95.082 123.159 23.650 1.00 30.99 N ATOM 1538 CA ARG A 209 93.843 123.882 23.515 1.00 37.94 C ATOM 1539 C ARG A 209 93.867 124.910 24.659 1.00 37.78 C ATOM 1540 O ARG A 209 94.201 124.584 25.809 1.00 38.30 O ATOM 1541 CB ARG A 209 92.647 122.919 23.565 1.00 46.98 C ATOM 1542 CG ARG A 209 91.296 123.601 23.404 1.00 60.52 C ATOM 1543 CD ARG A 209 90.162 122.597 23.139 1.00 65.03 C ATOM 1544 NE ARG A 209 88.899 123.028 23.745 1.00 76.96 N ATOM 1545 CZ ARG A 209 87.710 122.462 23.524 1.00 83.03 C ATOM 1546 NH1 ARG A 209 87.601 121.419 22.702 1.00 77.16 N ATOM 1547 NH2 ARG A 209 86.622 122.941 24.120 1.00 89.92 N ATOM 1548 HE ARG A 209 88.931 123.837 24.398 1.00 0.00 H ATOM 1549 HH12 ARG A 209 86.671 120.984 22.535 1.00 0.00 H ATOM 1550 HH11 ARG A 209 88.445 121.040 22.228 1.00 0.00 H ATOM 1551 HH22 ARG A 209 85.697 122.499 23.947 1.00 0.00 H ATOM 1552 HH21 ARG A 209 86.696 123.758 24.759 1.00 0.00 H ATOM 1553 H ARG A 209 95.604 123.175 24.549 1.00 0.00 H ATOM 1554 N ASN A 210 93.469 126.112 24.253 1.00 37.34 N ATOM 1555 CA ASN A 210 93.515 127.260 25.136 1.00 38.61 C ATOM 1556 C ASN A 210 94.909 127.519 25.683 1.00 37.87 C ATOM 1557 O ASN A 210 95.074 127.991 26.805 1.00 50.87 O ATOM 1558 CB ASN A 210 92.548 127.064 26.285 1.00 43.82 C ATOM 1559 CG ASN A 210 91.146 126.678 25.808 1.00 53.99 C ATOM 1560 OD1 ASN A 210 90.628 127.239 24.839 1.00 58.83 O ATOM 1561 ND2 ASN A 210 90.527 125.733 26.496 1.00 55.68 N ATOM 1562 HD22 ASN A 210 91.000 125.286 27.307 1.00 0.00 H ATOM 1563 HD21 ASN A 210 89.567 125.437 26.226 1.00 0.00 H ATOM 1564 H ASN A 210 93.117 126.231 23.281 1.00 0.00 H ATOM 1565 N GLY A 211 95.919 127.194 24.901 1.00 36.99 N ATOM 1566 CA GLY A 211 97.280 127.462 25.300 1.00 41.27 C ATOM 1567 C GLY A 211 97.834 126.431 26.251 1.00 48.53 C ATOM 1568 O GLY A 211 99.025 126.518 26.602 1.00 48.53 O ATOM 1569 H GLY A 211 95.733 126.739 23.985 1.00 0.00 H ATOM 1570 N LYS A 212 97.017 125.417 26.606 1.00 42.40 N ATOM 1571 CA LYS A 212 97.520 124.406 27.513 1.00 37.01 C ATOM 1572 C LYS A 212 97.573 123.049 26.816 1.00 34.28 C ATOM 1573 O LYS A 212 96.736 122.730 25.956 1.00 31.86 O ATOM 1574 CB LYS A 212 96.647 124.271 28.768 1.00 36.06 C ATOM 1575 CG LYS A 212 96.591 125.523 29.647 1.00 42.79 C ATOM 1576 CD LYS A 212 97.917 125.782 30.383 1.00 53.10 C ATOM 1577 CE LYS A 212 97.846 127.078 31.221 1.00 66.11 C ATOM 1578 NZ LYS A 212 99.196 127.563 31.631 1.00 69.19 N ATOM 1579 HZ1 LYS A 212 99.666 126.834 32.205 1.00 0.00 H ATOM 1580 HZ2 LYS A 212 99.765 127.758 30.783 1.00 0.00 H ATOM 1581 HZ3 LYS A 212 99.095 128.434 32.190 1.00 0.00 H ATOM 1582 H LYS A 212 96.047 125.363 26.236 1.00 0.00 H ATOM 1583 N PRO A 213 98.522 122.229 27.268 1.00 33.70 N ATOM 1584 CA PRO A 213 98.726 120.937 26.628 1.00 30.91 C ATOM 1585 C PRO A 213 97.473 120.038 26.828 1.00 31.31 C ATOM 1586 O PRO A 213 96.798 120.122 27.852 1.00 32.57 O ATOM 1587 CB PRO A 213 99.974 120.385 27.328 1.00 34.24 C ATOM 1588 CG PRO A 213 100.210 121.308 28.542 1.00 34.86 C ATOM 1589 CD PRO A 213 99.570 122.594 28.243 1.00 37.25 C ATOM 1590 N VAL A 214 97.151 119.217 25.830 1.00 27.88 N ATOM 1591 CA VAL A 214 96.087 118.226 25.944 1.00 26.67 C ATOM 1592 C VAL A 214 96.720 116.908 25.506 1.00 25.20 C ATOM 1593 O VAL A 214 97.072 116.708 24.313 1.00 25.12 O ATOM 1594 CB VAL A 214 94.850 118.551 25.049 1.00 28.73 C ATOM 1595 CG1 VAL A 214 93.802 117.399 25.125 1.00 28.90 C ATOM 1596 CG2 VAL A 214 94.202 119.888 25.444 1.00 35.14 C ATOM 1597 H VAL A 214 97.678 119.285 24.936 1.00 0.00 H ATOM 1598 N ARG A 215 96.908 116.018 26.472 1.00 25.08 N ATOM 1599 CA ARG A 215 97.461 114.698 26.179 1.00 23.87 C ATOM 1600 C ARG A 215 96.379 113.759 25.667 1.00 22.44 C ATOM 1601 O ARG A 215 95.513 113.375 26.427 1.00 23.22 O ATOM 1602 CB ARG A 215 98.084 114.106 27.424 1.00 24.63 C ATOM 1603 CG ARG A 215 99.286 114.996 27.856 1.00 26.40 C ATOM 1604 CD ARG A 215 99.721 114.528 29.208 1.00 31.18 C ATOM 1605 NE ARG A 215 98.755 114.971 30.209 1.00 31.57 N ATOM 1606 CZ ARG A 215 98.822 114.701 31.502 1.00 36.92 C ATOM 1607 NH1 ARG A 215 99.829 113.979 31.970 1.00 43.58 N ATOM 1608 NH2 ARG A 215 97.874 115.166 32.328 1.00 37.06 N ATOM 1609 HE ARG A 215 97.952 115.543 29.880 1.00 0.00 H ATOM 1610 HH12 ARG A 215 99.887 113.764 32.986 1.00 0.00 H ATOM 1611 HH11 ARG A 215 100.562 113.627 31.322 1.00 0.00 H ATOM 1612 HH22 ARG A 215 97.922 114.956 33.345 1.00 0.00 H ATOM 1613 HH21 ARG A 215 97.090 115.736 31.951 1.00 0.00 H ATOM 1614 H ARG A 215 96.658 116.264 27.451 1.00 0.00 H ATOM 1615 N ILE A 216 96.418 113.486 24.382 1.00 21.38 N ATOM 1616 CA ILE A 216 95.359 112.708 23.715 1.00 20.19 C ATOM 1617 C ILE A 216 95.782 111.230 23.645 1.00 20.82 C ATOM 1618 O ILE A 216 96.919 110.908 23.277 1.00 20.10 O ATOM 1619 CB ILE A 216 95.103 113.239 22.301 1.00 23.49 C ATOM 1620 CG1 ILE A 216 94.590 114.700 22.348 1.00 21.35 C ATOM 1621 CG2 ILE A 216 94.185 112.271 21.496 1.00 19.42 C ATOM 1622 CD1 ILE A 216 94.402 115.318 20.929 1.00 28.11 C ATOM 1623 H ILE A 216 97.221 113.830 23.818 1.00 0.00 H ATOM 1624 N ALA A 217 94.886 110.343 24.056 1.00 19.47 N ATOM 1625 CA ALA A 217 95.182 108.917 23.975 1.00 21.94 C ATOM 1626 C ALA A 217 94.164 108.307 23.037 1.00 20.49 C ATOM 1627 O ALA A 217 92.969 108.315 23.347 1.00 19.30 O ATOM 1628 CB ALA A 217 95.097 108.273 25.345 1.00 20.72 C ATOM 1629 H ALA A 217 93.973 110.664 24.436 1.00 0.00 H ATOM 1630 N TYR A 218 94.634 107.761 21.925 1.00 19.13 N ATOM 1631 CA TYR A 218 93.747 107.045 21.000 1.00 18.88 C ATOM 1632 C TYR A 218 93.932 105.540 21.293 1.00 19.88 C ATOM 1633 O TYR A 218 94.830 104.910 20.743 1.00 18.82 O ATOM 1634 CB TYR A 218 94.095 107.406 19.536 1.00 21.08 C ATOM 1635 CG TYR A 218 93.150 106.812 18.501 1.00 18.20 C ATOM 1636 CD1 TYR A 218 91.757 106.848 18.702 1.00 20.17 C ATOM 1637 CD2 TYR A 218 93.624 106.228 17.337 1.00 19.44 C ATOM 1638 CE1 TYR A 218 90.890 106.327 17.786 1.00 19.40 C ATOM 1639 CE2 TYR A 218 92.745 105.672 16.389 1.00 18.88 C ATOM 1640 CZ TYR A 218 91.379 105.733 16.612 1.00 19.10 C ATOM 1641 OH TYR A 218 90.497 105.240 15.700 1.00 19.58 O ATOM 1642 HH TYR A 218 90.666 104.274 15.568 1.00 0.00 H ATOM 1643 H TYR A 218 95.647 107.841 21.704 1.00 0.00 H ATOM 1644 N ALA A 219 93.074 104.994 22.145 1.00 18.75 N ATOM 1645 CA ALA A 219 93.283 103.619 22.641 1.00 17.21 C ATOM 1646 C ALA A 219 92.491 102.703 21.751 1.00 17.49 C ATOM 1647 O ALA A 219 91.312 102.991 21.390 1.00 19.17 O ATOM 1648 CB ALA A 219 92.821 103.493 24.111 1.00 19.77 C ATOM 1649 H ALA A 219 92.248 105.538 22.466 1.00 0.00 H ATOM 1650 N ASP A 220 93.063 101.549 21.438 1.00 19.16 N ATOM 1651 CA ASP A 220 92.351 100.601 20.596 1.00 19.38 C ATOM 1652 C ASP A 220 91.232 99.897 21.333 1.00 17.74 C ATOM 1653 O ASP A 220 91.063 99.991 22.560 1.00 17.65 O ATOM 1654 CB ASP A 220 93.354 99.541 20.049 1.00 16.72 C ATOM 1655 CG ASP A 220 92.810 98.779 18.865 1.00 17.69 C ATOM 1656 OD1 ASP A 220 91.857 99.247 18.198 1.00 19.04 O ATOM 1657 OD2 ASP A 220 93.402 97.725 18.540 1.00 19.09 O ATOM 1658 H ASP A 220 94.014 101.323 21.792 1.00 0.00 H ATOM 1659 N SER A 221 90.467 99.145 20.554 1.00 16.21 N ATOM 1660 CA SER A 221 89.429 98.264 21.057 1.00 16.74 C ATOM 1661 C SER A 221 89.956 97.254 22.070 1.00 19.92 C ATOM 1662 O SER A 221 91.052 96.737 21.933 1.00 17.37 O ATOM 1663 CB SER A 221 88.783 97.508 19.895 1.00 18.66 C ATOM 1664 OG SER A 221 88.230 98.393 18.943 1.00 22.14 O ATOM 1665 HG SER A 221 87.537 98.952 19.377 1.00 0.00 H ATOM 1666 H SER A 221 90.619 99.189 19.526 1.00 0.00 H ATOM 1667 N LEU A 222 89.135 96.979 23.072 1.00 18.02 N ATOM 1668 CA LEU A 222 89.459 95.989 24.120 1.00 18.31 C ATOM 1669 C LEU A 222 88.364 94.932 24.164 1.00 18.38 C ATOM 1670 O LEU A 222 88.238 94.204 25.166 1.00 19.51 O ATOM 1671 CB LEU A 222 89.614 96.647 25.483 1.00 19.56 C ATOM 1672 CG LEU A 222 90.895 97.448 25.697 1.00 15.46 C ATOM 1673 CD1 LEU A 222 90.823 98.290 26.987 1.00 17.91 C ATOM 1674 CD2 LEU A 222 92.096 96.468 25.749 1.00 20.88 C ATOM 1675 H LEU A 222 88.225 97.480 23.123 1.00 0.00 H ATOM 1676 N SER A 225 87.577 94.868 23.100 1.00 18.75 N ATOM 1677 CA SER A 225 86.470 93.933 22.988 1.00 17.13 C ATOM 1678 C SER A 225 86.977 92.589 22.509 1.00 19.25 C ATOM 1679 O SER A 225 88.078 92.496 21.991 1.00 19.09 O ATOM 1680 CB SER A 225 85.449 94.464 21.990 1.00 20.75 C ATOM 1681 OG SER A 225 86.040 94.625 20.717 1.00 21.47 O ATOM 1682 HG SER A 225 85.364 94.970 20.082 1.00 0.00 H ATOM 1683 H SER A 225 87.760 95.517 22.308 1.00 0.00 H ATOM 1684 N ALA A 226 86.169 91.548 22.667 1.00 19.54 N ATOM 1685 CA ALA A 226 86.575 90.243 22.145 1.00 18.63 C ATOM 1686 C ALA A 226 85.348 89.587 21.516 1.00 18.40 C ATOM 1687 O ALA A 226 84.854 88.573 22.002 1.00 20.74 O ATOM 1688 CB ALA A 226 87.177 89.361 23.293 1.00 21.08 C ATOM 1689 H ALA A 226 85.258 91.659 23.156 1.00 0.00 H ATOM 1690 N PRO A 227 84.813 90.185 20.441 1.00 19.09 N ATOM 1691 CA PRO A 227 83.482 89.821 19.941 1.00 21.76 C ATOM 1692 C PRO A 227 83.361 88.400 19.392 1.00 23.54 C ATOM 1693 O PRO A 227 83.869 88.113 18.319 1.00 23.24 O ATOM 1694 CB PRO A 227 83.235 90.848 18.833 1.00 24.22 C ATOM 1695 CG PRO A 227 84.573 91.258 18.399 1.00 23.10 C ATOM 1696 CD PRO A 227 85.444 91.219 19.609 1.00 21.33 C ATOM 1697 N GLY A 228 82.675 87.530 20.128 1.00 21.97 N ATOM 1698 CA GLY A 228 82.536 86.117 19.720 1.00 25.74 C ATOM 1699 C GLY A 228 83.832 85.296 19.791 1.00 23.92 C ATOM 1700 O GLY A 228 83.917 84.162 19.250 1.00 21.20 O ATOM 1701 H GLY A 228 82.227 87.851 21.010 1.00 0.00 H ATOM 1702 N TYR A 229 84.866 85.868 20.430 1.00 20.76 N ATOM 1703 CA TYR A 229 86.162 85.175 20.484 1.00 16.72 C ATOM 1704 C TYR A 229 86.121 83.989 21.432 1.00 20.07 C ATOM 1705 O TYR A 229 85.516 84.083 22.505 1.00 21.47 O ATOM 1706 CB TYR A 229 87.279 86.088 21.013 1.00 16.24 C ATOM 1707 CG TYR A 229 87.737 87.228 20.106 1.00 18.92 C ATOM 1708 CD1 TYR A 229 87.064 87.541 18.931 1.00 17.19 C ATOM 1709 CD2 TYR A 229 88.814 88.002 20.471 1.00 15.10 C ATOM 1710 CE1 TYR A 229 87.460 88.626 18.139 1.00 16.74 C ATOM 1711 CE2 TYR A 229 89.250 89.042 19.652 1.00 15.32 C ATOM 1712 CZ TYR A 229 88.580 89.339 18.490 1.00 18.71 C ATOM 1713 OH TYR A 229 88.955 90.381 17.687 1.00 18.92 O ATOM 1714 HH TYR A 229 89.885 90.240 17.379 1.00 0.00 H ATOM 1715 H TYR A 229 84.751 86.796 20.884 1.00 0.00 H ATOM 1716 N GLN A 230 86.812 82.911 21.072 1.00 17.33 N ATOM 1717 CA GLN A 230 87.165 81.875 22.048 1.00 18.19 C ATOM 1718 C GLN A 230 88.376 82.379 22.822 1.00 18.49 C ATOM 1719 O GLN A 230 89.452 82.602 22.247 1.00 20.09 O ATOM 1720 CB GLN A 230 87.503 80.564 21.372 1.00 18.82 C ATOM 1721 CG GLN A 230 88.031 79.550 22.382 1.00 22.82 C ATOM 1722 CD GLN A 230 88.450 78.224 21.756 1.00 30.47 C ATOM 1723 OE1 GLN A 230 87.999 77.859 20.654 1.00 37.81 O ATOM 1724 NE2 GLN A 230 89.314 77.479 22.470 1.00 28.51 N ATOM 1725 HE22 GLN A 230 89.665 77.824 23.386 1.00 0.00 H ATOM 1726 HE21 GLN A 230 89.631 76.558 22.106 1.00 0.00 H ATOM 1727 H GLN A 230 87.107 82.801 20.081 1.00 0.00 H ATOM 1728 N LEU A 231 88.176 82.609 24.108 1.00 16.99 N ATOM 1729 CA LEU A 231 89.184 83.248 24.951 1.00 19.55 C ATOM 1730 C LEU A 231 90.141 82.210 25.533 1.00 22.80 C ATOM 1731 O LEU A 231 91.340 82.441 25.543 1.00 20.62 O ATOM 1732 CB LEU A 231 88.506 84.004 26.104 1.00 22.19 C ATOM 1733 CG LEU A 231 87.487 85.080 25.694 1.00 22.27 C ATOM 1734 CD1 LEU A 231 86.862 85.728 26.965 1.00 24.61 C ATOM 1735 CD2 LEU A 231 88.138 86.161 24.809 1.00 21.58 C ATOM 1736 H LEU A 231 87.271 82.326 24.534 1.00 0.00 H ATOM 1737 N GLN A 232 89.590 81.097 26.072 1.00 20.89 N ATOM 1738 CA GLN A 232 90.406 80.099 26.792 1.00 22.43 C ATOM 1739 C GLN A 232 90.854 78.981 25.856 1.00 23.18 C ATOM 1740 O GLN A 232 90.047 78.446 25.099 1.00 23.13 O ATOM 1741 CB GLN A 232 89.618 79.510 27.969 1.00 27.18 C ATOM 1742 CG GLN A 232 88.995 80.576 28.858 1.00 40.89 C ATOM 1743 CD GLN A 232 88.047 80.001 29.903 1.00 58.25 C ATOM 1744 OE1 GLN A 232 88.458 79.215 30.775 1.00 66.78 O ATOM 1745 NE2 GLN A 232 86.777 80.394 29.825 1.00 52.22 N ATOM 1746 HE22 GLN A 232 86.482 81.053 29.077 1.00 0.00 H ATOM 1747 HE21 GLN A 232 86.080 80.042 30.512 1.00 0.00 H ATOM 1748 H GLN A 232 88.566 80.941 25.977 1.00 0.00 H ATOM 1749 N GLY A 233 92.139 78.628 25.898 1.00 23.30 N ATOM 1750 CA GLY A 233 92.631 77.463 25.191 1.00 24.58 C ATOM 1751 C GLY A 233 92.459 77.615 23.687 1.00 25.15 C ATOM 1752 O GLY A 233 92.219 76.644 22.977 1.00 26.24 O ATOM 1753 H GLY A 233 92.805 79.203 26.452 1.00 0.00 H ATOM 1754 N ASN A 234 92.591 78.842 23.187 1.00 21.21 N ATOM 1755 CA ASN A 234 92.448 79.094 21.761 1.00 18.13 C ATOM 1756 C ASN A 234 93.760 78.712 21.061 1.00 22.02 C ATOM 1757 O ASN A 234 94.784 79.330 21.340 1.00 22.19 O ATOM 1758 CB ASN A 234 92.150 80.589 21.540 1.00 19.25 C ATOM 1759 CG ASN A 234 91.801 80.905 20.095 1.00 22.46 C ATOM 1760 OD1 ASN A 234 92.382 80.341 19.149 1.00 21.99 O ATOM 1761 ND2 ASN A 234 90.808 81.770 19.909 1.00 16.69 N ATOM 1762 HD22 ASN A 234 90.349 82.219 20.727 1.00 0.00 H ATOM 1763 HD21 ASN A 234 90.490 81.997 18.945 1.00 0.00 H ATOM 1764 H ASN A 234 92.800 79.635 23.827 1.00 0.00 H ATOM 1765 N PRO A 235 93.758 77.707 20.172 1.00 21.70 N ATOM 1766 CA PRO A 235 95.048 77.226 19.636 1.00 20.50 C ATOM 1767 C PRO A 235 95.735 78.280 18.748 1.00 24.65 C ATOM 1768 O PRO A 235 96.964 78.241 18.630 1.00 23.10 O ATOM 1769 CB PRO A 235 94.672 75.984 18.820 1.00 23.81 C ATOM 1770 CG PRO A 235 93.212 76.097 18.580 1.00 28.89 C ATOM 1771 CD PRO A 235 92.628 76.851 19.752 1.00 25.56 C ATOM 1772 N ARG A 236 94.964 79.196 18.179 1.00 18.45 N ATOM 1773 CA ARG A 236 95.552 80.246 17.360 1.00 17.20 C ATOM 1774 C ARG A 236 96.063 81.424 18.212 1.00 17.02 C ATOM 1775 O ARG A 236 96.769 82.303 17.684 1.00 18.16 O ATOM 1776 CB ARG A 236 94.540 80.819 16.341 1.00 19.20 C ATOM 1777 CG ARG A 236 94.142 79.837 15.227 1.00 21.88 C ATOM 1778 CD ARG A 236 95.272 79.554 14.247 1.00 22.46 C ATOM 1779 NE ARG A 236 95.758 80.699 13.488 1.00 22.20 N ATOM 1780 CZ ARG A 236 95.176 81.162 12.374 1.00 26.16 C ATOM 1781 NH1 ARG A 236 94.047 80.601 11.915 1.00 27.25 N ATOM 1782 NH2 ARG A 236 95.727 82.156 11.715 1.00 23.28 N ATOM 1783 HE ARG A 236 96.609 81.187 13.833 1.00 0.00 H ATOM 1784 HH12 ARG A 236 93.600 80.965 11.049 1.00 0.00 H ATOM 1785 HH11 ARG A 236 93.619 79.802 12.425 1.00 0.00 H ATOM 1786 HH22 ARG A 236 95.278 82.518 10.850 1.00 0.00 H ATOM 1787 HH21 ARG A 236 96.612 82.581 12.059 1.00 0.00 H ATOM 1788 H ARG A 236 93.934 79.164 18.318 1.00 0.00 H ATOM 1789 N TYR A 237 95.698 81.476 19.491 1.00 17.44 N ATOM 1790 CA TYR A 237 96.136 82.598 20.336 1.00 15.65 C ATOM 1791 C TYR A 237 96.232 82.104 21.780 1.00 18.60 C ATOM 1792 O TYR A 237 95.410 82.420 22.608 1.00 19.17 O ATOM 1793 CB TYR A 237 95.149 83.785 20.221 1.00 15.64 C ATOM 1794 CG TYR A 237 95.745 85.137 20.629 1.00 21.87 C ATOM 1795 CD1 TYR A 237 96.273 85.368 21.908 1.00 26.90 C ATOM 1796 CD2 TYR A 237 95.757 86.192 19.716 1.00 32.84 C ATOM 1797 CE1 TYR A 237 96.799 86.606 22.246 1.00 28.36 C ATOM 1798 CE2 TYR A 237 96.281 87.408 20.042 1.00 35.17 C ATOM 1799 CZ TYR A 237 96.794 87.619 21.283 1.00 21.64 C ATOM 1800 OH TYR A 237 97.324 88.863 21.586 1.00 19.09 O ATOM 1801 HH TYR A 237 97.655 88.861 22.519 1.00 0.00 H ATOM 1802 H TYR A 237 95.103 80.724 19.893 1.00 0.00 H ATOM 1803 N PRO A 238 97.234 81.305 22.070 1.00 18.86 N ATOM 1804 CA PRO A 238 97.263 80.609 23.372 1.00 17.73 C ATOM 1805 C PRO A 238 97.382 81.524 24.566 1.00 19.12 C ATOM 1806 O PRO A 238 96.907 81.144 25.645 1.00 22.59 O ATOM 1807 CB PRO A 238 98.486 79.668 23.241 1.00 19.87 C ATOM 1808 CG PRO A 238 98.563 79.417 21.801 1.00 20.99 C ATOM 1809 CD PRO A 238 98.244 80.761 21.141 1.00 20.01 C ATOM 1810 N HIS A 239 98.014 82.696 24.413 1.00 22.07 N ATOM 1811 CA HIS A 239 98.188 83.570 25.574 1.00 21.67 C ATOM 1812 C HIS A 239 97.203 84.740 25.493 1.00 24.28 C ATOM 1813 O HIS A 239 97.514 85.826 26.016 1.00 22.25 O ATOM 1814 CB HIS A 239 99.627 84.116 25.660 1.00 25.03 C ATOM 1815 CG HIS A 239 100.678 83.066 25.882 1.00 32.36 C ATOM 1816 ND1 HIS A 239 100.407 81.848 26.463 1.00 38.90 N ATOM 1817 CD2 HIS A 239 102.000 83.061 25.599 1.00 37.20 C ATOM 1818 CE1 HIS A 239 101.522 81.130 26.523 1.00 37.80 C ATOM 1819 NE2 HIS A 239 102.498 81.841 25.992 1.00 38.29 N ATOM 1820 H HIS A 239 98.376 82.981 23.481 1.00 0.00 H ATOM 1821 N LEU A 240 96.049 84.531 24.826 1.00 17.33 N ATOM 1822 CA LEU A 240 95.072 85.614 24.630 1.00 16.94 C ATOM 1823 C LEU A 240 94.729 86.281 25.965 1.00 18.78 C ATOM 1824 O LEU A 240 94.730 87.522 26.093 1.00 18.22 O ATOM 1825 CB LEU A 240 93.803 85.033 23.927 1.00 17.14 C ATOM 1826 CG LEU A 240 92.737 86.079 23.602 1.00 15.44 C ATOM 1827 CD1 LEU A 240 91.947 85.531 22.409 1.00 17.94 C ATOM 1828 CD2 LEU A 240 91.816 86.238 24.864 1.00 19.13 C ATOM 1829 H LEU A 240 95.846 83.586 24.443 1.00 0.00 H ATOM 1830 N ILE A 241 94.422 85.495 26.983 1.00 20.73 N ATOM 1831 CA ILE A 241 93.914 86.115 28.214 1.00 18.81 C ATOM 1832 C ILE A 241 95.012 86.954 28.886 1.00 19.63 C ATOM 1833 O ILE A 241 94.737 88.079 29.289 1.00 21.28 O ATOM 1834 CB ILE A 241 93.366 85.041 29.149 1.00 21.44 C ATOM 1835 CG1 ILE A 241 92.107 84.419 28.515 1.00 19.74 C ATOM 1836 CG2 ILE A 241 93.030 85.566 30.576 1.00 24.21 C ATOM 1837 CD1 ILE A 241 91.743 83.087 29.170 1.00 20.39 C ATOM 1838 H ILE A 241 94.537 84.464 26.914 1.00 0.00 H ATOM 1839 N GLU A 242 96.233 86.417 28.977 1.00 22.01 N ATOM 1840 CA GLU A 242 97.344 87.173 29.546 1.00 20.65 C ATOM 1841 C GLU A 242 97.574 88.485 28.791 1.00 23.04 C ATOM 1842 O GLU A 242 97.848 89.536 29.435 1.00 24.75 O ATOM 1843 CB GLU A 242 98.619 86.304 29.522 1.00 27.21 C ATOM 1844 CG GLU A 242 99.902 87.071 29.790 1.00 41.44 C ATOM 1845 CD GLU A 242 101.161 86.164 29.797 1.00 77.10 C ATOM 1846 OE1 GLU A 242 101.216 85.164 29.044 1.00 73.55 O ATOM 1847 OE2 GLU A 242 102.104 86.469 30.563 1.00 79.21 O ATOM 1848 H GLU A 242 96.393 85.447 28.638 1.00 0.00 H ATOM 1849 N ASP A 243 97.449 88.448 27.465 1.00 21.12 N ATOM 1850 CA ASP A 243 97.656 89.674 26.675 1.00 19.27 C ATOM 1851 C ASP A 243 96.557 90.702 26.989 1.00 18.96 C ATOM 1852 O ASP A 243 96.861 91.894 27.208 1.00 19.79 O ATOM 1853 CB ASP A 243 97.707 89.386 25.183 1.00 19.15 C ATOM 1854 CG ASP A 243 99.073 88.840 24.748 1.00 19.84 C ATOM 1855 OD1 ASP A 243 100.015 88.772 25.595 1.00 25.28 O ATOM 1856 OD2 ASP A 243 99.212 88.514 23.566 1.00 21.69 O ATOM 1857 H ASP A 243 97.206 87.556 26.989 1.00 0.00 H ATOM 1858 N TYR A 244 95.295 90.261 26.999 1.00 17.14 N ATOM 1859 CA TYR A 244 94.255 91.202 27.395 1.00 17.60 C ATOM 1860 C TYR A 244 94.482 91.793 28.783 1.00 19.49 C ATOM 1861 O TYR A 244 94.315 93.025 28.945 1.00 19.87 O ATOM 1862 CB TYR A 244 92.885 90.568 27.398 1.00 16.50 C ATOM 1863 CG TYR A 244 92.166 90.640 26.090 1.00 18.07 C ATOM 1864 CD1 TYR A 244 92.371 89.657 25.116 1.00 19.86 C ATOM 1865 CD2 TYR A 244 91.257 91.669 25.815 1.00 18.33 C ATOM 1866 CE1 TYR A 244 91.670 89.675 23.915 1.00 17.71 C ATOM 1867 CE2 TYR A 244 90.532 91.700 24.591 1.00 14.51 C ATOM 1868 CZ TYR A 244 90.757 90.714 23.642 1.00 15.71 C ATOM 1869 OH TYR A 244 90.059 90.693 22.443 1.00 17.53 O ATOM 1870 HH TYR A 244 89.090 90.614 22.628 1.00 0.00 H ATOM 1871 H TYR A 244 95.064 89.282 26.734 1.00 0.00 H ATOM 1872 N ARG A 245 94.876 90.976 29.777 1.00 18.92 N ATOM 1873 CA ARG A 245 95.082 91.564 31.109 1.00 20.59 C ATOM 1874 C ARG A 245 96.167 92.620 31.106 1.00 24.01 C ATOM 1875 O ARG A 245 96.038 93.648 31.754 1.00 22.31 O ATOM 1876 CB ARG A 245 95.464 90.494 32.105 1.00 24.67 C ATOM 1877 CG ARG A 245 94.426 89.423 32.167 1.00 32.55 C ATOM 1878 CD ARG A 245 93.678 89.468 33.435 1.00 39.63 C ATOM 1879 NE ARG A 245 92.677 88.416 33.514 1.00 37.71 N ATOM 1880 CZ ARG A 245 91.378 88.659 33.634 1.00 34.68 C ATOM 1881 NH1 ARG A 245 90.934 89.926 33.729 1.00 31.71 N ATOM 1882 NH2 ARG A 245 90.538 87.636 33.718 1.00 33.01 N ATOM 1883 HE ARG A 245 92.994 87.426 33.475 1.00 0.00 H ATOM 1884 HH12 ARG A 245 89.916 90.114 33.823 1.00 0.00 H ATOM 1885 HH11 ARG A 245 91.609 90.717 33.708 1.00 0.00 H ATOM 1886 HH22 ARG A 245 89.517 87.808 33.812 1.00 0.00 H ATOM 1887 HH21 ARG A 245 90.901 86.662 33.689 1.00 0.00 H ATOM 1888 H ARG A 245 95.030 89.961 29.609 1.00 0.00 H ATOM 1889 N ARG A 246 97.221 92.351 30.374 1.00 19.54 N ATOM 1890 CA ARG A 246 98.316 93.273 30.286 1.00 19.72 C ATOM 1891 C ARG A 246 97.849 94.540 29.599 1.00 21.61 C ATOM 1892 O ARG A 246 98.200 95.586 29.991 1.00 21.85 O ATOM 1893 CB ARG A 246 99.501 92.670 29.558 1.00 24.00 C ATOM 1894 CG ARG A 246 100.754 93.484 29.497 1.00 38.07 C ATOM 1895 CD ARG A 246 101.863 92.692 28.793 1.00 56.41 C ATOM 1896 NE ARG A 246 102.255 91.503 29.553 1.00 66.75 N ATOM 1897 CZ ARG A 246 103.464 91.309 30.129 1.00 80.86 C ATOM 1898 NH1 ARG A 246 103.734 90.204 30.836 1.00 82.74 N ATOM 1899 NH2 ARG A 246 104.425 92.200 30.000 1.00 81.98 N ATOM 1900 HE ARG A 246 101.548 90.748 29.658 1.00 0.00 H ATOM 1901 HH12 ARG A 246 104.672 90.080 31.269 1.00 0.00 H ATOM 1902 HH11 ARG A 246 103.006 89.470 30.952 1.00 0.00 H ATOM 1903 HH22 ARG A 246 105.349 92.037 30.449 1.00 0.00 H ATOM 1904 HH21 ARG A 246 104.260 93.067 29.450 1.00 0.00 H ATOM 1905 H ARG A 246 97.264 91.454 29.849 1.00 0.00 H ATOM 1906 N SER A 247 97.052 94.390 28.563 1.00 18.53 N ATOM 1907 CA SER A 247 96.505 95.532 27.811 1.00 20.74 C ATOM 1908 C SER A 247 95.577 96.384 28.656 1.00 20.86 C ATOM 1909 O SER A 247 95.602 97.621 28.521 1.00 18.77 O ATOM 1910 CB SER A 247 95.806 95.036 26.561 1.00 17.93 C ATOM 1911 OG SER A 247 96.823 94.532 25.674 1.00 19.53 O ATOM 1912 HG SER A 247 96.399 94.198 24.844 1.00 0.00 H ATOM 1913 H SER A 247 96.798 93.427 28.263 1.00 0.00 H ATOM 1914 N PHE A 248 94.755 95.772 29.515 1.00 17.98 N ATOM 1915 CA PHE A 248 93.958 96.637 30.428 1.00 16.40 C ATOM 1916 C PHE A 248 94.877 97.554 31.275 1.00 18.98 C ATOM 1917 O PHE A 248 94.597 98.733 31.488 1.00 19.94 O ATOM 1918 CB PHE A 248 93.105 95.807 31.362 1.00 19.72 C ATOM 1919 CG PHE A 248 92.181 94.844 30.654 1.00 18.19 C ATOM 1920 CD1 PHE A 248 91.479 95.231 29.507 1.00 19.09 C ATOM 1921 CD2 PHE A 248 91.992 93.572 31.200 1.00 19.25 C ATOM 1922 CE1 PHE A 248 90.616 94.313 28.856 1.00 19.62 C ATOM 1923 CE2 PHE A 248 91.147 92.661 30.554 1.00 19.64 C ATOM 1924 CZ PHE A 248 90.460 93.019 29.406 1.00 19.50 C ATOM 1925 H PHE A 248 94.676 94.735 29.544 1.00 0.00 H ATOM 1926 N ALA A 249 95.980 97.002 31.759 1.00 19.05 N ATOM 1927 CA ALA A 249 96.896 97.777 32.607 1.00 21.06 C ATOM 1928 C ALA A 249 97.587 98.877 31.788 1.00 23.03 C ATOM 1929 O ALA A 249 97.808 99.989 32.273 1.00 22.23 O ATOM 1930 CB ALA A 249 97.964 96.813 33.279 1.00 22.39 C ATOM 1931 H ALA A 249 96.200 96.010 31.536 1.00 0.00 H ATOM 1932 N THR A 250 97.950 98.553 30.553 1.00 21.94 N ATOM 1933 CA THR A 250 98.560 99.526 29.633 1.00 20.67 C ATOM 1934 C THR A 250 97.623 100.693 29.407 1.00 19.51 C ATOM 1935 O THR A 250 98.018 101.874 29.539 1.00 21.70 O ATOM 1936 CB THR A 250 98.905 98.870 28.287 1.00 20.75 C ATOM 1937 OG1 THR A 250 99.988 97.960 28.565 1.00 23.12 O ATOM 1938 CG2 THR A 250 99.446 99.922 27.285 1.00 22.02 C ATOM 1939 HG1 THR A 250 100.257 97.503 27.729 1.00 0.00 H ATOM 1940 H THR A 250 97.798 97.578 30.224 1.00 0.00 H ATOM 1941 N VAL A 251 96.391 100.369 29.095 1.00 18.74 N ATOM 1942 CA VAL A 251 95.431 101.451 28.821 1.00 18.51 C ATOM 1943 C VAL A 251 95.169 102.337 30.064 1.00 23.33 C ATOM 1944 O VAL A 251 95.145 103.588 29.979 1.00 19.59 O ATOM 1945 CB VAL A 251 94.092 100.848 28.263 1.00 18.47 C ATOM 1946 CG1 VAL A 251 92.986 101.938 28.234 1.00 18.38 C ATOM 1947 CG2 VAL A 251 94.317 100.287 26.866 1.00 17.71 C ATOM 1948 H VAL A 251 96.099 99.372 29.042 1.00 0.00 H ATOM 1949 N ARG A 252 95.031 101.707 31.236 1.00 21.16 N ATOM 1950 CA ARG A 252 94.797 102.426 32.506 1.00 22.59 C ATOM 1951 C ARG A 252 95.885 103.458 32.763 1.00 21.84 C ATOM 1952 O ARG A 252 95.592 104.559 33.285 1.00 23.41 O ATOM 1953 CB ARG A 252 94.753 101.387 33.656 1.00 27.66 C ATOM 1954 CG ARG A 252 94.666 101.951 35.036 1.00 40.89 C ATOM 1955 CD ARG A 252 94.482 100.832 36.062 1.00 52.95 C ATOM 1956 NE ARG A 252 94.818 101.270 37.428 1.00 59.33 N ATOM 1957 CZ ARG A 252 93.983 101.893 38.260 1.00 59.05 C ATOM 1958 NH1 ARG A 252 92.734 102.185 37.884 1.00 41.83 N ATOM 1959 NH2 ARG A 252 94.406 102.236 39.475 1.00 64.81 N ATOM 1960 HE ARG A 252 95.781 101.078 37.770 1.00 0.00 H ATOM 1961 HH12 ARG A 252 92.093 102.671 38.543 1.00 0.00 H ATOM 1962 HH11 ARG A 252 92.403 101.926 36.933 1.00 0.00 H ATOM 1963 HH22 ARG A 252 93.763 102.722 40.132 1.00 0.00 H ATOM 1964 HH21 ARG A 252 95.380 102.018 39.767 1.00 0.00 H ATOM 1965 H ARG A 252 95.091 100.669 31.254 1.00 0.00 H ATOM 1966 N ALA A 253 97.111 103.140 32.363 1.00 20.81 N ATOM 1967 CA ALA A 253 98.269 103.981 32.677 1.00 21.21 C ATOM 1968 C ALA A 253 98.628 105.002 31.573 1.00 22.63 C ATOM 1969 O ALA A 253 99.573 105.737 31.737 1.00 25.88 O ATOM 1970 CB ALA A 253 99.500 103.091 33.009 1.00 24.53 C ATOM 1971 H ALA A 253 97.253 102.270 31.812 1.00 0.00 H ATOM 1972 N LEU A 254 97.881 105.073 30.461 1.00 20.26 N ATOM 1973 CA LEU A 254 98.280 105.991 29.369 1.00 22.14 C ATOM 1974 C LEU A 254 98.207 107.443 29.806 1.00 21.44 C ATOM 1975 O LEU A 254 97.356 107.782 30.622 1.00 23.28 O ATOM 1976 CB LEU A 254 97.377 105.822 28.127 1.00 18.86 C ATOM 1977 CG LEU A 254 97.405 104.440 27.444 1.00 19.96 C ATOM 1978 CD1 LEU A 254 96.271 104.364 26.431 1.00 21.69 C ATOM 1979 CD2 LEU A 254 98.751 104.229 26.766 1.00 20.91 C ATOM 1980 H LEU A 254 97.027 104.487 30.366 1.00 0.00 H ATOM 1981 N PRO A 255 99.070 108.310 29.229 1.00 21.45 N ATOM 1982 CA PRO A 255 98.891 109.758 29.412 1.00 23.09 C ATOM 1983 C PRO A 255 97.578 110.122 28.738 1.00 22.14 C ATOM 1984 O PRO A 255 97.437 109.836 27.564 1.00 21.92 O ATOM 1985 CB PRO A 255 100.104 110.368 28.694 1.00 25.75 C ATOM 1986 CG PRO A 255 100.510 109.349 27.659 1.00 26.74 C ATOM 1987 CD PRO A 255 100.165 107.977 28.288 1.00 22.85 C ATOM 1988 N CYS A 256 96.632 110.695 29.467 1.00 23.18 N ATOM 1989 CA CYS A 256 95.263 110.628 28.984 1.00 21.64 C ATOM 1990 C CYS A 256 94.363 111.771 29.490 1.00 22.60 C ATOM 1991 O CYS A 256 93.419 111.541 30.247 1.00 24.39 O ATOM 1992 CB CYS A 256 94.711 109.283 29.412 1.00 20.20 C ATOM 1993 SG CYS A 256 93.015 108.902 28.730 1.00 24.17 S ATOM 1994 H CYS A 256 96.862 111.178 30.359 1.00 0.00 H ATOM 1995 N ASP A 257 94.600 113.001 29.031 1.00 22.08 N ATOM 1996 CA ASP A 257 93.633 114.077 29.311 1.00 22.95 C ATOM 1997 C ASP A 257 92.327 113.850 28.533 1.00 22.20 C ATOM 1998 O ASP A 257 91.232 114.235 28.975 1.00 22.44 O ATOM 1999 CB ASP A 257 94.227 115.400 28.884 1.00 24.80 C ATOM 2000 CG ASP A 257 95.419 115.818 29.721 1.00 27.99 C ATOM 2001 OD1 ASP A 257 95.376 115.606 30.952 1.00 27.19 O ATOM 2002 OD2 ASP A 257 96.388 116.423 29.157 1.00 27.19 O ATOM 2003 H ASP A 257 95.460 113.199 28.480 1.00 0.00 H ATOM 2004 N VAL A 258 92.465 113.311 27.323 1.00 21.57 N ATOM 2005 CA VAL A 258 91.302 113.026 26.475 1.00 20.98 C ATOM 2006 C VAL A 258 91.467 111.637 25.837 1.00 24.59 C ATOM 2007 O VAL A 258 92.442 111.392 25.156 1.00 20.09 O ATOM 2008 CB VAL A 258 91.152 114.073 25.357 1.00 22.41 C ATOM 2009 CG1 VAL A 258 89.981 113.703 24.479 1.00 26.68 C ATOM 2010 CG2 VAL A 258 90.939 115.451 25.987 1.00 24.15 C ATOM 2011 H VAL A 258 93.418 113.087 26.972 1.00 0.00 H ATOM 2012 N LEU A 259 90.482 110.770 26.039 1.00 18.27 N ATOM 2013 CA LEU A 259 90.469 109.430 25.422 1.00 19.78 C ATOM 2014 C LEU A 259 89.593 109.445 24.193 1.00 16.90 C ATOM 2015 O LEU A 259 88.512 109.994 24.259 1.00 18.10 O ATOM 2016 CB LEU A 259 89.901 108.410 26.392 1.00 17.22 C ATOM 2017 CG LEU A 259 89.580 107.028 25.810 1.00 18.54 C ATOM 2018 CD1 LEU A 259 90.856 106.302 25.397 1.00 16.25 C ATOM 2019 CD2 LEU A 259 88.781 106.241 26.864 1.00 16.32 C ATOM 2020 H LEU A 259 89.691 111.046 26.655 1.00 0.00 H ATOM 2021 N LEU A 260 90.076 108.876 23.086 1.00 18.62 N ATOM 2022 CA LEU A 260 89.320 108.614 21.864 1.00 16.44 C ATOM 2023 C LEU A 260 89.486 107.124 21.567 1.00 17.59 C ATOM 2024 O LEU A 260 90.498 106.525 21.931 1.00 18.01 O ATOM 2025 CB LEU A 260 89.835 109.454 20.686 1.00 21.33 C ATOM 2026 CG LEU A 260 89.696 110.963 20.966 1.00 23.30 C ATOM 2027 CD1 LEU A 260 90.884 111.655 20.339 1.00 27.59 C ATOM 2028 CD2 LEU A 260 88.466 111.447 20.328 1.00 24.14 C ATOM 2029 H LEU A 260 91.077 108.595 23.095 1.00 0.00 H ATOM 2030 N THR A 261 88.464 106.508 20.955 1.00 18.71 N ATOM 2031 CA THR A 261 88.526 105.102 20.581 1.00 17.60 C ATOM 2032 C THR A 261 88.019 104.896 19.172 1.00 17.45 C ATOM 2033 O THR A 261 87.237 105.695 18.668 1.00 18.07 O ATOM 2034 CB THR A 261 87.691 104.224 21.548 1.00 15.66 C ATOM 2035 OG1 THR A 261 86.402 104.833 21.664 1.00 18.01 O ATOM 2036 CG2 THR A 261 88.349 104.144 22.930 1.00 19.22 C ATOM 2037 HG1 THR A 261 86.503 105.750 22.024 1.00 0.00 H ATOM 2038 H THR A 261 87.602 107.050 20.741 1.00 0.00 H ATOM 2039 N PRO A 262 88.440 103.791 18.539 1.00 15.61 N ATOM 2040 CA PRO A 262 88.058 103.553 17.139 1.00 15.88 C ATOM 2041 C PRO A 262 86.545 103.480 16.938 1.00 16.46 C ATOM 2042 O PRO A 262 86.024 104.047 15.980 1.00 18.16 O ATOM 2043 CB PRO A 262 88.746 102.200 16.805 1.00 15.82 C ATOM 2044 CG PRO A 262 89.970 102.193 17.662 1.00 17.01 C ATOM 2045 CD PRO A 262 89.555 102.902 18.979 1.00 18.58 C ATOM 2046 N HIS A 263 85.842 102.839 17.858 1.00 14.65 N ATOM 2047 CA HIS A 263 84.401 102.988 17.932 1.00 15.66 C ATOM 2048 C HIS A 263 84.108 104.006 19.029 1.00 17.13 C ATOM 2049 O HIS A 263 84.370 103.741 20.190 1.00 18.23 O ATOM 2050 CB HIS A 263 83.738 101.648 18.236 1.00 16.86 C ATOM 2051 CG HIS A 263 83.952 100.617 17.173 1.00 17.64 C ATOM 2052 ND1 HIS A 263 83.065 100.417 16.141 1.00 17.77 N ATOM 2053 CD2 HIS A 263 84.959 99.735 16.976 1.00 16.77 C ATOM 2054 CE1 HIS A 263 83.513 99.455 15.357 1.00 18.67 C ATOM 2055 NE2 HIS A 263 84.660 99.026 15.841 1.00 16.64 N ATOM 2056 H HIS A 263 86.329 102.220 18.537 1.00 0.00 H ATOM 2057 N PRO A 264 83.589 105.186 18.657 1.00 17.18 N ATOM 2058 CA PRO A 264 83.480 106.254 19.662 1.00 18.44 C ATOM 2059 C PRO A 264 82.624 105.902 20.857 1.00 20.39 C ATOM 2060 O PRO A 264 82.911 106.390 21.946 1.00 18.96 O ATOM 2061 CB PRO A 264 82.815 107.411 18.884 1.00 20.28 C ATOM 2062 CG PRO A 264 82.176 106.768 17.679 1.00 19.61 C ATOM 2063 CD PRO A 264 83.146 105.637 17.332 1.00 18.08 C ATOM 2064 N GLY A 265 81.602 105.074 20.653 1.00 18.94 N ATOM 2065 CA GLY A 265 80.748 104.694 21.775 1.00 21.18 C ATOM 2066 C GLY A 265 81.496 103.951 22.870 1.00 21.36 C ATOM 2067 O GLY A 265 81.112 104.013 24.011 1.00 22.17 O ATOM 2068 H GLY A 265 81.413 104.700 19.701 1.00 0.00 H ATOM 2069 N ALA A 266 82.599 103.291 22.519 1.00 18.16 N ATOM 2070 CA ALA A 266 83.366 102.587 23.532 1.00 19.18 C ATOM 2071 C ALA A 266 83.931 103.523 24.605 1.00 19.05 C ATOM 2072 O ALA A 266 84.146 103.113 25.767 1.00 20.04 O ATOM 2073 CB ALA A 266 84.490 101.802 22.849 1.00 19.65 C ATOM 2074 H ALA A 266 82.909 103.280 21.526 1.00 0.00 H ATOM 2075 N SER A 267 84.155 104.787 24.239 1.00 18.86 N ATOM 2076 CA SER A 267 84.682 105.752 25.207 1.00 19.97 C ATOM 2077 C SER A 267 83.639 106.832 25.496 1.00 19.31 C ATOM 2078 O SER A 267 83.949 107.863 26.052 1.00 17.94 O ATOM 2079 CB SER A 267 85.989 106.381 24.691 1.00 20.08 C ATOM 2080 OG SER A 267 85.812 106.906 23.371 1.00 18.75 O ATOM 2081 HG SER A 267 85.545 106.175 22.759 1.00 0.00 H ATOM 2082 H SER A 267 83.955 105.088 23.264 1.00 0.00 H ATOM 2083 N ASN A 268 82.395 106.555 25.125 1.00 16.74 N ATOM 2084 CA ASN A 268 81.264 107.485 25.333 1.00 16.90 C ATOM 2085 C ASN A 268 81.333 108.787 24.635 1.00 19.45 C ATOM 2086 O ASN A 268 80.717 109.732 25.072 1.00 21.84 O ATOM 2087 CB ASN A 268 81.072 107.718 26.800 1.00 20.56 C ATOM 2088 CG ASN A 268 80.054 106.824 27.279 1.00 42.59 C ATOM 2089 OD1 ASN A 268 80.348 105.673 27.600 1.00 44.27 O ATOM 2090 ND2 ASN A 268 78.801 107.239 27.102 1.00 43.97 N ATOM 2091 HD22 ASN A 268 78.613 108.225 26.830 1.00 0.00 H ATOM 2092 HD21 ASN A 268 78.010 106.577 27.235 1.00 0.00 H ATOM 2093 H ASN A 268 82.207 105.641 24.666 1.00 0.00 H ATOM 2094 N TRP A 269 82.014 108.799 23.511 1.00 17.61 N ATOM 2095 CA TRP A 269 81.932 109.921 22.566 1.00 20.06 C ATOM 2096 C TRP A 269 80.647 109.818 21.773 1.00 21.61 C ATOM 2097 O TRP A 269 80.202 108.713 21.462 1.00 21.02 O ATOM 2098 CB TRP A 269 83.137 109.922 21.608 1.00 17.69 C ATOM 2099 CG TRP A 269 84.325 110.619 22.170 1.00 16.96 C ATOM 2100 CD1 TRP A 269 85.273 110.108 23.001 1.00 18.30 C ATOM 2101 CD2 TRP A 269 84.710 111.973 21.890 1.00 18.63 C ATOM 2102 NE1 TRP A 269 86.213 111.077 23.288 1.00 18.24 N ATOM 2103 CE2 TRP A 269 85.879 112.235 22.634 1.00 19.98 C ATOM 2104 CE3 TRP A 269 84.162 112.994 21.104 1.00 19.39 C ATOM 2105 CZ2 TRP A 269 86.530 113.475 22.581 1.00 19.48 C ATOM 2106 CZ3 TRP A 269 84.809 114.215 21.043 1.00 19.99 C ATOM 2107 CH2 TRP A 269 85.985 114.445 21.786 1.00 22.65 C ATOM 2108 HE1 TRP A 269 87.042 110.949 23.902 1.00 0.00 H ATOM 2109 H TRP A 269 82.628 107.991 23.284 1.00 0.00 H ATOM 2110 N ASP A 270 80.082 110.979 21.411 1.00 18.69 N ATOM 2111 CA ASP A 270 78.936 111.046 20.517 1.00 19.39 C ATOM 2112 C ASP A 270 79.265 112.073 19.431 1.00 20.77 C ATOM 2113 O ASP A 270 79.056 113.256 19.627 1.00 24.01 O ATOM 2114 CB ASP A 270 77.665 111.458 21.293 1.00 22.34 C ATOM 2115 CG ASP A 270 76.442 111.500 20.407 1.00 29.08 C ATOM 2116 OD1 ASP A 270 76.557 111.260 19.175 1.00 30.60 O ATOM 2117 OD2 ASP A 270 75.359 111.844 20.942 1.00 32.94 O ATOM 2118 H ASP A 270 80.478 111.866 21.784 1.00 0.00 H ATOM 2119 N TYR A 271 79.847 111.637 18.316 1.00 21.20 N ATOM 2120 CA TYR A 271 80.322 112.585 17.297 1.00 21.46 C ATOM 2121 C TYR A 271 79.196 113.428 16.691 1.00 24.10 C ATOM 2122 O TYR A 271 79.448 114.482 16.103 1.00 26.57 O ATOM 2123 CB TYR A 271 81.058 111.862 16.161 1.00 23.56 C ATOM 2124 CG TYR A 271 82.395 111.229 16.569 1.00 20.25 C ATOM 2125 CD1 TYR A 271 83.155 111.760 17.605 1.00 20.61 C ATOM 2126 CD2 TYR A 271 82.895 110.105 15.894 1.00 19.28 C ATOM 2127 CE1 TYR A 271 84.372 111.212 17.989 1.00 20.71 C ATOM 2128 CE2 TYR A 271 84.149 109.531 16.278 1.00 20.42 C ATOM 2129 CZ TYR A 271 84.873 110.093 17.293 1.00 20.83 C ATOM 2130 OH TYR A 271 86.070 109.536 17.658 1.00 19.89 O ATOM 2131 HH TYR A 271 85.922 108.602 17.952 1.00 0.00 H ATOM 2132 H TYR A 271 79.967 110.615 18.164 1.00 0.00 H ATOM 2133 N ALA A 272 77.964 112.952 16.811 1.00 24.80 N ATOM 2134 CA ALA A 272 76.859 113.737 16.267 1.00 30.93 C ATOM 2135 C ALA A 272 76.382 114.839 17.242 1.00 31.36 C ATOM 2136 O ALA A 272 75.492 115.645 16.884 1.00 35.25 O ATOM 2137 CB ALA A 272 75.698 112.813 15.890 1.00 28.90 C ATOM 2138 H ALA A 272 77.789 112.041 17.281 1.00 0.00 H ATOM 2139 N ALA A 273 76.964 114.924 18.437 1.00 28.87 N ATOM 2140 CA ALA A 273 76.424 115.819 19.489 1.00 29.60 C ATOM 2141 C ALA A 273 77.089 117.222 19.534 1.00 36.28 C ATOM 2142 O ALA A 273 76.937 117.970 20.533 1.00 35.28 O ATOM 2143 CB ALA A 273 76.521 115.146 20.862 1.00 27.34 C ATOM 2144 H ALA A 273 77.811 114.354 18.636 1.00 0.00 H ATOM 2145 N GLY A 274 77.834 117.550 18.476 1.00 37.36 N ATOM 2146 CA GLY A 274 78.394 118.885 18.298 1.00 35.80 C ATOM 2147 C GLY A 274 79.336 119.314 19.397 1.00 33.23 C ATOM 2148 O GLY A 274 80.340 118.643 19.658 1.00 30.54 O ATOM 2149 H GLY A 274 78.022 116.827 17.752 1.00 0.00 H ATOM 2150 N ALA A 275 78.982 120.413 20.069 1.00 37.86 N ATOM 2151 CA ALA A 275 79.846 121.007 21.081 1.00 38.22 C ATOM 2152 C ALA A 275 79.924 120.120 22.315 1.00 37.73 C ATOM 2153 O ALA A 275 80.803 120.299 23.158 1.00 43.92 O ATOM 2154 CB ALA A 275 79.356 122.392 21.451 1.00 41.87 C ATOM 2155 H ALA A 275 78.064 120.857 19.864 1.00 0.00 H ATOM 2156 N ARG A 276 79.001 119.167 22.410 1.00 30.84 N ATOM 2157 CA ARG A 276 78.966 118.235 23.539 1.00 28.94 C ATOM 2158 C ARG A 276 79.468 116.858 23.148 1.00 27.38 C ATOM 2159 O ARG A 276 79.354 115.925 23.931 1.00 24.34 O ATOM 2160 CB ARG A 276 77.537 118.106 24.110 1.00 31.67 C ATOM 2161 CG ARG A 276 77.058 119.295 24.943 1.00 33.80 C ATOM 2162 CD ARG A 276 75.613 119.108 25.450 1.00 28.90 C ATOM 2163 NE ARG A 276 75.447 117.902 26.273 1.00 29.70 N ATOM 2164 CZ ARG A 276 74.661 116.883 25.956 1.00 28.12 C ATOM 2165 NH1 ARG A 276 73.956 116.912 24.835 1.00 30.82 N ATOM 2166 NH2 ARG A 276 74.570 115.843 26.745 1.00 29.70 N ATOM 2167 HE ARG A 276 75.982 117.844 27.163 1.00 0.00 H ATOM 2168 HH12 ARG A 276 73.340 116.112 24.587 1.00 0.00 H ATOM 2169 HH11 ARG A 276 74.019 117.735 24.202 1.00 0.00 H ATOM 2170 HH22 ARG A 276 73.951 115.048 26.488 1.00 0.00 H ATOM 2171 HH21 ARG A 276 75.117 115.811 27.629 1.00 0.00 H ATOM 2172 H ARG A 276 78.284 119.081 21.661 1.00 0.00 H ATOM 2173 N ALA A 289 80.035 116.726 21.951 1.00 23.35 N ATOM 2174 CA ALA A 289 80.447 115.393 21.472 1.00 20.35 C ATOM 2175 C ALA A 289 81.319 114.633 22.438 1.00 21.11 C ATOM 2176 O ALA A 289 81.178 113.403 22.568 1.00 21.76 O ATOM 2177 CB ALA A 289 81.221 115.505 20.139 1.00 23.34 C ATOM 2178 H ALA A 289 80.188 117.563 21.353 1.00 0.00 H ATOM 2179 N GLY A 290 82.280 115.323 23.055 1.00 23.23 N ATOM 2180 CA GLY A 290 83.214 114.655 23.947 1.00 20.46 C ATOM 2181 C GLY A 290 82.863 114.813 25.430 1.00 20.68 C ATOM 2182 O GLY A 290 83.632 114.400 26.311 1.00 20.56 O ATOM 2183 H GLY A 290 82.362 116.348 22.897 1.00 0.00 H ATOM 2184 N ALA A 291 81.727 115.406 25.727 1.00 20.60 N ATOM 2185 CA ALA A 291 81.437 115.793 27.109 1.00 20.39 C ATOM 2186 C ALA A 291 81.403 114.597 28.048 1.00 23.70 C ATOM 2187 O ALA A 291 81.899 114.655 29.180 1.00 23.59 O ATOM 2188 CB ALA A 291 80.108 116.554 27.185 1.00 21.97 C ATOM 2189 H ALA A 291 81.033 115.601 24.978 1.00 0.00 H ATOM 2190 N LYS A 292 80.846 113.499 27.563 1.00 22.24 N ATOM 2191 CA LYS A 292 80.651 112.335 28.448 1.00 19.45 C ATOM 2192 C LYS A 292 81.777 111.341 28.330 1.00 19.60 C ATOM 2193 O LYS A 292 81.661 110.221 28.885 1.00 19.44 O ATOM 2194 CB LYS A 292 79.336 111.622 28.100 1.00 20.02 C ATOM 2195 CG LYS A 292 78.091 112.515 28.057 1.00 27.19 C ATOM 2196 CD LYS A 292 76.924 111.720 27.430 1.00 31.96 C ATOM 2197 CE LYS A 292 75.673 112.577 27.279 1.00 37.95 C ATOM 2198 NZ LYS A 292 74.572 111.827 26.609 1.00 43.96 N ATOM 2199 HZ1 LYS A 292 74.883 111.529 25.662 1.00 0.00 H ATOM 2200 HZ2 LYS A 292 74.330 110.989 27.175 1.00 0.00 H ATOM 2201 HZ3 LYS A 292 73.737 112.442 26.524 1.00 0.00 H ATOM 2202 H LYS A 292 80.549 113.457 26.567 1.00 0.00 H ATOM 2203 N ALA A 293 82.846 111.686 27.594 1.00 18.95 N ATOM 2204 CA ALA A 293 83.938 110.708 27.369 1.00 17.53 C ATOM 2205 C ALA A 293 84.479 110.165 28.697 1.00 18.29 C ATOM 2206 O ALA A 293 84.662 110.885 29.693 1.00 18.35 O ATOM 2207 CB ALA A 293 85.079 111.316 26.557 1.00 18.41 C ATOM 2208 H ALA A 293 82.908 112.639 27.182 1.00 0.00 H ATOM 2209 N LEU A 294 84.732 108.860 28.666 1.00 17.43 N ATOM 2210 CA LEU A 294 85.436 108.149 29.747 1.00 15.15 C ATOM 2211 C LEU A 294 86.892 108.571 29.884 1.00 16.80 C ATOM 2212 O LEU A 294 87.518 108.950 28.882 1.00 20.22 O ATOM 2213 CB LEU A 294 85.438 106.651 29.445 1.00 17.07 C ATOM 2214 CG LEU A 294 84.068 106.014 29.358 1.00 18.17 C ATOM 2215 CD1 LEU A 294 84.271 104.493 29.128 1.00 18.83 C ATOM 2216 CD2 LEU A 294 83.170 106.298 30.622 1.00 19.52 C ATOM 2217 H LEU A 294 84.418 108.315 27.838 1.00 0.00 H ATOM 2218 N THR A 295 87.418 108.446 31.095 1.00 19.15 N ATOM 2219 CA THR A 295 88.879 108.414 31.256 1.00 19.04 C ATOM 2220 C THR A 295 89.441 107.092 30.710 1.00 21.75 C ATOM 2221 O THR A 295 88.731 106.091 30.541 1.00 18.40 O ATOM 2222 CB THR A 295 89.275 108.537 32.725 1.00 19.55 C ATOM 2223 OG1 THR A 295 88.765 107.378 33.385 1.00 18.94 O ATOM 2224 CG2 THR A 295 88.696 109.790 33.386 1.00 17.76 C ATOM 2225 HG1 THR A 295 89.162 106.567 32.979 1.00 0.00 H ATOM 2226 H THR A 295 86.799 108.371 31.928 1.00 0.00 H ATOM 2227 N CYS A 296 90.740 107.096 30.449 1.00 19.96 N ATOM 2228 CA CYS A 296 91.404 105.840 30.089 1.00 18.26 C ATOM 2229 C CYS A 296 91.213 104.787 31.217 1.00 19.62 C ATOM 2230 O CYS A 296 91.024 103.569 30.914 1.00 18.37 O ATOM 2231 CB CYS A 296 92.886 106.059 29.819 1.00 19.24 C ATOM 2232 SG CYS A 296 93.199 106.852 28.235 1.00 23.24 S ATOM 2233 H CYS A 296 91.283 107.982 30.499 1.00 0.00 H ATOM 2234 N LYS A 297 91.288 105.222 32.462 1.00 21.01 N ATOM 2235 CA LYS A 297 91.109 104.321 33.603 1.00 19.80 C ATOM 2236 C LYS A 297 89.712 103.685 33.580 1.00 21.00 C ATOM 2237 O LYS A 297 89.570 102.463 33.778 1.00 22.01 O ATOM 2238 CB LYS A 297 91.315 105.050 34.945 1.00 23.26 C ATOM 2239 CG LYS A 297 92.749 105.468 35.221 1.00 30.57 C ATOM 2240 CD LYS A 297 92.851 106.387 36.444 1.00 42.20 C ATOM 2241 CE LYS A 297 92.377 105.725 37.737 1.00 56.44 C ATOM 2242 NZ LYS A 297 92.418 106.643 38.948 1.00 65.72 N ATOM 2243 HZ1 LYS A 297 93.395 106.964 39.105 1.00 0.00 H ATOM 2244 HZ2 LYS A 297 91.804 107.465 38.779 1.00 0.00 H ATOM 2245 HZ3 LYS A 297 92.083 106.125 39.785 1.00 0.00 H ATOM 2246 H LYS A 297 91.479 106.229 32.636 1.00 0.00 H ATOM 2247 N ALA A 298 88.690 104.497 33.332 1.00 20.46 N ATOM 2248 CA ALA A 298 87.318 104.007 33.355 1.00 20.84 C ATOM 2249 C ALA A 298 87.090 103.058 32.145 1.00 19.33 C ATOM 2250 O ALA A 298 86.377 102.081 32.259 1.00 19.02 O ATOM 2251 CB ALA A 298 86.287 105.219 33.317 1.00 22.92 C ATOM 2252 H ALA A 298 88.872 105.498 33.118 1.00 0.00 H ATOM 2253 N TYR A 299 87.692 103.394 31.017 1.00 18.73 N ATOM 2254 CA TYR A 299 87.546 102.598 29.809 1.00 17.92 C ATOM 2255 C TYR A 299 88.161 101.208 30.047 1.00 17.26 C ATOM 2256 O TYR A 299 87.547 100.157 29.729 1.00 19.06 O ATOM 2257 CB TYR A 299 88.246 103.304 28.630 1.00 19.38 C ATOM 2258 CG TYR A 299 88.379 102.466 27.387 1.00 18.63 C ATOM 2259 CD1 TYR A 299 87.248 101.873 26.809 1.00 20.83 C ATOM 2260 CD2 TYR A 299 89.586 102.337 26.747 1.00 16.91 C ATOM 2261 CE1 TYR A 299 87.381 101.129 25.615 1.00 24.60 C ATOM 2262 CE2 TYR A 299 89.716 101.627 25.561 1.00 17.20 C ATOM 2263 CZ TYR A 299 88.604 101.011 25.018 1.00 19.21 C ATOM 2264 OH TYR A 299 88.686 100.260 23.841 1.00 20.59 O ATOM 2265 HH TYR A 299 87.791 99.903 23.616 1.00 0.00 H ATOM 2266 H TYR A 299 88.284 104.248 30.993 1.00 0.00 H ATOM 2267 N ALA A 300 89.349 101.216 30.623 1.00 16.43 N ATOM 2268 CA ALA A 300 90.043 99.935 30.905 1.00 18.07 C ATOM 2269 C ALA A 300 89.262 99.135 31.931 1.00 19.66 C ATOM 2270 O ALA A 300 89.112 97.901 31.778 1.00 18.28 O ATOM 2271 CB ALA A 300 91.471 100.191 31.409 1.00 19.30 C ATOM 2272 H ALA A 300 89.798 102.119 30.879 1.00 0.00 H ATOM 2273 N ASP A 301 88.774 99.793 32.976 1.00 18.14 N ATOM 2274 CA ASP A 301 88.039 99.068 34.015 1.00 17.76 C ATOM 2275 C ASP A 301 86.744 98.430 33.408 1.00 18.82 C ATOM 2276 O ASP A 301 86.392 97.273 33.688 1.00 20.19 O ATOM 2277 CB ASP A 301 87.666 99.974 35.198 1.00 19.81 C ATOM 2278 CG ASP A 301 87.055 99.166 36.312 1.00 28.08 C ATOM 2279 OD1 ASP A 301 87.827 98.502 37.006 1.00 29.95 O ATOM 2280 OD2 ASP A 301 85.824 99.155 36.482 1.00 29.77 O ATOM 2281 H ASP A 301 88.913 100.820 33.057 1.00 0.00 H ATOM 2282 N ALA A 302 86.026 99.193 32.591 1.00 18.49 N ATOM 2283 CA ALA A 302 84.786 98.687 32.017 1.00 19.60 C ATOM 2284 C ALA A 302 85.085 97.498 31.094 1.00 20.71 C ATOM 2285 O ALA A 302 84.321 96.525 31.100 1.00 20.01 O ATOM 2286 CB ALA A 302 84.022 99.826 31.222 1.00 20.46 C ATOM 2287 H ALA A 302 86.350 100.154 32.361 1.00 0.00 H ATOM 2288 N ALA A 303 86.177 97.583 30.314 1.00 17.59 N ATOM 2289 CA ALA A 303 86.538 96.530 29.350 1.00 17.13 C ATOM 2290 C ALA A 303 86.915 95.277 30.138 1.00 17.81 C ATOM 2291 O ALA A 303 86.594 94.176 29.724 1.00 18.31 O ATOM 2292 CB ALA A 303 87.691 97.000 28.455 1.00 22.50 C ATOM 2293 H ALA A 303 86.788 98.421 30.394 1.00 0.00 H ATOM 2294 N GLU A 304 87.613 95.474 31.259 1.00 16.98 N ATOM 2295 CA GLU A 304 88.059 94.317 32.036 1.00 17.68 C ATOM 2296 C GLU A 304 86.856 93.622 32.686 1.00 22.46 C ATOM 2297 O GLU A 304 86.777 92.379 32.709 1.00 21.77 O ATOM 2298 CB GLU A 304 89.096 94.737 33.106 1.00 18.59 C ATOM 2299 CG GLU A 304 89.524 93.498 33.961 1.00 20.35 C ATOM 2300 CD GLU A 304 90.898 93.664 34.599 1.00 34.95 C ATOM 2301 OE1 GLU A 304 91.240 94.799 34.979 1.00 30.86 O ATOM 2302 OE2 GLU A 304 91.655 92.654 34.682 1.00 35.44 O ATOM 2303 H GLU A 304 87.837 96.439 31.576 1.00 0.00 H ATOM 2304 N GLN A 305 85.915 94.402 33.196 1.00 18.74 N ATOM 2305 CA GLN A 305 84.724 93.811 33.823 1.00 21.68 C ATOM 2306 C GLN A 305 83.926 93.062 32.765 1.00 23.15 C ATOM 2307 O GLN A 305 83.419 91.938 33.030 1.00 23.70 O ATOM 2308 CB GLN A 305 83.858 94.908 34.485 1.00 23.24 C ATOM 2309 CG GLN A 305 84.544 95.549 35.709 1.00 31.48 C ATOM 2310 CD GLN A 305 84.823 94.532 36.796 1.00 42.54 C ATOM 2311 OE1 GLN A 305 85.985 94.266 37.146 1.00 43.12 O ATOM 2312 NE2 GLN A 305 83.756 93.951 37.338 1.00 43.66 N ATOM 2313 HE22 GLN A 305 82.802 94.207 37.011 1.00 0.00 H ATOM 2314 HE21 GLN A 305 83.875 93.241 38.088 1.00 0.00 H ATOM 2315 H GLN A 305 86.019 95.436 33.153 1.00 0.00 H ATOM 2316 N LYS A 306 83.768 93.649 31.592 1.00 20.22 N ATOM 2317 CA LYS A 306 83.082 92.949 30.498 1.00 17.68 C ATOM 2318 C LYS A 306 83.813 91.625 30.107 1.00 26.07 C ATOM 2319 O LYS A 306 83.188 90.573 29.896 1.00 22.42 O ATOM 2320 CB LYS A 306 82.959 93.832 29.279 1.00 21.84 C ATOM 2321 CG LYS A 306 82.031 93.155 28.288 1.00 34.01 C ATOM 2322 CD LYS A 306 81.665 94.016 27.096 1.00 49.28 C ATOM 2323 CE LYS A 306 80.741 93.205 26.158 1.00 56.05 C ATOM 2324 NZ LYS A 306 80.224 94.024 25.013 1.00 63.05 N ATOM 2325 HZ1 LYS A 306 79.679 94.829 25.382 1.00 0.00 H ATOM 2326 HZ2 LYS A 306 81.025 94.375 24.450 1.00 0.00 H ATOM 2327 HZ3 LYS A 306 79.611 93.434 24.415 1.00 0.00 H ATOM 2328 H LYS A 306 84.131 94.612 31.442 1.00 0.00 H ATOM 2329 N PHE A 307 85.118 91.711 30.014 1.00 19.17 N ATOM 2330 CA PHE A 307 85.968 90.573 29.660 1.00 21.34 C ATOM 2331 C PHE A 307 85.816 89.448 30.702 1.00 18.95 C ATOM 2332 O PHE A 307 85.687 88.269 30.335 1.00 20.56 O ATOM 2333 CB PHE A 307 87.435 91.037 29.579 1.00 17.88 C ATOM 2334 CG PHE A 307 88.360 89.980 29.057 1.00 19.58 C ATOM 2335 CD1 PHE A 307 88.527 89.808 27.702 1.00 19.92 C ATOM 2336 CD2 PHE A 307 89.083 89.161 29.942 1.00 20.17 C ATOM 2337 CE1 PHE A 307 89.369 88.835 27.187 1.00 26.25 C ATOM 2338 CE2 PHE A 307 89.933 88.190 29.436 1.00 21.93 C ATOM 2339 CZ PHE A 307 90.073 88.019 28.062 1.00 23.83 C ATOM 2340 H PHE A 307 85.570 92.629 30.200 1.00 0.00 H ATOM 2341 N ASP A 308 85.874 89.799 31.987 1.00 19.91 N ATOM 2342 CA ASP A 308 85.658 88.796 33.046 1.00 19.16 C ATOM 2343 C ASP A 308 84.283 88.151 32.950 1.00 23.95 C ATOM 2344 O ASP A 308 84.132 86.953 33.210 1.00 26.16 O ATOM 2345 CB ASP A 308 85.820 89.437 34.442 1.00 25.17 C ATOM 2346 CG ASP A 308 87.250 89.847 34.733 1.00 26.25 C ATOM 2347 OD1 ASP A 308 88.147 89.439 33.990 1.00 29.47 O ATOM 2348 OD2 ASP A 308 87.496 90.568 35.734 1.00 32.56 O ATOM 2349 H ASP A 308 86.073 90.787 32.244 1.00 0.00 H ATOM 2350 N GLY A 309 83.265 88.944 32.587 1.00 22.82 N ATOM 2351 CA GLY A 309 81.934 88.370 32.389 1.00 21.13 C ATOM 2352 C GLY A 309 81.931 87.370 31.229 1.00 21.83 C ATOM 2353 O GLY A 309 81.264 86.334 31.290 1.00 23.54 O ATOM 2354 H GLY A 309 83.421 89.963 32.447 1.00 0.00 H ATOM 2355 N GLN A 310 82.639 87.722 30.158 1.00 22.12 N ATOM 2356 CA GLN A 310 82.670 86.891 28.953 1.00 22.31 C ATOM 2357 C GLN A 310 83.394 85.571 29.291 1.00 22.07 C ATOM 2358 O GLN A 310 83.008 84.491 28.845 1.00 23.03 O ATOM 2359 CB GLN A 310 83.355 87.666 27.791 1.00 23.73 C ATOM 2360 CG GLN A 310 83.325 86.902 26.519 1.00 27.16 C ATOM 2361 CD GLN A 310 83.776 87.772 25.345 1.00 31.20 C ATOM 2362 OE1 GLN A 310 83.772 89.017 25.441 1.00 33.42 O ATOM 2363 NE2 GLN A 310 84.213 87.119 24.262 1.00 31.33 N ATOM 2364 HE22 GLN A 310 84.193 86.079 24.238 1.00 0.00 H ATOM 2365 HE21 GLN A 310 84.573 87.651 23.444 1.00 0.00 H ATOM 2366 H GLN A 310 83.183 88.608 30.178 1.00 0.00 H ATOM 2367 N LEU A 311 84.448 85.663 30.080 1.00 22.24 N ATOM 2368 CA LEU A 311 85.171 84.454 30.447 1.00 23.40 C ATOM 2369 C LEU A 311 84.265 83.536 31.222 1.00 24.65 C ATOM 2370 O LEU A 311 84.266 82.317 31.010 1.00 25.68 O ATOM 2371 CB LEU A 311 86.404 84.771 31.289 1.00 25.41 C ATOM 2372 CG LEU A 311 87.682 85.260 30.660 1.00 29.18 C ATOM 2373 CD1 LEU A 311 88.587 85.943 31.744 1.00 32.96 C ATOM 2374 CD2 LEU A 311 88.398 84.066 30.004 1.00 37.43 C ATOM 2375 H LEU A 311 84.759 86.590 30.436 1.00 0.00 H ATOM 2376 N ALA A 312 83.557 84.100 32.204 1.00 23.94 N ATOM 2377 CA ALA A 312 82.631 83.276 33.001 1.00 24.56 C ATOM 2378 C ALA A 312 81.565 82.660 32.144 1.00 23.46 C ATOM 2379 O ALA A 312 81.181 81.492 32.344 1.00 24.74 O ATOM 2380 CB ALA A 312 81.997 84.137 34.123 1.00 25.55 C ATOM 2381 H ALA A 312 83.659 85.115 32.405 1.00 0.00 H ATOM 2382 N LYS A 313 81.029 83.440 31.211 1.00 23.55 N ATOM 2383 CA LYS A 313 80.034 82.885 30.291 1.00 24.95 C ATOM 2384 C LYS A 313 80.618 81.776 29.407 1.00 25.27 C ATOM 2385 O LYS A 313 79.932 80.780 29.142 1.00 26.56 O ATOM 2386 CB LYS A 313 79.437 83.992 29.394 1.00 28.82 C ATOM 2387 CG LYS A 313 78.398 84.852 30.138 1.00 42.09 C ATOM 2388 CD LYS A 313 77.948 86.091 29.337 1.00 53.96 C ATOM 2389 CE LYS A 313 79.050 87.176 29.368 1.00 62.00 C ATOM 2390 NZ LYS A 313 78.563 88.582 29.275 1.00 65.02 N ATOM 2391 HZ1 LYS A 313 78.047 88.710 28.381 1.00 0.00 H ATOM 2392 HZ2 LYS A 313 77.929 88.782 30.075 1.00 0.00 H ATOM 2393 HZ3 LYS A 313 79.375 89.231 29.304 1.00 0.00 H ATOM 2394 H LYS A 313 81.314 84.437 31.135 1.00 0.00 H ATOM 2395 N GLU A 314 81.864 81.930 28.968 1.00 25.83 N ATOM 2396 CA GLU A 314 82.477 80.929 28.098 1.00 28.29 C ATOM 2397 C GLU A 314 82.618 79.617 28.872 1.00 29.98 C ATOM 2398 O GLU A 314 82.330 78.551 28.348 1.00 32.12 O ATOM 2399 CB GLU A 314 83.838 81.410 27.587 1.00 28.73 C ATOM 2400 CG GLU A 314 84.514 80.382 26.733 1.00 31.80 C ATOM 2401 CD GLU A 314 85.755 80.960 26.141 1.00 38.28 C ATOM 2402 OE1 GLU A 314 85.659 81.940 25.376 1.00 37.75 O ATOM 2403 OE2 GLU A 314 86.850 80.487 26.480 1.00 43.70 O ATOM 2404 H GLU A 314 82.408 82.772 29.247 1.00 0.00 H ATOM 2405 N THR A 315 83.089 79.726 30.111 1.00 29.37 N ATOM 2406 CA THR A 315 83.166 78.550 30.997 1.00 31.19 C ATOM 2407 C THR A 315 81.814 77.894 31.167 1.00 31.19 C ATOM 2408 O THR A 315 81.721 76.649 31.171 1.00 33.50 O ATOM 2409 CB THR A 315 83.737 78.949 32.363 1.00 30.65 C ATOM 2410 OG1 THR A 315 85.072 79.423 32.174 1.00 31.12 O ATOM 2411 CG2 THR A 315 83.693 77.781 33.386 1.00 32.80 C ATOM 2412 HG1 THR A 315 85.455 79.685 33.049 1.00 0.00 H ATOM 2413 H THR A 315 83.407 80.653 30.459 1.00 0.00 H ATOM 2414 N ALA A 316 80.756 78.693 31.288 1.00 28.96 N ATOM 2415 CA ALA A 316 79.432 78.117 31.443 1.00 29.02 C ATOM 2416 C ALA A 316 78.856 77.545 30.119 1.00 40.60 C ATOM 2417 O ALA A 316 77.983 76.692 30.138 1.00 52.80 O ATOM 2418 CB ALA A 316 78.458 79.157 32.069 1.00 30.74 C ATOM 2419 H ALA A 316 80.877 79.726 31.272 1.00 0.00 H ATOM 2420 N GLY A 317 79.369 77.958 28.978 1.00 35.00 N ATOM 2421 CA GLY A 317 78.785 77.519 27.727 1.00 38.59 C ATOM 2422 C GLY A 317 79.655 76.504 27.026 1.00 54.04 C ATOM 2423 O GLY A 317 80.643 76.033 27.594 1.00 60.22 O ATOM 2424 H GLY A 317 80.190 78.597 28.975 1.00 0.00 H TER 2425 GLY A 317 HETATM 2426 ZN ZN A 1 85.930 97.865 14.701 1.00 18.68 ZN HETATM 2427 ZN ZN A 2 88.349 94.925 15.306 1.00 19.04 ZN HETATM 2428 O HOH 3 85.572 96.910 19.121 1.00 53.37 O HETATM 2429 O HOH 4 75.005 109.220 15.088 1.00 35.64 O HETATM 2430 O HOH 5 91.952 81.992 10.155 1.00 44.73 O HETATM 2431 O HOH 6 72.591 107.294 8.349 1.00 48.09 O HETATM 2432 O HOH 7 81.702 114.378 -0.199 1.00 52.81 O HETATM 2433 O HOH 8 76.567 123.422 28.342 1.00 61.67 O HETATM 2434 O HOH 9 100.860 127.902 25.756 1.00 39.53 O HETATM 2435 O HOH 10 91.773 82.310 2.653 1.00 25.36 O HETATM 2436 O HOH 11 107.014 108.844 24.074 1.00 41.74 O HETATM 2437 O HOH 12 104.980 103.762 0.000 1.00 42.99 O HETATM 2438 O HOH 13 83.799 99.646 35.064 1.00 28.14 O HETATM 2439 O HOH 14 89.659 91.275 36.820 1.00 40.76 O HETATM 2440 O HOH 15 101.545 95.482 5.630 1.00 30.91 O HETATM 2441 O HOH 16 76.197 71.303 -1.920 1.00 27.72 O HETATM 2442 O HOH 17 82.466 94.848 24.059 1.00 50.45 O HETATM 2443 O HOH 18 104.167 102.692 26.524 1.00 42.51 O HETATM 2444 O HOH 19 110.712 102.254 12.880 1.00 21.45 O HETATM 2445 O HOH 20 108.650 105.646 24.513 1.00 46.00 O HETATM 2446 O HOH 21 97.457 80.437 9.061 1.00 32.96 O HETATM 2447 O HOH 22 99.321 119.722 7.711 1.00 32.06 O HETATM 2448 O HOH 23 83.678 84.869 9.774 1.00 45.52 O HETATM 2449 O HOH 24 78.695 116.959 15.882 1.00 51.90 O HETATM 2450 O HOH 25 85.043 124.527 25.444 1.00 54.67 O HETATM 2451 O HOH 26 81.264 88.134 5.671 1.00 40.76 O HETATM 2452 O HOH 27 102.494 110.623 24.147 1.00 28.98 O HETATM 2453 O HOH 28 89.326 92.502 9.018 1.00 20.72 O HETATM 2454 O HOH 29 87.662 82.503 1.806 1.00 29.96 O HETATM 2455 O HOH 30 103.473 86.397 15.695 1.00 19.66 O HETATM 2456 O HOH 31 95.444 106.995 32.318 1.00 23.66 O HETATM 2457 O HOH 32 84.169 121.356 10.351 1.00 34.53 O HETATM 2458 O HOH 33 78.162 104.700 19.110 1.00 48.95 O HETATM 2459 O HOH 34 75.643 87.619 -0.469 1.00 33.32 O HETATM 2460 O HOH 35 90.164 81.247 16.935 1.00 31.48 O HETATM 2461 O HOH 36 92.643 126.416 21.757 1.00 37.41 O HETATM 2462 O HOH 37 80.901 102.188 16.234 1.00 19.14 O HETATM 2463 O HOH 38 104.239 111.166 22.306 1.00 28.16 O HETATM 2464 O HOH 39 93.244 123.083 27.774 1.00 45.73 O HETATM 2465 O HOH 40 100.048 101.900 13.180 1.00 19.23 O HETATM 2466 O HOH 41 86.361 93.604 26.947 1.00 22.80 O HETATM 2467 O HOH 42 82.199 116.950 4.993 1.00 52.06 O HETATM 2468 O HOH 43 98.600 90.062 13.117 1.00 20.95 O HETATM 2469 O HOH 44 97.137 118.596 30.506 1.00 27.99 O HETATM 2470 O HOH 45 84.677 113.549 29.610 1.00 18.96 O HETATM 2471 O HOH 46 82.189 91.112 35.246 1.00 38.86 O HETATM 2472 O HOH 47 95.689 78.827 26.178 1.00 35.38 O HETATM 2473 O HOH 48 81.750 96.685 31.813 1.00 29.33 O HETATM 2474 O HOH 49 99.296 86.851 14.436 1.00 23.87 O HETATM 2475 O HOH 50 104.727 80.522 25.326 1.00 34.66 O HETATM 2476 O HOH 51 99.980 95.962 26.778 1.00 24.62 O HETATM 2477 O HOH 52 75.413 112.675 23.490 1.00 36.21 O HETATM 2478 O HOH 53 99.167 89.563 31.770 1.00 30.59 O HETATM 2479 O HOH 54 102.040 87.251 26.480 1.00 50.24 O HETATM 2480 O HOH 55 83.783 107.820 0.766 1.00 24.32 O HETATM 2481 O HOH 56 76.368 113.379 9.830 1.00 50.86 O HETATM 2482 O HOH 57 88.716 103.621 13.265 1.00 21.02 O HETATM 2483 O HOH 58 78.377 120.134 29.410 1.00 40.12 O HETATM 2484 O HOH 59 86.577 105.521 -4.206 1.00 45.75 O HETATM 2485 O HOH 60 98.314 100.065 34.912 1.00 29.63 O HETATM 2486 O HOH 61 94.269 120.627 28.616 1.00 46.96 O HETATM 2487 O HOH 62 85.603 93.703 1.652 1.00 52.80 O HETATM 2488 O HOH 63 89.010 101.555 -0.294 1.00 23.58 O HETATM 2489 O HOH 64 94.964 94.164 34.171 1.00 31.91 O HETATM 2490 O HOH 65 89.222 80.385 4.466 1.00 44.48 O HETATM 2491 O HOH 66 83.480 100.943 27.221 1.00 28.49 O HETATM 2492 O HOH 67 96.249 127.004 22.223 1.00 33.10 O HETATM 2493 O HOH 68 94.169 112.098 -5.068 1.00 44.73 O HETATM 2494 O HOH 69 91.865 85.300 34.090 1.00 46.07 O HETATM 2495 O HOH 70 95.591 96.545 -2.682 1.00 23.06 O HETATM 2496 O HOH 71 79.548 108.883 17.745 1.00 24.60 O HETATM 2497 O HOH 72 88.948 115.666 29.328 1.00 32.45 O HETATM 2498 O HOH 73 80.411 90.520 29.755 1.00 39.91 O HETATM 2499 O HOH 74 91.027 90.583 10.011 1.00 19.08 O HETATM 2500 O HOH 75 92.872 98.778 2.361 1.00 21.03 O HETATM 2501 O HOH 76 90.718 77.692 30.607 1.00 60.18 O HETATM 2502 O HOH 77 88.337 88.067 8.205 1.00 28.18 O HETATM 2503 O HOH 78 102.882 97.963 25.885 1.00 27.22 O HETATM 2504 O HOH 79 85.820 118.971 0.410 1.00 40.17 O HETATM 2505 O HOH 80 89.884 118.051 23.709 1.00 39.37 O HETATM 2506 O HOH 81 87.749 82.796 18.335 1.00 19.88 O HETATM 2507 O HOH 82 80.201 112.422 24.938 1.00 20.68 O HETATM 2508 O HOH 83 86.507 81.104 33.799 1.00 54.19 O HETATM 2509 O HOH 84 101.123 90.629 20.051 1.00 31.65 O HETATM 2510 O HOH 85 101.428 89.759 22.524 1.00 27.12 O HETATM 2511 O HOH 86 75.508 83.151 1.430 1.00 39.82 O HETATM 2512 O HOH 87 91.598 90.729 1.262 1.00 41.21 O HETATM 2513 O HOH 88 74.301 79.967 -3.327 1.00 38.07 O HETATM 2514 O HOH 89 86.099 123.887 15.362 1.00 49.23 O HETATM 2515 O HOH 90 112.017 100.029 15.229 1.00 19.73 O HETATM 2516 O HOH 91 81.306 109.601 31.545 1.00 20.05 O HETATM 2517 O HOH 92 100.953 89.024 5.395 1.00 30.82 O HETATM 2518 O HOH 93 90.175 89.350 15.268 1.00 16.08 O HETATM 2519 O HOH 94 84.491 102.107 34.270 1.00 23.95 O HETATM 2520 O HOH 95 102.165 88.399 18.945 1.00 27.39 O HETATM 2521 O HOH 96 74.731 118.701 22.024 1.00 39.42 O HETATM 2522 O HOH 97 90.949 79.070 17.159 1.00 46.10 O HETATM 2523 O HOH 98 103.699 98.431 -1.709 1.00 43.88 O HETATM 2524 O HOH 99 97.639 83.287 6.497 1.00 31.83 O HETATM 2525 O HOH 100 93.583 114.641 32.822 1.00 60.95 O HETATM 2526 O HOH 101 93.946 86.039 34.135 1.00 43.72 O HETATM 2527 O HOH 102 102.277 100.711 -1.226 1.00 32.65 O HETATM 2528 O HOH 103 88.675 111.403 28.333 1.00 19.97 O HETATM 2529 O HOH 104 110.328 98.149 22.242 1.00 19.84 O HETATM 2530 O HOH 105 79.597 82.441 2.149 1.00 39.30 O HETATM 2531 O HOH 106 101.120 91.039 26.741 1.00 29.18 O HETATM 2532 O HOH 107 98.379 75.997 19.435 1.00 22.49 O HETATM 2533 O HOH 108 84.616 120.887 18.266 1.00 43.76 O HETATM 2534 O HOH 109 81.864 113.712 2.246 1.00 36.14 O HETATM 2535 O HOH 110 74.904 105.898 16.574 1.00 49.50 O HETATM 2536 O HOH 111 85.523 106.060 -1.472 1.00 28.30 O HETATM 2537 O HOH 112 82.968 119.168 20.409 1.00 38.93 O HETATM 2538 O HOH 113 77.793 113.637 24.449 1.00 32.62 O HETATM 2539 O HOH 114 111.627 98.700 12.740 1.00 23.33 O HETATM 2540 O HOH 115 78.509 104.740 24.713 1.00 38.04 O HETATM 2541 O HOH 116 113.060 105.203 15.719 1.00 22.04 O HETATM 2542 O HOH 117 98.064 98.928 14.699 1.00 27.89 O HETATM 2543 O HOH 118 86.272 103.397 -1.926 1.00 39.75 O HETATM 2544 O HOH 119 96.164 94.758 14.024 1.00 16.88 O HETATM 2545 O HOH 120 93.643 81.216 24.533 1.00 19.92 O HETATM 2546 O HOH 121 93.065 88.331 18.698 1.00 17.15 O HETATM 2547 O HOH 122 78.480 116.953 9.928 1.00 36.08 O HETATM 2548 O HOH 123 93.516 122.548 12.800 1.00 44.23 O HETATM 2549 O HOH 124 103.369 115.941 26.917 1.00 52.18 O HETATM 2550 O HOH 125 91.531 97.498 34.276 1.00 32.00 O HETATM 2551 O HOH 126 79.510 84.290 -4.326 1.00 23.56 O HETATM 2552 O HOH 127 100.701 102.702 29.512 1.00 26.72 O HETATM 2553 O HOH 128 109.697 101.931 3.138 1.00 23.46 O HETATM 2554 O HOH 129 101.044 112.630 25.410 1.00 25.58 O HETATM 2555 O HOH 130 83.889 110.486 32.372 1.00 16.67 O HETATM 2556 O HOH 131 80.462 103.534 18.588 1.00 25.88 O HETATM 2557 O HOH 132 85.057 117.834 20.105 1.00 34.89 O HETATM 2558 O HOH 133 75.481 109.954 24.704 1.00 64.22 O HETATM 2559 O HOH 134 91.284 101.226 35.649 1.00 27.33 O HETATM 2560 O HOH 135 99.485 89.634 0.253 1.00 51.87 O HETATM 2561 O HOH 136 84.583 121.448 15.266 1.00 28.41 O HETATM 2562 O HOH 137 76.211 89.925 1.027 1.00 38.69 O HETATM 2563 O HOH 138 73.978 102.365 15.195 1.00 52.78 O HETATM 2564 O HOH 139 83.341 74.471 31.959 1.00 35.79 O HETATM 2565 O HOH 140 107.230 95.854 24.828 1.00 33.98 O HETATM 2566 O HOH 141 100.248 94.872 19.818 1.00 20.29 O HETATM 2567 O HOH 142 85.638 85.539 35.146 1.00 33.22 O HETATM 2568 O HOH 143 110.748 99.554 9.278 1.00 29.06 O HETATM 2569 O HOH 144 86.153 82.071 6.922 1.00 36.30 O HETATM 2570 O HOH 145 98.006 100.572 -2.115 1.00 22.50 O HETATM 2571 O HOH 146 108.835 107.531 8.970 1.00 49.22 O HETATM 2572 O HOH 147 100.819 86.269 22.912 1.00 20.18 O HETATM 2573 O HOH 148 83.857 84.067 24.807 1.00 35.08 O HETATM 2574 O HOH 149 83.534 91.662 23.724 1.00 35.10 O HETATM 2575 O HOH 150 93.242 94.879 22.523 1.00 17.63 O HETATM 2576 O HOH 151 105.102 110.137 3.198 1.00 37.86 O HETATM 2577 O HOH 152 73.078 77.422 -0.787 1.00 45.56 O HETATM 2578 O HOH 153 111.911 107.439 16.897 1.00 32.52 O HETATM 2579 O HOH 154 81.052 117.657 12.662 1.00 35.18 O HETATM 2580 O HOH 155 94.000 108.686 37.721 1.00 53.37 O HETATM 2581 O HOH 156 86.623 98.385 23.172 1.00 26.97 O HETATM 2582 O HOH 157 99.086 105.480 -7.356 1.00 40.82 O HETATM 2583 O HOH 158 108.278 103.916 1.876 1.00 29.24 O HETATM 2584 O HOH 159 86.450 114.794 25.930 1.00 24.87 O HETATM 2585 O HOH 160 102.408 102.203 27.855 1.00 35.99 O HETATM 2586 O HOH 161 108.720 116.824 11.330 1.00 41.28 O HETATM 2587 O HOH 162 98.647 111.466 25.513 1.00 20.60 O HETATM 2588 O HOH 163 98.449 85.845 12.136 1.00 21.89 O HETATM 2589 O HOH 164 81.597 78.264 25.569 1.00 41.39 O HETATM 2590 O HOH 165 84.550 91.620 26.438 1.00 44.10 O HETATM 2591 O HOH 166 92.078 78.626 12.688 1.00 41.69 O HETATM 2592 O HOH 167 103.217 115.126 21.006 1.00 31.84 O HETATM 2593 O HOH 168 97.116 92.089 14.389 1.00 17.51 O HETATM 2594 O HOH 169 95.260 103.632 18.154 1.00 27.98 O HETATM 2595 O HOH 170 88.502 95.598 36.594 1.00 39.38 O HETATM 2596 O HOH 171 86.923 100.799 19.903 1.00 19.13 O HETATM 2597 O HOH 172 102.341 112.915 30.981 1.00 37.10 O HETATM 2598 O HOH 173 100.796 96.369 31.028 1.00 44.69 O HETATM 2599 O HOH 174 99.450 119.824 -3.042 1.00 66.91 O HETATM 2600 O HOH 175 85.713 83.374 16.751 1.00 32.51 O HETATM 2601 O HOH 176 77.902 97.130 12.537 1.00 26.19 O HETATM 2602 O HOH 177 90.523 111.419 30.508 1.00 24.73 O HETATM 2603 O HOH 178 73.788 81.756 -0.675 1.00 38.05 O HETATM 2604 O HOH 179 96.967 111.123 32.335 1.00 33.60 O HETATM 2605 O HOH 180 81.769 120.035 13.262 1.00 41.88 O HETATM 2606 O HOH 181 84.289 85.963 16.385 1.00 36.75 O HETATM 2607 O HOH 182 72.974 97.249 7.985 1.00 64.89 O HETATM 2608 O HOH 183 86.216 108.350 20.332 1.00 19.24 O HETATM 2609 O HOH 184 84.883 89.351 3.366 1.00 54.82 O HETATM 2610 O HOH 185 92.503 110.288 -6.721 1.00 39.43 O HETATM 2611 O HOH 186 100.606 99.418 14.697 1.00 19.18 O HETATM 2612 O HOH 187 99.476 93.356 26.098 1.00 28.93 O HETATM 2613 O HOH 188 96.615 98.837 -3.829 1.00 22.13 O HETATM 2614 O HOH 189 93.720 88.187 13.392 1.00 16.43 O HETATM 2615 O HOH 190 81.113 87.931 22.584 1.00 37.63 O HETATM 2616 O HOH 191 100.349 124.643 20.353 1.00 39.90 O HETATM 2617 O HOH 192 73.316 114.237 23.789 1.00 54.89 O HETATM 2618 O HOH 193 81.246 84.733 2.783 1.00 42.77 O HETATM 2619 O HOH 194 91.492 100.312 0.103 1.00 18.20 O HETATM 2620 O HOH 195 100.495 86.842 6.765 1.00 40.22 O HETATM 2621 O HOH 196 86.969 77.719 25.442 1.00 47.79 O HETATM 2622 O HOH 197 81.682 83.403 17.454 1.00 59.57 O HETATM 2623 O HOH 198 81.580 84.057 26.276 1.00 32.15 O HETATM 2624 O HOH 199 94.731 82.492 27.157 1.00 22.69 O HETATM 2625 O HOH 200 107.866 95.690 20.521 1.00 20.78 O HETATM 2626 O HOH 201 82.828 111.377 -1.864 1.00 48.34 O HETATM 2627 O HOH 202 78.642 107.002 19.580 1.00 35.79 O HETATM 2628 O HOH 203 99.928 99.043 -0.350 1.00 30.70 O HETATM 2629 O HOH 204 92.387 115.841 -0.055 1.00 34.94 O HETATM 2630 O HOH 205 85.396 99.390 27.786 1.00 39.21 O HETATM 2631 O HOH 206 110.814 102.813 7.023 1.00 29.82 O HETATM 2632 O HOH 207 72.769 102.701 12.538 1.00 34.75 O HETATM 2633 O HOH 208 92.467 108.451 41.344 1.00 36.56 O HETATM 2634 O HOH 209 100.539 107.561 -4.544 1.00 43.78 O HETATM 2635 O HOH 210 104.077 93.485 16.351 1.00 23.47 O HETATM 2636 O HOH 211 91.011 123.278 19.967 1.00 41.94 O HETATM 2637 O HOH 212 86.082 78.915 18.567 1.00 62.44 O HETATM 2638 O HOH 213 100.808 94.227 23.952 1.00 22.58 O HETATM 2639 O HOH 214 75.125 116.127 13.916 1.00 58.08 O HETATM 2640 O HOH 215 113.248 107.770 11.654 1.00 46.57 O HETATM 2641 O HOH 216 78.434 91.464 8.595 1.00 59.19 O HETATM 2642 O HOH 217 83.097 118.218 23.465 1.00 27.42 O HETATM 2643 O HOH 218 78.108 101.010 17.065 1.00 54.92 O HETATM 2644 O HOH 219 90.308 115.219 31.700 1.00 58.42 O HETATM 2645 O HOH 220 93.591 80.153 28.101 1.00 28.85 O HETATM 2646 O HOH 221 107.597 123.065 7.816 1.00 48.69 O HETATM 2647 O HOH 222 104.980 100.146 0.000 1.00 51.16 O HETATM 2648 O HOH 223 71.530 100.129 10.615 1.00 43.21 O HETATM 2649 O HOH 224 92.813 107.848 32.780 1.00 23.43 O HETATM 2650 O HOH 225 89.060 75.723 26.082 1.00 57.57 O HETATM 2651 O HOH 226 87.475 112.631 -2.925 1.00 48.41 O HETATM 2652 O HOH 227 96.261 104.856 36.271 1.00 58.33 O HETATM 2653 O HOH 228 96.855 83.405 28.868 1.00 26.06 O HETATM 2654 O HOH 229 88.726 125.927 13.967 1.00 54.88 O HETATM 2655 O HOH 230 83.338 87.964 1.879 1.00 47.71 O HETATM 2656 O HOH 231 83.075 92.542 2.180 1.00 51.38 O HETATM 2657 O HOH 232 83.431 81.472 20.757 1.00 44.05 O HETATM 2658 O HOH 233 89.754 81.540 12.450 1.00 46.80 O HETATM 2659 O HOH 234 83.757 80.849 23.129 1.00 43.57 O HETATM 2660 O HOH 235 72.779 80.888 -5.265 1.00 38.53 O HETATM 2661 O HOH 236 77.667 109.021 24.658 1.00 61.81 O HETATM 2662 O HOH 237 81.495 95.913 36.285 1.00 50.28 O HETATM 2663 O HOH 238 111.247 105.976 22.212 1.00 43.51 O HETATM 2664 O HOH 239 95.857 77.155 23.408 1.00 37.26 O HETATM 2665 O HOH 240 89.671 74.608 21.123 1.00 55.70 O HETATM 2666 O HOH 241 106.079 95.480 3.947 1.00 53.06 O HETATM 2667 O HOH 242 108.220 97.173 5.494 1.00 56.36 O HETATM 2668 O HOH 243 102.435 93.453 18.776 1.00 28.57 O HETATM 2669 O HOH 244 97.743 116.731 -4.309 1.00 42.92 O HETATM 2670 O HOH 245 86.390 121.956 8.498 1.00 43.45 O HETATM 2671 O HOH 246 92.814 89.063 15.958 1.00 18.49 O HETATM 2672 O HOH 247 88.995 122.225 19.780 1.00 45.21 O HETATM 2673 O HOH 248 106.999 112.331 3.613 1.00 46.32 O HETATM 2674 O HOH 249 102.947 95.096 25.442 1.00 56.43 O HETATM 2675 O HOH 250 106.454 110.407 7.603 1.00 50.92 O HETATM 2676 O HOH 251 99.506 112.598 -3.882 1.00 47.95 O HETATM 2677 O HOH 252 97.244 78.616 11.163 1.00 26.58 O HETATM 2678 O HOH 253 96.459 88.266 13.039 1.00 20.98 O HETATM 2679 O HOH 254 98.339 79.987 28.598 1.00 53.70 O HETATM 2680 O HOH 255 98.775 96.106 -2.555 1.00 45.57 O HETATM 2681 O HOH 256 106.267 118.504 20.941 1.00 51.04 O HETATM 2682 O HOH 257 91.562 112.921 -4.588 1.00 54.37 O HETATM 2683 O HOH 258 102.141 109.802 -4.519 1.00 67.70 O HETATM 2684 O HOH 259 110.176 98.377 6.456 1.00 47.67 O HETATM 2685 O HOH 260 70.083 66.673 -3.375 1.00 51.65 O HETATM 2686 O HOH 261 85.578 82.919 34.908 1.00 44.46 O HETATM 2687 O HOH 262 89.275 93.758 38.457 1.00 53.64 O HETATM 2688 O HOH 263 87.012 87.254 0.211 1.00 55.20 O HETATM 2689 O HOH 264 94.347 97.037 34.960 1.00 47.53 O HETATM 2690 O HOH 265 80.406 94.444 32.612 1.00 45.24 O HETATM 2691 O HOH 266 79.798 115.017 5.522 1.00 40.71 O HETATM 2692 O HOH 267 88.052 86.213 35.918 1.00 44.26 O HETATM 2693 O HOH 268 112.310 105.745 9.897 1.00 48.80 O HETATM 2694 O HOH 269 83.511 97.604 27.729 1.00 42.77 O HETATM 2695 O HOH 270 102.202 105.225 29.269 1.00 50.48 O HETATM 2696 O HOH 271 109.705 119.649 12.629 1.00 50.04 O HETATM 2697 O HOH 272 79.660 105.213 31.162 1.00 31.39 O HETATM 2698 O HOH 273 111.602 108.472 9.179 1.00 65.02 O HETATM 2699 O HOH 274 73.081 107.231 10.874 1.00 39.22 O HETATM 2700 O HOH 275 80.460 101.040 20.442 1.00 44.27 O HETATM 2701 O HOH 276 85.006 98.672 20.813 1.00 27.76 O HETATM 2702 O HOH 277 77.128 117.974 14.455 1.00 68.32 O HETATM 2703 O HOH 278 77.321 108.707 30.211 1.00 33.96 O HETATM 2704 O HOH 279 85.385 81.236 9.712 1.00 78.30 O HETATM 2705 O HOH 280 88.107 80.051 17.529 1.00 41.21 O HETATM 2706 O HOH 281 91.942 126.172 11.380 1.00 47.54 O HETATM 2707 O HOH 282 85.893 117.985 22.276 1.00 40.74 O HETATM 2708 O HOH 283 97.998 123.007 10.053 1.00 45.28 O HETATM 2709 O HOH 284 99.465 94.338 -1.360 1.00 47.13 O HETATM 2710 O HOH 285 99.534 118.603 31.378 1.00 45.24 O HETATM 2711 O HOH 286 84.619 95.575 25.788 1.00 33.50 O HETATM 2712 O HOH 287 106.058 103.842 26.095 1.00 47.44 O HETATM 2713 O HOH 288 108.617 105.373 5.564 1.00 42.63 O HETATM 2714 O HOH 289 82.917 86.698 11.012 1.00 58.94 O HETATM 2715 O HOH 290 87.181 113.720 28.408 1.00 22.64 O HETATM 2716 O HOH 291 84.570 100.188 -1.660 1.00 49.23 O HETATM 2717 O HOH 292 90.638 112.940 32.822 1.00 41.82 O HETATM 2718 O HOH 293 86.075 79.486 36.094 1.00 41.65 O HETATM 2719 O HOH 294 106.357 81.431 27.220 1.00 50.83 O HETATM 2720 O HOH 295 102.689 112.827 27.894 1.00 32.21 O HETATM 2721 O HOH 296 83.692 80.847 35.761 1.00 43.41 O HETATM 2722 O HOH 297 95.845 123.318 11.743 1.00 36.22 O HETATM 2723 O HOH 298 80.280 120.655 16.062 1.00 55.85 O HETATM 2724 O HOH 299 114.152 105.123 11.957 1.00 54.32 O HETATM 2725 O HOH 300 90.793 121.629 27.165 1.00 51.15 O HETATM 2726 O HOH 301 96.284 85.981 33.118 1.00 46.08 O HETATM 2727 O HOH 302 101.638 117.880 29.338 1.00 44.51 O HETATM 2728 O HOH 303 97.384 98.122 36.354 1.00 47.00 O HETATM 2729 O HOH 304 86.433 84.944 0.824 1.00 41.88 O HETATM 2730 O HOH 305 78.675 110.486 31.925 1.00 25.48 O HETATM 2731 O HOH 306 70.367 76.098 -7.434 1.00 59.20 O HETATM 2732 O HOH 307 100.320 97.141 -3.929 1.00 50.30 O HETATM 2733 O HOH 308 81.928 98.030 34.892 1.00 46.90 O HETATM 2734 O HOH 309 83.046 118.456 1.332 1.00 49.63 O HETATM 2735 O HOH 310 106.167 112.640 23.923 1.00 45.17 O HETATM 2736 O HOH 311 92.474 118.443 28.819 1.00 38.68 O HETATM 2737 O HOH 312 97.725 87.636 33.405 1.00 41.42 O HETATM 2738 O HOH 313 103.325 89.922 5.376 1.00 48.04 O HETATM 2739 O HOH 314 80.334 121.225 11.142 1.00 45.29 O HETATM 2740 O HOH 315 85.213 97.788 25.412 1.00 41.41 O HETATM 2741 O HOH 316 81.978 99.286 25.013 1.00 57.30 O HETATM 2742 O HOH 317 76.989 106.152 31.046 1.00 59.94 O HETATM 2743 O HOH 318 81.580 101.646 29.190 1.00 35.36 O HETATM 2744 O HOH 319 102.096 101.012 31.306 1.00 54.56 O HETATM 2745 O HOH 320 108.452 122.826 10.134 1.00 52.28 O HETATM 2746 O HOH 321 106.258 93.704 22.011 1.00 31.60 O HETATM 2747 O HOH 322 95.859 109.676 39.325 1.00 37.90 O HETATM 2748 O HOH 323 113.463 109.278 18.156 1.00 38.44 O HETATM 2749 O HOH 324 96.612 89.101 35.938 1.00 51.83 O HETATM 2750 O HOH 325 95.072 116.854 -5.627 1.00 55.38 O HETATM 2751 O HOH 326 94.700 76.079 14.601 1.00 41.28 O HETATM 2752 O HOH 327 81.497 88.276 10.726 1.00 63.36 O HETATM 2753 O HOH 328 102.346 92.213 23.056 1.00 40.22 O HETATM 2754 O HOH 329 72.855 80.747 1.376 1.00 60.53 O HETATM 2755 O HOH 330 104.916 89.420 19.968 1.00 37.33 O HETATM 2756 O HOH 331 92.100 76.880 14.945 1.00 50.57 O HETATM 2757 O HOH 332 81.284 102.768 31.578 1.00 28.51 O HETATM 2758 O HOH 333 80.711 107.209 32.822 1.00 21.62 O HETATM 2759 O HOH 334 107.025 106.524 7.212 1.00 58.26 O HETATM 2760 O HOH 335 115.801 109.113 17.180 1.00 45.74 O HETATM 2761 C12 UNN A 336 81.553 95.808 16.818 1.00 0.05 C HETATM 2762 C08 UNN A 336 83.015 95.495 16.922 1.00 0.04 C HETATM 2763 C09 UNN A 336 83.317 95.084 18.366 1.00 0.09 C HETATM 2764 O11 UNN A 336 82.431 94.562 19.055 1.00 -0.56 O HETATM 2765 O10 UNN A 336 84.412 95.381 18.784 1.00 -0.56 O HETATM 2766 N07 UNN A 336 83.409 94.426 15.966 1.00 0.27 N HETATM 2767 C03 UNN A 336 83.984 94.872 14.672 1.00 0.04 C HETATM 2768 C02 UNN A 336 85.466 94.586 14.626 1.00 0.04 C HETATM 2769 S01 UNN A 336 86.291 95.852 15.566 1.00 -0.17 S HETATM 2770 H8 UNN A 336 87.285 95.685 15.552 1.00 0.10 H HETATM 2771 H6 UNN A 336 85.819 94.603 13.584 1.00 0.04 H HETATM 2772 H7 UNN A 336 85.671 93.599 15.066 1.00 0.04 H HETATM 2773 S04 UNN A 336 83.255 93.873 13.438 1.00 -0.10 S HETATM 2774 C05 UNN A 336 82.717 92.629 14.550 1.00 0.05 C HETATM 2775 C06 UNN A 336 82.306 93.481 15.757 1.00 0.04 C HETATM 2776 S13 UNN A 336 80.970 94.614 15.661 1.00 -0.10 S HETATM 2777 H9 UNN A 336 82.153 92.810 16.615 1.00 0.10 H HETATM 2778 H10 UNN A 336 81.865 92.064 14.144 1.00 0.04 H HETATM 2779 H11 UNN A 336 83.531 91.933 14.804 1.00 0.04 H HETATM 2780 H5 UNN A 336 83.785 95.940 14.502 1.00 0.10 H HETATM 2781 H4 UNN A 336 84.145 93.912 16.424 1.00 0.21 H HETATM 2782 H3 UNN A 336 83.590 96.401 16.682 1.00 0.10 H HETATM 2783 H1 UNN A 336 81.394 96.830 16.445 1.00 0.05 H HETATM 2784 H2 UNN A 336 81.054 95.691 17.791 1.00 0.05 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 765 763 764 2427 CONECT 779 778 781 2427 CONECT 797 795 2426 CONECT 808 806 807 2426 CONECT 1423 1421 1422 2427 CONECT 1993 1992 2232 CONECT 2055 2053 2054 2426 CONECT 2232 1993 2231 CONECT 2426 797 808 2055 CONECT 2427 765 779 1423 CONECT 2761 2762 2776 2783 2784 CONECT 2762 2761 2763 2766 2782 CONECT 2763 2762 2764 2765 CONECT 2764 2763 CONECT 2765 2763 CONECT 2766 2762 2767 2775 2781 CONECT 2767 2766 2768 2773 2780 CONECT 2768 2767 2769 2771 2772 CONECT 2769 2768 2770 CONECT 2770 2769 CONECT 2771 2768 CONECT 2772 2768 CONECT 2773 2767 2774 CONECT 2774 2773 2775 2778 2779 CONECT 2775 2766 2774 2776 2777 CONECT 2776 2761 2775 CONECT 2777 2775 CONECT 2778 2774 CONECT 2779 2774 CONECT 2780 2767 CONECT 2781 2766 CONECT 2782 2762 CONECT 2783 2761 CONECT 2784 2761 MASTER 0 0 0 0 0 0 0 0 2783 1 38 21 END
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Related entries of code: 5evk
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Protein Sequence Similarity
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5ew0
RCSB PDB
PDBbind
3C7
Entry Information
PDB ID
5evk
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
metallo-beta-lactamase L1 (MBL-L1)
Ligand Name
3C7
EC.Number
E.C.3.5.2.6
Resolution
1.63(Å)
Affinity (Kd/Ki/IC50)
Ki=12uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Proc.Natl.Acad.Sci.USA Vol. 113: pp. E3745-E3754
Ligand Properties
Formula
C
7
H
1
2
NO
2
S
3
Molecular Weight
238.371
Exact Mass
238.003
No. of atoms
25
No. of bonds
26
Polar Surface Area
131.14
LOGP Value
-0.04 (
Computed with XLOGP3
)
0.97 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
SC[C@H]1SC[C@H]2[N@@H+]1[C@@H](CS2)C(=O)O
InChI String
InChI=1S/C7H11NO2S3/c9-7(10)4-2-12-6-3-13-5(1-11)8(4)6/h4-6,11H,1-3H2,(H,9,10)/p+1/t4-,5+,6-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P52700
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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