Browse entries in the PDBbind-CN Database
HEADER 5A5Z_COMPLEX COMPND 5A5Z_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 236 GLN GLN MET GLU THR GLY ASP GLN ARG PHE GLY ASP LEU SEQRES 2 A 236 VAL PHE ARG GLN LEU ALA PRO ASN VAL TRP GLN HIS THR SEQRES 3 A 236 SER TYR LEU ASP MET PRO GLY PHE GLY ALA VAL ALA SER SEQRES 4 A 236 ASN GLY LEU ILE VAL ARG ASP GLY GLY ARG VAL LEU VAL SEQRES 5 A 236 VAL ASP THR ALA TRP THR ASP ASP GLN THR ALA GLN ILE SEQRES 6 A 236 LEU ASN TRP ILE LYS GLN GLU ILE ASN LEU PRO VAL ALA SEQRES 7 A 236 LEU ALA VAL VAL THR HIS ALA HIS GLN ASP LYS MET GLY SEQRES 8 A 236 GLY MET ASP ALA LEU HIS ALA ALA GLY ILE ALA THR TYR SEQRES 9 A 236 ALA ASN ALA LEU SER ASN GLN LEU ALA PRO GLN GLU GLY SEQRES 10 A 236 MET VAL ALA ALA GLN HIS SER LEU THR PHE ALA ALA ASN SEQRES 11 A 236 GLY TRP VAL GLU PRO ALA THR ALA PRO ASN PHE GLY PRO SEQRES 12 A 236 LEU LYS VAL PHE TYR PRO GLY PRO GLY HIS THR SER ASP SEQRES 13 A 236 ASN ILE THR VAL GLY ILE ASP GLY THR ASP ILE ALA PHE SEQRES 14 A 236 GLY GLY CYS LEU ILE LYS ASP SER LYS ALA LYS SER LEU SEQRES 15 A 236 GLY ASN LEU GLY ASP ALA ASP THR GLU HIS TYR ALA ALA SEQRES 16 A 236 SER ALA ARG ALA PHE GLY ALA ALA PHE PRO LYS ALA SER SEQRES 17 A 236 MET ILE VAL MET SER HIS SER ALA PRO ASP SER ARG ALA SEQRES 18 A 236 ALA ILE THR HIS THR ALA ARG MET ALA ASP LYS LEU ARG SEQRES 19 A 236 LEU GLU HET ZN A 1 1 HET ZN A 2 1 HET WJZ A 282 18 ATOM 1 N GLN A 37 29.231 64.821 -25.570 1.00 68.16 N ATOM 2 CA GLN A 37 28.581 66.094 -25.833 1.00 73.14 C ATOM 3 C GLN A 37 28.516 66.876 -24.534 1.00 75.66 C ATOM 4 O GLN A 37 27.847 66.461 -23.587 1.00 75.02 O ATOM 5 CB GLN A 37 27.177 65.877 -26.447 1.00 73.01 C ATOM 6 CG GLN A 37 26.143 66.988 -26.157 1.00 79.96 C ATOM 7 CD GLN A 37 24.928 66.905 -27.076 1.00 88.51 C ATOM 8 OE1 GLN A 37 24.717 65.888 -27.741 1.00 92.23 O ATOM 9 NE2 GLN A 37 24.128 67.969 -27.118 1.00 92.11 N ATOM 10 HE22 GLN A 37 24.345 68.806 -26.540 1.00 0.00 H ATOM 11 HE21 GLN A 37 23.287 67.963 -27.729 1.00 0.00 H ATOM 12 HN3 GLN A 37 28.682 64.292 -24.863 1.00 0.00 H ATOM 13 HN2 GLN A 37 30.191 64.992 -25.208 1.00 0.00 H ATOM 14 HN1 GLN A 37 29.284 64.271 -26.451 1.00 0.00 H ATOM 15 N GLN A 38 29.253 67.985 -24.478 1.00 77.99 N ATOM 16 CA GLN A 38 29.263 68.806 -23.270 1.00 79.62 C ATOM 17 C GLN A 38 28.044 69.722 -23.219 1.00 81.88 C ATOM 18 O GLN A 38 27.517 70.153 -24.251 1.00 84.88 O ATOM 19 CB GLN A 38 30.581 69.621 -23.153 1.00 82.80 C ATOM 20 CG GLN A 38 31.280 69.948 -24.464 1.00 84.62 C ATOM 21 CD GLN A 38 32.743 70.287 -24.250 1.00 93.89 C ATOM 22 OE1 GLN A 38 33.203 70.354 -23.111 1.00 99.49 O ATOM 23 NE2 GLN A 38 33.480 70.504 -25.336 1.00 91.02 N ATOM 24 HE22 GLN A 38 33.048 70.436 -26.280 1.00 0.00 H ATOM 25 HE21 GLN A 38 34.488 70.741 -25.241 1.00 0.00 H ATOM 26 H GLN A 38 29.825 68.268 -25.300 1.00 0.00 H ATOM 27 N MET A 39 27.604 70.016 -22.003 1.00 86.45 N ATOM 28 CA MET A 39 26.429 70.847 -21.814 1.00 90.81 C ATOM 29 C MET A 39 26.776 72.063 -20.927 1.00 90.55 C ATOM 30 O MET A 39 27.946 72.255 -20.558 1.00 84.85 O ATOM 31 CB MET A 39 25.309 70.037 -21.193 1.00 89.79 C ATOM 32 CG MET A 39 24.798 68.908 -22.111 1.00 90.86 C ATOM 33 SD MET A 39 23.430 67.984 -21.387 1.00115.78 S ATOM 34 CE MET A 39 24.171 67.466 -19.845 1.00 79.22 C ATOM 35 H MET A 39 28.108 69.646 -21.172 1.00 0.00 H ATOM 36 N GLU A 40 25.772 72.888 -20.632 1.00 95.90 N ATOM 37 CA GLU A 40 25.865 74.012 -19.714 1.00 99.47 C ATOM 38 C GLU A 40 26.659 73.708 -18.440 1.00 94.24 C ATOM 39 O GLU A 40 27.763 74.218 -18.230 1.00 91.75 O ATOM 40 CB GLU A 40 24.419 74.491 -19.345 1.00101.38 C ATOM 41 CG GLU A 40 24.247 75.729 -18.424 1.00108.81 C ATOM 42 CD GLU A 40 25.238 76.903 -18.652 1.00108.15 C ATOM 43 OE1 GLU A 40 26.004 76.924 -19.641 1.00105.41 O ATOM 44 OE2 GLU A 40 25.254 77.826 -17.795 1.00108.04 O ATOM 45 H GLU A 40 24.855 72.715 -21.092 1.00 0.00 H ATOM 46 N THR A 41 26.110 72.829 -17.611 1.00 91.43 N ATOM 47 CA THR A 41 26.629 72.635 -16.260 1.00 85.38 C ATOM 48 C THR A 41 27.923 71.833 -16.204 1.00 78.64 C ATOM 49 O THR A 41 28.334 71.415 -15.128 1.00 78.98 O ATOM 50 CB THR A 41 25.585 71.951 -15.347 1.00 83.61 C ATOM 51 OG1 THR A 41 25.138 70.726 -15.940 1.00 81.53 O ATOM 52 CG2 THR A 41 24.403 72.877 -15.146 1.00 87.90 C ATOM 53 HG1 THR A 41 25.910 70.119 -16.062 1.00 0.00 H ATOM 54 H THR A 41 25.295 72.268 -17.930 1.00 0.00 H ATOM 55 N GLY A 42 28.575 71.634 -17.347 1.00 78.22 N ATOM 56 CA GLY A 42 29.837 70.910 -17.390 1.00 77.64 C ATOM 57 C GLY A 42 29.643 69.408 -17.427 1.00 74.33 C ATOM 58 O GLY A 42 30.586 68.645 -17.219 1.00 70.15 O ATOM 59 H GLY A 42 28.173 72.005 -18.231 1.00 0.00 H ATOM 60 N ASP A 43 28.415 68.980 -17.693 1.00 74.42 N ATOM 61 CA ASP A 43 28.118 67.556 -17.765 1.00 68.78 C ATOM 62 C ASP A 43 28.247 67.047 -19.194 1.00 68.38 C ATOM 63 O ASP A 43 27.611 67.571 -20.107 1.00 75.09 O ATOM 64 CB ASP A 43 26.712 67.265 -17.237 1.00 67.42 C ATOM 65 CG ASP A 43 26.508 67.748 -15.817 1.00 69.37 C ATOM 66 OD1 ASP A 43 27.482 67.738 -15.037 1.00 67.39 O ATOM 67 OD2 ASP A 43 25.369 68.133 -15.481 1.00 76.46 O ATOM 68 H ASP A 43 27.654 69.671 -17.852 1.00 0.00 H ATOM 69 N GLN A 44 29.076 66.026 -19.385 1.00 64.79 N ATOM 70 CA GLN A 44 29.213 65.391 -20.690 1.00 61.77 C ATOM 71 C GLN A 44 28.111 64.363 -20.899 1.00 59.88 C ATOM 72 O GLN A 44 27.964 63.435 -20.104 1.00 57.86 O ATOM 73 CB GLN A 44 30.580 64.720 -20.831 1.00 63.07 C ATOM 74 CG GLN A 44 30.724 63.883 -22.095 1.00 67.14 C ATOM 75 CD GLN A 44 31.539 62.621 -21.876 1.00 68.19 C ATOM 76 OE1 GLN A 44 32.376 62.557 -20.976 1.00 66.52 O ATOM 77 NE2 GLN A 44 31.294 61.608 -22.700 1.00 69.89 N ATOM 78 HE22 GLN A 44 30.577 61.707 -23.447 1.00 0.00 H ATOM 79 HE21 GLN A 44 31.819 60.716 -22.598 1.00 0.00 H ATOM 80 H GLN A 44 29.640 65.672 -18.586 1.00 0.00 H ATOM 81 N ARG A 45 27.334 64.522 -21.966 1.00 64.20 N ATOM 82 CA ARG A 45 26.295 63.547 -22.262 1.00 64.13 C ATOM 83 C ARG A 45 26.792 62.579 -23.335 1.00 66.20 C ATOM 84 O ARG A 45 27.360 62.979 -24.354 1.00 63.72 O ATOM 85 CB ARG A 45 24.986 64.242 -22.668 1.00 69.96 C ATOM 86 CG ARG A 45 24.594 64.161 -24.134 1.00 76.39 C ATOM 87 CD ARG A 45 23.169 64.661 -24.332 1.00 84.65 C ATOM 88 NE ARG A 45 22.196 63.805 -23.658 1.00 86.54 N ATOM 89 CZ ARG A 45 21.256 64.245 -22.826 1.00 85.57 C ATOM 90 NH1 ARG A 45 21.156 65.540 -22.556 1.00 82.46 N ATOM 91 NH2 ARG A 45 20.416 63.387 -22.262 1.00 78.16 N ATOM 92 HE ARG A 45 22.241 62.782 -23.841 1.00 0.00 H ATOM 93 HH12 ARG A 45 20.420 65.880 -21.905 1.00 0.00 H ATOM 94 HH11 ARG A 45 21.814 66.215 -22.995 1.00 0.00 H ATOM 95 HH22 ARG A 45 19.681 63.730 -21.611 1.00 0.00 H ATOM 96 HH21 ARG A 45 20.493 62.371 -22.470 1.00 0.00 H ATOM 97 H ARG A 45 27.469 65.343 -22.589 1.00 0.00 H ATOM 98 N PHE A 46 26.601 61.295 -23.061 1.00 66.14 N ATOM 99 CA PHE A 46 27.142 60.221 -23.880 1.00 61.23 C ATOM 100 C PHE A 46 26.009 59.266 -24.234 1.00 60.88 C ATOM 101 O PHE A 46 25.715 58.333 -23.488 1.00 59.85 O ATOM 102 CB PHE A 46 28.272 59.507 -23.124 1.00 59.04 C ATOM 103 CG PHE A 46 28.938 58.397 -23.894 1.00 61.72 C ATOM 104 CD1 PHE A 46 28.448 57.103 -23.837 1.00 60.53 C ATOM 105 CD2 PHE A 46 30.077 58.642 -24.646 1.00 64.31 C ATOM 106 CE1 PHE A 46 29.062 56.081 -24.531 1.00 56.80 C ATOM 107 CE2 PHE A 46 30.699 57.620 -25.341 1.00 63.85 C ATOM 108 CZ PHE A 46 30.190 56.338 -25.282 1.00 57.22 C ATOM 109 H PHE A 46 26.039 61.045 -22.223 1.00 0.00 H ATOM 110 N GLY A 47 25.359 59.515 -25.366 1.00 67.17 N ATOM 111 CA GLY A 47 24.195 58.740 -25.750 1.00 67.17 C ATOM 112 C GLY A 47 23.013 59.090 -24.869 1.00 66.79 C ATOM 113 O GLY A 47 22.598 60.248 -24.802 1.00 68.09 O ATOM 114 H GLY A 47 25.691 60.280 -25.988 1.00 0.00 H ATOM 115 N ASP A 48 22.411 58.129 -24.185 1.00 69.19 N ATOM 116 CA ASP A 48 21.341 58.492 -23.271 1.00 67.90 C ATOM 117 C ASP A 48 21.846 58.649 -21.858 1.00 62.00 C ATOM 118 O ASP A 48 21.073 58.779 -20.926 1.00 59.54 O ATOM 119 CB ASP A 48 20.158 57.523 -23.297 1.00 75.60 C ATOM 120 CG ASP A 48 20.456 56.232 -24.014 1.00 85.51 C ATOM 121 OD1 ASP A 48 21.267 56.256 -24.948 1.00 87.73 O ATOM 122 OD2 ASP A 48 19.853 55.200 -23.648 1.00 90.28 O ATOM 123 H ASP A 48 22.698 57.136 -24.299 1.00 0.00 H ATOM 124 N LEU A 49 23.152 58.619 -21.704 1.00 57.06 N ATOM 125 CA LEU A 49 23.745 58.796 -20.386 1.00 54.18 C ATOM 126 C LEU A 49 24.440 60.143 -20.239 1.00 53.35 C ATOM 127 O LEU A 49 24.781 60.791 -21.228 1.00 54.65 O ATOM 128 CB LEU A 49 24.738 57.667 -20.108 1.00 50.89 C ATOM 129 CG LEU A 49 24.235 56.393 -19.426 1.00 46.59 C ATOM 130 CD1 LEU A 49 22.908 55.923 -19.990 1.00 52.42 C ATOM 131 CD2 LEU A 49 25.277 55.316 -19.598 1.00 47.24 C ATOM 132 H LEU A 49 23.766 58.468 -22.530 1.00 0.00 H ATOM 133 N VAL A 50 24.643 60.551 -18.990 1.00 48.27 N ATOM 134 CA VAL A 50 25.339 61.793 -18.675 1.00 48.15 C ATOM 135 C VAL A 50 26.467 61.526 -17.681 1.00 44.69 C ATOM 136 O VAL A 50 26.272 60.836 -16.681 1.00 44.14 O ATOM 137 CB VAL A 50 24.374 62.848 -18.095 1.00 46.51 C ATOM 138 CG1 VAL A 50 25.142 64.042 -17.549 1.00 48.26 C ATOM 139 CG2 VAL A 50 23.374 63.287 -19.151 1.00 51.57 C ATOM 140 H VAL A 50 24.292 59.962 -18.208 1.00 0.00 H ATOM 141 N PHE A 51 27.647 62.070 -17.962 1.00 45.48 N ATOM 142 CA PHE A 51 28.810 61.853 -17.108 1.00 44.57 C ATOM 143 C PHE A 51 29.382 63.169 -16.590 1.00 48.08 C ATOM 144 O PHE A 51 29.612 64.103 -17.357 1.00 51.48 O ATOM 145 CB PHE A 51 29.891 61.078 -17.867 1.00 48.04 C ATOM 146 CG PHE A 51 29.474 59.692 -18.271 1.00 45.87 C ATOM 147 CD1 PHE A 51 28.813 59.477 -19.469 1.00 48.88 C ATOM 148 CD2 PHE A 51 29.741 58.606 -17.454 1.00 43.80 C ATOM 149 CE1 PHE A 51 28.426 58.204 -19.845 1.00 48.23 C ATOM 150 CE2 PHE A 51 29.357 57.330 -17.826 1.00 43.79 C ATOM 151 CZ PHE A 51 28.698 57.130 -19.023 1.00 46.34 C ATOM 152 H PHE A 51 27.743 62.664 -18.810 1.00 0.00 H ATOM 153 N ARG A 52 29.608 63.234 -15.282 1.00 44.08 N ATOM 154 CA ARG A 52 30.233 64.399 -14.666 1.00 41.20 C ATOM 155 C ARG A 52 31.438 63.976 -13.835 1.00 39.61 C ATOM 156 O ARG A 52 31.373 62.995 -13.095 1.00 40.16 O ATOM 157 CB ARG A 52 29.233 65.156 -13.789 1.00 43.96 C ATOM 158 CG ARG A 52 29.825 66.371 -13.090 1.00 46.25 C ATOM 159 CD ARG A 52 28.808 67.068 -12.203 1.00 46.00 C ATOM 160 NE ARG A 52 29.294 68.368 -11.747 1.00 49.79 N ATOM 161 CZ ARG A 52 29.105 69.507 -12.406 1.00 54.19 C ATOM 162 NH1 ARG A 52 28.438 69.511 -13.552 1.00 63.39 N ATOM 163 NH2 ARG A 52 29.584 70.644 -11.920 1.00 52.38 N ATOM 164 HE ARG A 52 29.821 68.405 -10.851 1.00 0.00 H ATOM 165 HH12 ARG A 52 28.292 70.404 -14.065 1.00 0.00 H ATOM 166 HH11 ARG A 52 28.061 68.622 -13.937 1.00 0.00 H ATOM 167 HH22 ARG A 52 29.435 71.534 -12.437 1.00 0.00 H ATOM 168 HH21 ARG A 52 30.108 70.646 -11.022 1.00 0.00 H ATOM 169 H ARG A 52 29.331 62.432 -14.681 1.00 0.00 H ATOM 170 N GLN A 53 32.539 64.711 -13.961 1.00 41.22 N ATOM 171 CA GLN A 53 33.732 64.424 -13.173 1.00 42.31 C ATOM 172 C GLN A 53 33.705 65.197 -11.857 1.00 38.65 C ATOM 173 O GLN A 53 33.452 66.401 -11.835 1.00 36.38 O ATOM 174 CB GLN A 53 35.003 64.756 -13.960 1.00 41.33 C ATOM 175 CG GLN A 53 36.275 64.231 -13.308 1.00 38.44 C ATOM 176 CD GLN A 53 37.506 64.403 -14.178 1.00 37.07 C ATOM 177 OE1 GLN A 53 37.484 65.128 -15.172 1.00 39.25 O ATOM 178 NE2 GLN A 53 38.589 63.730 -13.805 1.00 37.11 N ATOM 179 HE22 GLN A 53 38.561 63.129 -12.957 1.00 0.00 H ATOM 180 HE21 GLN A 53 39.465 63.804 -14.361 1.00 0.00 H ATOM 181 H GLN A 53 32.549 65.504 -14.633 1.00 0.00 H ATOM 182 N LEU A 54 33.971 64.491 -10.762 1.00 38.61 N ATOM 183 CA LEU A 54 33.883 65.070 -9.426 1.00 40.77 C ATOM 184 C LEU A 54 35.268 65.315 -8.837 1.00 40.95 C ATOM 185 O LEU A 54 35.464 66.224 -8.030 1.00 41.36 O ATOM 186 CB LEU A 54 33.077 64.148 -8.510 1.00 41.43 C ATOM 187 CG LEU A 54 31.740 63.659 -9.072 1.00 38.48 C ATOM 188 CD1 LEU A 54 31.061 62.703 -8.104 1.00 38.09 C ATOM 189 CD2 LEU A 54 30.828 64.834 -9.402 1.00 38.65 C ATOM 190 H LEU A 54 34.251 63.494 -10.861 1.00 0.00 H ATOM 191 N ALA A 55 36.222 64.490 -9.253 1.00 39.78 N ATOM 192 CA ALA A 55 37.590 64.541 -8.756 1.00 38.11 C ATOM 193 C ALA A 55 38.508 63.976 -9.840 1.00 39.48 C ATOM 194 O ALA A 55 38.018 63.348 -10.777 1.00 37.81 O ATOM 195 CB ALA A 55 37.713 63.752 -7.453 1.00 38.33 C ATOM 196 H ALA A 55 35.981 63.774 -9.967 1.00 0.00 H ATOM 197 N PRO A 56 39.833 64.209 -9.734 1.00 42.24 N ATOM 198 CA PRO A 56 40.778 63.673 -10.724 1.00 40.65 C ATOM 199 C PRO A 56 40.562 62.202 -11.104 1.00 41.57 C ATOM 200 O PRO A 56 40.801 61.835 -12.255 1.00 41.26 O ATOM 201 CB PRO A 56 42.126 63.847 -10.028 1.00 37.38 C ATOM 202 CG PRO A 56 41.952 65.093 -9.232 1.00 36.70 C ATOM 203 CD PRO A 56 40.508 65.113 -8.781 1.00 37.13 C ATOM 204 N ASN A 57 40.108 61.382 -10.161 1.00 38.95 N ATOM 205 CA ASN A 57 39.914 59.959 -10.427 1.00 38.84 C ATOM 206 C ASN A 57 38.505 59.458 -10.115 1.00 38.43 C ATOM 207 O ASN A 57 38.292 58.256 -9.961 1.00 38.85 O ATOM 208 CB ASN A 57 40.933 59.137 -9.636 1.00 40.46 C ATOM 209 CG ASN A 57 42.361 59.407 -10.069 1.00 43.72 C ATOM 210 OD1 ASN A 57 42.665 59.438 -11.261 1.00 41.19 O ATOM 211 ND2 ASN A 57 43.246 59.607 -9.099 1.00 46.06 N ATOM 212 HD22 ASN A 57 42.944 59.572 -8.104 1.00 0.00 H ATOM 213 HD21 ASN A 57 44.241 59.799 -9.334 1.00 0.00 H ATOM 214 H ASN A 57 39.887 61.760 -9.218 1.00 0.00 H ATOM 215 N VAL A 58 37.544 60.373 -10.021 1.00 37.54 N ATOM 216 CA VAL A 58 36.169 59.996 -9.697 1.00 35.54 C ATOM 217 C VAL A 58 35.151 60.673 -10.615 1.00 37.61 C ATOM 218 O VAL A 58 35.116 61.899 -10.723 1.00 38.27 O ATOM 219 CB VAL A 58 35.819 60.338 -8.230 1.00 38.86 C ATOM 220 CG1 VAL A 58 34.345 60.073 -7.957 1.00 37.84 C ATOM 221 CG2 VAL A 58 36.694 59.545 -7.268 1.00 36.45 C ATOM 222 H VAL A 58 37.775 61.374 -10.181 1.00 0.00 H ATOM 223 N TRP A 59 34.326 59.862 -11.271 1.00 37.87 N ATOM 224 CA TRP A 59 33.246 60.369 -12.113 1.00 38.45 C ATOM 225 C TRP A 59 31.888 59.890 -11.610 1.00 36.64 C ATOM 226 O TRP A 59 31.788 58.838 -10.979 1.00 35.75 O ATOM 227 CB TRP A 59 33.433 59.930 -13.569 1.00 36.60 C ATOM 228 CG TRP A 59 34.697 60.410 -14.201 1.00 37.21 C ATOM 229 CD1 TRP A 59 34.843 61.486 -15.027 1.00 38.40 C ATOM 230 CD2 TRP A 59 35.996 59.823 -14.073 1.00 35.70 C ATOM 231 NE1 TRP A 59 36.155 61.610 -15.417 1.00 40.20 N ATOM 232 CE2 TRP A 59 36.883 60.600 -14.845 1.00 36.51 C ATOM 233 CE3 TRP A 59 36.495 58.716 -13.380 1.00 36.62 C ATOM 234 CZ2 TRP A 59 38.242 60.306 -14.941 1.00 35.68 C ATOM 235 CZ3 TRP A 59 37.844 58.427 -13.476 1.00 37.72 C ATOM 236 CH2 TRP A 59 38.701 59.218 -14.251 1.00 40.04 C ATOM 237 HE1 TRP A 59 36.533 62.349 -16.043 1.00 0.00 H ATOM 238 H TRP A 59 34.454 58.834 -11.181 1.00 0.00 H ATOM 239 N GLN A 60 30.847 60.665 -11.894 1.00 37.14 N ATOM 240 CA GLN A 60 29.479 60.251 -11.602 1.00 36.63 C ATOM 241 C GLN A 60 28.750 59.909 -12.894 1.00 39.06 C ATOM 242 O GLN A 60 28.660 60.740 -13.798 1.00 39.66 O ATOM 243 CB GLN A 60 28.719 61.348 -10.850 1.00 36.67 C ATOM 244 CG GLN A 60 27.272 60.982 -10.529 1.00 37.96 C ATOM 245 CD GLN A 60 26.448 62.172 -10.070 1.00 38.31 C ATOM 246 OE1 GLN A 60 25.910 62.180 -8.962 1.00 40.57 O ATOM 247 NE2 GLN A 60 26.338 63.181 -10.926 1.00 37.01 N ATOM 248 HE22 GLN A 60 26.810 63.131 -11.852 1.00 0.00 H ATOM 249 HE21 GLN A 60 25.780 64.021 -10.671 1.00 0.00 H ATOM 250 H GLN A 60 31.012 61.592 -12.336 1.00 0.00 H ATOM 251 N HIS A 61 28.233 58.688 -12.990 1.00 38.90 N ATOM 252 CA HIS A 61 27.462 58.306 -14.166 1.00 40.38 C ATOM 253 C HIS A 61 25.967 58.422 -13.888 1.00 40.54 C ATOM 254 O HIS A 61 25.482 58.008 -12.835 1.00 40.46 O ATOM 255 CB HIS A 61 27.823 56.888 -14.629 1.00 39.72 C ATOM 256 CG HIS A 61 27.385 55.803 -13.694 1.00 35.65 C ATOM 257 ND1 HIS A 61 26.074 55.390 -13.592 1.00 35.17 N ATOM 258 CD2 HIS A 61 28.092 55.025 -12.840 1.00 35.67 C ATOM 259 CE1 HIS A 61 25.990 54.415 -12.705 1.00 33.97 C ATOM 260 NE2 HIS A 61 27.200 54.173 -12.235 1.00 32.88 N ATOM 261 H HIS A 61 28.380 58.002 -12.222 1.00 0.00 H ATOM 262 N THR A 62 25.247 59.001 -14.843 1.00 39.88 N ATOM 263 CA THR A 62 23.817 59.234 -14.695 1.00 39.59 C ATOM 264 C THR A 62 23.032 58.614 -15.843 1.00 39.46 C ATOM 265 O THR A 62 23.321 58.865 -17.013 1.00 43.19 O ATOM 266 CB THR A 62 23.501 60.739 -14.625 1.00 39.12 C ATOM 267 OG1 THR A 62 24.328 61.358 -13.632 1.00 39.44 O ATOM 268 CG2 THR A 62 22.034 60.967 -14.287 1.00 37.33 C ATOM 269 HG1 THR A 62 25.280 61.232 -13.872 1.00 0.00 H ATOM 270 H THR A 62 25.718 59.296 -15.722 1.00 0.00 H ATOM 271 N SER A 63 22.040 57.797 -15.500 1.00 37.35 N ATOM 272 CA SER A 63 21.161 57.196 -16.495 1.00 38.19 C ATOM 273 C SER A 63 19.711 57.556 -16.193 1.00 39.94 C ATOM 274 O SER A 63 19.376 57.926 -15.068 1.00 39.69 O ATOM 275 CB SER A 63 21.337 55.677 -16.535 1.00 36.89 C ATOM 276 OG SER A 63 20.957 55.078 -15.309 1.00 35.78 O ATOM 277 HG SER A 63 21.083 54.098 -15.369 1.00 0.00 H ATOM 278 H SER A 63 21.887 57.581 -14.494 1.00 0.00 H ATOM 279 N TYR A 64 18.851 57.441 -17.199 1.00 43.25 N ATOM 280 CA TYR A 64 17.461 57.854 -17.057 1.00 44.71 C ATOM 281 C TYR A 64 16.484 56.745 -17.435 1.00 47.10 C ATOM 282 O TYR A 64 16.698 56.024 -18.409 1.00 48.04 O ATOM 283 CB TYR A 64 17.188 59.094 -17.914 1.00 41.58 C ATOM 284 CG TYR A 64 17.993 60.314 -17.519 1.00 39.11 C ATOM 285 CD1 TYR A 64 19.309 60.469 -17.936 1.00 41.23 C ATOM 286 CD2 TYR A 64 17.431 61.316 -16.741 1.00 44.04 C ATOM 287 CE1 TYR A 64 20.046 61.583 -17.580 1.00 43.56 C ATOM 288 CE2 TYR A 64 18.159 62.434 -16.382 1.00 42.89 C ATOM 289 CZ TYR A 64 19.466 62.562 -16.804 1.00 44.68 C ATOM 290 OH TYR A 64 20.197 63.672 -16.450 1.00 51.03 O ATOM 291 HH TYR A 64 21.107 63.603 -16.834 1.00 0.00 H ATOM 292 H TYR A 64 19.176 57.049 -18.106 1.00 0.00 H ATOM 293 N LEU A 65 15.416 56.610 -16.654 1.00 49.57 N ATOM 294 CA LEU A 65 14.334 55.693 -16.991 1.00 55.39 C ATOM 295 C LEU A 65 12.991 56.405 -16.932 1.00 65.62 C ATOM 296 O LEU A 65 12.626 56.981 -15.906 1.00 65.75 O ATOM 297 CB LEU A 65 14.313 54.482 -16.055 1.00 53.29 C ATOM 298 CG LEU A 65 13.135 53.531 -16.298 1.00 59.44 C ATOM 299 CD1 LEU A 65 13.258 52.861 -17.660 1.00 56.18 C ATOM 300 CD2 LEU A 65 13.010 52.490 -15.196 1.00 55.19 C ATOM 301 H LEU A 65 15.351 57.172 -15.782 1.00 0.00 H ATOM 302 N ASP A 66 12.266 56.371 -18.045 1.00 67.99 N ATOM 303 CA ASP A 66 10.906 56.887 -18.088 1.00 75.44 C ATOM 304 C ASP A 66 10.032 56.009 -17.197 1.00 82.26 C ATOM 305 O ASP A 66 9.617 54.921 -17.597 1.00 85.59 O ATOM 306 CB ASP A 66 10.388 56.916 -19.527 1.00 82.19 C ATOM 307 CG ASP A 66 9.234 57.883 -19.717 1.00 88.31 C ATOM 308 OD1 ASP A 66 8.381 57.993 -18.813 1.00 91.31 O ATOM 309 OD2 ASP A 66 9.186 58.539 -20.779 1.00 94.19 O ATOM 310 H ASP A 66 12.681 55.965 -18.908 1.00 0.00 H ATOM 311 N MET A 67 9.764 56.486 -15.985 1.00 83.14 N ATOM 312 CA MET A 67 9.177 55.643 -14.944 1.00 92.85 C ATOM 313 C MET A 67 7.654 55.685 -14.895 1.00101.80 C ATOM 314 O MET A 67 7.058 56.763 -14.881 1.00102.46 O ATOM 315 CB MET A 67 9.740 56.039 -13.576 1.00 93.78 C ATOM 316 CG MET A 67 9.514 54.999 -12.491 1.00 98.29 C ATOM 317 SD MET A 67 10.611 55.242 -11.082 1.00125.69 S ATOM 318 CE MET A 67 10.101 53.893 -10.021 1.00 89.40 C ATOM 319 H MET A 67 9.977 57.482 -15.772 1.00 0.00 H ATOM 320 N PRO A 68 7.025 54.502 -14.860 1.00104.53 N ATOM 321 CA PRO A 68 5.584 54.299 -14.722 1.00105.42 C ATOM 322 C PRO A 68 5.155 54.182 -13.253 1.00104.87 C ATOM 323 O PRO A 68 5.599 53.258 -12.572 1.00102.18 O ATOM 324 CB PRO A 68 5.345 52.973 -15.471 1.00107.98 C ATOM 325 CG PRO A 68 6.752 52.447 -15.864 1.00105.62 C ATOM 326 CD PRO A 68 7.721 53.221 -15.033 1.00102.58 C ATOM 327 N GLY A 69 4.340 55.107 -12.755 1.00109.62 N ATOM 328 CA GLY A 69 3.904 56.262 -13.509 1.00110.73 C ATOM 329 C GLY A 69 4.415 57.529 -12.849 1.00110.22 C ATOM 330 O GLY A 69 3.988 57.882 -11.749 1.00112.18 O ATOM 331 H GLY A 69 4.000 54.995 -11.778 1.00 0.00 H ATOM 332 N PHE A 70 5.331 58.217 -13.524 1.00110.13 N ATOM 333 CA PHE A 70 6.010 59.367 -12.938 1.00109.07 C ATOM 334 C PHE A 70 6.616 60.249 -14.022 1.00110.15 C ATOM 335 O PHE A 70 6.222 61.400 -14.194 1.00114.54 O ATOM 336 CB PHE A 70 7.094 58.889 -11.960 1.00105.98 C ATOM 337 CG PHE A 70 7.849 60.000 -11.270 1.00104.82 C ATOM 338 CD1 PHE A 70 8.790 60.768 -11.944 1.00103.99 C ATOM 339 CD2 PHE A 70 7.651 60.236 -9.921 1.00104.30 C ATOM 340 CE1 PHE A 70 9.485 61.771 -11.294 1.00104.23 C ATOM 341 CE2 PHE A 70 8.344 61.237 -9.267 1.00104.76 C ATOM 342 CZ PHE A 70 9.262 62.004 -9.953 1.00106.12 C ATOM 343 H PHE A 70 5.569 57.928 -14.494 1.00 0.00 H ATOM 344 N GLY A 71 7.592 59.702 -14.737 1.00100.97 N ATOM 345 CA GLY A 71 8.326 60.452 -15.738 1.00 94.97 C ATOM 346 C GLY A 71 9.752 59.948 -15.846 1.00 85.65 C ATOM 347 O GLY A 71 10.040 58.810 -15.477 1.00 84.84 O ATOM 348 H GLY A 71 7.838 58.705 -14.574 1.00 0.00 H ATOM 349 N ALA A 72 10.646 60.797 -16.343 1.00 77.51 N ATOM 350 CA ALA A 72 12.042 60.415 -16.537 1.00 72.66 C ATOM 351 C ALA A 72 12.868 60.633 -15.271 1.00 66.31 C ATOM 352 O ALA A 72 13.303 61.749 -14.988 1.00 68.05 O ATOM 353 CB ALA A 72 12.642 61.192 -17.699 1.00 70.86 C ATOM 354 H ALA A 72 10.343 61.758 -16.600 1.00 0.00 H ATOM 355 N VAL A 73 13.088 59.557 -14.521 1.00 63.20 N ATOM 356 CA VAL A 73 13.816 59.629 -13.257 1.00 57.51 C ATOM 357 C VAL A 73 15.304 59.330 -13.433 1.00 50.85 C ATOM 358 O VAL A 73 15.681 58.313 -14.016 1.00 50.48 O ATOM 359 CB VAL A 73 13.231 58.651 -12.220 1.00 58.02 C ATOM 360 CG1 VAL A 73 13.984 58.759 -10.903 1.00 55.98 C ATOM 361 CG2 VAL A 73 11.753 58.923 -12.013 1.00 70.92 C ATOM 362 H VAL A 73 12.730 58.636 -14.845 1.00 0.00 H ATOM 363 N ALA A 74 16.145 60.223 -12.920 1.00 44.13 N ATOM 364 CA ALA A 74 17.592 60.066 -13.016 1.00 44.86 C ATOM 365 C ALA A 74 18.149 59.231 -11.867 1.00 44.80 C ATOM 366 O ALA A 74 17.650 59.293 -10.744 1.00 46.49 O ATOM 367 CB ALA A 74 18.265 61.427 -13.049 1.00 46.33 C ATOM 368 H ALA A 74 15.759 61.059 -12.436 1.00 0.00 H ATOM 369 N SER A 75 19.189 58.453 -12.154 1.00 43.08 N ATOM 370 CA SER A 75 19.862 57.659 -11.133 1.00 40.20 C ATOM 371 C SER A 75 21.374 57.807 -11.262 1.00 39.93 C ATOM 372 O SER A 75 21.913 57.778 -12.367 1.00 39.68 O ATOM 373 CB SER A 75 19.465 56.187 -11.236 1.00 42.86 C ATOM 374 OG SER A 75 20.101 55.423 -10.225 1.00 43.18 O ATOM 375 HG SER A 75 19.830 54.475 -10.310 1.00 0.00 H ATOM 376 H SER A 75 19.532 58.410 -13.135 1.00 0.00 H ATOM 377 N ASN A 76 22.054 57.961 -10.131 1.00 41.62 N ATOM 378 CA ASN A 76 23.489 58.224 -10.141 1.00 39.89 C ATOM 379 C ASN A 76 24.326 57.090 -9.566 1.00 39.74 C ATOM 380 O ASN A 76 23.927 56.429 -8.608 1.00 42.67 O ATOM 381 CB ASN A 76 23.793 59.511 -9.374 1.00 42.09 C ATOM 382 CG ASN A 76 23.180 60.730 -10.022 1.00 39.76 C ATOM 383 OD1 ASN A 76 23.154 60.846 -11.246 1.00 39.71 O ATOM 384 ND2 ASN A 76 22.682 61.648 -9.204 1.00 40.44 N ATOM 385 HD22 ASN A 76 22.727 61.506 -8.175 1.00 0.00 H ATOM 386 HD21 ASN A 76 22.247 62.509 -9.592 1.00 0.00 H ATOM 387 H ASN A 76 21.554 57.893 -9.222 1.00 0.00 H ATOM 388 N GLY A 77 25.493 56.876 -10.162 1.00 37.01 N ATOM 389 CA GLY A 77 26.463 55.929 -9.650 1.00 36.87 C ATOM 390 C GLY A 77 27.845 56.535 -9.779 1.00 37.18 C ATOM 391 O GLY A 77 27.982 57.666 -10.243 1.00 36.84 O ATOM 392 H GLY A 77 25.719 57.407 -11.027 1.00 0.00 H ATOM 393 N LEU A 78 28.872 55.795 -9.378 1.00 35.33 N ATOM 394 CA LEU A 78 30.230 56.328 -9.422 1.00 34.08 C ATOM 395 C LEU A 78 31.187 55.466 -10.238 1.00 33.76 C ATOM 396 O LEU A 78 31.042 54.247 -10.315 1.00 33.62 O ATOM 397 CB LEU A 78 30.780 56.500 -8.005 1.00 36.37 C ATOM 398 CG LEU A 78 30.190 57.646 -7.182 1.00 34.48 C ATOM 399 CD1 LEU A 78 30.847 57.713 -5.815 1.00 30.42 C ATOM 400 CD2 LEU A 78 30.347 58.966 -7.918 1.00 34.97 C ATOM 401 H LEU A 78 28.708 54.829 -9.030 1.00 0.00 H ATOM 402 N ILE A 79 32.162 56.127 -10.850 1.00 35.73 N ATOM 403 CA ILE A 79 33.251 55.456 -11.543 1.00 34.31 C ATOM 404 C ILE A 79 34.568 55.935 -10.949 1.00 35.37 C ATOM 405 O ILE A 79 34.837 57.136 -10.913 1.00 35.77 O ATOM 406 CB ILE A 79 33.231 55.733 -13.057 1.00 34.45 C ATOM 407 CG1 ILE A 79 31.875 55.356 -13.656 1.00 35.35 C ATOM 408 CG2 ILE A 79 34.351 54.978 -13.751 1.00 30.89 C ATOM 409 CD1 ILE A 79 31.758 55.657 -15.134 1.00 35.57 C ATOM 410 H ILE A 79 32.147 57.167 -10.833 1.00 0.00 H ATOM 411 N VAL A 80 35.383 54.998 -10.477 1.00 34.57 N ATOM 412 CA VAL A 80 36.623 55.348 -9.795 1.00 35.56 C ATOM 413 C VAL A 80 37.851 54.744 -10.467 1.00 37.95 C ATOM 414 O VAL A 80 37.948 53.527 -10.626 1.00 38.21 O ATOM 415 CB VAL A 80 36.596 54.896 -8.322 1.00 34.93 C ATOM 416 CG1 VAL A 80 37.934 55.179 -7.653 1.00 35.52 C ATOM 417 CG2 VAL A 80 35.463 55.583 -7.578 1.00 33.26 C ATOM 418 H VAL A 80 35.132 53.996 -10.596 1.00 0.00 H ATOM 419 N ARG A 81 38.788 55.600 -10.858 1.00 37.68 N ATOM 420 CA ARG A 81 40.049 55.138 -11.422 1.00 37.37 C ATOM 421 C ARG A 81 41.071 54.930 -10.313 1.00 40.14 C ATOM 422 O ARG A 81 41.499 55.883 -9.661 1.00 39.99 O ATOM 423 CB ARG A 81 40.581 56.127 -12.457 1.00 40.48 C ATOM 424 CG ARG A 81 41.884 55.697 -13.107 1.00 41.64 C ATOM 425 CD ARG A 81 42.270 56.648 -14.221 1.00 40.96 C ATOM 426 NE ARG A 81 42.315 58.032 -13.759 1.00 43.14 N ATOM 427 CZ ARG A 81 42.312 59.088 -14.565 1.00 41.87 C ATOM 428 NH1 ARG A 81 42.263 58.921 -15.878 1.00 39.53 N ATOM 429 NH2 ARG A 81 42.354 60.312 -14.056 1.00 41.91 N ATOM 430 HE ARG A 81 42.352 58.202 -12.734 1.00 0.00 H ATOM 431 HH12 ARG A 81 42.261 59.749 -16.508 1.00 0.00 H ATOM 432 HH11 ARG A 81 42.227 57.962 -16.279 1.00 0.00 H ATOM 433 HH22 ARG A 81 42.352 61.138 -14.688 1.00 0.00 H ATOM 434 HH21 ARG A 81 42.389 60.446 -13.025 1.00 0.00 H ATOM 435 H ARG A 81 38.618 56.621 -10.759 1.00 0.00 H ATOM 436 N ASP A 82 41.451 53.675 -10.102 1.00 44.11 N ATOM 437 CA ASP A 82 42.394 53.320 -9.051 1.00 41.76 C ATOM 438 C ASP A 82 43.633 52.654 -9.646 1.00 44.35 C ATOM 439 O ASP A 82 43.718 51.430 -9.723 1.00 45.37 O ATOM 440 CB ASP A 82 41.723 52.398 -8.029 1.00 40.83 C ATOM 441 CG ASP A 82 42.682 51.901 -6.970 1.00 45.29 C ATOM 442 OD1 ASP A 82 43.466 52.717 -6.442 1.00 52.56 O ATOM 443 OD2 ASP A 82 42.653 50.689 -6.667 1.00 43.91 O ATOM 444 H ASP A 82 41.063 52.923 -10.706 1.00 0.00 H ATOM 445 N GLY A 83 44.591 53.469 -10.073 1.00 44.01 N ATOM 446 CA GLY A 83 45.792 52.958 -10.705 1.00 42.26 C ATOM 447 C GLY A 83 45.521 52.461 -12.112 1.00 44.88 C ATOM 448 O GLY A 83 45.067 53.217 -12.970 1.00 46.87 O ATOM 449 H GLY A 83 44.477 54.496 -9.951 1.00 0.00 H ATOM 450 N GLY A 84 45.792 51.181 -12.347 1.00 41.29 N ATOM 451 CA GLY A 84 45.609 50.593 -13.662 1.00 44.48 C ATOM 452 C GLY A 84 44.291 49.859 -13.811 1.00 44.09 C ATOM 453 O GLY A 84 44.135 49.018 -14.695 1.00 46.06 O ATOM 454 H GLY A 84 46.144 50.586 -11.570 1.00 0.00 H ATOM 455 N ARG A 85 43.337 50.182 -12.943 1.00 44.58 N ATOM 456 CA ARG A 85 42.026 49.544 -12.971 1.00 41.93 C ATOM 457 C ARG A 85 40.920 50.542 -12.639 1.00 40.71 C ATOM 458 O ARG A 85 41.181 51.612 -12.090 1.00 40.19 O ATOM 459 CB ARG A 85 41.978 48.372 -11.990 1.00 38.40 C ATOM 460 CG ARG A 85 42.249 48.783 -10.555 1.00 38.88 C ATOM 461 CD ARG A 85 42.044 47.640 -9.581 1.00 39.90 C ATOM 462 NE ARG A 85 42.039 48.113 -8.201 1.00 44.48 N ATOM 463 CZ ARG A 85 41.618 47.396 -7.165 1.00 41.79 C ATOM 464 NH1 ARG A 85 41.160 46.166 -7.350 1.00 45.24 N ATOM 465 NH2 ARG A 85 41.649 47.911 -5.943 1.00 38.94 N ATOM 466 HE ARG A 85 42.388 49.075 -8.016 1.00 0.00 H ATOM 467 HH12 ARG A 85 40.831 45.606 -6.538 1.00 0.00 H ATOM 468 HH11 ARG A 85 41.130 45.761 -8.307 1.00 0.00 H ATOM 469 HH22 ARG A 85 41.319 47.348 -5.133 1.00 0.00 H ATOM 470 HH21 ARG A 85 42.003 48.878 -5.795 1.00 0.00 H ATOM 471 H ARG A 85 43.531 50.909 -12.225 1.00 0.00 H ATOM 472 N VAL A 86 39.685 50.177 -12.967 1.00 38.07 N ATOM 473 CA VAL A 86 38.529 51.029 -12.709 1.00 37.43 C ATOM 474 C VAL A 86 37.525 50.319 -11.802 1.00 37.94 C ATOM 475 O VAL A 86 37.258 49.130 -11.973 1.00 36.66 O ATOM 476 CB VAL A 86 37.837 51.445 -14.029 1.00 38.41 C ATOM 477 CG1 VAL A 86 36.440 51.993 -13.770 1.00 37.18 C ATOM 478 CG2 VAL A 86 38.688 52.461 -14.777 1.00 39.36 C ATOM 479 H VAL A 86 39.538 49.254 -13.423 1.00 0.00 H ATOM 480 N LEU A 87 36.986 51.046 -10.827 1.00 36.64 N ATOM 481 CA LEU A 87 35.965 50.505 -9.939 1.00 34.20 C ATOM 482 C LEU A 87 34.631 51.204 -10.186 1.00 35.94 C ATOM 483 O LEU A 87 34.588 52.421 -10.366 1.00 37.68 O ATOM 484 CB LEU A 87 36.386 50.660 -8.477 1.00 34.20 C ATOM 485 CG LEU A 87 37.853 50.364 -8.157 1.00 35.05 C ATOM 486 CD1 LEU A 87 38.139 50.596 -6.682 1.00 35.89 C ATOM 487 CD2 LEU A 87 38.225 48.946 -8.558 1.00 36.53 C ATOM 488 H LEU A 87 37.302 52.028 -10.695 1.00 0.00 H ATOM 489 N VAL A 88 33.546 50.435 -10.196 1.00 33.06 N ATOM 490 CA VAL A 88 32.223 50.986 -10.479 1.00 31.75 C ATOM 491 C VAL A 88 31.277 50.818 -9.293 1.00 34.05 C ATOM 492 O VAL A 88 31.231 49.761 -8.668 1.00 32.87 O ATOM 493 CB VAL A 88 31.599 50.324 -11.728 1.00 33.07 C ATOM 494 CG1 VAL A 88 30.182 50.834 -11.964 1.00 32.29 C ATOM 495 CG2 VAL A 88 32.467 50.578 -12.950 1.00 31.61 C ATOM 496 H VAL A 88 33.642 49.419 -9.998 1.00 0.00 H ATOM 497 N VAL A 89 30.530 51.873 -8.980 1.00 35.44 N ATOM 498 CA VAL A 89 29.524 51.810 -7.930 1.00 31.37 C ATOM 499 C VAL A 89 28.135 51.949 -8.539 1.00 33.32 C ATOM 500 O VAL A 89 27.826 52.972 -9.152 1.00 36.27 O ATOM 501 CB VAL A 89 29.737 52.903 -6.872 1.00 33.81 C ATOM 502 CG1 VAL A 89 28.734 52.744 -5.740 1.00 34.51 C ATOM 503 CG2 VAL A 89 31.161 52.846 -6.339 1.00 34.30 C ATOM 504 H VAL A 89 30.668 52.764 -9.498 1.00 0.00 H ATOM 505 N ASP A 90 27.325 50.899 -8.405 1.00 34.25 N ATOM 506 CA ASP A 90 25.958 50.875 -8.932 1.00 33.78 C ATOM 507 C ASP A 90 25.893 50.836 -10.462 1.00 30.32 C ATOM 508 O ASP A 90 26.648 51.535 -11.138 1.00 31.89 O ATOM 509 CB ASP A 90 25.164 52.074 -8.407 1.00 32.51 C ATOM 510 CG ASP A 90 24.807 51.938 -6.939 1.00 38.95 C ATOM 511 OD1 ASP A 90 24.899 50.812 -6.406 1.00 42.21 O ATOM 512 OD2 ASP A 90 24.436 52.956 -6.320 1.00 42.96 O ATOM 513 H ASP A 90 27.679 50.059 -7.904 1.00 0.00 H ATOM 514 N THR A 91 24.984 50.024 -11.003 1.00 30.94 N ATOM 515 CA THR A 91 24.772 49.981 -12.442 1.00 31.96 C ATOM 516 C THR A 91 23.804 51.079 -12.853 1.00 30.86 C ATOM 517 O THR A 91 23.541 52.006 -12.088 1.00 31.56 O ATOM 518 CB THR A 91 24.206 48.626 -12.902 1.00 31.83 C ATOM 519 OG1 THR A 91 22.822 48.538 -12.541 1.00 31.87 O ATOM 520 CG2 THR A 91 24.966 47.483 -12.260 1.00 31.59 C ATOM 521 HG1 THR A 91 22.321 49.271 -12.979 1.00 0.00 H ATOM 522 H THR A 91 24.416 49.410 -10.385 1.00 0.00 H ATOM 523 N ALA A 92 23.272 50.964 -14.063 1.00 33.02 N ATOM 524 CA ALA A 92 22.219 51.857 -14.522 1.00 31.54 C ATOM 525 C ALA A 92 20.873 51.148 -14.420 1.00 34.82 C ATOM 526 O ALA A 92 20.786 50.049 -13.873 1.00 34.79 O ATOM 527 CB ALA A 92 22.485 52.306 -15.940 1.00 35.14 C ATOM 528 H ALA A 92 23.616 50.217 -14.699 1.00 0.00 H ATOM 529 N TRP A 93 19.824 51.774 -14.943 1.00 35.47 N ATOM 530 CA TRP A 93 18.497 51.172 -14.898 1.00 37.66 C ATOM 531 C TRP A 93 18.439 49.873 -15.702 1.00 38.21 C ATOM 532 O TRP A 93 17.781 48.914 -15.297 1.00 38.25 O ATOM 533 CB TRP A 93 17.439 52.144 -15.423 1.00 41.82 C ATOM 534 CG TRP A 93 17.270 53.402 -14.621 1.00 41.60 C ATOM 535 CD1 TRP A 93 17.896 54.596 -14.829 1.00 41.59 C ATOM 536 CD2 TRP A 93 16.392 53.599 -13.505 1.00 41.45 C ATOM 537 NE1 TRP A 93 17.472 55.521 -13.904 1.00 42.34 N ATOM 538 CE2 TRP A 93 16.548 54.934 -13.081 1.00 42.62 C ATOM 539 CE3 TRP A 93 15.494 52.775 -12.819 1.00 41.76 C ATOM 540 CZ2 TRP A 93 15.840 55.463 -12.003 1.00 45.20 C ATOM 541 CZ3 TRP A 93 14.790 53.302 -11.751 1.00 41.39 C ATOM 542 CH2 TRP A 93 14.968 54.632 -11.353 1.00 46.12 C ATOM 543 HE1 TRP A 93 17.800 56.506 -13.840 1.00 0.00 H ATOM 544 H TRP A 93 19.951 52.704 -15.390 1.00 0.00 H ATOM 545 N THR A 94 19.126 49.846 -16.842 1.00 37.85 N ATOM 546 CA THR A 94 19.039 48.712 -17.760 1.00 40.24 C ATOM 547 C THR A 94 20.404 48.145 -18.146 1.00 40.62 C ATOM 548 O THR A 94 21.440 48.761 -17.894 1.00 39.12 O ATOM 549 CB THR A 94 18.292 49.100 -19.056 1.00 40.12 C ATOM 550 OG1 THR A 94 19.095 50.006 -19.822 1.00 41.83 O ATOM 551 CG2 THR A 94 16.959 49.755 -18.735 1.00 37.25 C ATOM 552 HG1 THR A 94 18.613 50.252 -20.651 1.00 0.00 H ATOM 553 H THR A 94 19.739 50.650 -17.085 1.00 0.00 H ATOM 554 N ASP A 95 20.387 46.964 -18.761 1.00 42.86 N ATOM 555 CA ASP A 95 21.600 46.316 -19.250 1.00 42.01 C ATOM 556 C ASP A 95 22.281 47.142 -20.335 1.00 42.35 C ATOM 557 O ASP A 95 23.503 47.288 -20.341 1.00 41.68 O ATOM 558 CB ASP A 95 21.284 44.919 -19.792 1.00 42.68 C ATOM 559 CG ASP A 95 21.063 43.900 -18.693 1.00 44.11 C ATOM 560 OD1 ASP A 95 21.780 43.960 -17.673 1.00 48.42 O ATOM 561 OD2 ASP A 95 20.176 43.035 -18.853 1.00 47.36 O ATOM 562 H ASP A 95 19.474 46.485 -18.898 1.00 0.00 H ATOM 563 N ASP A 96 21.481 47.677 -21.253 1.00 44.42 N ATOM 564 CA ASP A 96 22.002 48.468 -22.363 1.00 45.50 C ATOM 565 C ASP A 96 22.684 49.743 -21.876 1.00 42.88 C ATOM 566 O ASP A 96 23.727 50.136 -22.399 1.00 40.47 O ATOM 567 CB ASP A 96 20.880 48.815 -23.344 1.00 48.76 C ATOM 568 CG ASP A 96 20.476 47.636 -24.211 1.00 59.17 C ATOM 569 OD1 ASP A 96 20.702 46.481 -23.793 1.00 65.03 O ATOM 570 OD2 ASP A 96 19.932 47.865 -25.312 1.00 66.90 O ATOM 571 H ASP A 96 20.455 47.527 -21.178 1.00 0.00 H ATOM 572 N GLN A 97 22.090 50.385 -20.875 1.00 42.02 N ATOM 573 CA GLN A 97 22.658 51.599 -20.299 1.00 41.73 C ATOM 574 C GLN A 97 23.952 51.300 -19.549 1.00 38.84 C ATOM 575 O GLN A 97 24.898 52.085 -19.590 1.00 38.70 O ATOM 576 CB GLN A 97 21.655 52.272 -19.362 1.00 39.82 C ATOM 577 CG GLN A 97 20.458 52.898 -20.051 1.00 42.00 C ATOM 578 CD GLN A 97 19.436 53.418 -19.060 1.00 42.21 C ATOM 579 OE1 GLN A 97 19.309 52.894 -17.953 1.00 44.41 O ATOM 580 NE2 GLN A 97 18.705 54.454 -19.450 1.00 47.12 N ATOM 581 HE22 GLN A 97 18.847 54.864 -20.395 1.00 0.00 H ATOM 582 HE21 GLN A 97 17.990 54.856 -18.811 1.00 0.00 H ATOM 583 H GLN A 97 21.198 50.012 -20.493 1.00 0.00 H ATOM 584 N THR A 98 23.985 50.165 -18.859 1.00 35.78 N ATOM 585 CA THR A 98 25.183 49.743 -18.143 1.00 36.91 C ATOM 586 C THR A 98 26.289 49.408 -19.136 1.00 37.33 C ATOM 587 O THR A 98 27.464 49.691 -18.895 1.00 35.20 O ATOM 588 CB THR A 98 24.911 48.522 -17.245 1.00 37.34 C ATOM 589 OG1 THR A 98 23.802 48.798 -16.382 1.00 34.67 O ATOM 590 CG2 THR A 98 26.134 48.195 -16.397 1.00 32.67 C ATOM 591 HG1 THR A 98 23.000 48.990 -16.929 1.00 0.00 H ATOM 592 H THR A 98 23.137 49.564 -18.829 1.00 0.00 H ATOM 593 N ALA A 99 25.904 48.807 -20.257 1.00 38.18 N ATOM 594 CA ALA A 99 26.849 48.507 -21.324 1.00 38.70 C ATOM 595 C ALA A 99 27.388 49.801 -21.923 1.00 37.68 C ATOM 596 O ALA A 99 28.533 49.860 -22.369 1.00 39.23 O ATOM 597 CB ALA A 99 26.194 47.652 -22.395 1.00 35.83 C ATOM 598 H ALA A 99 24.905 48.545 -20.375 1.00 0.00 H ATOM 599 N GLN A 100 26.553 50.835 -21.925 1.00 37.09 N ATOM 600 CA GLN A 100 26.968 52.154 -22.386 1.00 41.31 C ATOM 601 C GLN A 100 27.994 52.765 -21.435 1.00 40.67 C ATOM 602 O GLN A 100 28.914 53.457 -21.870 1.00 42.44 O ATOM 603 CB GLN A 100 25.763 53.086 -22.530 1.00 44.77 C ATOM 604 CG GLN A 100 24.921 52.830 -23.769 1.00 45.57 C ATOM 605 CD GLN A 100 23.762 53.801 -23.896 1.00 57.05 C ATOM 606 OE1 GLN A 100 23.955 54.978 -24.203 1.00 63.37 O ATOM 607 NE2 GLN A 100 22.550 53.311 -23.665 1.00 54.71 N ATOM 608 HE22 GLN A 100 22.434 52.310 -23.408 1.00 0.00 H ATOM 609 HE21 GLN A 100 21.716 53.928 -23.741 1.00 0.00 H ATOM 610 H GLN A 100 25.578 50.699 -21.589 1.00 0.00 H ATOM 611 N ILE A 101 27.827 52.511 -20.139 1.00 38.93 N ATOM 612 CA ILE A 101 28.799 52.955 -19.144 1.00 37.60 C ATOM 613 C ILE A 101 30.150 52.303 -19.411 1.00 34.89 C ATOM 614 O ILE A 101 31.191 52.959 -19.365 1.00 36.46 O ATOM 615 CB ILE A 101 28.355 52.622 -17.702 1.00 38.41 C ATOM 616 CG1 ILE A 101 27.019 53.290 -17.378 1.00 36.60 C ATOM 617 CG2 ILE A 101 29.419 53.053 -16.701 1.00 36.40 C ATOM 618 CD1 ILE A 101 26.526 53.032 -15.973 1.00 34.10 C ATOM 619 H ILE A 101 26.986 51.985 -19.828 1.00 0.00 H ATOM 620 N LEU A 102 30.116 51.007 -19.702 1.00 36.44 N ATOM 621 CA LEU A 102 31.327 50.243 -19.978 1.00 39.25 C ATOM 622 C LEU A 102 32.040 50.756 -21.223 1.00 40.65 C ATOM 623 O LEU A 102 33.269 50.804 -21.268 1.00 38.35 O ATOM 624 CB LEU A 102 30.993 48.759 -20.137 1.00 37.66 C ATOM 625 CG LEU A 102 30.359 48.108 -18.906 1.00 39.00 C ATOM 626 CD1 LEU A 102 30.121 46.625 -19.136 1.00 35.66 C ATOM 627 CD2 LEU A 102 31.215 48.339 -17.666 1.00 33.15 C ATOM 628 H LEU A 102 29.197 50.522 -19.734 1.00 0.00 H ATOM 629 N ASN A 103 31.261 51.138 -22.232 1.00 39.86 N ATOM 630 CA ASN A 103 31.818 51.709 -23.452 1.00 41.25 C ATOM 631 C ASN A 103 32.501 53.041 -23.174 1.00 40.75 C ATOM 632 O ASN A 103 33.579 53.318 -23.699 1.00 42.91 O ATOM 633 CB ASN A 103 30.730 51.892 -24.513 1.00 44.70 C ATOM 634 CG ASN A 103 30.154 50.574 -24.992 1.00 47.82 C ATOM 635 OD1 ASN A 103 30.756 49.516 -24.807 1.00 48.07 O ATOM 636 ND2 ASN A 103 28.983 50.633 -25.618 1.00 44.70 N ATOM 637 HD22 ASN A 103 28.510 51.550 -25.752 1.00 0.00 H ATOM 638 HD21 ASN A 103 28.539 49.762 -25.974 1.00 0.00 H ATOM 639 H ASN A 103 30.230 51.027 -22.148 1.00 0.00 H ATOM 640 N TRP A 104 31.865 53.860 -22.342 1.00 40.54 N ATOM 641 CA TRP A 104 32.408 55.162 -21.974 1.00 41.03 C ATOM 642 C TRP A 104 33.751 55.023 -21.266 1.00 39.56 C ATOM 643 O TRP A 104 34.693 55.758 -21.556 1.00 41.31 O ATOM 644 CB TRP A 104 31.420 55.922 -21.085 1.00 43.36 C ATOM 645 CG TRP A 104 31.903 57.279 -20.662 1.00 46.70 C ATOM 646 CD1 TRP A 104 31.657 58.466 -21.287 1.00 48.49 C ATOM 647 CD2 TRP A 104 32.711 57.588 -19.518 1.00 43.42 C ATOM 648 NE1 TRP A 104 32.262 59.496 -20.606 1.00 47.36 N ATOM 649 CE2 TRP A 104 32.915 58.983 -19.516 1.00 46.52 C ATOM 650 CE3 TRP A 104 33.281 56.822 -18.496 1.00 41.67 C ATOM 651 CZ2 TRP A 104 33.665 59.626 -18.534 1.00 45.70 C ATOM 652 CZ3 TRP A 104 34.025 57.464 -17.522 1.00 42.44 C ATOM 653 CH2 TRP A 104 34.210 58.851 -17.548 1.00 40.18 C ATOM 654 HE1 TRP A 104 32.229 60.500 -20.874 1.00 0.00 H ATOM 655 H TRP A 104 30.952 53.563 -21.941 1.00 0.00 H ATOM 656 N ILE A 105 33.825 54.079 -20.332 1.00 39.55 N ATOM 657 CA ILE A 105 35.058 53.801 -19.604 1.00 40.73 C ATOM 658 C ILE A 105 36.162 53.348 -20.557 1.00 40.15 C ATOM 659 O ILE A 105 37.304 53.801 -20.468 1.00 39.27 O ATOM 660 CB ILE A 105 34.842 52.721 -18.525 1.00 37.37 C ATOM 661 CG1 ILE A 105 33.797 53.183 -17.507 1.00 38.33 C ATOM 662 CG2 ILE A 105 36.153 52.386 -17.832 1.00 36.11 C ATOM 663 CD1 ILE A 105 33.461 52.141 -16.462 1.00 34.68 C ATOM 664 H ILE A 105 32.975 53.520 -20.113 1.00 0.00 H ATOM 665 N LYS A 106 35.806 52.452 -21.472 1.00 41.97 N ATOM 666 CA LYS A 106 36.734 51.963 -22.485 1.00 44.72 C ATOM 667 C LYS A 106 37.222 53.093 -23.388 1.00 43.73 C ATOM 668 O LYS A 106 38.373 53.100 -23.827 1.00 42.62 O ATOM 669 CB LYS A 106 36.067 50.867 -23.324 1.00 42.85 C ATOM 670 CG LYS A 106 36.872 50.405 -24.531 1.00 41.40 C ATOM 671 CD LYS A 106 38.205 49.804 -24.120 1.00 46.80 C ATOM 672 CE LYS A 106 38.988 49.319 -25.332 1.00 51.12 C ATOM 673 NZ LYS A 106 40.352 48.847 -24.965 1.00 51.39 N ATOM 674 HZ1 LYS A 106 40.882 49.628 -24.527 1.00 0.00 H ATOM 675 HZ2 LYS A 106 40.275 48.058 -24.291 1.00 0.00 H ATOM 676 HZ3 LYS A 106 40.848 48.526 -25.821 1.00 0.00 H ATOM 677 H LYS A 106 34.832 52.087 -21.465 1.00 0.00 H ATOM 678 N GLN A 107 36.342 54.054 -23.649 1.00 42.40 N ATOM 679 CA GLN A 107 36.634 55.129 -24.590 1.00 44.52 C ATOM 680 C GLN A 107 37.344 56.313 -23.936 1.00 47.78 C ATOM 681 O GLN A 107 38.227 56.924 -24.539 1.00 50.76 O ATOM 682 CB GLN A 107 35.342 55.609 -25.254 1.00 45.72 C ATOM 683 CG GLN A 107 35.507 56.030 -26.706 1.00 56.13 C ATOM 684 CD GLN A 107 34.188 56.376 -27.370 1.00 66.31 C ATOM 685 OE1 GLN A 107 33.673 57.483 -27.215 1.00 66.22 O ATOM 686 NE2 GLN A 107 33.631 55.424 -28.112 1.00 71.60 N ATOM 687 HE22 GLN A 107 34.102 54.503 -28.215 1.00 0.00 H ATOM 688 HE21 GLN A 107 32.724 55.601 -28.589 1.00 0.00 H ATOM 689 H GLN A 107 35.420 54.039 -23.169 1.00 0.00 H ATOM 690 N GLU A 108 36.958 56.635 -22.706 1.00 46.40 N ATOM 691 CA GLU A 108 37.479 57.821 -22.033 1.00 44.45 C ATOM 692 C GLU A 108 38.644 57.510 -21.097 1.00 43.87 C ATOM 693 O GLU A 108 39.593 58.287 -21.001 1.00 44.22 O ATOM 694 CB GLU A 108 36.361 58.514 -21.252 1.00 42.64 C ATOM 695 CG GLU A 108 35.207 58.985 -22.118 1.00 49.11 C ATOM 696 CD GLU A 108 35.646 59.964 -23.187 1.00 56.32 C ATOM 697 OE1 GLU A 108 36.173 61.038 -22.829 1.00 58.57 O ATOM 698 OE2 GLU A 108 35.466 59.658 -24.385 1.00 62.63 O ATOM 699 H GLU A 108 36.271 56.030 -22.213 1.00 0.00 H ATOM 700 N ILE A 109 38.570 56.376 -20.409 1.00 41.75 N ATOM 701 CA ILE A 109 39.593 56.008 -19.435 1.00 40.12 C ATOM 702 C ILE A 109 40.540 54.946 -19.988 1.00 41.45 C ATOM 703 O ILE A 109 41.752 55.012 -19.773 1.00 44.41 O ATOM 704 CB ILE A 109 38.956 55.497 -18.125 1.00 39.98 C ATOM 705 CG1 ILE A 109 38.102 56.596 -17.490 1.00 40.01 C ATOM 706 CG2 ILE A 109 40.025 55.027 -17.148 1.00 38.00 C ATOM 707 CD1 ILE A 109 37.389 56.165 -16.228 1.00 39.39 C ATOM 708 H ILE A 109 37.765 55.736 -20.568 1.00 0.00 H ATOM 709 N ASN A 110 39.973 53.976 -20.702 1.00 42.06 N ATOM 710 CA ASN A 110 40.729 52.872 -21.292 1.00 42.70 C ATOM 711 C ASN A 110 41.494 52.065 -20.243 1.00 41.27 C ATOM 712 O ASN A 110 42.720 51.968 -20.282 1.00 46.88 O ATOM 713 CB ASN A 110 41.691 53.393 -22.364 1.00 41.51 C ATOM 714 CG ASN A 110 42.265 52.284 -23.223 1.00 45.31 C ATOM 715 OD1 ASN A 110 41.627 51.255 -23.440 1.00 46.50 O ATOM 716 ND2 ASN A 110 43.482 52.488 -23.711 1.00 51.06 N ATOM 717 HD22 ASN A 110 43.985 53.374 -23.501 1.00 0.00 H ATOM 718 HD21 ASN A 110 43.933 51.762 -24.303 1.00 0.00 H ATOM 719 H ASN A 110 38.944 54.005 -20.847 1.00 0.00 H ATOM 720 N LEU A 111 40.750 51.493 -19.302 1.00 40.76 N ATOM 721 CA LEU A 111 41.310 50.632 -18.267 1.00 40.75 C ATOM 722 C LEU A 111 40.316 49.530 -17.934 1.00 38.96 C ATOM 723 O LEU A 111 39.106 49.758 -17.960 1.00 43.67 O ATOM 724 CB LEU A 111 41.654 51.435 -17.008 1.00 42.23 C ATOM 725 CG LEU A 111 42.893 52.331 -17.050 1.00 44.73 C ATOM 726 CD1 LEU A 111 42.991 53.163 -15.781 1.00 42.62 C ATOM 727 CD2 LEU A 111 44.148 51.497 -17.250 1.00 36.83 C ATOM 728 H LEU A 111 39.725 51.667 -19.304 1.00 0.00 H ATOM 729 N PRO A 112 40.820 48.328 -17.623 1.00 38.33 N ATOM 730 CA PRO A 112 39.934 47.212 -17.279 1.00 38.71 C ATOM 731 C PRO A 112 39.176 47.463 -15.979 1.00 39.90 C ATOM 732 O PRO A 112 39.762 47.937 -15.006 1.00 40.77 O ATOM 733 CB PRO A 112 40.899 46.031 -17.132 1.00 36.27 C ATOM 734 CG PRO A 112 42.209 46.657 -16.783 1.00 36.00 C ATOM 735 CD PRO A 112 42.242 47.950 -17.546 1.00 38.50 C ATOM 736 N VAL A 113 37.883 47.154 -15.970 1.00 37.42 N ATOM 737 CA VAL A 113 37.073 47.314 -14.770 1.00 33.52 C ATOM 738 C VAL A 113 37.265 46.116 -13.853 1.00 35.54 C ATOM 739 O VAL A 113 36.910 44.992 -14.204 1.00 36.74 O ATOM 740 CB VAL A 113 35.580 47.476 -15.108 1.00 33.37 C ATOM 741 CG1 VAL A 113 34.762 47.638 -13.834 1.00 32.31 C ATOM 742 CG2 VAL A 113 35.376 48.664 -16.031 1.00 35.34 C ATOM 743 H VAL A 113 37.440 46.790 -16.838 1.00 0.00 H ATOM 744 N ALA A 114 37.833 46.364 -12.677 1.00 37.52 N ATOM 745 CA ALA A 114 38.165 45.295 -11.743 1.00 35.84 C ATOM 746 C ALA A 114 36.930 44.735 -11.050 1.00 37.81 C ATOM 747 O ALA A 114 36.724 43.522 -11.014 1.00 41.98 O ATOM 748 CB ALA A 114 39.163 45.792 -10.711 1.00 37.00 C ATOM 749 H ALA A 114 38.046 47.348 -12.416 1.00 0.00 H ATOM 750 N LEU A 115 36.109 45.620 -10.496 1.00 35.98 N ATOM 751 CA LEU A 115 34.951 45.183 -9.731 1.00 34.48 C ATOM 752 C LEU A 115 33.834 46.214 -9.741 1.00 33.27 C ATOM 753 O LEU A 115 34.047 47.380 -10.074 1.00 32.23 O ATOM 754 CB LEU A 115 35.357 44.871 -8.286 1.00 34.14 C ATOM 755 CG LEU A 115 35.966 46.008 -7.453 1.00 34.42 C ATOM 756 CD1 LEU A 115 34.913 46.729 -6.613 1.00 33.43 C ATOM 757 CD2 LEU A 115 37.095 45.488 -6.575 1.00 35.20 C ATOM 758 H LEU A 115 36.296 46.637 -10.610 1.00 0.00 H ATOM 759 N ALA A 116 32.641 45.769 -9.364 1.00 32.27 N ATOM 760 CA ALA A 116 31.507 46.663 -9.191 1.00 29.14 C ATOM 761 C ALA A 116 30.802 46.375 -7.868 1.00 31.72 C ATOM 762 O ALA A 116 30.675 45.220 -7.462 1.00 32.74 O ATOM 763 CB ALA A 116 30.538 46.531 -10.350 1.00 30.92 C ATOM 764 H ALA A 116 32.514 44.752 -9.187 1.00 0.00 H ATOM 765 N VAL A 117 30.356 47.430 -7.197 1.00 30.87 N ATOM 766 CA VAL A 117 29.591 47.280 -5.968 1.00 30.17 C ATOM 767 C VAL A 117 28.251 47.994 -6.099 1.00 29.56 C ATOM 768 O VAL A 117 28.190 49.177 -6.434 1.00 30.48 O ATOM 769 CB VAL A 117 30.361 47.819 -4.737 1.00 30.17 C ATOM 770 CG1 VAL A 117 30.954 49.192 -5.022 1.00 29.38 C ATOM 771 CG2 VAL A 117 29.453 47.859 -3.516 1.00 27.34 C ATOM 772 H VAL A 117 30.558 48.385 -7.557 1.00 0.00 H ATOM 773 N VAL A 118 27.172 47.261 -5.855 1.00 30.25 N ATOM 774 CA VAL A 118 25.839 47.835 -5.942 1.00 32.05 C ATOM 775 C VAL A 118 25.278 48.050 -4.537 1.00 32.01 C ATOM 776 O VAL A 118 25.420 47.195 -3.662 1.00 32.67 O ATOM 777 CB VAL A 118 24.907 46.950 -6.788 1.00 34.86 C ATOM 778 CG1 VAL A 118 25.359 46.968 -8.241 1.00 33.96 C ATOM 779 CG2 VAL A 118 24.896 45.526 -6.265 1.00 33.39 C ATOM 780 H VAL A 118 27.282 46.259 -5.597 1.00 0.00 H ATOM 781 N THR A 119 24.648 49.202 -4.325 1.00 33.77 N ATOM 782 CA THR A 119 24.360 49.674 -2.972 1.00 34.82 C ATOM 783 C THR A 119 23.057 49.149 -2.357 1.00 34.74 C ATOM 784 O THR A 119 22.957 49.048 -1.133 1.00 35.18 O ATOM 785 CB THR A 119 24.349 51.212 -2.928 1.00 35.02 C ATOM 786 OG1 THR A 119 23.506 51.720 -3.968 1.00 37.83 O ATOM 787 CG2 THR A 119 25.759 51.747 -3.125 1.00 32.50 C ATOM 788 HG1 THR A 119 23.850 51.419 -4.846 1.00 0.00 H ATOM 789 H THR A 119 24.354 49.779 -5.139 1.00 0.00 H ATOM 790 N HIS A 120 22.066 48.826 -3.186 1.00 32.67 N ATOM 791 CA HIS A 120 20.900 48.071 -2.713 1.00 34.73 C ATOM 792 C HIS A 120 20.110 47.462 -3.872 1.00 34.06 C ATOM 793 O HIS A 120 20.372 47.753 -5.039 1.00 34.36 O ATOM 794 CB HIS A 120 19.985 48.944 -1.842 1.00 36.23 C ATOM 795 CG HIS A 120 19.254 50.010 -2.593 1.00 36.57 C ATOM 796 ND1 HIS A 120 19.827 51.223 -2.915 1.00 38.60 N ATOM 797 CD2 HIS A 120 17.988 50.055 -3.069 1.00 38.43 C ATOM 798 CE1 HIS A 120 18.948 51.964 -3.563 1.00 40.89 C ATOM 799 NE2 HIS A 120 17.823 51.278 -3.672 1.00 40.19 N ATOM 800 H HIS A 120 22.119 49.113 -4.184 1.00 0.00 H ATOM 801 N ALA A 121 19.143 46.612 -3.536 1.00 33.74 N ATOM 802 CA ALA A 121 18.469 45.775 -4.527 1.00 32.71 C ATOM 803 C ALA A 121 17.244 46.427 -5.165 1.00 35.50 C ATOM 804 O ALA A 121 16.138 45.895 -5.085 1.00 36.36 O ATOM 805 CB ALA A 121 18.074 44.445 -3.895 1.00 32.99 C ATOM 806 H ALA A 121 18.858 46.541 -2.538 1.00 0.00 H ATOM 807 N HIS A 122 17.447 47.574 -5.802 1.00 37.91 N ATOM 808 CA HIS A 122 16.412 48.177 -6.634 1.00 38.53 C ATOM 809 C HIS A 122 16.944 48.324 -8.057 1.00 38.24 C ATOM 810 O HIS A 122 18.147 48.198 -8.285 1.00 35.68 O ATOM 811 CB HIS A 122 15.961 49.525 -6.064 1.00 40.56 C ATOM 812 CG HIS A 122 15.005 49.403 -4.917 1.00 41.91 C ATOM 813 ND1 HIS A 122 14.753 50.438 -4.041 1.00 42.92 N ATOM 814 CD2 HIS A 122 14.238 48.367 -4.503 1.00 39.85 C ATOM 815 CE1 HIS A 122 13.873 50.044 -3.139 1.00 40.93 C ATOM 816 NE2 HIS A 122 13.544 48.791 -3.396 1.00 41.89 N ATOM 817 H HIS A 122 18.365 48.053 -5.706 1.00 0.00 H ATOM 818 N GLN A 123 16.051 48.577 -9.010 1.00 40.42 N ATOM 819 CA GLN A 123 16.420 48.562 -10.425 1.00 40.56 C ATOM 820 C GLN A 123 17.442 49.635 -10.786 1.00 40.11 C ATOM 821 O GLN A 123 18.322 49.407 -11.615 1.00 37.00 O ATOM 822 CB GLN A 123 15.181 48.728 -11.307 1.00 38.88 C ATOM 823 CG GLN A 123 15.445 48.437 -12.778 1.00 42.85 C ATOM 824 CD GLN A 123 14.297 48.846 -13.681 1.00 46.88 C ATOM 825 OE1 GLN A 123 13.255 49.303 -13.214 1.00 47.24 O ATOM 826 NE2 GLN A 123 14.484 48.675 -14.985 1.00 47.76 N ATOM 827 HE22 GLN A 123 15.382 48.285 -15.335 1.00 0.00 H ATOM 828 HE21 GLN A 123 13.732 48.931 -15.656 1.00 0.00 H ATOM 829 H GLN A 123 15.069 48.790 -8.743 1.00 0.00 H ATOM 830 N ASP A 124 17.330 50.801 -10.159 1.00 39.43 N ATOM 831 CA ASP A 124 18.232 51.909 -10.452 1.00 39.36 C ATOM 832 C ASP A 124 19.667 51.603 -10.029 1.00 40.01 C ATOM 833 O ASP A 124 20.601 52.295 -10.435 1.00 37.51 O ATOM 834 CB ASP A 124 17.746 53.186 -9.765 1.00 41.44 C ATOM 835 CG ASP A 124 17.579 53.017 -8.268 1.00 47.00 C ATOM 836 OD1 ASP A 124 17.405 51.867 -7.816 1.00 47.62 O ATOM 837 OD2 ASP A 124 17.620 54.034 -7.544 1.00 52.15 O ATOM 838 H ASP A 124 16.584 50.926 -9.445 1.00 0.00 H ATOM 839 N LYS A 125 19.839 50.561 -9.220 1.00 39.84 N ATOM 840 CA LYS A 125 21.153 50.214 -8.696 1.00 36.52 C ATOM 841 C LYS A 125 21.652 48.861 -9.207 1.00 33.93 C ATOM 842 O LYS A 125 22.856 48.662 -9.365 1.00 32.22 O ATOM 843 CB LYS A 125 21.124 50.211 -7.165 1.00 39.55 C ATOM 844 CG LYS A 125 20.440 51.423 -6.540 1.00 40.30 C ATOM 845 CD LYS A 125 21.378 52.617 -6.395 1.00 42.48 C ATOM 846 CE LYS A 125 21.216 53.612 -7.535 1.00 42.87 C ATOM 847 NZ LYS A 125 22.042 54.835 -7.330 1.00 43.34 N ATOM 848 HZ1 LYS A 125 21.754 55.302 -6.447 1.00 0.00 H ATOM 849 HZ2 LYS A 125 23.045 54.568 -7.271 1.00 0.00 H ATOM 850 HZ3 LYS A 125 21.901 55.485 -8.130 1.00 0.00 H ATOM 851 H LYS A 125 19.017 49.981 -8.956 1.00 0.00 H ATOM 852 N MET A 126 20.732 47.937 -9.469 1.00 35.41 N ATOM 853 CA MET A 126 21.111 46.587 -9.887 1.00 36.34 C ATOM 854 C MET A 126 20.457 46.155 -11.197 1.00 36.34 C ATOM 855 O MET A 126 20.457 44.972 -11.533 1.00 36.38 O ATOM 856 CB MET A 126 20.760 45.575 -8.793 1.00 35.42 C ATOM 857 CG MET A 126 21.470 45.799 -7.475 1.00 35.15 C ATOM 858 SD MET A 126 21.216 44.437 -6.320 1.00 43.27 S ATOM 859 CE MET A 126 22.030 43.096 -7.184 1.00 37.23 C ATOM 860 H MET A 126 19.725 48.178 -9.375 1.00 0.00 H ATOM 861 N GLY A 127 19.906 47.108 -11.937 1.00 36.84 N ATOM 862 CA GLY A 127 19.186 46.791 -13.156 1.00 36.42 C ATOM 863 C GLY A 127 20.046 46.307 -14.310 1.00 36.84 C ATOM 864 O GLY A 127 19.522 45.836 -15.318 1.00 42.08 O ATOM 865 H GLY A 127 19.992 48.100 -11.638 1.00 0.00 H ATOM 866 N GLY A 128 21.363 46.416 -14.171 1.00 38.08 N ATOM 867 CA GLY A 128 22.261 46.045 -15.249 1.00 35.94 C ATOM 868 C GLY A 128 23.344 45.056 -14.865 1.00 35.81 C ATOM 869 O GLY A 128 24.463 45.129 -15.372 1.00 38.50 O ATOM 870 H GLY A 128 21.756 46.772 -13.277 1.00 0.00 H ATOM 871 N MET A 129 23.010 44.125 -13.976 1.00 34.73 N ATOM 872 CA MET A 129 23.964 43.124 -13.501 1.00 34.20 C ATOM 873 C MET A 129 24.449 42.213 -14.625 1.00 36.34 C ATOM 874 O MET A 129 25.641 41.918 -14.724 1.00 34.94 O ATOM 875 CB MET A 129 23.341 42.283 -12.386 1.00 35.68 C ATOM 876 CG MET A 129 22.917 43.089 -11.172 1.00 41.14 C ATOM 877 SD MET A 129 24.304 43.900 -10.361 1.00 45.08 S ATOM 878 CE MET A 129 25.348 42.487 -10.040 1.00 32.94 C ATOM 879 H MET A 129 22.038 44.108 -13.606 1.00 0.00 H ATOM 880 N ASP A 130 23.519 41.771 -15.468 1.00 36.29 N ATOM 881 CA ASP A 130 23.840 40.883 -16.582 1.00 35.89 C ATOM 882 C ASP A 130 24.865 41.506 -17.524 1.00 37.69 C ATOM 883 O ASP A 130 25.690 40.803 -18.107 1.00 39.37 O ATOM 884 CB ASP A 130 22.574 40.520 -17.359 1.00 36.22 C ATOM 885 CG ASP A 130 21.734 39.474 -16.650 1.00 44.32 C ATOM 886 OD1 ASP A 130 22.302 38.683 -15.865 1.00 38.19 O ATOM 887 OD2 ASP A 130 20.506 39.440 -16.879 1.00 47.53 O ATOM 888 H ASP A 130 22.532 42.067 -15.329 1.00 0.00 H ATOM 889 N ALA A 131 24.810 42.826 -17.666 1.00 36.01 N ATOM 890 CA ALA A 131 25.758 43.544 -18.510 1.00 33.31 C ATOM 891 C ALA A 131 27.167 43.476 -17.925 1.00 34.09 C ATOM 892 O ALA A 131 28.146 43.334 -18.657 1.00 35.54 O ATOM 893 CB ALA A 131 25.322 44.989 -18.687 1.00 34.67 C ATOM 894 H ALA A 131 24.073 43.360 -17.163 1.00 0.00 H ATOM 895 N LEU A 132 27.257 43.582 -16.603 1.00 33.65 N ATOM 896 CA LEU A 132 28.536 43.480 -15.907 1.00 33.59 C ATOM 897 C LEU A 132 29.102 42.069 -16.000 1.00 34.20 C ATOM 898 O LEU A 132 30.289 41.878 -16.266 1.00 34.91 O ATOM 899 CB LEU A 132 28.385 43.878 -14.439 1.00 32.13 C ATOM 900 CG LEU A 132 27.972 45.317 -14.133 1.00 32.23 C ATOM 901 CD1 LEU A 132 27.898 45.520 -12.634 1.00 28.48 C ATOM 902 CD2 LEU A 132 28.945 46.300 -14.759 1.00 31.24 C ATOM 903 H LEU A 132 26.392 43.742 -16.049 1.00 0.00 H ATOM 904 N HIS A 133 28.240 41.084 -15.773 1.00 32.32 N ATOM 905 CA HIS A 133 28.649 39.686 -15.768 1.00 33.23 C ATOM 906 C HIS A 133 29.043 39.208 -17.163 1.00 34.87 C ATOM 907 O HIS A 133 29.931 38.369 -17.310 1.00 33.04 O ATOM 908 CB HIS A 133 27.529 38.810 -15.206 1.00 34.63 C ATOM 909 CG HIS A 133 27.203 39.095 -13.773 1.00 32.30 C ATOM 910 ND1 HIS A 133 26.038 38.665 -13.176 1.00 33.95 N ATOM 911 CD2 HIS A 133 27.890 39.766 -12.818 1.00 31.98 C ATOM 912 CE1 HIS A 133 26.020 39.060 -11.915 1.00 32.76 C ATOM 913 NE2 HIS A 133 27.132 39.729 -11.673 1.00 33.16 N ATOM 914 H HIS A 133 27.243 41.318 -15.593 1.00 0.00 H ATOM 915 N ALA A 134 28.380 39.744 -18.184 1.00 35.91 N ATOM 916 CA ALA A 134 28.731 39.430 -19.563 1.00 34.92 C ATOM 917 C ALA A 134 30.081 40.046 -19.913 1.00 34.96 C ATOM 918 O ALA A 134 30.779 39.575 -20.811 1.00 37.14 O ATOM 919 CB ALA A 134 27.653 39.926 -20.516 1.00 29.51 C ATOM 920 H ALA A 134 27.596 40.400 -17.994 1.00 0.00 H ATOM 921 N ALA A 135 30.441 41.101 -19.190 1.00 34.32 N ATOM 922 CA ALA A 135 31.712 41.784 -19.394 1.00 34.03 C ATOM 923 C ALA A 135 32.809 41.173 -18.526 1.00 34.04 C ATOM 924 O ALA A 135 33.965 41.594 -18.581 1.00 37.70 O ATOM 925 CB ALA A 135 31.565 43.268 -19.099 1.00 32.30 C ATOM 926 H ALA A 135 29.794 41.451 -18.454 1.00 0.00 H ATOM 927 N GLY A 136 32.438 40.179 -17.726 1.00 33.69 N ATOM 928 CA GLY A 136 33.389 39.486 -16.875 1.00 32.15 C ATOM 929 C GLY A 136 33.777 40.286 -15.647 1.00 33.67 C ATOM 930 O GLY A 136 34.821 40.047 -15.042 1.00 35.35 O ATOM 931 H GLY A 136 31.439 39.889 -17.709 1.00 0.00 H ATOM 932 N ILE A 137 32.930 41.239 -15.276 1.00 32.43 N ATOM 933 CA ILE A 137 33.188 42.076 -14.110 1.00 33.39 C ATOM 934 C ILE A 137 32.670 41.433 -12.826 1.00 33.03 C ATOM 935 O ILE A 137 31.487 41.114 -12.715 1.00 34.35 O ATOM 936 CB ILE A 137 32.548 43.466 -14.271 1.00 33.09 C ATOM 937 CG1 ILE A 137 33.164 44.199 -15.464 1.00 30.12 C ATOM 938 CG2 ILE A 137 32.711 44.284 -12.999 1.00 31.97 C ATOM 939 CD1 ILE A 137 32.478 45.500 -15.792 1.00 29.84 C ATOM 940 H ILE A 137 32.063 41.392 -15.830 1.00 0.00 H ATOM 941 N ALA A 138 33.565 41.241 -11.860 1.00 31.90 N ATOM 942 CA ALA A 138 33.186 40.697 -10.560 1.00 33.69 C ATOM 943 C ALA A 138 32.320 41.695 -9.802 1.00 34.22 C ATOM 944 O ALA A 138 32.707 42.848 -9.615 1.00 35.63 O ATOM 945 CB ALA A 138 34.421 40.339 -9.749 1.00 30.41 C ATOM 946 H ALA A 138 34.561 41.485 -12.036 1.00 0.00 H ATOM 947 N THR A 139 31.150 41.248 -9.363 1.00 32.23 N ATOM 948 CA THR A 139 30.188 42.142 -8.733 1.00 33.27 C ATOM 949 C THR A 139 29.991 41.830 -7.255 1.00 32.44 C ATOM 950 O THR A 139 29.973 40.669 -6.849 1.00 30.62 O ATOM 951 CB THR A 139 28.827 42.079 -9.446 1.00 32.95 C ATOM 952 OG1 THR A 139 28.298 40.749 -9.363 1.00 32.47 O ATOM 953 CG2 THR A 139 28.976 42.473 -10.905 1.00 31.85 C ATOM 954 HG1 THR A 139 27.422 40.714 -9.823 1.00 0.00 H ATOM 955 H THR A 139 30.916 40.241 -9.471 1.00 0.00 H ATOM 956 N TYR A 140 29.838 42.883 -6.459 1.00 35.81 N ATOM 957 CA TYR A 140 29.706 42.744 -5.016 1.00 33.02 C ATOM 958 C TYR A 140 28.462 43.455 -4.497 1.00 34.94 C ATOM 959 O TYR A 140 28.053 44.487 -5.030 1.00 34.41 O ATOM 960 CB TYR A 140 30.952 43.288 -4.314 1.00 32.92 C ATOM 961 CG TYR A 140 32.201 42.474 -4.565 1.00 34.87 C ATOM 962 CD1 TYR A 140 32.936 42.631 -5.734 1.00 33.51 C ATOM 963 CD2 TYR A 140 32.652 41.553 -3.628 1.00 32.91 C ATOM 964 CE1 TYR A 140 34.079 41.888 -5.965 1.00 33.76 C ATOM 965 CE2 TYR A 140 33.793 40.808 -3.850 1.00 34.93 C ATOM 966 CZ TYR A 140 34.503 40.978 -5.018 1.00 35.55 C ATOM 967 OH TYR A 140 35.639 40.234 -5.236 1.00 41.47 O ATOM 968 HH TYR A 140 36.026 40.475 -6.115 1.00 0.00 H ATOM 969 H TYR A 140 29.812 43.834 -6.879 1.00 0.00 H ATOM 970 N ALA A 141 27.864 42.894 -3.451 1.00 33.91 N ATOM 971 CA ALA A 141 26.670 43.471 -2.851 1.00 32.13 C ATOM 972 C ALA A 141 26.498 42.997 -1.418 1.00 31.77 C ATOM 973 O ALA A 141 27.068 41.981 -1.017 1.00 32.38 O ATOM 974 CB ALA A 141 25.439 43.119 -3.668 1.00 30.73 C ATOM 975 H ALA A 141 28.260 42.020 -3.051 1.00 0.00 H ATOM 976 N ASN A 142 25.717 43.749 -0.650 1.00 31.02 N ATOM 977 CA ASN A 142 25.314 43.329 0.682 1.00 31.05 C ATOM 978 C ASN A 142 24.644 41.965 0.594 1.00 31.25 C ATOM 979 O ASN A 142 23.840 41.725 -0.306 1.00 32.74 O ATOM 980 CB ASN A 142 24.374 44.362 1.307 1.00 32.13 C ATOM 981 CG ASN A 142 23.952 43.999 2.719 1.00 32.93 C ATOM 982 OD1 ASN A 142 24.493 43.076 3.328 1.00 38.13 O ATOM 983 ND2 ASN A 142 22.979 44.730 3.247 1.00 32.91 N ATOM 984 HD22 ASN A 142 22.550 45.501 2.696 1.00 0.00 H ATOM 985 HD21 ASN A 142 22.645 44.532 4.212 1.00 0.00 H ATOM 986 H ASN A 142 25.384 44.665 -1.013 1.00 0.00 H ATOM 987 N ALA A 143 24.990 41.073 1.516 1.00 29.50 N ATOM 988 CA ALA A 143 24.458 39.713 1.515 1.00 29.42 C ATOM 989 C ALA A 143 22.935 39.713 1.546 1.00 30.32 C ATOM 990 O ALA A 143 22.289 38.827 0.984 1.00 30.86 O ATOM 991 CB ALA A 143 25.010 38.931 2.692 1.00 27.80 C ATOM 992 H ALA A 143 25.660 41.352 2.261 1.00 0.00 H ATOM 993 N LEU A 144 22.371 40.718 2.206 1.00 29.61 N ATOM 994 CA LEU A 144 20.928 40.888 2.267 1.00 30.07 C ATOM 995 C LEU A 144 20.381 41.344 0.916 1.00 31.90 C ATOM 996 O LEU A 144 19.286 40.947 0.518 1.00 31.42 O ATOM 997 CB LEU A 144 20.556 41.888 3.363 1.00 30.71 C ATOM 998 CG LEU A 144 19.064 42.152 3.565 1.00 35.28 C ATOM 999 CD1 LEU A 144 18.306 40.847 3.752 1.00 33.35 C ATOM 1000 CD2 LEU A 144 18.850 43.073 4.754 1.00 34.77 C ATOM 1001 H LEU A 144 22.980 41.405 2.694 1.00 0.00 H ATOM 1002 N SER A 145 21.149 42.175 0.215 1.00 30.48 N ATOM 1003 CA SER A 145 20.765 42.625 -1.121 1.00 31.29 C ATOM 1004 C SER A 145 20.701 41.434 -2.070 1.00 30.71 C ATOM 1005 O SER A 145 19.755 41.296 -2.846 1.00 32.07 O ATOM 1006 CB SER A 145 21.744 43.678 -1.649 1.00 33.25 C ATOM 1007 OG SER A 145 21.749 44.836 -0.832 1.00 37.36 O ATOM 1008 HG SER A 145 20.841 45.231 -0.816 1.00 0.00 H ATOM 1009 H SER A 145 22.042 42.512 0.627 1.00 0.00 H ATOM 1010 N ASN A 146 21.709 40.571 -1.995 1.00 29.59 N ATOM 1011 CA ASN A 146 21.734 39.352 -2.793 1.00 29.95 C ATOM 1012 C ASN A 146 20.586 38.415 -2.434 1.00 32.00 C ATOM 1013 O ASN A 146 20.068 37.697 -3.289 1.00 31.05 O ATOM 1014 CB ASN A 146 23.070 38.628 -2.621 1.00 28.41 C ATOM 1015 CG ASN A 146 24.219 39.360 -3.284 1.00 29.25 C ATOM 1016 OD1 ASN A 146 24.024 40.101 -4.247 1.00 28.76 O ATOM 1017 ND2 ASN A 146 25.426 39.153 -2.773 1.00 29.79 N ATOM 1018 HD22 ASN A 146 25.544 38.518 -1.958 1.00 0.00 H ATOM 1019 HD21 ASN A 146 26.254 39.626 -3.188 1.00 0.00 H ATOM 1020 H ASN A 146 22.500 40.771 -1.350 1.00 0.00 H ATOM 1021 N GLN A 147 20.192 38.427 -1.165 1.00 28.71 N ATOM 1022 CA GLN A 147 19.096 37.586 -0.702 1.00 30.25 C ATOM 1023 C GLN A 147 17.749 38.160 -1.131 1.00 32.03 C ATOM 1024 O GLN A 147 16.822 37.418 -1.456 1.00 31.53 O ATOM 1025 CB GLN A 147 19.145 37.429 0.820 1.00 28.52 C ATOM 1026 CG GLN A 147 18.132 36.439 1.365 1.00 28.36 C ATOM 1027 CD GLN A 147 18.279 36.206 2.857 1.00 34.54 C ATOM 1028 OE1 GLN A 147 19.088 36.853 3.524 1.00 35.66 O ATOM 1029 NE2 GLN A 147 17.497 35.273 3.388 1.00 29.88 N ATOM 1030 HE22 GLN A 147 16.828 34.751 2.787 1.00 0.00 H ATOM 1031 HE21 GLN A 147 17.554 35.064 4.405 1.00 0.00 H ATOM 1032 H GLN A 147 20.676 39.050 -0.488 1.00 0.00 H ATOM 1033 N LEU A 148 17.650 39.485 -1.138 1.00 31.69 N ATOM 1034 CA LEU A 148 16.402 40.160 -1.478 1.00 31.33 C ATOM 1035 C LEU A 148 16.200 40.310 -2.984 1.00 32.54 C ATOM 1036 O LEU A 148 15.080 40.532 -3.442 1.00 33.38 O ATOM 1037 CB LEU A 148 16.347 41.542 -0.821 1.00 32.00 C ATOM 1038 CG LEU A 148 16.077 41.618 0.682 1.00 34.30 C ATOM 1039 CD1 LEU A 148 16.200 43.054 1.169 1.00 33.08 C ATOM 1040 CD2 LEU A 148 14.704 41.057 1.007 1.00 31.56 C ATOM 1041 H LEU A 148 18.484 40.056 -0.895 1.00 0.00 H ATOM 1042 N ALA A 149 17.287 40.186 -3.743 1.00 31.91 N ATOM 1043 CA ALA A 149 17.284 40.468 -5.182 1.00 31.84 C ATOM 1044 C ALA A 149 16.215 39.719 -5.997 1.00 33.01 C ATOM 1045 O ALA A 149 15.555 40.335 -6.836 1.00 36.81 O ATOM 1046 CB ALA A 149 18.673 40.192 -5.767 1.00 35.52 C ATOM 1047 H ALA A 149 18.174 39.877 -3.297 1.00 0.00 H ATOM 1048 N PRO A 150 16.042 38.398 -5.773 1.00 33.18 N ATOM 1049 CA PRO A 150 14.990 37.723 -6.546 1.00 32.63 C ATOM 1050 C PRO A 150 13.592 38.295 -6.304 1.00 35.76 C ATOM 1051 O PRO A 150 12.808 38.408 -7.247 1.00 40.60 O ATOM 1052 CB PRO A 150 15.066 36.276 -6.052 1.00 28.07 C ATOM 1053 CG PRO A 150 16.458 36.116 -5.566 1.00 30.95 C ATOM 1054 CD PRO A 150 16.817 37.438 -4.963 1.00 32.05 C ATOM 1055 N GLN A 151 13.292 38.646 -5.058 1.00 32.46 N ATOM 1056 CA GLN A 151 12.001 39.231 -4.712 1.00 34.74 C ATOM 1057 C GLN A 151 11.833 40.608 -5.344 1.00 37.12 C ATOM 1058 O GLN A 151 10.722 41.016 -5.683 1.00 40.19 O ATOM 1059 CB GLN A 151 11.850 39.334 -3.193 1.00 37.72 C ATOM 1060 CG GLN A 151 12.011 38.016 -2.459 1.00 40.86 C ATOM 1061 CD GLN A 151 12.108 38.195 -0.957 1.00 39.91 C ATOM 1062 OE1 GLN A 151 11.333 38.939 -0.358 1.00 44.46 O ATOM 1063 NE2 GLN A 151 13.065 37.512 -0.340 1.00 38.14 N ATOM 1064 HE22 GLN A 151 13.698 36.894 -0.887 1.00 0.00 H ATOM 1065 HE21 GLN A 151 13.181 37.595 0.690 1.00 0.00 H ATOM 1066 H GLN A 151 13.998 38.500 -4.308 1.00 0.00 H ATOM 1067 N GLU A 152 12.945 41.319 -5.500 1.00 37.28 N ATOM 1068 CA GLU A 152 12.923 42.665 -6.060 1.00 38.24 C ATOM 1069 C GLU A 152 13.057 42.649 -7.582 1.00 37.38 C ATOM 1070 O GLU A 152 13.221 43.695 -8.210 1.00 37.72 O ATOM 1071 CB GLU A 152 14.034 43.514 -5.440 1.00 36.36 C ATOM 1072 CG GLU A 152 13.843 43.794 -3.956 1.00 36.83 C ATOM 1073 CD GLU A 152 12.606 44.627 -3.674 1.00 41.08 C ATOM 1074 OE1 GLU A 152 12.300 45.530 -4.480 1.00 45.35 O ATOM 1075 OE2 GLU A 152 11.941 44.380 -2.645 1.00 44.20 O ATOM 1076 H GLU A 152 13.855 40.904 -5.215 1.00 0.00 H ATOM 1077 N GLY A 153 12.982 41.457 -8.166 1.00 38.38 N ATOM 1078 CA GLY A 153 13.061 41.301 -9.608 1.00 38.68 C ATOM 1079 C GLY A 153 14.449 41.561 -10.161 1.00 36.71 C ATOM 1080 O GLY A 153 14.607 41.910 -11.330 1.00 36.23 O ATOM 1081 H GLY A 153 12.863 40.611 -7.573 1.00 0.00 H ATOM 1082 N MET A 154 15.461 41.383 -9.321 1.00 37.05 N ATOM 1083 CA MET A 154 16.832 41.681 -9.714 1.00 35.70 C ATOM 1084 C MET A 154 17.676 40.424 -9.865 1.00 33.67 C ATOM 1085 O MET A 154 17.321 39.358 -9.361 1.00 30.58 O ATOM 1086 CB MET A 154 17.488 42.615 -8.693 1.00 34.44 C ATOM 1087 CG MET A 154 16.817 43.967 -8.562 1.00 35.26 C ATOM 1088 SD MET A 154 16.894 44.920 -10.089 1.00 40.25 S ATOM 1089 CE MET A 154 15.150 45.130 -10.436 1.00 40.05 C ATOM 1090 H MET A 154 15.272 41.024 -8.364 1.00 0.00 H ATOM 1091 N VAL A 155 18.791 40.564 -10.574 1.00 34.01 N ATOM 1092 CA VAL A 155 19.811 39.526 -10.628 1.00 33.85 C ATOM 1093 C VAL A 155 20.821 39.793 -9.522 1.00 33.59 C ATOM 1094 O VAL A 155 21.367 40.891 -9.428 1.00 35.33 O ATOM 1095 CB VAL A 155 20.534 39.485 -11.991 1.00 34.83 C ATOM 1096 CG1 VAL A 155 21.736 38.556 -11.930 1.00 33.35 C ATOM 1097 CG2 VAL A 155 19.578 39.054 -13.093 1.00 39.18 C ATOM 1098 H VAL A 155 18.940 41.444 -11.108 1.00 0.00 H ATOM 1099 N ALA A 156 21.062 38.795 -8.680 1.00 31.65 N ATOM 1100 CA ALA A 156 21.977 38.960 -7.557 1.00 34.01 C ATOM 1101 C ALA A 156 23.411 39.176 -8.027 1.00 33.78 C ATOM 1102 O ALA A 156 23.777 38.795 -9.139 1.00 34.91 O ATOM 1103 CB ALA A 156 21.902 37.754 -6.636 1.00 31.46 C ATOM 1104 H ALA A 156 20.590 37.880 -8.824 1.00 0.00 H ATOM 1105 N ALA A 157 24.217 39.799 -7.174 1.00 33.09 N ATOM 1106 CA ALA A 157 25.641 39.936 -7.441 1.00 31.70 C ATOM 1107 C ALA A 157 26.331 38.600 -7.205 1.00 32.33 C ATOM 1108 O ALA A 157 25.742 37.680 -6.636 1.00 34.31 O ATOM 1109 CB ALA A 157 26.254 41.019 -6.572 1.00 31.67 C ATOM 1110 H ALA A 157 23.822 40.197 -6.298 1.00 0.00 H ATOM 1111 N GLN A 158 27.580 38.493 -7.639 1.00 32.79 N ATOM 1112 CA GLN A 158 28.294 37.226 -7.563 1.00 33.00 C ATOM 1113 C GLN A 158 28.930 36.999 -6.194 1.00 30.87 C ATOM 1114 O GLN A 158 29.246 35.865 -5.836 1.00 34.21 O ATOM 1115 CB GLN A 158 29.357 37.158 -8.662 1.00 33.07 C ATOM 1116 CG GLN A 158 28.774 37.162 -10.068 1.00 32.99 C ATOM 1117 CD GLN A 158 29.838 37.177 -11.149 1.00 34.86 C ATOM 1118 OE1 GLN A 158 31.010 37.439 -10.880 1.00 38.07 O ATOM 1119 NE2 GLN A 158 29.432 36.896 -12.381 1.00 31.98 N ATOM 1120 HE22 GLN A 158 28.431 36.680 -12.562 1.00 0.00 H ATOM 1121 HE21 GLN A 158 30.115 36.891 -13.165 1.00 0.00 H ATOM 1122 H GLN A 158 28.056 39.326 -8.039 1.00 0.00 H ATOM 1123 N HIS A 159 29.112 38.071 -5.429 1.00 33.06 N ATOM 1124 CA HIS A 159 29.739 37.965 -4.114 1.00 31.14 C ATOM 1125 C HIS A 159 28.991 38.781 -3.067 1.00 30.09 C ATOM 1126 O HIS A 159 28.391 39.809 -3.380 1.00 29.19 O ATOM 1127 CB HIS A 159 31.199 38.412 -4.184 1.00 30.70 C ATOM 1128 CG HIS A 159 31.969 37.781 -5.300 1.00 35.19 C ATOM 1129 ND1 HIS A 159 32.405 36.475 -5.259 1.00 33.85 N ATOM 1130 CD2 HIS A 159 32.371 38.275 -6.496 1.00 33.83 C ATOM 1131 CE1 HIS A 159 33.048 36.192 -6.378 1.00 31.95 C ATOM 1132 NE2 HIS A 159 33.040 37.267 -7.146 1.00 34.23 N ATOM 1133 H HIS A 159 28.802 39.002 -5.773 1.00 0.00 H ATOM 1134 N SER A 160 29.037 38.320 -1.821 1.00 30.66 N ATOM 1135 CA SER A 160 28.281 38.954 -0.749 1.00 28.11 C ATOM 1136 C SER A 160 29.167 39.689 0.251 1.00 30.40 C ATOM 1137 O SER A 160 30.125 39.127 0.785 1.00 32.93 O ATOM 1138 CB SER A 160 27.437 37.914 -0.010 1.00 26.72 C ATOM 1139 OG SER A 160 26.385 37.434 -0.829 1.00 33.94 O ATOM 1140 HG SER A 160 25.857 36.764 -0.327 1.00 0.00 H ATOM 1141 H SER A 160 29.625 37.489 -1.607 1.00 0.00 H ATOM 1142 N LEU A 161 28.832 40.952 0.497 1.00 29.97 N ATOM 1143 CA LEU A 161 29.478 41.732 1.543 1.00 30.56 C ATOM 1144 C LEU A 161 28.745 41.554 2.870 1.00 35.60 C ATOM 1145 O LEU A 161 27.519 41.659 2.932 1.00 33.95 O ATOM 1146 CB LEU A 161 29.523 43.217 1.170 1.00 30.05 C ATOM 1147 CG LEU A 161 30.155 43.635 -0.160 1.00 32.10 C ATOM 1148 CD1 LEU A 161 29.957 45.125 -0.397 1.00 30.24 C ATOM 1149 CD2 LEU A 161 31.629 43.286 -0.197 1.00 30.27 C ATOM 1150 H LEU A 161 28.086 41.396 -0.075 1.00 0.00 H ATOM 1151 N THR A 162 29.498 41.278 3.928 1.00 33.32 N ATOM 1152 CA THR A 162 28.928 41.233 5.269 1.00 34.25 C ATOM 1153 C THR A 162 29.559 42.325 6.123 1.00 33.75 C ATOM 1154 O THR A 162 30.636 42.829 5.804 1.00 32.53 O ATOM 1155 CB THR A 162 29.129 39.863 5.936 1.00 32.68 C ATOM 1156 OG1 THR A 162 30.522 39.528 5.939 1.00 37.33 O ATOM 1157 CG2 THR A 162 28.355 38.790 5.185 1.00 32.52 C ATOM 1158 HG1 THR A 162 30.647 38.645 6.369 1.00 0.00 H ATOM 1159 H THR A 162 30.513 41.091 3.798 1.00 0.00 H ATOM 1160 N PHE A 163 28.885 42.689 7.208 1.00 34.25 N ATOM 1161 CA PHE A 163 29.273 43.868 7.973 1.00 36.63 C ATOM 1162 C PHE A 163 29.372 43.612 9.472 1.00 33.96 C ATOM 1163 O PHE A 163 28.624 42.811 10.032 1.00 31.93 O ATOM 1164 CB PHE A 163 28.283 45.004 7.705 1.00 33.65 C ATOM 1165 CG PHE A 163 28.206 45.407 6.259 1.00 35.19 C ATOM 1166 CD1 PHE A 163 27.382 44.726 5.375 1.00 33.59 C ATOM 1167 CD2 PHE A 163 28.963 46.461 5.781 1.00 33.62 C ATOM 1168 CE1 PHE A 163 27.317 45.091 4.045 1.00 33.45 C ATOM 1169 CE2 PHE A 163 28.902 46.832 4.453 1.00 32.68 C ATOM 1170 CZ PHE A 163 28.080 46.146 3.583 1.00 33.44 C ATOM 1171 H PHE A 163 28.068 42.124 7.517 1.00 0.00 H ATOM 1172 N ALA A 164 30.303 44.306 10.117 1.00 35.07 N ATOM 1173 CA ALA A 164 30.454 44.220 11.562 1.00 35.16 C ATOM 1174 C ALA A 164 29.307 44.938 12.262 1.00 34.35 C ATOM 1175 O ALA A 164 28.500 45.613 11.623 1.00 37.03 O ATOM 1176 CB ALA A 164 31.789 44.800 11.993 1.00 29.59 C ATOM 1177 H ALA A 164 30.939 44.926 9.576 1.00 0.00 H ATOM 1178 N ALA A 165 29.243 44.794 13.581 1.00 34.03 N ATOM 1179 CA ALA A 165 28.176 45.399 14.369 1.00 34.01 C ATOM 1180 C ALA A 165 28.260 46.924 14.361 1.00 34.80 C ATOM 1181 O ALA A 165 27.268 47.603 14.620 1.00 39.10 O ATOM 1182 CB ALA A 165 28.213 44.875 15.795 1.00 32.33 C ATOM 1183 H ALA A 165 29.974 44.234 14.065 1.00 0.00 H ATOM 1184 N ASN A 166 29.441 47.459 14.065 1.00 33.01 N ATOM 1185 CA ASN A 166 29.613 48.907 14.013 1.00 33.53 C ATOM 1186 C ASN A 166 29.347 49.477 12.623 1.00 37.13 C ATOM 1187 O ASN A 166 29.443 50.685 12.410 1.00 37.96 O ATOM 1188 CB ASN A 166 31.015 49.303 14.491 1.00 32.50 C ATOM 1189 CG ASN A 166 32.127 48.742 13.617 1.00 35.39 C ATOM 1190 OD1 ASN A 166 31.883 48.113 12.586 1.00 39.53 O ATOM 1191 ND2 ASN A 166 33.366 48.975 14.033 1.00 35.12 N ATOM 1192 HD22 ASN A 166 33.528 49.511 14.910 1.00 0.00 H ATOM 1193 HD21 ASN A 166 34.174 48.622 13.482 1.00 0.00 H ATOM 1194 H ASN A 166 30.252 46.838 13.868 1.00 0.00 H ATOM 1195 N GLY A 167 29.023 48.599 11.678 1.00 36.47 N ATOM 1196 CA GLY A 167 28.592 49.026 10.360 1.00 34.46 C ATOM 1197 C GLY A 167 29.610 48.856 9.248 1.00 33.77 C ATOM 1198 O GLY A 167 29.245 48.834 8.073 1.00 35.27 O ATOM 1199 H GLY A 167 29.080 47.582 11.889 1.00 0.00 H ATOM 1200 N TRP A 168 30.884 48.740 9.608 1.00 34.89 N ATOM 1201 CA TRP A 168 31.938 48.602 8.608 1.00 34.00 C ATOM 1202 C TRP A 168 31.967 47.199 8.015 1.00 35.31 C ATOM 1203 O TRP A 168 31.712 46.213 8.706 1.00 34.65 O ATOM 1204 CB TRP A 168 33.304 48.949 9.204 1.00 31.29 C ATOM 1205 CG TRP A 168 33.445 50.401 9.532 1.00 34.22 C ATOM 1206 CD1 TRP A 168 33.502 50.959 10.776 1.00 33.98 C ATOM 1207 CD2 TRP A 168 33.523 51.487 8.602 1.00 34.41 C ATOM 1208 NE1 TRP A 168 33.623 52.323 10.678 1.00 34.58 N ATOM 1209 CE2 TRP A 168 33.636 52.674 9.353 1.00 37.26 C ATOM 1210 CE3 TRP A 168 33.511 51.573 7.205 1.00 34.28 C ATOM 1211 CZ2 TRP A 168 33.739 53.929 8.757 1.00 34.78 C ATOM 1212 CZ3 TRP A 168 33.613 52.820 6.615 1.00 33.88 C ATOM 1213 CH2 TRP A 168 33.725 53.981 7.390 1.00 35.47 C ATOM 1214 HE1 TRP A 168 33.693 52.983 11.479 1.00 0.00 H ATOM 1215 H TRP A 168 31.134 48.748 10.618 1.00 0.00 H ATOM 1216 N VAL A 169 32.281 47.123 6.725 1.00 34.58 N ATOM 1217 CA VAL A 169 32.315 45.855 6.009 1.00 36.87 C ATOM 1218 C VAL A 169 33.448 44.970 6.517 1.00 36.41 C ATOM 1219 O VAL A 169 34.518 45.462 6.875 1.00 36.12 O ATOM 1220 CB VAL A 169 32.468 46.081 4.481 1.00 35.87 C ATOM 1221 CG1 VAL A 169 33.768 46.813 4.165 1.00 31.43 C ATOM 1222 CG2 VAL A 169 32.383 44.765 3.719 1.00 35.12 C ATOM 1223 H VAL A 169 32.510 47.997 6.211 1.00 0.00 H ATOM 1224 N GLU A 170 33.195 43.666 6.582 1.00 39.28 N ATOM 1225 CA GLU A 170 34.254 42.705 6.845 1.00 39.18 C ATOM 1226 C GLU A 170 35.265 42.791 5.709 1.00 40.48 C ATOM 1227 O GLU A 170 34.927 42.508 4.559 1.00 37.59 O ATOM 1228 CB GLU A 170 33.693 41.286 6.963 1.00 37.46 C ATOM 1229 CG GLU A 170 32.693 41.097 8.094 1.00 42.55 C ATOM 1230 CD GLU A 170 33.341 41.162 9.464 1.00 53.42 C ATOM 1231 OE1 GLU A 170 34.565 40.930 9.557 1.00 57.68 O ATOM 1232 OE2 GLU A 170 32.625 41.444 10.448 1.00 67.38 O ATOM 1233 H GLU A 170 32.222 43.327 6.442 1.00 0.00 H ATOM 1234 N PRO A 171 36.505 43.202 6.025 1.00 41.47 N ATOM 1235 CA PRO A 171 37.559 43.403 5.023 1.00 41.36 C ATOM 1236 C PRO A 171 37.793 42.169 4.157 1.00 41.02 C ATOM 1237 O PRO A 171 38.158 42.293 2.988 1.00 40.23 O ATOM 1238 CB PRO A 171 38.795 43.713 5.872 1.00 42.68 C ATOM 1239 CG PRO A 171 38.247 44.266 7.144 1.00 36.82 C ATOM 1240 CD PRO A 171 36.972 43.515 7.387 1.00 39.40 C ATOM 1241 N ALA A 172 37.575 40.991 4.732 1.00 40.59 N ATOM 1242 CA ALA A 172 37.757 39.739 4.009 1.00 40.80 C ATOM 1243 C ALA A 172 36.691 39.550 2.932 1.00 38.61 C ATOM 1244 O ALA A 172 36.873 38.768 1.998 1.00 39.88 O ATOM 1245 CB ALA A 172 37.743 38.566 4.977 1.00 36.58 C ATOM 1246 H ALA A 172 37.266 40.962 5.725 1.00 0.00 H ATOM 1247 N THR A 173 35.582 40.269 3.063 1.00 37.89 N ATOM 1248 CA THR A 173 34.477 40.141 2.118 1.00 38.35 C ATOM 1249 C THR A 173 34.544 41.196 1.017 1.00 35.48 C ATOM 1250 O THR A 173 33.885 41.066 -0.013 1.00 35.43 O ATOM 1251 CB THR A 173 33.116 40.241 2.831 1.00 36.11 C ATOM 1252 OG1 THR A 173 32.974 41.540 3.419 1.00 36.47 O ATOM 1253 CG2 THR A 173 33.008 39.179 3.914 1.00 34.14 C ATOM 1254 HG1 THR A 173 33.701 41.685 4.075 1.00 0.00 H ATOM 1255 H THR A 173 35.499 40.937 3.856 1.00 0.00 H ATOM 1256 N ALA A 174 35.346 42.234 1.235 1.00 37.63 N ATOM 1257 CA ALA A 174 35.540 43.274 0.228 1.00 41.04 C ATOM 1258 C ALA A 174 37.017 43.420 -0.139 1.00 40.26 C ATOM 1259 O ALA A 174 37.639 44.435 0.173 1.00 41.86 O ATOM 1260 CB ALA A 174 34.981 44.600 0.722 1.00 35.81 C ATOM 1261 H ALA A 174 35.847 42.307 2.144 1.00 0.00 H ATOM 1262 N PRO A 175 37.578 42.409 -0.822 1.00 39.65 N ATOM 1263 CA PRO A 175 39.016 42.375 -1.104 1.00 41.64 C ATOM 1264 C PRO A 175 39.440 43.320 -2.226 1.00 40.21 C ATOM 1265 O PRO A 175 38.751 43.427 -3.241 1.00 38.98 O ATOM 1266 CB PRO A 175 39.249 40.919 -1.509 1.00 40.58 C ATOM 1267 CG PRO A 175 37.968 40.518 -2.151 1.00 37.38 C ATOM 1268 CD PRO A 175 36.876 41.256 -1.415 1.00 37.19 C ATOM 1269 N ASN A 176 40.573 43.989 -2.027 1.00 40.52 N ATOM 1270 CA ASN A 176 41.154 44.880 -3.028 1.00 39.34 C ATOM 1271 C ASN A 176 40.167 45.918 -3.553 1.00 39.32 C ATOM 1272 O ASN A 176 40.069 46.139 -4.759 1.00 38.60 O ATOM 1273 CB ASN A 176 41.715 44.065 -4.194 1.00 41.70 C ATOM 1274 CG ASN A 176 42.688 42.996 -3.741 1.00 44.00 C ATOM 1275 OD1 ASN A 176 42.483 41.808 -3.989 1.00 49.98 O ATOM 1276 ND2 ASN A 176 43.752 43.414 -3.066 1.00 39.91 N ATOM 1277 HD22 ASN A 176 43.884 44.429 -2.880 1.00 0.00 H ATOM 1278 HD21 ASN A 176 44.453 42.727 -2.724 1.00 0.00 H ATOM 1279 H ASN A 176 41.066 43.872 -1.119 1.00 0.00 H ATOM 1280 N PHE A 177 39.440 46.551 -2.638 1.00 37.75 N ATOM 1281 CA PHE A 177 38.474 47.584 -3.000 1.00 36.60 C ATOM 1282 C PHE A 177 39.152 48.936 -3.189 1.00 37.55 C ATOM 1283 O PHE A 177 38.490 49.939 -3.460 1.00 37.15 O ATOM 1284 CB PHE A 177 37.377 47.689 -1.938 1.00 34.16 C ATOM 1285 CG PHE A 177 36.174 46.837 -2.225 1.00 36.37 C ATOM 1286 CD1 PHE A 177 36.318 45.583 -2.794 1.00 38.09 C ATOM 1287 CD2 PHE A 177 34.899 47.288 -1.925 1.00 36.66 C ATOM 1288 CE1 PHE A 177 35.214 44.797 -3.062 1.00 36.87 C ATOM 1289 CE2 PHE A 177 33.790 46.505 -2.189 1.00 35.77 C ATOM 1290 CZ PHE A 177 33.949 45.258 -2.758 1.00 36.25 C ATOM 1291 H PHE A 177 39.563 46.303 -1.635 1.00 0.00 H ATOM 1292 N GLY A 178 40.474 48.954 -3.047 1.00 35.95 N ATOM 1293 CA GLY A 178 41.250 50.168 -3.214 1.00 34.98 C ATOM 1294 C GLY A 178 40.821 51.273 -2.269 1.00 37.33 C ATOM 1295 O GLY A 178 40.834 51.093 -1.052 1.00 41.34 O ATOM 1296 H GLY A 178 40.967 48.070 -2.809 1.00 0.00 H ATOM 1297 N PRO A 179 40.431 52.426 -2.832 1.00 37.36 N ATOM 1298 CA PRO A 179 40.011 53.598 -2.057 1.00 40.90 C ATOM 1299 C PRO A 179 38.581 53.488 -1.528 1.00 38.62 C ATOM 1300 O PRO A 179 38.148 54.339 -0.751 1.00 40.03 O ATOM 1301 CB PRO A 179 40.128 54.736 -3.072 1.00 36.49 C ATOM 1302 CG PRO A 179 39.844 54.080 -4.381 1.00 33.29 C ATOM 1303 CD PRO A 179 40.433 52.696 -4.282 1.00 35.86 C ATOM 1304 N LEU A 180 37.860 52.451 -1.942 1.00 36.42 N ATOM 1305 CA LEU A 180 36.466 52.292 -1.543 1.00 37.51 C ATOM 1306 C LEU A 180 36.323 51.805 -0.102 1.00 38.88 C ATOM 1307 O LEU A 180 36.824 50.739 0.258 1.00 38.92 O ATOM 1308 CB LEU A 180 35.747 51.326 -2.489 1.00 36.30 C ATOM 1309 CG LEU A 180 35.670 51.719 -3.966 1.00 36.53 C ATOM 1310 CD1 LEU A 180 34.679 50.834 -4.707 1.00 32.37 C ATOM 1311 CD2 LEU A 180 35.300 53.185 -4.112 1.00 37.26 C ATOM 1312 H LEU A 180 38.298 51.740 -2.562 1.00 0.00 H ATOM 1313 N LYS A 181 35.637 52.596 0.716 1.00 37.83 N ATOM 1314 CA LYS A 181 35.291 52.192 2.074 1.00 38.18 C ATOM 1315 C LYS A 181 33.782 51.993 2.184 1.00 36.68 C ATOM 1316 O LYS A 181 33.017 52.958 2.169 1.00 36.74 O ATOM 1317 CB LYS A 181 35.772 53.229 3.089 1.00 40.84 C ATOM 1318 CG LYS A 181 37.279 53.409 3.112 1.00 48.45 C ATOM 1319 CD LYS A 181 37.968 52.155 3.627 1.00 59.41 C ATOM 1320 CE LYS A 181 39.479 52.316 3.648 1.00 63.42 C ATOM 1321 NZ LYS A 181 39.913 53.387 4.588 1.00 72.08 N ATOM 1322 HZ1 LYS A 181 39.493 54.293 4.297 1.00 0.00 H ATOM 1323 HZ2 LYS A 181 39.598 53.151 5.550 1.00 0.00 H ATOM 1324 HZ3 LYS A 181 40.950 53.463 4.571 1.00 0.00 H ATOM 1325 H LYS A 181 35.337 53.533 0.377 1.00 0.00 H ATOM 1326 N VAL A 182 33.362 50.737 2.289 1.00 34.52 N ATOM 1327 CA VAL A 182 31.943 50.396 2.318 1.00 34.58 C ATOM 1328 C VAL A 182 31.403 50.356 3.745 1.00 36.86 C ATOM 1329 O VAL A 182 32.026 49.787 4.642 1.00 36.37 O ATOM 1330 CB VAL A 182 31.686 49.043 1.637 1.00 32.42 C ATOM 1331 CG1 VAL A 182 30.198 48.838 1.418 1.00 32.78 C ATOM 1332 CG2 VAL A 182 32.428 48.977 0.315 1.00 31.42 C ATOM 1333 H VAL A 182 34.065 49.974 2.352 1.00 0.00 H ATOM 1334 N PHE A 183 30.236 50.959 3.947 1.00 35.46 N ATOM 1335 CA PHE A 183 29.660 51.083 5.280 1.00 33.27 C ATOM 1336 C PHE A 183 28.152 50.857 5.275 1.00 34.50 C ATOM 1337 O PHE A 183 27.421 51.514 4.534 1.00 32.77 O ATOM 1338 CB PHE A 183 29.981 52.462 5.860 1.00 33.54 C ATOM 1339 CG PHE A 183 29.383 52.709 7.216 1.00 35.02 C ATOM 1340 CD1 PHE A 183 29.947 52.151 8.348 1.00 34.12 C ATOM 1341 CD2 PHE A 183 28.262 53.511 7.358 1.00 32.88 C ATOM 1342 CE1 PHE A 183 29.401 52.381 9.595 1.00 34.85 C ATOM 1343 CE2 PHE A 183 27.714 53.745 8.603 1.00 34.54 C ATOM 1344 CZ PHE A 183 28.283 53.178 9.722 1.00 34.56 C ATOM 1345 H PHE A 183 29.721 51.352 3.134 1.00 0.00 H ATOM 1346 N TYR A 184 27.693 49.922 6.103 1.00 33.40 N ATOM 1347 CA TYR A 184 26.263 49.687 6.279 1.00 34.60 C ATOM 1348 C TYR A 184 25.742 50.500 7.460 1.00 32.30 C ATOM 1349 O TYR A 184 26.039 50.187 8.612 1.00 33.24 O ATOM 1350 CB TYR A 184 25.969 48.197 6.483 1.00 33.47 C ATOM 1351 CG TYR A 184 24.514 47.907 6.787 1.00 34.88 C ATOM 1352 CD1 TYR A 184 23.546 48.004 5.798 1.00 34.76 C ATOM 1353 CD2 TYR A 184 24.109 47.536 8.063 1.00 34.93 C ATOM 1354 CE1 TYR A 184 22.214 47.746 6.069 1.00 36.88 C ATOM 1355 CE2 TYR A 184 22.781 47.272 8.343 1.00 33.79 C ATOM 1356 CZ TYR A 184 21.837 47.379 7.343 1.00 38.89 C ATOM 1357 OH TYR A 184 20.513 47.118 7.620 1.00 38.80 O ATOM 1358 HH TYR A 184 19.975 47.241 6.798 1.00 0.00 H ATOM 1359 H TYR A 184 28.371 49.343 6.639 1.00 0.00 H ATOM 1360 N PRO A 185 24.957 51.548 7.171 1.00 35.29 N ATOM 1361 CA PRO A 185 24.493 52.507 8.179 1.00 34.07 C ATOM 1362 C PRO A 185 23.298 52.016 8.989 1.00 33.73 C ATOM 1363 O PRO A 185 22.897 52.674 9.949 1.00 35.05 O ATOM 1364 CB PRO A 185 24.106 53.722 7.335 1.00 33.51 C ATOM 1365 CG PRO A 185 23.624 53.123 6.058 1.00 33.04 C ATOM 1366 CD PRO A 185 24.469 51.892 5.822 1.00 32.40 C ATOM 1367 N GLY A 186 22.746 50.871 8.606 1.00 34.14 N ATOM 1368 CA GLY A 186 21.522 50.376 9.208 1.00 34.77 C ATOM 1369 C GLY A 186 20.356 50.585 8.261 1.00 37.44 C ATOM 1370 O GLY A 186 20.510 51.235 7.227 1.00 37.28 O ATOM 1371 H GLY A 186 23.203 50.315 7.855 1.00 0.00 H ATOM 1372 N PRO A 187 19.183 50.034 8.602 1.00 38.24 N ATOM 1373 CA PRO A 187 17.984 50.164 7.761 1.00 37.43 C ATOM 1374 C PRO A 187 17.542 51.628 7.571 1.00 39.59 C ATOM 1375 O PRO A 187 17.391 52.339 8.563 1.00 42.54 O ATOM 1376 CB PRO A 187 16.931 49.354 8.532 1.00 38.53 C ATOM 1377 CG PRO A 187 17.722 48.430 9.425 1.00 38.75 C ATOM 1378 CD PRO A 187 18.945 49.204 9.796 1.00 37.49 C ATOM 1379 N GLY A 188 17.349 52.037 6.318 1.00 38.90 N ATOM 1380 CA GLY A 188 16.971 53.388 5.964 1.00 37.87 C ATOM 1381 C GLY A 188 16.078 53.366 4.749 1.00 39.74 C ATOM 1382 O GLY A 188 14.857 53.133 4.883 1.00 39.92 O ATOM 1383 H GLY A 188 17.477 51.346 5.551 1.00 0.00 H ATOM 1384 N HIS A 189 16.608 53.658 3.593 1.00 42.28 N ATOM 1385 CA HIS A 189 15.815 53.609 2.401 1.00 43.06 C ATOM 1386 C HIS A 189 15.211 52.249 2.202 1.00 42.47 C ATOM 1387 O HIS A 189 14.132 52.150 1.728 1.00 41.36 O ATOM 1388 CB HIS A 189 16.653 54.024 1.223 1.00 42.49 C ATOM 1389 CG HIS A 189 15.942 53.981 -0.084 1.00 51.77 C ATOM 1390 ND1 HIS A 189 14.922 54.836 -0.391 1.00 50.55 N ATOM 1391 CD2 HIS A 189 16.075 53.171 -1.146 1.00 61.24 C ATOM 1392 CE1 HIS A 189 14.464 54.575 -1.595 1.00 54.59 C ATOM 1393 NE2 HIS A 189 15.154 53.568 -2.077 1.00 49.48 N ATOM 1394 H HIS A 189 17.611 53.928 3.537 1.00 0.00 H ATOM 1395 N THR A 190 15.943 51.219 2.576 1.00 41.41 N ATOM 1396 CA THR A 190 15.598 49.827 2.480 1.00 43.16 C ATOM 1397 C THR A 190 16.289 49.196 3.672 1.00 39.86 C ATOM 1398 O THR A 190 17.012 49.893 4.404 1.00 39.06 O ATOM 1399 CB THR A 190 16.081 49.208 1.151 1.00 38.81 C ATOM 1400 OG1 THR A 190 17.504 49.344 1.081 1.00 38.97 O ATOM 1401 CG2 THR A 190 15.468 49.979 -0.013 1.00 40.36 C ATOM 1402 HG1 THR A 190 17.831 48.951 0.233 1.00 0.00 H ATOM 1403 H THR A 190 16.873 51.438 2.986 1.00 0.00 H ATOM 1404 N SER A 191 16.093 47.896 3.866 1.00 38.82 N ATOM 1405 CA SER A 191 16.753 47.214 4.956 1.00 37.97 C ATOM 1406 C SER A 191 18.219 46.981 4.579 1.00 39.17 C ATOM 1407 O SER A 191 19.025 46.718 5.456 1.00 41.07 O ATOM 1408 CB SER A 191 16.025 45.911 5.294 1.00 40.71 C ATOM 1409 OG SER A 191 14.788 46.198 5.922 1.00 47.16 O ATOM 1410 HG SER A 191 14.324 45.350 6.137 1.00 0.00 H ATOM 1411 H SER A 191 15.462 47.367 3.231 1.00 0.00 H ATOM 1412 N ASP A 192 18.566 47.143 3.298 1.00 38.65 N ATOM 1413 CA ASP A 192 19.880 46.743 2.842 1.00 36.33 C ATOM 1414 C ASP A 192 20.799 47.785 2.203 1.00 37.78 C ATOM 1415 O ASP A 192 21.889 47.409 1.799 1.00 36.95 O ATOM 1416 CB ASP A 192 19.766 45.590 1.839 1.00 33.31 C ATOM 1417 CG ASP A 192 19.075 45.981 0.540 1.00 36.68 C ATOM 1418 OD1 ASP A 192 17.981 46.567 0.592 1.00 37.93 O ATOM 1419 OD2 ASP A 192 19.669 45.715 -0.533 1.00 34.73 O ATOM 1420 H ASP A 192 17.889 47.558 2.627 1.00 0.00 H ATOM 1421 N ASN A 193 20.413 49.054 2.155 1.00 36.17 N ATOM 1422 CA ASN A 193 21.285 50.077 1.573 1.00 36.13 C ATOM 1423 C ASN A 193 22.647 50.219 2.270 1.00 35.68 C ATOM 1424 O ASN A 193 22.713 50.415 3.483 1.00 37.32 O ATOM 1425 CB ASN A 193 20.571 51.431 1.541 1.00 39.01 C ATOM 1426 CG ASN A 193 19.974 51.805 2.884 1.00 42.93 C ATOM 1427 OD1 ASN A 193 19.125 52.692 2.973 1.00 55.19 O ATOM 1428 ND2 ASN A 193 20.415 51.129 3.937 1.00 38.68 N ATOM 1429 HD22 ASN A 193 21.134 50.387 3.815 1.00 0.00 H ATOM 1430 HD21 ASN A 193 20.042 51.341 4.884 1.00 0.00 H ATOM 1431 H ASN A 193 19.483 49.324 2.534 1.00 0.00 H ATOM 1432 N ILE A 194 23.727 50.126 1.493 1.00 34.03 N ATOM 1433 CA ILE A 194 25.054 50.335 1.991 1.00 33.28 C ATOM 1434 C ILE A 194 25.552 51.621 1.366 1.00 32.78 C ATOM 1435 O ILE A 194 24.988 52.093 0.376 1.00 33.09 O ATOM 1436 CB ILE A 194 25.981 49.162 1.667 1.00 33.51 C ATOM 1437 CG1 ILE A 194 26.108 49.014 0.159 1.00 32.76 C ATOM 1438 CG2 ILE A 194 25.409 47.892 2.265 1.00 32.95 C ATOM 1439 CD1 ILE A 194 27.046 47.920 -0.256 1.00 30.46 C ATOM 1440 H ILE A 194 23.601 49.893 0.487 1.00 0.00 H ATOM 1441 N THR A 195 26.590 52.199 1.962 1.00 31.69 N ATOM 1442 CA THR A 195 27.175 53.450 1.494 1.00 34.26 C ATOM 1443 C THR A 195 28.670 53.272 1.279 1.00 34.67 C ATOM 1444 O THR A 195 29.302 52.420 1.908 1.00 34.74 O ATOM 1445 CB THR A 195 26.935 54.587 2.492 1.00 34.59 C ATOM 1446 OG1 THR A 195 27.591 54.279 3.730 1.00 33.47 O ATOM 1447 CG2 THR A 195 25.446 54.787 2.741 1.00 32.51 C ATOM 1448 HG1 THR A 195 27.225 53.435 4.095 1.00 0.00 H ATOM 1449 H THR A 195 27.003 51.739 2.798 1.00 0.00 H ATOM 1450 N VAL A 196 29.229 54.085 0.390 1.00 33.35 N ATOM 1451 CA VAL A 196 30.644 54.002 0.051 1.00 35.77 C ATOM 1452 C VAL A 196 31.357 55.349 0.172 1.00 34.67 C ATOM 1453 O VAL A 196 30.860 56.373 -0.298 1.00 34.12 O ATOM 1454 CB VAL A 196 30.848 53.474 -1.387 1.00 33.84 C ATOM 1455 CG1 VAL A 196 32.323 53.229 -1.661 1.00 34.68 C ATOM 1456 CG2 VAL A 196 30.047 52.201 -1.612 1.00 32.85 C ATOM 1457 H VAL A 196 28.639 54.802 -0.078 1.00 0.00 H ATOM 1458 N GLY A 197 32.528 55.337 0.801 1.00 33.65 N ATOM 1459 CA GLY A 197 33.391 56.503 0.836 1.00 36.36 C ATOM 1460 C GLY A 197 34.624 56.273 -0.018 1.00 38.57 C ATOM 1461 O GLY A 197 35.058 55.135 -0.192 1.00 37.55 O ATOM 1462 H GLY A 197 32.834 54.467 1.282 1.00 0.00 H ATOM 1463 N ILE A 198 35.189 57.348 -0.557 1.00 38.73 N ATOM 1464 CA ILE A 198 36.366 57.232 -1.412 1.00 40.28 C ATOM 1465 C ILE A 198 37.585 57.892 -0.774 1.00 42.99 C ATOM 1466 O ILE A 198 37.648 59.115 -0.659 1.00 46.48 O ATOM 1467 CB ILE A 198 36.118 57.858 -2.798 1.00 39.70 C ATOM 1468 CG1 ILE A 198 34.853 57.275 -3.430 1.00 35.81 C ATOM 1469 CG2 ILE A 198 37.316 57.637 -3.709 1.00 41.28 C ATOM 1470 CD1 ILE A 198 34.443 57.964 -4.712 1.00 38.91 C ATOM 1471 H ILE A 198 34.786 58.288 -0.366 1.00 0.00 H ATOM 1472 N ASP A 199 38.549 57.075 -0.356 1.00 43.37 N ATOM 1473 CA ASP A 199 39.788 57.583 0.226 1.00 47.14 C ATOM 1474 C ASP A 199 40.535 58.463 -0.769 1.00 49.79 C ATOM 1475 O ASP A 199 40.499 58.218 -1.974 1.00 50.42 O ATOM 1476 CB ASP A 199 40.690 56.433 0.679 1.00 50.85 C ATOM 1477 CG ASP A 199 40.209 55.780 1.960 1.00 60.98 C ATOM 1478 OD1 ASP A 199 39.368 56.382 2.661 1.00 63.72 O ATOM 1479 OD2 ASP A 199 40.681 54.666 2.267 1.00 73.38 O ATOM 1480 H ASP A 199 38.416 56.047 -0.446 1.00 0.00 H ATOM 1481 N GLY A 200 41.211 59.489 -0.263 1.00 51.29 N ATOM 1482 CA GLY A 200 41.943 60.408 -1.115 1.00 49.68 C ATOM 1483 C GLY A 200 41.094 61.577 -1.579 1.00 49.50 C ATOM 1484 O GLY A 200 41.615 62.582 -2.063 1.00 54.23 O ATOM 1485 H GLY A 200 41.216 59.637 0.766 1.00 0.00 H ATOM 1486 N THR A 201 39.779 61.440 -1.438 1.00 47.24 N ATOM 1487 CA THR A 201 38.853 62.504 -1.804 1.00 49.21 C ATOM 1488 C THR A 201 37.991 62.894 -0.610 1.00 48.42 C ATOM 1489 O THR A 201 38.150 62.355 0.485 1.00 49.97 O ATOM 1490 CB THR A 201 37.929 62.090 -2.970 1.00 46.67 C ATOM 1491 OG1 THR A 201 36.820 61.336 -2.462 1.00 44.49 O ATOM 1492 CG2 THR A 201 38.685 61.259 -3.995 1.00 45.31 C ATOM 1493 HG1 THR A 201 37.156 60.525 -2.004 1.00 0.00 H ATOM 1494 H THR A 201 39.401 60.549 -1.056 1.00 0.00 H ATOM 1495 N ASP A 202 37.081 63.837 -0.829 1.00 48.94 N ATOM 1496 CA ASP A 202 36.100 64.209 0.182 1.00 48.44 C ATOM 1497 C ASP A 202 34.714 63.793 -0.291 1.00 45.75 C ATOM 1498 O ASP A 202 33.720 64.467 -0.022 1.00 46.41 O ATOM 1499 CB ASP A 202 36.151 65.712 0.466 1.00 50.51 C ATOM 1500 CG ASP A 202 35.986 66.550 -0.787 1.00 57.20 C ATOM 1501 OD1 ASP A 202 36.290 66.042 -1.887 1.00 64.07 O ATOM 1502 OD2 ASP A 202 35.560 67.718 -0.670 1.00 62.69 O ATOM 1503 H ASP A 202 37.069 64.323 -1.748 1.00 0.00 H ATOM 1504 N ILE A 203 34.665 62.669 -0.998 1.00 43.35 N ATOM 1505 CA ILE A 203 33.430 62.181 -1.598 1.00 40.33 C ATOM 1506 C ILE A 203 32.882 60.950 -0.882 1.00 37.57 C ATOM 1507 O ILE A 203 33.589 59.959 -0.697 1.00 37.91 O ATOM 1508 CB ILE A 203 33.635 61.831 -3.087 1.00 42.79 C ATOM 1509 CG1 ILE A 203 34.097 63.060 -3.874 1.00 45.31 C ATOM 1510 CG2 ILE A 203 32.360 61.258 -3.681 1.00 38.85 C ATOM 1511 CD1 ILE A 203 34.506 62.750 -5.300 1.00 41.07 C ATOM 1512 H ILE A 203 35.538 62.119 -1.128 1.00 0.00 H ATOM 1513 N ALA A 204 31.618 61.026 -0.479 1.00 37.39 N ATOM 1514 CA ALA A 204 30.914 59.879 0.081 1.00 35.47 C ATOM 1515 C ALA A 204 29.621 59.653 -0.694 1.00 36.68 C ATOM 1516 O ALA A 204 28.922 60.607 -1.037 1.00 35.29 O ATOM 1517 CB ALA A 204 30.626 60.088 1.557 1.00 33.60 C ATOM 1518 H ALA A 204 31.115 61.932 -0.566 1.00 0.00 H ATOM 1519 N PHE A 205 29.311 58.393 -0.980 1.00 36.20 N ATOM 1520 CA PHE A 205 28.109 58.063 -1.736 1.00 35.53 C ATOM 1521 C PHE A 205 27.012 57.551 -0.809 1.00 36.75 C ATOM 1522 O PHE A 205 27.121 56.462 -0.246 1.00 38.44 O ATOM 1523 CB PHE A 205 28.422 57.026 -2.818 1.00 36.16 C ATOM 1524 CG PHE A 205 27.264 56.734 -3.730 1.00 38.17 C ATOM 1525 CD1 PHE A 205 26.808 57.692 -4.619 1.00 36.95 C ATOM 1526 CD2 PHE A 205 26.637 55.500 -3.704 1.00 40.39 C ATOM 1527 CE1 PHE A 205 25.744 57.429 -5.461 1.00 40.71 C ATOM 1528 CE2 PHE A 205 25.574 55.229 -4.546 1.00 42.10 C ATOM 1529 CZ PHE A 205 25.127 56.196 -5.425 1.00 42.45 C ATOM 1530 H PHE A 205 29.938 57.628 -0.658 1.00 0.00 H ATOM 1531 N GLY A 206 25.958 58.345 -0.653 1.00 34.10 N ATOM 1532 CA GLY A 206 24.873 58.005 0.250 1.00 37.03 C ATOM 1533 C GLY A 206 23.834 57.126 -0.410 1.00 39.32 C ATOM 1534 O GLY A 206 23.007 56.502 0.261 1.00 37.12 O ATOM 1535 H GLY A 206 25.909 59.233 -1.192 1.00 0.00 H ATOM 1536 N GLY A 207 23.891 57.074 -1.735 1.00 40.65 N ATOM 1537 CA GLY A 207 22.939 56.312 -2.509 1.00 40.93 C ATOM 1538 C GLY A 207 21.564 56.899 -2.315 1.00 41.42 C ATOM 1539 O GLY A 207 21.373 58.116 -2.349 1.00 45.20 O ATOM 1540 H GLY A 207 24.642 57.596 -2.230 1.00 0.00 H ATOM 1541 N CYS A 208 20.591 56.034 -2.093 1.00 38.04 N ATOM 1542 CA CYS A 208 19.237 56.522 -1.993 1.00 41.68 C ATOM 1543 C CYS A 208 18.842 56.677 -0.526 1.00 40.68 C ATOM 1544 O CYS A 208 17.678 56.915 -0.219 1.00 39.07 O ATOM 1545 CB CYS A 208 18.269 55.581 -2.692 1.00 44.08 C ATOM 1546 SG CYS A 208 18.270 55.323 -4.476 1.00 51.38 S ATOM 1547 H CYS A 208 20.797 55.020 -1.992 1.00 0.00 H ATOM 1548 N LEU A 209 19.807 56.507 0.375 1.00 39.71 N ATOM 1549 CA LEU A 209 19.597 56.802 1.788 1.00 39.19 C ATOM 1550 C LEU A 209 19.462 58.305 1.984 1.00 38.72 C ATOM 1551 O LEU A 209 18.531 58.783 2.632 1.00 36.40 O ATOM 1552 CB LEU A 209 20.750 56.264 2.637 1.00 35.85 C ATOM 1553 CG LEU A 209 20.665 56.563 4.134 1.00 34.75 C ATOM 1554 CD1 LEU A 209 19.477 55.851 4.748 1.00 35.33 C ATOM 1555 CD2 LEU A 209 21.955 56.175 4.837 1.00 34.02 C ATOM 1556 H LEU A 209 20.735 56.155 0.063 1.00 0.00 H ATOM 1557 N ILE A 210 20.400 59.046 1.403 1.00 38.46 N ATOM 1558 CA ILE A 210 20.449 60.494 1.561 1.00 38.26 C ATOM 1559 C ILE A 210 19.737 61.225 0.428 1.00 40.00 C ATOM 1560 O ILE A 210 19.939 60.921 -0.748 1.00 44.11 O ATOM 1561 CB ILE A 210 21.905 61.000 1.635 1.00 37.30 C ATOM 1562 CG1 ILE A 210 22.687 60.232 2.702 1.00 35.80 C ATOM 1563 CG2 ILE A 210 21.943 62.497 1.916 1.00 37.38 C ATOM 1564 CD1 ILE A 210 22.090 60.340 4.088 1.00 35.61 C ATOM 1565 H ILE A 210 21.121 58.578 0.818 1.00 0.00 H ATOM 1566 N LYS A 211 18.898 62.188 0.795 1.00 39.36 N ATOM 1567 CA LYS A 211 18.267 63.074 -0.174 1.00 39.83 C ATOM 1568 C LYS A 211 18.906 64.457 -0.073 1.00 41.65 C ATOM 1569 O LYS A 211 19.549 64.772 0.928 1.00 41.15 O ATOM 1570 CB LYS A 211 16.758 63.152 0.064 1.00 42.07 C ATOM 1571 CG LYS A 211 16.081 61.797 0.210 1.00 43.32 C ATOM 1572 CD LYS A 211 16.351 60.904 -0.991 1.00 46.40 C ATOM 1573 CE LYS A 211 15.743 59.524 -0.797 1.00 44.32 C ATOM 1574 NZ LYS A 211 16.029 58.626 -1.950 1.00 49.50 N ATOM 1575 HZ1 LYS A 211 15.631 59.040 -2.817 1.00 0.00 H ATOM 1576 HZ2 LYS A 211 17.058 58.518 -2.057 1.00 0.00 H ATOM 1577 HZ3 LYS A 211 15.597 57.695 -1.779 1.00 0.00 H ATOM 1578 H LYS A 211 18.685 62.313 1.805 1.00 0.00 H ATOM 1579 N ASP A 212 18.735 65.280 -1.104 1.00 44.35 N ATOM 1580 CA ASP A 212 19.370 66.595 -1.129 1.00 46.25 C ATOM 1581 C ASP A 212 18.747 67.543 -0.106 1.00 47.16 C ATOM 1582 O ASP A 212 17.689 67.263 0.455 1.00 45.84 O ATOM 1583 CB ASP A 212 19.298 67.206 -2.531 1.00 45.14 C ATOM 1584 CG ASP A 212 17.877 67.465 -2.984 1.00 48.49 C ATOM 1585 OD1 ASP A 212 17.255 66.541 -3.549 1.00 53.20 O ATOM 1586 OD2 ASP A 212 17.385 68.595 -2.783 1.00 49.05 O ATOM 1587 H ASP A 212 18.141 64.983 -1.904 1.00 0.00 H ATOM 1588 N SER A 213 19.413 68.670 0.124 1.00 48.34 N ATOM 1589 CA SER A 213 19.029 69.600 1.181 1.00 47.51 C ATOM 1590 C SER A 213 17.754 70.388 0.880 1.00 49.88 C ATOM 1591 O SER A 213 17.269 71.133 1.731 1.00 51.30 O ATOM 1592 CB SER A 213 20.176 70.575 1.453 1.00 47.94 C ATOM 1593 OG SER A 213 20.644 71.157 0.249 1.00 46.71 O ATOM 1594 HG SER A 213 20.969 70.444 -0.356 1.00 0.00 H ATOM 1595 H SER A 213 20.236 68.897 -0.470 1.00 0.00 H ATOM 1596 N LYS A 214 17.215 70.228 -0.325 1.00 53.66 N ATOM 1597 CA LYS A 214 16.007 70.947 -0.716 1.00 53.82 C ATOM 1598 C LYS A 214 14.829 69.997 -0.905 1.00 53.90 C ATOM 1599 O LYS A 214 13.723 70.425 -1.232 1.00 58.85 O ATOM 1600 CB LYS A 214 16.249 71.746 -1.998 1.00 55.50 C ATOM 1601 CG LYS A 214 17.467 72.656 -1.941 1.00 54.28 C ATOM 1602 CD LYS A 214 17.268 73.815 -0.975 1.00 57.31 C ATOM 1603 CE LYS A 214 16.506 74.956 -1.630 1.00 59.90 C ATOM 1604 NZ LYS A 214 16.431 76.155 -0.748 1.00 61.34 N ATOM 1605 HZ1 LYS A 214 15.944 75.904 0.136 1.00 0.00 H ATOM 1606 HZ2 LYS A 214 17.393 76.487 -0.533 1.00 0.00 H ATOM 1607 HZ3 LYS A 214 15.903 76.908 -1.233 1.00 0.00 H ATOM 1608 H LYS A 214 17.663 69.578 -1.002 1.00 0.00 H ATOM 1609 N ALA A 215 15.072 68.707 -0.696 1.00 53.42 N ATOM 1610 CA ALA A 215 14.017 67.705 -0.792 1.00 54.76 C ATOM 1611 C ALA A 215 12.928 67.942 0.255 1.00 57.88 C ATOM 1612 O ALA A 215 13.216 68.254 1.412 1.00 55.52 O ATOM 1613 CB ALA A 215 14.600 66.310 -0.644 1.00 48.36 C ATOM 1614 H ALA A 215 16.038 68.405 -0.458 1.00 0.00 H ATOM 1615 N LYS A 216 11.675 67.789 -0.162 1.00 57.72 N ATOM 1616 CA LYS A 216 10.543 68.026 0.725 1.00 62.35 C ATOM 1617 C LYS A 216 9.938 66.717 1.237 1.00 60.43 C ATOM 1618 O LYS A 216 9.046 66.724 2.086 1.00 64.89 O ATOM 1619 CB LYS A 216 9.477 68.858 0.018 1.00 62.34 C ATOM 1620 CG LYS A 216 9.564 70.346 0.323 1.00 66.25 C ATOM 1621 CD LYS A 216 9.621 70.591 1.822 1.00 70.01 C ATOM 1622 CE LYS A 216 8.592 71.618 2.263 1.00 72.89 C ATOM 1623 NZ LYS A 216 8.580 71.797 3.738 1.00 63.73 N ATOM 1624 HZ1 LYS A 216 8.351 70.891 4.194 1.00 0.00 H ATOM 1625 HZ2 LYS A 216 9.517 72.119 4.055 1.00 0.00 H ATOM 1626 HZ3 LYS A 216 7.864 72.506 3.994 1.00 0.00 H ATOM 1627 H LYS A 216 11.498 67.493 -1.143 1.00 0.00 H ATOM 1628 N SER A 217 10.432 65.594 0.725 1.00 56.98 N ATOM 1629 CA SER A 217 10.019 64.283 1.217 1.00 59.43 C ATOM 1630 C SER A 217 11.206 63.332 1.190 1.00 60.90 C ATOM 1631 O SER A 217 12.343 63.757 0.990 1.00 62.08 O ATOM 1632 CB SER A 217 8.866 63.723 0.385 1.00 56.41 C ATOM 1633 OG SER A 217 9.317 63.286 -0.883 1.00 59.72 O ATOM 1634 HG SER A 217 8.551 62.929 -1.399 1.00 0.00 H ATOM 1635 H SER A 217 11.129 65.651 -0.044 1.00 0.00 H ATOM 1636 N LEU A 218 10.942 62.047 1.393 1.00 57.73 N ATOM 1637 CA LEU A 218 12.000 61.044 1.378 1.00 55.88 C ATOM 1638 C LEU A 218 11.827 60.071 0.215 1.00 58.16 C ATOM 1639 O LEU A 218 12.600 59.126 0.062 1.00 63.87 O ATOM 1640 CB LEU A 218 12.041 60.284 2.706 1.00 52.50 C ATOM 1641 CG LEU A 218 12.695 61.030 3.873 1.00 51.32 C ATOM 1642 CD1 LEU A 218 12.654 60.199 5.148 1.00 48.63 C ATOM 1643 CD2 LEU A 218 14.125 61.409 3.524 1.00 47.99 C ATOM 1644 H LEU A 218 9.961 61.750 1.566 1.00 0.00 H ATOM 1645 N GLY A 219 10.804 60.309 -0.600 1.00 60.84 N ATOM 1646 CA GLY A 219 10.601 59.544 -1.816 1.00 60.96 C ATOM 1647 C GLY A 219 9.948 58.189 -1.618 1.00 66.70 C ATOM 1648 O GLY A 219 8.998 58.050 -0.848 1.00 66.21 O ATOM 1649 H GLY A 219 10.131 61.064 -0.359 1.00 0.00 H ATOM 1650 N ASN A 220 10.461 57.189 -2.330 1.00 72.75 N ATOM 1651 CA ASN A 220 9.920 55.836 -2.274 1.00 70.33 C ATOM 1652 C ASN A 220 10.112 55.210 -0.899 1.00 70.40 C ATOM 1653 O ASN A 220 11.201 54.742 -0.566 1.00 67.22 O ATOM 1654 CB ASN A 220 10.571 54.960 -3.346 1.00 71.32 C ATOM 1655 CG ASN A 220 9.962 53.574 -3.419 1.00 69.06 C ATOM 1656 OD1 ASN A 220 8.795 53.377 -3.080 1.00 74.46 O ATOM 1657 ND2 ASN A 220 10.752 52.603 -3.865 1.00 62.24 N ATOM 1658 HD22 ASN A 220 11.732 52.815 -4.141 1.00 0.00 H ATOM 1659 HD21 ASN A 220 10.390 51.631 -3.939 1.00 0.00 H ATOM 1660 H ASN A 220 11.276 57.379 -2.948 1.00 0.00 H ATOM 1661 N LEU A 221 9.045 55.203 -0.106 1.00 68.73 N ATOM 1662 CA LEU A 221 9.105 54.691 1.258 1.00 66.83 C ATOM 1663 C LEU A 221 8.502 53.294 1.370 1.00 67.57 C ATOM 1664 O LEU A 221 8.075 52.878 2.447 1.00 64.90 O ATOM 1665 CB LEU A 221 8.386 55.648 2.212 1.00 66.98 C ATOM 1666 CG LEU A 221 8.950 57.069 2.256 1.00 66.77 C ATOM 1667 CD1 LEU A 221 8.096 57.968 3.138 1.00 65.49 C ATOM 1668 CD2 LEU A 221 10.395 57.052 2.734 1.00 62.74 C ATOM 1669 H LEU A 221 8.143 55.573 -0.468 1.00 0.00 H ATOM 1670 N GLY A 222 8.475 52.575 0.251 1.00 64.81 N ATOM 1671 CA GLY A 222 7.909 51.239 0.210 1.00 60.15 C ATOM 1672 C GLY A 222 8.673 50.236 1.053 1.00 60.59 C ATOM 1673 O GLY A 222 8.089 49.529 1.873 1.00 62.57 O ATOM 1674 H GLY A 222 8.871 52.982 -0.620 1.00 0.00 H ATOM 1675 N ASP A 223 9.986 50.176 0.851 1.00 59.54 N ATOM 1676 CA ASP A 223 10.834 49.247 1.589 1.00 56.59 C ATOM 1677 C ASP A 223 11.553 49.948 2.740 1.00 51.89 C ATOM 1678 O ASP A 223 12.498 49.406 3.313 1.00 48.86 O ATOM 1679 CB ASP A 223 11.855 48.596 0.651 1.00 52.88 C ATOM 1680 CG ASP A 223 11.202 47.759 -0.434 1.00 56.98 C ATOM 1681 OD1 ASP A 223 10.185 47.094 -0.145 1.00 67.52 O ATOM 1682 OD2 ASP A 223 11.706 47.765 -1.578 1.00 52.44 O ATOM 1683 H ASP A 223 10.420 50.808 0.148 1.00 0.00 H ATOM 1684 N ALA A 224 11.090 51.147 3.084 1.00 51.03 N ATOM 1685 CA ALA A 224 11.784 51.987 4.058 1.00 47.30 C ATOM 1686 C ALA A 224 11.533 51.602 5.503 1.00 45.60 C ATOM 1687 O ALA A 224 10.438 51.184 5.871 1.00 48.90 O ATOM 1688 CB ALA A 224 11.416 53.451 3.839 1.00 51.43 C ATOM 1689 H ALA A 224 10.212 51.495 2.649 1.00 0.00 H ATOM 1690 N ASP A 225 12.575 51.745 6.315 1.00 45.14 N ATOM 1691 CA ASP A 225 12.465 51.567 7.754 1.00 42.54 C ATOM 1692 C ASP A 225 12.320 52.940 8.399 1.00 43.07 C ATOM 1693 O ASP A 225 13.310 53.621 8.665 1.00 43.74 O ATOM 1694 CB ASP A 225 13.684 50.825 8.306 1.00 42.69 C ATOM 1695 CG ASP A 225 13.474 50.320 9.724 1.00 44.95 C ATOM 1696 OD1 ASP A 225 12.782 50.996 10.513 1.00 42.27 O ATOM 1697 OD2 ASP A 225 14.003 49.236 10.050 1.00 46.58 O ATOM 1698 H ASP A 225 13.500 51.992 5.908 1.00 0.00 H ATOM 1699 N THR A 226 11.077 53.341 8.645 1.00 43.78 N ATOM 1700 CA THR A 226 10.783 54.675 9.158 1.00 44.15 C ATOM 1701 C THR A 226 11.267 54.864 10.592 1.00 43.60 C ATOM 1702 O THR A 226 11.434 55.992 11.055 1.00 47.81 O ATOM 1703 CB THR A 226 9.273 54.971 9.104 1.00 45.28 C ATOM 1704 OG1 THR A 226 8.633 54.428 10.266 1.00 49.61 O ATOM 1705 CG2 THR A 226 8.655 54.366 7.851 1.00 49.42 C ATOM 1706 HG1 THR A 226 7.663 54.621 10.227 1.00 0.00 H ATOM 1707 H THR A 226 10.290 52.684 8.467 1.00 0.00 H ATOM 1708 N GLU A 227 11.495 53.757 11.291 1.00 42.16 N ATOM 1709 CA GLU A 227 11.901 53.811 12.690 1.00 42.79 C ATOM 1710 C GLU A 227 13.403 54.041 12.846 1.00 43.24 C ATOM 1711 O GLU A 227 13.841 54.688 13.797 1.00 43.41 O ATOM 1712 CB GLU A 227 11.498 52.522 13.409 1.00 43.73 C ATOM 1713 CG GLU A 227 11.387 52.664 14.919 1.00 51.91 C ATOM 1714 CD GLU A 227 10.252 53.581 15.336 1.00 55.69 C ATOM 1715 OE1 GLU A 227 9.230 53.630 14.617 1.00 48.95 O ATOM 1716 OE2 GLU A 227 10.380 54.252 16.381 1.00 61.29 O ATOM 1717 H GLU A 227 11.381 52.832 10.830 1.00 0.00 H ATOM 1718 N HIS A 228 14.186 53.514 11.909 1.00 42.93 N ATOM 1719 CA HIS A 228 15.642 53.556 12.020 1.00 39.77 C ATOM 1720 C HIS A 228 16.318 54.450 10.979 1.00 38.50 C ATOM 1721 O HIS A 228 17.539 54.603 10.998 1.00 37.77 O ATOM 1722 CB HIS A 228 16.218 52.141 11.914 1.00 40.95 C ATOM 1723 CG HIS A 228 15.803 51.230 13.027 1.00 41.36 C ATOM 1724 ND1 HIS A 228 15.027 50.109 12.822 1.00 43.32 N ATOM 1725 CD2 HIS A 228 16.059 51.270 14.356 1.00 40.78 C ATOM 1726 CE1 HIS A 228 14.821 49.500 13.975 1.00 41.85 C ATOM 1727 NE2 HIS A 228 15.438 50.185 14.923 1.00 42.43 N ATOM 1728 H HIS A 228 13.752 53.062 11.079 1.00 0.00 H ATOM 1729 N TYR A 229 15.528 55.015 10.072 1.00 37.08 N ATOM 1730 CA TYR A 229 16.065 55.838 8.993 1.00 39.37 C ATOM 1731 C TYR A 229 16.957 56.959 9.518 1.00 38.38 C ATOM 1732 O TYR A 229 18.104 57.104 9.094 1.00 37.67 O ATOM 1733 CB TYR A 229 14.929 56.423 8.151 1.00 38.34 C ATOM 1734 CG TYR A 229 15.346 56.824 6.754 1.00 38.78 C ATOM 1735 CD1 TYR A 229 16.404 57.699 6.548 1.00 39.22 C ATOM 1736 CD2 TYR A 229 14.681 56.326 5.641 1.00 41.01 C ATOM 1737 CE1 TYR A 229 16.788 58.068 5.272 1.00 38.51 C ATOM 1738 CE2 TYR A 229 15.058 56.689 4.362 1.00 38.56 C ATOM 1739 CZ TYR A 229 16.112 57.560 4.184 1.00 40.02 C ATOM 1740 OH TYR A 229 16.491 57.924 2.912 1.00 41.19 O ATOM 1741 HH TYR A 229 17.257 58.549 2.963 1.00 0.00 H ATOM 1742 H TYR A 229 14.500 54.867 10.133 1.00 0.00 H ATOM 1743 N ALA A 230 16.420 57.751 10.439 1.00 38.89 N ATOM 1744 CA ALA A 230 17.143 58.890 11.000 1.00 37.45 C ATOM 1745 C ALA A 230 18.488 58.473 11.586 1.00 36.00 C ATOM 1746 O ALA A 230 19.509 59.118 11.339 1.00 34.71 O ATOM 1747 CB ALA A 230 16.301 59.575 12.056 1.00 39.31 C ATOM 1748 H ALA A 230 15.454 57.554 10.771 1.00 0.00 H ATOM 1749 N ALA A 231 18.481 57.390 12.358 1.00 37.02 N ATOM 1750 CA ALA A 231 19.703 56.867 12.955 1.00 33.11 C ATOM 1751 C ALA A 231 20.694 56.445 11.877 1.00 34.28 C ATOM 1752 O ALA A 231 21.896 56.678 12.000 1.00 35.53 O ATOM 1753 CB ALA A 231 19.387 55.696 13.873 1.00 31.41 C ATOM 1754 H ALA A 231 17.580 56.904 12.540 1.00 0.00 H ATOM 1755 N SER A 232 20.177 55.828 10.820 1.00 35.41 N ATOM 1756 CA SER A 232 21.005 55.378 9.708 1.00 36.39 C ATOM 1757 C SER A 232 21.657 56.556 8.991 1.00 35.48 C ATOM 1758 O SER A 232 22.831 56.499 8.628 1.00 34.85 O ATOM 1759 CB SER A 232 20.172 54.557 8.720 1.00 36.70 C ATOM 1760 OG SER A 232 19.650 53.392 9.336 1.00 38.71 O ATOM 1761 HG SER A 232 19.117 52.882 8.676 1.00 0.00 H ATOM 1762 H SER A 232 19.151 55.661 10.785 1.00 0.00 H ATOM 1763 N ALA A 233 20.887 57.622 8.794 1.00 35.26 N ATOM 1764 CA ALA A 233 21.382 58.819 8.120 1.00 35.62 C ATOM 1765 C ALA A 233 22.536 59.459 8.888 1.00 35.90 C ATOM 1766 O ALA A 233 23.558 59.819 8.304 1.00 37.42 O ATOM 1767 CB ALA A 233 20.253 59.821 7.932 1.00 37.76 C ATOM 1768 H ALA A 233 19.903 57.603 9.130 1.00 0.00 H ATOM 1769 N ARG A 234 22.363 59.597 10.199 1.00 35.02 N ATOM 1770 CA ARG A 234 23.387 60.191 11.052 1.00 34.95 C ATOM 1771 C ARG A 234 24.609 59.284 11.172 1.00 33.19 C ATOM 1772 O ARG A 234 25.739 59.761 11.275 1.00 32.57 O ATOM 1773 CB ARG A 234 22.814 60.495 12.438 1.00 33.95 C ATOM 1774 CG ARG A 234 21.948 61.745 12.483 1.00 36.09 C ATOM 1775 CD ARG A 234 21.424 62.018 13.882 1.00 35.63 C ATOM 1776 NE ARG A 234 20.034 61.600 14.034 1.00 40.25 N ATOM 1777 CZ ARG A 234 18.992 62.412 13.881 1.00 43.15 C ATOM 1778 NH1 ARG A 234 19.184 63.688 13.576 1.00 41.76 N ATOM 1779 NH2 ARG A 234 17.759 61.949 14.034 1.00 42.94 N ATOM 1780 HE ARG A 234 19.847 60.606 14.277 1.00 0.00 H ATOM 1781 HH12 ARG A 234 18.369 64.322 13.456 1.00 0.00 H ATOM 1782 HH11 ARG A 234 20.150 64.054 13.456 1.00 0.00 H ATOM 1783 HH22 ARG A 234 16.946 62.586 13.914 1.00 0.00 H ATOM 1784 HH21 ARG A 234 17.605 60.949 14.274 1.00 0.00 H ATOM 1785 H ARG A 234 21.473 59.273 10.628 1.00 0.00 H ATOM 1786 N ALA A 235 24.372 57.976 11.159 1.00 33.96 N ATOM 1787 CA ALA A 235 25.454 57.001 11.216 1.00 32.95 C ATOM 1788 C ALA A 235 26.339 57.119 9.980 1.00 33.83 C ATOM 1789 O ALA A 235 27.562 56.998 10.065 1.00 32.70 O ATOM 1790 CB ALA A 235 24.899 55.592 11.341 1.00 30.28 C ATOM 1791 H ALA A 235 23.389 57.640 11.107 1.00 0.00 H ATOM 1792 N PHE A 236 25.709 57.359 8.834 1.00 34.27 N ATOM 1793 CA PHE A 236 26.428 57.549 7.580 1.00 34.41 C ATOM 1794 C PHE A 236 27.355 58.756 7.643 1.00 37.65 C ATOM 1795 O PHE A 236 28.519 58.679 7.248 1.00 37.61 O ATOM 1796 CB PHE A 236 25.444 57.709 6.423 1.00 33.60 C ATOM 1797 CG PHE A 236 26.066 58.255 5.169 1.00 34.22 C ATOM 1798 CD1 PHE A 236 26.964 57.500 4.437 1.00 33.46 C ATOM 1799 CD2 PHE A 236 25.745 59.525 4.721 1.00 33.29 C ATOM 1800 CE1 PHE A 236 27.533 58.002 3.282 1.00 33.45 C ATOM 1801 CE2 PHE A 236 26.309 60.033 3.567 1.00 33.27 C ATOM 1802 CZ PHE A 236 27.204 59.271 2.846 1.00 32.94 C ATOM 1803 H PHE A 236 24.670 57.413 8.832 1.00 0.00 H ATOM 1804 N GLY A 237 26.829 59.871 8.140 1.00 35.26 N ATOM 1805 CA GLY A 237 27.610 61.084 8.288 1.00 34.05 C ATOM 1806 C GLY A 237 28.772 60.902 9.245 1.00 36.07 C ATOM 1807 O GLY A 237 29.846 61.468 9.044 1.00 36.45 O ATOM 1808 H GLY A 237 25.830 59.874 8.431 1.00 0.00 H ATOM 1809 N ALA A 238 28.556 60.104 10.287 1.00 35.72 N ATOM 1810 CA ALA A 238 29.588 59.851 11.287 1.00 33.48 C ATOM 1811 C ALA A 238 30.656 58.903 10.754 1.00 35.49 C ATOM 1812 O ALA A 238 31.810 58.949 11.182 1.00 35.08 O ATOM 1813 CB ALA A 238 28.968 59.290 12.558 1.00 31.25 C ATOM 1814 H ALA A 238 27.627 59.648 10.392 1.00 0.00 H ATOM 1815 N ALA A 239 30.267 58.045 9.817 1.00 36.40 N ATOM 1816 CA ALA A 239 31.196 57.090 9.223 1.00 35.74 C ATOM 1817 C ALA A 239 32.211 57.790 8.328 1.00 35.81 C ATOM 1818 O ALA A 239 33.374 57.390 8.262 1.00 35.76 O ATOM 1819 CB ALA A 239 30.439 56.037 8.438 1.00 35.60 C ATOM 1820 H ALA A 239 29.277 58.055 9.500 1.00 0.00 H ATOM 1821 N PHE A 240 31.764 58.834 7.638 1.00 36.07 N ATOM 1822 CA PHE A 240 32.638 59.612 6.767 1.00 36.32 C ATOM 1823 C PHE A 240 32.578 61.091 7.136 1.00 39.31 C ATOM 1824 O PHE A 240 32.035 61.900 6.383 1.00 40.56 O ATOM 1825 CB PHE A 240 32.247 59.419 5.301 1.00 34.05 C ATOM 1826 CG PHE A 240 32.084 57.981 4.903 1.00 34.96 C ATOM 1827 CD1 PHE A 240 33.190 57.185 4.653 1.00 34.71 C ATOM 1828 CD2 PHE A 240 30.823 57.423 4.777 1.00 34.67 C ATOM 1829 CE1 PHE A 240 33.041 55.861 4.287 1.00 34.55 C ATOM 1830 CE2 PHE A 240 30.667 56.100 4.411 1.00 31.80 C ATOM 1831 CZ PHE A 240 31.778 55.318 4.166 1.00 33.16 C ATOM 1832 H PHE A 240 30.763 59.104 7.721 1.00 0.00 H ATOM 1833 N PRO A 241 33.145 61.450 8.298 1.00 41.57 N ATOM 1834 CA PRO A 241 33.023 62.808 8.839 1.00 41.95 C ATOM 1835 C PRO A 241 33.734 63.871 8.004 1.00 42.01 C ATOM 1836 O PRO A 241 33.346 65.038 8.058 1.00 41.46 O ATOM 1837 CB PRO A 241 33.669 62.689 10.224 1.00 39.33 C ATOM 1838 CG PRO A 241 34.634 61.570 10.088 1.00 39.15 C ATOM 1839 CD PRO A 241 33.993 60.594 9.146 1.00 39.78 C ATOM 1840 N LYS A 242 34.752 63.478 7.244 1.00 41.63 N ATOM 1841 CA LYS A 242 35.539 64.440 6.478 1.00 46.01 C ATOM 1842 C LYS A 242 35.113 64.511 5.014 1.00 47.41 C ATOM 1843 O LYS A 242 35.822 65.069 4.177 1.00 51.03 O ATOM 1844 CB LYS A 242 37.031 64.106 6.570 1.00 46.30 C ATOM 1845 CG LYS A 242 37.751 64.777 7.735 1.00 50.36 C ATOM 1846 CD LYS A 242 37.283 64.238 9.080 1.00 58.44 C ATOM 1847 CE LYS A 242 38.000 64.920 10.237 1.00 57.00 C ATOM 1848 NZ LYS A 242 37.557 64.390 11.558 1.00 53.18 N ATOM 1849 HZ1 LYS A 242 36.535 64.549 11.669 1.00 0.00 H ATOM 1850 HZ2 LYS A 242 37.758 63.371 11.606 1.00 0.00 H ATOM 1851 HZ3 LYS A 242 38.070 64.882 12.317 1.00 0.00 H ATOM 1852 H LYS A 242 34.992 62.467 7.194 1.00 0.00 H ATOM 1853 N ALA A 243 33.952 63.945 4.711 1.00 43.85 N ATOM 1854 CA ALA A 243 33.397 64.028 3.367 1.00 42.70 C ATOM 1855 C ALA A 243 32.549 65.288 3.230 1.00 44.59 C ATOM 1856 O ALA A 243 31.569 65.463 3.953 1.00 46.58 O ATOM 1857 CB ALA A 243 32.575 62.794 3.052 1.00 38.71 C ATOM 1858 H ALA A 243 33.428 63.432 5.448 1.00 0.00 H ATOM 1859 N SER A 244 32.931 66.163 2.305 1.00 44.26 N ATOM 1860 CA SER A 244 32.226 67.426 2.114 1.00 41.80 C ATOM 1861 C SER A 244 31.310 67.383 0.893 1.00 41.07 C ATOM 1862 O SER A 244 30.387 68.189 0.773 1.00 41.58 O ATOM 1863 CB SER A 244 33.221 68.582 1.983 1.00 43.93 C ATOM 1864 OG SER A 244 34.161 68.334 0.955 1.00 48.29 O ATOM 1865 HG SER A 244 34.663 67.506 1.161 1.00 0.00 H ATOM 1866 H SER A 244 33.751 65.942 1.704 1.00 0.00 H ATOM 1867 N MET A 245 31.570 66.448 -0.014 1.00 41.25 N ATOM 1868 CA MET A 245 30.692 66.249 -1.161 1.00 39.65 C ATOM 1869 C MET A 245 29.933 64.934 -1.035 1.00 39.30 C ATOM 1870 O MET A 245 30.520 63.855 -1.125 1.00 38.43 O ATOM 1871 CB MET A 245 31.478 66.271 -2.472 1.00 39.81 C ATOM 1872 CG MET A 245 30.601 66.052 -3.698 1.00 41.87 C ATOM 1873 SD MET A 245 31.529 65.795 -5.219 1.00 47.33 S ATOM 1874 CE MET A 245 32.327 67.386 -5.385 1.00 47.07 C ATOM 1875 H MET A 245 32.413 65.849 0.096 1.00 0.00 H ATOM 1876 N ILE A 246 28.625 65.032 -0.824 1.00 37.70 N ATOM 1877 CA ILE A 246 27.784 63.851 -0.693 1.00 37.14 C ATOM 1878 C ILE A 246 27.078 63.547 -2.009 1.00 37.15 C ATOM 1879 O ILE A 246 26.220 64.308 -2.459 1.00 36.20 O ATOM 1880 CB ILE A 246 26.732 64.019 0.420 1.00 37.24 C ATOM 1881 CG1 ILE A 246 27.380 64.574 1.691 1.00 35.07 C ATOM 1882 CG2 ILE A 246 26.035 62.695 0.698 1.00 33.22 C ATOM 1883 CD1 ILE A 246 28.478 63.700 2.253 1.00 34.06 C ATOM 1884 H ILE A 246 28.192 65.975 -0.751 1.00 0.00 H ATOM 1885 N VAL A 247 27.452 62.433 -2.625 1.00 36.46 N ATOM 1886 CA VAL A 247 26.821 61.999 -3.861 1.00 38.59 C ATOM 1887 C VAL A 247 25.627 61.106 -3.549 1.00 38.10 C ATOM 1888 O VAL A 247 25.741 60.155 -2.778 1.00 38.62 O ATOM 1889 CB VAL A 247 27.809 61.242 -4.767 1.00 37.41 C ATOM 1890 CG1 VAL A 247 27.150 60.886 -6.088 1.00 35.77 C ATOM 1891 CG2 VAL A 247 29.054 62.078 -5.004 1.00 36.43 C ATOM 1892 H VAL A 247 28.214 61.857 -2.214 1.00 0.00 H ATOM 1893 N MET A 248 24.482 61.422 -4.145 1.00 41.54 N ATOM 1894 CA MET A 248 23.270 60.642 -3.924 1.00 45.97 C ATOM 1895 C MET A 248 22.672 60.170 -5.244 1.00 46.82 C ATOM 1896 O MET A 248 23.122 60.567 -6.318 1.00 45.01 O ATOM 1897 CB MET A 248 22.249 61.457 -3.129 1.00 45.49 C ATOM 1898 CG MET A 248 22.005 62.851 -3.676 1.00 53.88 C ATOM 1899 SD MET A 248 21.532 64.006 -2.377 1.00 46.45 S ATOM 1900 CE MET A 248 22.979 63.927 -1.325 1.00 42.09 C ATOM 1901 H MET A 248 24.450 62.243 -4.783 1.00 0.00 H ATOM 1902 N SER A 249 21.653 59.325 -5.156 1.00 46.87 N ATOM 1903 CA SER A 249 21.120 58.644 -6.329 1.00 46.79 C ATOM 1904 C SER A 249 20.379 59.545 -7.310 1.00 45.64 C ATOM 1905 O SER A 249 20.523 59.391 -8.521 1.00 46.70 O ATOM 1906 CB SER A 249 20.183 57.525 -5.898 1.00 43.49 C ATOM 1907 OG SER A 249 20.883 56.482 -5.242 1.00 44.44 O ATOM 1908 HG SER A 249 20.244 55.774 -4.976 1.00 0.00 H ATOM 1909 H SER A 249 21.224 59.144 -4.226 1.00 0.00 H ATOM 1910 N HIS A 250 19.587 60.480 -6.796 1.00 50.81 N ATOM 1911 CA HIS A 250 18.619 61.172 -7.643 1.00 52.48 C ATOM 1912 C HIS A 250 18.759 62.691 -7.678 1.00 53.53 C ATOM 1913 O HIS A 250 17.959 63.374 -8.318 1.00 61.86 O ATOM 1914 CB HIS A 250 17.209 60.798 -7.195 1.00 52.74 C ATOM 1915 CG HIS A 250 16.980 59.321 -7.129 1.00 55.60 C ATOM 1916 ND1 HIS A 250 17.021 58.513 -8.244 1.00 54.89 N ATOM 1917 CD2 HIS A 250 16.729 58.503 -6.080 1.00 56.51 C ATOM 1918 CE1 HIS A 250 16.796 57.262 -7.887 1.00 55.21 C ATOM 1919 NE2 HIS A 250 16.615 57.228 -6.579 1.00 58.24 N ATOM 1920 H HIS A 250 19.657 60.720 -5.786 1.00 0.00 H ATOM 1921 N SER A 251 19.768 63.220 -6.998 1.00 52.76 N ATOM 1922 CA SER A 251 20.056 64.647 -7.062 1.00 47.50 C ATOM 1923 C SER A 251 21.523 64.881 -7.383 1.00 47.84 C ATOM 1924 O SER A 251 22.346 63.973 -7.257 1.00 52.15 O ATOM 1925 CB SER A 251 19.691 65.337 -5.746 1.00 49.52 C ATOM 1926 OG SER A 251 18.303 65.234 -5.485 1.00 56.65 O ATOM 1927 HG SER A 251 18.095 65.688 -4.630 1.00 0.00 H ATOM 1928 H SER A 251 20.364 62.605 -6.408 1.00 0.00 H ATOM 1929 N ALA A 252 21.845 66.097 -7.809 1.00 43.40 N ATOM 1930 CA ALA A 252 23.234 66.494 -7.993 1.00 40.86 C ATOM 1931 C ALA A 252 23.944 66.437 -6.645 1.00 43.19 C ATOM 1932 O ALA A 252 23.300 66.605 -5.608 1.00 44.19 O ATOM 1933 CB ALA A 252 23.318 67.889 -8.593 1.00 36.62 C ATOM 1934 H ALA A 252 21.089 66.780 -8.016 1.00 0.00 H ATOM 1935 N PRO A 253 25.265 66.181 -6.651 1.00 42.52 N ATOM 1936 CA PRO A 253 26.035 66.114 -5.402 1.00 42.54 C ATOM 1937 C PRO A 253 25.808 67.327 -4.502 1.00 41.38 C ATOM 1938 O PRO A 253 25.750 68.457 -4.986 1.00 41.13 O ATOM 1939 CB PRO A 253 27.482 66.060 -5.892 1.00 39.29 C ATOM 1940 CG PRO A 253 27.387 65.383 -7.214 1.00 39.81 C ATOM 1941 CD PRO A 253 26.103 65.879 -7.825 1.00 40.17 C ATOM 1942 N ASP A 254 25.669 67.081 -3.204 1.00 42.46 N ATOM 1943 CA ASP A 254 25.350 68.137 -2.253 1.00 42.19 C ATOM 1944 C ASP A 254 26.397 68.203 -1.145 1.00 39.58 C ATOM 1945 O ASP A 254 27.397 67.487 -1.183 1.00 39.24 O ATOM 1946 CB ASP A 254 23.959 67.906 -1.656 1.00 41.05 C ATOM 1947 CG ASP A 254 23.248 69.199 -1.310 1.00 43.73 C ATOM 1948 OD1 ASP A 254 23.934 70.217 -1.081 1.00 44.14 O ATOM 1949 OD2 ASP A 254 22.001 69.195 -1.268 1.00 44.47 O ATOM 1950 H ASP A 254 25.791 66.108 -2.858 1.00 0.00 H ATOM 1951 N SER A 255 26.168 69.071 -0.165 1.00 40.48 N ATOM 1952 CA SER A 255 27.050 69.162 0.992 1.00 42.50 C ATOM 1953 C SER A 255 26.525 68.282 2.120 1.00 40.07 C ATOM 1954 O SER A 255 25.569 67.531 1.932 1.00 40.49 O ATOM 1955 CB SER A 255 27.182 70.613 1.461 1.00 42.39 C ATOM 1956 OG SER A 255 25.929 71.138 1.861 1.00 44.11 O ATOM 1957 HG SER A 255 26.045 72.075 2.158 1.00 0.00 H ATOM 1958 H SER A 255 25.341 69.699 -0.225 1.00 0.00 H ATOM 1959 N ARG A 256 27.145 68.381 3.293 1.00 38.66 N ATOM 1960 CA ARG A 256 26.719 67.598 4.451 1.00 35.98 C ATOM 1961 C ARG A 256 25.360 68.064 4.959 1.00 38.79 C ATOM 1962 O ARG A 256 24.741 67.408 5.797 1.00 42.81 O ATOM 1963 CB ARG A 256 27.755 67.681 5.573 1.00 33.29 C ATOM 1964 CG ARG A 256 29.104 67.085 5.211 1.00 36.73 C ATOM 1965 CD ARG A 256 30.051 67.079 6.400 1.00 35.63 C ATOM 1966 NE ARG A 256 29.666 66.089 7.401 1.00 34.97 N ATOM 1967 CZ ARG A 256 30.002 64.803 7.346 1.00 39.58 C ATOM 1968 NH1 ARG A 256 30.729 64.347 6.334 1.00 39.04 N ATOM 1969 NH2 ARG A 256 29.607 63.971 8.301 1.00 38.32 N ATOM 1970 HE ARG A 256 29.093 66.409 8.208 1.00 0.00 H ATOM 1971 HH12 ARG A 256 30.990 63.341 6.293 1.00 0.00 H ATOM 1972 HH11 ARG A 256 31.037 64.995 5.582 1.00 0.00 H ATOM 1973 HH22 ARG A 256 29.870 62.966 8.257 1.00 0.00 H ATOM 1974 HH21 ARG A 256 29.034 64.324 9.094 1.00 0.00 H ATOM 1975 H ARG A 256 27.952 69.031 3.388 1.00 0.00 H ATOM 1976 N ALA A 257 24.906 69.203 4.442 1.00 40.49 N ATOM 1977 CA ALA A 257 23.583 69.723 4.755 1.00 40.54 C ATOM 1978 C ALA A 257 22.504 68.736 4.330 1.00 39.58 C ATOM 1979 O ALA A 257 21.424 68.697 4.914 1.00 41.62 O ATOM 1980 CB ALA A 257 23.368 71.070 4.082 1.00 35.52 C ATOM 1981 H ALA A 257 25.517 69.739 3.793 1.00 0.00 H ATOM 1982 N ALA A 258 22.807 67.939 3.310 1.00 41.40 N ATOM 1983 CA ALA A 258 21.885 66.919 2.827 1.00 41.73 C ATOM 1984 C ALA A 258 21.680 65.828 3.873 1.00 40.81 C ATOM 1985 O ALA A 258 20.576 65.308 4.030 1.00 39.09 O ATOM 1986 CB ALA A 258 22.394 66.318 1.525 1.00 42.20 C ATOM 1987 H ALA A 258 23.730 68.047 2.843 1.00 0.00 H ATOM 1988 N ILE A 259 22.749 65.491 4.588 1.00 38.31 N ATOM 1989 CA ILE A 259 22.694 64.448 5.607 1.00 39.40 C ATOM 1990 C ILE A 259 21.831 64.863 6.795 1.00 42.15 C ATOM 1991 O ILE A 259 20.952 64.116 7.223 1.00 44.31 O ATOM 1992 CB ILE A 259 24.101 64.079 6.115 1.00 35.80 C ATOM 1993 CG1 ILE A 259 25.022 63.732 4.944 1.00 34.62 C ATOM 1994 CG2 ILE A 259 24.028 62.922 7.102 1.00 33.01 C ATOM 1995 CD1 ILE A 259 26.419 63.328 5.366 1.00 32.65 C ATOM 1996 H ILE A 259 23.649 65.984 4.416 1.00 0.00 H ATOM 1997 N THR A 260 22.088 66.056 7.323 1.00 42.01 N ATOM 1998 CA THR A 260 21.335 66.564 8.466 1.00 41.18 C ATOM 1999 C THR A 260 19.884 66.848 8.091 1.00 41.25 C ATOM 2000 O THR A 260 18.980 66.676 8.907 1.00 44.79 O ATOM 2001 CB THR A 260 21.969 67.849 9.040 1.00 40.24 C ATOM 2002 OG1 THR A 260 21.770 68.937 8.130 1.00 45.70 O ATOM 2003 CG2 THR A 260 23.458 67.651 9.283 1.00 38.16 C ATOM 2004 HG1 THR A 260 22.195 68.722 7.262 1.00 0.00 H ATOM 2005 H THR A 260 22.843 66.641 6.912 1.00 0.00 H ATOM 2006 N HIS A 261 19.668 67.285 6.854 1.00 40.23 N ATOM 2007 CA HIS A 261 18.319 67.554 6.368 1.00 41.45 C ATOM 2008 C HIS A 261 17.533 66.259 6.208 1.00 42.84 C ATOM 2009 O HIS A 261 16.342 66.206 6.516 1.00 43.14 O ATOM 2010 CB HIS A 261 18.361 68.310 5.039 1.00 41.43 C ATOM 2011 CG HIS A 261 17.008 68.605 4.469 1.00 44.05 C ATOM 2012 ND1 HIS A 261 16.167 69.555 5.004 1.00 43.78 N ATOM 2013 CD2 HIS A 261 16.351 68.072 3.411 1.00 47.31 C ATOM 2014 CE1 HIS A 261 15.049 69.597 4.300 1.00 45.27 C ATOM 2015 NE2 HIS A 261 15.135 68.707 3.329 1.00 47.60 N ATOM 2016 H HIS A 261 20.478 67.438 6.220 1.00 0.00 H ATOM 2017 N THR A 262 18.204 65.220 5.720 1.00 44.04 N ATOM 2018 CA THR A 262 17.579 63.913 5.547 1.00 42.80 C ATOM 2019 C THR A 262 17.164 63.334 6.893 1.00 41.79 C ATOM 2020 O THR A 262 16.015 62.928 7.076 1.00 42.67 O ATOM 2021 CB THR A 262 18.519 62.915 4.840 1.00 41.77 C ATOM 2022 OG1 THR A 262 18.909 63.438 3.564 1.00 38.93 O ATOM 2023 CG2 THR A 262 17.827 61.573 4.648 1.00 39.59 C ATOM 2024 HG1 THR A 262 19.380 64.299 3.692 1.00 0.00 H ATOM 2025 H THR A 262 19.202 65.342 5.454 1.00 0.00 H ATOM 2026 N ALA A 263 18.108 63.305 7.828 1.00 40.67 N ATOM 2027 CA ALA A 263 17.862 62.785 9.168 1.00 41.48 C ATOM 2028 C ALA A 263 16.746 63.557 9.861 1.00 42.14 C ATOM 2029 O ALA A 263 15.938 62.981 10.590 1.00 41.42 O ATOM 2030 CB ALA A 263 19.137 62.837 9.999 1.00 38.23 C ATOM 2031 H ALA A 263 19.055 63.666 7.596 1.00 0.00 H ATOM 2032 N ARG A 264 16.705 64.865 9.624 1.00 42.47 N ATOM 2033 CA ARG A 264 15.676 65.717 10.206 1.00 42.05 C ATOM 2034 C ARG A 264 14.305 65.361 9.641 1.00 43.68 C ATOM 2035 O ARG A 264 13.317 65.311 10.373 1.00 42.79 O ATOM 2036 CB ARG A 264 15.992 67.192 9.951 1.00 41.23 C ATOM 2037 CG ARG A 264 15.192 68.159 10.805 1.00 42.20 C ATOM 2038 CD ARG A 264 15.519 69.603 10.457 1.00 41.61 C ATOM 2039 NE ARG A 264 15.248 69.897 9.053 1.00 51.88 N ATOM 2040 CZ ARG A 264 14.056 70.245 8.579 1.00 49.21 C ATOM 2041 NH1 ARG A 264 13.018 70.344 9.398 1.00 45.18 N ATOM 2042 NH2 ARG A 264 13.902 70.493 7.286 1.00 49.96 N ATOM 2043 HE ARG A 264 16.038 69.830 8.380 1.00 0.00 H ATOM 2044 HH12 ARG A 264 12.086 70.616 9.026 1.00 0.00 H ATOM 2045 HH11 ARG A 264 13.136 70.149 10.413 1.00 0.00 H ATOM 2046 HH22 ARG A 264 12.969 70.765 6.916 1.00 0.00 H ATOM 2047 HH21 ARG A 264 14.714 70.415 6.641 1.00 0.00 H ATOM 2048 H ARG A 264 17.426 65.291 9.007 1.00 0.00 H ATOM 2049 N MET A 265 14.252 65.112 8.336 1.00 43.83 N ATOM 2050 CA MET A 265 13.014 64.695 7.686 1.00 43.44 C ATOM 2051 C MET A 265 12.598 63.307 8.159 1.00 45.00 C ATOM 2052 O MET A 265 11.412 63.031 8.338 1.00 45.16 O ATOM 2053 CB MET A 265 13.168 64.699 6.163 1.00 45.60 C ATOM 2054 CG MET A 265 13.013 66.067 5.518 1.00 48.30 C ATOM 2055 SD MET A 265 12.860 65.964 3.722 1.00 72.19 S ATOM 2056 CE MET A 265 14.389 65.133 3.294 1.00 52.06 C ATOM 2057 H MET A 265 15.114 65.217 7.764 1.00 0.00 H ATOM 2058 N ALA A 266 13.584 62.438 8.359 1.00 46.12 N ATOM 2059 CA ALA A 266 13.329 61.081 8.822 1.00 44.57 C ATOM 2060 C ALA A 266 12.774 61.086 10.244 1.00 45.63 C ATOM 2061 O ALA A 266 11.996 60.208 10.618 1.00 47.49 O ATOM 2062 CB ALA A 266 14.597 60.249 8.747 1.00 40.92 C ATOM 2063 H ALA A 266 14.564 62.735 8.180 1.00 0.00 H ATOM 2064 N ASP A 267 13.180 62.079 11.029 1.00 43.44 N ATOM 2065 CA ASP A 267 12.674 62.243 12.387 1.00 44.19 C ATOM 2066 C ASP A 267 11.201 62.631 12.378 1.00 48.44 C ATOM 2067 O ASP A 267 10.402 62.080 13.134 1.00 49.73 O ATOM 2068 CB ASP A 267 13.488 63.294 13.144 1.00 42.32 C ATOM 2069 CG ASP A 267 14.796 62.744 13.676 1.00 42.29 C ATOM 2070 OD1 ASP A 267 14.816 61.566 14.091 1.00 45.39 O ATOM 2071 OD2 ASP A 267 15.800 63.488 13.685 1.00 40.19 O ATOM 2072 H ASP A 267 13.878 62.758 10.664 1.00 0.00 H ATOM 2073 N LYS A 268 10.853 63.584 11.517 1.00 46.35 N ATOM 2074 CA LYS A 268 9.475 64.040 11.375 1.00 47.66 C ATOM 2075 C LYS A 268 8.548 62.886 11.013 1.00 51.63 C ATOM 2076 O LYS A 268 7.443 62.772 11.543 1.00 58.44 O ATOM 2077 CB LYS A 268 9.381 65.135 10.311 1.00 45.57 C ATOM 2078 CG LYS A 268 10.229 66.359 10.594 1.00 46.52 C ATOM 2079 CD LYS A 268 10.477 67.161 9.324 1.00 46.82 C ATOM 2080 CE LYS A 268 9.171 67.558 8.655 1.00 48.37 C ATOM 2081 NZ LYS A 268 8.328 68.402 9.545 1.00 51.31 N ATOM 2082 HZ1 LYS A 268 8.104 67.873 10.412 1.00 0.00 H ATOM 2083 HZ2 LYS A 268 8.846 69.269 9.791 1.00 0.00 H ATOM 2084 HZ3 LYS A 268 7.447 68.651 9.052 1.00 0.00 H ATOM 2085 H LYS A 268 11.589 64.019 10.925 1.00 0.00 H ATOM 2086 N LEU A 269 9.013 62.034 10.105 1.00 50.55 N ATOM 2087 CA LEU A 269 8.246 60.877 9.663 1.00 51.52 C ATOM 2088 C LEU A 269 8.043 59.880 10.799 1.00 56.79 C ATOM 2089 O LEU A 269 6.940 59.376 11.007 1.00 60.72 O ATOM 2090 CB LEU A 269 8.947 60.196 8.486 1.00 52.76 C ATOM 2091 CG LEU A 269 8.244 58.983 7.876 1.00 56.36 C ATOM 2092 CD1 LEU A 269 6.951 59.403 7.197 1.00 57.63 C ATOM 2093 CD2 LEU A 269 9.162 58.261 6.900 1.00 55.72 C ATOM 2094 H LEU A 269 9.955 62.199 9.697 1.00 0.00 H ATOM 2095 N ARG A 270 9.117 59.605 11.531 1.00 53.61 N ATOM 2096 CA ARG A 270 9.084 58.650 12.634 1.00 55.66 C ATOM 2097 C ARG A 270 8.176 59.118 13.773 1.00 59.21 C ATOM 2098 O ARG A 270 7.538 58.305 14.445 1.00 57.85 O ATOM 2099 CB ARG A 270 10.502 58.406 13.155 1.00 50.03 C ATOM 2100 CG ARG A 270 10.584 57.503 14.373 1.00 49.33 C ATOM 2101 CD ARG A 270 12.028 57.250 14.770 1.00 51.38 C ATOM 2102 NE ARG A 270 12.821 58.476 14.754 1.00 52.47 N ATOM 2103 CZ ARG A 270 12.882 59.344 15.759 1.00 55.42 C ATOM 2104 NH1 ARG A 270 12.193 59.125 16.871 1.00 55.78 N ATOM 2105 NH2 ARG A 270 13.630 60.433 15.651 1.00 51.46 N ATOM 2106 HE ARG A 270 13.375 58.684 13.899 1.00 0.00 H ATOM 2107 HH12 ARG A 270 12.242 59.806 17.656 1.00 0.00 H ATOM 2108 HH11 ARG A 270 11.603 58.273 16.958 1.00 0.00 H ATOM 2109 HH22 ARG A 270 13.677 61.112 16.438 1.00 0.00 H ATOM 2110 HH21 ARG A 270 14.170 60.609 14.780 1.00 0.00 H ATOM 2111 H ARG A 270 10.012 60.087 11.310 1.00 0.00 H ATOM 2112 N LEU A 271 8.111 60.432 13.976 1.00 58.90 N ATOM 2113 CA LEU A 271 7.294 61.006 15.040 1.00 58.90 C ATOM 2114 C LEU A 271 5.840 61.178 14.611 1.00 66.40 C ATOM 2115 O LEU A 271 5.047 61.796 15.323 1.00 72.52 O ATOM 2116 CB LEU A 271 7.866 62.355 15.484 1.00 54.57 C ATOM 2117 CG LEU A 271 9.265 62.327 16.103 1.00 53.34 C ATOM 2118 CD1 LEU A 271 9.759 63.739 16.362 1.00 46.39 C ATOM 2119 CD2 LEU A 271 9.269 61.508 17.383 1.00 54.83 C ATOM 2120 H LEU A 271 8.657 61.067 13.359 1.00 0.00 H ATOM 2121 N GLU A 272 5.506 60.624 13.448 1.00 69.69 N ATOM 2122 CA GLU A 272 4.157 60.689 12.894 1.00 72.20 C ATOM 2123 C GLU A 272 3.713 62.139 12.711 1.00 76.35 C ATOM 2124 O GLU A 272 3.345 62.554 11.612 1.00 81.40 O ATOM 2125 CB GLU A 272 3.158 59.934 13.784 1.00 73.87 C ATOM 2126 CG GLU A 272 3.527 58.480 14.094 1.00 72.51 C ATOM 2127 CD GLU A 272 4.159 57.742 12.922 1.00 78.32 C ATOM 2128 OE1 GLU A 272 3.632 57.818 11.791 1.00 82.01 O ATOM 2129 OE2 GLU A 272 5.197 57.082 13.140 1.00 74.68 O ATOM 2130 H GLU A 272 6.240 60.122 12.909 1.00 0.00 H TER 2131 GLU A 272 HETATM 2132 ZN ZN A 1 15.946 52.170 -4.009 1.00 46.26 ZN HETATM 2133 ZN ZN A 2 15.764 54.517 -6.022 1.00101.58 ZN HETATM 2134 O HOH 3 32.434 66.477 -17.157 1.00 47.61 O HETATM 2135 O HOH 4 33.382 63.851 -17.917 1.00 44.40 O HETATM 2136 O HOH 5 18.427 62.772 -20.932 1.00 53.97 O HETATM 2137 O HOH 6 20.044 57.548 -19.927 1.00 47.24 O HETATM 2138 O HOH 7 26.650 62.347 -13.954 1.00 37.80 O HETATM 2139 O HOH 8 40.517 61.555 -7.190 1.00 42.70 O HETATM 2140 O HOH 9 43.111 60.870 -5.871 1.00 55.50 O HETATM 2141 O HOH 10 24.872 63.127 -6.691 1.00 41.23 O HETATM 2142 O HOH 11 37.115 43.322 -17.513 1.00 45.33 O HETATM 2143 O HOH 12 43.465 56.753 -17.685 1.00 38.42 O HETATM 2144 O HOH 13 17.972 51.454 -22.199 1.00 42.69 O HETATM 2145 O HOH 14 35.386 48.943 -20.253 1.00 36.38 O HETATM 2146 O HOH 15 37.547 49.405 -20.335 1.00 41.63 O HETATM 2147 O HOH 16 36.866 44.986 -18.360 1.00 43.79 O HETATM 2148 O HOH 17 24.242 46.046 -1.476 1.00 30.98 O HETATM 2149 O HOH 18 31.661 54.637 12.850 1.00 43.44 O HETATM 2150 O HOH 19 37.529 58.724 8.242 1.00 52.01 O HETATM 2151 O HOH 20 19.396 42.880 -12.809 1.00 39.79 O HETATM 2152 O HOH 21 23.878 37.669 -14.949 1.00 35.53 O HETATM 2153 O HOH 22 31.544 38.081 -14.023 1.00 41.92 O HETATM 2154 O HOH 23 21.475 36.956 3.797 1.00 32.72 O HETATM 2155 O HOH 24 20.404 35.137 -4.525 1.00 33.85 O HETATM 2156 O HOH 25 12.627 38.039 2.610 1.00 36.66 O HETATM 2157 O HOH 26 25.089 35.229 -8.265 1.00 35.77 O HETATM 2158 O HOH 27 34.269 33.593 -4.118 1.00 31.11 O HETATM 2159 O HOH 28 31.266 33.399 -3.778 1.00 35.97 O HETATM 2160 O HOH 29 30.310 35.307 -1.807 1.00 29.87 O HETATM 2161 O HOH 30 25.841 45.053 11.005 1.00 34.01 O HETATM 2162 O HOH 31 37.046 40.268 7.732 1.00 41.64 O HETATM 2163 O HOH 32 43.188 40.538 -1.937 1.00 47.21 O HETATM 2164 O HOH 33 41.124 63.929 -4.829 1.00 49.15 O HETATM 2165 O HOH 34 37.977 65.427 -4.031 1.00 49.53 O HETATM 2166 O HOH 35 18.098 78.520 -1.736 1.00 52.77 O HETATM 2167 O HOH 36 19.265 77.301 0.362 1.00 53.94 O HETATM 2168 O HOH 37 13.677 46.395 12.270 1.00 43.30 O HETATM 2169 O HOH 38 15.850 56.782 13.869 1.00 37.13 O HETATM 2170 O HOH 39 28.985 55.619 12.601 1.00 39.12 O HETATM 2171 O HOH 40 36.016 60.601 6.398 1.00 47.62 O HETATM 2172 O HOH 41 26.079 69.358 -7.838 1.00 46.16 O HETATM 2173 O HOH 42 16.275 58.550 15.374 1.00 43.77 O HETATM 2174 O HOH 43 16.207 66.029 14.143 1.00 39.96 O HETATM 2175 O HOH 44 7.193 56.335 16.612 1.00 57.16 O HETATM 2176 O HOH 45 5.405 58.828 17.340 1.00 64.43 O HETATM 2177 C01 WJZ A 46 12.274 57.286 -5.589 1.00 -0.04 C HETATM 2178 C02 WJZ A 46 13.071 56.008 -5.718 1.00 0.09 C HETATM 2179 S01 WJZ A 46 14.502 56.110 -4.678 1.00 -0.15 S HETATM 2180 H5 WJZ A 46 15.068 56.894 -4.963 1.00 0.10 H HETATM 2181 C03 WJZ A 46 13.494 55.828 -7.159 1.00 0.19 C HETATM 2182 N01 WJZ A 46 13.534 54.535 -7.745 1.00 -0.27 N HETATM 2183 C04 WJZ A 46 13.178 53.380 -6.994 1.00 0.08 C HETATM 2184 C05 WJZ A 46 13.542 52.146 -7.790 1.00 0.06 C HETATM 2185 O01 WJZ A 46 12.873 51.088 -7.661 1.00 -0.57 O HETATM 2186 O02 WJZ A 46 14.519 52.180 -8.583 1.00 -0.57 O HETATM 2187 H7 WJZ A 46 12.096 53.386 -6.798 1.00 0.07 H HETATM 2188 H8 WJZ A 46 13.724 53.378 -6.039 1.00 0.07 H HETATM 2189 H4 WJZ A 46 13.816 54.435 -8.699 1.00 0.19 H HETATM 2190 O03 WJZ A 46 13.800 56.799 -7.821 1.00 -0.40 O HETATM 2191 H6 WJZ A 46 12.452 55.153 -5.408 1.00 0.06 H HETATM 2192 H1 WJZ A 46 11.384 57.229 -6.232 1.00 0.03 H HETATM 2193 H2 WJZ A 46 12.896 58.139 -5.898 1.00 0.03 H HETATM 2194 H3 WJZ A 46 11.962 57.420 -4.543 1.00 0.03 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 799 797 798 2132 CONECT 813 812 815 2132 CONECT 837 835 2133 CONECT 1393 1391 1392 2132 CONECT 1546 1545 2133 CONECT 1919 1917 1918 2133 CONECT 2132 799 813 1393 CONECT 2133 837 1546 1919 CONECT 2177 2178 2192 2193 2194 CONECT 2178 2177 2179 2181 2191 CONECT 2179 2178 2180 CONECT 2180 2179 CONECT 2181 2178 2182 2190 CONECT 2182 2181 2183 2189 CONECT 2183 2182 2184 2187 2188 CONECT 2184 2183 2185 2186 CONECT 2185 2184 CONECT 2186 2184 CONECT 2187 2183 CONECT 2188 2183 CONECT 2189 2182 CONECT 2190 2181 CONECT 2191 2178 CONECT 2192 2177 CONECT 2193 2177 CONECT 2194 2177 MASTER 0 0 0 0 0 0 0 0 2193 1 30 19 END
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RCSB PDB
PDBbind
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6d1g
RCSB PDB
PDBbind
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RCSB PDB
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5a5z
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
BETA-LACTAMASE NDM-1
Ligand Name
WJZ
EC.Number
E.C.3.5.2.6
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
IC50=84uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 3626
Ligand Properties
Formula
C
5
H
9
NO
3
S
Molecular Weight
163.195
Exact Mass
163.030
No. of atoms
19
No. of bonds
18
Polar Surface Area
105.2
LOGP Value
0.74 (
Computed with XLOGP3
)
-0.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 0
Canonical SMILES
C[C@@H](C(=O)NCC(=O)O)S
InChI String
InChI=1S/C5H9NO3S/c1-3(10)5(9)6-2-4(7)8/h3,10H,2H2,1H3,(H,6,9)(H,7,8)/t3-/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):
C7C422
Entrez Gene ID
NCBI Entrez Gene ID:
61419528
ASD
Information of known allosteric effects of PDB entries
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