Browse entries in the PDBbind-CN Database
HEADER 2MC1_COMPLEX COMPND 2MC1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 107 GLY HIS MET GLN ASP LEU SER VAL HIS LEU TRP TYR ALA SEQRES 2 A 107 GLY PRO MET GLU ARG ALA GLY ALA GLU SER ILE LEU ALA SEQRES 3 A 107 ASN ARG SER ASP GLY THR PHE LEU VAL ARG GLN ARG VAL SEQRES 4 A 107 LYS ASP ALA ALA GLU PHE ALA ILE SER ILE LYS TYR ASN SEQRES 5 A 107 VAL GLU VAL LYS HIS ILE LYS ILE MET THR ALA GLU GLY SEQRES 6 A 107 LEU TYR ARG ILE THR GLU LYS LYS ALA PHE ARG GLY LEU SEQRES 7 A 107 THR GLU LEU VAL GLU PHE TYR GLN GLN ASN SER LEU LYS SEQRES 8 A 107 ASP CYS PHE LYS SER LEU ASP THR THR LEU GLN PHE PRO SEQRES 9 A 107 PHE LYS GLU HET ASP A 108 196 ATOM 1 N GLY A 661 5.639 -14.224 -10.096 1.00 1.31 N ATOM 2 CA GLY A 661 6.982 -14.798 -10.414 1.00 1.48 C ATOM 3 C GLY A 661 7.038 -16.244 -9.934 1.00 1.63 C ATOM 4 O GLY A 661 6.624 -17.155 -10.645 1.00 1.99 O ATOM 5 HA3 GLY A 661 7.755 -14.217 -9.911 1.00 0.00 H ATOM 6 HA2 GLY A 661 7.147 -14.765 -11.491 1.00 0.00 H ATOM 7 HN3 GLY A 661 5.484 -14.257 -9.068 1.00 0.00 H ATOM 8 HN2 GLY A 661 4.903 -14.780 -10.577 1.00 0.00 H ATOM 9 HN1 GLY A 661 5.599 -13.237 -10.423 1.00 0.00 H ATOM 10 N HIS A 662 7.530 -16.441 -8.718 1.00 1.49 N ATOM 11 CA HIS A 662 7.618 -17.772 -8.136 1.00 1.81 C ATOM 12 C HIS A 662 6.235 -18.221 -7.658 1.00 1.67 C ATOM 13 O HIS A 662 5.975 -19.419 -7.508 1.00 1.93 O ATOM 14 CB HIS A 662 8.610 -17.736 -6.966 1.00 1.97 C ATOM 15 CG HIS A 662 8.846 -19.121 -6.426 1.00 2.45 C ATOM 16 ND1 HIS A 662 7.910 -20.132 -6.543 1.00 2.53 N ATOM 17 CD2 HIS A 662 9.903 -19.664 -5.740 1.00 2.92 C ATOM 18 CE1 HIS A 662 8.413 -21.224 -5.937 1.00 3.00 C ATOM 19 NE2 HIS A 662 9.626 -20.992 -5.430 1.00 3.25 N ATOM 20 HA HIS A 662 7.969 -18.485 -8.882 1.00 0.00 H ATOM 21 HB2 HIS A 662 9.556 -17.320 -7.312 1.00 0.00 H ATOM 22 HB3 HIS A 662 8.206 -17.106 -6.173 1.00 0.00 H ATOM 23 HD2 HIS A 662 10.820 -19.136 -5.478 1.00 0.00 H ATOM 24 HE1 HIS A 662 7.894 -22.180 -5.869 1.00 0.00 H ATOM 25 H HIS A 662 7.861 -15.624 -8.167 1.00 0.00 H ATOM 26 N MET A 663 5.356 -17.246 -7.431 1.00 1.30 N ATOM 27 CA MET A 663 3.994 -17.521 -6.978 1.00 1.22 C ATOM 28 C MET A 663 3.208 -16.213 -6.864 1.00 0.95 C ATOM 29 O MET A 663 2.804 -15.633 -7.872 1.00 0.97 O ATOM 30 CB MET A 663 4.026 -18.254 -5.628 1.00 1.38 C ATOM 31 CG MET A 663 2.599 -18.534 -5.151 1.00 1.45 C ATOM 32 SD MET A 663 2.376 -17.849 -3.491 1.00 1.70 S ATOM 33 CE MET A 663 1.449 -19.243 -2.812 1.00 1.97 C ATOM 34 HA MET A 663 3.497 -18.162 -7.706 1.00 0.00 H ATOM 35 HB2 MET A 663 4.561 -19.197 -5.741 1.00 0.00 H ATOM 36 HB3 MET A 663 4.538 -17.634 -4.892 1.00 0.00 H ATOM 37 HG2 MET A 663 2.428 -19.610 -5.127 1.00 0.00 H ATOM 38 HG3 MET A 663 1.889 -18.070 -5.835 1.00 0.00 H ATOM 39 HE1 MET A 663 0.534 -19.384 -3.388 1.00 0.00 H ATOM 40 HE2 MET A 663 2.058 -20.145 -2.869 1.00 0.00 H ATOM 41 HE3 MET A 663 1.197 -19.038 -1.771 1.00 0.00 H ATOM 42 H MET A 663 5.648 -16.259 -7.581 1.00 0.00 H ATOM 43 N GLN A 664 3.002 -15.746 -5.641 1.00 0.82 N ATOM 44 CA GLN A 664 2.271 -14.502 -5.424 1.00 0.62 C ATOM 45 C GLN A 664 3.235 -13.317 -5.360 1.00 0.51 C ATOM 46 O GLN A 664 3.097 -12.424 -4.515 1.00 0.54 O ATOM 47 CB GLN A 664 1.457 -14.600 -4.131 1.00 0.65 C ATOM 48 CG GLN A 664 0.251 -13.652 -4.201 1.00 0.60 C ATOM 49 CD GLN A 664 0.307 -12.633 -3.071 1.00 0.69 C ATOM 50 OE1 GLN A 664 -0.675 -12.439 -2.355 1.00 0.69 O ATOM 51 NE2 GLN A 664 1.402 -11.964 -2.868 1.00 1.30 N ATOM 52 HA GLN A 664 1.591 -14.342 -6.260 1.00 0.00 H ATOM 53 HB2 GLN A 664 1.106 -15.624 -4.001 1.00 0.00 H ATOM 54 HB3 GLN A 664 2.086 -14.323 -3.285 1.00 0.00 H ATOM 55 HG2 GLN A 664 0.261 -13.129 -5.157 1.00 0.00 H ATOM 56 HG3 GLN A 664 -0.667 -14.233 -4.116 1.00 0.00 H ATOM 57 HE22 GLN A 664 2.232 -12.128 -3.473 1.00 0.00 H ATOM 58 HE21 GLN A 664 1.449 -11.264 -2.100 1.00 0.00 H ATOM 59 H GLN A 664 3.367 -16.274 -4.823 1.00 0.00 H ATOM 60 N ASP A 665 4.212 -13.311 -6.264 1.00 0.46 N ATOM 61 CA ASP A 665 5.190 -12.233 -6.309 1.00 0.40 C ATOM 62 C ASP A 665 4.542 -10.949 -6.825 1.00 0.32 C ATOM 63 O ASP A 665 4.674 -10.589 -7.998 1.00 0.36 O ATOM 64 CB ASP A 665 6.371 -12.606 -7.214 1.00 0.42 C ATOM 65 CG ASP A 665 6.508 -14.116 -7.365 1.00 0.62 C ATOM 66 OD1 ASP A 665 5.544 -14.749 -7.774 1.00 0.74 O ATOM 67 OD2 ASP A 665 7.586 -14.620 -7.110 1.00 0.83 O ATOM 68 HA ASP A 665 5.558 -12.071 -5.296 1.00 0.00 H ATOM 69 HB2 ASP A 665 6.216 -12.165 -8.198 1.00 0.00 H ATOM 70 HB3 ASP A 665 7.289 -12.209 -6.780 1.00 0.00 H ATOM 71 H ASP A 665 4.278 -14.090 -6.950 1.00 0.00 H ATOM 72 N LEU A 666 3.842 -10.262 -5.938 1.00 0.30 N ATOM 73 CA LEU A 666 3.171 -9.014 -6.300 1.00 0.26 C ATOM 74 C LEU A 666 4.162 -8.029 -6.923 1.00 0.25 C ATOM 75 O LEU A 666 3.766 -7.078 -7.602 1.00 0.28 O ATOM 76 CB LEU A 666 2.528 -8.382 -5.060 1.00 0.30 C ATOM 77 CG LEU A 666 1.596 -9.388 -4.376 1.00 0.38 C ATOM 78 CD1 LEU A 666 0.956 -8.734 -3.153 1.00 0.49 C ATOM 79 CD2 LEU A 666 0.494 -9.820 -5.348 1.00 0.57 C ATOM 80 HA LEU A 666 2.396 -9.243 -7.032 1.00 0.00 H ATOM 81 HB2 LEU A 666 3.310 -8.083 -4.362 1.00 0.00 H ATOM 82 HB3 LEU A 666 1.954 -7.505 -5.359 1.00 0.00 H ATOM 83 HG LEU A 666 2.173 -10.261 -4.071 1.00 0.00 H ATOM 84 HD21 LEU A 666 -0.081 -8.946 -5.655 1.00 0.00 H ATOM 85 HD22 LEU A 666 0.946 -10.285 -6.224 1.00 0.00 H ATOM 86 HD23 LEU A 666 -0.164 -10.535 -4.854 1.00 0.00 H ATOM 87 HD11 LEU A 666 1.736 -8.427 -2.457 1.00 0.00 H ATOM 88 HD12 LEU A 666 0.384 -7.861 -3.467 1.00 0.00 H ATOM 89 HD13 LEU A 666 0.293 -9.449 -2.666 1.00 0.00 H ATOM 90 H LEU A 666 3.767 -10.616 -4.963 1.00 0.00 H ATOM 91 N SER A 667 5.449 -8.277 -6.694 1.00 0.27 N ATOM 92 CA SER A 667 6.513 -7.423 -7.230 1.00 0.29 C ATOM 93 C SER A 667 6.303 -7.144 -8.714 1.00 0.27 C ATOM 94 O SER A 667 6.872 -6.201 -9.261 1.00 0.34 O ATOM 95 CB SER A 667 7.873 -8.093 -7.017 1.00 0.34 C ATOM 96 OG SER A 667 8.756 -7.173 -6.385 1.00 0.95 O ATOM 97 HA SER A 667 6.485 -6.472 -6.698 1.00 0.00 H ATOM 98 HB2 SER A 667 8.287 -8.392 -7.980 1.00 0.00 H ATOM 99 HB3 SER A 667 7.751 -8.973 -6.386 1.00 0.00 H ATOM 100 HG SER A 667 9.636 -7.604 -6.246 1.00 0.00 H ATOM 101 H SER A 667 5.708 -9.102 -6.117 1.00 0.00 H ATOM 102 N VAL A 668 5.483 -7.960 -9.361 1.00 0.25 N ATOM 103 CA VAL A 668 5.205 -7.774 -10.778 1.00 0.27 C ATOM 104 C VAL A 668 4.374 -6.507 -10.997 1.00 0.26 C ATOM 105 O VAL A 668 4.359 -5.945 -12.092 1.00 0.34 O ATOM 106 CB VAL A 668 4.461 -8.997 -11.334 1.00 0.32 C ATOM 107 CG1 VAL A 668 5.280 -10.264 -11.068 1.00 0.37 C ATOM 108 CG2 VAL A 668 3.095 -9.132 -10.656 1.00 0.33 C ATOM 109 HA VAL A 668 6.151 -7.665 -11.308 1.00 0.00 H ATOM 110 HB VAL A 668 4.322 -8.867 -12.407 1.00 0.00 H ATOM 111 HG11 VAL A 668 6.250 -10.177 -11.557 1.00 0.00 H ATOM 112 HG12 VAL A 668 5.422 -10.384 -9.994 1.00 0.00 H ATOM 113 HG13 VAL A 668 4.748 -11.129 -11.464 1.00 0.00 H ATOM 114 HG21 VAL A 668 3.234 -9.254 -9.582 1.00 0.00 H ATOM 115 HG22 VAL A 668 2.506 -8.235 -10.848 1.00 0.00 H ATOM 116 HG23 VAL A 668 2.576 -10.002 -11.058 1.00 0.00 H ATOM 117 H VAL A 668 5.032 -8.745 -8.849 1.00 0.00 H ATOM 118 N HIS A 669 3.683 -6.061 -9.950 1.00 0.22 N ATOM 119 CA HIS A 669 2.854 -4.862 -10.051 1.00 0.22 C ATOM 120 C HIS A 669 3.697 -3.603 -9.889 1.00 0.21 C ATOM 121 O HIS A 669 4.429 -3.443 -8.910 1.00 0.26 O ATOM 122 CB HIS A 669 1.755 -4.894 -8.994 1.00 0.23 C ATOM 123 CG HIS A 669 1.061 -6.226 -9.062 1.00 0.26 C ATOM 124 ND1 HIS A 669 0.464 -6.686 -10.226 1.00 0.34 N ATOM 125 CD2 HIS A 669 0.884 -7.216 -8.133 1.00 0.30 C ATOM 126 CE1 HIS A 669 -0.036 -7.908 -9.971 1.00 0.38 C ATOM 127 NE2 HIS A 669 0.192 -8.280 -8.707 1.00 0.36 N ATOM 128 HA HIS A 669 2.398 -4.845 -11.041 1.00 0.00 H ATOM 129 HB2 HIS A 669 2.193 -4.758 -8.005 1.00 0.00 H ATOM 130 HB3 HIS A 669 1.038 -4.096 -9.186 1.00 0.00 H ATOM 131 HD2 HIS A 669 1.232 -7.177 -7.101 1.00 0.00 H ATOM 132 HE1 HIS A 669 -0.562 -8.520 -10.704 1.00 0.00 H ATOM 133 H HIS A 669 3.734 -6.574 -9.047 1.00 0.00 H ATOM 134 N LEU A 670 3.582 -2.716 -10.865 1.00 0.21 N ATOM 135 CA LEU A 670 4.333 -1.467 -10.867 1.00 0.22 C ATOM 136 C LEU A 670 4.265 -0.756 -9.513 1.00 0.21 C ATOM 137 O LEU A 670 5.211 -0.083 -9.118 1.00 0.24 O ATOM 138 CB LEU A 670 3.783 -0.558 -11.976 1.00 0.27 C ATOM 139 CG LEU A 670 4.620 0.721 -12.094 1.00 0.26 C ATOM 140 CD1 LEU A 670 6.058 0.377 -12.470 1.00 0.26 C ATOM 141 CD2 LEU A 670 4.030 1.608 -13.188 1.00 0.28 C ATOM 142 HA LEU A 670 5.382 -1.695 -11.054 1.00 0.00 H ATOM 143 HB2 LEU A 670 3.812 -1.093 -12.925 1.00 0.00 H ATOM 144 HB3 LEU A 670 2.752 -0.291 -11.742 1.00 0.00 H ATOM 145 HG LEU A 670 4.609 1.239 -11.135 1.00 0.00 H ATOM 146 HD21 LEU A 670 4.045 1.071 -14.137 1.00 0.00 H ATOM 147 HD22 LEU A 670 3.002 1.865 -12.931 1.00 0.00 H ATOM 148 HD23 LEU A 670 4.623 2.519 -13.275 1.00 0.00 H ATOM 149 HD11 LEU A 670 6.490 -0.263 -11.701 1.00 0.00 H ATOM 150 HD12 LEU A 670 6.067 -0.145 -13.427 1.00 0.00 H ATOM 151 HD13 LEU A 670 6.641 1.295 -12.550 1.00 0.00 H ATOM 152 H LEU A 670 2.936 -2.917 -11.655 1.00 0.00 H ATOM 153 N TRP A 671 3.159 -0.906 -8.791 1.00 0.17 N ATOM 154 CA TRP A 671 3.045 -0.249 -7.491 1.00 0.17 C ATOM 155 C TRP A 671 3.638 -1.103 -6.370 1.00 0.17 C ATOM 156 O TRP A 671 3.615 -0.707 -5.201 1.00 0.21 O ATOM 157 CB TRP A 671 1.587 0.111 -7.171 1.00 0.20 C ATOM 158 CG TRP A 671 0.645 -0.899 -7.744 1.00 0.19 C ATOM 159 CD1 TRP A 671 -0.073 -0.733 -8.880 1.00 0.21 C ATOM 160 CD2 TRP A 671 0.289 -2.212 -7.224 1.00 0.19 C ATOM 161 NE1 TRP A 671 -0.847 -1.860 -9.088 1.00 0.22 N ATOM 162 CE2 TRP A 671 -0.656 -2.799 -8.097 1.00 0.20 C ATOM 163 CE3 TRP A 671 0.688 -2.945 -6.090 1.00 0.22 C ATOM 164 CZ2 TRP A 671 -1.183 -4.063 -7.860 1.00 0.23 C ATOM 165 CZ3 TRP A 671 0.155 -4.223 -5.847 1.00 0.25 C ATOM 166 CH2 TRP A 671 -0.779 -4.780 -6.731 1.00 0.25 C ATOM 167 HA TRP A 671 3.622 0.674 -7.553 1.00 0.00 H ATOM 168 HB2 TRP A 671 1.458 0.145 -6.089 1.00 0.00 H ATOM 169 HB3 TRP A 671 1.361 1.090 -7.594 1.00 0.00 H ATOM 170 HE1 TRP A 671 -1.494 -1.984 -9.893 1.00 0.00 H ATOM 171 HD1 TRP A 671 -0.045 0.145 -9.525 1.00 0.00 H ATOM 172 HZ2 TRP A 671 -1.908 -4.493 -8.551 1.00 0.00 H ATOM 173 HH2 TRP A 671 -1.190 -5.771 -6.538 1.00 0.00 H ATOM 174 HZ3 TRP A 671 0.470 -4.783 -4.967 1.00 0.00 H ATOM 175 HE3 TRP A 671 1.414 -2.519 -5.397 1.00 0.00 H ATOM 176 H TRP A 671 2.377 -1.490 -9.151 1.00 0.00 H ATOM 177 N TYR A 672 4.191 -2.262 -6.720 1.00 0.19 N ATOM 178 CA TYR A 672 4.796 -3.125 -5.710 1.00 0.18 C ATOM 179 C TYR A 672 6.299 -2.864 -5.606 1.00 0.20 C ATOM 180 O TYR A 672 7.069 -3.233 -6.491 1.00 0.27 O ATOM 181 CB TYR A 672 4.543 -4.596 -6.044 1.00 0.21 C ATOM 182 CG TYR A 672 4.401 -5.372 -4.755 1.00 0.22 C ATOM 183 CD1 TYR A 672 3.191 -5.335 -4.058 1.00 0.27 C ATOM 184 CD2 TYR A 672 5.475 -6.118 -4.255 1.00 0.25 C ATOM 185 CE1 TYR A 672 3.052 -6.043 -2.856 1.00 0.31 C ATOM 186 CE2 TYR A 672 5.336 -6.826 -3.053 1.00 0.29 C ATOM 187 CZ TYR A 672 4.125 -6.788 -2.355 1.00 0.30 C ATOM 188 OH TYR A 672 3.990 -7.481 -1.171 1.00 0.37 O ATOM 189 HA TYR A 672 4.336 -2.897 -4.749 1.00 0.00 H ATOM 190 HB3 TYR A 672 5.381 -4.991 -6.619 1.00 0.00 H ATOM 191 HB2 TYR A 672 3.628 -4.687 -6.629 1.00 0.00 H ATOM 192 HD2 TYR A 672 6.419 -6.148 -4.800 1.00 0.00 H ATOM 193 HE2 TYR A 672 6.172 -7.406 -2.662 1.00 0.00 H ATOM 194 HE1 TYR A 672 2.108 -6.013 -2.312 1.00 0.00 H ATOM 195 HD1 TYR A 672 2.355 -4.755 -4.449 1.00 0.00 H ATOM 196 HH TYR A 672 3.077 -7.346 -0.813 1.00 0.00 H ATOM 197 H TYR A 672 4.192 -2.554 -7.718 1.00 0.00 H ATOM 198 N ALA A 673 6.709 -2.231 -4.511 1.00 0.19 N ATOM 199 CA ALA A 673 8.121 -1.930 -4.293 1.00 0.23 C ATOM 200 C ALA A 673 8.834 -3.154 -3.706 1.00 0.26 C ATOM 201 O ALA A 673 10.048 -3.147 -3.481 1.00 0.35 O ATOM 202 CB ALA A 673 8.242 -0.722 -3.361 1.00 0.27 C ATOM 203 HA ALA A 673 8.598 -1.687 -5.243 1.00 0.00 H ATOM 204 HB1 ALA A 673 7.751 0.138 -3.817 1.00 0.00 H ATOM 205 HB2 ALA A 673 7.765 -0.951 -2.408 1.00 0.00 H ATOM 206 HB3 ALA A 673 9.295 -0.495 -3.197 1.00 0.00 H ATOM 207 H ALA A 673 6.010 -1.945 -3.796 1.00 0.00 H ATOM 208 N GLY A 674 8.056 -4.210 -3.492 1.00 0.25 N ATOM 209 CA GLY A 674 8.575 -5.475 -2.966 1.00 0.30 C ATOM 210 C GLY A 674 9.463 -5.296 -1.735 1.00 0.24 C ATOM 211 O GLY A 674 8.985 -4.880 -0.677 1.00 0.28 O ATOM 212 HA3 GLY A 674 9.159 -5.962 -3.747 1.00 0.00 H ATOM 213 HA2 GLY A 674 7.731 -6.110 -2.696 1.00 0.00 H ATOM 214 H GLY A 674 7.041 -4.136 -3.706 1.00 0.00 H ATOM 215 N PRO A 675 10.735 -5.632 -1.857 1.00 0.29 N ATOM 216 CA PRO A 675 11.731 -5.552 -0.734 1.00 0.38 C ATOM 217 C PRO A 675 11.900 -4.151 -0.168 1.00 0.44 C ATOM 218 O PRO A 675 12.569 -3.964 0.849 1.00 0.89 O ATOM 219 CB PRO A 675 13.048 -6.028 -1.361 1.00 0.51 C ATOM 220 CG PRO A 675 12.855 -5.936 -2.838 1.00 0.54 C ATOM 221 CD PRO A 675 11.364 -6.119 -3.095 1.00 0.41 C ATOM 222 HA PRO A 675 11.400 -6.154 0.112 1.00 0.00 H ATOM 223 HD3 PRO A 675 11.042 -5.529 -3.953 1.00 0.00 H ATOM 224 HD2 PRO A 675 11.125 -7.168 -3.266 1.00 0.00 H ATOM 225 HG3 PRO A 675 13.422 -6.719 -3.341 1.00 0.00 H ATOM 226 HG2 PRO A 675 13.183 -4.962 -3.200 1.00 0.00 H ATOM 227 HB2 PRO A 675 13.872 -5.388 -1.045 1.00 0.00 H ATOM 228 HB3 PRO A 675 13.257 -7.057 -1.069 1.00 0.00 H ATOM 229 N MET A 676 11.314 -3.167 -0.821 1.00 0.27 N ATOM 230 CA MET A 676 11.437 -1.795 -0.356 1.00 0.25 C ATOM 231 C MET A 676 10.975 -1.689 1.093 1.00 0.21 C ATOM 232 O MET A 676 10.192 -2.511 1.558 1.00 0.25 O ATOM 233 CB MET A 676 10.576 -0.897 -1.247 1.00 0.29 C ATOM 234 CG MET A 676 10.854 0.582 -0.963 1.00 0.35 C ATOM 235 SD MET A 676 11.560 1.333 -2.447 1.00 1.47 S ATOM 236 CE MET A 676 13.221 0.653 -2.240 1.00 1.09 C ATOM 237 HA MET A 676 12.479 -1.480 -0.409 1.00 0.00 H ATOM 238 HB2 MET A 676 10.802 -1.109 -2.292 1.00 0.00 H ATOM 239 HB3 MET A 676 9.524 -1.106 -1.054 1.00 0.00 H ATOM 240 HG2 MET A 676 11.558 0.671 -0.136 1.00 0.00 H ATOM 241 HG3 MET A 676 9.924 1.087 -0.703 1.00 0.00 H ATOM 242 HE1 MET A 676 13.638 0.997 -1.293 1.00 0.00 H ATOM 243 HE2 MET A 676 13.169 -0.436 -2.241 1.00 0.00 H ATOM 244 HE3 MET A 676 13.855 0.989 -3.061 1.00 0.00 H ATOM 245 H MET A 676 10.759 -3.374 -1.676 1.00 0.00 H ATOM 246 N GLU A 677 11.460 -0.679 1.805 1.00 0.20 N ATOM 247 CA GLU A 677 11.065 -0.485 3.197 1.00 0.20 C ATOM 248 C GLU A 677 10.143 0.726 3.305 1.00 0.21 C ATOM 249 O GLU A 677 10.045 1.526 2.372 1.00 0.26 O ATOM 250 CB GLU A 677 12.293 -0.294 4.097 1.00 0.21 C ATOM 251 CG GLU A 677 13.376 0.511 3.371 1.00 0.23 C ATOM 252 CD GLU A 677 14.594 0.667 4.272 1.00 0.29 C ATOM 253 OE1 GLU A 677 15.181 -0.350 4.621 1.00 0.34 O ATOM 254 OE2 GLU A 677 14.919 1.795 4.606 1.00 0.35 O ATOM 255 HA GLU A 677 10.535 -1.376 3.533 1.00 0.00 H ATOM 256 HB2 GLU A 677 11.996 0.239 5.000 1.00 0.00 H ATOM 257 HB3 GLU A 677 12.694 -1.271 4.368 1.00 0.00 H ATOM 258 HG2 GLU A 677 13.665 -0.011 2.459 1.00 0.00 H ATOM 259 HG3 GLU A 677 12.985 1.496 3.116 1.00 0.00 H ATOM 260 H GLU A 677 12.131 -0.017 1.365 1.00 0.00 H ATOM 261 N ARG A 678 9.463 0.860 4.434 1.00 0.21 N ATOM 262 CA ARG A 678 8.551 1.984 4.629 1.00 0.21 C ATOM 263 C ARG A 678 9.288 3.302 4.414 1.00 0.21 C ATOM 264 O ARG A 678 8.949 4.073 3.514 1.00 0.23 O ATOM 265 CB ARG A 678 7.960 1.936 6.037 1.00 0.24 C ATOM 266 CG ARG A 678 7.215 3.241 6.334 1.00 0.24 C ATOM 267 CD ARG A 678 8.101 4.152 7.186 1.00 0.27 C ATOM 268 NE ARG A 678 7.349 5.314 7.645 1.00 0.27 N ATOM 269 CZ ARG A 678 6.552 5.248 8.695 1.00 0.28 C ATOM 270 NH1 ARG A 678 6.360 4.118 9.299 1.00 0.27 N ATOM 271 NH2 ARG A 678 5.947 6.311 9.110 1.00 0.36 N ATOM 272 HA ARG A 678 7.742 1.913 3.902 1.00 0.00 H ATOM 273 HB2 ARG A 678 7.266 1.099 6.110 1.00 0.00 H ATOM 274 HB3 ARG A 678 8.763 1.805 6.762 1.00 0.00 H ATOM 275 HG2 ARG A 678 6.972 3.743 5.397 1.00 0.00 H ATOM 276 HG3 ARG A 678 6.295 3.019 6.875 1.00 0.00 H ATOM 277 HD2 ARG A 678 8.950 4.487 6.590 1.00 0.00 H ATOM 278 HD3 ARG A 678 8.463 3.595 8.050 1.00 0.00 H ATOM 279 HE ARG A 678 7.443 6.215 7.134 1.00 0.00 H ATOM 280 HH12 ARG A 678 5.731 4.071 10.126 1.00 0.00 H ATOM 281 HH11 ARG A 678 6.835 3.258 8.957 1.00 0.00 H ATOM 282 HH22 ARG A 678 5.318 6.262 9.937 1.00 0.00 H ATOM 283 HH21 ARG A 678 6.088 7.216 8.617 1.00 0.00 H ATOM 284 H ARG A 678 9.580 0.156 5.191 1.00 0.00 H ATOM 285 N ALA A 679 10.310 3.540 5.228 1.00 0.22 N ATOM 286 CA ALA A 679 11.108 4.753 5.105 1.00 0.24 C ATOM 287 C ALA A 679 11.519 4.925 3.653 1.00 0.24 C ATOM 288 O ALA A 679 11.443 6.018 3.084 1.00 0.31 O ATOM 289 CB ALA A 679 12.350 4.640 5.987 1.00 0.27 C ATOM 290 HA ALA A 679 10.525 5.616 5.425 1.00 0.00 H ATOM 291 HB1 ALA A 679 12.046 4.509 7.026 1.00 0.00 H ATOM 292 HB2 ALA A 679 12.943 3.782 5.670 1.00 0.00 H ATOM 293 HB3 ALA A 679 12.945 5.549 5.893 1.00 0.00 H ATOM 294 H ALA A 679 10.545 2.847 5.967 1.00 0.00 H ATOM 295 N GLY A 680 11.922 3.812 3.054 1.00 0.23 N ATOM 296 CA GLY A 680 12.319 3.803 1.657 1.00 0.25 C ATOM 297 C GLY A 680 11.126 4.167 0.796 1.00 0.24 C ATOM 298 O GLY A 680 11.222 5.027 -0.076 1.00 0.29 O ATOM 299 HA3 GLY A 680 12.675 2.809 1.385 1.00 0.00 H ATOM 300 HA2 GLY A 680 13.117 4.529 1.500 1.00 0.00 H ATOM 301 H GLY A 680 11.954 2.926 3.597 1.00 0.00 H ATOM 302 N ALA A 681 9.991 3.529 1.068 1.00 0.22 N ATOM 303 CA ALA A 681 8.776 3.815 0.324 1.00 0.22 C ATOM 304 C ALA A 681 8.497 5.308 0.363 1.00 0.20 C ATOM 305 O ALA A 681 8.144 5.909 -0.652 1.00 0.25 O ATOM 306 CB ALA A 681 7.592 3.048 0.921 1.00 0.24 C ATOM 307 HA ALA A 681 8.910 3.497 -0.710 1.00 0.00 H ATOM 308 HB1 ALA A 681 7.794 1.978 0.875 1.00 0.00 H ATOM 309 HB2 ALA A 681 7.452 3.349 1.959 1.00 0.00 H ATOM 310 HB3 ALA A 681 6.690 3.274 0.352 1.00 0.00 H ATOM 311 H ALA A 681 9.973 2.815 1.824 1.00 0.00 H ATOM 312 N GLU A 682 8.673 5.902 1.542 1.00 0.18 N ATOM 313 CA GLU A 682 8.448 7.335 1.706 1.00 0.17 C ATOM 314 C GLU A 682 9.475 8.133 0.905 1.00 0.18 C ATOM 315 O GLU A 682 9.163 9.198 0.375 1.00 0.23 O ATOM 316 CB GLU A 682 8.549 7.739 3.187 1.00 0.19 C ATOM 317 CG GLU A 682 7.953 6.648 4.084 1.00 0.18 C ATOM 318 CD GLU A 682 7.222 7.279 5.261 1.00 0.20 C ATOM 319 OE1 GLU A 682 6.131 7.760 5.048 1.00 0.25 O ATOM 320 OE2 GLU A 682 7.752 7.251 6.358 1.00 0.26 O ATOM 321 HA GLU A 682 7.445 7.556 1.340 1.00 0.00 H ATOM 322 HB2 GLU A 682 9.597 7.886 3.448 1.00 0.00 H ATOM 323 HB3 GLU A 682 8.003 8.670 3.343 1.00 0.00 H ATOM 324 HG2 GLU A 682 7.252 6.047 3.504 1.00 0.00 H ATOM 325 HG3 GLU A 682 8.754 6.010 4.457 1.00 0.00 H ATOM 326 H GLU A 682 8.976 5.335 2.360 1.00 0.00 H ATOM 327 N SER A 683 10.698 7.611 0.826 1.00 0.20 N ATOM 328 CA SER A 683 11.773 8.288 0.101 1.00 0.23 C ATOM 329 C SER A 683 11.333 8.667 -1.305 1.00 0.22 C ATOM 330 O SER A 683 11.454 9.824 -1.712 1.00 0.29 O ATOM 331 CB SER A 683 13.012 7.392 0.029 1.00 0.27 C ATOM 332 OG SER A 683 12.807 6.375 -0.943 1.00 0.26 O ATOM 333 HA SER A 683 12.018 9.201 0.644 1.00 0.00 H ATOM 334 HB2 SER A 683 13.187 6.934 1.003 1.00 0.00 H ATOM 335 HB3 SER A 683 13.878 7.992 -0.250 1.00 0.00 H ATOM 336 HG SER A 683 12.020 5.831 -0.688 1.00 0.00 H ATOM 337 H SER A 683 10.893 6.701 1.290 1.00 0.00 H ATOM 338 N ILE A 684 10.815 7.694 -2.038 1.00 0.20 N ATOM 339 CA ILE A 684 10.351 7.950 -3.402 1.00 0.21 C ATOM 340 C ILE A 684 9.061 8.751 -3.358 1.00 0.21 C ATOM 341 O ILE A 684 8.952 9.828 -3.952 1.00 0.26 O ATOM 342 CB ILE A 684 10.097 6.634 -4.144 1.00 0.22 C ATOM 343 CG1 ILE A 684 11.254 5.662 -3.899 1.00 0.26 C ATOM 344 CG2 ILE A 684 9.971 6.905 -5.647 1.00 0.29 C ATOM 345 CD1 ILE A 684 10.745 4.470 -3.090 1.00 0.29 C ATOM 346 HA ILE A 684 11.123 8.510 -3.929 1.00 0.00 H ATOM 347 HB ILE A 684 9.172 6.192 -3.773 1.00 0.00 H ATOM 348 HG12 ILE A 684 11.647 5.314 -4.854 1.00 0.00 H ATOM 349 HG13 ILE A 684 12.045 6.168 -3.345 1.00 0.00 H ATOM 350 HD11 ILE A 684 10.353 4.821 -2.136 1.00 0.00 H ATOM 351 HD12 ILE A 684 9.954 3.966 -3.646 1.00 0.00 H ATOM 352 HD13 ILE A 684 11.566 3.775 -2.913 1.00 0.00 H ATOM 353 HG21 ILE A 684 9.139 7.587 -5.823 1.00 0.00 H ATOM 354 HG22 ILE A 684 10.894 7.354 -6.013 1.00 0.00 H ATOM 355 HG23 ILE A 684 9.790 5.966 -6.170 1.00 0.00 H ATOM 356 H ILE A 684 10.737 6.736 -1.640 1.00 0.00 H ATOM 357 N LEU A 685 8.083 8.213 -2.644 1.00 0.19 N ATOM 358 CA LEU A 685 6.795 8.872 -2.515 1.00 0.20 C ATOM 359 C LEU A 685 6.978 10.317 -2.069 1.00 0.22 C ATOM 360 O LEU A 685 6.432 11.225 -2.690 1.00 0.27 O ATOM 361 CB LEU A 685 5.912 8.130 -1.511 1.00 0.22 C ATOM 362 CG LEU A 685 5.503 6.770 -2.079 1.00 0.21 C ATOM 363 CD1 LEU A 685 4.631 6.040 -1.059 1.00 0.34 C ATOM 364 CD2 LEU A 685 4.704 6.962 -3.371 1.00 0.33 C ATOM 365 HA LEU A 685 6.308 8.861 -3.490 1.00 0.00 H ATOM 366 HB2 LEU A 685 6.465 7.983 -0.583 1.00 0.00 H ATOM 367 HB3 LEU A 685 5.018 8.721 -1.310 1.00 0.00 H ATOM 368 HG LEU A 685 6.399 6.187 -2.291 1.00 0.00 H ATOM 369 HD21 LEU A 685 3.809 7.547 -3.160 1.00 0.00 H ATOM 370 HD22 LEU A 685 5.319 7.487 -4.102 1.00 0.00 H ATOM 371 HD23 LEU A 685 4.417 5.988 -3.768 1.00 0.00 H ATOM 372 HD11 LEU A 685 5.195 5.897 -0.137 1.00 0.00 H ATOM 373 HD12 LEU A 685 3.740 6.634 -0.853 1.00 0.00 H ATOM 374 HD13 LEU A 685 4.338 5.070 -1.461 1.00 0.00 H ATOM 375 H LEU A 685 8.240 7.302 -2.167 1.00 0.00 H ATOM 376 N ALA A 686 7.749 10.533 -1.000 1.00 0.21 N ATOM 377 CA ALA A 686 7.983 11.888 -0.504 1.00 0.23 C ATOM 378 C ALA A 686 8.389 12.809 -1.651 1.00 0.23 C ATOM 379 O ALA A 686 7.928 13.952 -1.728 1.00 0.26 O ATOM 380 CB ALA A 686 9.077 11.882 0.566 1.00 0.27 C ATOM 381 HA ALA A 686 7.057 12.257 -0.062 1.00 0.00 H ATOM 382 HB1 ALA A 686 8.768 11.247 1.397 1.00 0.00 H ATOM 383 HB2 ALA A 686 10.001 11.496 0.137 1.00 0.00 H ATOM 384 HB3 ALA A 686 9.239 12.899 0.924 1.00 0.00 H ATOM 385 H ALA A 686 8.189 9.726 -0.514 1.00 0.00 H ATOM 386 N ASN A 687 9.229 12.298 -2.547 1.00 0.23 N ATOM 387 CA ASN A 687 9.680 13.074 -3.699 1.00 0.25 C ATOM 388 C ASN A 687 8.584 13.171 -4.767 1.00 0.23 C ATOM 389 O ASN A 687 8.546 14.132 -5.535 1.00 0.32 O ATOM 390 CB ASN A 687 10.930 12.423 -4.301 1.00 0.30 C ATOM 391 CG ASN A 687 11.639 13.395 -5.239 1.00 0.43 C ATOM 392 OD1 ASN A 687 12.855 13.544 -5.174 1.00 0.83 O ATOM 393 ND2 ASN A 687 10.950 14.077 -6.107 1.00 0.90 N ATOM 394 HA ASN A 687 9.915 14.083 -3.360 1.00 0.00 H ATOM 395 HB2 ASN A 687 11.610 12.139 -3.497 1.00 0.00 H ATOM 396 HB3 ASN A 687 10.638 11.534 -4.859 1.00 0.00 H ATOM 397 HD22 ASN A 687 9.919 13.954 -6.165 1.00 0.00 H ATOM 398 HD21 ASN A 687 11.430 14.746 -6.743 1.00 0.00 H ATOM 399 H ASN A 687 9.572 11.324 -2.424 1.00 0.00 H ATOM 400 N ARG A 688 7.710 12.169 -4.826 1.00 0.20 N ATOM 401 CA ARG A 688 6.634 12.159 -5.817 1.00 0.20 C ATOM 402 C ARG A 688 5.494 13.101 -5.415 1.00 0.20 C ATOM 403 O ARG A 688 5.482 13.649 -4.312 1.00 0.26 O ATOM 404 CB ARG A 688 6.099 10.735 -5.977 1.00 0.20 C ATOM 405 CG ARG A 688 5.979 10.401 -7.466 1.00 0.23 C ATOM 406 CD ARG A 688 7.367 10.148 -8.050 1.00 0.26 C ATOM 407 NE ARG A 688 7.309 10.270 -9.511 1.00 0.28 N ATOM 408 CZ ARG A 688 7.495 9.237 -10.323 1.00 0.26 C ATOM 409 NH1 ARG A 688 7.807 8.071 -9.860 1.00 0.29 N ATOM 410 NH2 ARG A 688 7.366 9.401 -11.600 1.00 0.31 N ATOM 411 HA ARG A 688 7.041 12.510 -6.765 1.00 0.00 H ATOM 412 HB2 ARG A 688 6.784 10.033 -5.501 1.00 0.00 H ATOM 413 HB3 ARG A 688 5.118 10.660 -5.507 1.00 0.00 H ATOM 414 HG2 ARG A 688 5.366 9.509 -7.589 1.00 0.00 H ATOM 415 HG3 ARG A 688 5.512 11.236 -7.989 1.00 0.00 H ATOM 416 HD2 ARG A 688 7.698 9.145 -7.781 1.00 0.00 H ATOM 417 HD3 ARG A 688 8.069 10.880 -7.651 1.00 0.00 H ATOM 418 HE ARG A 688 7.114 11.203 -9.927 1.00 0.00 H ATOM 419 HH12 ARG A 688 7.949 7.273 -10.512 1.00 0.00 H ATOM 420 HH11 ARG A 688 7.916 7.931 -8.835 1.00 0.00 H ATOM 421 HH22 ARG A 688 7.510 8.598 -12.245 1.00 0.00 H ATOM 422 HH21 ARG A 688 7.119 10.336 -11.982 1.00 0.00 H ATOM 423 H ARG A 688 7.794 11.379 -4.155 1.00 0.00 H ATOM 424 N SER A 689 4.538 13.292 -6.318 1.00 0.21 N ATOM 425 CA SER A 689 3.408 14.179 -6.038 1.00 0.23 C ATOM 426 C SER A 689 2.339 13.478 -5.208 1.00 0.22 C ATOM 427 O SER A 689 2.343 12.249 -5.060 1.00 0.24 O ATOM 428 CB SER A 689 2.777 14.669 -7.344 1.00 0.28 C ATOM 429 OG SER A 689 2.907 16.083 -7.426 1.00 0.48 O ATOM 430 HA SER A 689 3.795 15.025 -5.471 1.00 0.00 H ATOM 431 HB2 SER A 689 1.721 14.398 -7.363 1.00 0.00 H ATOM 432 HB3 SER A 689 3.285 14.206 -8.190 1.00 0.00 H ATOM 433 HG SER A 689 2.500 16.402 -8.270 1.00 0.00 H ATOM 434 H SER A 689 4.593 12.805 -7.235 1.00 0.00 H ATOM 435 N ASP A 690 1.409 14.268 -4.689 1.00 0.23 N ATOM 436 CA ASP A 690 0.315 13.741 -3.893 1.00 0.23 C ATOM 437 C ASP A 690 -0.508 12.749 -4.712 1.00 0.23 C ATOM 438 O ASP A 690 -0.809 12.990 -5.883 1.00 0.30 O ATOM 439 CB ASP A 690 -0.572 14.897 -3.419 1.00 0.30 C ATOM 440 CG ASP A 690 -0.744 15.926 -4.535 1.00 0.38 C ATOM 441 OD1 ASP A 690 0.265 16.425 -5.017 1.00 0.44 O ATOM 442 OD2 ASP A 690 -1.879 16.202 -4.885 1.00 0.49 O ATOM 443 HA ASP A 690 0.722 13.219 -3.027 1.00 0.00 H ATOM 444 HB2 ASP A 690 -1.550 14.507 -3.135 1.00 0.00 H ATOM 445 HB3 ASP A 690 -0.109 15.376 -2.556 1.00 0.00 H ATOM 446 H ASP A 690 1.465 15.293 -4.857 1.00 0.00 H ATOM 447 N GLY A 691 -0.853 11.625 -4.096 1.00 0.21 N ATOM 448 CA GLY A 691 -1.628 10.600 -4.789 1.00 0.23 C ATOM 449 C GLY A 691 -0.743 9.421 -5.149 1.00 0.20 C ATOM 450 O GLY A 691 -1.219 8.292 -5.276 1.00 0.26 O ATOM 451 HA3 GLY A 691 -2.051 11.024 -5.700 1.00 0.00 H ATOM 452 HA2 GLY A 691 -2.435 10.259 -4.140 1.00 0.00 H ATOM 453 H GLY A 691 -0.568 11.473 -3.108 1.00 0.00 H ATOM 454 N THR A 692 0.553 9.687 -5.295 1.00 0.17 N ATOM 455 CA THR A 692 1.511 8.632 -5.619 1.00 0.16 C ATOM 456 C THR A 692 1.381 7.511 -4.601 1.00 0.15 C ATOM 457 O THR A 692 1.299 7.775 -3.401 1.00 0.19 O ATOM 458 CB THR A 692 2.938 9.181 -5.590 1.00 0.18 C ATOM 459 OG1 THR A 692 2.990 10.411 -6.302 1.00 0.23 O ATOM 460 CG2 THR A 692 3.886 8.172 -6.243 1.00 0.22 C ATOM 461 HA THR A 692 1.300 8.255 -6.620 1.00 0.00 H ATOM 462 HB THR A 692 3.241 9.348 -4.556 1.00 0.00 H ATOM 463 HG1 THR A 692 2.377 11.063 -5.878 1.00 0.00 H ATOM 464 HG23 THR A 692 3.845 7.230 -5.696 1.00 0.00 H ATOM 465 HG21 THR A 692 3.583 8.007 -7.277 1.00 0.00 H ATOM 466 HG22 THR A 692 4.903 8.563 -6.219 1.00 0.00 H ATOM 467 H THR A 692 0.890 10.664 -5.176 1.00 0.00 H ATOM 468 N PHE A 693 1.332 6.267 -5.066 1.00 0.16 N ATOM 469 CA PHE A 693 1.172 5.148 -4.137 1.00 0.17 C ATOM 470 C PHE A 693 2.048 3.949 -4.485 1.00 0.17 C ATOM 471 O PHE A 693 2.576 3.837 -5.592 1.00 0.24 O ATOM 472 CB PHE A 693 -0.292 4.711 -4.125 1.00 0.19 C ATOM 473 CG PHE A 693 -0.616 3.996 -5.416 1.00 0.20 C ATOM 474 CD1 PHE A 693 -0.942 4.729 -6.563 1.00 0.26 C ATOM 475 CD2 PHE A 693 -0.597 2.597 -5.463 1.00 0.26 C ATOM 476 CE1 PHE A 693 -1.247 4.065 -7.756 1.00 0.33 C ATOM 477 CE2 PHE A 693 -0.901 1.933 -6.657 1.00 0.33 C ATOM 478 CZ PHE A 693 -1.226 2.667 -7.803 1.00 0.35 C ATOM 479 HA PHE A 693 1.487 5.501 -3.155 1.00 0.00 H ATOM 480 HB2 PHE A 693 -0.464 4.039 -3.284 1.00 0.00 H ATOM 481 HB3 PHE A 693 -0.932 5.587 -4.024 1.00 0.00 H ATOM 482 HD2 PHE A 693 -0.346 2.025 -4.570 1.00 0.00 H ATOM 483 HE2 PHE A 693 -0.885 0.844 -6.694 1.00 0.00 H ATOM 484 HZ PHE A 693 -1.463 2.149 -8.733 1.00 0.00 H ATOM 485 HE1 PHE A 693 -1.501 4.637 -8.649 1.00 0.00 H ATOM 486 HD1 PHE A 693 -0.958 5.818 -6.527 1.00 0.00 H ATOM 487 H PHE A 693 1.407 6.089 -6.088 1.00 0.00 H ATOM 488 N LEU A 694 2.181 3.048 -3.512 1.00 0.15 N ATOM 489 CA LEU A 694 2.976 1.839 -3.697 1.00 0.15 C ATOM 490 C LEU A 694 2.750 0.838 -2.563 1.00 0.14 C ATOM 491 O LEU A 694 2.132 1.149 -1.539 1.00 0.19 O ATOM 492 CB LEU A 694 4.464 2.192 -3.776 1.00 0.16 C ATOM 493 CG LEU A 694 4.979 2.598 -2.391 1.00 0.17 C ATOM 494 CD1 LEU A 694 5.545 1.376 -1.663 1.00 0.23 C ATOM 495 CD2 LEU A 694 6.081 3.646 -2.543 1.00 0.19 C ATOM 496 HA LEU A 694 2.657 1.376 -4.631 1.00 0.00 H ATOM 497 HB2 LEU A 694 5.023 1.326 -4.130 1.00 0.00 H ATOM 498 HB3 LEU A 694 4.603 3.021 -4.470 1.00 0.00 H ATOM 499 HG LEU A 694 4.152 3.011 -1.813 1.00 0.00 H ATOM 500 HD21 LEU A 694 6.900 3.228 -3.127 1.00 0.00 H ATOM 501 HD22 LEU A 694 5.680 4.522 -3.053 1.00 0.00 H ATOM 502 HD23 LEU A 694 6.446 3.933 -1.557 1.00 0.00 H ATOM 503 HD11 LEU A 694 4.761 0.627 -1.549 1.00 0.00 H ATOM 504 HD12 LEU A 694 6.367 0.958 -2.243 1.00 0.00 H ATOM 505 HD13 LEU A 694 5.908 1.676 -0.680 1.00 0.00 H ATOM 506 H LEU A 694 1.707 3.210 -2.600 1.00 0.00 H ATOM 507 N VAL A 695 3.274 -0.359 -2.770 1.00 0.14 N ATOM 508 CA VAL A 695 3.169 -1.440 -1.789 1.00 0.15 C ATOM 509 C VAL A 695 4.535 -2.103 -1.630 1.00 0.17 C ATOM 510 O VAL A 695 5.322 -2.142 -2.580 1.00 0.19 O ATOM 511 CB VAL A 695 2.120 -2.462 -2.229 1.00 0.18 C ATOM 512 CG1 VAL A 695 1.625 -3.243 -1.007 1.00 0.27 C ATOM 513 CG2 VAL A 695 0.937 -1.728 -2.868 1.00 0.23 C ATOM 514 HA VAL A 695 2.854 -1.031 -0.829 1.00 0.00 H ATOM 515 HB VAL A 695 2.562 -3.150 -2.950 1.00 0.00 H ATOM 516 HG11 VAL A 695 2.465 -3.760 -0.543 1.00 0.00 H ATOM 517 HG12 VAL A 695 1.182 -2.551 -0.291 1.00 0.00 H ATOM 518 HG13 VAL A 695 0.877 -3.971 -1.321 1.00 0.00 H ATOM 519 HG21 VAL A 695 0.499 -1.044 -2.141 1.00 0.00 H ATOM 520 HG22 VAL A 695 1.285 -1.165 -3.734 1.00 0.00 H ATOM 521 HG23 VAL A 695 0.188 -2.454 -3.183 1.00 0.00 H ATOM 522 H VAL A 695 3.779 -0.538 -3.662 1.00 0.00 H ATOM 523 N ARG A 696 4.838 -2.578 -0.426 1.00 0.17 N ATOM 524 CA ARG A 696 6.152 -3.182 -0.176 1.00 0.19 C ATOM 525 C ARG A 696 6.113 -4.265 0.904 1.00 0.19 C ATOM 526 O ARG A 696 5.208 -4.295 1.740 1.00 0.22 O ATOM 527 CB ARG A 696 7.121 -2.077 0.255 1.00 0.20 C ATOM 528 CG ARG A 696 6.497 -1.274 1.411 1.00 0.22 C ATOM 529 CD ARG A 696 7.544 -1.024 2.500 1.00 0.25 C ATOM 530 NE ARG A 696 8.338 -2.230 2.721 1.00 0.22 N ATOM 531 CZ ARG A 696 7.893 -3.239 3.436 1.00 0.24 C ATOM 532 NH1 ARG A 696 6.729 -3.174 3.964 1.00 0.30 N ATOM 533 NH2 ARG A 696 8.619 -4.290 3.594 1.00 0.31 N ATOM 534 HA ARG A 696 6.477 -3.662 -1.099 1.00 0.00 H ATOM 535 HB2 ARG A 696 8.059 -2.523 0.586 1.00 0.00 H ATOM 536 HB3 ARG A 696 7.314 -1.413 -0.587 1.00 0.00 H ATOM 537 HG2 ARG A 696 6.134 -0.318 1.033 1.00 0.00 H ATOM 538 HG3 ARG A 696 5.664 -1.836 1.833 1.00 0.00 H ATOM 539 HD2 ARG A 696 7.041 -0.748 3.427 1.00 0.00 H ATOM 540 HD3 ARG A 696 8.201 -0.212 2.189 1.00 0.00 H ATOM 541 HE ARG A 696 9.286 -2.292 2.299 1.00 0.00 H ATOM 542 HH12 ARG A 696 6.370 -3.968 4.531 1.00 0.00 H ATOM 543 HH11 ARG A 696 6.142 -2.327 3.826 1.00 0.00 H ATOM 544 HH22 ARG A 696 8.264 -5.087 4.160 1.00 0.00 H ATOM 545 HH21 ARG A 696 9.560 -4.342 3.155 1.00 0.00 H ATOM 546 H ARG A 696 4.140 -2.521 0.343 1.00 0.00 H ATOM 547 N GLN A 697 7.132 -5.133 0.894 1.00 0.21 N ATOM 548 CA GLN A 697 7.245 -6.199 1.889 1.00 0.22 C ATOM 549 C GLN A 697 8.717 -6.560 2.106 1.00 0.24 C ATOM 550 O GLN A 697 9.528 -6.472 1.190 1.00 0.32 O ATOM 551 CB GLN A 697 6.457 -7.441 1.458 1.00 0.25 C ATOM 552 CG GLN A 697 6.414 -8.458 2.613 1.00 0.27 C ATOM 553 CD GLN A 697 6.193 -7.749 3.950 1.00 0.27 C ATOM 554 OE1 GLN A 697 7.144 -7.250 4.558 1.00 0.30 O ATOM 555 NE2 GLN A 697 4.997 -7.677 4.450 1.00 0.32 N ATOM 556 HA GLN A 697 6.822 -5.836 2.826 1.00 0.00 H ATOM 557 HB2 GLN A 697 5.440 -7.151 1.193 1.00 0.00 H ATOM 558 HB3 GLN A 697 6.941 -7.895 0.593 1.00 0.00 H ATOM 559 HG2 GLN A 697 5.599 -9.161 2.441 1.00 0.00 H ATOM 560 HG3 GLN A 697 7.359 -9.001 2.647 1.00 0.00 H ATOM 561 HE22 GLN A 697 4.194 -8.097 3.940 1.00 0.00 H ATOM 562 HE21 GLN A 697 4.842 -7.200 5.361 1.00 0.00 H ATOM 563 H GLN A 697 7.863 -5.047 0.159 1.00 0.00 H ATOM 564 N ARG A 698 9.055 -6.956 3.330 1.00 0.24 N ATOM 565 CA ARG A 698 10.439 -7.309 3.660 1.00 0.25 C ATOM 566 C ARG A 698 10.521 -8.047 5.003 1.00 0.30 C ATOM 567 O ARG A 698 11.552 -8.634 5.336 1.00 0.39 O ATOM 568 CB ARG A 698 11.285 -6.028 3.719 1.00 0.26 C ATOM 569 CG ARG A 698 12.778 -6.372 3.680 1.00 0.38 C ATOM 570 CD ARG A 698 13.601 -5.079 3.726 1.00 0.37 C ATOM 571 NE ARG A 698 13.474 -4.446 5.039 1.00 0.39 N ATOM 572 CZ ARG A 698 13.975 -3.244 5.288 1.00 0.37 C ATOM 573 NH1 ARG A 698 14.592 -2.588 4.358 1.00 0.34 N ATOM 574 NH2 ARG A 698 13.843 -2.723 6.463 1.00 0.44 N ATOM 575 HA ARG A 698 10.821 -7.976 2.887 1.00 0.00 H ATOM 576 HB2 ARG A 698 11.039 -5.395 2.866 1.00 0.00 H ATOM 577 HB3 ARG A 698 11.063 -5.493 4.642 1.00 0.00 H ATOM 578 HG2 ARG A 698 13.030 -6.995 4.538 1.00 0.00 H ATOM 579 HG3 ARG A 698 13.003 -6.914 2.761 1.00 0.00 H ATOM 580 HD2 ARG A 698 13.239 -4.394 2.959 1.00 0.00 H ATOM 581 HD3 ARG A 698 14.649 -5.312 3.538 1.00 0.00 H ATOM 582 HE ARG A 698 12.977 -4.953 5.799 1.00 0.00 H ATOM 583 HH12 ARG A 698 14.983 -1.645 4.559 1.00 0.00 H ATOM 584 HH11 ARG A 698 14.697 -3.004 3.410 1.00 0.00 H ATOM 585 HH22 ARG A 698 14.235 -1.780 6.661 1.00 0.00 H ATOM 586 HH21 ARG A 698 13.345 -3.246 7.211 1.00 0.00 H ATOM 587 H ARG A 698 8.324 -7.016 4.067 1.00 0.00 H ATOM 588 N VAL A 699 9.435 -8.014 5.775 1.00 0.32 N ATOM 589 CA VAL A 699 9.414 -8.682 7.076 1.00 0.37 C ATOM 590 C VAL A 699 9.320 -10.205 6.909 1.00 0.41 C ATOM 591 O VAL A 699 8.256 -10.806 7.083 1.00 0.45 O ATOM 592 CB VAL A 699 8.242 -8.149 7.916 1.00 0.40 C ATOM 593 CG1 VAL A 699 6.909 -8.450 7.221 1.00 0.42 C ATOM 594 CG2 VAL A 699 8.254 -8.807 9.301 1.00 0.50 C ATOM 595 HA VAL A 699 10.347 -8.464 7.597 1.00 0.00 H ATOM 596 HB VAL A 699 8.352 -7.070 8.023 1.00 0.00 H ATOM 597 HG11 VAL A 699 6.894 -7.969 6.243 1.00 0.00 H ATOM 598 HG12 VAL A 699 6.799 -9.528 7.099 1.00 0.00 H ATOM 599 HG13 VAL A 699 6.089 -8.066 7.828 1.00 0.00 H ATOM 600 HG21 VAL A 699 8.157 -9.887 9.190 1.00 0.00 H ATOM 601 HG22 VAL A 699 9.193 -8.576 9.804 1.00 0.00 H ATOM 602 HG23 VAL A 699 7.421 -8.425 9.891 1.00 0.00 H ATOM 603 H VAL A 699 8.589 -7.505 5.447 1.00 0.00 H ATOM 604 N LYS A 700 10.455 -10.821 6.571 1.00 0.47 N ATOM 605 CA LYS A 700 10.524 -12.275 6.378 1.00 0.55 C ATOM 606 C LYS A 700 10.154 -13.027 7.663 1.00 0.57 C ATOM 607 O LYS A 700 10.844 -13.967 8.073 1.00 0.66 O ATOM 608 CB LYS A 700 11.944 -12.662 5.944 1.00 0.64 C ATOM 609 CG LYS A 700 12.956 -12.163 6.988 1.00 0.69 C ATOM 610 CD LYS A 700 13.723 -13.351 7.586 1.00 0.83 C ATOM 611 CE LYS A 700 13.680 -13.282 9.116 1.00 0.88 C ATOM 612 NZ LYS A 700 12.514 -14.068 9.608 1.00 0.84 N ATOM 613 HA LYS A 700 9.807 -12.554 5.606 1.00 0.00 H ATOM 614 HB2 LYS A 700 12.015 -13.746 5.859 1.00 0.00 H ATOM 615 HB3 LYS A 700 12.165 -12.208 4.978 1.00 0.00 H ATOM 616 HG2 LYS A 700 13.660 -11.481 6.511 1.00 0.00 H ATOM 617 HG3 LYS A 700 12.426 -11.638 7.783 1.00 0.00 H ATOM 618 HD2 LYS A 700 13.265 -14.282 7.253 1.00 0.00 H ATOM 619 HD3 LYS A 700 14.760 -13.318 7.251 1.00 0.00 H ATOM 620 HE2 LYS A 700 13.580 -12.244 9.432 1.00 0.00 H ATOM 621 HE3 LYS A 700 14.600 -13.698 9.526 1.00 0.00 H ATOM 622 HZ1 LYS A 700 11.638 -13.669 9.215 1.00 0.00 H ATOM 623 HZ2 LYS A 700 12.612 -15.058 9.305 1.00 0.00 H ATOM 624 HZ3 LYS A 700 12.481 -14.024 10.647 1.00 0.00 H ATOM 625 H LYS A 700 11.317 -10.254 6.440 1.00 0.00 H ATOM 626 N ASP A 701 9.062 -12.606 8.287 1.00 0.55 N ATOM 627 CA ASP A 701 8.592 -13.222 9.523 1.00 0.63 C ATOM 628 C ASP A 701 7.064 -13.291 9.535 1.00 0.66 C ATOM 629 O ASP A 701 6.479 -14.277 9.987 1.00 0.89 O ATOM 630 CB ASP A 701 9.088 -12.406 10.723 1.00 0.69 C ATOM 631 CG ASP A 701 10.593 -12.190 10.625 1.00 0.73 C ATOM 632 OD1 ASP A 701 10.998 -11.274 9.931 1.00 0.74 O ATOM 633 OD2 ASP A 701 11.325 -12.956 11.234 1.00 0.83 O ATOM 634 HA ASP A 701 8.986 -14.236 9.587 1.00 0.00 H ATOM 635 HB2 ASP A 701 8.585 -11.439 10.734 1.00 0.00 H ATOM 636 HB3 ASP A 701 8.860 -12.943 11.643 1.00 0.00 H ATOM 637 H ASP A 701 8.525 -11.813 7.883 1.00 0.00 H ATOM 638 N ALA A 702 6.427 -12.236 9.029 1.00 0.59 N ATOM 639 CA ALA A 702 4.968 -12.176 8.973 1.00 0.64 C ATOM 640 C ALA A 702 4.502 -11.884 7.546 1.00 0.55 C ATOM 641 O ALA A 702 4.738 -10.798 7.014 1.00 0.54 O ATOM 642 CB ALA A 702 4.460 -11.085 9.920 1.00 0.72 C ATOM 643 HA ALA A 702 4.563 -13.140 9.282 1.00 0.00 H ATOM 644 HB1 ALA A 702 4.774 -11.314 10.938 1.00 0.00 H ATOM 645 HB2 ALA A 702 4.874 -10.123 9.619 1.00 0.00 H ATOM 646 HB3 ALA A 702 3.372 -11.044 9.875 1.00 0.00 H ATOM 647 H ALA A 702 6.982 -11.435 8.665 1.00 0.00 H ATOM 648 N ALA A 703 3.847 -12.861 6.928 1.00 0.66 N ATOM 649 CA ALA A 703 3.360 -12.701 5.556 1.00 0.67 C ATOM 650 C ALA A 703 2.283 -11.612 5.468 1.00 0.60 C ATOM 651 O ALA A 703 1.196 -11.843 4.936 1.00 0.81 O ATOM 652 CB ALA A 703 2.794 -14.036 5.060 1.00 0.86 C ATOM 653 HA ALA A 703 4.196 -12.395 4.927 1.00 0.00 H ATOM 654 HB1 ALA A 703 3.578 -14.793 5.083 1.00 0.00 H ATOM 655 HB2 ALA A 703 1.972 -14.343 5.706 1.00 0.00 H ATOM 656 HB3 ALA A 703 2.431 -13.918 4.039 1.00 0.00 H ATOM 657 H ALA A 703 3.677 -13.757 7.428 1.00 0.00 H ATOM 658 N GLU A 704 2.588 -10.427 5.991 1.00 0.40 N ATOM 659 CA GLU A 704 1.629 -9.318 5.963 1.00 0.35 C ATOM 660 C GLU A 704 1.902 -8.380 4.783 1.00 0.30 C ATOM 661 O GLU A 704 2.862 -8.572 4.031 1.00 0.33 O ATOM 662 CB GLU A 704 1.686 -8.539 7.284 1.00 0.37 C ATOM 663 CG GLU A 704 3.073 -7.905 7.468 1.00 0.35 C ATOM 664 CD GLU A 704 3.142 -6.540 6.788 1.00 0.32 C ATOM 665 OE1 GLU A 704 2.149 -5.829 6.802 1.00 0.40 O ATOM 666 OE2 GLU A 704 4.198 -6.225 6.266 1.00 0.41 O ATOM 667 HA GLU A 704 0.630 -9.736 5.837 1.00 0.00 H ATOM 668 HB2 GLU A 704 0.930 -7.754 7.272 1.00 0.00 H ATOM 669 HB3 GLU A 704 1.488 -9.220 8.112 1.00 0.00 H ATOM 670 HG2 GLU A 704 3.272 -7.784 8.533 1.00 0.00 H ATOM 671 HG3 GLU A 704 3.826 -8.560 7.031 1.00 0.00 H ATOM 672 H GLU A 704 3.522 -10.285 6.427 1.00 0.00 H ATOM 673 N PHE A 705 1.045 -7.367 4.622 1.00 0.28 N ATOM 674 CA PHE A 705 1.196 -6.410 3.523 1.00 0.26 C ATOM 675 C PHE A 705 0.622 -5.038 3.903 1.00 0.22 C ATOM 676 O PHE A 705 -0.203 -4.924 4.810 1.00 0.28 O ATOM 677 CB PHE A 705 0.475 -6.934 2.273 1.00 0.29 C ATOM 678 CG PHE A 705 1.044 -8.278 1.875 1.00 0.33 C ATOM 679 CD1 PHE A 705 2.253 -8.346 1.172 1.00 0.45 C ATOM 680 CD2 PHE A 705 0.361 -9.455 2.208 1.00 0.42 C ATOM 681 CE1 PHE A 705 2.781 -9.590 0.804 1.00 0.55 C ATOM 682 CE2 PHE A 705 0.888 -10.698 1.840 1.00 0.52 C ATOM 683 CZ PHE A 705 2.098 -10.766 1.139 1.00 0.55 C ATOM 684 HA PHE A 705 2.260 -6.297 3.317 1.00 0.00 H ATOM 685 HB2 PHE A 705 -0.588 -7.041 2.487 1.00 0.00 H ATOM 686 HB3 PHE A 705 0.611 -6.227 1.454 1.00 0.00 H ATOM 687 HD2 PHE A 705 -0.581 -9.403 2.754 1.00 0.00 H ATOM 688 HE2 PHE A 705 0.356 -11.614 2.099 1.00 0.00 H ATOM 689 HZ PHE A 705 2.509 -11.735 0.854 1.00 0.00 H ATOM 690 HE1 PHE A 705 3.723 -9.643 0.257 1.00 0.00 H ATOM 691 HD1 PHE A 705 2.784 -7.430 0.911 1.00 0.00 H ATOM 692 H PHE A 705 0.256 -7.256 5.290 1.00 0.00 H ATOM 693 N ALA A 706 1.062 -4.002 3.194 1.00 0.23 N ATOM 694 CA ALA A 706 0.590 -2.639 3.451 1.00 0.20 C ATOM 695 C ALA A 706 0.761 -1.769 2.213 1.00 0.18 C ATOM 696 O ALA A 706 1.716 -1.937 1.454 1.00 0.22 O ATOM 697 CB ALA A 706 1.384 -2.025 4.601 1.00 0.23 C ATOM 698 HA ALA A 706 -0.467 -2.687 3.711 1.00 0.00 H ATOM 699 HB1 ALA A 706 1.248 -2.629 5.498 1.00 0.00 H ATOM 700 HB2 ALA A 706 2.441 -1.997 4.337 1.00 0.00 H ATOM 701 HB3 ALA A 706 1.028 -1.012 4.787 1.00 0.00 H ATOM 702 H ALA A 706 1.758 -4.164 2.439 1.00 0.00 H ATOM 703 N ILE A 707 -0.155 -0.832 2.026 1.00 0.19 N ATOM 704 CA ILE A 707 -0.080 0.070 0.879 1.00 0.18 C ATOM 705 C ILE A 707 0.375 1.455 1.322 1.00 0.17 C ATOM 706 O ILE A 707 -0.045 1.952 2.371 1.00 0.23 O ATOM 707 CB ILE A 707 -1.441 0.168 0.191 1.00 0.22 C ATOM 708 CG1 ILE A 707 -1.924 -1.238 -0.176 1.00 0.31 C ATOM 709 CG2 ILE A 707 -1.314 1.012 -1.082 1.00 0.24 C ATOM 710 CD1 ILE A 707 -3.331 -1.166 -0.770 1.00 0.33 C ATOM 711 HA ILE A 707 0.646 -0.332 0.173 1.00 0.00 H ATOM 712 HB ILE A 707 -2.157 0.638 0.866 1.00 0.00 H ATOM 713 HG12 ILE A 707 -1.244 -1.675 -0.908 1.00 0.00 H ATOM 714 HG13 ILE A 707 -1.941 -1.860 0.719 1.00 0.00 H ATOM 715 HD11 ILE A 707 -4.011 -0.731 -0.038 1.00 0.00 H ATOM 716 HD12 ILE A 707 -3.314 -0.545 -1.666 1.00 0.00 H ATOM 717 HD13 ILE A 707 -3.667 -2.170 -1.028 1.00 0.00 H ATOM 718 HG21 ILE A 707 -0.967 2.012 -0.821 1.00 0.00 H ATOM 719 HG22 ILE A 707 -0.599 0.543 -1.758 1.00 0.00 H ATOM 720 HG23 ILE A 707 -2.286 1.080 -1.570 1.00 0.00 H ATOM 721 H ILE A 707 -0.938 -0.737 2.704 1.00 0.00 H ATOM 722 N SER A 708 1.236 2.071 0.518 1.00 0.16 N ATOM 723 CA SER A 708 1.750 3.398 0.829 1.00 0.17 C ATOM 724 C SER A 708 1.332 4.396 -0.245 1.00 0.17 C ATOM 725 O SER A 708 1.504 4.140 -1.441 1.00 0.25 O ATOM 726 CB SER A 708 3.271 3.348 0.928 1.00 0.20 C ATOM 727 OG SER A 708 3.759 4.642 1.237 1.00 0.26 O ATOM 728 HA SER A 708 1.336 3.722 1.784 1.00 0.00 H ATOM 729 HB2 SER A 708 3.688 3.018 -0.023 1.00 0.00 H ATOM 730 HB3 SER A 708 3.563 2.650 1.713 1.00 0.00 H ATOM 731 HG SER A 708 3.378 4.939 2.101 1.00 0.00 H ATOM 732 H SER A 708 1.549 1.595 -0.352 1.00 0.00 H ATOM 733 N ILE A 709 0.758 5.521 0.186 1.00 0.14 N ATOM 734 CA ILE A 709 0.295 6.547 -0.753 1.00 0.14 C ATOM 735 C ILE A 709 0.731 7.945 -0.314 1.00 0.14 C ATOM 736 O ILE A 709 0.764 8.256 0.881 1.00 0.20 O ATOM 737 CB ILE A 709 -1.237 6.512 -0.871 1.00 0.16 C ATOM 738 CG1 ILE A 709 -1.723 5.063 -0.954 1.00 0.21 C ATOM 739 CG2 ILE A 709 -1.683 7.267 -2.133 1.00 0.20 C ATOM 740 CD1 ILE A 709 -2.153 4.588 0.433 1.00 0.28 C ATOM 741 HA ILE A 709 0.745 6.329 -1.721 1.00 0.00 H ATOM 742 HB ILE A 709 -1.666 6.989 0.010 1.00 0.00 H ATOM 743 HG12 ILE A 709 -2.570 5.002 -1.638 1.00 0.00 H ATOM 744 HG13 ILE A 709 -0.916 4.429 -1.321 1.00 0.00 H ATOM 745 HD11 ILE A 709 -1.305 4.648 1.115 1.00 0.00 H ATOM 746 HD12 ILE A 709 -2.961 5.222 0.798 1.00 0.00 H ATOM 747 HD13 ILE A 709 -2.499 3.556 0.371 1.00 0.00 H ATOM 748 HG21 ILE A 709 -1.351 8.303 -2.071 1.00 0.00 H ATOM 749 HG22 ILE A 709 -1.244 6.795 -3.012 1.00 0.00 H ATOM 750 HG23 ILE A 709 -2.770 7.237 -2.208 1.00 0.00 H ATOM 751 H ILE A 709 0.637 5.673 1.208 1.00 0.00 H ATOM 752 N LYS A 710 1.057 8.776 -1.303 1.00 0.14 N ATOM 753 CA LYS A 710 1.488 10.153 -1.056 1.00 0.16 C ATOM 754 C LYS A 710 0.287 11.069 -0.819 1.00 0.17 C ATOM 755 O LYS A 710 -0.639 11.123 -1.635 1.00 0.28 O ATOM 756 CB LYS A 710 2.278 10.667 -2.265 1.00 0.18 C ATOM 757 CG LYS A 710 2.778 12.095 -1.997 1.00 0.21 C ATOM 758 CD LYS A 710 3.969 12.060 -1.035 1.00 0.23 C ATOM 759 CE LYS A 710 4.715 13.395 -1.094 1.00 0.21 C ATOM 760 NZ LYS A 710 5.785 13.306 -2.124 1.00 0.20 N ATOM 761 HA LYS A 710 2.115 10.160 -0.165 1.00 0.00 H ATOM 762 HB2 LYS A 710 3.131 10.013 -2.444 1.00 0.00 H ATOM 763 HB3 LYS A 710 1.633 10.669 -3.144 1.00 0.00 H ATOM 764 HG2 LYS A 710 3.086 12.552 -2.937 1.00 0.00 H ATOM 765 HG3 LYS A 710 1.973 12.683 -1.555 1.00 0.00 H ATOM 766 HD2 LYS A 710 3.611 11.889 -0.020 1.00 0.00 H ATOM 767 HD3 LYS A 710 4.644 11.254 -1.322 1.00 0.00 H ATOM 768 HE2 LYS A 710 5.160 13.609 -0.122 1.00 0.00 H ATOM 769 HE3 LYS A 710 4.019 14.192 -1.357 1.00 0.00 H ATOM 770 HZ1 LYS A 710 6.446 12.545 -1.870 1.00 0.00 H ATOM 771 HZ2 LYS A 710 5.357 13.101 -3.050 1.00 0.00 H ATOM 772 HZ3 LYS A 710 6.297 14.210 -2.170 1.00 0.00 H ATOM 773 H LYS A 710 1.003 8.435 -2.284 1.00 0.00 H ATOM 774 N TYR A 711 0.321 11.799 0.290 1.00 0.17 N ATOM 775 CA TYR A 711 -0.757 12.720 0.627 1.00 0.18 C ATOM 776 C TYR A 711 -0.211 13.955 1.349 1.00 0.20 C ATOM 777 O TYR A 711 0.423 13.843 2.397 1.00 0.26 O ATOM 778 CB TYR A 711 -1.782 12.007 1.517 1.00 0.20 C ATOM 779 CG TYR A 711 -3.170 12.451 1.131 1.00 0.20 C ATOM 780 CD1 TYR A 711 -3.507 13.807 1.180 1.00 0.30 C ATOM 781 CD2 TYR A 711 -4.116 11.510 0.715 1.00 0.20 C ATOM 782 CE1 TYR A 711 -4.789 14.225 0.815 1.00 0.33 C ATOM 783 CE2 TYR A 711 -5.402 11.926 0.347 1.00 0.22 C ATOM 784 CZ TYR A 711 -5.738 13.290 0.397 1.00 0.26 C ATOM 785 OH TYR A 711 -7.000 13.722 0.040 1.00 0.32 O ATOM 786 HA TYR A 711 -1.238 13.046 -0.295 1.00 0.00 H ATOM 787 HB3 TYR A 711 -1.596 12.259 2.561 1.00 0.00 H ATOM 788 HB2 TYR A 711 -1.694 10.929 1.383 1.00 0.00 H ATOM 789 HD2 TYR A 711 -3.853 10.453 0.677 1.00 0.00 H ATOM 790 HE2 TYR A 711 -6.141 11.193 0.022 1.00 0.00 H ATOM 791 HE1 TYR A 711 -5.049 15.283 0.857 1.00 0.00 H ATOM 792 HD1 TYR A 711 -2.768 14.540 1.504 1.00 0.00 H ATOM 793 HH TYR A 711 -7.179 13.473 -0.901 1.00 0.00 H ATOM 794 H TYR A 711 1.135 11.711 0.932 1.00 0.00 H ATOM 795 N ASN A 712 -0.466 15.131 0.776 1.00 0.24 N ATOM 796 CA ASN A 712 -0.001 16.391 1.365 1.00 0.26 C ATOM 797 C ASN A 712 1.474 16.298 1.761 1.00 0.24 C ATOM 798 O ASN A 712 1.804 16.247 2.944 1.00 0.26 O ATOM 799 CB ASN A 712 -0.849 16.736 2.595 1.00 0.29 C ATOM 800 CG ASN A 712 -2.257 17.136 2.169 1.00 0.34 C ATOM 801 OD1 ASN A 712 -2.688 16.820 1.063 1.00 0.48 O ATOM 802 ND2 ASN A 712 -3.003 17.820 2.984 1.00 0.47 N ATOM 803 HA ASN A 712 -0.107 17.178 0.618 1.00 0.00 H ATOM 804 HB2 ASN A 712 -0.904 15.866 3.250 1.00 0.00 H ATOM 805 HB3 ASN A 712 -0.386 17.564 3.131 1.00 0.00 H ATOM 806 HD22 ASN A 712 -2.639 18.088 3.921 1.00 0.00 H ATOM 807 HD21 ASN A 712 -3.964 18.099 2.700 1.00 0.00 H ATOM 808 H ASN A 712 -1.008 15.156 -0.111 1.00 0.00 H ATOM 809 N VAL A 713 2.345 16.267 0.753 1.00 0.25 N ATOM 810 CA VAL A 713 3.796 16.170 0.969 1.00 0.26 C ATOM 811 C VAL A 713 4.147 15.092 1.995 1.00 0.22 C ATOM 812 O VAL A 713 5.256 15.071 2.532 1.00 0.26 O ATOM 813 CB VAL A 713 4.379 17.529 1.403 1.00 0.31 C ATOM 814 CG1 VAL A 713 3.918 18.620 0.435 1.00 0.41 C ATOM 815 CG2 VAL A 713 3.915 17.886 2.820 1.00 0.33 C ATOM 816 HA VAL A 713 4.244 15.883 0.017 1.00 0.00 H ATOM 817 HB VAL A 713 5.467 17.458 1.392 1.00 0.00 H ATOM 818 HG11 VAL A 713 4.265 18.382 -0.571 1.00 0.00 H ATOM 819 HG12 VAL A 713 2.829 18.674 0.442 1.00 0.00 H ATOM 820 HG13 VAL A 713 4.333 19.579 0.746 1.00 0.00 H ATOM 821 HG21 VAL A 713 2.827 17.945 2.841 1.00 0.00 H ATOM 822 HG22 VAL A 713 4.252 17.118 3.516 1.00 0.00 H ATOM 823 HG23 VAL A 713 4.337 18.849 3.108 1.00 0.00 H ATOM 824 H VAL A 713 1.985 16.313 -0.222 1.00 0.00 H ATOM 825 N GLU A 714 3.200 14.197 2.250 1.00 0.19 N ATOM 826 CA GLU A 714 3.407 13.114 3.203 1.00 0.17 C ATOM 827 C GLU A 714 2.940 11.782 2.630 1.00 0.15 C ATOM 828 O GLU A 714 2.236 11.739 1.617 1.00 0.18 O ATOM 829 CB GLU A 714 2.653 13.417 4.496 1.00 0.21 C ATOM 830 CG GLU A 714 3.653 13.907 5.540 1.00 0.28 C ATOM 831 CD GLU A 714 4.438 12.732 6.121 1.00 0.41 C ATOM 832 OE1 GLU A 714 4.646 11.758 5.406 1.00 0.34 O ATOM 833 OE2 GLU A 714 4.825 12.828 7.273 1.00 0.74 O ATOM 834 HA GLU A 714 4.474 13.038 3.411 1.00 0.00 H ATOM 835 HB2 GLU A 714 1.905 14.189 4.313 1.00 0.00 H ATOM 836 HB3 GLU A 714 2.161 12.513 4.855 1.00 0.00 H ATOM 837 HG2 GLU A 714 4.346 14.606 5.073 1.00 0.00 H ATOM 838 HG3 GLU A 714 3.116 14.412 6.343 1.00 0.00 H ATOM 839 H GLU A 714 2.287 14.271 1.757 1.00 0.00 H ATOM 840 N VAL A 715 3.347 10.693 3.272 1.00 0.15 N ATOM 841 CA VAL A 715 2.977 9.360 2.800 1.00 0.15 C ATOM 842 C VAL A 715 2.061 8.636 3.788 1.00 0.16 C ATOM 843 O VAL A 715 2.317 8.621 4.990 1.00 0.24 O ATOM 844 CB VAL A 715 4.241 8.526 2.598 1.00 0.17 C ATOM 845 CG1 VAL A 715 3.864 7.146 2.071 1.00 0.27 C ATOM 846 CG2 VAL A 715 5.168 9.208 1.595 1.00 0.28 C ATOM 847 HA VAL A 715 2.437 9.480 1.861 1.00 0.00 H ATOM 848 HB VAL A 715 4.755 8.430 3.555 1.00 0.00 H ATOM 849 HG11 VAL A 715 3.213 6.649 2.790 1.00 0.00 H ATOM 850 HG12 VAL A 715 3.343 7.252 1.119 1.00 0.00 H ATOM 851 HG13 VAL A 715 4.768 6.554 1.928 1.00 0.00 H ATOM 852 HG21 VAL A 715 4.653 9.314 0.640 1.00 0.00 H ATOM 853 HG22 VAL A 715 5.446 10.193 1.970 1.00 0.00 H ATOM 854 HG23 VAL A 715 6.064 8.603 1.461 1.00 0.00 H ATOM 855 H VAL A 715 3.937 10.790 4.123 1.00 0.00 H ATOM 856 N LYS A 716 1.009 8.008 3.259 1.00 0.14 N ATOM 857 CA LYS A 716 0.072 7.248 4.093 1.00 0.15 C ATOM 858 C LYS A 716 0.318 5.747 3.904 1.00 0.15 C ATOM 859 O LYS A 716 0.032 5.194 2.836 1.00 0.19 O ATOM 860 CB LYS A 716 -1.382 7.582 3.709 1.00 0.17 C ATOM 861 CG LYS A 716 -2.329 7.290 4.896 1.00 0.20 C ATOM 862 CD LYS A 716 -3.407 8.392 5.005 1.00 0.19 C ATOM 863 CE LYS A 716 -2.735 9.771 5.107 1.00 0.27 C ATOM 864 NZ LYS A 716 -3.454 10.637 6.092 1.00 0.53 N ATOM 865 HA LYS A 716 0.232 7.519 5.137 1.00 0.00 H ATOM 866 HB2 LYS A 716 -1.451 8.637 3.444 1.00 0.00 H ATOM 867 HB3 LYS A 716 -1.678 6.974 2.854 1.00 0.00 H ATOM 868 HG2 LYS A 716 -2.814 6.326 4.741 1.00 0.00 H ATOM 869 HG3 LYS A 716 -1.750 7.260 5.819 1.00 0.00 H ATOM 870 HD2 LYS A 716 -4.044 8.364 4.121 1.00 0.00 H ATOM 871 HD3 LYS A 716 -4.014 8.218 5.894 1.00 0.00 H ATOM 872 HE2 LYS A 716 -2.752 10.251 4.129 1.00 0.00 H ATOM 873 HE3 LYS A 716 -1.702 9.643 5.430 1.00 0.00 H ATOM 874 HZ1 LYS A 716 -4.440 10.764 5.785 1.00 0.00 H ATOM 875 HZ2 LYS A 716 -3.437 10.184 7.028 1.00 0.00 H ATOM 876 HZ3 LYS A 716 -2.984 11.563 6.145 1.00 0.00 H ATOM 877 H LYS A 716 0.850 8.059 2.232 1.00 0.00 H ATOM 878 N HIS A 717 0.850 5.093 4.938 1.00 0.16 N ATOM 879 CA HIS A 717 1.121 3.653 4.868 1.00 0.17 C ATOM 880 C HIS A 717 0.074 2.893 5.674 1.00 0.18 C ATOM 881 O HIS A 717 0.111 2.905 6.901 1.00 0.22 O ATOM 882 CB HIS A 717 2.500 3.316 5.457 1.00 0.21 C ATOM 883 CG HIS A 717 3.586 4.156 4.845 1.00 0.18 C ATOM 884 ND1 HIS A 717 4.462 3.650 3.897 1.00 0.20 N ATOM 885 CD2 HIS A 717 3.991 5.443 5.080 1.00 0.19 C ATOM 886 CE1 HIS A 717 5.346 4.624 3.605 1.00 0.21 C ATOM 887 NE2 HIS A 717 5.097 5.739 4.302 1.00 0.20 N ATOM 888 HA HIS A 717 1.093 3.364 3.817 1.00 0.00 H ATOM 889 HB2 HIS A 717 2.478 3.494 6.532 1.00 0.00 H ATOM 890 HB3 HIS A 717 2.718 2.265 5.269 1.00 0.00 H ATOM 891 HD2 HIS A 717 3.513 6.132 5.776 1.00 0.00 H ATOM 892 HE1 HIS A 717 6.162 4.517 2.890 1.00 0.00 H ATOM 893 H HIS A 717 1.077 5.613 5.809 1.00 0.00 H ATOM 894 N ILE A 718 -0.842 2.216 4.996 1.00 0.18 N ATOM 895 CA ILE A 718 -1.873 1.456 5.698 1.00 0.20 C ATOM 896 C ILE A 718 -1.614 -0.034 5.521 1.00 0.19 C ATOM 897 O ILE A 718 -1.340 -0.502 4.412 1.00 0.20 O ATOM 898 CB ILE A 718 -3.267 1.838 5.167 1.00 0.21 C ATOM 899 CG1 ILE A 718 -3.856 2.986 6.001 1.00 0.23 C ATOM 900 CG2 ILE A 718 -4.215 0.635 5.229 1.00 0.27 C ATOM 901 CD1 ILE A 718 -4.222 2.492 7.399 1.00 0.30 C ATOM 902 HA ILE A 718 -1.840 1.693 6.761 1.00 0.00 H ATOM 903 HB ILE A 718 -3.159 2.157 4.130 1.00 0.00 H ATOM 904 HG12 ILE A 718 -3.120 3.786 6.083 1.00 0.00 H ATOM 905 HG13 ILE A 718 -4.751 3.367 5.508 1.00 0.00 H ATOM 906 HD11 ILE A 718 -4.960 1.694 7.319 1.00 0.00 H ATOM 907 HD12 ILE A 718 -3.328 2.113 7.895 1.00 0.00 H ATOM 908 HD13 ILE A 718 -4.638 3.317 7.977 1.00 0.00 H ATOM 909 HG21 ILE A 718 -3.813 -0.174 4.619 1.00 0.00 H ATOM 910 HG22 ILE A 718 -4.309 0.301 6.262 1.00 0.00 H ATOM 911 HG23 ILE A 718 -5.194 0.926 4.849 1.00 0.00 H ATOM 912 H ILE A 718 -0.826 2.226 3.956 1.00 0.00 H ATOM 913 N LYS A 719 -1.676 -0.771 6.626 1.00 0.22 N ATOM 914 CA LYS A 719 -1.423 -2.206 6.591 1.00 0.23 C ATOM 915 C LYS A 719 -2.619 -2.959 6.030 1.00 0.23 C ATOM 916 O LYS A 719 -3.769 -2.552 6.212 1.00 0.31 O ATOM 917 CB LYS A 719 -1.109 -2.715 8.002 1.00 0.29 C ATOM 918 CG LYS A 719 -2.360 -2.613 8.881 1.00 0.47 C ATOM 919 CD LYS A 719 -1.939 -2.437 10.342 1.00 0.60 C ATOM 920 CE LYS A 719 -3.182 -2.268 11.220 1.00 0.64 C ATOM 921 NZ LYS A 719 -2.811 -1.519 12.452 1.00 0.54 N ATOM 922 HA LYS A 719 -0.568 -2.384 5.939 1.00 0.00 H ATOM 923 HB2 LYS A 719 -0.788 -3.755 7.949 1.00 0.00 H ATOM 924 HB3 LYS A 719 -0.312 -2.112 8.436 1.00 0.00 H ATOM 925 HG2 LYS A 719 -2.956 -1.756 8.568 1.00 0.00 H ATOM 926 HG3 LYS A 719 -2.952 -3.523 8.779 1.00 0.00 H ATOM 927 HD2 LYS A 719 -1.382 -3.316 10.667 1.00 0.00 H ATOM 928 HD3 LYS A 719 -1.307 -1.553 10.434 1.00 0.00 H ATOM 929 HE2 LYS A 719 -3.573 -3.248 11.492 1.00 0.00 H ATOM 930 HE3 LYS A 719 -3.944 -1.714 10.672 1.00 0.00 H ATOM 931 HZ1 LYS A 719 -2.084 -2.049 12.973 1.00 0.00 H ATOM 932 HZ2 LYS A 719 -2.438 -0.584 12.189 1.00 0.00 H ATOM 933 HZ3 LYS A 719 -3.653 -1.402 13.052 1.00 0.00 H ATOM 934 H LYS A 719 -1.909 -0.315 7.531 1.00 0.00 H ATOM 935 N ILE A 720 -2.336 -4.060 5.353 1.00 0.21 N ATOM 936 CA ILE A 720 -3.385 -4.878 4.770 1.00 0.22 C ATOM 937 C ILE A 720 -3.638 -6.097 5.655 1.00 0.23 C ATOM 938 O ILE A 720 -2.703 -6.782 6.065 1.00 0.38 O ATOM 939 CB ILE A 720 -2.972 -5.327 3.366 1.00 0.24 C ATOM 940 CG1 ILE A 720 -3.013 -4.125 2.423 1.00 0.28 C ATOM 941 CG2 ILE A 720 -3.942 -6.398 2.859 1.00 0.34 C ATOM 942 CD1 ILE A 720 -2.552 -4.557 1.033 1.00 0.33 C ATOM 943 HA ILE A 720 -4.302 -4.292 4.699 1.00 0.00 H ATOM 944 HB ILE A 720 -1.964 -5.739 3.400 1.00 0.00 H ATOM 945 HG12 ILE A 720 -4.032 -3.741 2.366 1.00 0.00 H ATOM 946 HG13 ILE A 720 -2.352 -3.344 2.799 1.00 0.00 H ATOM 947 HD11 ILE A 720 -1.533 -4.940 1.092 1.00 0.00 H ATOM 948 HD12 ILE A 720 -3.214 -5.338 0.658 1.00 0.00 H ATOM 949 HD13 ILE A 720 -2.581 -3.700 0.360 1.00 0.00 H ATOM 950 HG21 ILE A 720 -3.921 -7.254 3.533 1.00 0.00 H ATOM 951 HG22 ILE A 720 -4.951 -5.986 2.825 1.00 0.00 H ATOM 952 HG23 ILE A 720 -3.643 -6.713 1.859 1.00 0.00 H ATOM 953 H ILE A 720 -1.343 -4.345 5.236 1.00 0.00 H ATOM 954 N MET A 721 -4.902 -6.370 5.954 1.00 0.23 N ATOM 955 CA MET A 721 -5.232 -7.517 6.800 1.00 0.25 C ATOM 956 C MET A 721 -5.341 -8.803 5.988 1.00 0.27 C ATOM 957 O MET A 721 -5.689 -8.777 4.805 1.00 0.33 O ATOM 958 CB MET A 721 -6.550 -7.275 7.524 1.00 0.29 C ATOM 959 CG MET A 721 -6.626 -8.186 8.749 1.00 0.39 C ATOM 960 SD MET A 721 -8.259 -8.026 9.517 1.00 0.62 S ATOM 961 CE MET A 721 -7.746 -8.372 11.219 1.00 1.47 C ATOM 962 HA MET A 721 -4.424 -7.630 7.522 1.00 0.00 H ATOM 963 HB2 MET A 721 -6.607 -6.233 7.840 1.00 0.00 H ATOM 964 HB3 MET A 721 -7.380 -7.496 6.853 1.00 0.00 H ATOM 965 HG2 MET A 721 -5.857 -7.898 9.465 1.00 0.00 H ATOM 966 HG3 MET A 721 -6.467 -9.220 8.444 1.00 0.00 H ATOM 967 HE1 MET A 721 -7.305 -9.368 11.269 1.00 0.00 H ATOM 968 HE2 MET A 721 -7.011 -7.631 11.533 1.00 0.00 H ATOM 969 HE3 MET A 721 -8.615 -8.325 11.876 1.00 0.00 H ATOM 970 H MET A 721 -5.663 -5.765 5.585 1.00 0.00 H ATOM 971 N THR A 722 -5.051 -9.924 6.646 1.00 0.32 N ATOM 972 CA THR A 722 -5.123 -11.233 6.002 1.00 0.37 C ATOM 973 C THR A 722 -5.742 -12.262 6.941 1.00 0.44 C ATOM 974 O THR A 722 -5.368 -12.360 8.109 1.00 0.57 O ATOM 975 CB THR A 722 -3.724 -11.687 5.591 1.00 0.46 C ATOM 976 OG1 THR A 722 -2.799 -11.372 6.622 1.00 0.55 O ATOM 977 CG2 THR A 722 -3.326 -10.959 4.316 1.00 0.48 C ATOM 978 HA THR A 722 -5.752 -11.147 5.116 1.00 0.00 H ATOM 979 HB THR A 722 -3.720 -12.764 5.422 1.00 0.00 H ATOM 980 HG1 THR A 722 -3.065 -11.836 7.455 1.00 0.00 H ATOM 981 HG23 THR A 722 -4.036 -11.200 3.525 1.00 0.00 H ATOM 982 HG21 THR A 722 -3.332 -9.884 4.496 1.00 0.00 H ATOM 983 HG22 THR A 722 -2.326 -11.273 4.017 1.00 0.00 H ATOM 984 H THR A 722 -4.766 -9.866 7.644 1.00 0.00 H ATOM 985 N ALA A 723 -6.700 -13.021 6.420 1.00 0.43 N ATOM 986 CA ALA A 723 -7.379 -14.034 7.220 1.00 0.51 C ATOM 987 C ALA A 723 -7.998 -15.100 6.328 1.00 0.51 C ATOM 988 O ALA A 723 -7.540 -16.240 6.273 1.00 0.60 O ATOM 989 CB ALA A 723 -8.487 -13.372 8.040 1.00 0.55 C ATOM 990 HA ALA A 723 -6.647 -14.503 7.878 1.00 0.00 H ATOM 991 HB1 ALA A 723 -8.051 -12.619 8.697 1.00 0.00 H ATOM 992 HB2 ALA A 723 -9.202 -12.898 7.367 1.00 0.00 H ATOM 993 HB3 ALA A 723 -8.995 -14.128 8.638 1.00 0.00 H ATOM 994 H ALA A 723 -6.970 -12.890 5.424 1.00 0.00 H ATOM 995 N GLU A 724 -9.045 -14.700 5.633 1.00 0.44 N ATOM 996 CA GLU A 724 -9.769 -15.577 4.734 1.00 0.45 C ATOM 997 C GLU A 724 -9.108 -15.566 3.356 1.00 0.41 C ATOM 998 O GLU A 724 -9.777 -15.632 2.317 1.00 0.44 O ATOM 999 CB GLU A 724 -11.216 -15.077 4.633 1.00 0.47 C ATOM 1000 CG GLU A 724 -11.607 -14.304 5.913 1.00 0.49 C ATOM 1001 CD GLU A 724 -11.162 -12.837 5.833 1.00 0.46 C ATOM 1002 OE1 GLU A 724 -10.122 -12.578 5.252 1.00 0.50 O ATOM 1003 OE2 GLU A 724 -11.857 -11.989 6.375 1.00 0.49 O ATOM 1004 HA GLU A 724 -9.757 -16.599 5.112 1.00 0.00 H ATOM 1005 HB2 GLU A 724 -11.309 -14.416 3.771 1.00 0.00 H ATOM 1006 HB3 GLU A 724 -11.884 -15.930 4.509 1.00 0.00 H ATOM 1007 HG2 GLU A 724 -12.690 -14.341 6.035 1.00 0.00 H ATOM 1008 HG3 GLU A 724 -11.130 -14.774 6.773 1.00 0.00 H ATOM 1009 H GLU A 724 -9.364 -13.715 5.734 1.00 0.00 H ATOM 1010 N GLY A 725 -7.784 -15.448 3.349 1.00 0.41 N ATOM 1011 CA GLY A 725 -7.049 -15.392 2.094 1.00 0.41 C ATOM 1012 C GLY A 725 -7.461 -14.143 1.330 1.00 0.36 C ATOM 1013 O GLY A 725 -7.328 -14.073 0.108 1.00 0.40 O ATOM 1014 HA3 GLY A 725 -7.276 -16.276 1.498 1.00 0.00 H ATOM 1015 HA2 GLY A 725 -5.979 -15.358 2.299 1.00 0.00 H ATOM 1016 H GLY A 725 -7.268 -15.395 4.250 1.00 0.00 H ATOM 1017 N LEU A 726 -7.983 -13.164 2.068 1.00 0.32 N ATOM 1018 CA LEU A 726 -8.432 -11.911 1.471 1.00 0.29 C ATOM 1019 C LEU A 726 -7.507 -10.767 1.864 1.00 0.30 C ATOM 1020 O LEU A 726 -6.870 -10.803 2.917 1.00 0.45 O ATOM 1021 CB LEU A 726 -9.851 -11.577 1.941 1.00 0.31 C ATOM 1022 CG LEU A 726 -10.832 -12.636 1.438 1.00 0.31 C ATOM 1023 CD1 LEU A 726 -12.044 -12.693 2.369 1.00 0.37 C ATOM 1024 CD2 LEU A 726 -11.294 -12.277 0.023 1.00 0.34 C ATOM 1025 HA LEU A 726 -8.420 -12.034 0.388 1.00 0.00 H ATOM 1026 HB2 LEU A 726 -9.874 -11.552 3.030 1.00 0.00 H ATOM 1027 HB3 LEU A 726 -10.141 -10.602 1.550 1.00 0.00 H ATOM 1028 HG LEU A 726 -10.338 -13.608 1.423 1.00 0.00 H ATOM 1029 HD21 LEU A 726 -11.786 -11.305 0.039 1.00 0.00 H ATOM 1030 HD22 LEU A 726 -10.430 -12.238 -0.641 1.00 0.00 H ATOM 1031 HD23 LEU A 726 -11.993 -13.034 -0.333 1.00 0.00 H ATOM 1032 HD11 LEU A 726 -11.715 -12.951 3.376 1.00 0.00 H ATOM 1033 HD12 LEU A 726 -12.535 -11.720 2.384 1.00 0.00 H ATOM 1034 HD13 LEU A 726 -12.742 -13.449 2.009 1.00 0.00 H ATOM 1035 H LEU A 726 -8.073 -13.297 3.096 1.00 0.00 H ATOM 1036 N TYR A 727 -7.449 -9.754 1.013 1.00 0.22 N ATOM 1037 CA TYR A 727 -6.609 -8.589 1.272 1.00 0.21 C ATOM 1038 C TYR A 727 -7.471 -7.353 1.532 1.00 0.20 C ATOM 1039 O TYR A 727 -8.340 -7.018 0.724 1.00 0.23 O ATOM 1040 CB TYR A 727 -5.705 -8.328 0.063 1.00 0.23 C ATOM 1041 CG TYR A 727 -4.828 -9.533 -0.190 1.00 0.24 C ATOM 1042 CD1 TYR A 727 -5.289 -10.577 -1.002 1.00 0.31 C ATOM 1043 CD2 TYR A 727 -3.553 -9.604 0.379 1.00 0.30 C ATOM 1044 CE1 TYR A 727 -4.476 -11.691 -1.241 1.00 0.36 C ATOM 1045 CE2 TYR A 727 -2.739 -10.717 0.139 1.00 0.36 C ATOM 1046 CZ TYR A 727 -3.201 -11.760 -0.671 1.00 0.36 C ATOM 1047 OH TYR A 727 -2.399 -12.856 -0.907 1.00 0.45 O ATOM 1048 HA TYR A 727 -6.001 -8.789 2.154 1.00 0.00 H ATOM 1049 HB3 TYR A 727 -5.078 -7.459 0.261 1.00 0.00 H ATOM 1050 HB2 TYR A 727 -6.321 -8.138 -0.816 1.00 0.00 H ATOM 1051 HD2 TYR A 727 -3.192 -8.792 1.010 1.00 0.00 H ATOM 1052 HE2 TYR A 727 -1.745 -10.771 0.583 1.00 0.00 H ATOM 1053 HE1 TYR A 727 -4.836 -12.504 -1.871 1.00 0.00 H ATOM 1054 HD1 TYR A 727 -6.282 -10.522 -1.448 1.00 0.00 H ATOM 1055 HH TYR A 727 -1.562 -12.563 -1.347 1.00 0.00 H ATOM 1056 H TYR A 727 -8.015 -9.789 0.141 1.00 0.00 H ATOM 1057 N ARG A 728 -7.231 -6.679 2.655 1.00 0.19 N ATOM 1058 CA ARG A 728 -7.998 -5.482 2.988 1.00 0.18 C ATOM 1059 C ARG A 728 -7.153 -4.449 3.731 1.00 0.18 C ATOM 1060 O ARG A 728 -6.420 -4.776 4.667 1.00 0.22 O ATOM 1061 CB ARG A 728 -9.216 -5.839 3.837 1.00 0.19 C ATOM 1062 CG ARG A 728 -8.896 -7.023 4.764 1.00 0.23 C ATOM 1063 CD ARG A 728 -9.583 -6.829 6.123 1.00 0.25 C ATOM 1064 NE ARG A 728 -9.663 -8.110 6.834 1.00 0.29 N ATOM 1065 CZ ARG A 728 -10.547 -9.044 6.505 1.00 0.28 C ATOM 1066 NH1 ARG A 728 -11.451 -8.811 5.610 1.00 0.27 N ATOM 1067 NH2 ARG A 728 -10.525 -10.191 7.106 1.00 0.35 N ATOM 1068 HA ARG A 728 -8.324 -5.045 2.044 1.00 0.00 H ATOM 1069 HB2 ARG A 728 -9.499 -4.976 4.440 1.00 0.00 H ATOM 1070 HB3 ARG A 728 -10.044 -6.109 3.182 1.00 0.00 H ATOM 1071 HG2 ARG A 728 -9.254 -7.946 4.307 1.00 0.00 H ATOM 1072 HG3 ARG A 728 -7.818 -7.086 4.910 1.00 0.00 H ATOM 1073 HD2 ARG A 728 -10.589 -6.439 5.967 1.00 0.00 H ATOM 1074 HD3 ARG A 728 -9.009 -6.120 6.720 1.00 0.00 H ATOM 1075 HE ARG A 728 -9.007 -8.292 7.620 1.00 0.00 H ATOM 1076 HH12 ARG A 728 -12.138 -9.550 5.360 1.00 0.00 H ATOM 1077 HH11 ARG A 728 -11.491 -7.884 5.140 1.00 0.00 H ATOM 1078 HH22 ARG A 728 -11.216 -10.925 6.851 1.00 0.00 H ATOM 1079 HH21 ARG A 728 -9.816 -10.378 7.844 1.00 0.00 H ATOM 1080 H ARG A 728 -6.488 -7.009 3.303 1.00 0.00 H ATOM 1081 N ILE A 729 -7.294 -3.197 3.306 1.00 0.18 N ATOM 1082 CA ILE A 729 -6.573 -2.086 3.921 1.00 0.19 C ATOM 1083 C ILE A 729 -7.290 -1.647 5.182 1.00 0.21 C ATOM 1084 O ILE A 729 -6.797 -0.822 5.951 1.00 0.37 O ATOM 1085 CB ILE A 729 -6.493 -0.905 2.950 1.00 0.20 C ATOM 1086 CG1 ILE A 729 -7.762 -0.852 2.082 1.00 0.21 C ATOM 1087 CG2 ILE A 729 -5.255 -1.062 2.066 1.00 0.26 C ATOM 1088 CD1 ILE A 729 -7.633 -1.790 0.879 1.00 0.25 C ATOM 1089 HA ILE A 729 -5.564 -2.417 4.167 1.00 0.00 H ATOM 1090 HB ILE A 729 -6.418 0.025 3.513 1.00 0.00 H ATOM 1091 HG12 ILE A 729 -8.620 -1.155 2.682 1.00 0.00 H ATOM 1092 HG13 ILE A 729 -7.911 0.168 1.727 1.00 0.00 H ATOM 1093 HD11 ILE A 729 -6.778 -1.487 0.274 1.00 0.00 H ATOM 1094 HD12 ILE A 729 -7.488 -2.812 1.230 1.00 0.00 H ATOM 1095 HD13 ILE A 729 -8.542 -1.737 0.279 1.00 0.00 H ATOM 1096 HG21 ILE A 729 -4.363 -1.082 2.692 1.00 0.00 H ATOM 1097 HG22 ILE A 729 -5.327 -1.993 1.504 1.00 0.00 H ATOM 1098 HG23 ILE A 729 -5.196 -0.222 1.374 1.00 0.00 H ATOM 1099 H ILE A 729 -7.937 -3.003 2.512 1.00 0.00 H ATOM 1100 N THR A 730 -8.464 -2.210 5.382 1.00 0.20 N ATOM 1101 CA THR A 730 -9.263 -1.893 6.543 1.00 0.20 C ATOM 1102 C THR A 730 -10.012 -3.132 7.001 1.00 0.20 C ATOM 1103 O THR A 730 -10.600 -3.868 6.200 1.00 0.24 O ATOM 1104 CB THR A 730 -10.229 -0.747 6.217 1.00 0.22 C ATOM 1105 OG1 THR A 730 -10.679 -0.131 7.420 1.00 0.25 O ATOM 1106 CG2 THR A 730 -11.428 -1.275 5.433 1.00 0.24 C ATOM 1107 HA THR A 730 -8.615 -1.565 7.356 1.00 0.00 H ATOM 1108 HB THR A 730 -9.703 -0.010 5.610 1.00 0.00 H ATOM 1109 HG1 THR A 730 -11.301 0.607 7.199 1.00 0.00 H ATOM 1110 HG23 THR A 730 -11.080 -1.746 4.513 1.00 0.00 H ATOM 1111 HG21 THR A 730 -11.962 -2.008 6.038 1.00 0.00 H ATOM 1112 HG22 THR A 730 -12.094 -0.447 5.190 1.00 0.00 H ATOM 1113 H THR A 730 -8.823 -2.897 4.689 1.00 0.00 H ATOM 1114 N GLU A 731 -9.969 -3.342 8.297 1.00 0.19 N ATOM 1115 CA GLU A 731 -10.613 -4.471 8.954 1.00 0.22 C ATOM 1116 C GLU A 731 -12.065 -4.638 8.503 1.00 0.22 C ATOM 1117 O GLU A 731 -12.743 -5.587 8.897 1.00 0.27 O ATOM 1118 CB GLU A 731 -10.572 -4.192 10.455 1.00 0.24 C ATOM 1119 CG GLU A 731 -11.035 -2.751 10.687 1.00 0.25 C ATOM 1120 CD GLU A 731 -9.818 -1.834 10.786 1.00 0.27 C ATOM 1121 OE1 GLU A 731 -9.180 -1.616 9.766 1.00 0.27 O ATOM 1122 OE2 GLU A 731 -9.529 -1.369 11.867 1.00 0.35 O ATOM 1123 HA GLU A 731 -10.091 -5.393 8.697 1.00 0.00 H ATOM 1124 HB2 GLU A 731 -11.235 -4.882 10.977 1.00 0.00 H ATOM 1125 HB3 GLU A 731 -9.555 -4.317 10.826 1.00 0.00 H ATOM 1126 HG2 GLU A 731 -11.663 -2.433 9.855 1.00 0.00 H ATOM 1127 HG3 GLU A 731 -11.607 -2.698 11.614 1.00 0.00 H ATOM 1128 H GLU A 731 -9.446 -2.664 8.887 1.00 0.00 H ATOM 1129 N LYS A 732 -12.542 -3.687 7.712 1.00 0.22 N ATOM 1130 CA LYS A 732 -13.922 -3.698 7.246 1.00 0.25 C ATOM 1131 C LYS A 732 -14.061 -4.153 5.780 1.00 0.26 C ATOM 1132 O LYS A 732 -15.174 -4.221 5.259 1.00 0.36 O ATOM 1133 CB LYS A 732 -14.487 -2.287 7.399 1.00 0.28 C ATOM 1134 CG LYS A 732 -13.973 -1.709 8.713 1.00 0.33 C ATOM 1135 CD LYS A 732 -14.649 -0.377 9.011 1.00 0.38 C ATOM 1136 CE LYS A 732 -13.948 0.245 10.212 1.00 0.44 C ATOM 1137 NZ LYS A 732 -14.432 1.642 10.414 1.00 0.42 N ATOM 1138 HA LYS A 732 -14.475 -4.419 7.848 1.00 0.00 H ATOM 1139 HB2 LYS A 732 -14.157 -1.665 6.567 1.00 0.00 H ATOM 1140 HB3 LYS A 732 -15.576 -2.325 7.413 1.00 0.00 H ATOM 1141 HG2 LYS A 732 -14.187 -2.409 9.521 1.00 0.00 H ATOM 1142 HG3 LYS A 732 -12.896 -1.557 8.641 1.00 0.00 H ATOM 1143 HD2 LYS A 732 -14.563 0.284 8.148 1.00 0.00 H ATOM 1144 HD3 LYS A 732 -15.702 -0.539 9.239 1.00 0.00 H ATOM 1145 HE2 LYS A 732 -12.872 0.256 10.037 1.00 0.00 H ATOM 1146 HE3 LYS A 732 -14.164 -0.345 11.103 1.00 0.00 H ATOM 1147 HZ1 LYS A 732 -14.225 2.206 9.565 1.00 0.00 H ATOM 1148 HZ2 LYS A 732 -15.458 1.631 10.582 1.00 0.00 H ATOM 1149 HZ3 LYS A 732 -13.949 2.060 11.235 1.00 0.00 H ATOM 1150 H LYS A 732 -11.914 -2.912 7.416 1.00 0.00 H ATOM 1151 N LYS A 733 -12.940 -4.436 5.109 1.00 0.21 N ATOM 1152 CA LYS A 733 -12.988 -4.852 3.695 1.00 0.22 C ATOM 1153 C LYS A 733 -12.289 -6.197 3.467 1.00 0.22 C ATOM 1154 O LYS A 733 -11.875 -6.867 4.416 1.00 0.24 O ATOM 1155 CB LYS A 733 -12.330 -3.765 2.833 1.00 0.25 C ATOM 1156 CG LYS A 733 -13.074 -3.622 1.499 1.00 0.29 C ATOM 1157 CD LYS A 733 -14.149 -2.530 1.608 1.00 0.28 C ATOM 1158 CE LYS A 733 -13.554 -1.174 1.223 1.00 0.32 C ATOM 1159 NZ LYS A 733 -13.315 -1.142 -0.249 1.00 0.35 N ATOM 1160 HA LYS A 733 -14.033 -4.980 3.412 1.00 0.00 H ATOM 1161 HB2 LYS A 733 -12.361 -2.815 3.366 1.00 0.00 H ATOM 1162 HB3 LYS A 733 -11.293 -4.038 2.639 1.00 0.00 H ATOM 1163 HG2 LYS A 733 -12.364 -3.353 0.717 1.00 0.00 H ATOM 1164 HG3 LYS A 733 -13.548 -4.571 1.247 1.00 0.00 H ATOM 1165 HD2 LYS A 733 -14.975 -2.767 0.937 1.00 0.00 H ATOM 1166 HD3 LYS A 733 -14.517 -2.486 2.633 1.00 0.00 H ATOM 1167 HE2 LYS A 733 -12.611 -1.027 1.749 1.00 0.00 H ATOM 1168 HE3 LYS A 733 -14.249 -0.380 1.497 1.00 0.00 H ATOM 1169 HZ1 LYS A 733 -12.652 -1.900 -0.508 1.00 0.00 H ATOM 1170 HZ2 LYS A 733 -14.216 -1.282 -0.748 1.00 0.00 H ATOM 1171 HZ3 LYS A 733 -12.910 -0.221 -0.513 1.00 0.00 H ATOM 1172 H LYS A 733 -12.021 -4.362 5.591 1.00 0.00 H ATOM 1173 N ALA A 734 -12.168 -6.590 2.196 1.00 0.22 N ATOM 1174 CA ALA A 734 -11.518 -7.858 1.849 1.00 0.23 C ATOM 1175 C ALA A 734 -11.469 -8.089 0.329 1.00 0.23 C ATOM 1176 O ALA A 734 -12.504 -8.135 -0.334 1.00 0.32 O ATOM 1177 CB ALA A 734 -12.264 -9.021 2.516 1.00 0.27 C ATOM 1178 HA ALA A 734 -10.491 -7.808 2.211 1.00 0.00 H ATOM 1179 HB1 ALA A 734 -12.246 -8.889 3.598 1.00 0.00 H ATOM 1180 HB2 ALA A 734 -13.297 -9.036 2.167 1.00 0.00 H ATOM 1181 HB3 ALA A 734 -11.777 -9.961 2.255 1.00 0.00 H ATOM 1182 H ALA A 734 -12.542 -5.985 1.438 1.00 0.00 H ATOM 1183 N PHE A 735 -10.257 -8.265 -0.207 1.00 0.19 N ATOM 1184 CA PHE A 735 -10.077 -8.530 -1.642 1.00 0.20 C ATOM 1185 C PHE A 735 -9.365 -9.863 -1.828 1.00 0.21 C ATOM 1186 O PHE A 735 -8.715 -10.350 -0.906 1.00 0.25 O ATOM 1187 CB PHE A 735 -9.264 -7.415 -2.313 1.00 0.19 C ATOM 1188 CG PHE A 735 -10.181 -6.260 -2.620 1.00 0.19 C ATOM 1189 CD1 PHE A 735 -10.759 -5.531 -1.575 1.00 0.21 C ATOM 1190 CD2 PHE A 735 -10.462 -5.927 -3.949 1.00 0.20 C ATOM 1191 CE1 PHE A 735 -11.623 -4.467 -1.863 1.00 0.23 C ATOM 1192 CE2 PHE A 735 -11.326 -4.867 -4.236 1.00 0.22 C ATOM 1193 CZ PHE A 735 -11.908 -4.137 -3.192 1.00 0.23 C ATOM 1194 HA PHE A 735 -11.061 -8.565 -2.110 1.00 0.00 H ATOM 1195 HB2 PHE A 735 -8.471 -7.085 -1.642 1.00 0.00 H ATOM 1196 HB3 PHE A 735 -8.823 -7.789 -3.237 1.00 0.00 H ATOM 1197 HD2 PHE A 735 -10.007 -6.494 -4.761 1.00 0.00 H ATOM 1198 HE2 PHE A 735 -11.547 -4.608 -5.272 1.00 0.00 H ATOM 1199 HZ PHE A 735 -12.583 -3.311 -3.415 1.00 0.00 H ATOM 1200 HE1 PHE A 735 -12.073 -3.896 -1.051 1.00 0.00 H ATOM 1201 HD1 PHE A 735 -10.538 -5.790 -0.540 1.00 0.00 H ATOM 1202 H PHE A 735 -9.419 -8.213 0.407 1.00 0.00 H ATOM 1203 N ARG A 736 -9.486 -10.458 -3.009 1.00 0.22 N ATOM 1204 CA ARG A 736 -8.843 -11.748 -3.262 1.00 0.25 C ATOM 1205 C ARG A 736 -7.384 -11.572 -3.660 1.00 0.27 C ATOM 1206 O ARG A 736 -6.596 -12.515 -3.595 1.00 0.35 O ATOM 1207 CB ARG A 736 -9.591 -12.499 -4.362 1.00 0.30 C ATOM 1208 CG ARG A 736 -10.780 -13.236 -3.743 1.00 0.36 C ATOM 1209 CD ARG A 736 -10.497 -14.745 -3.693 1.00 0.43 C ATOM 1210 NE ARG A 736 -10.823 -15.281 -2.368 1.00 0.45 N ATOM 1211 CZ ARG A 736 -9.988 -15.174 -1.344 1.00 0.43 C ATOM 1212 NH1 ARG A 736 -8.841 -14.596 -1.502 1.00 0.41 N ATOM 1213 NH2 ARG A 736 -10.326 -15.655 -0.188 1.00 0.48 N ATOM 1214 HA ARG A 736 -8.876 -12.326 -2.338 1.00 0.00 H ATOM 1215 HB2 ARG A 736 -9.949 -11.791 -5.110 1.00 0.00 H ATOM 1216 HB3 ARG A 736 -8.921 -13.217 -4.835 1.00 0.00 H ATOM 1217 HG2 ARG A 736 -10.947 -12.866 -2.731 1.00 0.00 H ATOM 1218 HG3 ARG A 736 -11.670 -13.055 -4.346 1.00 0.00 H ATOM 1219 HD2 ARG A 736 -9.442 -14.920 -3.902 1.00 0.00 H ATOM 1220 HD3 ARG A 736 -11.104 -15.250 -4.445 1.00 0.00 H ATOM 1221 HE ARG A 736 -11.736 -15.759 -2.227 1.00 0.00 H ATOM 1222 HH12 ARG A 736 -8.186 -14.512 -0.699 1.00 0.00 H ATOM 1223 HH11 ARG A 736 -8.574 -14.215 -2.432 1.00 0.00 H ATOM 1224 HH22 ARG A 736 -9.675 -15.574 0.619 1.00 0.00 H ATOM 1225 HH21 ARG A 736 -11.248 -16.122 -0.068 1.00 0.00 H ATOM 1226 H ARG A 736 -10.043 -10.003 -3.761 1.00 0.00 H ATOM 1227 N GLY A 737 -7.038 -10.361 -4.072 1.00 0.26 N ATOM 1228 CA GLY A 737 -5.668 -10.068 -4.483 1.00 0.29 C ATOM 1229 C GLY A 737 -5.388 -8.569 -4.489 1.00 0.26 C ATOM 1230 O GLY A 737 -6.218 -7.770 -4.930 1.00 0.31 O ATOM 1231 HA3 GLY A 737 -5.509 -10.461 -5.487 1.00 0.00 H ATOM 1232 HA2 GLY A 737 -4.980 -10.553 -3.791 1.00 0.00 H ATOM 1233 H GLY A 737 -7.754 -9.607 -4.103 1.00 0.00 H ATOM 1234 N LEU A 738 -4.199 -8.206 -4.013 1.00 0.26 N ATOM 1235 CA LEU A 738 -3.773 -6.807 -3.970 1.00 0.26 C ATOM 1236 C LEU A 738 -4.173 -6.090 -5.257 1.00 0.25 C ATOM 1237 O LEU A 738 -4.787 -5.018 -5.237 1.00 0.27 O ATOM 1238 CB LEU A 738 -2.240 -6.753 -3.838 1.00 0.30 C ATOM 1239 CG LEU A 738 -1.817 -6.161 -2.489 1.00 0.26 C ATOM 1240 CD1 LEU A 738 -2.377 -4.747 -2.335 1.00 0.28 C ATOM 1241 CD2 LEU A 738 -2.322 -7.047 -1.349 1.00 0.32 C ATOM 1242 HA LEU A 738 -4.251 -6.319 -3.120 1.00 0.00 H ATOM 1243 HB2 LEU A 738 -1.840 -7.763 -3.924 1.00 0.00 H ATOM 1244 HB3 LEU A 738 -1.836 -6.135 -4.640 1.00 0.00 H ATOM 1245 HG LEU A 738 -0.729 -6.116 -2.451 1.00 0.00 H ATOM 1246 HD21 LEU A 738 -3.410 -7.106 -1.391 1.00 0.00 H ATOM 1247 HD22 LEU A 738 -1.898 -8.046 -1.452 1.00 0.00 H ATOM 1248 HD23 LEU A 738 -2.017 -6.618 -0.395 1.00 0.00 H ATOM 1249 HD11 LEU A 738 -1.995 -4.117 -3.138 1.00 0.00 H ATOM 1250 HD12 LEU A 738 -3.465 -4.781 -2.385 1.00 0.00 H ATOM 1251 HD13 LEU A 738 -2.069 -4.338 -1.373 1.00 0.00 H ATOM 1252 H LEU A 738 -3.552 -8.940 -3.660 1.00 0.00 H ATOM 1253 N THR A 739 -3.794 -6.700 -6.370 1.00 0.26 N ATOM 1254 CA THR A 739 -4.067 -6.149 -7.692 1.00 0.26 C ATOM 1255 C THR A 739 -5.551 -5.882 -7.913 1.00 0.25 C ATOM 1256 O THR A 739 -5.912 -4.958 -8.638 1.00 0.29 O ATOM 1257 CB THR A 739 -3.541 -7.116 -8.757 1.00 0.30 C ATOM 1258 OG1 THR A 739 -2.220 -7.501 -8.409 1.00 0.35 O ATOM 1259 CG2 THR A 739 -3.526 -6.436 -10.126 1.00 0.33 C ATOM 1260 HA THR A 739 -3.557 -5.189 -7.768 1.00 0.00 H ATOM 1261 HB THR A 739 -4.190 -7.991 -8.806 1.00 0.00 H ATOM 1262 HG1 THR A 739 -1.869 -8.127 -9.091 1.00 0.00 H ATOM 1263 HG23 THR A 739 -4.540 -6.140 -10.394 1.00 0.00 H ATOM 1264 HG21 THR A 739 -2.887 -5.554 -10.085 1.00 0.00 H ATOM 1265 HG22 THR A 739 -3.140 -7.131 -10.871 1.00 0.00 H ATOM 1266 H THR A 739 -3.284 -7.603 -6.298 1.00 0.00 H ATOM 1267 N GLU A 740 -6.417 -6.666 -7.285 1.00 0.24 N ATOM 1268 CA GLU A 740 -7.844 -6.451 -7.450 1.00 0.25 C ATOM 1269 C GLU A 740 -8.308 -5.377 -6.482 1.00 0.22 C ATOM 1270 O GLU A 740 -9.369 -4.782 -6.646 1.00 0.25 O ATOM 1271 CB GLU A 740 -8.623 -7.749 -7.199 1.00 0.28 C ATOM 1272 CG GLU A 740 -7.809 -8.959 -7.680 1.00 0.34 C ATOM 1273 CD GLU A 740 -7.435 -8.802 -9.152 1.00 0.45 C ATOM 1274 OE1 GLU A 740 -8.281 -9.057 -9.991 1.00 0.74 O ATOM 1275 OE2 GLU A 740 -6.302 -8.436 -9.416 1.00 0.59 O ATOM 1276 HA GLU A 740 -8.033 -6.130 -8.474 1.00 0.00 H ATOM 1277 HB2 GLU A 740 -8.821 -7.849 -6.132 1.00 0.00 H ATOM 1278 HB3 GLU A 740 -9.568 -7.712 -7.741 1.00 0.00 H ATOM 1279 HG2 GLU A 740 -6.899 -9.039 -7.085 1.00 0.00 H ATOM 1280 HG3 GLU A 740 -8.404 -9.864 -7.555 1.00 0.00 H ATOM 1281 H GLU A 740 -6.074 -7.435 -6.674 1.00 0.00 H ATOM 1282 N LEU A 741 -7.490 -5.143 -5.466 1.00 0.20 N ATOM 1283 CA LEU A 741 -7.787 -4.143 -4.456 1.00 0.19 C ATOM 1284 C LEU A 741 -7.289 -2.780 -4.919 1.00 0.19 C ATOM 1285 O LEU A 741 -8.022 -1.791 -4.927 1.00 0.23 O ATOM 1286 CB LEU A 741 -7.108 -4.562 -3.138 1.00 0.20 C ATOM 1287 CG LEU A 741 -7.259 -3.476 -2.066 1.00 0.19 C ATOM 1288 CD1 LEU A 741 -6.195 -2.395 -2.273 1.00 0.20 C ATOM 1289 CD2 LEU A 741 -8.644 -2.846 -2.157 1.00 0.21 C ATOM 1290 HA LEU A 741 -8.863 -4.070 -4.297 1.00 0.00 H ATOM 1291 HB2 LEU A 741 -7.567 -5.483 -2.778 1.00 0.00 H ATOM 1292 HB3 LEU A 741 -6.048 -4.734 -3.323 1.00 0.00 H ATOM 1293 HG LEU A 741 -7.132 -3.928 -1.082 1.00 0.00 H ATOM 1294 HD21 LEU A 741 -8.775 -2.400 -3.143 1.00 0.00 H ATOM 1295 HD22 LEU A 741 -9.402 -3.614 -2.001 1.00 0.00 H ATOM 1296 HD23 LEU A 741 -8.742 -2.076 -1.392 1.00 0.00 H ATOM 1297 HD11 LEU A 741 -5.204 -2.843 -2.197 1.00 0.00 H ATOM 1298 HD12 LEU A 741 -6.319 -1.949 -3.260 1.00 0.00 H ATOM 1299 HD13 LEU A 741 -6.307 -1.626 -1.509 1.00 0.00 H ATOM 1300 H LEU A 741 -6.610 -5.692 -5.390 1.00 0.00 H ATOM 1301 N VAL A 742 -6.025 -2.758 -5.299 1.00 0.19 N ATOM 1302 CA VAL A 742 -5.362 -1.547 -5.762 1.00 0.19 C ATOM 1303 C VAL A 742 -5.974 -1.010 -7.045 1.00 0.20 C ATOM 1304 O VAL A 742 -6.381 0.149 -7.131 1.00 0.24 O ATOM 1305 CB VAL A 742 -3.900 -1.889 -6.037 1.00 0.22 C ATOM 1306 CG1 VAL A 742 -3.164 -0.666 -6.588 1.00 0.26 C ATOM 1307 CG2 VAL A 742 -3.241 -2.360 -4.745 1.00 0.24 C ATOM 1308 HA VAL A 742 -5.471 -0.782 -4.993 1.00 0.00 H ATOM 1309 HB VAL A 742 -3.850 -2.685 -6.780 1.00 0.00 H ATOM 1310 HG11 VAL A 742 -3.637 -0.347 -7.517 1.00 0.00 H ATOM 1311 HG12 VAL A 742 -3.210 0.143 -5.859 1.00 0.00 H ATOM 1312 HG13 VAL A 742 -2.123 -0.926 -6.779 1.00 0.00 H ATOM 1313 HG21 VAL A 742 -3.297 -1.566 -4.000 1.00 0.00 H ATOM 1314 HG22 VAL A 742 -3.760 -3.244 -4.375 1.00 0.00 H ATOM 1315 HG23 VAL A 742 -2.197 -2.605 -4.939 1.00 0.00 H ATOM 1316 H VAL A 742 -5.480 -3.643 -5.266 1.00 0.00 H ATOM 1317 N GLU A 743 -5.980 -1.864 -8.046 1.00 0.20 N ATOM 1318 CA GLU A 743 -6.469 -1.504 -9.363 1.00 0.22 C ATOM 1319 C GLU A 743 -7.967 -1.221 -9.358 1.00 0.23 C ATOM 1320 O GLU A 743 -8.478 -0.530 -10.237 1.00 0.27 O ATOM 1321 CB GLU A 743 -6.122 -2.632 -10.330 1.00 0.24 C ATOM 1322 CG GLU A 743 -4.642 -3.033 -10.136 1.00 0.24 C ATOM 1323 CD GLU A 743 -3.698 -2.206 -11.016 1.00 0.25 C ATOM 1324 OE1 GLU A 743 -4.165 -1.598 -11.967 1.00 0.29 O ATOM 1325 OE2 GLU A 743 -2.510 -2.190 -10.714 1.00 0.39 O ATOM 1326 HA GLU A 743 -5.987 -0.580 -9.683 1.00 0.00 H ATOM 1327 HB2 GLU A 743 -6.762 -3.492 -10.132 1.00 0.00 H ATOM 1328 HB3 GLU A 743 -6.277 -2.294 -11.355 1.00 0.00 H ATOM 1329 HG2 GLU A 743 -4.371 -2.882 -9.091 1.00 0.00 H ATOM 1330 HG3 GLU A 743 -4.527 -4.087 -10.391 1.00 0.00 H ATOM 1331 H GLU A 743 -5.623 -2.828 -7.888 1.00 0.00 H ATOM 1332 N PHE A 744 -8.665 -1.737 -8.357 1.00 0.21 N ATOM 1333 CA PHE A 744 -10.097 -1.507 -8.252 1.00 0.22 C ATOM 1334 C PHE A 744 -10.360 -0.149 -7.617 1.00 0.21 C ATOM 1335 O PHE A 744 -11.323 0.539 -7.958 1.00 0.27 O ATOM 1336 CB PHE A 744 -10.722 -2.607 -7.401 1.00 0.23 C ATOM 1337 CG PHE A 744 -12.156 -2.263 -7.070 1.00 0.27 C ATOM 1338 CD1 PHE A 744 -13.092 -2.063 -8.090 1.00 0.43 C ATOM 1339 CD2 PHE A 744 -12.546 -2.149 -5.732 1.00 0.28 C ATOM 1340 CE1 PHE A 744 -14.418 -1.747 -7.771 1.00 0.52 C ATOM 1341 CE2 PHE A 744 -13.871 -1.833 -5.410 1.00 0.37 C ATOM 1342 CZ PHE A 744 -14.808 -1.632 -6.430 1.00 0.46 C ATOM 1343 HA PHE A 744 -10.540 -1.521 -9.248 1.00 0.00 H ATOM 1344 HB2 PHE A 744 -10.695 -3.547 -7.952 1.00 0.00 H ATOM 1345 HB3 PHE A 744 -10.155 -2.713 -6.476 1.00 0.00 H ATOM 1346 HD2 PHE A 744 -11.816 -2.307 -4.938 1.00 0.00 H ATOM 1347 HE2 PHE A 744 -14.173 -1.744 -4.366 1.00 0.00 H ATOM 1348 HZ PHE A 744 -15.840 -1.386 -6.181 1.00 0.00 H ATOM 1349 HE1 PHE A 744 -15.147 -1.590 -8.566 1.00 0.00 H ATOM 1350 HD1 PHE A 744 -12.789 -2.153 -9.133 1.00 0.00 H ATOM 1351 H PHE A 744 -8.183 -2.313 -7.638 1.00 0.00 H ATOM 1352 N TYR A 745 -9.492 0.232 -6.689 1.00 0.19 N ATOM 1353 CA TYR A 745 -9.639 1.509 -6.005 1.00 0.20 C ATOM 1354 C TYR A 745 -9.283 2.663 -6.927 1.00 0.22 C ATOM 1355 O TYR A 745 -9.698 3.798 -6.696 1.00 0.27 O ATOM 1356 CB TYR A 745 -8.764 1.526 -4.753 1.00 0.19 C ATOM 1357 CG TYR A 745 -9.408 0.688 -3.668 1.00 0.19 C ATOM 1358 CD1 TYR A 745 -10.556 -0.075 -3.941 1.00 0.24 C ATOM 1359 CD2 TYR A 745 -8.851 0.668 -2.386 1.00 0.23 C ATOM 1360 CE1 TYR A 745 -11.138 -0.849 -2.936 1.00 0.26 C ATOM 1361 CE2 TYR A 745 -9.436 -0.112 -1.384 1.00 0.24 C ATOM 1362 CZ TYR A 745 -10.580 -0.870 -1.662 1.00 0.24 C ATOM 1363 OH TYR A 745 -11.152 -1.653 -0.676 1.00 0.28 O ATOM 1364 HA TYR A 745 -10.681 1.631 -5.710 1.00 0.00 H ATOM 1365 HB3 TYR A 745 -8.654 2.552 -4.401 1.00 0.00 H ATOM 1366 HB2 TYR A 745 -7.782 1.118 -4.992 1.00 0.00 H ATOM 1367 HD2 TYR A 745 -7.962 1.260 -2.168 1.00 0.00 H ATOM 1368 HE2 TYR A 745 -9.001 -0.130 -0.385 1.00 0.00 H ATOM 1369 HE1 TYR A 745 -12.030 -1.437 -3.150 1.00 0.00 H ATOM 1370 HD1 TYR A 745 -10.993 -0.062 -4.940 1.00 0.00 H ATOM 1371 HH TYR A 745 -11.425 -1.079 0.083 1.00 0.00 H ATOM 1372 H TYR A 745 -8.695 -0.390 -6.446 1.00 0.00 H ATOM 1373 N GLN A 746 -8.543 2.371 -7.990 1.00 0.21 N ATOM 1374 CA GLN A 746 -8.179 3.414 -8.946 1.00 0.23 C ATOM 1375 C GLN A 746 -9.408 4.252 -9.299 1.00 0.26 C ATOM 1376 O GLN A 746 -9.295 5.422 -9.662 1.00 0.32 O ATOM 1377 CB GLN A 746 -7.612 2.786 -10.217 1.00 0.23 C ATOM 1378 CG GLN A 746 -6.190 2.273 -9.957 1.00 0.26 C ATOM 1379 CD GLN A 746 -5.786 1.273 -11.038 1.00 0.32 C ATOM 1380 OE1 GLN A 746 -6.493 1.104 -12.027 1.00 0.56 O ATOM 1381 NE2 GLN A 746 -4.683 0.598 -10.908 1.00 0.29 N ATOM 1382 HA GLN A 746 -7.423 4.054 -8.492 1.00 0.00 H ATOM 1383 HB2 GLN A 746 -8.246 1.954 -10.523 1.00 0.00 H ATOM 1384 HB3 GLN A 746 -7.587 3.534 -11.010 1.00 0.00 H ATOM 1385 HG2 GLN A 746 -5.496 3.114 -9.966 1.00 0.00 H ATOM 1386 HG3 GLN A 746 -6.155 1.785 -8.983 1.00 0.00 H ATOM 1387 HE22 GLN A 746 -4.082 0.740 -10.071 1.00 0.00 H ATOM 1388 HE21 GLN A 746 -4.401 -0.084 -11.641 1.00 0.00 H ATOM 1389 H GLN A 746 -8.221 1.394 -8.143 1.00 0.00 H ATOM 1390 N GLN A 747 -10.581 3.636 -9.183 1.00 0.24 N ATOM 1391 CA GLN A 747 -11.838 4.318 -9.479 1.00 0.29 C ATOM 1392 C GLN A 747 -12.691 4.450 -8.215 1.00 0.29 C ATOM 1393 O GLN A 747 -13.862 4.823 -8.281 1.00 0.44 O ATOM 1394 CB GLN A 747 -12.607 3.541 -10.552 1.00 0.35 C ATOM 1395 CG GLN A 747 -11.711 3.332 -11.781 1.00 0.37 C ATOM 1396 CD GLN A 747 -11.414 4.668 -12.455 1.00 0.44 C ATOM 1397 OE1 GLN A 747 -12.018 4.998 -13.472 1.00 0.56 O ATOM 1398 NE2 GLN A 747 -10.517 5.466 -11.948 1.00 0.58 N ATOM 1399 HA GLN A 747 -11.614 5.319 -9.849 1.00 0.00 H ATOM 1400 HB2 GLN A 747 -12.907 2.572 -10.153 1.00 0.00 H ATOM 1401 HB3 GLN A 747 -13.494 4.104 -10.842 1.00 0.00 H ATOM 1402 HG2 GLN A 747 -10.774 2.871 -11.469 1.00 0.00 H ATOM 1403 HG3 GLN A 747 -12.219 2.677 -12.489 1.00 0.00 H ATOM 1404 HE22 GLN A 747 -10.003 5.190 -11.087 1.00 0.00 H ATOM 1405 HE21 GLN A 747 -10.315 6.378 -12.405 1.00 0.00 H ATOM 1406 H GLN A 747 -10.604 2.643 -8.874 1.00 0.00 H ATOM 1407 N ASN A 748 -12.089 4.153 -7.065 1.00 0.22 N ATOM 1408 CA ASN A 748 -12.795 4.252 -5.791 1.00 0.23 C ATOM 1409 C ASN A 748 -11.888 4.876 -4.734 1.00 0.22 C ATOM 1410 O ASN A 748 -10.878 4.290 -4.343 1.00 0.30 O ATOM 1411 CB ASN A 748 -13.260 2.865 -5.327 1.00 0.26 C ATOM 1412 CG ASN A 748 -13.897 2.962 -3.945 1.00 0.36 C ATOM 1413 OD1 ASN A 748 -13.620 2.142 -3.072 1.00 0.92 O ATOM 1414 ND2 ASN A 748 -14.744 3.917 -3.699 1.00 0.45 N ATOM 1415 HA ASN A 748 -13.670 4.887 -5.929 1.00 0.00 H ATOM 1416 HB2 ASN A 748 -13.991 2.474 -6.035 1.00 0.00 H ATOM 1417 HB3 ASN A 748 -12.403 2.193 -5.283 1.00 0.00 H ATOM 1418 HD22 ASN A 748 -14.977 4.609 -4.439 1.00 0.00 H ATOM 1419 HD21 ASN A 748 -15.189 3.989 -2.762 1.00 0.00 H ATOM 1420 H ASN A 748 -11.096 3.844 -7.075 1.00 0.00 H ATOM 1421 N SER A 749 -12.250 6.072 -4.286 1.00 0.20 N ATOM 1422 CA SER A 749 -11.460 6.778 -3.278 1.00 0.20 C ATOM 1423 C SER A 749 -11.019 5.828 -2.171 1.00 0.20 C ATOM 1424 O SER A 749 -11.779 4.960 -1.740 1.00 0.24 O ATOM 1425 CB SER A 749 -12.270 7.917 -2.670 1.00 0.24 C ATOM 1426 OG SER A 749 -11.382 8.876 -2.102 1.00 0.37 O ATOM 1427 HA SER A 749 -10.576 7.183 -3.771 1.00 0.00 H ATOM 1428 HB2 SER A 749 -12.926 7.524 -1.894 1.00 0.00 H ATOM 1429 HB3 SER A 749 -12.871 8.391 -3.446 1.00 0.00 H ATOM 1430 HG SER A 749 -10.787 9.232 -2.809 1.00 0.00 H ATOM 1431 H SER A 749 -13.113 6.516 -4.660 1.00 0.00 H ATOM 1432 N LEU A 750 -9.787 5.993 -1.715 1.00 0.18 N ATOM 1433 CA LEU A 750 -9.261 5.132 -0.663 1.00 0.19 C ATOM 1434 C LEU A 750 -9.997 5.356 0.650 1.00 0.18 C ATOM 1435 O LEU A 750 -10.180 4.416 1.424 1.00 0.19 O ATOM 1436 CB LEU A 750 -7.773 5.390 -0.482 1.00 0.20 C ATOM 1437 CG LEU A 750 -7.039 4.958 -1.751 1.00 0.23 C ATOM 1438 CD1 LEU A 750 -6.161 6.100 -2.245 1.00 0.27 C ATOM 1439 CD2 LEU A 750 -6.174 3.740 -1.445 1.00 0.29 C ATOM 1440 HA LEU A 750 -9.414 4.095 -0.960 1.00 0.00 H ATOM 1441 HB2 LEU A 750 -7.604 6.452 -0.305 1.00 0.00 H ATOM 1442 HB3 LEU A 750 -7.403 4.818 0.368 1.00 0.00 H ATOM 1443 HG LEU A 750 -7.764 4.702 -2.523 1.00 0.00 H ATOM 1444 HD21 LEU A 750 -5.448 3.996 -0.673 1.00 0.00 H ATOM 1445 HD22 LEU A 750 -6.807 2.925 -1.094 1.00 0.00 H ATOM 1446 HD23 LEU A 750 -5.650 3.431 -2.350 1.00 0.00 H ATOM 1447 HD11 LEU A 750 -6.784 6.967 -2.463 1.00 0.00 H ATOM 1448 HD12 LEU A 750 -5.434 6.357 -1.474 1.00 0.00 H ATOM 1449 HD13 LEU A 750 -5.639 5.790 -3.150 1.00 0.00 H ATOM 1450 H LEU A 750 -9.188 6.745 -2.112 1.00 0.00 H ATOM 1451 N LYS A 751 -10.434 6.593 0.882 1.00 0.19 N ATOM 1452 CA LYS A 751 -11.174 6.924 2.102 1.00 0.20 C ATOM 1453 C LYS A 751 -12.291 5.918 2.325 1.00 0.20 C ATOM 1454 O LYS A 751 -12.791 5.755 3.437 1.00 0.23 O ATOM 1455 CB LYS A 751 -11.791 8.317 1.976 1.00 0.22 C ATOM 1456 CG LYS A 751 -12.978 8.240 1.018 1.00 0.24 C ATOM 1457 CD LYS A 751 -13.208 9.596 0.356 1.00 0.26 C ATOM 1458 CE LYS A 751 -14.388 9.496 -0.616 1.00 0.28 C ATOM 1459 NZ LYS A 751 -15.345 8.442 -0.146 1.00 0.30 N ATOM 1460 HA LYS A 751 -10.481 6.899 2.943 1.00 0.00 H ATOM 1461 HB2 LYS A 751 -12.130 8.659 2.954 1.00 0.00 H ATOM 1462 HB3 LYS A 751 -11.049 9.014 1.586 1.00 0.00 H ATOM 1463 HG2 LYS A 751 -12.774 7.494 0.250 1.00 0.00 H ATOM 1464 HG3 LYS A 751 -13.871 7.953 1.573 1.00 0.00 H ATOM 1465 HD2 LYS A 751 -13.429 10.341 1.120 1.00 0.00 H ATOM 1466 HD3 LYS A 751 -12.312 9.891 -0.189 1.00 0.00 H ATOM 1467 HE2 LYS A 751 -14.019 9.234 -1.608 1.00 0.00 H ATOM 1468 HE3 LYS A 751 -14.901 10.456 -0.663 1.00 0.00 H ATOM 1469 HZ1 LYS A 751 -14.856 7.525 -0.103 1.00 0.00 H ATOM 1470 HZ2 LYS A 751 -15.698 8.693 0.800 1.00 0.00 H ATOM 1471 HZ3 LYS A 751 -16.143 8.379 -0.810 1.00 0.00 H ATOM 1472 H LYS A 751 -10.246 7.339 0.182 1.00 0.00 H ATOM 1473 N ASP A 752 -12.679 5.248 1.248 1.00 0.20 N ATOM 1474 CA ASP A 752 -13.744 4.256 1.329 1.00 0.22 C ATOM 1475 C ASP A 752 -13.223 3.005 2.037 1.00 0.22 C ATOM 1476 O ASP A 752 -13.985 2.224 2.612 1.00 0.26 O ATOM 1477 CB ASP A 752 -14.233 3.909 -0.084 1.00 0.25 C ATOM 1478 CG ASP A 752 -14.918 5.113 -0.734 1.00 0.27 C ATOM 1479 OD1 ASP A 752 -14.633 6.238 -0.341 1.00 0.33 O ATOM 1480 OD2 ASP A 752 -15.717 4.893 -1.626 1.00 0.34 O ATOM 1481 HA ASP A 752 -14.580 4.660 1.899 1.00 0.00 H ATOM 1482 HB2 ASP A 752 -13.380 3.610 -0.694 1.00 0.00 H ATOM 1483 HB3 ASP A 752 -14.942 3.083 -0.024 1.00 0.00 H ATOM 1484 H ASP A 752 -12.218 5.433 0.334 1.00 0.00 H ATOM 1485 N CYS A 753 -11.909 2.839 1.984 1.00 0.19 N ATOM 1486 CA CYS A 753 -11.234 1.713 2.608 1.00 0.20 C ATOM 1487 C CYS A 753 -10.267 2.204 3.667 1.00 0.20 C ATOM 1488 O CYS A 753 -10.275 1.743 4.805 1.00 0.24 O ATOM 1489 CB CYS A 753 -10.480 0.955 1.531 1.00 0.22 C ATOM 1490 SG CYS A 753 -11.508 0.918 0.044 1.00 0.32 S ATOM 1491 HA CYS A 753 -11.964 1.061 3.087 1.00 0.00 H ATOM 1492 HB2 CYS A 753 -10.279 -0.062 1.867 1.00 0.00 H ATOM 1493 HB3 CYS A 753 -9.537 1.458 1.316 1.00 0.00 H ATOM 1494 HG CYS A 753 -10.846 0.233 -0.954 1.00 0.00 H ATOM 1495 H CYS A 753 -11.338 3.543 1.475 1.00 0.00 H ATOM 1496 N PHE A 754 -9.440 3.152 3.272 1.00 0.19 N ATOM 1497 CA PHE A 754 -8.460 3.724 4.174 1.00 0.20 C ATOM 1498 C PHE A 754 -9.156 4.515 5.271 1.00 0.22 C ATOM 1499 O PHE A 754 -10.332 4.845 5.157 1.00 0.27 O ATOM 1500 CB PHE A 754 -7.525 4.642 3.400 1.00 0.23 C ATOM 1501 CG PHE A 754 -6.471 3.821 2.698 1.00 0.25 C ATOM 1502 CD1 PHE A 754 -6.849 2.849 1.767 1.00 0.28 C ATOM 1503 CD2 PHE A 754 -5.116 4.034 2.975 1.00 0.35 C ATOM 1504 CE1 PHE A 754 -5.875 2.088 1.114 1.00 0.39 C ATOM 1505 CE2 PHE A 754 -4.143 3.274 2.323 1.00 0.44 C ATOM 1506 CZ PHE A 754 -4.522 2.302 1.392 1.00 0.45 C ATOM 1507 HA PHE A 754 -7.885 2.917 4.628 1.00 0.00 H ATOM 1508 HB2 PHE A 754 -8.098 5.204 2.662 1.00 0.00 H ATOM 1509 HB3 PHE A 754 -7.044 5.335 4.090 1.00 0.00 H ATOM 1510 HD2 PHE A 754 -4.820 4.793 3.699 1.00 0.00 H ATOM 1511 HE2 PHE A 754 -3.088 3.438 2.540 1.00 0.00 H ATOM 1512 HZ PHE A 754 -3.761 1.710 0.882 1.00 0.00 H ATOM 1513 HE1 PHE A 754 -6.170 1.329 0.389 1.00 0.00 H ATOM 1514 HD1 PHE A 754 -7.904 2.684 1.550 1.00 0.00 H ATOM 1515 H PHE A 754 -9.492 3.497 2.292 1.00 0.00 H ATOM 1516 N LYS A 755 -8.431 4.805 6.336 1.00 0.21 N ATOM 1517 CA LYS A 755 -9.009 5.546 7.447 1.00 0.23 C ATOM 1518 C LYS A 755 -8.994 7.053 7.169 1.00 0.25 C ATOM 1519 O LYS A 755 -10.045 7.688 7.102 1.00 0.30 O ATOM 1520 CB LYS A 755 -8.259 5.211 8.742 1.00 0.24 C ATOM 1521 CG LYS A 755 -7.576 3.832 8.622 1.00 0.22 C ATOM 1522 CD LYS A 755 -8.597 2.753 8.219 1.00 0.24 C ATOM 1523 CE LYS A 755 -8.175 1.389 8.786 1.00 0.24 C ATOM 1524 NZ LYS A 755 -9.390 0.583 9.113 1.00 0.22 N ATOM 1525 HA LYS A 755 -10.051 5.249 7.564 1.00 0.00 H ATOM 1526 HB2 LYS A 755 -7.502 5.973 8.927 1.00 0.00 H ATOM 1527 HB3 LYS A 755 -8.965 5.192 9.572 1.00 0.00 H ATOM 1528 HG2 LYS A 755 -6.793 3.885 7.865 1.00 0.00 H ATOM 1529 HG3 LYS A 755 -7.134 3.566 9.582 1.00 0.00 H ATOM 1530 HD2 LYS A 755 -9.578 3.020 8.612 1.00 0.00 H ATOM 1531 HD3 LYS A 755 -8.647 2.692 7.132 1.00 0.00 H ATOM 1532 HE2 LYS A 755 -7.585 1.539 9.690 1.00 0.00 H ATOM 1533 HE3 LYS A 755 -7.576 0.858 8.046 1.00 0.00 H ATOM 1534 HZ1 LYS A 755 -9.961 1.090 9.820 1.00 0.00 H ATOM 1535 HZ2 LYS A 755 -9.952 0.440 8.250 1.00 0.00 H ATOM 1536 HZ3 LYS A 755 -9.100 -0.339 9.496 1.00 0.00 H ATOM 1537 H LYS A 755 -7.437 4.501 6.381 1.00 0.00 H ATOM 1538 N SER A 756 -7.798 7.616 7.009 1.00 0.24 N ATOM 1539 CA SER A 756 -7.665 9.050 6.736 1.00 0.27 C ATOM 1540 C SER A 756 -7.528 9.326 5.239 1.00 0.29 C ATOM 1541 O SER A 756 -7.960 10.367 4.747 1.00 0.53 O ATOM 1542 CB SER A 756 -6.442 9.611 7.465 1.00 0.30 C ATOM 1543 OG SER A 756 -5.618 10.321 6.539 1.00 0.48 O ATOM 1544 HA SER A 756 -8.570 9.539 7.095 1.00 0.00 H ATOM 1545 HB2 SER A 756 -5.873 8.791 7.904 1.00 0.00 H ATOM 1546 HB3 SER A 756 -6.768 10.288 8.254 1.00 0.00 H ATOM 1547 HG SER A 756 -6.136 11.066 6.142 1.00 0.00 H ATOM 1548 H SER A 756 -6.943 7.028 7.079 1.00 0.00 H ATOM 1549 N LEU A 757 -6.891 8.400 4.534 1.00 0.20 N ATOM 1550 CA LEU A 757 -6.655 8.536 3.094 1.00 0.18 C ATOM 1551 C LEU A 757 -7.887 9.054 2.351 1.00 0.18 C ATOM 1552 O LEU A 757 -8.931 8.412 2.359 1.00 0.26 O ATOM 1553 CB LEU A 757 -6.289 7.166 2.529 1.00 0.19 C ATOM 1554 CG LEU A 757 -5.320 7.296 1.358 1.00 0.20 C ATOM 1555 CD1 LEU A 757 -5.804 8.364 0.384 1.00 0.21 C ATOM 1556 CD2 LEU A 757 -3.943 7.671 1.883 1.00 0.26 C ATOM 1557 HA LEU A 757 -5.850 9.257 2.954 1.00 0.00 H ATOM 1558 HB2 LEU A 757 -5.822 6.570 3.313 1.00 0.00 H ATOM 1559 HB3 LEU A 757 -7.196 6.668 2.187 1.00 0.00 H ATOM 1560 HG LEU A 757 -5.268 6.342 0.833 1.00 0.00 H ATOM 1561 HD21 LEU A 757 -4.004 8.621 2.414 1.00 0.00 H ATOM 1562 HD22 LEU A 757 -3.591 6.895 2.564 1.00 0.00 H ATOM 1563 HD23 LEU A 757 -3.250 7.764 1.047 1.00 0.00 H ATOM 1564 HD11 LEU A 757 -6.787 8.088 0.003 1.00 0.00 H ATOM 1565 HD12 LEU A 757 -5.869 9.322 0.900 1.00 0.00 H ATOM 1566 HD13 LEU A 757 -5.101 8.443 -0.445 1.00 0.00 H ATOM 1567 H LEU A 757 -6.547 7.548 5.020 1.00 0.00 H ATOM 1568 N ASP A 758 -7.750 10.202 1.684 1.00 0.17 N ATOM 1569 CA ASP A 758 -8.867 10.755 0.924 1.00 0.18 C ATOM 1570 C ASP A 758 -8.472 11.047 -0.528 1.00 0.17 C ATOM 1571 O ASP A 758 -8.357 12.200 -0.944 1.00 0.19 O ATOM 1572 CB ASP A 758 -9.401 12.021 1.597 1.00 0.23 C ATOM 1573 CG ASP A 758 -10.896 12.145 1.327 1.00 0.41 C ATOM 1574 OD1 ASP A 758 -11.251 12.537 0.228 1.00 1.05 O ATOM 1575 OD2 ASP A 758 -11.664 11.829 2.218 1.00 1.26 O ATOM 1576 HA ASP A 758 -9.658 10.005 0.908 1.00 0.00 H ATOM 1577 HB2 ASP A 758 -9.229 11.962 2.672 1.00 0.00 H ATOM 1578 HB3 ASP A 758 -8.885 12.893 1.195 1.00 0.00 H ATOM 1579 H ASP A 758 -6.841 10.706 1.706 1.00 0.00 H ATOM 1580 N THR A 759 -8.284 9.983 -1.298 1.00 0.17 N ATOM 1581 CA THR A 759 -7.934 10.108 -2.716 1.00 0.18 C ATOM 1582 C THR A 759 -8.024 8.745 -3.396 1.00 0.18 C ATOM 1583 O THR A 759 -8.632 7.816 -2.852 1.00 0.20 O ATOM 1584 CB THR A 759 -6.529 10.711 -2.904 1.00 0.20 C ATOM 1585 OG1 THR A 759 -6.369 11.081 -4.266 1.00 0.26 O ATOM 1586 CG2 THR A 759 -5.444 9.699 -2.537 1.00 0.21 C ATOM 1587 HA THR A 759 -8.647 10.789 -3.180 1.00 0.00 H ATOM 1588 HB THR A 759 -6.431 11.578 -2.251 1.00 0.00 H ATOM 1589 HG1 THR A 759 -5.468 11.470 -4.397 1.00 0.00 H ATOM 1590 HG23 THR A 759 -5.558 9.408 -1.493 1.00 0.00 H ATOM 1591 HG21 THR A 759 -5.540 8.819 -3.173 1.00 0.00 H ATOM 1592 HG22 THR A 759 -4.463 10.150 -2.685 1.00 0.00 H ATOM 1593 H THR A 759 -8.388 9.034 -0.884 1.00 0.00 H ATOM 1594 N THR A 760 -7.432 8.628 -4.579 1.00 0.18 N ATOM 1595 CA THR A 760 -7.458 7.366 -5.323 1.00 0.19 C ATOM 1596 C THR A 760 -6.056 6.943 -5.729 1.00 0.19 C ATOM 1597 O THR A 760 -5.102 7.715 -5.615 1.00 0.23 O ATOM 1598 CB THR A 760 -8.305 7.513 -6.590 1.00 0.22 C ATOM 1599 OG1 THR A 760 -7.949 8.713 -7.260 1.00 0.27 O ATOM 1600 CG2 THR A 760 -9.781 7.561 -6.216 1.00 0.23 C ATOM 1601 HA THR A 760 -7.890 6.609 -4.668 1.00 0.00 H ATOM 1602 HB THR A 760 -8.125 6.661 -7.246 1.00 0.00 H ATOM 1603 HG1 THR A 760 -8.497 8.807 -8.079 1.00 0.00 H ATOM 1604 HG23 THR A 760 -10.054 6.640 -5.702 1.00 0.00 H ATOM 1605 HG21 THR A 760 -9.961 8.412 -5.559 1.00 0.00 H ATOM 1606 HG22 THR A 760 -10.380 7.665 -7.120 1.00 0.00 H ATOM 1607 H THR A 760 -6.940 9.449 -4.986 1.00 0.00 H ATOM 1608 N LEU A 761 -5.943 5.716 -6.232 1.00 0.20 N ATOM 1609 CA LEU A 761 -4.657 5.210 -6.689 1.00 0.21 C ATOM 1610 C LEU A 761 -4.245 6.012 -7.920 1.00 0.22 C ATOM 1611 O LEU A 761 -4.435 5.574 -9.055 1.00 0.30 O ATOM 1612 CB LEU A 761 -4.774 3.716 -7.034 1.00 0.24 C ATOM 1613 CG LEU A 761 -4.919 2.882 -5.751 1.00 0.24 C ATOM 1614 CD1 LEU A 761 -3.752 3.175 -4.814 1.00 0.28 C ATOM 1615 CD2 LEU A 761 -6.228 3.231 -5.042 1.00 0.26 C ATOM 1616 HA LEU A 761 -3.905 5.317 -5.907 1.00 0.00 H ATOM 1617 HB2 LEU A 761 -5.649 3.560 -7.665 1.00 0.00 H ATOM 1618 HB3 LEU A 761 -3.879 3.399 -7.570 1.00 0.00 H ATOM 1619 HG LEU A 761 -4.923 1.825 -6.018 1.00 0.00 H ATOM 1620 HD21 LEU A 761 -6.228 4.290 -4.783 1.00 0.00 H ATOM 1621 HD22 LEU A 761 -7.067 3.018 -5.705 1.00 0.00 H ATOM 1622 HD23 LEU A 761 -6.319 2.634 -4.135 1.00 0.00 H ATOM 1623 HD11 LEU A 761 -2.816 2.917 -5.310 1.00 0.00 H ATOM 1624 HD12 LEU A 761 -3.750 4.235 -4.559 1.00 0.00 H ATOM 1625 HD13 LEU A 761 -3.859 2.582 -3.906 1.00 0.00 H ATOM 1626 H LEU A 761 -6.786 5.110 -6.299 1.00 0.00 H ATOM 1627 N GLN A 762 -3.724 7.213 -7.676 1.00 0.21 N ATOM 1628 CA GLN A 762 -3.331 8.113 -8.760 1.00 0.23 C ATOM 1629 C GLN A 762 -2.232 7.511 -9.632 1.00 0.22 C ATOM 1630 O GLN A 762 -2.440 7.264 -10.819 1.00 0.26 O ATOM 1631 CB GLN A 762 -2.862 9.448 -8.176 1.00 0.24 C ATOM 1632 CG GLN A 762 -4.046 10.155 -7.506 1.00 0.29 C ATOM 1633 CD GLN A 762 -4.760 11.058 -8.504 1.00 0.47 C ATOM 1634 OE1 GLN A 762 -4.190 12.034 -8.986 1.00 0.77 O ATOM 1635 NE2 GLN A 762 -5.985 10.788 -8.842 1.00 0.71 N ATOM 1636 HA GLN A 762 -4.203 8.271 -9.395 1.00 0.00 H ATOM 1637 HB2 GLN A 762 -2.081 9.268 -7.438 1.00 0.00 H ATOM 1638 HB3 GLN A 762 -2.468 10.076 -8.975 1.00 0.00 H ATOM 1639 HG2 GLN A 762 -4.746 9.408 -7.133 1.00 0.00 H ATOM 1640 HG3 GLN A 762 -3.681 10.757 -6.674 1.00 0.00 H ATOM 1641 HE22 GLN A 762 -6.467 9.962 -8.434 1.00 0.00 H ATOM 1642 HE21 GLN A 762 -6.484 11.398 -9.521 1.00 0.00 H ATOM 1643 H GLN A 762 -3.593 7.519 -6.691 1.00 0.00 H ATOM 1644 N PHE A 763 -1.066 7.281 -9.044 1.00 0.22 N ATOM 1645 CA PHE A 763 0.045 6.709 -9.801 1.00 0.23 C ATOM 1646 C PHE A 763 1.001 5.940 -8.891 1.00 0.20 C ATOM 1647 O PHE A 763 1.180 6.277 -7.714 1.00 0.22 O ATOM 1648 CB PHE A 763 0.821 7.806 -10.554 1.00 0.29 C ATOM 1649 CG PHE A 763 0.401 9.180 -10.076 1.00 0.29 C ATOM 1650 CD1 PHE A 763 0.961 9.722 -8.915 1.00 0.35 C ATOM 1651 CD2 PHE A 763 -0.547 9.912 -10.803 1.00 0.35 C ATOM 1652 CE1 PHE A 763 0.575 10.994 -8.478 1.00 0.43 C ATOM 1653 CE2 PHE A 763 -0.933 11.185 -10.365 1.00 0.43 C ATOM 1654 CZ PHE A 763 -0.373 11.726 -9.203 1.00 0.46 C ATOM 1655 HA PHE A 763 -0.382 6.014 -10.524 1.00 0.00 H ATOM 1656 HB2 PHE A 763 1.889 7.676 -10.377 1.00 0.00 H ATOM 1657 HB3 PHE A 763 0.618 7.720 -11.621 1.00 0.00 H ATOM 1658 HD2 PHE A 763 -0.984 9.491 -11.709 1.00 0.00 H ATOM 1659 HE2 PHE A 763 -1.671 11.755 -10.930 1.00 0.00 H ATOM 1660 HZ PHE A 763 -0.674 12.717 -8.862 1.00 0.00 H ATOM 1661 HE1 PHE A 763 1.013 11.415 -7.573 1.00 0.00 H ATOM 1662 HD1 PHE A 763 1.699 9.153 -8.350 1.00 0.00 H ATOM 1663 H PHE A 763 -0.941 7.509 -8.037 1.00 0.00 H ATOM 1664 N PRO A 764 1.621 4.920 -9.427 1.00 0.18 N ATOM 1665 CA PRO A 764 2.590 4.081 -8.676 1.00 0.17 C ATOM 1666 C PRO A 764 3.903 4.817 -8.452 1.00 0.16 C ATOM 1667 O PRO A 764 4.338 5.602 -9.292 1.00 0.25 O ATOM 1668 CB PRO A 764 2.802 2.860 -9.571 1.00 0.19 C ATOM 1669 CG PRO A 764 2.450 3.305 -10.952 1.00 0.22 C ATOM 1670 CD PRO A 764 1.461 4.461 -10.815 1.00 0.22 C ATOM 1671 HA PRO A 764 2.223 3.819 -7.684 1.00 0.00 H ATOM 1672 HD3 PRO A 764 1.703 5.260 -11.516 1.00 0.00 H ATOM 1673 HD2 PRO A 764 0.441 4.119 -10.993 1.00 0.00 H ATOM 1674 HG3 PRO A 764 1.992 2.484 -11.504 1.00 0.00 H ATOM 1675 HG2 PRO A 764 3.345 3.639 -11.477 1.00 0.00 H ATOM 1676 HB2 PRO A 764 3.841 2.534 -9.530 1.00 0.00 H ATOM 1677 HB3 PRO A 764 2.153 2.042 -9.258 1.00 0.00 H ATOM 1678 N PHE A 765 4.538 4.558 -7.324 1.00 0.16 N ATOM 1679 CA PHE A 765 5.806 5.209 -7.018 1.00 0.16 C ATOM 1680 C PHE A 765 6.862 4.858 -8.068 1.00 0.17 C ATOM 1681 O PHE A 765 7.751 5.658 -8.364 1.00 0.23 O ATOM 1682 CB PHE A 765 6.282 4.767 -5.634 1.00 0.17 C ATOM 1683 CG PHE A 765 7.061 3.475 -5.747 1.00 0.19 C ATOM 1684 CD1 PHE A 765 6.401 2.284 -6.073 1.00 0.21 C ATOM 1685 CD2 PHE A 765 8.440 3.471 -5.526 1.00 0.24 C ATOM 1686 CE1 PHE A 765 7.121 1.091 -6.174 1.00 0.26 C ATOM 1687 CE2 PHE A 765 9.163 2.277 -5.628 1.00 0.29 C ATOM 1688 CZ PHE A 765 8.504 1.087 -5.950 1.00 0.29 C ATOM 1689 HA PHE A 765 5.659 6.289 -7.028 1.00 0.00 H ATOM 1690 HB2 PHE A 765 6.922 5.539 -5.208 1.00 0.00 H ATOM 1691 HB3 PHE A 765 5.419 4.614 -4.986 1.00 0.00 H ATOM 1692 HD2 PHE A 765 8.954 4.399 -5.274 1.00 0.00 H ATOM 1693 HE2 PHE A 765 10.239 2.275 -5.456 1.00 0.00 H ATOM 1694 HZ PHE A 765 9.066 0.156 -6.027 1.00 0.00 H ATOM 1695 HE1 PHE A 765 6.607 0.164 -6.427 1.00 0.00 H ATOM 1696 HD1 PHE A 765 5.325 2.288 -6.248 1.00 0.00 H ATOM 1697 H PHE A 765 4.130 3.883 -6.647 1.00 0.00 H ATOM 1698 N LYS A 766 6.758 3.644 -8.604 1.00 0.18 N ATOM 1699 CA LYS A 766 7.696 3.149 -9.594 1.00 0.21 C ATOM 1700 C LYS A 766 7.657 3.934 -10.884 1.00 0.23 C ATOM 1701 O LYS A 766 8.599 3.849 -11.682 1.00 0.27 O ATOM 1702 CB LYS A 766 7.347 1.715 -9.905 1.00 0.21 C ATOM 1703 CG LYS A 766 8.192 0.800 -9.040 1.00 0.22 C ATOM 1704 CD LYS A 766 9.259 0.136 -9.908 1.00 0.28 C ATOM 1705 CE LYS A 766 10.182 1.216 -10.500 1.00 0.33 C ATOM 1706 NZ LYS A 766 9.618 1.719 -11.795 1.00 0.34 N ATOM 1707 HA LYS A 766 8.697 3.249 -9.175 1.00 0.00 H ATOM 1708 HB2 LYS A 766 6.291 1.542 -9.696 1.00 0.00 H ATOM 1709 HB3 LYS A 766 7.546 1.510 -10.957 1.00 0.00 H ATOM 1710 HG2 LYS A 766 8.672 1.382 -8.253 1.00 0.00 H ATOM 1711 HG3 LYS A 766 7.559 0.035 -8.590 1.00 0.00 H ATOM 1712 HD2 LYS A 766 9.847 -0.552 -9.300 1.00 0.00 H ATOM 1713 HD3 LYS A 766 8.779 -0.415 -10.716 1.00 0.00 H ATOM 1714 HE2 LYS A 766 11.169 0.790 -10.677 1.00 0.00 H ATOM 1715 HE3 LYS A 766 10.266 2.044 -9.797 1.00 0.00 H ATOM 1716 HZ1 LYS A 766 9.539 0.929 -12.467 1.00 0.00 H ATOM 1717 HZ2 LYS A 766 8.677 2.128 -11.626 1.00 0.00 H ATOM 1718 HZ3 LYS A 766 10.248 2.448 -12.187 1.00 0.00 H ATOM 1719 H LYS A 766 5.976 3.028 -8.302 1.00 0.00 H ATOM 1720 N GLU A 767 6.567 4.657 -11.100 1.00 0.23 N ATOM 1721 CA GLU A 767 6.424 5.435 -12.318 1.00 0.26 C ATOM 1722 C GLU A 767 7.413 6.610 -12.310 1.00 0.29 C ATOM 1723 O GLU A 767 7.221 7.547 -13.066 1.00 0.37 O ATOM 1724 CB GLU A 767 4.985 5.953 -12.446 1.00 0.29 C ATOM 1725 CG GLU A 767 4.342 5.384 -13.718 1.00 0.35 C ATOM 1726 CD GLU A 767 3.285 6.344 -14.251 1.00 0.40 C ATOM 1727 OE1 GLU A 767 2.276 6.509 -13.583 1.00 0.44 O ATOM 1728 OE2 GLU A 767 3.499 6.895 -15.317 1.00 0.66 O ATOM 1729 HA GLU A 767 6.644 4.797 -13.174 1.00 0.00 H ATOM 1730 OXT GLU A 767 8.348 6.565 -11.528 1.00 0.30 O ATOM 1731 HB2 GLU A 767 4.408 5.639 -11.576 1.00 0.00 H ATOM 1732 HB3 GLU A 767 4.995 7.042 -12.500 1.00 0.00 H ATOM 1733 HG2 GLU A 767 5.111 5.239 -14.476 1.00 0.00 H ATOM 1734 HG3 GLU A 767 3.875 4.426 -13.488 1.00 0.00 H ATOM 1735 H GLU A 767 5.807 4.667 -10.390 1.00 0.00 H TER 1736 GLU A 767 HETATM 1737 N ASP A 1 15.171 2.155 6.935 1.00 0.24 N HETATM 1738 CA ASP A 1 16.150 1.060 7.176 1.00 0.08 C HETATM 1739 C ASP A 1 15.495 -0.062 7.988 1.00 0.23 C HETATM 1740 O ASP A 1 15.015 -1.049 7.426 1.00 -0.39 O HETATM 1741 N ASP A 1 15.502 0.092 9.309 1.00 -0.26 N HETATM 1742 CA ASP A 1 14.941 -0.907 10.215 1.00 0.16 C HETATM 1743 C ASP A 1 13.505 -0.571 10.607 1.00 0.21 C HETATM 1744 O ASP A 1 12.952 -1.173 11.528 1.00 -0.39 O HETATM 1745 N ASP A 1 12.903 0.387 9.912 1.00 -0.26 N HETATM 1746 CA ASP A 1 11.531 0.787 10.207 1.00 0.13 C HETATM 1747 C ASP A 1 10.557 0.170 9.202 1.00 0.20 C HETATM 1748 O ASP A 1 10.966 -0.535 8.278 1.00 -0.39 O HETATM 1749 N ASP A 1 9.269 0.449 9.389 1.00 -0.26 N HETATM 1750 CA ASP A 1 8.234 -0.069 8.496 1.00 0.13 C HETATM 1751 C ASP A 1 6.960 0.772 8.625 1.00 0.20 C HETATM 1752 O ASP A 1 7.022 1.973 8.892 1.00 -0.39 O HETATM 1753 N ASP A 1 5.810 0.129 8.442 1.00 -0.26 N HETATM 1754 CA ASP A 1 4.520 0.810 8.551 1.00 0.14 C HETATM 1755 C ASP A 1 3.851 0.457 9.878 1.00 0.21 C HETATM 1756 O ASP A 1 3.275 -0.622 10.023 1.00 -0.39 O HETATM 1757 N ASP A 1 3.934 1.367 10.847 1.00 -0.26 N HETATM 1758 CA ASP A 1 3.333 1.132 12.159 1.00 0.13 C HETATM 1759 C ASP A 1 1.843 0.827 12.015 1.00 0.20 C HETATM 1760 O ASP A 1 1.432 -0.337 12.013 1.00 -0.39 O HETATM 1761 N ASP A 1 1.038 1.879 11.889 1.00 -0.26 N HETATM 1762 CA ASP A 1 -0.408 1.722 11.737 1.00 0.15 C HETATM 1763 C ASP A 1 -1.118 3.068 11.829 1.00 0.21 C HETATM 1764 O ASP A 1 -1.677 3.406 12.872 1.00 -0.39 O HETATM 1765 N ASP A 1 -1.119 3.829 10.761 1.00 -0.25 N HETATM 1766 CA ASP A 1 -1.788 5.160 10.719 1.00 0.13 C HETATM 1767 C ASP A 1 -3.099 5.178 11.514 1.00 0.20 C HETATM 1768 O ASP A 1 -3.293 6.033 12.382 1.00 -0.39 O HETATM 1769 N ASP A 1 -3.992 4.225 11.227 1.00 -0.26 N HETATM 1770 CA ASP A 1 -5.275 4.160 11.936 1.00 0.15 C HETATM 1771 C ASP A 1 -5.965 2.796 11.757 1.00 0.21 C HETATM 1772 O ASP A 1 -5.724 2.078 10.783 1.00 -0.39 O HETATM 1773 N ASP A 1 -6.834 2.471 12.716 1.00 -0.26 N HETATM 1774 CA ASP A 1 -7.608 1.220 12.725 1.00 0.13 C HETATM 1775 C ASP A 1 -8.970 1.505 13.340 1.00 0.20 C HETATM 1776 O ASP A 1 -9.156 2.528 14.002 1.00 -0.39 O HETATM 1777 N ASP A 1 -9.921 0.620 13.103 1.00 -0.26 N HETATM 1778 CA ASP A 1 -11.266 0.808 13.616 1.00 0.14 C HETATM 1779 C ASP A 1 -11.639 -0.302 14.602 1.00 0.21 C HETATM 1780 O ASP A 1 -11.659 -1.480 14.244 1.00 -0.39 O HETATM 1781 N ASP A 1 -11.927 0.059 15.831 1.00 -0.25 N HETATM 1782 CA ASP A 1 -12.304 -0.917 16.897 1.00 0.13 C HETATM 1783 C ASP A 1 -13.765 -1.357 16.813 1.00 0.20 C HETATM 1784 O ASP A 1 -14.498 -0.954 15.906 1.00 -0.39 O HETATM 1785 N ASP A 1 -14.172 -2.186 17.769 1.00 -0.27 N HETATM 1786 CA ASP A 1 -15.540 -2.684 17.817 1.00 0.10 C HETATM 1787 C ASP A 1 -16.493 -1.620 18.372 1.00 0.06 C HETATM 1788 O ASP A 1 -16.014 -0.660 18.959 1.00 -0.57 O HETATM 1789 OXT ASP A 1 -17.693 -1.780 18.200 1.00 -0.57 O HETATM 1790 CB ASP A 1 -15.598 -3.944 18.692 1.00 -0.01 C HETATM 1791 CG ASP A 1 -14.959 -3.664 20.059 1.00 0.00 C HETATM 1792 CD ASP A 1 -13.466 -3.979 20.022 1.00 0.04 C HETATM 1793 OE1 ASP A 1 -12.726 -3.186 19.459 1.00 -0.57 O HETATM 1794 OE2 ASP A 1 -13.086 -5.008 20.555 1.00 -0.57 O HETATM 1795 H84 ASP A 1 -15.443 -4.292 20.821 1.00 0.04 H HETATM 1796 H85 ASP A 1 -15.100 -2.603 20.315 1.00 0.04 H HETATM 1797 H82 ASP A 1 -15.051 -4.758 18.194 1.00 0.03 H HETATM 1798 H83 ASP A 1 -16.648 -4.240 18.834 1.00 0.03 H HETATM 1799 H81 ASP A 1 -15.858 -2.943 16.796 1.00 0.07 H HETATM 1800 H80 ASP A 1 -13.523 -2.475 18.473 1.00 0.19 H HETATM 1801 CB ASP A 1 -12.052 -0.134 18.184 1.00 -0.01 C HETATM 1802 CG ASP A 1 -12.277 1.296 17.824 1.00 -0.03 C HETATM 1803 CD ASP A 1 -11.924 1.442 16.343 1.00 0.04 C HETATM 1804 H78 ASP A 1 -12.676 2.053 15.821 1.00 0.05 H HETATM 1805 H79 ASP A 1 -10.931 1.900 16.222 1.00 0.05 H HETATM 1806 H76 ASP A 1 -11.631 1.946 18.433 1.00 0.03 H HETATM 1807 H77 ASP A 1 -13.330 1.567 17.990 1.00 0.03 H HETATM 1808 H74 ASP A 1 -11.020 -0.286 18.532 1.00 0.03 H HETATM 1809 H75 ASP A 1 -12.754 -0.449 18.970 1.00 0.03 H HETATM 1810 H73 ASP A 1 -11.660 -1.807 16.847 1.00 0.08 H HETATM 1811 CB ASP A 1 -12.243 0.817 12.440 1.00 0.04 C HETATM 1812 CG ASP A 1 -11.767 1.778 11.348 1.00 0.04 C HETATM 1813 OD1 ASP A 1 -10.719 1.530 10.764 1.00 -0.57 O HETATM 1814 OD2 ASP A 1 -12.485 2.727 11.073 1.00 -0.57 O HETATM 1815 H71 ASP A 1 -13.233 1.137 12.796 1.00 0.05 H HETATM 1816 H72 ASP A 1 -12.314 -0.198 12.022 1.00 0.05 H HETATM 1817 H70 ASP A 1 -11.319 1.775 14.137 1.00 0.08 H HETATM 1818 H69 ASP A 1 -9.711 -0.194 12.561 1.00 0.19 H HETATM 1819 CB ASP A 1 -6.878 0.157 13.551 1.00 -0.02 C HETATM 1820 H66 ASP A 1 -7.465 -0.774 13.551 1.00 0.03 H HETATM 1821 H67 ASP A 1 -6.757 0.515 14.584 1.00 0.03 H HETATM 1822 H68 ASP A 1 -5.888 -0.034 13.111 1.00 0.03 H HETATM 1823 H65 ASP A 1 -7.735 0.857 11.695 1.00 0.08 H HETATM 1824 H64 ASP A 1 -6.966 3.114 13.471 1.00 0.19 H HETATM 1825 CB ASP A 1 -6.206 5.289 11.443 1.00 0.04 C HETATM 1826 CG ASP A 1 -5.463 6.175 10.463 1.00 -0.00 C HETATM 1827 CD1 ASP A 1 -5.131 5.694 9.189 1.00 -0.02 C HETATM 1828 CE1 ASP A 1 -4.414 6.501 8.298 1.00 0.01 C HETATM 1829 CZ ASP A 1 -4.032 7.790 8.685 1.00 0.17 C HETATM 1830 CE2 ASP A 1 -4.368 8.273 9.954 1.00 0.01 C HETATM 1831 CD2 ASP A 1 -5.079 7.465 10.844 1.00 -0.02 C HETATM 1832 H61 ASP A 1 -5.333 7.837 11.830 1.00 0.07 H HETATM 1833 H63 ASP A 1 -4.076 9.275 10.247 1.00 0.07 H HETATM 1834 OH ASP A 1 -3.308 8.587 7.820 1.00 -0.20 O HETATM 1835 P ASP A 1 -1.770 8.991 8.213 1.00 0.13 P HETATM 1836 O1P ASP A 1 -0.745 8.559 7.161 1.00 -0.67 O HETATM 1837 O2P ASP A 1 -1.783 10.521 8.293 1.00 -0.67 O HETATM 1838 O3P ASP A 1 -1.386 8.411 9.573 1.00 -0.67 O HETATM 1839 H62 ASP A 1 -4.156 6.129 7.313 1.00 0.07 H HETATM 1840 H60 ASP A 1 -5.430 4.695 8.893 1.00 0.07 H HETATM 1841 H58 ASP A 1 -6.536 5.891 12.302 1.00 0.06 H HETATM 1842 H59 ASP A 1 -7.082 4.849 10.945 1.00 0.06 H HETATM 1843 H57 ASP A 1 -5.082 4.308 13.009 1.00 0.08 H HETATM 1844 H56 ASP A 1 -3.783 3.549 10.521 1.00 0.19 H HETATM 1845 CB ASP A 1 -2.011 5.364 9.217 1.00 -0.01 C HETATM 1846 CG ASP A 1 -0.833 4.719 8.586 1.00 -0.03 C HETATM 1847 CD ASP A 1 -0.482 3.513 9.467 1.00 0.04 C HETATM 1848 H54 ASP A 1 -0.893 2.585 9.043 1.00 0.05 H HETATM 1849 H55 ASP A 1 0.608 3.413 9.580 1.00 0.05 H HETATM 1850 H52 ASP A 1 0.012 5.422 8.548 1.00 0.03 H HETATM 1851 H53 ASP A 1 -1.080 4.387 7.567 1.00 0.03 H HETATM 1852 H50 ASP A 1 -2.049 6.435 8.970 1.00 0.03 H HETATM 1853 H51 ASP A 1 -2.943 4.879 8.891 1.00 0.03 H HETATM 1854 H49 ASP A 1 -1.124 5.940 11.120 1.00 0.08 H HETATM 1855 CB ASP A 1 -0.960 0.791 12.817 1.00 0.08 C HETATM 1856 OG ASP A 1 -0.796 -0.556 12.388 1.00 -0.39 O HETATM 1857 H48 ASP A 1 0.127 -0.733 12.250 1.00 0.21 H HETATM 1858 H46 ASP A 1 -2.028 1.001 12.976 1.00 0.06 H HETATM 1859 H47 ASP A 1 -0.411 0.949 13.757 1.00 0.06 H HETATM 1860 H45 ASP A 1 -0.610 1.282 10.749 1.00 0.08 H HETATM 1861 H44 ASP A 1 1.431 2.799 11.899 1.00 0.19 H HETATM 1862 CB ASP A 1 3.528 2.363 13.054 1.00 -0.00 C HETATM 1863 CG ASP A 1 5.023 2.561 13.346 1.00 0.00 C HETATM 1864 CD ASP A 1 5.775 2.927 12.071 1.00 0.04 C HETATM 1865 OE1 ASP A 1 5.188 3.581 11.221 1.00 -0.57 O HETATM 1866 OE2 ASP A 1 6.924 2.541 11.952 1.00 -0.57 O HETATM 1867 H42 ASP A 1 5.438 1.628 13.755 1.00 0.04 H HETATM 1868 H43 ASP A 1 5.144 3.370 14.082 1.00 0.04 H HETATM 1869 H40 ASP A 1 2.987 2.216 14.001 1.00 0.03 H HETATM 1870 H41 ASP A 1 3.135 3.253 12.541 1.00 0.03 H HETATM 1871 H39 ASP A 1 3.829 0.269 12.627 1.00 0.08 H HETATM 1872 H38 ASP A 1 4.416 2.226 10.674 1.00 0.19 H HETATM 1873 CB ASP A 1 3.591 0.411 7.389 1.00 0.02 C HETATM 1874 CG ASP A 1 4.013 -0.914 6.788 1.00 -0.05 C HETATM 1875 CD1 ASP A 1 4.366 -1.995 7.614 1.00 -0.07 C HETATM 1876 CE1 ASP A 1 4.762 -3.211 7.046 1.00 -0.04 C HETATM 1877 CZ ASP A 1 4.806 -3.348 5.659 1.00 0.08 C HETATM 1878 CE2 ASP A 1 4.453 -2.276 4.837 1.00 -0.04 C HETATM 1879 CD2 ASP A 1 4.055 -1.063 5.397 1.00 -0.07 C HETATM 1880 H34 ASP A 1 3.778 -0.235 4.755 1.00 0.05 H HETATM 1881 H36 ASP A 1 4.489 -2.387 3.759 1.00 0.05 H HETATM 1882 OH ASP A 1 5.223 -4.537 5.093 1.00 -0.34 O HETATM 1883 H37 ASP A 1 5.425 -5.160 5.781 1.00 0.25 H HETATM 1884 H35 ASP A 1 5.034 -4.045 7.683 1.00 0.05 H HETATM 1885 H33 ASP A 1 4.332 -1.887 8.692 1.00 0.05 H HETATM 1886 H31 ASP A 1 3.633 1.188 6.612 1.00 0.05 H HETATM 1887 H32 ASP A 1 2.561 0.324 7.765 1.00 0.05 H HETATM 1888 H30 ASP A 1 4.690 1.896 8.513 1.00 0.08 H HETATM 1889 H29 ASP A 1 5.828 -0.847 8.224 1.00 0.19 H HETATM 1890 CB ASP A 1 7.923 -1.541 8.830 1.00 -0.01 C HETATM 1891 CG1 ASP A 1 9.102 -2.432 8.439 1.00 -0.06 C HETATM 1892 H23 ASP A 1 8.867 -3.479 8.682 1.00 0.02 H HETATM 1893 H24 ASP A 1 9.998 -2.119 8.994 1.00 0.02 H HETATM 1894 H25 ASP A 1 9.289 -2.340 7.359 1.00 0.02 H HETATM 1895 CG2 ASP A 1 7.659 -1.683 10.331 1.00 -0.06 C HETATM 1896 H26 ASP A 1 6.811 -1.043 10.616 1.00 0.02 H HETATM 1897 H27 ASP A 1 8.555 -1.376 10.891 1.00 0.02 H HETATM 1898 H28 ASP A 1 7.422 -2.732 10.564 1.00 0.02 H HETATM 1899 H22 ASP A 1 7.029 -1.857 8.271 1.00 0.03 H HETATM 1900 H21 ASP A 1 8.598 -0.009 7.460 1.00 0.08 H HETATM 1901 H20 ASP A 1 9.003 1.028 10.160 1.00 0.19 H HETATM 1902 CB ASP A 1 11.426 2.318 10.175 1.00 -0.00 C HETATM 1903 CG ASP A 1 11.048 2.811 8.766 1.00 0.00 C HETATM 1904 CD ASP A 1 11.875 2.111 7.688 1.00 0.04 C HETATM 1905 OE1 ASP A 1 13.057 1.887 7.913 1.00 -0.57 O HETATM 1906 OE2 ASP A 1 11.313 1.814 6.647 1.00 -0.57 O HETATM 1907 H18 ASP A 1 11.227 3.895 8.706 1.00 0.04 H HETATM 1908 H19 ASP A 1 9.982 2.605 8.589 1.00 0.04 H HETATM 1909 H16 ASP A 1 12.396 2.752 10.461 1.00 0.03 H HETATM 1910 H17 ASP A 1 10.655 2.642 10.889 1.00 0.03 H HETATM 1911 H15 ASP A 1 11.268 0.433 11.215 1.00 0.08 H HETATM 1912 H14 ASP A 1 13.399 0.843 9.173 1.00 0.19 H HETATM 1913 CB ASP A 1 15.807 -0.977 11.480 1.00 0.09 C HETATM 1914 OG1 ASP A 1 17.066 -0.358 11.234 1.00 -0.39 O HETATM 1915 H10 ASP A 1 16.929 0.551 10.995 1.00 0.21 H HETATM 1916 CG2 ASP A 1 16.032 -2.437 11.872 1.00 -0.03 C HETATM 1917 H11 ASP A 1 16.653 -2.482 12.779 1.00 0.03 H HETATM 1918 H12 ASP A 1 16.543 -2.962 11.052 1.00 0.03 H HETATM 1919 H13 ASP A 1 15.062 -2.918 12.068 1.00 0.03 H HETATM 1920 H9 ASP A 1 15.296 -0.453 12.301 1.00 0.06 H HETATM 1921 H8 ASP A 1 14.951 -1.886 9.713 1.00 0.08 H HETATM 1922 H7 ASP A 1 15.906 0.921 9.696 1.00 0.19 H HETATM 1923 CB ASP A 1 17.353 1.632 7.932 1.00 0.06 C HETATM 1924 CG ASP A 1 16.866 2.457 9.108 1.00 0.04 C HETATM 1925 OD1 ASP A 1 16.478 3.587 8.884 1.00 -0.57 O HETATM 1926 OD2 ASP A 1 16.850 1.922 10.210 1.00 -0.57 O HETATM 1927 H5 ASP A 1 17.942 2.269 7.256 1.00 0.05 H HETATM 1928 H6 ASP A 1 17.982 0.807 8.298 1.00 0.05 H HETATM 1929 H4 ASP A 1 16.487 0.654 6.211 1.00 0.11 H HETATM 1930 H1 ASP A 1 15.611 2.888 6.401 1.00 0.20 H HETATM 1931 H2 ASP A 1 14.857 2.526 7.818 1.00 0.20 H HETATM 1932 H3 ASP A 1 14.382 1.793 6.423 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1737 1738 1930 1931 1932 CONECT 1738 1737 1739 1923 1929 CONECT 1739 1738 1740 1741 CONECT 1740 1739 CONECT 1741 1739 1742 1922 CONECT 1742 1741 1743 1913 1921 CONECT 1743 1742 1744 1745 CONECT 1744 1743 CONECT 1745 1743 1746 1912 CONECT 1746 1745 1747 1902 1911 CONECT 1747 1746 1748 1749 CONECT 1748 1747 CONECT 1749 1747 1750 1901 CONECT 1750 1749 1751 1890 1900 CONECT 1751 1750 1752 1753 CONECT 1752 1751 CONECT 1753 1751 1754 1889 CONECT 1754 1753 1755 1873 1888 CONECT 1755 1754 1756 1757 CONECT 1756 1755 CONECT 1757 1755 1758 1872 CONECT 1758 1757 1759 1862 1871 CONECT 1759 1758 1760 1761 CONECT 1760 1759 CONECT 1761 1759 1762 1861 CONECT 1762 1761 1763 1855 1860 CONECT 1763 1762 1764 1765 CONECT 1764 1763 CONECT 1765 1763 1766 1847 CONECT 1766 1765 1767 1845 1854 CONECT 1767 1766 1768 1769 CONECT 1768 1767 CONECT 1769 1767 1770 1844 CONECT 1770 1769 1771 1825 1843 CONECT 1771 1770 1772 1773 CONECT 1772 1771 CONECT 1773 1771 1774 1824 CONECT 1774 1773 1775 1819 1823 CONECT 1775 1774 1776 1777 CONECT 1776 1775 CONECT 1777 1775 1778 1818 CONECT 1778 1777 1779 1811 1817 CONECT 1779 1778 1780 1781 CONECT 1780 1779 CONECT 1781 1779 1782 1803 CONECT 1782 1781 1783 1801 1810 CONECT 1783 1782 1784 1785 CONECT 1784 1783 CONECT 1785 1783 1786 1800 CONECT 1786 1785 1787 1790 1799 CONECT 1787 1786 1788 1789 CONECT 1788 1787 CONECT 1789 1787 CONECT 1790 1786 1791 1797 1798 CONECT 1791 1790 1792 1795 1796 CONECT 1792 1791 1793 1794 CONECT 1793 1792 CONECT 1794 1792 CONECT 1795 1791 CONECT 1796 1791 CONECT 1797 1790 CONECT 1798 1790 CONECT 1799 1786 CONECT 1800 1785 CONECT 1801 1782 1802 1808 1809 CONECT 1802 1801 1803 1806 1807 CONECT 1803 1781 1802 1804 1805 CONECT 1804 1803 CONECT 1805 1803 CONECT 1806 1802 CONECT 1807 1802 CONECT 1808 1801 CONECT 1809 1801 CONECT 1810 1782 CONECT 1811 1778 1812 1815 1816 CONECT 1812 1811 1813 1814 CONECT 1813 1812 CONECT 1814 1812 CONECT 1815 1811 CONECT 1816 1811 CONECT 1817 1778 CONECT 1818 1777 CONECT 1819 1774 1820 1821 1822 CONECT 1820 1819 CONECT 1821 1819 CONECT 1822 1819 CONECT 1823 1774 CONECT 1824 1773 CONECT 1825 1770 1826 1841 1842 CONECT 1826 1825 1827 1831 CONECT 1827 1826 1828 1840 CONECT 1828 1827 1829 1839 CONECT 1829 1828 1830 1834 CONECT 1830 1829 1831 1833 CONECT 1831 1826 1830 1832 CONECT 1832 1831 CONECT 1833 1830 CONECT 1834 1829 1835 CONECT 1835 1834 1836 1837 1838 CONECT 1836 1835 CONECT 1837 1835 CONECT 1838 1835 CONECT 1839 1828 CONECT 1840 1827 CONECT 1841 1825 CONECT 1842 1825 CONECT 1843 1770 CONECT 1844 1769 CONECT 1845 1766 1846 1852 1853 CONECT 1846 1845 1847 1850 1851 CONECT 1847 1765 1846 1848 1849 CONECT 1848 1847 CONECT 1849 1847 CONECT 1850 1846 CONECT 1851 1846 CONECT 1852 1845 CONECT 1853 1845 CONECT 1854 1766 CONECT 1855 1762 1856 1858 1859 CONECT 1856 1855 1857 CONECT 1857 1856 CONECT 1858 1855 CONECT 1859 1855 CONECT 1860 1762 CONECT 1861 1761 CONECT 1862 1758 1863 1869 1870 CONECT 1863 1862 1864 1867 1868 CONECT 1864 1863 1865 1866 CONECT 1865 1864 CONECT 1866 1864 CONECT 1867 1863 CONECT 1868 1863 CONECT 1869 1862 CONECT 1870 1862 CONECT 1871 1758 CONECT 1872 1757 CONECT 1873 1754 1874 1886 1887 CONECT 1874 1873 1875 1879 CONECT 1875 1874 1876 1885 CONECT 1876 1875 1877 1884 CONECT 1877 1876 1878 1882 CONECT 1878 1877 1879 1881 CONECT 1879 1874 1878 1880 CONECT 1880 1879 CONECT 1881 1878 CONECT 1882 1877 1883 CONECT 1883 1882 CONECT 1884 1876 CONECT 1885 1875 CONECT 1886 1873 CONECT 1887 1873 CONECT 1888 1754 CONECT 1889 1753 CONECT 1890 1750 1891 1895 1899 CONECT 1891 1890 1892 1893 1894 CONECT 1892 1891 CONECT 1893 1891 CONECT 1894 1891 CONECT 1895 1890 1896 1897 1898 CONECT 1896 1895 CONECT 1897 1895 CONECT 1898 1895 CONECT 1899 1890 CONECT 1900 1750 CONECT 1901 1749 CONECT 1902 1746 1903 1909 1910 CONECT 1903 1902 1904 1907 1908 CONECT 1904 1903 1905 1906 CONECT 1905 1904 CONECT 1906 1904 CONECT 1907 1903 CONECT 1908 1903 CONECT 1909 1902 CONECT 1910 1902 CONECT 1911 1746 CONECT 1912 1745 CONECT 1913 1742 1914 1916 1920 CONECT 1914 1913 1915 CONECT 1915 1914 CONECT 1916 1913 1917 1918 1919 CONECT 1917 1916 CONECT 1918 1916 CONECT 1919 1916 CONECT 1920 1913 CONECT 1921 1742 CONECT 1922 1741 CONECT 1923 1738 1924 1927 1928 CONECT 1924 1923 1925 1926 CONECT 1925 1924 CONECT 1926 1924 CONECT 1927 1923 CONECT 1928 1923 CONECT 1929 1738 CONECT 1930 1737 CONECT 1931 1737 CONECT 1932 1737 MASTER 0 0 0 0 0 0 0 0 1931 1 200 9 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 2mc1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2lct
RCSB PDB
PDBbind
107aa, >2LCT_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1g6g
RCSB PDB
PDBbind
13-mer
1gag
RCSB PDB
PDBbind
13-mer
1haa
RCSB PDB
PDBbind
13-mer
1hc9
RCSB PDB
PDBbind
13-mer
1i8h
RCSB PDB
PDBbind
13-mer
1j4p
RCSB PDB
PDBbind
13-mer
1j4q
RCSB PDB
PDBbind
13-mer
1juq
RCSB PDB
PDBbind
13-mer
1jwm
RCSB PDB
PDBbind
13-mer
1jws
RCSB PDB
PDBbind
13-mer
1jwu
RCSB PDB
PDBbind
13-mer
1k3n
RCSB PDB
PDBbind
13-mer
1k3q
RCSB PDB
PDBbind
13-mer
1oeb
RCSB PDB
PDBbind
13-mer
1opi
RCSB PDB
PDBbind
13-mer
1osv
RCSB PDB
PDBbind
13-mer
1ow6
RCSB PDB
PDBbind
13-mer
1ow7
RCSB PDB
PDBbind
13-mer
1ow8
RCSB PDB
PDBbind
13-mer
1p4u
RCSB PDB
PDBbind
13-mer
1r5v
RCSB PDB
PDBbind
13-mer
1r5w
RCSB PDB
PDBbind
13-mer
1rgj
RCSB PDB
PDBbind
13-mer
1sjh
RCSB PDB
PDBbind
13-mer
1sm3
RCSB PDB
PDBbind
13-mer
1thr
RCSB PDB
PDBbind
13-mer
1u9l
RCSB PDB
PDBbind
13-mer
1uef
RCSB PDB
PDBbind
13-mer
1yvh
RCSB PDB
PDBbind
13-mer
1ywh
RCSB PDB
PDBbind
13-mer
1zhk
RCSB PDB
PDBbind
13-mer
1zhl
RCSB PDB
PDBbind
13-mer
2a25
RCSB PDB
PDBbind
13-mer
2c9t
RCSB PDB
PDBbind
13-mer
2dwx
RCSB PDB
PDBbind
13-mer
2fts
RCSB PDB
PDBbind
13-mer
2las
RCSB PDB
PDBbind
13-mer
2lct
RCSB PDB
PDBbind
13-mer
2lsp
RCSB PDB
PDBbind
13-mer
2lto
RCSB PDB
PDBbind
13-mer
2lyw
RCSB PDB
PDBbind
13-mer
2mkr
RCSB PDB
PDBbind
13-mer
2ndf
RCSB PDB
PDBbind
13-mer
2ndg
RCSB PDB
PDBbind
13-mer
2qki
RCSB PDB
PDBbind
13-mer
2r0y
RCSB PDB
PDBbind
13-mer
2rnx
RCSB PDB
PDBbind
13-mer
2v87
RCSB PDB
PDBbind
13-mer
2vr3
RCSB PDB
PDBbind
13-mer
3ask
RCSB PDB
PDBbind
13-mer
3bum
RCSB PDB
PDBbind
13-mer
3bun
RCSB PDB
PDBbind
13-mer
3buo
RCSB PDB
PDBbind
13-mer
3buw
RCSB PDB
PDBbind
13-mer
3bux
RCSB PDB
PDBbind
13-mer
3c3o
RCSB PDB
PDBbind
13-mer
3c3r
RCSB PDB
PDBbind
13-mer
3coj
RCSB PDB
PDBbind
13-mer
3e1r
RCSB PDB
PDBbind
13-mer
3eg6
RCSB PDB
PDBbind
13-mer
3emh
RCSB PDB
PDBbind
13-mer
3g2s
RCSB PDB
PDBbind
13-mer
3g2t
RCSB PDB
PDBbind
13-mer
3g2u
RCSB PDB
PDBbind
13-mer
3g2v
RCSB PDB
PDBbind
13-mer
3ml4
RCSB PDB
PDBbind
13-mer
3n5u
RCSB PDB
PDBbind
13-mer
3nfk
RCSB PDB
PDBbind
13-mer
3nti
RCSB PDB
PDBbind
13-mer
3o1d
RCSB PDB
PDBbind
13-mer
3o1e
RCSB PDB
PDBbind
13-mer
3q5u
RCSB PDB
PDBbind
13-mer
3rqf
RCSB PDB
PDBbind
13-mer
3rqg
RCSB PDB
PDBbind
13-mer
3rz9
RCSB PDB
PDBbind
13-mer
3s7f
RCSB PDB
PDBbind
13-mer
3tdz
RCSB PDB
PDBbind
13-mer
3ui2
RCSB PDB
PDBbind
13-mer
4abi
RCSB PDB
PDBbind
13-mer
4abj
RCSB PDB
PDBbind
13-mer
4b9w
RCSB PDB
PDBbind
13-mer
4bea
RCSB PDB
PDBbind
13-mer
4bv2
RCSB PDB
PDBbind
13-mer
4f14
RCSB PDB
PDBbind
13-mer
4f20
RCSB PDB
PDBbind
13-mer
4h3q
RCSB PDB
PDBbind
13-mer
4ib5
RCSB PDB
PDBbind
13-mer
4jmg
RCSB PDB
PDBbind
13-mer
4jmh
RCSB PDB
PDBbind
13-mer
4l1u
RCSB PDB
PDBbind
13-mer
4m7c
RCSB PDB
PDBbind
13-mer
4mz5
RCSB PDB
PDBbind
13-mer
4mz6
RCSB PDB
PDBbind
13-mer
4n7h
RCSB PDB
PDBbind
13-mer
4po7
RCSB PDB
PDBbind
13-mer
4qh8
RCSB PDB
PDBbind
13-mer
4rme
RCSB PDB
PDBbind
13-mer
4um9
RCSB PDB
PDBbind
13-mer
4umn
RCSB PDB
PDBbind
13-mer
4w4z
RCSB PDB
PDBbind
13-mer
4wj7
RCSB PDB
PDBbind
13-mer
4x3e
RCSB PDB
PDBbind
13-mer
4yjl
RCSB PDB
PDBbind
13-mer
4z0d
RCSB PDB
PDBbind
13-mer
4z0e
RCSB PDB
PDBbind
13-mer
4z0f
RCSB PDB
PDBbind
13-mer
5cil
RCSB PDB
PDBbind
13-mer
5dd0
RCSB PDB
PDBbind
13-mer
5dhf
RCSB PDB
PDBbind
13-mer
5dx3
RCSB PDB
PDBbind
13-mer
5dxb
RCSB PDB
PDBbind
13-mer
5dxe
RCSB PDB
PDBbind
13-mer
5dxg
RCSB PDB
PDBbind
13-mer
5e0m
RCSB PDB
PDBbind
13-mer
5eay
RCSB PDB
PDBbind
13-mer
5eyz
RCSB PDB
PDBbind
13-mer
5fyq
RCSB PDB
PDBbind
13-mer
5gg4
RCSB PDB
PDBbind
13-mer
5h1e
RCSB PDB
PDBbind
13-mer
5h7g
RCSB PDB
PDBbind
13-mer
5hyr
RCSB PDB
PDBbind
13-mer
5hyx
RCSB PDB
PDBbind
13-mer
5jr2
RCSB PDB
PDBbind
13-mer
5kgn
RCSB PDB
PDBbind
13-mer
5lgp
RCSB PDB
PDBbind
13-mer
5lu2
RCSB PDB
PDBbind
13-mer
5n8b
RCSB PDB
PDBbind
13-mer
5n8e
RCSB PDB
PDBbind
13-mer
5n8t
RCSB PDB
PDBbind
13-mer
5t6j
RCSB PDB
PDBbind
13-mer
5u6k
RCSB PDB
PDBbind
13-mer
5umz
RCSB PDB
PDBbind
13-mer
5vqi
RCSB PDB
PDBbind
13-mer
5wgd
RCSB PDB
PDBbind
13-mer
5wgq
RCSB PDB
PDBbind
13-mer
5yyz
RCSB PDB
PDBbind
13-mer
6bij
RCSB PDB
PDBbind
13-mer
6bil
RCSB PDB
PDBbind
13-mer
6bin
RCSB PDB
PDBbind
13-mer
6bir
RCSB PDB
PDBbind
13-mer
6biv
RCSB PDB
PDBbind
13-mer
6bix
RCSB PDB
PDBbind
13-mer
6biy
RCSB PDB
PDBbind
13-mer
6bnh
RCSB PDB
PDBbind
13-mer
6cf6
RCSB PDB
PDBbind
13-mer
6drt
RCSB PDB
PDBbind
13-mer
6e8k
RCSB PDB
PDBbind
13-mer
6e8m
RCSB PDB
PDBbind
13-mer
6o7g
RCSB PDB
PDBbind
13-mer
6o3y
RCSB PDB
PDBbind
13-mer
6nkp
RCSB PDB
PDBbind
13-mer
6n9t
RCSB PDB
PDBbind
13-mer
6n87
RCSB PDB
PDBbind
13-mer
6n7q
RCSB PDB
PDBbind
13-mer
6hy7
RCSB PDB
PDBbind
13-mer
6bcy
RCSB PDB
PDBbind
13-mer
5yy9
RCSB PDB
PDBbind
13-mer
5mtw
RCSB PDB
PDBbind
13-mer
Entry Information
PDB ID
2mc1
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Proto-oncogene vav
Ligand Name
13-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=71uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Biopolymers Vol. 99: pp. 897-907
Ligand Properties
Formula
C
6
6
H
9
4
N
1
3
O
3
1
P
Molecular Weight
1596.490
Exact Mass
1595.590
No. of atoms
205
No. of bonds
208
Polar Surface Area
727.26
LOGP Value
-0.31 (
Computed with XLOGP3
)
-3.89 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 30
No. of Rotatable Bonds: 53
No. of Nitrogen and Oxygen Atoms: 44
No. of Rings: 4
Canonical SMILES
OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)Cc1ccc(cc1)O)CCC(=O)O
InChI String
InChI=1S/C66H94N13O31P/c1-30(2)52(76-57(96)39(18-21-48(85)86)70-63(102)53(32(4)81)77-55(94)37(67)27-50(89)90)62(101)73-42(25-33-9-13-35(82)14-10-33)59(98)69-38(17-20-47(83)84)56(95)75-44(29-80)65(104)79-24-6-8-46(79)61(100)72-41(26-34-11-15-36(16-12-34)110-111(107,108)109)58(97)68-31(3)54(93)74-43(28-51(91)92)64(103)78-23-5-7-45(78)60(99)71-40(66(105)106)19-22-49(87)88/h9-16,30-32,37-46,52-53,80-82,107-109,111H,5-8,17-29,67H2,1-4H3,(H,68,97)(H,69,98)(H,70,102)(H,71,99)(H,72,100)(H,73,101)(H,74,93)(H,75,95)(H,76,96)(H,77,94)(H,83,84)(H,85,86)(H,87,88)(H,89,90)(H,91,92)(H,105,106)/p+1/t31-,32+,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,52-,53-/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):
P15498
P48025
Entrez Gene ID
NCBI Entrez Gene ID:
7409
20963
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com