Browse entries in the PDBbind-CN Database
HEADER 6UDY_COMPLEX COMPND 6UDY_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 151 GLU ASP GLU LEU TYR ARG GLN SER LEU GLU ILE ILE SER SEQRES 2 A 151 ARG TYR LEU ARG GLU GLN ALA THR GLY ALA LYS ASP THR SEQRES 3 A 151 LYS PRO MET GLY ARG SER GLY ALA THR SER ARG LYS ALA SEQRES 4 A 151 LEU GLU THR LEU ARG ARG VAL GLY ASP GLY VAL GLN ARG SEQRES 5 A 151 ASN HIS GLU THR ALA PHE GLN GLY MET LEU ARG LYS LEU SEQRES 6 A 151 ASP ILE LYS ASN GLU ASP ASP VAL LYS SER LEU SER ARG SEQRES 7 A 151 VAL MET ILE HIS VAL PHE SER ASP GLY VAL THR ASN TRP SEQRES 8 A 151 GLY ARG ILE VAL THR LEU ILE SER PHE GLY ALA PHE VAL SEQRES 9 A 151 ALA LYS HIS LEU LYS THR ILE ASN GLN GLU SER CYS ILE SEQRES 10 A 151 GLU PRO LEU ALA GLU SER ILE THR ASP VAL LEU VAL ARG SEQRES 11 A 151 THR LYS ARG ASP TRP LEU VAL LYS GLN ARG GLY TRP ASP SEQRES 12 A 151 GLY PHE VAL GLU PHE PHE HIS VAL HET Q A 54 54 ATOM 1 N GLU A 171 -20.140 33.657 -4.898 1.00 34.75 N ATOM 2 CA GLU A 171 -19.108 32.679 -5.351 1.00 33.51 C ATOM 3 C GLU A 171 -19.784 31.455 -5.969 1.00 32.38 C ATOM 4 O GLU A 171 -20.893 31.115 -5.603 1.00 33.97 O ATOM 5 CB GLU A 171 -18.236 32.262 -4.165 1.00 34.49 C ATOM 6 HN3 GLU A 171 -20.753 33.208 -4.187 1.00 0.00 H ATOM 7 HN2 GLU A 171 -20.713 33.956 -5.712 1.00 0.00 H ATOM 8 HN1 GLU A 171 -19.671 34.485 -4.479 1.00 0.00 H ATOM 9 N ASP A 172 -19.101 30.783 -6.886 1.00 30.12 N ATOM 10 CA ASP A 172 -19.647 29.594 -7.549 1.00 26.32 C ATOM 11 C ASP A 172 -19.713 28.461 -6.525 1.00 25.64 C ATOM 12 O ASP A 172 -18.754 27.702 -6.373 1.00 25.14 O ATOM 13 CB ASP A 172 -18.726 29.175 -8.703 1.00 24.89 C ATOM 14 CG ASP A 172 -19.382 28.207 -9.664 1.00 22.50 C ATOM 15 OD1 ASP A 172 -20.263 27.433 -9.243 1.00 21.05 O ATOM 16 OD2 ASP A 172 -18.991 28.211 -10.844 1.00 22.56 O ATOM 17 H ASP A 172 -18.148 31.110 -7.143 1.00 0.00 H ATOM 18 N GLU A 173 -20.831 28.348 -5.819 1.00 24.46 N ATOM 19 CA GLU A 173 -20.959 27.314 -4.809 1.00 24.42 C ATOM 20 C GLU A 173 -21.044 25.896 -5.350 1.00 22.65 C ATOM 21 O GLU A 173 -20.550 24.968 -4.731 1.00 21.05 O ATOM 22 CB GLU A 173 -22.147 27.627 -3.906 1.00 27.82 C ATOM 23 CG GLU A 173 -21.821 28.743 -2.933 1.00 32.50 C ATOM 24 CD GLU A 173 -23.017 29.477 -2.425 1.00 36.39 C ATOM 25 OE1 GLU A 173 -23.965 28.809 -1.941 1.00 38.00 O ATOM 26 OE2 GLU A 173 -23.032 30.730 -2.510 1.00 37.66 O ATOM 27 H GLU A 173 -21.620 29.004 -5.991 1.00 0.00 H ATOM 28 N LEU A 174 -21.657 25.725 -6.511 1.00 20.69 N ATOM 29 CA LEU A 174 -21.745 24.393 -7.094 1.00 19.50 C ATOM 30 C LEU A 174 -20.341 23.911 -7.456 1.00 18.43 C ATOM 31 O LEU A 174 -19.998 22.746 -7.229 1.00 17.22 O ATOM 32 CB LEU A 174 -22.620 24.389 -8.350 1.00 20.08 C ATOM 33 CG LEU A 174 -22.609 23.057 -9.112 1.00 20.85 C ATOM 34 CD1 LEU A 174 -23.106 21.931 -8.216 1.00 21.47 C ATOM 35 CD2 LEU A 174 -23.470 23.157 -10.347 1.00 20.65 C ATOM 36 H LEU A 174 -22.074 26.539 -7.005 1.00 0.00 H ATOM 37 N TYR A 175 -19.522 24.801 -8.011 1.00 18.30 N ATOM 38 CA TYR A 175 -18.170 24.417 -8.384 1.00 18.20 C ATOM 39 C TYR A 175 -17.348 24.065 -7.147 1.00 18.73 C ATOM 40 O TYR A 175 -16.665 23.044 -7.116 1.00 18.07 O ATOM 41 CB TYR A 175 -17.442 25.547 -9.125 1.00 18.97 C ATOM 42 CG TYR A 175 -16.085 25.114 -9.655 1.00 20.74 C ATOM 43 CD1 TYR A 175 -15.960 24.588 -10.938 1.00 21.70 C ATOM 44 CD2 TYR A 175 -14.946 25.137 -8.836 1.00 22.04 C ATOM 45 CE1 TYR A 175 -14.745 24.093 -11.395 1.00 22.19 C ATOM 46 CE2 TYR A 175 -13.718 24.640 -9.281 1.00 22.64 C ATOM 47 CZ TYR A 175 -13.626 24.116 -10.564 1.00 23.52 C ATOM 48 OH TYR A 175 -12.430 23.604 -11.025 1.00 24.51 O ATOM 49 HH TYR A 175 -12.548 23.277 -11.952 1.00 0.00 H ATOM 50 H TYR A 175 -19.850 25.774 -8.178 1.00 0.00 H ATOM 51 N ARG A 176 -17.402 24.921 -6.130 1.00 17.90 N ATOM 52 CA ARG A 176 -16.619 24.679 -4.923 1.00 18.82 C ATOM 53 C ARG A 176 -17.004 23.359 -4.260 1.00 17.39 C ATOM 54 O ARG A 176 -16.152 22.623 -3.761 1.00 18.06 O ATOM 55 CB ARG A 176 -16.829 25.806 -3.918 1.00 20.97 C ATOM 56 CG ARG A 176 -15.902 25.722 -2.727 1.00 25.79 C ATOM 57 CD ARG A 176 -16.598 26.207 -1.457 1.00 28.27 C ATOM 58 NE ARG A 176 -17.730 25.346 -1.115 1.00 30.84 N ATOM 59 CZ ARG A 176 -17.638 24.172 -0.496 1.00 30.72 C ATOM 60 NH1 ARG A 176 -16.457 23.699 -0.124 1.00 31.59 N ATOM 61 NH2 ARG A 176 -18.737 23.462 -0.277 1.00 29.11 N ATOM 62 HE ARG A 176 -18.681 25.677 -1.376 1.00 0.00 H ATOM 63 HH12 ARG A 176 -16.394 22.780 0.359 1.00 0.00 H ATOM 64 HH11 ARG A 176 -15.594 24.246 -0.316 1.00 0.00 H ATOM 65 HH22 ARG A 176 -18.675 22.543 0.206 1.00 0.00 H ATOM 66 HH21 ARG A 176 -19.661 23.824 -0.588 1.00 0.00 H ATOM 67 H ARG A 176 -18.005 25.766 -6.196 1.00 0.00 H ATOM 68 N GLN A 177 -18.300 23.065 -4.231 1.00 16.58 N ATOM 69 CA GLN A 177 -18.733 21.814 -3.610 1.00 16.63 C ATOM 70 C GLN A 177 -18.370 20.610 -4.430 1.00 17.02 C ATOM 71 O GLN A 177 -18.015 19.587 -3.863 1.00 16.80 O ATOM 72 CB GLN A 177 -20.247 21.789 -3.367 1.00 17.93 C ATOM 73 CG GLN A 177 -20.722 20.686 -2.591 1.00 18.93 C ATOM 74 CD GLN A 177 -22.200 20.632 -2.350 1.00 20.18 C ATOM 75 OE1 GLN A 177 -22.664 19.976 -1.402 1.00 22.51 O ATOM 76 NE2 GLN A 177 -22.963 21.345 -3.186 1.00 19.71 N ATOM 77 HE22 GLN A 177 -22.524 21.877 -3.965 1.00 0.00 H ATOM 78 HE21 GLN A 177 -23.995 21.367 -3.057 1.00 0.00 H ATOM 79 H GLN A 177 -18.997 23.716 -4.645 1.00 0.00 H ATOM 80 N SER A 178 -18.472 20.727 -5.750 1.00 16.68 N ATOM 81 CA SER A 178 -18.130 19.621 -6.629 1.00 17.19 C ATOM 82 C SER A 178 -16.646 19.277 -6.478 1.00 17.74 C ATOM 83 O SER A 178 -16.285 18.105 -6.373 1.00 17.97 O ATOM 84 CB SER A 178 -18.435 20.001 -8.075 1.00 16.54 C ATOM 85 OG SER A 178 -19.819 20.245 -8.227 1.00 15.05 O ATOM 86 HG SER A 178 -20.090 20.987 -7.630 1.00 0.00 H ATOM 87 H SER A 178 -18.802 21.624 -6.160 1.00 0.00 H ATOM 88 N LEU A 179 -15.796 20.301 -6.450 1.00 18.13 N ATOM 89 CA LEU A 179 -14.359 20.083 -6.310 1.00 18.70 C ATOM 90 C LEU A 179 -14.016 19.414 -4.972 1.00 18.62 C ATOM 91 O LEU A 179 -13.179 18.512 -4.912 1.00 18.59 O ATOM 92 CB LEU A 179 -13.609 21.417 -6.440 1.00 19.32 C ATOM 93 CG LEU A 179 -12.077 21.319 -6.419 1.00 20.21 C ATOM 94 CD1 LEU A 179 -11.601 20.411 -7.536 1.00 21.47 C ATOM 95 CD2 LEU A 179 -11.462 22.692 -6.555 1.00 21.07 C ATOM 96 H LEU A 179 -16.161 21.272 -6.529 1.00 0.00 H ATOM 97 N GLU A 180 -14.647 19.860 -3.891 1.00 18.65 N ATOM 98 CA GLU A 180 -14.356 19.257 -2.596 1.00 19.73 C ATOM 99 C GLU A 180 -14.738 17.774 -2.584 1.00 18.61 C ATOM 100 O GLU A 180 -13.976 16.937 -2.115 1.00 19.31 O ATOM 101 CB GLU A 180 -15.074 20.002 -1.470 1.00 21.79 C ATOM 102 CG GLU A 180 -14.734 19.455 -0.088 1.00 25.86 C ATOM 103 CD GLU A 180 -14.903 20.481 1.025 1.00 28.82 C ATOM 104 OE1 GLU A 180 -16.004 21.061 1.124 1.00 29.86 O ATOM 105 OE2 GLU A 180 -13.932 20.692 1.784 1.00 30.54 O ATOM 106 H GLU A 180 -15.341 20.631 -3.968 1.00 0.00 H ATOM 107 N ILE A 181 -15.906 17.447 -3.118 1.00 17.37 N ATOM 108 CA ILE A 181 -16.360 16.071 -3.145 1.00 17.21 C ATOM 109 C ILE A 181 -15.488 15.186 -4.025 1.00 17.49 C ATOM 110 O ILE A 181 -15.071 14.102 -3.619 1.00 17.40 O ATOM 111 CB ILE A 181 -17.808 15.988 -3.663 1.00 17.32 C ATOM 112 CG1 ILE A 181 -18.753 16.615 -2.639 1.00 17.10 C ATOM 113 CG2 ILE A 181 -18.174 14.532 -3.954 1.00 16.83 C ATOM 114 CD1 ILE A 181 -20.157 16.853 -3.140 1.00 16.93 C ATOM 115 H ILE A 181 -16.508 18.191 -3.525 1.00 0.00 H ATOM 116 N ILE A 182 -15.211 15.665 -5.231 1.00 16.97 N ATOM 117 CA ILE A 182 -14.390 14.930 -6.187 1.00 17.47 C ATOM 118 C ILE A 182 -12.934 14.792 -5.709 1.00 18.09 C ATOM 119 O ILE A 182 -12.359 13.717 -5.815 1.00 17.20 O ATOM 120 CB ILE A 182 -14.449 15.615 -7.573 1.00 17.39 C ATOM 121 CG1 ILE A 182 -15.861 15.499 -8.148 1.00 17.49 C ATOM 122 CG2 ILE A 182 -13.424 14.976 -8.517 1.00 17.75 C ATOM 123 CD1 ILE A 182 -16.080 16.255 -9.470 1.00 18.55 C ATOM 124 H ILE A 182 -15.591 16.594 -5.503 1.00 0.00 H ATOM 125 N SER A 183 -12.363 15.870 -5.182 1.00 18.28 N ATOM 126 CA SER A 183 -11.009 15.818 -4.689 1.00 19.97 C ATOM 127 C SER A 183 -10.871 14.840 -3.525 1.00 20.21 C ATOM 128 O SER A 183 -9.953 14.037 -3.477 1.00 21.00 O ATOM 129 CB SER A 183 -10.497 17.211 -4.244 1.00 21.34 C ATOM 130 OG SER A 183 -10.441 18.109 -5.292 1.00 26.00 O ATOM 131 HG SER A 183 -11.346 18.223 -5.676 1.00 0.00 H ATOM 132 H SER A 183 -12.898 16.760 -5.125 1.00 0.00 H ATOM 133 N ARG A 184 -11.780 14.898 -2.570 1.00 19.48 N ATOM 134 CA ARG A 184 -11.698 13.989 -1.432 1.00 19.84 C ATOM 135 C ARG A 184 -11.830 12.529 -1.816 1.00 19.04 C ATOM 136 O ARG A 184 -11.094 11.692 -1.325 1.00 20.44 O ATOM 137 CB ARG A 184 -12.750 14.359 -0.376 1.00 20.47 C ATOM 138 CG ARG A 184 -12.540 15.733 0.232 1.00 22.90 C ATOM 139 CD ARG A 184 -13.170 15.802 1.599 1.00 24.72 C ATOM 140 NE ARG A 184 -12.906 17.079 2.254 1.00 27.92 N ATOM 141 CZ ARG A 184 -12.904 17.256 3.569 1.00 27.32 C ATOM 142 NH1 ARG A 184 -13.147 16.238 4.373 1.00 27.30 N ATOM 143 NH2 ARG A 184 -12.667 18.458 4.071 1.00 28.06 N ATOM 144 HE ARG A 184 -12.707 17.903 1.652 1.00 0.00 H ATOM 145 HH12 ARG A 184 -13.145 16.377 5.404 1.00 0.00 H ATOM 146 HH11 ARG A 184 -13.340 15.296 3.976 1.00 0.00 H ATOM 147 HH22 ARG A 184 -12.665 18.600 5.101 1.00 0.00 H ATOM 148 HH21 ARG A 184 -12.483 19.260 3.435 1.00 0.00 H ATOM 149 H ARG A 184 -12.554 15.591 -2.629 1.00 0.00 H ATOM 150 N TYR A 185 -12.757 12.219 -2.710 1.00 17.74 N ATOM 151 CA TYR A 185 -12.926 10.826 -3.133 1.00 17.57 C ATOM 152 C TYR A 185 -11.667 10.336 -3.850 1.00 17.80 C ATOM 153 O TYR A 185 -11.147 9.278 -3.518 1.00 17.65 O ATOM 154 CB TYR A 185 -14.137 10.676 -4.062 1.00 17.77 C ATOM 155 CG TYR A 185 -14.392 9.260 -4.501 1.00 17.48 C ATOM 156 CD1 TYR A 185 -14.618 8.253 -3.567 1.00 17.54 C ATOM 157 CD2 TYR A 185 -14.425 8.925 -5.858 1.00 18.54 C ATOM 158 CE1 TYR A 185 -14.880 6.943 -3.975 1.00 18.26 C ATOM 159 CE2 TYR A 185 -14.683 7.632 -6.270 1.00 18.43 C ATOM 160 CZ TYR A 185 -14.913 6.640 -5.326 1.00 17.86 C ATOM 161 OH TYR A 185 -15.209 5.350 -5.734 1.00 19.85 O ATOM 162 HH TYR A 185 -15.343 4.776 -4.939 1.00 0.00 H ATOM 163 H TYR A 185 -13.364 12.963 -3.111 1.00 0.00 H ATOM 164 N LEU A 186 -11.163 11.119 -4.796 1.00 16.91 N ATOM 165 CA LEU A 186 -9.970 10.702 -5.510 1.00 18.97 C ATOM 166 C LEU A 186 -8.778 10.508 -4.557 1.00 20.13 C ATOM 167 O LEU A 186 -8.065 9.530 -4.660 1.00 21.48 O ATOM 168 CB LEU A 186 -9.612 11.723 -6.621 1.00 18.58 C ATOM 169 CG LEU A 186 -10.121 11.414 -8.039 1.00 17.82 C ATOM 170 CD1 LEU A 186 -11.646 11.351 -8.044 1.00 19.15 C ATOM 171 CD2 LEU A 186 -9.619 12.456 -9.004 1.00 18.22 C ATOM 172 H LEU A 186 -11.620 12.025 -5.024 1.00 0.00 H ATOM 173 N ARG A 187 -8.554 11.480 -3.672 1.00 21.25 N ATOM 174 CA ARG A 187 -7.440 11.390 -2.740 1.00 22.61 C ATOM 175 C ARG A 187 -7.601 10.180 -1.814 1.00 22.59 C ATOM 176 O ARG A 187 -6.605 9.474 -1.507 1.00 22.84 O ATOM 177 CB ARG A 187 -7.281 12.625 -1.843 1.00 24.54 C ATOM 178 CG ARG A 187 -7.139 13.967 -2.540 1.00 28.54 C ATOM 179 CD ARG A 187 -6.658 15.014 -1.729 1.00 30.90 C ATOM 180 NE ARG A 187 -7.777 16.067 -1.583 1.00 34.49 N ATOM 181 CZ ARG A 187 -8.543 16.183 -0.489 1.00 35.66 C ATOM 182 NH1 ARG A 187 -8.315 15.361 0.565 1.00 36.48 N ATOM 183 NH2 ARG A 187 -9.546 16.999 -0.500 1.00 36.82 N ATOM 184 HE ARG A 187 -7.945 16.720 -2.374 1.00 0.00 H ATOM 185 HH12 ARG A 187 -8.901 15.438 1.421 1.00 0.00 H ATOM 186 HH11 ARG A 187 -7.555 14.653 0.517 1.00 0.00 H ATOM 187 HH22 ARG A 187 -10.146 17.096 0.344 1.00 0.00 H ATOM 188 HH21 ARG A 187 -9.752 17.558 -1.352 1.00 0.00 H ATOM 189 H ARG A 187 -9.181 12.310 -3.648 1.00 0.00 H ATOM 190 N GLU A 188 -8.829 9.945 -1.353 1.00 22.55 N ATOM 191 CA GLU A 188 -9.116 8.844 -0.460 1.00 23.53 C ATOM 192 C GLU A 188 -8.914 7.500 -1.148 1.00 22.91 C ATOM 193 O GLU A 188 -8.475 6.536 -0.531 1.00 23.41 O ATOM 194 CB GLU A 188 -10.546 9.013 0.041 1.00 25.68 C ATOM 195 CG GLU A 188 -11.013 7.947 1.027 1.00 28.81 C ATOM 196 CD GLU A 188 -12.421 8.235 1.538 1.00 30.76 C ATOM 197 OE1 GLU A 188 -12.650 9.336 2.061 1.00 31.87 O ATOM 198 OE2 GLU A 188 -13.283 7.357 1.378 1.00 33.44 O ATOM 199 H GLU A 188 -9.605 10.573 -1.644 1.00 0.00 H ATOM 200 N GLN A 189 -9.256 7.442 -2.424 1.00 22.96 N ATOM 201 CA GLN A 189 -9.104 6.225 -3.177 1.00 22.81 C ATOM 202 C GLN A 189 -7.632 5.925 -3.379 1.00 23.05 C ATOM 203 O GLN A 189 -7.197 4.768 -3.270 1.00 23.78 O ATOM 204 CB GLN A 189 -9.810 6.370 -4.519 1.00 23.38 C ATOM 205 CG GLN A 189 -11.322 6.364 -4.415 1.00 22.28 C ATOM 206 CD GLN A 189 -11.887 4.962 -4.324 1.00 22.59 C ATOM 207 OE1 GLN A 189 -11.704 4.159 -5.220 1.00 23.04 O ATOM 208 NE2 GLN A 189 -12.581 4.666 -3.235 1.00 22.68 N ATOM 209 HE22 GLN A 189 -12.714 5.382 -2.492 1.00 0.00 H ATOM 210 HE21 GLN A 189 -12.993 3.718 -3.123 1.00 0.00 H ATOM 211 H GLN A 189 -9.641 8.288 -2.890 1.00 0.00 H ATOM 212 N ALA A 190 -6.860 6.964 -3.662 1.00 23.48 N ATOM 213 CA ALA A 190 -5.431 6.784 -3.901 1.00 24.84 C ATOM 214 C ALA A 190 -4.602 6.482 -2.651 1.00 26.50 C ATOM 215 O ALA A 190 -3.653 5.706 -2.718 1.00 26.45 O ATOM 216 CB ALA A 190 -4.860 8.016 -4.597 1.00 23.76 C ATOM 217 H ALA A 190 -7.276 7.916 -3.714 1.00 0.00 H ATOM 218 N THR A 191 -4.949 7.079 -1.518 1.00 28.06 N ATOM 219 CA THR A 191 -4.174 6.849 -0.317 1.00 29.95 C ATOM 220 C THR A 191 -4.711 5.781 0.634 1.00 31.12 C ATOM 221 O THR A 191 -3.965 5.235 1.472 1.00 30.90 O ATOM 222 CB THR A 191 -3.986 8.174 0.447 1.00 30.25 C ATOM 223 OG1 THR A 191 -5.241 8.621 0.990 1.00 31.19 O ATOM 224 CG2 THR A 191 -3.439 9.240 -0.502 1.00 30.47 C ATOM 225 HG1 THR A 191 -5.887 8.762 0.253 1.00 0.00 H ATOM 226 H THR A 191 -5.775 7.710 -1.493 1.00 0.00 H ATOM 227 N GLY A 192 -5.993 5.464 0.509 1.00 31.50 N ATOM 228 CA GLY A 192 -6.575 4.469 1.390 1.00 32.77 C ATOM 229 C GLY A 192 -6.905 5.037 2.763 1.00 33.69 C ATOM 230 O GLY A 192 -7.217 4.303 3.697 1.00 34.27 O ATOM 231 H GLY A 192 -6.578 5.926 -0.216 1.00 0.00 H ATOM 232 N ALA A 193 -6.842 6.357 2.886 1.00 34.20 N ATOM 233 CA ALA A 193 -7.143 7.024 4.143 1.00 34.87 C ATOM 234 C ALA A 193 -8.121 8.179 3.978 1.00 35.17 C ATOM 235 O ALA A 193 -8.078 8.893 2.989 1.00 34.95 O ATOM 236 CB ALA A 193 -5.852 7.517 4.781 1.00 35.19 C ATOM 237 H ALA A 193 -6.570 6.930 2.062 1.00 0.00 H ATOM 238 N LYS A 194 -8.998 8.365 4.959 1.00 36.19 N ATOM 239 CA LYS A 194 -9.988 9.442 4.903 1.00 37.09 C ATOM 240 C LYS A 194 -9.381 10.769 5.353 1.00 36.88 C ATOM 241 O LYS A 194 -8.459 10.796 6.176 1.00 37.39 O ATOM 242 CB LYS A 194 -11.174 9.145 5.809 1.00 38.58 C ATOM 243 CG LYS A 194 -11.998 7.932 5.435 1.00 40.29 C ATOM 244 CD LYS A 194 -13.263 7.885 6.271 1.00 41.58 C ATOM 245 CE LYS A 194 -13.998 6.568 6.098 1.00 42.70 C ATOM 246 NZ LYS A 194 -14.173 6.225 4.660 1.00 44.05 N ATOM 247 HZ1 LYS A 194 -14.722 6.973 4.191 1.00 0.00 H ATOM 248 HZ2 LYS A 194 -13.240 6.143 4.208 1.00 0.00 H ATOM 249 HZ3 LYS A 194 -14.679 5.320 4.580 1.00 0.00 H ATOM 250 H LYS A 194 -8.981 7.732 5.784 1.00 0.00 H ATOM 251 N ASP A 195 -9.893 11.865 4.804 1.00 36.26 N ATOM 252 CA ASP A 195 -9.411 13.195 5.161 1.00 36.26 C ATOM 253 C ASP A 195 -10.326 13.627 6.301 1.00 36.14 C ATOM 254 O ASP A 195 -11.504 13.833 6.115 1.00 36.25 O ATOM 255 CB ASP A 195 -9.556 14.135 3.962 1.00 36.91 C ATOM 256 CG ASP A 195 -9.086 15.555 4.249 1.00 37.28 C ATOM 257 OD1 ASP A 195 -8.495 15.798 5.313 1.00 37.91 O ATOM 258 OD2 ASP A 195 -9.313 16.423 3.382 1.00 38.09 O ATOM 259 H ASP A 195 -10.656 11.773 4.103 1.00 0.00 H ATOM 260 N THR A 196 -9.783 13.743 7.503 1.00 35.77 N ATOM 261 CA THR A 196 -10.607 14.128 8.647 1.00 36.55 C ATOM 262 C THR A 196 -10.931 15.619 8.769 1.00 36.35 C ATOM 263 O THR A 196 -11.616 16.029 9.686 1.00 35.81 O ATOM 264 CB THR A 196 -10.018 13.619 9.976 1.00 37.00 C ATOM 265 OG1 THR A 196 -8.816 14.313 10.287 1.00 38.27 O ATOM 266 CG2 THR A 196 -9.724 12.120 9.881 1.00 37.59 C ATOM 267 HG1 THR A 196 -8.452 13.973 11.143 1.00 0.00 H ATOM 268 H THR A 196 -8.768 13.560 7.633 1.00 0.00 H ATOM 269 N LYS A 197 -10.444 16.424 7.831 1.00 36.25 N ATOM 270 CA LYS A 197 -10.719 17.852 7.861 1.00 36.33 C ATOM 271 C LYS A 197 -12.208 18.080 7.708 1.00 35.95 C ATOM 272 O LYS A 197 -12.886 17.349 6.971 1.00 36.19 O ATOM 273 CB LYS A 197 -9.964 18.567 6.756 1.00 37.20 C ATOM 274 CG LYS A 197 -8.569 19.053 7.182 1.00 38.83 C ATOM 275 CD LYS A 197 -7.885 19.827 6.037 1.00 39.84 C ATOM 276 CE LYS A 197 -6.970 18.921 5.244 1.00 40.41 C ATOM 277 NZ LYS A 197 -5.644 19.582 5.101 1.00 41.67 N ATOM 278 HZ1 LYS A 197 -5.761 20.488 4.603 1.00 0.00 H ATOM 279 HZ2 LYS A 197 -5.240 19.753 6.044 1.00 0.00 H ATOM 280 HZ3 LYS A 197 -5.008 18.966 4.556 1.00 0.00 H ATOM 281 H LYS A 197 -9.860 16.029 7.067 1.00 0.00 H ATOM 282 N PRO A 198 -12.719 19.175 8.297 1.00 35.44 N ATOM 283 CA PRO A 198 -14.166 19.413 8.170 1.00 34.74 C ATOM 284 C PRO A 198 -14.479 19.825 6.723 1.00 34.58 C ATOM 285 O PRO A 198 -13.606 20.301 5.969 1.00 33.50 O ATOM 286 CB PRO A 198 -14.404 20.567 9.124 1.00 34.62 C ATOM 287 CG PRO A 198 -13.363 20.304 10.194 1.00 35.37 C ATOM 288 CD PRO A 198 -12.145 20.016 9.368 1.00 35.22 C ATOM 289 N MET A 199 -15.718 19.612 6.305 1.00 34.44 N ATOM 290 CA MET A 199 -16.128 19.993 4.966 1.00 34.33 C ATOM 291 C MET A 199 -16.372 21.484 4.995 1.00 34.69 C ATOM 292 O MET A 199 -16.607 22.059 6.056 1.00 34.99 O ATOM 293 CB MET A 199 -17.434 19.286 4.577 1.00 34.05 C ATOM 294 CG MET A 199 -17.318 17.808 4.395 1.00 33.87 C ATOM 295 SD MET A 199 -16.576 17.441 2.824 1.00 34.16 S ATOM 296 CE MET A 199 -17.056 15.708 2.651 1.00 34.54 C ATOM 297 H MET A 199 -16.406 19.166 6.945 1.00 0.00 H ATOM 298 N GLY A 200 -16.301 22.115 3.832 1.00 35.04 N ATOM 299 CA GLY A 200 -16.576 23.539 3.778 1.00 35.42 C ATOM 300 C GLY A 200 -18.083 23.682 3.760 1.00 35.87 C ATOM 301 O GLY A 200 -18.788 22.907 4.397 1.00 35.99 O ATOM 302 H GLY A 200 -16.051 21.595 2.967 1.00 0.00 H ATOM 303 N ARG A 201 -18.578 24.654 3.008 1.00 35.77 N ATOM 304 CA ARG A 201 -20.007 24.899 2.905 1.00 36.17 C ATOM 305 C ARG A 201 -20.772 23.645 2.444 1.00 35.43 C ATOM 306 O ARG A 201 -20.220 22.787 1.751 1.00 35.20 O ATOM 307 CB ARG A 201 -20.266 26.069 1.939 1.00 38.25 C ATOM 308 CG ARG A 201 -21.657 26.642 2.032 1.00 40.56 C ATOM 309 CD ARG A 201 -21.818 27.918 1.178 1.00 42.87 C ATOM 310 NE ARG A 201 -20.673 28.820 1.316 1.00 45.22 N ATOM 311 CZ ARG A 201 -20.760 30.147 1.284 1.00 46.07 C ATOM 312 NH1 ARG A 201 -21.949 30.738 1.130 1.00 46.74 N ATOM 313 NH2 ARG A 201 -19.657 30.881 1.382 1.00 47.45 N ATOM 314 HE ARG A 201 -19.732 28.396 1.447 1.00 0.00 H ATOM 315 HH12 ARG A 201 -22.015 31.776 1.105 1.00 0.00 H ATOM 316 HH11 ARG A 201 -22.808 30.160 1.035 1.00 0.00 H ATOM 317 HH22 ARG A 201 -19.719 31.919 1.358 1.00 0.00 H ATOM 318 HH21 ARG A 201 -18.731 30.418 1.483 1.00 0.00 H ATOM 319 H ARG A 201 -17.923 25.261 2.474 1.00 0.00 H ATOM 320 N SER A 202 -22.042 23.551 2.842 1.00 33.75 N ATOM 321 CA SER A 202 -22.897 22.410 2.495 1.00 32.09 C ATOM 322 C SER A 202 -22.267 21.089 2.910 1.00 30.53 C ATOM 323 O SER A 202 -22.423 20.083 2.219 1.00 29.31 O ATOM 324 CB SER A 202 -23.183 22.400 0.992 1.00 32.59 C ATOM 325 OG SER A 202 -23.895 23.547 0.606 1.00 33.72 O ATOM 326 HG SER A 202 -23.362 24.353 0.822 1.00 0.00 H ATOM 327 H SER A 202 -22.442 24.317 3.421 1.00 0.00 H ATOM 328 N GLY A 203 -21.572 21.106 4.046 1.00 29.07 N ATOM 329 CA GLY A 203 -20.912 19.908 4.534 1.00 27.72 C ATOM 330 C GLY A 203 -21.777 18.668 4.674 1.00 26.48 C ATOM 331 O GLY A 203 -21.383 17.588 4.230 1.00 26.02 O ATOM 332 H GLY A 203 -21.501 21.989 4.591 1.00 0.00 H ATOM 333 N ALA A 204 -22.953 18.808 5.283 1.00 25.59 N ATOM 334 CA ALA A 204 -23.838 17.665 5.463 1.00 25.12 C ATOM 335 C ALA A 204 -24.036 16.940 4.131 1.00 24.69 C ATOM 336 O ALA A 204 -23.818 15.738 4.042 1.00 24.49 O ATOM 337 CB ALA A 204 -25.174 18.119 6.017 1.00 26.12 C ATOM 338 H ALA A 204 -23.243 19.743 5.634 1.00 0.00 H ATOM 339 N THR A 205 -24.436 17.678 3.100 1.00 23.97 N ATOM 340 CA THR A 205 -24.665 17.102 1.785 1.00 23.96 C ATOM 341 C THR A 205 -23.395 16.514 1.198 1.00 23.81 C ATOM 342 O THR A 205 -23.409 15.409 0.665 1.00 22.35 O ATOM 343 CB THR A 205 -25.228 18.148 0.802 1.00 25.63 C ATOM 344 OG1 THR A 205 -26.569 18.488 1.167 1.00 27.25 O ATOM 345 CG2 THR A 205 -25.222 17.604 -0.621 1.00 26.60 C ATOM 346 HG1 THR A 205 -26.923 19.160 0.531 1.00 0.00 H ATOM 347 H THR A 205 -24.590 18.697 3.238 1.00 0.00 H ATOM 348 N SER A 206 -22.287 17.235 1.305 1.00 23.06 N ATOM 349 CA SER A 206 -21.027 16.724 0.768 1.00 22.78 C ATOM 350 C SER A 206 -20.614 15.414 1.443 1.00 22.99 C ATOM 351 O SER A 206 -20.086 14.499 0.796 1.00 22.23 O ATOM 352 CB SER A 206 -19.922 17.754 0.935 1.00 22.45 C ATOM 353 OG SER A 206 -20.229 18.921 0.174 1.00 23.92 O ATOM 354 HG SER A 206 -19.506 19.587 0.287 1.00 0.00 H ATOM 355 H SER A 206 -22.315 18.164 1.771 1.00 0.00 H ATOM 356 N ARG A 207 -20.855 15.309 2.746 1.00 22.42 N ATOM 357 CA ARG A 207 -20.514 14.081 3.454 1.00 23.34 C ATOM 358 C ARG A 207 -21.328 12.900 2.933 1.00 23.41 C ATOM 359 O ARG A 207 -20.795 11.806 2.750 1.00 23.81 O ATOM 360 CB ARG A 207 -20.723 14.247 4.966 1.00 25.88 C ATOM 361 CG ARG A 207 -19.581 14.980 5.674 1.00 28.37 C ATOM 362 CD ARG A 207 -19.675 14.844 7.180 1.00 30.03 C ATOM 363 NE ARG A 207 -20.787 15.609 7.746 1.00 31.39 N ATOM 364 CZ ARG A 207 -20.802 16.933 7.863 1.00 32.21 C ATOM 365 NH1 ARG A 207 -19.767 17.645 7.458 1.00 32.46 N ATOM 366 NH2 ARG A 207 -21.852 17.553 8.378 1.00 32.72 N ATOM 367 HE ARG A 207 -21.620 15.082 8.078 1.00 0.00 H ATOM 368 HH12 ARG A 207 -19.780 18.681 7.550 1.00 0.00 H ATOM 369 HH11 ARG A 207 -18.938 17.170 7.047 1.00 0.00 H ATOM 370 HH22 ARG A 207 -21.853 18.589 8.465 1.00 0.00 H ATOM 371 HH21 ARG A 207 -22.676 17.004 8.696 1.00 0.00 H ATOM 372 H ARG A 207 -21.287 16.103 3.260 1.00 0.00 H ATOM 373 N LYS A 208 -22.614 13.131 2.683 1.00 22.74 N ATOM 374 CA LYS A 208 -23.485 12.081 2.176 1.00 23.23 C ATOM 375 C LYS A 208 -23.125 11.764 0.729 1.00 22.99 C ATOM 376 O LYS A 208 -23.234 10.613 0.286 1.00 21.97 O ATOM 377 CB LYS A 208 -24.950 12.503 2.281 1.00 24.93 C ATOM 378 CG LYS A 208 -25.438 12.693 3.706 1.00 26.61 C ATOM 379 CD LYS A 208 -26.955 12.770 3.777 1.00 28.77 C ATOM 380 CE LYS A 208 -27.495 14.015 3.115 1.00 30.95 C ATOM 381 NZ LYS A 208 -27.166 15.275 3.844 1.00 32.55 N ATOM 382 HZ1 LYS A 208 -27.568 15.235 4.802 1.00 0.00 H ATOM 383 HZ2 LYS A 208 -26.133 15.380 3.904 1.00 0.00 H ATOM 384 HZ3 LYS A 208 -27.568 16.086 3.332 1.00 0.00 H ATOM 385 H LYS A 208 -23.004 14.080 2.853 1.00 0.00 H ATOM 386 N ALA A 209 -22.697 12.789 -0.005 1.00 23.06 N ATOM 387 CA ALA A 209 -22.303 12.578 -1.388 1.00 23.33 C ATOM 388 C ALA A 209 -21.064 11.677 -1.428 1.00 23.34 C ATOM 389 O ALA A 209 -20.934 10.817 -2.297 1.00 22.01 O ATOM 390 CB ALA A 209 -22.013 13.919 -2.071 1.00 24.60 C ATOM 391 H ALA A 209 -22.645 13.741 0.411 1.00 0.00 H ATOM 392 N LEU A 210 -20.168 11.879 -0.466 1.00 23.87 N ATOM 393 CA LEU A 210 -18.934 11.117 -0.393 1.00 24.71 C ATOM 394 C LEU A 210 -19.233 9.666 -0.004 1.00 25.32 C ATOM 395 O LEU A 210 -18.666 8.701 -0.580 1.00 24.38 O ATOM 396 CB LEU A 210 -17.987 11.712 0.627 1.00 25.93 C ATOM 397 CG LEU A 210 -16.516 11.263 0.631 1.00 27.31 C ATOM 398 CD1 LEU A 210 -15.939 11.372 -0.781 1.00 27.41 C ATOM 399 CD2 LEU A 210 -15.701 12.132 1.602 1.00 26.90 C ATOM 400 H LEU A 210 -20.357 12.604 0.255 1.00 0.00 H ATOM 401 N GLU A 211 -20.157 9.454 0.930 1.00 25.70 N ATOM 402 CA GLU A 211 -20.480 8.068 1.294 1.00 27.07 C ATOM 403 C GLU A 211 -21.117 7.340 0.119 1.00 26.17 C ATOM 404 O GLU A 211 -20.879 6.178 -0.083 1.00 25.55 O ATOM 405 CB GLU A 211 -21.405 8.053 2.523 1.00 29.51 C ATOM 406 CG GLU A 211 -21.956 6.700 2.700 1.00 34.31 C ATOM 407 CD GLU A 211 -22.866 6.535 3.883 1.00 37.81 C ATOM 408 OE1 GLU A 211 -23.522 7.551 4.242 1.00 40.10 O ATOM 409 OE2 GLU A 211 -23.037 5.398 4.317 1.00 39.88 O ATOM 410 H GLU A 211 -20.639 10.251 1.392 1.00 0.00 H ATOM 411 N THR A 212 -21.916 8.083 -0.646 1.00 25.21 N ATOM 412 CA THR A 212 -22.614 7.543 -1.822 1.00 23.58 C ATOM 413 C THR A 212 -21.583 7.081 -2.862 1.00 24.17 C ATOM 414 O THR A 212 -21.730 6.017 -3.483 1.00 23.40 O ATOM 415 CB THR A 212 -23.541 8.586 -2.450 1.00 23.22 C ATOM 416 OG1 THR A 212 -24.536 8.959 -1.497 1.00 21.08 O ATOM 417 CG2 THR A 212 -24.209 8.057 -3.713 1.00 21.87 C ATOM 418 HG1 THR A 212 -24.097 9.341 -0.696 1.00 0.00 H ATOM 419 H THR A 212 -22.051 9.085 -0.401 1.00 0.00 H ATOM 420 N LEU A 213 -20.538 7.885 -3.036 1.00 23.52 N ATOM 421 CA LEU A 213 -19.472 7.613 -3.983 1.00 24.61 C ATOM 422 C LEU A 213 -18.675 6.396 -3.536 1.00 24.86 C ATOM 423 O LEU A 213 -18.282 5.568 -4.350 1.00 24.96 O ATOM 424 CB LEU A 213 -18.566 8.838 -4.080 1.00 24.61 C ATOM 425 CG LEU A 213 -18.133 9.435 -5.431 1.00 26.53 C ATOM 426 CD1 LEU A 213 -19.194 9.278 -6.510 1.00 25.42 C ATOM 427 CD2 LEU A 213 -17.821 10.910 -5.199 1.00 23.31 C ATOM 428 H LEU A 213 -20.482 8.752 -2.465 1.00 0.00 H ATOM 429 N ARG A 214 -18.430 6.282 -2.236 1.00 25.05 N ATOM 430 CA ARG A 214 -17.694 5.130 -1.735 1.00 25.57 C ATOM 431 C ARG A 214 -18.473 3.830 -1.995 1.00 25.65 C ATOM 432 O ARG A 214 -17.878 2.783 -2.187 1.00 25.41 O ATOM 433 CB ARG A 214 -17.448 5.252 -0.233 1.00 26.20 C ATOM 434 CG ARG A 214 -16.499 6.372 0.138 1.00 26.39 C ATOM 435 CD ARG A 214 -16.517 6.555 1.619 1.00 26.76 C ATOM 436 NE ARG A 214 -15.653 7.639 2.055 1.00 27.27 N ATOM 437 CZ ARG A 214 -15.935 8.441 3.074 1.00 27.78 C ATOM 438 NH1 ARG A 214 -17.063 8.275 3.749 1.00 27.76 N ATOM 439 NH2 ARG A 214 -15.095 9.409 3.407 1.00 27.75 N ATOM 440 HE ARG A 214 -14.763 7.795 1.539 1.00 0.00 H ATOM 441 HH12 ARG A 214 -17.288 8.901 4.548 1.00 0.00 H ATOM 442 HH11 ARG A 214 -17.724 7.518 3.480 1.00 0.00 H ATOM 443 HH22 ARG A 214 -15.316 10.037 4.206 1.00 0.00 H ATOM 444 HH21 ARG A 214 -14.214 9.541 2.870 1.00 0.00 H ATOM 445 H ARG A 214 -18.763 7.014 -1.577 1.00 0.00 H ATOM 446 N ARG A 215 -19.798 3.919 -1.965 1.00 25.16 N ATOM 447 CA ARG A 215 -20.633 2.779 -2.173 1.00 25.76 C ATOM 448 C ARG A 215 -20.842 2.426 -3.632 1.00 25.86 C ATOM 449 O ARG A 215 -20.685 1.286 -4.036 1.00 26.97 O ATOM 450 CB ARG A 215 -21.959 2.980 -1.474 1.00 25.58 C ATOM 451 CG ARG A 215 -23.034 1.974 -1.805 1.00 26.78 C ATOM 452 CD ARG A 215 -24.167 2.124 -0.802 1.00 28.00 C ATOM 453 NE ARG A 215 -24.567 3.517 -0.638 1.00 28.48 N ATOM 454 CZ ARG A 215 -25.435 4.150 -1.423 1.00 28.54 C ATOM 455 NH1 ARG A 215 -26.009 3.516 -2.437 1.00 28.31 N ATOM 456 NH2 ARG A 215 -25.738 5.423 -1.190 1.00 27.79 N ATOM 457 HE ARG A 215 -24.144 4.053 0.147 1.00 0.00 H ATOM 458 HH12 ARG A 215 -26.687 4.017 -3.047 1.00 0.00 H ATOM 459 HH11 ARG A 215 -25.781 2.518 -2.622 1.00 0.00 H ATOM 460 HH22 ARG A 215 -26.417 5.917 -1.804 1.00 0.00 H ATOM 461 HH21 ARG A 215 -25.296 5.925 -0.393 1.00 0.00 H ATOM 462 H ARG A 215 -20.239 4.843 -1.785 1.00 0.00 H ATOM 463 N VAL A 216 -21.183 3.408 -4.449 1.00 24.57 N ATOM 464 CA VAL A 216 -21.434 3.165 -5.878 1.00 25.32 C ATOM 465 C VAL A 216 -20.206 3.318 -6.742 1.00 24.91 C ATOM 466 O VAL A 216 -20.072 2.593 -7.737 1.00 26.13 O ATOM 467 CB VAL A 216 -22.532 4.071 -6.437 1.00 25.81 C ATOM 468 CG1 VAL A 216 -22.822 3.697 -7.824 1.00 26.11 C ATOM 469 CG2 VAL A 216 -23.771 3.948 -5.547 1.00 25.18 C ATOM 470 H VAL A 216 -21.276 4.373 -4.073 1.00 0.00 H ATOM 471 N GLY A 217 -19.336 4.253 -6.377 1.00 23.48 N ATOM 472 CA GLY A 217 -18.153 4.477 -7.168 1.00 23.55 C ATOM 473 C GLY A 217 -17.243 3.243 -7.137 1.00 23.66 C ATOM 474 O GLY A 217 -16.679 2.854 -8.180 1.00 23.57 O ATOM 475 H GLY A 217 -19.508 4.821 -5.523 1.00 0.00 H ATOM 476 N ASP A 218 -17.057 2.664 -5.942 1.00 23.19 N ATOM 477 CA ASP A 218 -16.207 1.500 -5.762 1.00 22.54 C ATOM 478 C ASP A 218 -16.757 0.326 -6.573 1.00 22.02 C ATOM 479 O ASP A 218 -15.999 -0.418 -7.196 1.00 22.26 O ATOM 480 CB ASP A 218 -16.134 1.129 -4.289 1.00 23.25 C ATOM 481 CG ASP A 218 -15.366 2.161 -3.456 1.00 24.75 C ATOM 482 OD1 ASP A 218 -15.475 3.377 -3.736 1.00 24.88 O ATOM 483 OD2 ASP A 218 -14.655 1.756 -2.515 1.00 25.78 O ATOM 484 H ASP A 218 -17.540 3.064 -5.112 1.00 0.00 H ATOM 485 N GLY A 219 -18.080 0.171 -6.565 1.00 21.55 N ATOM 486 CA GLY A 219 -18.713 -0.898 -7.308 1.00 20.97 C ATOM 487 C GLY A 219 -18.436 -0.765 -8.794 1.00 20.09 C ATOM 488 O GLY A 219 -18.146 -1.753 -9.470 1.00 20.58 O ATOM 489 H GLY A 219 -18.668 0.829 -6.015 1.00 0.00 H ATOM 490 N VAL A 220 -18.544 0.459 -9.312 1.00 18.55 N ATOM 491 CA VAL A 220 -18.301 0.735 -10.732 1.00 17.92 C ATOM 492 C VAL A 220 -16.905 0.304 -11.178 1.00 16.92 C ATOM 493 O VAL A 220 -16.758 -0.333 -12.225 1.00 15.38 O ATOM 494 CB VAL A 220 -18.472 2.247 -11.050 1.00 18.23 C ATOM 495 CG1 VAL A 220 -17.963 2.553 -12.463 1.00 20.24 C ATOM 496 CG2 VAL A 220 -19.950 2.638 -10.930 1.00 19.34 C ATOM 497 H VAL A 220 -18.810 1.246 -8.687 1.00 0.00 H ATOM 498 N GLN A 221 -15.888 0.652 -10.390 1.00 16.86 N ATOM 499 CA GLN A 221 -14.526 0.280 -10.746 1.00 17.76 C ATOM 500 C GLN A 221 -14.333 -1.229 -10.829 1.00 17.34 C ATOM 501 O GLN A 221 -13.481 -1.697 -11.576 1.00 18.41 O ATOM 502 CB GLN A 221 -13.534 0.869 -9.757 1.00 18.86 C ATOM 503 CG GLN A 221 -13.522 2.383 -9.734 1.00 20.29 C ATOM 504 CD GLN A 221 -12.558 2.933 -8.704 1.00 21.31 C ATOM 505 OE1 GLN A 221 -11.358 2.681 -8.775 1.00 22.25 O ATOM 506 NE2 GLN A 221 -13.079 3.684 -7.735 1.00 19.75 N ATOM 507 HE22 GLN A 221 -14.102 3.871 -7.715 1.00 0.00 H ATOM 508 HE21 GLN A 221 -12.463 4.083 -6.998 1.00 0.00 H ATOM 509 H GLN A 221 -16.068 1.191 -9.519 1.00 0.00 H ATOM 510 N ARG A 222 -15.118 -1.986 -10.066 1.00 18.96 N ATOM 511 CA ARG A 222 -15.011 -3.441 -10.114 1.00 19.42 C ATOM 512 C ARG A 222 -15.838 -4.035 -11.253 1.00 18.77 C ATOM 513 O ARG A 222 -15.353 -4.896 -11.988 1.00 18.60 O ATOM 514 CB ARG A 222 -15.438 -4.048 -8.771 1.00 21.77 C ATOM 515 CG ARG A 222 -14.447 -3.826 -7.656 1.00 26.12 C ATOM 516 CD ARG A 222 -13.255 -4.768 -7.777 1.00 30.55 C ATOM 517 NE ARG A 222 -11.985 -4.048 -7.804 1.00 35.83 N ATOM 518 CZ ARG A 222 -10.801 -4.643 -7.749 1.00 36.86 C ATOM 519 NH1 ARG A 222 -10.720 -5.963 -7.664 1.00 36.83 N ATOM 520 NH2 ARG A 222 -9.708 -3.914 -7.778 1.00 38.15 N ATOM 521 HE ARG A 222 -12.010 -3.010 -7.870 1.00 0.00 H ATOM 522 HH12 ARG A 222 -9.789 -6.425 -7.621 1.00 0.00 H ATOM 523 HH11 ARG A 222 -11.587 -6.537 -7.640 1.00 0.00 H ATOM 524 HH22 ARG A 222 -8.776 -4.373 -7.735 1.00 0.00 H ATOM 525 HH21 ARG A 222 -9.775 -2.878 -7.844 1.00 0.00 H ATOM 526 H ARG A 222 -15.811 -1.539 -9.433 1.00 0.00 H ATOM 527 N ASN A 223 -17.076 -3.574 -11.410 1.00 18.22 N ATOM 528 CA ASN A 223 -17.928 -4.084 -12.466 1.00 17.67 C ATOM 529 C ASN A 223 -17.353 -3.854 -13.856 1.00 17.24 C ATOM 530 O ASN A 223 -17.619 -4.618 -14.768 1.00 17.17 O ATOM 531 CB ASN A 223 -19.319 -3.446 -12.406 1.00 17.33 C ATOM 532 CG ASN A 223 -20.168 -3.977 -11.261 1.00 19.70 C ATOM 533 OD1 ASN A 223 -20.182 -5.166 -10.979 1.00 18.85 O ATOM 534 ND2 ASN A 223 -20.893 -3.090 -10.611 1.00 20.34 N ATOM 535 HD22 ASN A 223 -20.853 -2.087 -10.882 1.00 0.00 H ATOM 536 HD21 ASN A 223 -21.505 -3.393 -9.827 1.00 0.00 H ATOM 537 H ASN A 223 -17.437 -2.840 -10.768 1.00 0.00 H ATOM 538 N HIS A 224 -16.550 -2.813 -14.014 1.00 16.81 N ATOM 539 CA HIS A 224 -15.987 -2.499 -15.311 1.00 17.85 C ATOM 540 C HIS A 224 -14.455 -2.476 -15.309 1.00 17.61 C ATOM 541 O HIS A 224 -13.825 -1.838 -16.148 1.00 17.95 O ATOM 542 CB HIS A 224 -16.568 -1.158 -15.769 1.00 18.30 C ATOM 543 CG HIS A 224 -18.066 -1.154 -15.831 1.00 20.72 C ATOM 544 ND1 HIS A 224 -18.758 -1.704 -16.892 1.00 21.31 N ATOM 545 CD2 HIS A 224 -18.991 -0.769 -14.931 1.00 19.58 C ATOM 546 CE1 HIS A 224 -20.051 -1.664 -16.629 1.00 21.27 C ATOM 547 NE2 HIS A 224 -20.226 -1.106 -15.449 1.00 20.58 N ATOM 548 H HIS A 224 -16.321 -2.213 -13.196 1.00 0.00 H ATOM 549 N GLU A 225 -13.886 -3.217 -14.363 1.00 19.07 N ATOM 550 CA GLU A 225 -12.452 -3.314 -14.178 1.00 20.36 C ATOM 551 C GLU A 225 -11.649 -3.598 -15.439 1.00 19.61 C ATOM 552 O GLU A 225 -10.582 -3.023 -15.642 1.00 20.08 O ATOM 553 CB GLU A 225 -12.137 -4.371 -13.116 1.00 21.82 C ATOM 554 CG GLU A 225 -10.653 -4.554 -12.805 1.00 24.84 C ATOM 555 CD GLU A 225 -10.442 -5.416 -11.569 1.00 25.12 C ATOM 556 OE1 GLU A 225 -10.772 -4.962 -10.453 1.00 26.88 O ATOM 557 OE2 GLU A 225 -9.906 -6.523 -11.668 1.00 26.06 O ATOM 558 H GLU A 225 -14.503 -3.756 -13.722 1.00 0.00 H ATOM 559 N THR A 226 -12.136 -4.485 -16.295 1.00 20.70 N ATOM 560 CA THR A 226 -11.392 -4.796 -17.516 1.00 20.77 C ATOM 561 C THR A 226 -11.366 -3.597 -18.466 1.00 19.44 C ATOM 562 O THR A 226 -10.308 -3.238 -18.985 1.00 18.95 O ATOM 563 CB THR A 226 -11.982 -6.035 -18.222 1.00 22.06 C ATOM 564 OG1 THR A 226 -12.046 -7.115 -17.286 1.00 24.53 O ATOM 565 CG2 THR A 226 -11.110 -6.449 -19.396 1.00 22.34 C ATOM 566 HG1 THR A 226 -12.424 -7.914 -17.732 1.00 0.00 H ATOM 567 H THR A 226 -13.042 -4.957 -16.100 1.00 0.00 H ATOM 568 N ALA A 227 -12.522 -2.963 -18.666 1.00 18.53 N ATOM 569 CA ALA A 227 -12.599 -1.805 -19.549 1.00 16.86 C ATOM 570 C ALA A 227 -11.785 -0.653 -18.965 1.00 15.75 C ATOM 571 O ALA A 227 -11.089 0.072 -19.689 1.00 16.43 O ATOM 572 CB ALA A 227 -14.040 -1.379 -19.739 1.00 16.44 C ATOM 573 H ALA A 227 -13.381 -3.299 -18.185 1.00 0.00 H ATOM 574 N PHE A 228 -11.876 -0.480 -17.651 1.00 15.71 N ATOM 575 CA PHE A 228 -11.127 0.580 -16.979 1.00 15.93 C ATOM 576 C PHE A 228 -9.627 0.358 -17.180 1.00 16.40 C ATOM 577 O PHE A 228 -8.888 1.291 -17.497 1.00 17.16 O ATOM 578 CB PHE A 228 -11.468 0.608 -15.495 1.00 15.60 C ATOM 579 CG PHE A 228 -12.668 1.473 -15.166 1.00 15.71 C ATOM 580 CD1 PHE A 228 -13.685 1.651 -16.096 1.00 16.73 C ATOM 581 CD2 PHE A 228 -12.775 2.111 -13.934 1.00 15.14 C ATOM 582 CE1 PHE A 228 -14.790 2.449 -15.807 1.00 16.44 C ATOM 583 CE2 PHE A 228 -13.880 2.912 -13.637 1.00 15.25 C ATOM 584 CZ PHE A 228 -14.883 3.077 -14.579 1.00 16.02 C ATOM 585 H PHE A 228 -12.489 -1.108 -17.093 1.00 0.00 H ATOM 586 N GLN A 229 -9.182 -0.884 -17.015 1.00 18.05 N ATOM 587 CA GLN A 229 -7.769 -1.217 -17.204 1.00 19.16 C ATOM 588 C GLN A 229 -7.363 -0.952 -18.641 1.00 18.93 C ATOM 589 O GLN A 229 -6.277 -0.460 -18.896 1.00 18.74 O ATOM 590 CB GLN A 229 -7.513 -2.687 -16.859 1.00 19.14 C ATOM 591 CG GLN A 229 -7.731 -3.021 -15.388 1.00 22.62 C ATOM 592 CD GLN A 229 -7.582 -4.499 -15.059 1.00 24.32 C ATOM 593 OE1 GLN A 229 -7.844 -5.362 -15.887 1.00 24.79 O ATOM 594 NE2 GLN A 229 -7.190 -4.792 -13.824 1.00 25.97 N ATOM 595 HE22 GLN A 229 -6.977 -4.028 -13.151 1.00 0.00 H ATOM 596 HE21 GLN A 229 -7.096 -5.785 -13.530 1.00 0.00 H ATOM 597 H GLN A 229 -9.851 -1.634 -16.746 1.00 0.00 H ATOM 598 N GLY A 230 -8.252 -1.286 -19.572 1.00 19.06 N ATOM 599 CA GLY A 230 -7.977 -1.050 -20.978 1.00 19.39 C ATOM 600 C GLY A 230 -7.830 0.414 -21.360 1.00 19.87 C ATOM 601 O GLY A 230 -6.933 0.789 -22.110 1.00 20.52 O ATOM 602 H GLY A 230 -9.154 -1.721 -19.290 1.00 0.00 H ATOM 603 N MET A 231 -8.732 1.248 -20.859 1.00 18.51 N ATOM 604 CA MET A 231 -8.686 2.673 -21.162 1.00 18.33 C ATOM 605 C MET A 231 -7.439 3.294 -20.538 1.00 18.53 C ATOM 606 O MET A 231 -6.759 4.104 -21.157 1.00 19.90 O ATOM 607 CB MET A 231 -9.946 3.353 -20.633 1.00 19.39 C ATOM 608 CG MET A 231 -10.004 4.846 -20.897 1.00 19.54 C ATOM 609 SD MET A 231 -9.767 5.237 -22.632 1.00 22.65 S ATOM 610 CE MET A 231 -11.408 4.935 -23.289 1.00 20.85 C ATOM 611 H MET A 231 -9.483 0.880 -20.241 1.00 0.00 H ATOM 612 N LEU A 232 -7.134 2.897 -19.308 1.00 19.08 N ATOM 613 CA LEU A 232 -5.958 3.412 -18.613 1.00 19.13 C ATOM 614 C LEU A 232 -4.730 3.108 -19.465 1.00 20.41 C ATOM 615 O LEU A 232 -3.867 3.956 -19.641 1.00 20.90 O ATOM 616 CB LEU A 232 -5.794 2.732 -17.245 1.00 18.37 C ATOM 617 CG LEU A 232 -4.606 3.240 -16.430 1.00 18.09 C ATOM 618 CD1 LEU A 232 -4.792 4.720 -16.149 1.00 20.15 C ATOM 619 CD2 LEU A 232 -4.474 2.459 -15.141 1.00 17.64 C ATOM 620 H LEU A 232 -7.746 2.205 -18.830 1.00 0.00 H ATOM 621 N ARG A 233 -4.660 1.886 -19.987 1.00 21.48 N ATOM 622 CA ARG A 233 -3.527 1.498 -20.814 1.00 22.46 C ATOM 623 C ARG A 233 -3.436 2.358 -22.057 1.00 22.79 C ATOM 624 O ARG A 233 -2.334 2.794 -22.467 1.00 22.87 O ATOM 625 CB ARG A 233 -3.618 0.033 -21.236 1.00 23.28 C ATOM 626 CG ARG A 233 -2.679 -0.338 -22.374 1.00 25.51 C ATOM 627 CD ARG A 233 -3.029 -1.691 -23.001 1.00 27.83 C ATOM 628 NE ARG A 233 -2.282 -1.923 -24.239 1.00 29.14 N ATOM 629 CZ ARG A 233 -0.984 -2.201 -24.292 1.00 29.16 C ATOM 630 NH1 ARG A 233 -0.284 -2.290 -23.180 1.00 28.55 N ATOM 631 NH2 ARG A 233 -0.384 -2.391 -25.459 1.00 27.60 N ATOM 632 HE ARG A 233 -2.803 -1.866 -25.137 1.00 0.00 H ATOM 633 HH12 ARG A 233 0.732 -2.508 -23.221 1.00 0.00 H ATOM 634 HH11 ARG A 233 -0.747 -2.143 -22.261 1.00 0.00 H ATOM 635 HH22 ARG A 233 0.633 -2.608 -25.492 1.00 0.00 H ATOM 636 HH21 ARG A 233 -0.930 -2.323 -26.342 1.00 0.00 H ATOM 637 H ARG A 233 -5.422 1.202 -19.802 1.00 0.00 H ATOM 638 N LYS A 234 -4.584 2.585 -22.698 1.00 22.62 N ATOM 639 CA LYS A 234 -4.639 3.412 -23.934 1.00 23.34 C ATOM 640 C LYS A 234 -4.121 4.819 -23.678 1.00 23.01 C ATOM 641 O LYS A 234 -3.472 5.388 -24.546 1.00 22.77 O ATOM 642 CB LYS A 234 -6.100 3.467 -24.452 1.00 25.25 C ATOM 643 CG LYS A 234 -6.351 4.085 -25.788 1.00 28.13 C ATOM 644 CD LYS A 234 -7.743 3.929 -26.288 1.00 30.43 C ATOM 645 CE LYS A 234 -8.285 5.084 -27.071 1.00 32.23 C ATOM 646 NZ LYS A 234 -9.757 5.211 -27.120 1.00 33.78 N ATOM 647 HZ1 LYS A 234 -10.163 4.357 -27.552 1.00 0.00 H ATOM 648 HZ2 LYS A 234 -10.127 5.322 -26.154 1.00 0.00 H ATOM 649 HZ3 LYS A 234 -10.013 6.044 -27.688 1.00 0.00 H ATOM 650 H LYS A 234 -5.463 2.173 -22.324 1.00 0.00 H ATOM 651 N LEU A 235 -4.490 5.363 -22.515 1.00 22.35 N ATOM 652 CA LEU A 235 -4.107 6.708 -22.149 1.00 22.25 C ATOM 653 C LEU A 235 -2.608 6.847 -21.833 1.00 22.57 C ATOM 654 O LEU A 235 -2.041 7.953 -21.860 1.00 23.06 O ATOM 655 CB LEU A 235 -4.933 7.192 -20.969 1.00 20.76 C ATOM 656 CG LEU A 235 -6.446 7.294 -21.212 1.00 20.79 C ATOM 657 CD1 LEU A 235 -7.191 7.505 -19.912 1.00 19.75 C ATOM 658 CD2 LEU A 235 -6.727 8.414 -22.206 1.00 20.40 C ATOM 659 H LEU A 235 -5.068 4.804 -21.855 1.00 0.00 H ATOM 660 N ASP A 236 -1.986 5.722 -21.497 1.00 22.35 N ATOM 661 CA ASP A 236 -0.567 5.666 -21.188 1.00 23.53 C ATOM 662 C ASP A 236 -0.115 6.906 -20.407 1.00 22.93 C ATOM 663 O ASP A 236 0.574 7.767 -20.943 1.00 24.50 O ATOM 664 CB ASP A 236 0.216 5.537 -22.496 1.00 23.85 C ATOM 665 CG ASP A 236 1.670 5.176 -22.269 1.00 24.68 C ATOM 666 OD1 ASP A 236 1.928 4.235 -21.497 1.00 26.45 O ATOM 667 OD2 ASP A 236 2.554 5.825 -22.851 1.00 25.97 O ATOM 668 H ASP A 236 -2.539 4.842 -21.453 1.00 0.00 H ATOM 669 N ILE A 237 -0.497 6.978 -19.138 1.00 23.07 N ATOM 670 CA ILE A 237 -0.131 8.107 -18.307 1.00 23.33 C ATOM 671 C ILE A 237 1.182 7.883 -17.574 1.00 24.33 C ATOM 672 O ILE A 237 1.270 7.018 -16.712 1.00 23.21 O ATOM 673 CB ILE A 237 -1.237 8.389 -17.291 1.00 23.12 C ATOM 674 CG1 ILE A 237 -2.559 8.597 -18.014 1.00 22.26 C ATOM 675 CG2 ILE A 237 -0.891 9.626 -16.469 1.00 22.83 C ATOM 676 CD1 ILE A 237 -3.762 8.554 -17.092 1.00 23.91 C ATOM 677 H ILE A 237 -1.069 6.210 -18.733 1.00 0.00 H ATOM 678 N LYS A 238 2.172 8.702 -17.918 1.00 25.11 N ATOM 679 CA LYS A 238 3.509 8.608 -17.353 1.00 26.78 C ATOM 680 C LYS A 238 3.974 9.889 -16.658 1.00 27.69 C ATOM 681 O LYS A 238 4.921 9.854 -15.880 1.00 29.03 O ATOM 682 CB LYS A 238 4.531 8.305 -18.454 1.00 26.31 C ATOM 683 CG LYS A 238 4.205 7.128 -19.349 1.00 26.02 C ATOM 684 CD LYS A 238 5.145 7.080 -20.558 1.00 26.76 C ATOM 685 CE LYS A 238 4.892 8.278 -21.487 1.00 26.47 C ATOM 686 NZ LYS A 238 3.437 8.357 -21.869 1.00 25.92 N ATOM 687 HZ1 LYS A 238 3.162 7.484 -22.362 1.00 0.00 H ATOM 688 HZ2 LYS A 238 2.860 8.468 -21.011 1.00 0.00 H ATOM 689 HZ3 LYS A 238 3.288 9.173 -22.496 1.00 0.00 H ATOM 690 H LYS A 238 1.982 9.443 -18.623 1.00 0.00 H ATOM 691 N ASN A 239 3.320 11.016 -16.933 1.00 28.41 N ATOM 692 CA ASN A 239 3.752 12.286 -16.371 1.00 28.28 C ATOM 693 C ASN A 239 2.659 13.360 -16.370 1.00 28.91 C ATOM 694 O ASN A 239 1.496 13.093 -16.709 1.00 27.91 O ATOM 695 CB ASN A 239 4.930 12.764 -17.199 1.00 28.66 C ATOM 696 CG ASN A 239 4.626 12.718 -18.689 1.00 28.97 C ATOM 697 OD1 ASN A 239 5.264 11.991 -19.443 1.00 30.63 O ATOM 698 ND2 ASN A 239 3.619 13.473 -19.109 1.00 29.02 N ATOM 699 HD22 ASN A 239 3.104 14.075 -18.435 1.00 0.00 H ATOM 700 HD21 ASN A 239 3.344 13.462 -20.112 1.00 0.00 H ATOM 701 H ASN A 239 2.489 10.988 -17.558 1.00 0.00 H ATOM 702 N GLU A 240 3.039 14.582 -15.995 1.00 28.60 N ATOM 703 CA GLU A 240 2.099 15.709 -15.936 1.00 29.69 C ATOM 704 C GLU A 240 1.468 16.043 -17.286 1.00 29.55 C ATOM 705 O GLU A 240 0.274 16.305 -17.365 1.00 29.39 O ATOM 706 CB GLU A 240 2.787 16.979 -15.395 1.00 31.05 C ATOM 707 CG GLU A 240 1.848 18.189 -15.379 1.00 33.54 C ATOM 708 CD GLU A 240 2.521 19.464 -14.910 1.00 35.34 C ATOM 709 OE1 GLU A 240 3.557 19.818 -15.493 1.00 37.07 O ATOM 710 OE2 GLU A 240 2.003 20.100 -13.968 1.00 36.65 O ATOM 711 H GLU A 240 4.033 14.742 -15.736 1.00 0.00 H ATOM 712 N ASP A 241 2.275 16.053 -18.343 1.00 29.59 N ATOM 713 CA ASP A 241 1.733 16.366 -19.650 1.00 29.33 C ATOM 714 C ASP A 241 0.624 15.369 -19.989 1.00 28.46 C ATOM 715 O ASP A 241 -0.423 15.739 -20.524 1.00 27.92 O ATOM 716 CB ASP A 241 2.828 16.325 -20.709 1.00 31.53 C ATOM 717 CG ASP A 241 3.804 17.478 -20.579 1.00 34.42 C ATOM 718 OD1 ASP A 241 3.356 18.640 -20.521 1.00 36.02 O ATOM 719 OD2 ASP A 241 5.032 17.247 -20.544 1.00 36.64 O ATOM 720 H ASP A 241 3.287 15.838 -18.233 1.00 0.00 H ATOM 721 N ASP A 242 0.851 14.096 -19.679 1.00 26.89 N ATOM 722 CA ASP A 242 -0.147 13.071 -19.961 1.00 25.80 C ATOM 723 C ASP A 242 -1.399 13.361 -19.150 1.00 26.07 C ATOM 724 O ASP A 242 -2.502 13.154 -19.636 1.00 26.14 O ATOM 725 CB ASP A 242 0.372 11.680 -19.595 1.00 25.24 C ATOM 726 CG ASP A 242 1.517 11.221 -20.484 1.00 25.62 C ATOM 727 OD1 ASP A 242 1.608 11.667 -21.641 1.00 25.04 O ATOM 728 OD2 ASP A 242 2.328 10.399 -20.017 1.00 24.64 O ATOM 729 H ASP A 242 1.750 13.828 -19.230 1.00 0.00 H ATOM 730 N VAL A 243 -1.212 13.847 -17.923 1.00 24.64 N ATOM 731 CA VAL A 243 -2.330 14.166 -17.053 1.00 25.20 C ATOM 732 C VAL A 243 -3.132 15.327 -17.646 1.00 25.02 C ATOM 733 O VAL A 243 -4.356 15.328 -17.583 1.00 24.88 O ATOM 734 CB VAL A 243 -1.844 14.520 -15.634 1.00 24.98 C ATOM 735 CG1 VAL A 243 -3.017 15.016 -14.794 1.00 25.75 C ATOM 736 CG2 VAL A 243 -1.225 13.299 -14.984 1.00 24.86 C ATOM 737 H VAL A 243 -0.242 14.001 -17.581 1.00 0.00 H ATOM 738 N LYS A 244 -2.445 16.303 -18.237 1.00 25.53 N ATOM 739 CA LYS A 244 -3.122 17.448 -18.842 1.00 26.62 C ATOM 740 C LYS A 244 -3.884 17.069 -20.105 1.00 25.90 C ATOM 741 O LYS A 244 -4.827 17.745 -20.482 1.00 26.69 O ATOM 742 CB LYS A 244 -2.122 18.567 -19.181 1.00 27.99 C ATOM 743 CG LYS A 244 -1.427 19.191 -17.975 1.00 30.07 C ATOM 744 CD LYS A 244 -0.688 20.467 -18.328 1.00 33.06 C ATOM 745 CE LYS A 244 0.340 20.260 -19.406 1.00 35.31 C ATOM 746 NZ LYS A 244 1.277 21.457 -19.510 1.00 36.89 N ATOM 747 HZ1 LYS A 244 0.725 22.309 -19.736 1.00 0.00 H ATOM 748 HZ2 LYS A 244 1.768 21.591 -18.603 1.00 0.00 H ATOM 749 HZ3 LYS A 244 1.975 21.285 -20.262 1.00 0.00 H ATOM 750 H LYS A 244 -1.407 16.249 -18.269 1.00 0.00 H ATOM 751 N SER A 245 -3.476 15.993 -20.766 1.00 24.67 N ATOM 752 CA SER A 245 -4.167 15.576 -21.984 1.00 23.80 C ATOM 753 C SER A 245 -5.522 14.914 -21.707 1.00 22.15 C ATOM 754 O SER A 245 -6.314 14.708 -22.618 1.00 22.13 O ATOM 755 CB SER A 245 -3.296 14.618 -22.792 1.00 24.37 C ATOM 756 OG SER A 245 -3.089 13.403 -22.100 1.00 27.64 O ATOM 757 HG SER A 245 -2.638 13.588 -21.238 1.00 0.00 H ATOM 758 H SER A 245 -2.663 15.446 -20.417 1.00 0.00 H ATOM 759 N LEU A 246 -5.777 14.580 -20.451 1.00 20.90 N ATOM 760 CA LEU A 246 -7.014 13.931 -20.068 1.00 19.74 C ATOM 761 C LEU A 246 -8.263 14.802 -20.219 1.00 18.89 C ATOM 762 O LEU A 246 -9.377 14.277 -20.405 1.00 18.26 O ATOM 763 CB LEU A 246 -6.906 13.402 -18.622 1.00 19.04 C ATOM 764 CG LEU A 246 -5.834 12.334 -18.388 1.00 18.72 C ATOM 765 CD1 LEU A 246 -5.779 11.963 -16.913 1.00 19.35 C ATOM 766 CD2 LEU A 246 -6.126 11.120 -19.250 1.00 18.96 C ATOM 767 H LEU A 246 -5.069 14.790 -19.719 1.00 0.00 H ATOM 768 N SER A 247 -8.092 16.121 -20.187 1.00 16.75 N ATOM 769 CA SER A 247 -9.239 17.025 -20.290 1.00 15.71 C ATOM 770 C SER A 247 -9.924 16.886 -21.649 1.00 15.17 C ATOM 771 O SER A 247 -11.155 16.785 -21.723 1.00 11.50 O ATOM 772 CB SER A 247 -8.787 18.468 -20.084 1.00 15.72 C ATOM 773 OG SER A 247 -8.315 18.647 -18.785 1.00 17.86 O ATOM 774 HG SER A 247 -7.547 18.042 -18.628 1.00 0.00 H ATOM 775 H SER A 247 -7.134 16.514 -20.088 1.00 0.00 H ATOM 776 N ARG A 248 -9.137 16.891 -22.727 1.00 16.07 N ATOM 777 CA ARG A 248 -9.728 16.746 -24.058 1.00 18.89 C ATOM 778 C ARG A 248 -10.489 15.434 -24.190 1.00 18.27 C ATOM 779 O ARG A 248 -11.542 15.380 -24.806 1.00 18.40 O ATOM 780 CB ARG A 248 -8.662 16.845 -25.170 1.00 21.16 C ATOM 781 CG ARG A 248 -9.188 16.751 -26.545 1.00 25.57 C ATOM 782 CD ARG A 248 -8.174 17.021 -27.632 1.00 29.14 C ATOM 783 NE ARG A 248 -8.806 16.766 -28.952 1.00 32.76 N ATOM 784 CZ ARG A 248 -8.334 17.212 -30.124 1.00 33.94 C ATOM 785 NH1 ARG A 248 -7.220 17.943 -30.148 1.00 35.50 N ATOM 786 NH2 ARG A 248 -8.954 16.928 -31.274 1.00 34.33 N ATOM 787 HE ARG A 248 -9.678 16.200 -28.968 1.00 0.00 H ATOM 788 HH12 ARG A 248 -6.847 18.293 -31.054 1.00 0.00 H ATOM 789 HH11 ARG A 248 -6.724 18.164 -29.261 1.00 0.00 H ATOM 790 HH22 ARG A 248 -8.571 17.284 -32.173 1.00 0.00 H ATOM 791 HH21 ARG A 248 -9.819 16.351 -31.270 1.00 0.00 H ATOM 792 H ARG A 248 -8.108 16.998 -22.622 1.00 0.00 H ATOM 793 N VAL A 249 -9.939 14.369 -23.627 1.00 16.97 N ATOM 794 CA VAL A 249 -10.575 13.062 -23.688 1.00 16.88 C ATOM 795 C VAL A 249 -11.884 13.046 -22.877 1.00 15.99 C ATOM 796 O VAL A 249 -12.875 12.471 -23.325 1.00 15.75 O ATOM 797 CB VAL A 249 -9.637 11.948 -23.166 1.00 17.42 C ATOM 798 CG1 VAL A 249 -10.261 10.588 -23.412 1.00 17.60 C ATOM 799 CG2 VAL A 249 -8.287 12.029 -23.867 1.00 17.55 C ATOM 800 H VAL A 249 -9.031 14.469 -23.130 1.00 0.00 H ATOM 801 N MET A 250 -11.905 13.670 -21.700 1.00 15.21 N ATOM 802 CA MET A 250 -13.137 13.703 -20.903 1.00 14.29 C ATOM 803 C MET A 250 -14.229 14.468 -21.628 1.00 13.81 C ATOM 804 O MET A 250 -15.390 14.086 -21.584 1.00 14.11 O ATOM 805 CB MET A 250 -12.877 14.335 -19.526 1.00 15.37 C ATOM 806 CG MET A 250 -12.039 13.466 -18.594 1.00 16.65 C ATOM 807 SD MET A 250 -11.977 14.126 -16.918 1.00 18.90 S ATOM 808 CE MET A 250 -10.574 15.282 -17.102 1.00 19.09 C ATOM 809 H MET A 250 -11.045 14.135 -21.345 1.00 0.00 H ATOM 810 N ILE A 251 -13.850 15.548 -22.303 1.00 15.22 N ATOM 811 CA ILE A 251 -14.819 16.360 -23.030 1.00 16.61 C ATOM 812 C ILE A 251 -15.382 15.551 -24.207 1.00 17.27 C ATOM 813 O ILE A 251 -16.581 15.569 -24.478 1.00 16.59 O ATOM 814 CB ILE A 251 -14.165 17.656 -23.580 1.00 18.25 C ATOM 815 CG1 ILE A 251 -13.874 18.635 -22.439 1.00 18.66 C ATOM 816 CG2 ILE A 251 -15.106 18.304 -24.615 1.00 19.27 C ATOM 817 CD1 ILE A 251 -15.079 19.388 -21.923 1.00 20.24 C ATOM 818 H ILE A 251 -12.846 15.819 -22.313 1.00 0.00 H ATOM 819 N HIS A 252 -14.493 14.832 -24.888 1.00 16.16 N ATOM 820 CA HIS A 252 -14.859 14.010 -26.033 1.00 16.35 C ATOM 821 C HIS A 252 -15.824 12.899 -25.642 1.00 15.62 C ATOM 822 O HIS A 252 -16.856 12.723 -26.249 1.00 17.20 O ATOM 823 CB HIS A 252 -13.584 13.403 -26.650 1.00 18.49 C ATOM 824 CG HIS A 252 -13.797 12.702 -27.965 1.00 22.15 C ATOM 825 ND1 HIS A 252 -14.648 11.621 -28.114 1.00 24.99 N ATOM 826 CD2 HIS A 252 -13.216 12.889 -29.162 1.00 23.87 C ATOM 827 CE1 HIS A 252 -14.565 11.177 -29.356 1.00 24.70 C ATOM 828 NE2 HIS A 252 -13.704 11.919 -30.017 1.00 25.40 N ATOM 829 H HIS A 252 -13.497 14.858 -24.591 1.00 0.00 H ATOM 830 N VAL A 253 -15.474 12.157 -24.605 1.00 13.89 N ATOM 831 CA VAL A 253 -16.285 11.020 -24.155 1.00 14.79 C ATOM 832 C VAL A 253 -17.471 11.312 -23.234 1.00 14.45 C ATOM 833 O VAL A 253 -18.558 10.792 -23.442 1.00 15.61 O ATOM 834 CB VAL A 253 -15.391 9.966 -23.461 1.00 13.59 C ATOM 835 CG1 VAL A 253 -16.209 8.793 -22.989 1.00 13.77 C ATOM 836 CG2 VAL A 253 -14.294 9.515 -24.457 1.00 14.81 C ATOM 837 H VAL A 253 -14.598 12.386 -24.093 1.00 0.00 H ATOM 838 N PHE A 254 -17.260 12.116 -22.198 1.00 14.22 N ATOM 839 CA PHE A 254 -18.330 12.426 -21.249 1.00 14.90 C ATOM 840 C PHE A 254 -19.265 13.549 -21.678 1.00 14.13 C ATOM 841 O PHE A 254 -20.477 13.390 -21.711 1.00 15.43 O ATOM 842 CB PHE A 254 -17.745 12.784 -19.879 1.00 14.25 C ATOM 843 CG PHE A 254 -18.760 13.361 -18.931 1.00 13.89 C ATOM 844 CD1 PHE A 254 -19.711 12.544 -18.315 1.00 14.00 C ATOM 845 CD2 PHE A 254 -18.794 14.736 -18.681 1.00 13.68 C ATOM 846 CE1 PHE A 254 -20.681 13.087 -17.480 1.00 14.99 C ATOM 847 CE2 PHE A 254 -19.767 15.280 -17.847 1.00 14.69 C ATOM 848 CZ PHE A 254 -20.709 14.443 -17.243 1.00 14.66 C ATOM 849 H PHE A 254 -16.317 12.533 -22.059 1.00 0.00 H ATOM 850 N SER A 255 -18.702 14.707 -21.981 1.00 13.90 N ATOM 851 CA SER A 255 -19.531 15.842 -22.353 1.00 14.63 C ATOM 852 C SER A 255 -20.364 15.633 -23.601 1.00 14.04 C ATOM 853 O SER A 255 -21.522 16.041 -23.638 1.00 14.16 O ATOM 854 CB SER A 255 -18.675 17.105 -22.508 1.00 13.85 C ATOM 855 OG SER A 255 -18.051 17.428 -21.296 1.00 13.32 O ATOM 856 HG SER A 255 -18.740 17.589 -20.604 1.00 0.00 H ATOM 857 H SER A 255 -17.667 14.806 -21.953 1.00 0.00 H ATOM 858 N ASP A 256 -19.776 15.014 -24.618 1.00 15.32 N ATOM 859 CA ASP A 256 -20.482 14.781 -25.865 1.00 16.44 C ATOM 860 C ASP A 256 -21.367 13.540 -25.790 1.00 17.46 C ATOM 861 O ASP A 256 -21.167 12.572 -26.505 1.00 17.91 O ATOM 862 CB ASP A 256 -19.474 14.636 -26.999 1.00 16.80 C ATOM 863 CG ASP A 256 -20.092 14.848 -28.363 1.00 17.98 C ATOM 864 OD1 ASP A 256 -21.238 15.326 -28.450 1.00 18.75 O ATOM 865 OD2 ASP A 256 -19.425 14.532 -29.364 1.00 19.65 O ATOM 866 H ASP A 256 -18.793 14.690 -24.520 1.00 0.00 H ATOM 867 N GLY A 257 -22.354 13.593 -24.912 1.00 19.11 N ATOM 868 CA GLY A 257 -23.276 12.490 -24.751 1.00 20.03 C ATOM 869 C GLY A 257 -24.435 12.886 -23.868 1.00 21.31 C ATOM 870 O GLY A 257 -24.443 13.957 -23.277 1.00 19.58 O ATOM 871 H GLY A 257 -22.470 14.444 -24.326 1.00 0.00 H ATOM 872 N VAL A 258 -25.432 12.019 -23.787 1.00 22.35 N ATOM 873 CA VAL A 258 -26.593 12.304 -22.973 1.00 23.67 C ATOM 874 C VAL A 258 -26.125 12.263 -21.524 1.00 22.98 C ATOM 875 O VAL A 258 -25.263 11.484 -21.171 1.00 26.01 O ATOM 876 CB VAL A 258 -27.694 11.253 -23.201 1.00 25.45 C ATOM 877 CG1 VAL A 258 -27.185 9.878 -22.767 1.00 26.87 C ATOM 878 CG2 VAL A 258 -28.954 11.638 -22.463 1.00 27.22 C ATOM 879 H VAL A 258 -25.380 11.124 -24.314 1.00 0.00 H ATOM 880 N THR A 259 -26.682 13.120 -20.686 1.00 20.49 N ATOM 881 CA THR A 259 -26.278 13.166 -19.291 1.00 19.32 C ATOM 882 C THR A 259 -27.220 12.431 -18.349 1.00 17.97 C ATOM 883 O THR A 259 -28.431 12.548 -18.449 1.00 18.42 O ATOM 884 CB THR A 259 -26.164 14.621 -18.785 1.00 19.76 C ATOM 885 OG1 THR A 259 -25.341 15.370 -19.679 1.00 21.19 O ATOM 886 CG2 THR A 259 -25.530 14.654 -17.405 1.00 19.92 C ATOM 887 HG1 THR A 259 -25.746 15.364 -20.582 1.00 0.00 H ATOM 888 H THR A 259 -27.418 13.769 -21.029 1.00 0.00 H ATOM 889 N ASN A 260 -26.652 11.645 -17.444 1.00 16.25 N ATOM 890 CA ASN A 260 -27.431 10.948 -16.415 1.00 16.34 C ATOM 891 C ASN A 260 -26.482 10.699 -15.244 1.00 16.18 C ATOM 892 O ASN A 260 -25.252 10.761 -15.417 1.00 16.45 O ATOM 893 CB ASN A 260 -28.097 9.650 -16.931 1.00 15.90 C ATOM 894 CG ASN A 260 -27.127 8.685 -17.561 1.00 16.23 C ATOM 895 OD1 ASN A 260 -26.156 8.251 -16.928 1.00 15.18 O ATOM 896 ND2 ASN A 260 -27.395 8.321 -18.805 1.00 16.65 N ATOM 897 HD22 ASN A 260 -28.224 8.714 -19.295 1.00 0.00 H ATOM 898 HD21 ASN A 260 -26.777 7.642 -19.293 1.00 0.00 H ATOM 899 H ASN A 260 -25.620 11.519 -17.465 1.00 0.00 H ATOM 900 N TRP A 261 -27.024 10.462 -14.052 1.00 16.17 N ATOM 901 CA TRP A 261 -26.158 10.260 -12.897 1.00 15.47 C ATOM 902 C TRP A 261 -25.153 9.122 -13.060 1.00 15.08 C ATOM 903 O TRP A 261 -24.042 9.189 -12.538 1.00 13.84 O ATOM 904 CB TRP A 261 -26.990 10.074 -11.626 1.00 17.02 C ATOM 905 CG TRP A 261 -27.552 11.374 -11.068 1.00 18.25 C ATOM 906 CD1 TRP A 261 -28.870 11.668 -10.838 1.00 19.18 C ATOM 907 CD2 TRP A 261 -26.807 12.544 -10.670 1.00 17.72 C ATOM 908 NE1 TRP A 261 -28.992 12.943 -10.316 1.00 18.80 N ATOM 909 CE2 TRP A 261 -27.757 13.485 -10.194 1.00 18.63 C ATOM 910 CE3 TRP A 261 -25.453 12.861 -10.650 1.00 17.71 C ATOM 911 CZ2 TRP A 261 -27.358 14.753 -9.731 1.00 18.02 C ATOM 912 CZ3 TRP A 261 -25.068 14.122 -10.188 1.00 18.43 C ATOM 913 CH2 TRP A 261 -26.017 15.044 -9.723 1.00 17.95 C ATOM 914 HE1 TRP A 261 -29.886 13.409 -10.059 1.00 0.00 H ATOM 915 H TRP A 261 -28.058 10.421 -13.945 1.00 0.00 H ATOM 916 N GLY A 262 -25.528 8.100 -13.821 1.00 14.36 N ATOM 917 CA GLY A 262 -24.636 6.973 -14.035 1.00 14.48 C ATOM 918 C GLY A 262 -23.360 7.396 -14.736 1.00 14.27 C ATOM 919 O GLY A 262 -22.273 7.028 -14.304 1.00 15.08 O ATOM 920 H GLY A 262 -26.467 8.106 -14.267 1.00 0.00 H ATOM 921 N ARG A 263 -23.487 8.193 -15.795 1.00 13.54 N ATOM 922 CA ARG A 263 -22.310 8.638 -16.523 1.00 14.21 C ATOM 923 C ARG A 263 -21.457 9.579 -15.669 1.00 14.20 C ATOM 924 O ARG A 263 -20.238 9.632 -15.806 1.00 13.53 O ATOM 925 CB ARG A 263 -22.717 9.324 -17.833 1.00 16.03 C ATOM 926 CG ARG A 263 -23.530 8.415 -18.771 1.00 16.05 C ATOM 927 CD ARG A 263 -23.558 8.932 -20.210 1.00 19.68 C ATOM 928 NE ARG A 263 -22.271 8.769 -20.862 1.00 23.79 N ATOM 929 CZ ARG A 263 -21.649 9.741 -21.522 1.00 23.82 C ATOM 930 NH1 ARG A 263 -22.196 10.937 -21.612 1.00 24.03 N ATOM 931 NH2 ARG A 263 -20.474 9.535 -22.103 1.00 25.89 N ATOM 932 HE ARG A 263 -21.809 7.839 -20.810 1.00 0.00 H ATOM 933 HH12 ARG A 263 -21.707 11.695 -22.129 1.00 0.00 H ATOM 934 HH11 ARG A 263 -23.117 11.123 -21.166 1.00 0.00 H ATOM 935 HH22 ARG A 263 -20.004 10.309 -22.615 1.00 0.00 H ATOM 936 HH21 ARG A 263 -20.023 8.600 -22.047 1.00 0.00 H ATOM 937 H ARG A 263 -24.432 8.498 -16.103 1.00 0.00 H ATOM 938 N ILE A 264 -22.093 10.350 -14.797 1.00 13.56 N ATOM 939 CA ILE A 264 -21.319 11.241 -13.947 1.00 14.09 C ATOM 940 C ILE A 264 -20.552 10.376 -12.936 1.00 14.23 C ATOM 941 O ILE A 264 -19.425 10.701 -12.553 1.00 14.78 O ATOM 942 CB ILE A 264 -22.229 12.251 -13.203 1.00 14.16 C ATOM 943 CG1 ILE A 264 -22.823 13.230 -14.211 1.00 14.41 C ATOM 944 CG2 ILE A 264 -21.438 12.980 -12.130 1.00 15.34 C ATOM 945 CD1 ILE A 264 -23.974 14.063 -13.693 1.00 15.56 C ATOM 946 H ILE A 264 -23.130 10.318 -14.722 1.00 0.00 H ATOM 947 N VAL A 265 -21.159 9.272 -12.501 1.00 14.47 N ATOM 948 CA VAL A 265 -20.468 8.394 -11.558 1.00 14.41 C ATOM 949 C VAL A 265 -19.311 7.700 -12.274 1.00 14.59 C ATOM 950 O VAL A 265 -18.252 7.495 -11.687 1.00 15.12 O ATOM 951 CB VAL A 265 -21.410 7.332 -10.943 1.00 14.03 C ATOM 952 CG1 VAL A 265 -20.594 6.271 -10.172 1.00 14.02 C ATOM 953 CG2 VAL A 265 -22.388 8.004 -9.991 1.00 14.39 C ATOM 954 H VAL A 265 -22.117 9.037 -12.830 1.00 0.00 H ATOM 955 N THR A 266 -19.501 7.347 -13.543 1.00 14.26 N ATOM 956 CA THR A 266 -18.419 6.706 -14.272 1.00 14.88 C ATOM 957 C THR A 266 -17.261 7.693 -14.445 1.00 15.28 C ATOM 958 O THR A 266 -16.097 7.333 -14.265 1.00 14.50 O ATOM 959 CB THR A 266 -18.878 6.205 -15.646 1.00 14.92 C ATOM 960 OG1 THR A 266 -19.849 5.175 -15.471 1.00 17.78 O ATOM 961 CG2 THR A 266 -17.695 5.645 -16.437 1.00 16.47 C ATOM 962 HG1 THR A 266 -20.147 4.850 -16.357 1.00 0.00 H ATOM 963 H THR A 266 -20.414 7.528 -14.008 1.00 0.00 H ATOM 964 N LEU A 267 -17.590 8.940 -14.777 1.00 14.96 N ATOM 965 CA LEU A 267 -16.585 9.981 -14.958 1.00 15.12 C ATOM 966 C LEU A 267 -15.693 10.086 -13.725 1.00 14.89 C ATOM 967 O LEU A 267 -14.463 10.083 -13.836 1.00 14.37 O ATOM 968 CB LEU A 267 -17.262 11.343 -15.200 1.00 14.75 C ATOM 969 CG LEU A 267 -16.394 12.616 -15.164 1.00 15.40 C ATOM 970 CD1 LEU A 267 -15.585 12.768 -16.456 1.00 15.29 C ATOM 971 CD2 LEU A 267 -17.298 13.824 -14.962 1.00 14.97 C ATOM 972 H LEU A 267 -18.593 9.178 -14.911 1.00 0.00 H ATOM 973 N ILE A 268 -16.321 10.200 -12.557 1.00 15.42 N ATOM 974 CA ILE A 268 -15.593 10.351 -11.302 1.00 16.32 C ATOM 975 C ILE A 268 -14.923 9.038 -10.887 1.00 16.41 C ATOM 976 O ILE A 268 -13.809 9.049 -10.367 1.00 16.39 O ATOM 977 CB ILE A 268 -16.533 10.835 -10.175 1.00 15.99 C ATOM 978 CG1 ILE A 268 -17.096 12.218 -10.531 1.00 15.78 C ATOM 979 CG2 ILE A 268 -15.787 10.868 -8.847 1.00 15.98 C ATOM 980 CD1 ILE A 268 -18.249 12.667 -9.674 1.00 15.78 C ATOM 981 H ILE A 268 -17.361 10.181 -12.539 1.00 0.00 H ATOM 982 N SER A 269 -15.600 7.915 -11.122 1.00 16.54 N ATOM 983 CA SER A 269 -15.045 6.616 -10.765 1.00 16.11 C ATOM 984 C SER A 269 -13.783 6.291 -11.556 1.00 16.35 C ATOM 985 O SER A 269 -12.826 5.743 -11.013 1.00 15.64 O ATOM 986 CB SER A 269 -16.081 5.513 -10.960 1.00 16.77 C ATOM 987 OG SER A 269 -17.168 5.677 -10.072 1.00 19.44 O ATOM 988 HG SER A 269 -17.600 6.552 -10.239 1.00 0.00 H ATOM 989 H SER A 269 -16.539 7.966 -11.567 1.00 0.00 H ATOM 990 N PHE A 270 -13.770 6.610 -12.844 1.00 15.85 N ATOM 991 CA PHE A 270 -12.570 6.345 -13.615 1.00 15.52 C ATOM 992 C PHE A 270 -11.492 7.316 -13.157 1.00 16.33 C ATOM 993 O PHE A 270 -10.306 7.013 -13.199 1.00 16.24 O ATOM 994 CB PHE A 270 -12.796 6.501 -15.122 1.00 15.86 C ATOM 995 CG PHE A 270 -11.601 6.095 -15.945 1.00 15.67 C ATOM 996 CD1 PHE A 270 -11.214 4.757 -16.023 1.00 15.79 C ATOM 997 CD2 PHE A 270 -10.828 7.053 -16.600 1.00 14.29 C ATOM 998 CE1 PHE A 270 -10.065 4.378 -16.746 1.00 16.20 C ATOM 999 CE2 PHE A 270 -9.687 6.685 -17.319 1.00 15.58 C ATOM 1000 CZ PHE A 270 -9.308 5.347 -17.390 1.00 15.17 C ATOM 1001 H PHE A 270 -14.604 7.041 -13.292 1.00 0.00 H ATOM 1002 N GLY A 271 -11.911 8.499 -12.722 1.00 15.47 N ATOM 1003 CA GLY A 271 -10.957 9.471 -12.216 1.00 15.59 C ATOM 1004 C GLY A 271 -10.240 8.906 -10.997 1.00 16.19 C ATOM 1005 O GLY A 271 -9.031 9.078 -10.826 1.00 15.81 O ATOM 1006 H GLY A 271 -12.925 8.730 -12.744 1.00 0.00 H ATOM 1007 N ALA A 272 -10.984 8.211 -10.146 1.00 15.79 N ATOM 1008 CA ALA A 272 -10.391 7.611 -8.965 1.00 15.75 C ATOM 1009 C ALA A 272 -9.475 6.467 -9.394 1.00 16.11 C ATOM 1010 O ALA A 272 -8.461 6.201 -8.759 1.00 16.02 O ATOM 1011 CB ALA A 272 -11.482 7.097 -8.032 1.00 16.59 C ATOM 1012 H ALA A 272 -12.002 8.095 -10.327 1.00 0.00 H ATOM 1013 N PHE A 273 -9.841 5.793 -10.479 1.00 16.10 N ATOM 1014 CA PHE A 273 -9.047 4.683 -10.996 1.00 16.38 C ATOM 1015 C PHE A 273 -7.716 5.250 -11.438 1.00 16.61 C ATOM 1016 O PHE A 273 -6.662 4.666 -11.196 1.00 16.83 O ATOM 1017 CB PHE A 273 -9.760 4.034 -12.192 1.00 16.65 C ATOM 1018 CG PHE A 273 -9.193 2.689 -12.597 1.00 16.77 C ATOM 1019 CD1 PHE A 273 -9.517 1.543 -11.879 1.00 17.67 C ATOM 1020 CD2 PHE A 273 -8.354 2.568 -13.705 1.00 16.30 C ATOM 1021 CE1 PHE A 273 -9.018 0.295 -12.253 1.00 16.58 C ATOM 1022 CE2 PHE A 273 -7.849 1.334 -14.087 1.00 17.46 C ATOM 1023 CZ PHE A 273 -8.181 0.194 -13.362 1.00 17.15 C ATOM 1024 H PHE A 273 -10.716 6.063 -10.972 1.00 0.00 H ATOM 1025 N VAL A 274 -7.772 6.407 -12.086 1.00 16.95 N ATOM 1026 CA VAL A 274 -6.557 7.065 -12.547 1.00 17.19 C ATOM 1027 C VAL A 274 -5.751 7.532 -11.337 1.00 18.40 C ATOM 1028 O VAL A 274 -4.540 7.399 -11.315 1.00 18.75 O ATOM 1029 CB VAL A 274 -6.864 8.268 -13.463 1.00 16.55 C ATOM 1030 CG1 VAL A 274 -5.602 9.013 -13.795 1.00 18.39 C ATOM 1031 CG2 VAL A 274 -7.543 7.784 -14.735 1.00 16.83 C ATOM 1032 H VAL A 274 -8.696 6.850 -12.267 1.00 0.00 H ATOM 1033 N ALA A 275 -6.433 8.085 -10.337 1.00 17.95 N ATOM 1034 CA ALA A 275 -5.767 8.557 -9.129 1.00 18.46 C ATOM 1035 C ALA A 275 -4.920 7.447 -8.500 1.00 19.37 C ATOM 1036 O ALA A 275 -3.782 7.675 -8.079 1.00 20.00 O ATOM 1037 CB ALA A 275 -6.794 9.079 -8.127 1.00 17.32 C ATOM 1038 H ALA A 275 -7.465 8.183 -10.419 1.00 0.00 H ATOM 1039 N LYS A 276 -5.475 6.244 -8.413 1.00 19.57 N ATOM 1040 CA LYS A 276 -4.719 5.126 -7.865 1.00 21.19 C ATOM 1041 C LYS A 276 -3.475 4.885 -8.699 1.00 20.75 C ATOM 1042 O LYS A 276 -2.410 4.611 -8.160 1.00 20.46 O ATOM 1043 CB LYS A 276 -5.566 3.867 -7.848 1.00 21.76 C ATOM 1044 CG LYS A 276 -6.677 3.897 -6.842 1.00 24.28 C ATOM 1045 CD LYS A 276 -7.687 2.821 -7.191 1.00 26.44 C ATOM 1046 CE LYS A 276 -8.766 2.716 -6.173 1.00 27.37 C ATOM 1047 NZ LYS A 276 -9.745 1.711 -6.610 1.00 27.34 N ATOM 1048 HZ1 LYS A 276 -10.152 1.999 -7.523 1.00 0.00 H ATOM 1049 HZ2 LYS A 276 -9.272 0.791 -6.715 1.00 0.00 H ATOM 1050 HZ3 LYS A 276 -10.502 1.634 -5.901 1.00 0.00 H ATOM 1051 H LYS A 276 -6.453 6.099 -8.737 1.00 0.00 H ATOM 1052 N HIS A 277 -3.621 4.984 -10.014 1.00 21.19 N ATOM 1053 CA HIS A 277 -2.500 4.791 -10.919 1.00 21.49 C ATOM 1054 C HIS A 277 -1.399 5.814 -10.637 1.00 21.29 C ATOM 1055 O HIS A 277 -0.234 5.458 -10.511 1.00 22.13 O ATOM 1056 CB HIS A 277 -2.965 4.911 -12.381 1.00 21.87 C ATOM 1057 CG HIS A 277 -1.839 4.930 -13.380 1.00 22.36 C ATOM 1058 ND1 HIS A 277 -0.977 3.864 -13.557 1.00 23.12 N ATOM 1059 CD2 HIS A 277 -1.443 5.882 -14.253 1.00 22.74 C ATOM 1060 CE1 HIS A 277 -0.104 4.166 -14.502 1.00 22.44 C ATOM 1061 NE2 HIS A 277 -0.359 5.380 -14.943 1.00 22.86 N ATOM 1062 H HIS A 277 -4.559 5.205 -10.406 1.00 0.00 H ATOM 1063 N LEU A 278 -1.779 7.081 -10.535 1.00 21.52 N ATOM 1064 CA LEU A 278 -0.825 8.129 -10.267 1.00 22.26 C ATOM 1065 C LEU A 278 0.022 7.840 -9.034 1.00 23.45 C ATOM 1066 O LEU A 278 1.198 8.171 -8.998 1.00 23.78 O ATOM 1067 CB LEU A 278 -1.541 9.471 -10.120 1.00 21.37 C ATOM 1068 CG LEU A 278 -2.142 9.991 -11.436 1.00 20.29 C ATOM 1069 CD1 LEU A 278 -2.992 11.213 -11.168 1.00 19.98 C ATOM 1070 CD2 LEU A 278 -1.013 10.301 -12.420 1.00 20.48 C ATOM 1071 H LEU A 278 -2.784 7.323 -10.650 1.00 0.00 H ATOM 1072 N LYS A 279 -0.570 7.217 -8.026 1.00 25.19 N ATOM 1073 CA LYS A 279 0.180 6.899 -6.823 1.00 27.96 C ATOM 1074 C LYS A 279 1.125 5.747 -7.091 1.00 28.54 C ATOM 1075 O LYS A 279 2.182 5.660 -6.462 1.00 28.57 O ATOM 1076 CB LYS A 279 -0.752 6.540 -5.655 1.00 30.36 C ATOM 1077 CG LYS A 279 -0.007 6.366 -4.347 1.00 32.71 C ATOM 1078 CD LYS A 279 -0.723 5.424 -3.390 1.00 35.69 C ATOM 1079 CE LYS A 279 -0.030 5.384 -2.028 1.00 37.08 C ATOM 1080 NZ LYS A 279 1.370 4.849 -2.106 1.00 39.01 N ATOM 1081 HZ1 LYS A 279 1.349 3.880 -2.482 1.00 0.00 H ATOM 1082 HZ2 LYS A 279 1.936 5.454 -2.735 1.00 0.00 H ATOM 1083 HZ3 LYS A 279 1.791 4.844 -1.155 1.00 0.00 H ATOM 1084 H LYS A 279 -1.574 6.955 -8.096 1.00 0.00 H ATOM 1085 N THR A 280 0.756 4.855 -8.011 1.00 28.86 N ATOM 1086 CA THR A 280 1.644 3.731 -8.333 1.00 29.46 C ATOM 1087 C THR A 280 2.886 4.211 -9.058 1.00 29.51 C ATOM 1088 O THR A 280 3.953 3.588 -8.933 1.00 30.45 O ATOM 1089 CB THR A 280 0.955 2.636 -9.225 1.00 29.49 C ATOM 1090 OG1 THR A 280 0.939 3.111 -10.570 1.00 29.54 O ATOM 1091 CG2 THR A 280 -0.444 2.361 -8.745 1.00 29.65 C ATOM 1092 HG1 THR A 280 0.430 3.959 -10.613 1.00 0.00 H ATOM 1093 H THR A 280 -0.157 4.955 -8.498 1.00 0.00 H ATOM 1094 N ILE A 281 2.758 5.296 -9.820 1.00 29.23 N ATOM 1095 CA ILE A 281 3.928 5.808 -10.541 1.00 28.54 C ATOM 1096 C ILE A 281 4.544 7.036 -9.865 1.00 29.05 C ATOM 1097 O ILE A 281 5.218 7.845 -10.502 1.00 29.15 O ATOM 1098 CB ILE A 281 3.615 6.145 -12.031 1.00 27.75 C ATOM 1099 CG1 ILE A 281 2.611 7.292 -12.125 1.00 27.32 C ATOM 1100 CG2 ILE A 281 3.081 4.898 -12.730 1.00 27.69 C ATOM 1101 CD1 ILE A 281 2.377 7.762 -13.555 1.00 26.25 C ATOM 1102 H ILE A 281 1.838 5.775 -9.903 1.00 0.00 H ATOM 1103 N ASN A 282 4.287 7.172 -8.570 1.00 29.84 N ATOM 1104 CA ASN A 282 4.831 8.271 -7.795 1.00 31.22 C ATOM 1105 C ASN A 282 4.593 9.666 -8.396 1.00 31.30 C ATOM 1106 O ASN A 282 5.515 10.492 -8.490 1.00 30.49 O ATOM 1107 CB ASN A 282 6.320 8.031 -7.604 1.00 33.62 C ATOM 1108 CG ASN A 282 6.597 6.842 -6.720 1.00 35.63 C ATOM 1109 OD1 ASN A 282 6.330 6.878 -5.522 1.00 38.45 O ATOM 1110 ND2 ASN A 282 7.113 5.772 -7.303 1.00 37.11 N ATOM 1111 HD22 ASN A 282 7.324 5.785 -8.321 1.00 0.00 H ATOM 1112 HD21 ASN A 282 7.308 4.918 -6.743 1.00 0.00 H ATOM 1113 H ASN A 282 3.679 6.472 -8.098 1.00 0.00 H ATOM 1114 N GLN A 283 3.350 9.918 -8.801 1.00 30.45 N ATOM 1115 CA GLN A 283 2.948 11.205 -9.358 1.00 30.03 C ATOM 1116 C GLN A 283 1.701 11.644 -8.586 1.00 29.75 C ATOM 1117 O GLN A 283 0.730 12.133 -9.161 1.00 28.65 O ATOM 1118 CB GLN A 283 2.619 11.093 -10.855 1.00 31.83 C ATOM 1119 CG GLN A 283 3.818 10.929 -11.795 1.00 32.81 C ATOM 1120 CD GLN A 283 4.690 12.167 -11.870 1.00 34.20 C ATOM 1121 OE1 GLN A 283 4.203 13.298 -11.853 1.00 34.76 O ATOM 1122 NE2 GLN A 283 5.998 11.956 -11.983 1.00 35.17 N ATOM 1123 HE22 GLN A 283 6.369 10.984 -11.993 1.00 0.00 H ATOM 1124 HE21 GLN A 283 6.650 12.762 -12.061 1.00 0.00 H ATOM 1125 H GLN A 283 2.636 9.166 -8.717 1.00 0.00 H ATOM 1126 N GLU A 284 1.754 11.459 -7.272 1.00 30.09 N ATOM 1127 CA GLU A 284 0.658 11.808 -6.384 1.00 30.26 C ATOM 1128 C GLU A 284 0.283 13.282 -6.399 1.00 29.00 C ATOM 1129 O GLU A 284 -0.869 13.637 -6.135 1.00 28.79 O ATOM 1130 CB GLU A 284 0.974 11.377 -4.941 1.00 32.75 C ATOM 1131 CG GLU A 284 0.927 9.861 -4.719 1.00 36.38 C ATOM 1132 CD GLU A 284 0.981 9.477 -3.255 1.00 38.07 C ATOM 1133 OE1 GLU A 284 0.040 9.812 -2.512 1.00 39.85 O ATOM 1134 OE2 GLU A 284 1.958 8.814 -2.837 1.00 39.97 O ATOM 1135 H GLU A 284 2.616 11.047 -6.861 1.00 0.00 H ATOM 1136 N SER A 285 1.251 14.143 -6.695 1.00 26.69 N ATOM 1137 CA SER A 285 1.006 15.584 -6.726 1.00 26.28 C ATOM 1138 C SER A 285 0.051 15.972 -7.847 1.00 24.38 C ATOM 1139 O SER A 285 -0.449 17.090 -7.886 1.00 24.06 O ATOM 1140 CB SER A 285 2.319 16.348 -6.900 1.00 26.92 C ATOM 1141 OG SER A 285 2.807 16.175 -8.200 1.00 30.18 O ATOM 1142 HG SER A 285 2.966 15.212 -8.366 1.00 0.00 H ATOM 1143 H SER A 285 2.203 13.784 -6.909 1.00 0.00 H ATOM 1144 N CYS A 286 -0.194 15.042 -8.764 1.00 22.94 N ATOM 1145 CA CYS A 286 -1.080 15.286 -9.906 1.00 21.33 C ATOM 1146 C CYS A 286 -2.531 14.973 -9.591 1.00 21.17 C ATOM 1147 O CYS A 286 -3.410 15.284 -10.377 1.00 21.47 O ATOM 1148 CB CYS A 286 -0.671 14.427 -11.107 1.00 21.05 C ATOM 1149 SG CYS A 286 0.906 14.806 -11.854 1.00 18.33 S ATOM 1150 H CYS A 286 0.258 14.110 -8.668 1.00 0.00 H ATOM 1151 N ILE A 287 -2.779 14.372 -8.439 1.00 20.70 N ATOM 1152 CA ILE A 287 -4.136 14.010 -8.071 1.00 21.04 C ATOM 1153 C ILE A 287 -5.087 15.208 -7.887 1.00 22.36 C ATOM 1154 O ILE A 287 -6.236 15.174 -8.361 1.00 21.49 O ATOM 1155 CB ILE A 287 -4.152 13.144 -6.793 1.00 20.85 C ATOM 1156 CG1 ILE A 287 -3.464 11.820 -7.073 1.00 21.70 C ATOM 1157 CG2 ILE A 287 -5.591 12.916 -6.338 1.00 20.60 C ATOM 1158 CD1 ILE A 287 -3.396 10.878 -5.898 1.00 21.94 C ATOM 1159 H ILE A 287 -1.995 14.157 -7.791 1.00 0.00 H ATOM 1160 N GLU A 288 -4.646 16.257 -7.203 1.00 23.54 N ATOM 1161 CA GLU A 288 -5.532 17.399 -7.034 1.00 24.64 C ATOM 1162 C GLU A 288 -5.749 18.121 -8.375 1.00 23.57 C ATOM 1163 O GLU A 288 -6.862 18.555 -8.670 1.00 22.82 O ATOM 1164 CB GLU A 288 -5.009 18.339 -5.926 1.00 26.49 C ATOM 1165 CG GLU A 288 -4.999 17.631 -4.557 1.00 31.99 C ATOM 1166 CD GLU A 288 -4.935 18.574 -3.370 1.00 35.31 C ATOM 1167 OE1 GLU A 288 -4.158 19.566 -3.426 1.00 38.75 O ATOM 1168 OE2 GLU A 288 -5.633 18.303 -2.360 1.00 38.06 O ATOM 1169 H GLU A 288 -3.689 16.262 -6.797 1.00 0.00 H ATOM 1170 N PRO A 289 -4.696 18.265 -9.197 1.00 23.10 N ATOM 1171 CA PRO A 289 -4.920 18.939 -10.479 1.00 22.80 C ATOM 1172 C PRO A 289 -5.895 18.110 -11.332 1.00 22.65 C ATOM 1173 O PRO A 289 -6.659 18.659 -12.125 1.00 22.17 O ATOM 1174 CB PRO A 289 -3.529 18.973 -11.089 1.00 22.73 C ATOM 1175 CG PRO A 289 -2.647 19.114 -9.900 1.00 23.55 C ATOM 1176 CD PRO A 289 -3.252 18.151 -8.909 1.00 23.37 C ATOM 1177 N LEU A 290 -5.863 16.789 -11.154 1.00 21.49 N ATOM 1178 CA LEU A 290 -6.738 15.890 -11.897 1.00 21.09 C ATOM 1179 C LEU A 290 -8.178 16.125 -11.450 1.00 19.94 C ATOM 1180 O LEU A 290 -9.091 16.241 -12.274 1.00 19.28 O ATOM 1181 CB LEU A 290 -6.345 14.424 -11.653 1.00 22.15 C ATOM 1182 CG LEU A 290 -7.148 13.393 -12.454 1.00 24.58 C ATOM 1183 CD1 LEU A 290 -7.076 13.717 -13.942 1.00 24.54 C ATOM 1184 CD2 LEU A 290 -6.598 12.007 -12.192 1.00 26.74 C ATOM 1185 H LEU A 290 -5.195 16.388 -10.465 1.00 0.00 H ATOM 1186 N ALA A 291 -8.372 16.201 -10.136 1.00 19.41 N ATOM 1187 CA ALA A 291 -9.706 16.434 -9.581 1.00 19.16 C ATOM 1188 C ALA A 291 -10.263 17.759 -10.105 1.00 18.97 C ATOM 1189 O ALA A 291 -11.439 17.871 -10.404 1.00 17.87 O ATOM 1190 CB ALA A 291 -9.649 16.444 -8.073 1.00 19.36 C ATOM 1191 H ALA A 291 -7.562 16.093 -9.492 1.00 0.00 H ATOM 1192 N GLU A 292 -9.398 18.757 -10.225 1.00 19.02 N ATOM 1193 CA GLU A 292 -9.800 20.061 -10.719 1.00 19.76 C ATOM 1194 C GLU A 292 -10.264 19.956 -12.168 1.00 18.92 C ATOM 1195 O GLU A 292 -11.263 20.546 -12.559 1.00 17.79 O ATOM 1196 CB GLU A 292 -8.618 21.022 -10.615 1.00 22.72 C ATOM 1197 CG GLU A 292 -8.916 22.439 -11.050 1.00 27.36 C ATOM 1198 CD GLU A 292 -7.810 23.400 -10.670 1.00 29.31 C ATOM 1199 OE1 GLU A 292 -6.640 23.148 -11.038 1.00 32.09 O ATOM 1200 OE2 GLU A 292 -8.100 24.380 -9.951 1.00 31.01 O ATOM 1201 H GLU A 292 -8.405 18.601 -9.958 1.00 0.00 H ATOM 1202 N SER A 293 -9.536 19.174 -12.955 1.00 19.29 N ATOM 1203 CA SER A 293 -9.868 18.973 -14.359 1.00 19.57 C ATOM 1204 C SER A 293 -11.198 18.242 -14.533 1.00 18.44 C ATOM 1205 O SER A 293 -11.979 18.549 -15.432 1.00 18.69 O ATOM 1206 CB SER A 293 -8.758 18.185 -15.054 1.00 21.52 C ATOM 1207 OG SER A 293 -7.558 18.924 -15.043 1.00 26.96 O ATOM 1208 HG SER A 293 -7.291 19.104 -14.107 1.00 0.00 H ATOM 1209 H SER A 293 -8.705 18.691 -12.558 1.00 0.00 H ATOM 1210 N ILE A 294 -11.459 17.271 -13.668 1.00 17.33 N ATOM 1211 CA ILE A 294 -12.716 16.524 -13.743 1.00 15.42 C ATOM 1212 C ILE A 294 -13.866 17.452 -13.379 1.00 16.03 C ATOM 1213 O ILE A 294 -14.904 17.445 -14.014 1.00 15.06 O ATOM 1214 CB ILE A 294 -12.732 15.331 -12.758 1.00 14.79 C ATOM 1215 CG1 ILE A 294 -11.662 14.315 -13.148 1.00 15.64 C ATOM 1216 CG2 ILE A 294 -14.095 14.660 -12.769 1.00 15.17 C ATOM 1217 CD1 ILE A 294 -11.518 13.181 -12.148 1.00 15.33 C ATOM 1218 H ILE A 294 -10.764 17.038 -12.930 1.00 0.00 H ATOM 1219 N THR A 295 -13.652 18.249 -12.340 1.00 15.21 N ATOM 1220 CA THR A 295 -14.659 19.191 -11.887 1.00 15.31 C ATOM 1221 C THR A 295 -15.000 20.207 -12.976 1.00 16.40 C ATOM 1222 O THR A 295 -16.167 20.546 -13.163 1.00 14.92 O ATOM 1223 CB THR A 295 -14.199 19.928 -10.624 1.00 15.52 C ATOM 1224 OG1 THR A 295 -13.907 18.968 -9.601 1.00 17.20 O ATOM 1225 CG2 THR A 295 -15.305 20.851 -10.114 1.00 16.13 C ATOM 1226 HG1 THR A 295 -13.189 18.362 -9.914 1.00 0.00 H ATOM 1227 H THR A 295 -12.742 18.198 -11.839 1.00 0.00 H ATOM 1228 N ASP A 296 -13.987 20.676 -13.699 1.00 16.32 N ATOM 1229 CA ASP A 296 -14.210 21.650 -14.756 1.00 17.08 C ATOM 1230 C ASP A 296 -15.115 21.070 -15.823 1.00 16.05 C ATOM 1231 O ASP A 296 -16.053 21.700 -16.261 1.00 16.61 O ATOM 1232 CB ASP A 296 -12.892 22.059 -15.423 1.00 18.55 C ATOM 1233 CG ASP A 296 -12.039 22.939 -14.547 1.00 22.22 C ATOM 1234 OD1 ASP A 296 -12.616 23.687 -13.729 1.00 23.35 O ATOM 1235 OD2 ASP A 296 -10.803 22.890 -14.696 1.00 24.62 O ATOM 1236 H ASP A 296 -13.021 20.341 -13.506 1.00 0.00 H ATOM 1237 N VAL A 297 -14.797 19.860 -16.255 1.00 15.10 N ATOM 1238 CA VAL A 297 -15.580 19.198 -17.284 1.00 15.16 C ATOM 1239 C VAL A 297 -17.023 19.015 -16.823 1.00 13.81 C ATOM 1240 O VAL A 297 -17.964 19.401 -17.518 1.00 15.42 O ATOM 1241 CB VAL A 297 -14.962 17.825 -17.650 1.00 15.15 C ATOM 1242 CG1 VAL A 297 -15.879 17.080 -18.614 1.00 14.54 C ATOM 1243 CG2 VAL A 297 -13.594 18.025 -18.272 1.00 16.12 C ATOM 1244 H VAL A 297 -13.971 19.374 -15.850 1.00 0.00 H ATOM 1245 N LEU A 298 -17.191 18.470 -15.626 1.00 13.38 N ATOM 1246 CA LEU A 298 -18.514 18.233 -15.084 1.00 12.98 C ATOM 1247 C LEU A 298 -19.358 19.483 -14.908 1.00 14.14 C ATOM 1248 O LEU A 298 -20.431 19.606 -15.485 1.00 13.69 O ATOM 1249 CB LEU A 298 -18.402 17.507 -13.746 1.00 12.86 C ATOM 1250 CG LEU A 298 -19.737 17.217 -13.043 1.00 13.21 C ATOM 1251 CD1 LEU A 298 -20.549 16.264 -13.894 1.00 13.14 C ATOM 1252 CD2 LEU A 298 -19.475 16.618 -11.659 1.00 13.69 C ATOM 1253 H LEU A 298 -16.356 18.207 -15.064 1.00 0.00 H ATOM 1254 N VAL A 299 -18.854 20.419 -14.117 1.00 13.47 N ATOM 1255 CA VAL A 299 -19.590 21.639 -13.830 1.00 14.60 C ATOM 1256 C VAL A 299 -19.687 22.648 -14.953 1.00 14.97 C ATOM 1257 O VAL A 299 -20.763 23.209 -15.169 1.00 14.94 O ATOM 1258 CB VAL A 299 -19.027 22.323 -12.567 1.00 14.27 C ATOM 1259 CG1 VAL A 299 -19.745 23.636 -12.311 1.00 15.60 C ATOM 1260 CG2 VAL A 299 -19.155 21.386 -11.383 1.00 14.00 C ATOM 1261 H VAL A 299 -17.915 20.278 -13.694 1.00 0.00 H ATOM 1262 N ARG A 300 -18.603 22.867 -15.685 1.00 15.35 N ATOM 1263 CA ARG A 300 -18.656 23.843 -16.756 1.00 16.46 C ATOM 1264 C ARG A 300 -19.343 23.421 -18.046 1.00 15.43 C ATOM 1265 O ARG A 300 -19.715 24.282 -18.833 1.00 16.99 O ATOM 1266 CB ARG A 300 -17.244 24.419 -16.989 1.00 18.32 C ATOM 1267 CG ARG A 300 -16.697 25.010 -15.676 1.00 21.82 C ATOM 1268 CD ARG A 300 -15.519 25.913 -15.824 1.00 26.78 C ATOM 1269 NE ARG A 300 -14.909 26.213 -14.523 1.00 28.04 N ATOM 1270 CZ ARG A 300 -15.369 27.057 -13.603 1.00 28.52 C ATOM 1271 NH1 ARG A 300 -16.475 27.732 -13.790 1.00 28.68 N ATOM 1272 NH2 ARG A 300 -14.689 27.232 -12.481 1.00 29.53 N ATOM 1273 HE ARG A 300 -14.025 25.714 -14.297 1.00 0.00 H ATOM 1274 HH12 ARG A 300 -16.815 28.386 -13.057 1.00 0.00 H ATOM 1275 HH11 ARG A 300 -17.013 27.614 -14.672 1.00 0.00 H ATOM 1276 HH22 ARG A 300 -15.041 27.890 -11.757 1.00 0.00 H ATOM 1277 HH21 ARG A 300 -13.802 26.712 -12.324 1.00 0.00 H ATOM 1278 H ARG A 300 -17.725 22.344 -15.493 1.00 0.00 H ATOM 1279 N THR A 301 -19.528 22.117 -18.264 1.00 14.62 N ATOM 1280 CA THR A 301 -20.235 21.673 -19.470 1.00 14.08 C ATOM 1281 C THR A 301 -21.637 21.127 -19.171 1.00 14.38 C ATOM 1282 O THR A 301 -22.444 20.978 -20.082 1.00 15.17 O ATOM 1283 CB THR A 301 -19.468 20.579 -20.262 1.00 13.43 C ATOM 1284 OG1 THR A 301 -19.487 19.336 -19.541 1.00 12.89 O ATOM 1285 CG2 THR A 301 -18.046 21.036 -20.546 1.00 14.15 C ATOM 1286 HG1 THR A 301 -19.054 19.461 -18.659 1.00 0.00 H ATOM 1287 H THR A 301 -19.172 21.418 -17.581 1.00 0.00 H ATOM 1288 N LYS A 302 -21.924 20.826 -17.902 1.00 14.78 N ATOM 1289 CA LYS A 302 -23.230 20.272 -17.531 1.00 14.64 C ATOM 1290 C LYS A 302 -23.942 21.007 -16.394 1.00 14.77 C ATOM 1291 O LYS A 302 -24.766 20.409 -15.697 1.00 14.47 O ATOM 1292 CB LYS A 302 -23.095 18.791 -17.138 1.00 15.29 C ATOM 1293 CG LYS A 302 -22.434 17.908 -18.182 1.00 17.06 C ATOM 1294 CD LYS A 302 -23.193 17.911 -19.484 1.00 18.94 C ATOM 1295 CE LYS A 302 -22.459 17.066 -20.523 1.00 21.29 C ATOM 1296 NZ LYS A 302 -23.112 17.208 -21.862 1.00 23.83 N ATOM 1297 HZ1 LYS A 302 -24.100 16.889 -21.800 1.00 0.00 H ATOM 1298 HZ2 LYS A 302 -23.086 18.206 -22.155 1.00 0.00 H ATOM 1299 HZ3 LYS A 302 -22.602 16.628 -22.558 1.00 0.00 H ATOM 1300 H LYS A 302 -21.209 20.987 -17.164 1.00 0.00 H ATOM 1301 N ARG A 303 -23.648 22.293 -16.210 1.00 15.33 N ATOM 1302 CA ARG A 303 -24.283 23.046 -15.133 1.00 14.95 C ATOM 1303 C ARG A 303 -25.808 23.050 -15.215 1.00 15.53 C ATOM 1304 O ARG A 303 -26.484 22.806 -14.218 1.00 15.79 O ATOM 1305 CB ARG A 303 -23.793 24.497 -15.086 1.00 15.78 C ATOM 1306 CG ARG A 303 -24.275 25.251 -13.842 1.00 14.95 C ATOM 1307 CD ARG A 303 -23.852 26.722 -13.866 1.00 15.39 C ATOM 1308 NE ARG A 303 -22.395 26.906 -13.866 1.00 16.08 N ATOM 1309 CZ ARG A 303 -21.622 26.871 -12.782 1.00 14.73 C ATOM 1310 NH1 ARG A 303 -22.154 26.659 -11.583 1.00 13.50 N ATOM 1311 NH2 ARG A 303 -20.311 27.048 -12.898 1.00 12.78 N ATOM 1312 HE ARG A 303 -21.932 27.076 -14.781 1.00 0.00 H ATOM 1313 HH12 ARG A 303 -21.544 26.633 -10.741 1.00 0.00 H ATOM 1314 HH11 ARG A 303 -23.180 26.519 -11.487 1.00 0.00 H ATOM 1315 HH22 ARG A 303 -19.706 27.021 -12.053 1.00 0.00 H ATOM 1316 HH21 ARG A 303 -19.889 27.214 -13.834 1.00 0.00 H ATOM 1317 H ARG A 303 -22.963 22.762 -16.836 1.00 0.00 H ATOM 1318 N ASP A 304 -26.354 23.314 -16.395 1.00 15.79 N ATOM 1319 CA ASP A 304 -27.803 23.346 -16.519 1.00 17.31 C ATOM 1320 C ASP A 304 -28.451 22.047 -16.048 1.00 16.79 C ATOM 1321 O ASP A 304 -29.432 22.061 -15.302 1.00 16.30 O ATOM 1322 CB ASP A 304 -28.219 23.615 -17.958 1.00 21.19 C ATOM 1323 CG ASP A 304 -27.734 24.954 -18.465 1.00 24.15 C ATOM 1324 OD1 ASP A 304 -27.987 25.988 -17.799 1.00 27.60 O ATOM 1325 OD2 ASP A 304 -27.103 24.971 -19.540 1.00 29.14 O ATOM 1326 H ASP A 304 -25.752 23.496 -17.223 1.00 0.00 H ATOM 1327 N TRP A 305 -27.898 20.923 -16.493 1.00 16.05 N ATOM 1328 CA TRP A 305 -28.437 19.623 -16.113 1.00 16.12 C ATOM 1329 C TRP A 305 -28.326 19.426 -14.598 1.00 16.12 C ATOM 1330 O TRP A 305 -29.269 19.022 -13.945 1.00 16.00 O ATOM 1331 CB TRP A 305 -27.681 18.494 -16.802 1.00 16.45 C ATOM 1332 CG TRP A 305 -28.338 17.153 -16.632 1.00 15.68 C ATOM 1333 CD1 TRP A 305 -29.296 16.591 -17.433 1.00 17.70 C ATOM 1334 CD2 TRP A 305 -28.079 16.201 -15.570 1.00 16.67 C ATOM 1335 NE1 TRP A 305 -29.641 15.350 -16.941 1.00 18.08 N ATOM 1336 CE2 TRP A 305 -28.931 15.099 -15.838 1.00 17.41 C ATOM 1337 CE3 TRP A 305 -27.232 16.194 -14.477 1.00 15.63 C ATOM 1338 CZ2 TRP A 305 -28.926 13.979 -14.970 1.00 17.09 C ATOM 1339 CZ3 TRP A 305 -27.247 15.072 -13.636 1.00 15.73 C ATOM 1340 CH2 TRP A 305 -28.091 13.983 -13.896 1.00 17.05 C ATOM 1341 HE1 TRP A 305 -30.344 14.710 -17.363 1.00 0.00 H ATOM 1342 H TRP A 305 -27.070 20.972 -17.120 1.00 0.00 H ATOM 1343 N LEU A 306 -27.154 19.728 -14.052 1.00 15.24 N ATOM 1344 CA LEU A 306 -26.905 19.579 -12.629 1.00 15.39 C ATOM 1345 C LEU A 306 -27.878 20.408 -11.809 1.00 16.34 C ATOM 1346 O LEU A 306 -28.462 19.904 -10.838 1.00 15.24 O ATOM 1347 CB LEU A 306 -25.468 19.983 -12.303 1.00 14.37 C ATOM 1348 CG LEU A 306 -24.397 19.031 -12.826 1.00 14.54 C ATOM 1349 CD1 LEU A 306 -23.022 19.703 -12.746 1.00 13.53 C ATOM 1350 CD2 LEU A 306 -24.425 17.744 -11.996 1.00 14.07 C ATOM 1351 H LEU A 306 -26.390 20.082 -14.663 1.00 0.00 H ATOM 1352 N VAL A 307 -28.070 21.668 -12.204 1.00 16.17 N ATOM 1353 CA VAL A 307 -28.994 22.528 -11.481 1.00 16.88 C ATOM 1354 C VAL A 307 -30.406 21.953 -11.563 1.00 17.58 C ATOM 1355 O VAL A 307 -31.114 21.926 -10.567 1.00 18.93 O ATOM 1356 CB VAL A 307 -28.973 23.970 -12.050 1.00 16.92 C ATOM 1357 CG1 VAL A 307 -30.145 24.772 -11.505 1.00 18.31 C ATOM 1358 CG2 VAL A 307 -27.661 24.639 -11.690 1.00 18.13 C ATOM 1359 H VAL A 307 -27.558 22.036 -13.031 1.00 0.00 H ATOM 1360 N LYS A 308 -30.807 21.476 -12.736 1.00 18.07 N ATOM 1361 CA LYS A 308 -32.152 20.930 -12.888 1.00 18.99 C ATOM 1362 C LYS A 308 -32.364 19.661 -12.050 1.00 18.75 C ATOM 1363 O LYS A 308 -33.474 19.367 -11.627 1.00 17.97 O ATOM 1364 CB LYS A 308 -32.431 20.631 -14.364 1.00 20.81 C ATOM 1365 CG LYS A 308 -33.847 20.179 -14.618 1.00 25.44 C ATOM 1366 CD LYS A 308 -34.134 20.083 -16.101 1.00 28.74 C ATOM 1367 CE LYS A 308 -35.628 20.039 -16.357 1.00 31.08 C ATOM 1368 NZ LYS A 308 -35.946 20.059 -17.820 1.00 33.85 N ATOM 1369 HZ1 LYS A 308 -35.568 20.930 -18.244 1.00 0.00 H ATOM 1370 HZ2 LYS A 308 -35.512 19.233 -18.279 1.00 0.00 H ATOM 1371 HZ3 LYS A 308 -36.977 20.028 -17.950 1.00 0.00 H ATOM 1372 H LYS A 308 -30.160 21.492 -13.550 1.00 0.00 H ATOM 1373 N GLN A 309 -31.295 18.911 -11.819 1.00 18.32 N ATOM 1374 CA GLN A 309 -31.382 17.679 -11.043 1.00 18.85 C ATOM 1375 C GLN A 309 -31.055 17.889 -9.558 1.00 18.15 C ATOM 1376 O GLN A 309 -30.747 16.936 -8.840 1.00 17.84 O ATOM 1377 CB GLN A 309 -30.452 16.623 -11.647 1.00 20.27 C ATOM 1378 CG GLN A 309 -30.797 16.215 -13.075 1.00 23.78 C ATOM 1379 CD GLN A 309 -32.192 15.632 -13.213 1.00 26.04 C ATOM 1380 OE1 GLN A 309 -32.607 14.770 -12.434 1.00 26.91 O ATOM 1381 NE2 GLN A 309 -32.929 16.107 -14.212 1.00 26.90 N ATOM 1382 HE22 GLN A 309 -32.539 16.834 -14.846 1.00 0.00 H ATOM 1383 HE21 GLN A 309 -33.895 15.752 -14.360 1.00 0.00 H ATOM 1384 H GLN A 309 -30.374 19.208 -12.200 1.00 0.00 H ATOM 1385 N ARG A 310 -31.122 19.142 -9.111 1.00 17.54 N ATOM 1386 CA ARG A 310 -30.870 19.509 -7.724 1.00 17.89 C ATOM 1387 C ARG A 310 -29.454 19.257 -7.224 1.00 16.16 C ATOM 1388 O ARG A 310 -29.247 18.967 -6.055 1.00 16.43 O ATOM 1389 CB ARG A 310 -31.881 18.825 -6.811 1.00 18.86 C ATOM 1390 CG ARG A 310 -33.290 19.403 -6.936 1.00 20.60 C ATOM 1391 CD ARG A 310 -34.352 18.432 -6.407 1.00 23.26 C ATOM 1392 NE ARG A 310 -34.040 17.942 -5.069 1.00 26.27 N ATOM 1393 CZ ARG A 310 -34.052 18.682 -3.965 1.00 28.60 C ATOM 1394 NH1 ARG A 310 -34.362 19.966 -4.020 1.00 29.90 N ATOM 1395 NH2 ARG A 310 -33.757 18.134 -2.789 1.00 29.76 N ATOM 1396 HE ARG A 310 -33.789 16.937 -4.971 1.00 0.00 H ATOM 1397 HH12 ARG A 310 -34.369 20.537 -3.151 1.00 0.00 H ATOM 1398 HH11 ARG A 310 -34.599 20.405 -4.932 1.00 0.00 H ATOM 1399 HH22 ARG A 310 -33.767 18.716 -1.927 1.00 0.00 H ATOM 1400 HH21 ARG A 310 -33.516 17.124 -2.732 1.00 0.00 H ATOM 1401 H ARG A 310 -31.366 19.895 -9.785 1.00 0.00 H ATOM 1402 N GLY A 311 -28.484 19.396 -8.119 1.00 16.67 N ATOM 1403 CA GLY A 311 -27.086 19.219 -7.764 1.00 15.45 C ATOM 1404 C GLY A 311 -26.763 18.028 -6.892 1.00 15.62 C ATOM 1405 O GLY A 311 -27.286 16.941 -7.099 1.00 15.13 O ATOM 1406 H GLY A 311 -28.731 19.638 -9.100 1.00 0.00 H ATOM 1407 N TRP A 312 -25.905 18.237 -5.902 1.00 15.76 N ATOM 1408 CA TRP A 312 -25.509 17.144 -5.026 1.00 17.09 C ATOM 1409 C TRP A 312 -26.612 16.611 -4.102 1.00 17.70 C ATOM 1410 O TRP A 312 -26.571 15.470 -3.683 1.00 16.79 O ATOM 1411 CB TRP A 312 -24.244 17.536 -4.242 1.00 16.77 C ATOM 1412 CG TRP A 312 -23.063 17.709 -5.145 1.00 16.75 C ATOM 1413 CD1 TRP A 312 -22.511 18.887 -5.581 1.00 16.38 C ATOM 1414 CD2 TRP A 312 -22.360 16.647 -5.839 1.00 17.53 C ATOM 1415 NE1 TRP A 312 -21.505 18.623 -6.504 1.00 16.75 N ATOM 1416 CE2 TRP A 312 -21.390 17.295 -6.661 1.00 18.26 C ATOM 1417 CE3 TRP A 312 -22.448 15.256 -5.813 1.00 19.44 C ATOM 1418 CZ2 TRP A 312 -20.536 16.538 -7.493 1.00 18.71 C ATOM 1419 CZ3 TRP A 312 -21.598 14.526 -6.642 1.00 19.49 C ATOM 1420 CH2 TRP A 312 -20.639 15.178 -7.465 1.00 17.54 C ATOM 1421 HE1 TRP A 312 -20.933 19.340 -6.994 1.00 0.00 H ATOM 1422 H TRP A 312 -25.513 19.188 -5.751 1.00 0.00 H ATOM 1423 N ASP A 313 -27.604 17.435 -3.787 1.00 19.59 N ATOM 1424 CA ASP A 313 -28.713 16.949 -2.971 1.00 19.31 C ATOM 1425 C ASP A 313 -29.436 15.914 -3.828 1.00 18.83 C ATOM 1426 O ASP A 313 -29.850 14.877 -3.343 1.00 19.41 O ATOM 1427 CB ASP A 313 -29.677 18.081 -2.581 1.00 22.30 C ATOM 1428 CG ASP A 313 -29.213 18.847 -1.359 1.00 24.85 C ATOM 1429 OD1 ASP A 313 -28.371 18.329 -0.621 1.00 28.37 O ATOM 1430 OD2 ASP A 313 -29.714 19.960 -1.113 1.00 27.97 O ATOM 1431 H ASP A 313 -27.591 18.420 -4.119 1.00 0.00 H ATOM 1432 N GLY A 314 -29.562 16.208 -5.116 1.00 17.84 N ATOM 1433 CA GLY A 314 -30.213 15.302 -6.046 1.00 16.55 C ATOM 1434 C GLY A 314 -29.413 14.021 -6.206 1.00 17.69 C ATOM 1435 O GLY A 314 -29.989 12.943 -6.290 1.00 17.67 O ATOM 1436 H GLY A 314 -29.185 17.111 -5.469 1.00 0.00 H ATOM 1437 N PHE A 315 -28.089 14.150 -6.252 1.00 16.60 N ATOM 1438 CA PHE A 315 -27.191 13.005 -6.369 1.00 17.39 C ATOM 1439 C PHE A 315 -27.445 12.062 -5.198 1.00 17.85 C ATOM 1440 O PHE A 315 -27.662 10.855 -5.387 1.00 17.91 O ATOM 1441 CB PHE A 315 -25.745 13.485 -6.328 1.00 17.19 C ATOM 1442 CG PHE A 315 -24.718 12.372 -6.316 1.00 18.07 C ATOM 1443 CD1 PHE A 315 -24.425 11.650 -7.479 1.00 17.55 C ATOM 1444 CD2 PHE A 315 -24.025 12.067 -5.144 1.00 17.78 C ATOM 1445 CE1 PHE A 315 -23.459 10.643 -7.467 1.00 18.81 C ATOM 1446 CE2 PHE A 315 -23.054 11.062 -5.115 1.00 18.76 C ATOM 1447 CZ PHE A 315 -22.768 10.345 -6.287 1.00 20.06 C ATOM 1448 H PHE A 315 -27.678 15.104 -6.203 1.00 0.00 H ATOM 1449 N VAL A 316 -27.433 12.622 -3.989 1.00 18.42 N ATOM 1450 CA VAL A 316 -27.658 11.808 -2.788 1.00 18.82 C ATOM 1451 C VAL A 316 -29.035 11.138 -2.804 1.00 19.52 C ATOM 1452 O VAL A 316 -29.166 9.948 -2.510 1.00 19.30 O ATOM 1453 CB VAL A 316 -27.494 12.652 -1.504 1.00 18.53 C ATOM 1454 CG1 VAL A 316 -27.859 11.815 -0.277 1.00 20.13 C ATOM 1455 CG2 VAL A 316 -26.065 13.162 -1.415 1.00 18.35 C ATOM 1456 H VAL A 316 -27.263 13.644 -3.895 1.00 0.00 H ATOM 1457 N GLU A 317 -30.058 11.896 -3.178 1.00 19.93 N ATOM 1458 CA GLU A 317 -31.416 11.364 -3.236 1.00 22.10 C ATOM 1459 C GLU A 317 -31.571 10.269 -4.301 1.00 21.74 C ATOM 1460 O GLU A 317 -32.270 9.277 -4.081 1.00 21.95 O ATOM 1461 CB GLU A 317 -32.420 12.486 -3.527 1.00 23.79 C ATOM 1462 CG GLU A 317 -32.407 13.633 -2.536 1.00 27.68 C ATOM 1463 CD GLU A 317 -33.282 14.787 -2.981 1.00 29.95 C ATOM 1464 OE1 GLU A 317 -33.379 15.077 -4.178 1.00 32.13 O ATOM 1465 OE2 GLU A 317 -33.915 15.439 -2.145 1.00 32.75 O ATOM 1466 H GLU A 317 -29.889 12.889 -3.435 1.00 0.00 H ATOM 1467 N PHE A 318 -30.908 10.436 -5.442 1.00 20.73 N ATOM 1468 CA PHE A 318 -31.017 9.466 -6.522 1.00 20.74 C ATOM 1469 C PHE A 318 -30.559 8.069 -6.135 1.00 21.65 C ATOM 1470 O PHE A 318 -31.200 7.094 -6.498 1.00 21.63 O ATOM 1471 CB PHE A 318 -30.211 9.942 -7.735 1.00 19.41 C ATOM 1472 CG PHE A 318 -30.353 9.057 -8.940 1.00 19.48 C ATOM 1473 CD1 PHE A 318 -31.486 9.129 -9.731 1.00 19.45 C ATOM 1474 CD2 PHE A 318 -29.338 8.182 -9.309 1.00 19.20 C ATOM 1475 CE1 PHE A 318 -31.616 8.329 -10.876 1.00 19.45 C ATOM 1476 CE2 PHE A 318 -29.457 7.385 -10.439 1.00 19.04 C ATOM 1477 CZ PHE A 318 -30.596 7.465 -11.232 1.00 20.01 C ATOM 1478 H PHE A 318 -30.302 11.273 -5.564 1.00 0.00 H ATOM 1479 N PHE A 319 -29.437 7.999 -5.425 1.00 21.95 N ATOM 1480 CA PHE A 319 -28.837 6.741 -4.993 1.00 23.38 C ATOM 1481 C PHE A 319 -29.229 6.326 -3.587 1.00 24.57 C ATOM 1482 O PHE A 319 -28.672 5.394 -3.025 1.00 24.34 O ATOM 1483 CB PHE A 319 -27.309 6.829 -5.062 1.00 22.57 C ATOM 1484 CG PHE A 319 -26.760 7.014 -6.457 1.00 21.17 C ATOM 1485 CD1 PHE A 319 -26.571 5.926 -7.298 1.00 20.98 C ATOM 1486 CD2 PHE A 319 -26.452 8.285 -6.932 1.00 20.72 C ATOM 1487 CE1 PHE A 319 -26.050 6.094 -8.596 1.00 20.79 C ATOM 1488 CE2 PHE A 319 -25.939 8.472 -8.212 1.00 21.34 C ATOM 1489 CZ PHE A 319 -25.745 7.378 -9.053 1.00 20.09 C ATOM 1490 H PHE A 319 -28.962 8.887 -5.164 1.00 0.00 H ATOM 1491 N HIS A 320 -30.191 7.023 -3.001 1.00 25.85 N ATOM 1492 CA HIS A 320 -30.642 6.717 -1.617 1.00 28.17 C ATOM 1493 C HIS A 320 -31.021 5.252 -1.359 1.00 29.25 C ATOM 1494 O HIS A 320 -31.727 4.643 -2.134 1.00 29.02 O ATOM 1495 CB HIS A 320 -31.826 7.588 -1.267 1.00 28.74 C ATOM 1496 CG HIS A 320 -32.356 7.361 0.112 1.00 29.70 C ATOM 1497 ND1 HIS A 320 -31.661 7.738 1.233 1.00 30.52 N ATOM 1498 CD2 HIS A 320 -33.485 6.746 0.563 1.00 30.40 C ATOM 1499 CE1 HIS A 320 -32.322 7.367 2.320 1.00 30.75 C ATOM 1500 NE2 HIS A 320 -33.431 6.762 1.932 1.00 30.70 N ATOM 1501 H HIS A 320 -30.642 7.803 -3.521 1.00 0.00 H ATOM 1502 N VAL A 321 -30.482 4.726 -0.256 1.00 31.19 N ATOM 1503 CA VAL A 321 -30.702 3.344 0.170 1.00 32.92 C ATOM 1504 C VAL A 321 -31.882 3.349 1.115 1.00 33.40 C ATOM 1505 O VAL A 321 -33.003 2.772 0.838 1.00 34.14 O ATOM 1506 CB VAL A 321 -29.491 2.732 0.889 1.00 33.65 C ATOM 1507 CG1 VAL A 321 -29.893 1.446 1.599 1.00 34.10 C ATOM 1508 CG2 VAL A 321 -28.418 2.447 -0.139 1.00 34.09 C ATOM 1509 H VAL A 321 -29.873 5.331 0.331 1.00 0.00 H TER 1510 VAL A 321 HETATM 1511 O HOH 1 -32.579 16.029 -0.695 1.00 51.75 O HETATM 1512 O HOH 2 0.942 22.313 -21.460 1.00 35.71 O HETATM 1513 O HOH 3 4.058 14.695 -9.211 1.00 50.12 O HETATM 1514 O HOH 4 -20.502 -0.828 -4.629 1.00 41.85 O HETATM 1515 O HOH 5 2.113 6.354 -24.973 1.00 50.76 O HETATM 1516 O HOH 6 1.244 22.172 -17.379 1.00 50.70 O HETATM 1517 O HOH 7 -10.598 -7.859 -13.391 1.00 34.95 O HETATM 1518 O HOH 8 -12.739 25.815 -15.195 1.00 38.72 O HETATM 1519 O HOH 9 -26.016 16.380 -21.722 1.00 44.36 O HETATM 1520 O HOH 10 -11.842 11.512 2.670 1.00 27.32 O HETATM 1521 O HOH 11 -5.315 19.745 7.485 1.00 47.11 O HETATM 1522 O HOH 12 -23.148 30.189 -5.715 1.00 40.60 O HETATM 1523 O HOH 13 -19.838 8.604 -24.272 1.00 38.39 O HETATM 1524 O HOH 14 -18.755 20.742 0.895 1.00 40.56 O HETATM 1525 O HOH 15 -17.247 28.834 -15.850 1.00 31.84 O HETATM 1526 O HOH 16 -6.612 17.276 -17.612 1.00 33.21 O HETATM 1527 O HOH 17 -34.769 1.377 1.940 1.00 46.30 O HETATM 1528 O HOH 18 -6.140 20.803 -13.316 1.00 41.45 O HETATM 1529 O HOH 19 -23.064 9.833 5.191 1.00 57.17 O HETATM 1530 O HOH 20 -24.887 23.987 -18.822 1.00 29.16 O HETATM 1531 O HOH 21 -6.454 -6.122 -17.861 1.00 26.64 O HETATM 1532 O HOH 22 2.608 4.864 -16.696 1.00 39.13 O HETATM 1533 O HOH 23 5.498 16.044 -18.355 1.00 40.29 O HETATM 1534 O HOH 24 0.383 9.037 -23.145 1.00 40.69 O HETATM 1535 O HOH 25 -24.709 19.165 -22.371 1.00 53.96 O HETATM 1536 O HOH 26 1.344 19.561 -21.861 1.00 43.02 O HETATM 1537 O HOH 27 -6.570 22.550 -8.515 1.00 48.95 O HETATM 1538 O HOH 28 -11.191 -2.414 -10.163 1.00 27.84 O HETATM 1539 O HOH 29 -8.196 2.835 -1.844 1.00 44.62 O HETATM 1540 O HOH 30 -13.790 23.245 -2.864 1.00 27.66 O HETATM 1541 O HOH 31 -9.466 -7.409 -15.808 1.00 39.20 O HETATM 1542 O HOH 32 -6.329 17.920 -22.614 1.00 23.64 O HETATM 1543 O HOH 33 -13.579 -0.519 -6.190 1.00 23.33 O HETATM 1544 O HOH 34 -23.148 5.955 -21.124 1.00 24.13 O HETATM 1545 O HOH 35 -34.246 15.054 -6.683 1.00 55.17 O HETATM 1546 O HOH 36 -26.168 1.033 -3.362 1.00 36.40 O HETATM 1547 O HOH 37 -35.097 14.051 -11.850 1.00 33.61 O HETATM 1548 O HOH 38 -11.645 0.110 -22.287 1.00 23.83 O HETATM 1549 O HOH 39 -23.703 14.470 -27.885 1.00 25.89 O HETATM 1550 O HOH 40 -26.429 26.637 -15.724 1.00 30.85 O HETATM 1551 O HOH 41 0.384 13.492 -23.169 1.00 55.46 O HETATM 1552 O HOH 42 -5.426 20.209 -19.614 1.00 34.40 O HETATM 1553 O HOH 43 -19.637 2.606 -16.229 1.00 27.62 O HETATM 1554 O HOH 44 -3.963 22.247 -3.412 1.00 31.23 O HETATM 1555 O HOH 45 -18.803 -5.666 -16.945 1.00 23.24 O HETATM 1556 O HOH 46 -7.570 11.210 1.712 1.00 26.90 O HETATM 1557 O HOH 47 -36.098 18.954 -12.108 1.00 40.15 O HETATM 1558 O HOH 48 -27.318 8.147 -1.681 1.00 26.11 O HETATM 1559 O HOH 49 -19.007 10.456 4.284 1.00 33.29 O HETATM 1560 O HOH 50 -20.301 25.280 -2.045 1.00 34.28 O HETATM 1561 O HOH 51 -3.774 21.567 4.956 1.00 19.84 O HETATM 1562 O HOH 52 -2.025 4.860 -17.828 1.00 21.98 O HETATM 1563 O HOH 53 -32.523 12.869 -7.333 1.00 27.74 O HETATM 1564 O HOH 54 -9.831 12.512 0.969 1.00 24.17 O HETATM 1565 O HOH 55 -31.244 4.219 -4.803 1.00 44.87 O HETATM 1566 O HOH 56 -15.057 -0.758 -1.485 1.00 34.92 O HETATM 1567 O HOH 57 -8.175 -4.683 -19.945 1.00 27.41 O HETATM 1568 O HOH 58 -5.657 14.135 -25.226 1.00 32.58 O HETATM 1569 O HOH 59 -22.635 -1.942 -14.415 1.00 19.91 O HETATM 1570 O HOH 60 -22.381 24.383 -18.155 1.00 24.26 O HETATM 1571 O HOH 61 -12.345 17.344 -26.571 1.00 24.04 O HETATM 1572 O HOH 62 -14.231 3.089 -0.133 1.00 29.16 O HETATM 1573 O HOH 63 -31.274 24.132 -15.492 1.00 25.14 O HETATM 1574 O HOH 64 -2.500 2.904 -5.963 1.00 40.26 O HETATM 1575 O HOH 65 -6.386 -0.583 -24.470 1.00 44.26 O HETATM 1576 O HOH 66 -24.737 15.792 -25.352 1.00 50.98 O HETATM 1577 O HOH 67 -21.910 22.507 -22.356 1.00 32.75 O HETATM 1578 O HOH 68 -24.753 26.465 -19.783 1.00 35.73 O HETATM 1579 O HOH 69 -11.857 -9.858 -17.817 1.00 38.81 O HETATM 1580 O HOH 70 -12.699 5.287 -0.501 1.00 25.58 O HETATM 1581 O HOH 71 -30.366 13.797 -20.053 1.00 45.54 O HETATM 1582 O HOH 72 -27.820 28.074 -19.672 1.00 41.97 O HETATM 1583 O HOH 73 -22.250 3.086 2.922 1.00 39.06 O HETATM 1584 O HOH 74 -16.592 29.615 -11.311 1.00 32.91 O HETATM 1585 O HOH 75 -22.481 -0.177 -5.644 1.00 38.21 O HETATM 1586 O HOH 76 -8.230 19.832 -4.960 1.00 40.54 O HETATM 1587 O HOH 77 -4.059 3.236 -4.033 1.00 38.16 O HETATM 1588 O HOH 78 -30.052 9.995 1.794 1.00 37.52 O HETATM 1589 O HOH 79 -24.121 14.330 6.486 1.00 33.39 O HETATM 1590 O HOH 80 -19.591 21.830 6.900 1.00 48.12 O HETATM 1591 O HOH 81 -30.244 26.400 -16.122 1.00 53.45 O HETATM 1592 O HOH 82 -0.638 17.749 -22.522 1.00 31.57 O HETATM 1593 O HOH 83 -17.206 -2.887 -18.967 1.00 26.00 O HETATM 1594 O HOH 84 -10.852 20.026 -17.592 1.00 27.91 O HETATM 1595 O HOH 85 -22.950 13.340 -20.266 1.00 26.34 O HETATM 1596 O HOH 86 -0.538 19.602 -6.506 1.00 43.38 O HETATM 1597 O HOH 87 -15.031 -4.278 -18.140 1.00 19.57 O HETATM 1598 O HOH 88 1.826 0.631 -11.752 1.00 54.00 O HETATM 1599 O HOH 89 -22.159 5.198 -17.203 1.00 26.35 O HETATM 1600 O HOH 90 -13.621 24.059 -0.546 1.00 40.61 O HETATM 1601 O HOH 91 -29.919 10.460 -14.091 1.00 22.49 O HETATM 1602 O HOH 92 -17.659 0.091 -1.137 1.00 25.90 O HETATM 1603 O HOH 93 -22.261 25.171 -1.155 1.00 46.43 O HETATM 1604 O HOH 94 -5.953 1.862 -10.969 1.00 21.01 O HETATM 1605 O HOH 95 -21.591 4.228 -13.347 1.00 27.82 O HETATM 1606 O HOH 96 -23.716 24.093 -3.775 1.00 39.78 O HETATM 1607 O HOH 97 -34.926 17.586 -9.828 1.00 44.51 O HETATM 1608 O HOH 98 -25.164 8.915 2.247 1.00 34.56 O HETATM 1609 O HOH 99 -30.126 14.703 -0.436 1.00 37.54 O HETATM 1610 O HOH 100 4.410 12.368 -22.217 1.00 33.51 O HETATM 1611 O HOH 101 -10.229 4.393 0.426 1.00 41.09 O HETATM 1612 O HOH 102 -9.518 21.782 -17.088 1.00 41.61 O HETATM 1613 O HOH 103 -31.620 14.226 -9.553 1.00 26.98 O HETATM 1614 O HOH 104 -5.945 22.088 3.596 1.00 25.16 O HETATM 1615 O HOH 105 0.159 2.110 -20.493 1.00 26.83 O HETATM 1616 O HOH 106 5.522 14.557 -14.165 1.00 36.51 O HETATM 1617 O HOH 107 -14.584 -6.295 -16.028 1.00 23.37 O HETATM 1618 O HOH 108 -2.536 16.326 -5.139 1.00 30.51 O HETATM 1619 O HOH 109 3.548 3.080 -19.315 1.00 30.32 O HETATM 1620 O HOH 110 -24.340 21.295 6.071 1.00 31.24 O HETATM 1621 O HOH 111 -13.619 13.333 4.018 1.00 33.69 O HETATM 1622 O HOH 112 -24.977 22.509 -20.288 1.00 41.47 O HETATM 1623 O HOH 113 -26.242 20.793 -18.954 1.00 21.68 O HETATM 1624 O HOH 114 -18.804 10.646 -27.115 1.00 39.17 O HETATM 1625 O HOH 115 3.977 10.652 -5.462 1.00 37.85 O HETATM 1626 O HOH 116 -8.543 -2.197 -9.915 1.00 33.53 O HETATM 1627 O HOH 117 -13.085 -3.337 -5.128 1.00 46.01 O HETATM 1628 O HOH 118 -3.984 -1.153 -17.124 1.00 29.47 O HETATM 1629 O HOH 119 -6.948 -2.786 -11.632 1.00 32.26 O HETATM 1630 O HOH 120 8.635 11.082 -10.899 1.00 50.97 O HETATM 1631 O HOH 121 8.160 9.489 -9.436 1.00 47.47 O HETATM 1632 O HOH 122 -30.007 9.186 -19.965 1.00 37.34 O HETATM 1633 O HOH 123 -23.236 27.722 -8.111 1.00 20.06 O HETATM 1634 O HOH 124 -19.192 6.142 4.049 1.00 31.45 O HETATM 1635 O HOH 125 -1.511 1.116 -12.397 1.00 31.61 O HETATM 1636 O HOH 126 -33.453 1.861 3.697 1.00 45.71 O HETATM 1637 O HOH 127 -12.011 4.785 3.077 1.00 57.59 O HETATM 1638 O HOH 128 -24.862 26.632 -10.189 1.00 17.63 O HETATM 1639 O HOH 129 4.923 3.874 -22.799 1.00 37.20 O HETATM 1640 O HOH 130 -28.319 5.760 1.662 1.00 29.84 O HETATM 1641 O HOH 131 -20.268 4.255 2.244 1.00 39.24 O HETATM 1642 O HOH 132 -14.204 14.664 7.718 1.00 49.47 O HETATM 1643 O HOH 133 -24.132 6.823 1.103 1.00 24.82 O HETATM 1644 O HOH 134 7.839 10.296 -19.695 1.00 51.04 O HETATM 1645 O HOH 135 -25.674 6.099 -20.103 1.00 30.95 O HETATM 1646 O HOH 136 -31.909 11.789 -12.894 1.00 23.93 O HETATM 1647 O HOH 137 -25.654 20.795 -1.207 1.00 24.56 O HETATM 1648 O HOH 138 -28.165 15.367 0.857 1.00 31.06 O HETATM 1649 O HOH 139 -11.220 -0.982 -7.661 1.00 30.22 O HETATM 1650 O HOH 140 -32.723 17.752 -16.924 1.00 45.62 O HETATM 1651 O HOH 141 -17.500 5.128 -23.367 1.00 29.67 O HETATM 1652 O HOH 142 -27.853 18.951 4.039 1.00 44.76 O HETATM 1653 O HOH 143 -11.287 2.636 -26.015 1.00 44.49 O HETATM 1654 O HOH 144 -7.198 21.824 -16.341 1.00 50.49 O HETATM 1655 O HOH 145 1.363 17.842 -10.535 1.00 42.49 O HETATM 1656 O HOH 146 -24.300 9.134 -24.668 1.00 31.69 O HETATM 1657 O HOH 147 -21.577 -0.286 -12.053 1.00 30.92 O HETATM 1658 O HOH 148 -0.476 -2.666 -19.970 1.00 35.43 O HETATM 1659 O HOH 149 -11.376 14.787 -28.792 1.00 42.85 O HETATM 1660 O HOH 150 -16.203 12.249 4.562 1.00 35.71 O HETATM 1661 O HOH 151 -3.905 0.290 -26.030 1.00 56.31 O HETATM 1662 O HOH 152 5.143 14.734 -22.651 1.00 52.60 O HETATM 1663 O HOH 153 -22.347 0.226 -7.952 1.00 43.06 O HETATM 1664 O HOH 154 -12.996 -8.406 -14.371 1.00 26.62 O HETATM 1665 O HOH 155 -9.862 1.454 -24.036 1.00 29.74 O HETATM 1666 O HOH 156 -4.496 21.473 -8.156 1.00 32.97 O HETATM 1667 O HOH 157 -10.116 20.110 -23.053 1.00 22.84 O HETATM 1668 O HOH 158 -15.413 8.280 -27.745 1.00 47.58 O HETATM 1669 O HOH 159 -27.920 2.595 -5.173 1.00 35.57 O HETATM 1670 O HOH 160 -4.524 10.810 -23.918 1.00 50.55 O HETATM 1671 O HOH 161 -3.355 1.507 -10.050 1.00 23.59 O HETATM 1672 O HOH 162 -27.071 18.329 -20.417 1.00 36.32 O HETATM 1673 O HOH 163 -3.619 16.733 5.473 1.00 43.74 O HETATM 1674 O HOH 164 -7.588 21.579 -20.604 1.00 33.03 O HETATM 1675 O HOH 165 -5.659 -3.421 -20.805 1.00 37.79 O HETATM 1676 O HOH 166 -3.727 20.917 -21.757 1.00 31.14 O HETATM 1677 O HOH 167 -17.805 2.462 -18.524 1.00 33.03 O HETATM 1678 O HOH 168 5.220 1.614 -11.747 1.00 48.33 O HETATM 1679 O HOH 169 -23.980 30.210 -13.576 1.00 48.25 O HETATM 1680 O HOH 170 -19.226 29.243 -2.044 1.00 54.11 O HETATM 1681 O HOH 171 -11.830 21.401 -2.070 1.00 48.12 O HETATM 1682 O HOH 172 -33.434 10.849 0.208 1.00 60.65 O HETATM 1683 O HOH 173 -10.152 -10.189 -12.304 1.00 49.02 O HETATM 1684 O HOH 174 0.517 17.010 -12.479 1.00 30.29 O HETATM 1685 O HOH 175 -7.380 0.286 -9.144 1.00 32.36 O HETATM 1686 O HOH 176 -10.757 2.365 -0.899 1.00 51.67 O HETATM 1687 O HOH 177 9.046 10.809 -7.232 1.00 32.63 O HETATM 1688 O HOH 178 -12.841 -4.130 -22.239 1.00 49.39 O HETATM 1689 O HOH 179 -33.316 24.212 -13.430 1.00 34.09 O HETATM 1690 O HOH 180 8.317 9.645 -17.524 1.00 45.29 O HETATM 1691 O HOH 181 -14.449 -5.745 -20.463 1.00 35.27 O HETATM 1692 O HOH 182 -31.551 12.184 0.354 1.00 42.61 O HETATM 1693 O HOH 183 -0.388 2.513 -17.538 1.00 30.32 O HETATM 1694 O HOH 184 -37.370 15.966 -5.453 1.00 43.59 O HETATM 1695 O HOH 185 -10.824 -2.621 -22.793 1.00 36.72 O HETATM 1696 O HOH 186 -10.907 10.784 -27.391 1.00 46.22 O HETATM 1697 O HOH 187 -17.132 0.486 -19.683 1.00 47.10 O HETATM 1698 O HOH 188 -8.389 -0.214 -25.592 1.00 30.96 O HETATM 1699 O HOH 189 -5.040 14.096 11.273 1.00 38.96 O HETATM 1700 O HOH 190 1.932 2.709 -16.655 1.00 30.10 O HETATM 1701 O HOH 191 -27.803 8.487 1.130 1.00 33.92 O HETATM 1702 O HOH 192 -24.555 6.634 -23.276 1.00 41.52 O HETATM 1703 O HOH 193 -5.218 -1.568 -14.979 1.00 43.10 O HETATM 1704 O HOH 194 -3.268 -3.024 -18.924 1.00 42.82 O HETATM 1705 O HOH 195 -30.072 5.402 4.013 1.00 43.72 O HETATM 1706 O HOH 196 -31.627 11.085 -16.605 1.00 30.61 O HETATM 1707 O HOH 197 -20.610 9.554 6.066 1.00 50.92 O HETATM 1708 O HOH 198 -32.327 23.032 -17.859 1.00 51.42 O HETATM 1709 O HOH 199 -12.056 8.476 -27.188 1.00 56.95 O HETATM 1710 O HOH 200 -4.645 17.342 8.271 1.00 25.26 O HETATM 1711 O HOH 201 -4.955 17.486 -25.214 1.00 40.60 O HETATM 1712 O HOH 202 -28.765 5.377 -21.220 1.00 35.08 O HETATM 1713 O HOH 203 -17.421 8.811 -27.137 1.00 51.86 O HETATM 1714 O HOH 204 -18.916 -5.025 -19.208 1.00 40.64 O HETATM 1715 O HOH 205 -7.382 22.372 -6.453 1.00 32.49 O HETATM 1716 O HOH 206 -3.039 0.583 -7.615 1.00 28.15 O HETATM 1717 O HOH 207 -7.366 13.376 -27.098 1.00 44.28 O HETATM 1718 O HOH 208 -31.493 19.681 -18.155 1.00 42.05 O HETATM 1719 O HOH 209 -6.173 -3.419 -24.153 1.00 49.22 O HETATM 1720 O HOH 210 -13.617 6.328 -26.004 1.00 52.69 O HETATM 1721 O HOH 211 -26.632 1.530 2.551 1.00 40.31 O HETATM 1722 O HOH 212 -12.035 22.430 -18.833 1.00 29.10 O HETATM 1723 O HOH 213 -0.374 1.773 -4.648 1.00 34.44 O HETATM 1724 O HOH 214 -11.608 19.698 -25.415 1.00 32.68 O HETATM 1725 O HOH 215 -16.495 17.068 10.301 1.00 45.76 O HETATM 1726 O HOH 216 -14.860 5.267 -23.916 1.00 34.95 O HETATM 1727 O HOH 217 -19.167 0.094 1.288 1.00 27.79 O HETATM 1728 O HOH 218 -9.039 -6.461 -21.988 1.00 39.52 O HETATM 1729 O HOH 219 -21.469 0.613 1.100 1.00 38.17 O HETATM 1730 O HOH 220 -15.378 2.437 2.298 1.00 46.65 O HETATM 1731 O HOH 221 -5.715 14.250 13.741 1.00 32.87 O HETATM 1732 O HOH 222 7.178 10.463 -23.655 1.00 49.45 O HETATM 1733 O HOH 223 -1.775 0.195 -16.735 1.00 36.65 O HETATM 1734 O HOH 224 -32.422 12.599 -20.896 1.00 35.22 O HETATM 1735 O HOH 225 -31.463 17.396 2.935 1.00 51.60 O HETATM 1736 O HOH 226 -12.412 25.638 -4.284 1.00 43.85 O HETATM 1737 O HOH 227 -18.095 2.410 2.627 1.00 51.57 O HETATM 1738 O HOH 228 -9.041 -2.868 -24.966 1.00 55.61 O HETATM 1739 O HOH 229 8.641 9.017 -22.063 1.00 30.65 O HETATM 1740 O HOH 230 -14.279 3.015 -24.783 1.00 39.67 O HETATM 1741 C1 Q A 54 -12.077 10.493 -15.969 1.00 -0.03 C HETATM 1742 C2 Q A 54 -10.769 10.795 -16.344 1.00 0.06 C HETATM 1743 C3 Q A 54 -10.288 10.601 -17.627 1.00 -0.02 C HETATM 1744 C4 Q A 54 -11.131 10.072 -18.602 1.00 -0.02 C HETATM 1745 C24 Q A 54 -10.585 9.824 -19.977 1.00 -0.00 C HETATM 1746 C23 Q A 54 -11.322 8.730 -20.770 1.00 -0.05 C HETATM 1747 C22 Q A 54 -12.853 9.022 -20.759 1.00 -0.07 C HETATM 1748 C15 Q A 54 -13.466 9.136 -19.343 1.00 0.00 C HETATM 1749 C11 Q A 54 -14.770 9.978 -19.436 1.00 0.05 C HETATM 1750 O1 Q A 54 -15.710 9.641 -18.425 1.00 -0.33 O HETATM 1751 C14 Q A 54 -16.618 8.687 -18.854 1.00 0.11 C HETATM 1752 C10 Q A 54 -17.989 8.983 -18.609 1.00 -0.04 C HETATM 1753 C9 Q A 54 -18.990 8.104 -19.037 1.00 -0.07 C HETATM 1754 C8 Q A 54 -18.599 6.899 -19.721 1.00 -0.01 C HETATM 1755 C7 Q A 54 -17.272 6.634 -19.946 1.00 -0.04 C HETATM 1756 C13 Q A 54 -16.230 7.500 -19.525 1.00 0.07 C HETATM 1757 N1 Q A 54 -14.898 7.150 -19.750 1.00 -0.32 N HETATM 1758 C12 Q A 54 -13.813 7.705 -18.892 1.00 0.01 C HETATM 1759 H8 Q A 54 -14.150 7.724 -17.845 1.00 0.04 H HETATM 1760 H9 Q A 54 -12.919 7.069 -18.978 1.00 0.04 H HETATM 1761 C17 Q A 54 -14.499 6.005 -20.582 1.00 0.03 C HETATM 1762 C19 Q A 54 -14.621 4.667 -19.862 1.00 -0.02 C HETATM 1763 C20 Q A 54 -14.266 3.428 -20.719 1.00 -0.05 C HETATM 1764 C21 Q A 54 -13.614 2.815 -19.471 1.00 -0.05 C HETATM 1765 C18 Q A 54 -13.600 4.196 -18.798 1.00 -0.05 C HETATM 1766 H21 Q A 54 -13.980 4.205 -17.766 1.00 0.03 H HETATM 1767 H22 Q A 54 -12.630 4.713 -18.836 1.00 0.03 H HETATM 1768 H13 Q A 54 -12.614 2.392 -19.649 1.00 0.03 H HETATM 1769 H14 Q A 54 -14.241 2.071 -18.957 1.00 0.03 H HETATM 1770 H11 Q A 54 -13.569 3.629 -21.546 1.00 0.03 H HETATM 1771 H12 Q A 54 -15.135 2.872 -21.099 1.00 0.03 H HETATM 1772 H10 Q A 54 -15.646 4.626 -19.465 1.00 0.03 H HETATM 1773 H19 Q A 54 -15.141 5.981 -21.475 1.00 0.05 H HETATM 1774 H20 Q A 54 -13.451 6.143 -20.887 1.00 0.05 H HETATM 1775 H3 Q A 54 -17.008 5.722 -20.469 1.00 0.05 H HETATM 1776 C16 Q A 54 -19.593 5.948 -20.138 1.00 0.05 C HETATM 1777 O2 Q A 54 -20.842 6.184 -19.860 1.00 -0.56 O HETATM 1778 O3 Q A 54 -19.275 4.937 -20.736 1.00 -0.56 O HETATM 1779 H4 Q A 54 -20.036 8.325 -18.858 1.00 0.05 H HETATM 1780 H5 Q A 54 -18.259 9.895 -18.088 1.00 0.05 H HETATM 1781 H6 Q A 54 -15.232 9.805 -20.419 1.00 0.05 H HETATM 1782 H7 Q A 54 -14.510 11.042 -19.335 1.00 0.05 H HETATM 1783 C5 Q A 54 -12.506 9.735 -18.291 1.00 -0.04 C HETATM 1784 C6 Q A 54 -12.931 9.970 -16.938 1.00 -0.05 C HETATM 1785 H23 Q A 54 -13.952 9.732 -16.662 1.00 0.08 H HETATM 1786 H15 Q A 54 -13.027 9.971 -21.288 1.00 0.02 H HETATM 1787 H16 Q A 54 -13.364 8.206 -21.291 1.00 0.02 H HETATM 1788 H24 Q A 54 -10.958 8.721 -21.808 1.00 0.03 H HETATM 1789 H25 Q A 54 -11.132 7.751 -20.307 1.00 0.03 H HETATM 1790 H17 Q A 54 -9.531 9.526 -19.879 1.00 0.05 H HETATM 1791 H18 Q A 54 -10.649 10.763 -20.546 1.00 0.05 H HETATM 1792 H2 Q A 54 -9.264 10.858 -17.871 1.00 0.06 H HETATM 1793 CL1 Q A 54 -9.664 11.418 -15.152 1.00 -0.04 CL HETATM 1794 H1 Q A 54 -12.420 10.660 -14.954 1.00 0.07 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1741 1742 1784 1794 CONECT 1742 1741 1743 1793 CONECT 1743 1742 1744 1792 CONECT 1744 1743 1745 1783 CONECT 1745 1744 1746 1790 1791 CONECT 1746 1745 1747 1788 1789 CONECT 1747 1746 1748 1786 1787 CONECT 1748 1747 1749 1758 1783 CONECT 1749 1748 1750 1781 1782 CONECT 1750 1749 1751 CONECT 1751 1750 1752 1756 CONECT 1752 1751 1753 1780 CONECT 1753 1752 1754 1779 CONECT 1754 1753 1755 1776 CONECT 1755 1754 1756 1775 CONECT 1756 1751 1755 1757 CONECT 1757 1756 1758 1761 CONECT 1758 1748 1757 1759 1760 CONECT 1759 1758 CONECT 1760 1758 CONECT 1761 1757 1762 1773 1774 CONECT 1762 1761 1763 1765 1772 CONECT 1763 1762 1764 1770 1771 CONECT 1764 1763 1765 1768 1769 CONECT 1765 1762 1764 1766 1767 CONECT 1766 1765 CONECT 1767 1765 CONECT 1768 1764 CONECT 1769 1764 CONECT 1770 1763 CONECT 1771 1763 CONECT 1772 1762 CONECT 1773 1761 CONECT 1774 1761 CONECT 1775 1755 CONECT 1776 1754 1777 1778 CONECT 1777 1776 CONECT 1778 1776 CONECT 1779 1753 CONECT 1780 1752 CONECT 1781 1749 CONECT 1782 1749 CONECT 1783 1744 1748 1784 CONECT 1784 1741 1783 1785 CONECT 1785 1784 CONECT 1786 1747 CONECT 1787 1747 CONECT 1788 1746 CONECT 1789 1746 CONECT 1790 1745 CONECT 1791 1745 CONECT 1792 1743 CONECT 1793 1742 CONECT 1794 1741 MASTER 0 0 0 0 0 0 0 0 1793 1 58 12 END
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Structure:
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Protein
Pocket-Ligand
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Related entries of code: 6udy
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3wix
RCSB PDB
PDBbind
161aa, >3WIX_1|Chains... at 90%
3wiy
RCSB PDB
PDBbind
161aa, >3WIY_1|Chains... at 90%
4hw2
RCSB PDB
PDBbind
153aa, >4HW2_1|Chains... at 96%
4hw3
RCSB PDB
PDBbind
153aa, >4HW3_1|Chains... at 96%
4oq6
RCSB PDB
PDBbind
157aa, >4OQ6_1|Chains... at 92%
4wgi
RCSB PDB
PDBbind
518aa, >4WGI_1|Chain... *
4wmu
RCSB PDB
PDBbind
518aa, >4WMU_1|Chain... at 100%
4wmv
RCSB PDB
PDBbind
518aa, >4WMV_1|Chain... at 100%
4wmx
RCSB PDB
PDBbind
518aa, >4WMX_1|Chain... at 100%
4zbf
RCSB PDB
PDBbind
157aa, >4ZBF_1|Chains... at 93%
4zbi
RCSB PDB
PDBbind
157aa, >4ZBI_1|Chains... at 93%
5fdo
RCSB PDB
PDBbind
150aa, >5FDO_1|Chains... at 97%
5fdr
RCSB PDB
PDBbind
158aa, >5FDR_1|Chains... at 92%
5iez
RCSB PDB
PDBbind
159aa, >5IEZ_1|Chains... at 91%
5if4
RCSB PDB
PDBbind
159aa, >5IF4_1|Chains... at 91%
5vkc
RCSB PDB
PDBbind
157aa, >5VKC_1|Chains... at 92%
6b4l
RCSB PDB
PDBbind
157aa, >6B4L_1|Chains... at 92%
6b4u
RCSB PDB
PDBbind
157aa, >6B4U_1|Chain... at 92%
6bw2
RCSB PDB
PDBbind
158aa, >6BW2_1|Chains... at 92%
6bw8
RCSB PDB
PDBbind
158aa, >6BW8_1|Chains... at 92%
6dm8
RCSB PDB
PDBbind
518aa, >6DM8_1|Chains... at 96%
6fs1
RCSB PDB
PDBbind
150aa, >6FS1_1|Chains... at 92%
6qz7
RCSB PDB
PDBbind
518aa, >6QZ7_1|Chain... at 99%
6qyo
RCSB PDB
PDBbind
518aa, >6QYO_1|Chain... at 99%
6qyn
RCSB PDB
PDBbind
518aa, >6QYN_1|Chain... at 99%
6qyl
RCSB PDB
PDBbind
518aa, >6QYL_1|Chain... at 99%
6qyk
RCSB PDB
PDBbind
518aa, >6QYK_1|Chain... at 99%
6qxj
RCSB PDB
PDBbind
518aa, >6QXJ_1|Chain... at 99%
6p3p
RCSB PDB
PDBbind
157aa, >6P3P_1|Chain... at 92%
6oqn
RCSB PDB
PDBbind
157aa, >6OQN_1|Chains... at 92%
6oqd
RCSB PDB
PDBbind
157aa, >6OQD_1|Chain... at 92%
6oqc
RCSB PDB
PDBbind
157aa, >6OQC_1|Chains... at 92%
6oqb
RCSB PDB
PDBbind
157aa, >6OQB_1|Chain... at 92%
6o6g
RCSB PDB
PDBbind
156aa, >6O6G_1|Chain... at 93%
6o6f
RCSB PDB
PDBbind
158aa, >6O6F_1|Chains... at 92%
6ne5
RCSB PDB
PDBbind
159aa, >6NE5_1|Chains... at 91%
6ud2
RCSB PDB
PDBbind
157aa, >6UD2_1|Chain... at 92%
6udi
RCSB PDB
PDBbind
157aa, >6UDI_1|Chain... at 92%
6udt
RCSB PDB
PDBbind
157aa, >6UDT_1|Chain... at 92%
6udu
RCSB PDB
PDBbind
157aa, >6UDU_1|Chain... at 92%
6udv
RCSB PDB
PDBbind
157aa, >6UDV_1|Chain... at 92%
6udx
RCSB PDB
PDBbind
157aa, >6UDX_1|Chains... at 92%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6udy
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human Mcl-1
Ligand Name
Q54
EC.Number
E.C.-.-.-.-
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
IC50=27nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 10258-10271
Ligand Properties
Formula
C
2
4
H
2
6
ClNO
3
Molecular Weight
411.921
Exact Mass
411.160
No. of atoms
55
No. of bonds
59
Polar Surface Area
49.77
LOGP Value
7.01 (
Computed with XLOGP3
)
5.38 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 5
Canonical SMILES
Clc1ccc2c(c1)CCC[C@@]12COc2c(N(C1)CC1CCC1)cc(cc2)C(=O)O
InChI String
InChI=1S/C24H26ClNO3/c25-19-7-8-20-17(11-19)5-2-10-24(20)14-26(13-16-3-1-4-16)21-12-18(23(27)28)6-9-22(21)29-15-24/h6-9,11-12,16H,1-5,10,13-15H2,(H,27,28)/t24-/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):
Q07820
Entrez Gene ID
NCBI Entrez Gene ID:
4170
ASD
Information of known allosteric effects of PDB entries
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