Browse entries in the PDBbind-CN Database
HEADER 6EVQ_COMPLEX COMPND 6EVQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 70 ASP GLU ALA ALA GLU LEU MET GLN GLN VAL LYS VAL LEU SEQRES 2 A 70 LYS LEU THR VAL GLU ASP LEU GLU LYS GLU ARG ASP PHE SEQRES 3 A 70 TYR PHE GLY LYS LEU ARG ASN ILE GLU LEU ILE CYS GLN SEQRES 4 A 70 GLU ASN GLU GLY GLU ASN ASP PRO VAL LEU GLN ARG ILE SEQRES 5 A 70 VAL ASP ILE LEU TYR ALA THR ASP GLU GLY PHE VAL ILE SEQRES 6 A 70 PRO ASP GLU GLY GLY SEQRES 1 B 70 ASP GLU ALA ALA GLU LEU MET GLN GLN VAL LYS VAL LEU SEQRES 2 B 70 LYS LEU THR VAL GLU ASP LEU GLU LYS GLU ARG ASP PHE SEQRES 3 B 70 TYR PHE GLY LYS LEU ARG ASN ILE GLU LEU ILE CYS GLN SEQRES 4 B 70 GLU ASN GLU GLY GLU ASN ASP PRO VAL LEU GLN ARG ILE SEQRES 5 B 70 VAL ASP ILE LEU TYR ALA THR ASP GLU GLY PHE VAL ILE SEQRES 6 B 70 PRO ASP GLU GLY GLY HET C A 5 41 ATOM 1 N ASP A 191 -38.296 0.231 6.687 1.00 1.75 N ATOM 2 CA ASP A 191 -37.160 1.130 6.386 1.00 1.05 C ATOM 3 C ASP A 191 -35.999 0.335 5.801 1.00 0.85 C ATOM 4 O ASP A 191 -34.858 0.462 6.247 1.00 0.82 O ATOM 5 CB ASP A 191 -36.707 1.856 7.658 1.00 1.67 C ATOM 6 CG ASP A 191 -37.807 2.700 8.268 1.00 1.96 C ATOM 7 OD1 ASP A 191 -37.869 3.909 7.976 1.00 2.64 O ATOM 8 OD2 ASP A 191 -38.629 2.153 9.035 1.00 2.29 O ATOM 9 HN3 ASP A 191 -37.995 -0.488 7.375 1.00 0.00 H ATOM 10 HN2 ASP A 191 -38.609 -0.235 5.812 1.00 0.00 H ATOM 11 HN1 ASP A 191 -39.080 0.786 7.085 1.00 0.00 H ATOM 12 N GLU A 192 -36.299 -0.476 4.791 1.00 0.75 N ATOM 13 CA GLU A 192 -35.314 -1.365 4.189 1.00 0.64 C ATOM 14 C GLU A 192 -34.148 -0.575 3.604 1.00 0.51 C ATOM 15 O GLU A 192 -32.997 -0.761 4.004 1.00 0.53 O ATOM 16 CB GLU A 192 -35.969 -2.208 3.094 1.00 0.66 C ATOM 17 CG GLU A 192 -35.049 -3.258 2.489 1.00 0.69 C ATOM 18 CD GLU A 192 -34.688 -4.345 3.477 1.00 1.51 C ATOM 19 OE1 GLU A 192 -35.489 -5.286 3.642 1.00 2.10 O ATOM 20 OE2 GLU A 192 -33.608 -4.263 4.097 1.00 2.33 O ATOM 21 H GLU A 192 -37.270 -0.476 4.418 1.00 0.00 H ATOM 22 N ALA A 193 -34.452 0.318 2.669 1.00 0.42 N ATOM 23 CA ALA A 193 -33.419 1.071 1.980 1.00 0.34 C ATOM 24 C ALA A 193 -32.682 2.002 2.926 1.00 0.44 C ATOM 25 O ALA A 193 -31.500 2.263 2.735 1.00 0.43 O ATOM 26 CB ALA A 193 -34.008 1.862 0.828 1.00 0.33 C ATOM 27 H ALA A 193 -35.450 0.481 2.425 1.00 0.00 H ATOM 28 N ALA A 194 -33.376 2.486 3.950 1.00 0.56 N ATOM 29 CA ALA A 194 -32.793 3.424 4.898 1.00 0.68 C ATOM 30 C ALA A 194 -31.538 2.850 5.551 1.00 0.69 C ATOM 31 O ALA A 194 -30.540 3.553 5.729 1.00 0.74 O ATOM 32 CB ALA A 194 -33.815 3.797 5.950 1.00 0.80 C ATOM 33 H ALA A 194 -34.364 2.186 4.078 1.00 0.00 H ATOM 34 N GLU A 195 -31.584 1.566 5.890 1.00 0.69 N ATOM 35 CA GLU A 195 -30.434 0.894 6.475 1.00 0.73 C ATOM 36 C GLU A 195 -29.325 0.745 5.438 1.00 0.63 C ATOM 37 O GLU A 195 -28.141 0.863 5.754 1.00 0.68 O ATOM 38 CB GLU A 195 -30.834 -0.476 7.021 1.00 0.80 C ATOM 39 CG GLU A 195 -31.930 -0.415 8.071 1.00 1.19 C ATOM 40 CD GLU A 195 -32.224 -1.766 8.687 1.00 2.09 C ATOM 41 OE1 GLU A 195 -31.737 -2.032 9.805 1.00 2.84 O ATOM 42 OE2 GLU A 195 -32.938 -2.571 8.059 1.00 2.58 O ATOM 43 H GLU A 195 -32.461 1.030 5.734 1.00 0.00 H ATOM 44 N LEU A 196 -29.724 0.505 4.194 1.00 0.49 N ATOM 45 CA LEU A 196 -28.778 0.387 3.093 1.00 0.39 C ATOM 46 C LEU A 196 -28.119 1.730 2.787 1.00 0.40 C ATOM 47 O LEU A 196 -26.975 1.779 2.332 1.00 0.38 O ATOM 48 CB LEU A 196 -29.474 -0.160 1.845 1.00 0.30 C ATOM 49 CG LEU A 196 -29.714 -1.672 1.848 1.00 0.35 C ATOM 50 CD1 LEU A 196 -31.177 -1.992 1.618 1.00 0.37 C ATOM 51 CD2 LEU A 196 -28.856 -2.336 0.785 1.00 0.34 C ATOM 52 H LEU A 196 -30.740 0.398 4.001 1.00 0.00 H ATOM 53 N MET A 197 -28.844 2.818 3.046 1.00 0.47 N ATOM 54 CA MET A 197 -28.298 4.164 2.878 1.00 0.56 C ATOM 55 C MET A 197 -27.102 4.345 3.800 1.00 0.63 C ATOM 56 O MET A 197 -26.093 4.945 3.428 1.00 0.66 O ATOM 57 CB MET A 197 -29.345 5.235 3.209 1.00 0.66 C ATOM 58 CG MET A 197 -30.663 5.083 2.469 1.00 0.61 C ATOM 59 SD MET A 197 -30.540 5.372 0.699 1.00 0.59 S ATOM 60 CE MET A 197 -32.250 5.119 0.230 1.00 0.57 C ATOM 61 H MET A 197 -29.824 2.707 3.376 1.00 0.00 H ATOM 62 N GLN A 198 -27.227 3.817 5.011 1.00 0.68 N ATOM 63 CA GLN A 198 -26.139 3.848 5.972 1.00 0.76 C ATOM 64 C GLN A 198 -24.991 2.978 5.481 1.00 0.64 C ATOM 65 O GLN A 198 -23.821 3.347 5.597 1.00 0.63 O ATOM 66 CB GLN A 198 -26.613 3.345 7.337 1.00 0.93 C ATOM 67 CG GLN A 198 -25.537 3.395 8.410 1.00 1.05 C ATOM 68 CD GLN A 198 -25.904 2.596 9.643 1.00 1.65 C ATOM 69 OE1 GLN A 198 -26.535 3.107 10.567 1.00 2.14 O ATOM 70 NE2 GLN A 198 -25.510 1.334 9.667 1.00 2.19 N ATOM 71 HE22 GLN A 198 -24.978 0.940 8.865 1.00 0.00 H ATOM 72 HE21 GLN A 198 -25.732 0.735 10.488 1.00 0.00 H ATOM 73 H GLN A 198 -28.127 3.370 5.279 1.00 0.00 H ATOM 74 N GLN A 199 -25.343 1.832 4.910 1.00 0.58 N ATOM 75 CA GLN A 199 -24.355 0.866 4.460 1.00 0.52 C ATOM 76 C GLN A 199 -23.493 1.424 3.338 1.00 0.42 C ATOM 77 O GLN A 199 -22.274 1.318 3.397 1.00 0.43 O ATOM 78 CB GLN A 199 -25.017 -0.438 4.014 1.00 0.52 C ATOM 79 CG GLN A 199 -25.706 -1.190 5.140 1.00 0.67 C ATOM 80 CD GLN A 199 -24.849 -1.281 6.390 1.00 1.33 C ATOM 81 OE1 GLN A 199 -24.933 -0.428 7.277 1.00 2.06 O ATOM 82 NE2 GLN A 199 -24.017 -2.305 6.466 1.00 2.02 N ATOM 83 HE22 GLN A 199 -23.978 -3.002 5.695 1.00 0.00 H ATOM 84 HE21 GLN A 199 -23.401 -2.414 7.297 1.00 0.00 H ATOM 85 H GLN A 199 -26.353 1.620 4.781 1.00 0.00 H ATOM 86 N VAL A 200 -24.107 2.029 2.322 1.00 0.37 N ATOM 87 CA VAL A 200 -23.325 2.602 1.231 1.00 0.33 C ATOM 88 C VAL A 200 -22.421 3.710 1.746 1.00 0.39 C ATOM 89 O VAL A 200 -21.333 3.921 1.225 1.00 0.38 O ATOM 90 CB VAL A 200 -24.178 3.150 0.067 1.00 0.34 C ATOM 91 CG1 VAL A 200 -24.958 2.038 -0.593 1.00 0.28 C ATOM 92 CG2 VAL A 200 -25.098 4.261 0.523 1.00 0.44 C ATOM 93 H VAL A 200 -25.145 2.093 2.306 1.00 0.00 H ATOM 94 N LYS A 201 -22.869 4.399 2.787 1.00 0.49 N ATOM 95 CA LYS A 201 -22.098 5.480 3.371 1.00 0.58 C ATOM 96 C LYS A 201 -20.864 4.932 4.083 1.00 0.59 C ATOM 97 O LYS A 201 -19.743 5.338 3.787 1.00 0.61 O ATOM 98 CB LYS A 201 -22.963 6.298 4.332 1.00 0.67 C ATOM 99 CG LYS A 201 -22.235 7.472 4.962 1.00 1.05 C ATOM 100 CD LYS A 201 -23.172 8.307 5.817 1.00 1.38 C ATOM 101 CE LYS A 201 -23.704 7.528 7.011 1.00 1.69 C ATOM 102 NZ LYS A 201 -24.556 8.374 7.886 1.00 2.28 N ATOM 103 HZ1 LYS A 201 -23.997 9.176 8.241 1.00 0.00 H ATOM 104 HZ2 LYS A 201 -25.366 8.729 7.340 1.00 0.00 H ATOM 105 HZ3 LYS A 201 -24.899 7.807 8.687 1.00 0.00 H ATOM 106 H LYS A 201 -23.795 4.158 3.194 1.00 0.00 H ATOM 107 N VAL A 202 -21.063 3.994 5.001 1.00 0.61 N ATOM 108 CA VAL A 202 -19.945 3.415 5.739 1.00 0.66 C ATOM 109 C VAL A 202 -19.023 2.628 4.805 1.00 0.57 C ATOM 110 O VAL A 202 -17.809 2.565 5.014 1.00 0.61 O ATOM 111 CB VAL A 202 -20.423 2.507 6.899 1.00 0.73 C ATOM 112 CG1 VAL A 202 -21.356 3.271 7.816 1.00 0.81 C ATOM 113 CG2 VAL A 202 -21.100 1.247 6.386 1.00 0.68 C ATOM 114 H VAL A 202 -22.030 3.667 5.197 1.00 0.00 H ATOM 115 N LEU A 203 -19.607 2.049 3.763 1.00 0.47 N ATOM 116 CA LEU A 203 -18.853 1.296 2.772 1.00 0.40 C ATOM 117 C LEU A 203 -17.999 2.229 1.920 1.00 0.36 C ATOM 118 O LEU A 203 -16.798 2.010 1.766 1.00 0.35 O ATOM 119 CB LEU A 203 -19.816 0.495 1.885 1.00 0.36 C ATOM 120 CG LEU A 203 -19.739 -1.034 1.993 1.00 0.27 C ATOM 121 CD1 LEU A 203 -19.594 -1.479 3.435 1.00 0.43 C ATOM 122 CD2 LEU A 203 -20.985 -1.666 1.382 1.00 0.28 C ATOM 123 H LEU A 203 -20.637 2.136 3.651 1.00 0.00 H ATOM 124 N LYS A 204 -18.616 3.285 1.389 1.00 0.40 N ATOM 125 CA LYS A 204 -17.913 4.219 0.512 1.00 0.44 C ATOM 126 C LYS A 204 -16.801 4.946 1.263 1.00 0.51 C ATOM 127 O LYS A 204 -15.751 5.226 0.700 1.00 0.52 O ATOM 128 CB LYS A 204 -18.875 5.245 -0.098 1.00 0.51 C ATOM 129 CG LYS A 204 -19.377 6.284 0.897 1.00 0.62 C ATOM 130 CD LYS A 204 -20.328 7.284 0.254 1.00 0.70 C ATOM 131 CE LYS A 204 -19.686 8.019 -0.913 1.00 0.83 C ATOM 132 NZ LYS A 204 -18.574 8.912 -0.482 1.00 1.57 N ATOM 133 HZ1 LYS A 204 -18.940 9.623 0.183 1.00 0.00 H ATOM 134 HZ2 LYS A 204 -17.837 8.346 -0.015 1.00 0.00 H ATOM 135 HZ3 LYS A 204 -18.171 9.389 -1.314 1.00 0.00 H ATOM 136 H LYS A 204 -19.620 3.448 1.604 1.00 0.00 H ATOM 137 N LEU A 205 -17.039 5.246 2.536 1.00 0.57 N ATOM 138 CA LEU A 205 -16.049 5.936 3.348 1.00 0.65 C ATOM 139 C LEU A 205 -14.841 5.044 3.581 1.00 0.59 C ATOM 140 O LEU A 205 -13.701 5.500 3.521 1.00 0.65 O ATOM 141 CB LEU A 205 -16.662 6.375 4.675 1.00 0.77 C ATOM 142 CG LEU A 205 -17.755 7.437 4.550 1.00 0.85 C ATOM 143 CD1 LEU A 205 -18.415 7.681 5.898 1.00 0.96 C ATOM 144 CD2 LEU A 205 -17.176 8.732 4.003 1.00 0.93 C ATOM 145 H LEU A 205 -17.951 4.982 2.960 1.00 0.00 H ATOM 146 N THR A 206 -15.099 3.765 3.821 1.00 0.50 N ATOM 147 CA THR A 206 -14.027 2.791 3.926 1.00 0.44 C ATOM 148 C THR A 206 -13.286 2.706 2.596 1.00 0.34 C ATOM 149 O THR A 206 -12.060 2.618 2.559 1.00 0.32 O ATOM 150 CB THR A 206 -14.564 1.400 4.315 1.00 0.42 C ATOM 151 OG1 THR A 206 -15.401 1.506 5.478 1.00 0.54 O ATOM 152 CG2 THR A 206 -13.418 0.437 4.596 1.00 0.44 C ATOM 153 HG1 THR A 206 -16.163 2.107 5.281 1.00 0.00 H ATOM 154 H THR A 206 -16.085 3.455 3.936 1.00 0.00 H ATOM 155 N VAL A 207 -14.048 2.759 1.506 1.00 0.31 N ATOM 156 CA VAL A 207 -13.483 2.805 0.167 1.00 0.29 C ATOM 157 C VAL A 207 -12.549 4.001 0.013 1.00 0.37 C ATOM 158 O VAL A 207 -11.397 3.841 -0.360 1.00 0.35 O ATOM 159 CB VAL A 207 -14.593 2.883 -0.910 1.00 0.32 C ATOM 160 CG1 VAL A 207 -14.023 3.286 -2.259 1.00 0.40 C ATOM 161 CG2 VAL A 207 -15.325 1.559 -1.026 1.00 0.24 C ATOM 162 H VAL A 207 -15.082 2.768 1.616 1.00 0.00 H ATOM 163 N GLU A 208 -13.051 5.189 0.329 1.00 0.47 N ATOM 164 CA GLU A 208 -12.297 6.425 0.143 1.00 0.55 C ATOM 165 C GLU A 208 -10.999 6.433 0.953 1.00 0.54 C ATOM 166 O GLU A 208 -9.951 6.853 0.453 1.00 0.58 O ATOM 167 CB GLU A 208 -13.169 7.628 0.505 1.00 0.66 C ATOM 168 CG GLU A 208 -14.376 7.781 -0.407 1.00 1.38 C ATOM 169 CD GLU A 208 -15.195 9.016 -0.102 1.00 1.66 C ATOM 170 OE1 GLU A 208 -16.127 8.929 0.726 1.00 2.24 O ATOM 171 OE2 GLU A 208 -14.910 10.081 -0.691 1.00 2.05 O ATOM 172 H GLU A 208 -14.013 5.241 0.722 1.00 0.00 H ATOM 173 N ASP A 209 -11.061 5.960 2.194 1.00 0.52 N ATOM 174 CA ASP A 209 -9.872 5.903 3.043 1.00 0.54 C ATOM 175 C ASP A 209 -8.913 4.813 2.575 1.00 0.48 C ATOM 176 O ASP A 209 -7.705 4.907 2.775 1.00 0.62 O ATOM 177 CB ASP A 209 -10.242 5.678 4.513 1.00 0.60 C ATOM 178 CG ASP A 209 -10.783 6.928 5.180 1.00 1.18 C ATOM 179 OD1 ASP A 209 -9.985 7.844 5.478 1.00 1.80 O ATOM 180 OD2 ASP A 209 -12.003 6.996 5.428 1.00 1.92 O ATOM 181 H ASP A 209 -11.972 5.624 2.568 1.00 0.00 H ATOM 182 N LEU A 210 -9.453 3.782 1.949 1.00 0.31 N ATOM 183 CA LEU A 210 -8.636 2.702 1.414 1.00 0.23 C ATOM 184 C LEU A 210 -8.029 3.088 0.067 1.00 0.23 C ATOM 185 O LEU A 210 -6.880 2.746 -0.224 1.00 0.25 O ATOM 186 CB LEU A 210 -9.469 1.427 1.282 1.00 0.18 C ATOM 187 CG LEU A 210 -9.281 0.390 2.397 1.00 0.19 C ATOM 188 CD1 LEU A 210 -9.220 1.048 3.762 1.00 0.24 C ATOM 189 CD2 LEU A 210 -10.413 -0.623 2.374 1.00 0.25 C ATOM 190 H LEU A 210 -10.486 3.741 1.836 1.00 0.00 H ATOM 191 N GLU A 211 -8.802 3.806 -0.746 1.00 0.28 N ATOM 192 CA GLU A 211 -8.325 4.296 -2.037 1.00 0.33 C ATOM 193 C GLU A 211 -7.096 5.165 -1.850 1.00 0.35 C ATOM 194 O GLU A 211 -6.084 4.982 -2.531 1.00 0.38 O ATOM 195 CB GLU A 211 -9.402 5.110 -2.761 1.00 0.42 C ATOM 196 CG GLU A 211 -10.563 4.287 -3.291 1.00 0.43 C ATOM 197 CD GLU A 211 -11.442 5.080 -4.234 1.00 1.26 C ATOM 198 OE1 GLU A 211 -12.320 5.829 -3.758 1.00 1.93 O ATOM 199 OE2 GLU A 211 -11.256 4.959 -5.464 1.00 2.05 O ATOM 200 H GLU A 211 -9.776 4.025 -0.453 1.00 0.00 H ATOM 201 N LYS A 212 -7.188 6.103 -0.910 1.00 0.39 N ATOM 202 CA LYS A 212 -6.094 7.020 -0.650 1.00 0.43 C ATOM 203 C LYS A 212 -4.844 6.247 -0.244 1.00 0.30 C ATOM 204 O LYS A 212 -3.765 6.515 -0.754 1.00 0.28 O ATOM 205 CB LYS A 212 -6.472 8.052 0.427 1.00 0.58 C ATOM 206 CG LYS A 212 -6.581 7.479 1.829 1.00 0.70 C ATOM 207 CD LYS A 212 -7.019 8.520 2.842 1.00 0.81 C ATOM 208 CE LYS A 212 -6.940 7.969 4.259 1.00 1.02 C ATOM 209 NZ LYS A 212 -7.513 8.906 5.261 1.00 1.61 N ATOM 210 HZ1 LYS A 212 -6.989 9.804 5.234 1.00 0.00 H ATOM 211 HZ2 LYS A 212 -8.514 9.081 5.038 1.00 0.00 H ATOM 212 HZ3 LYS A 212 -7.436 8.487 6.210 1.00 0.00 H ATOM 213 H LYS A 212 -8.061 6.180 -0.351 1.00 0.00 H ATOM 214 N GLU A 213 -5.007 5.256 0.638 1.00 0.29 N ATOM 215 CA GLU A 213 -3.878 4.477 1.137 1.00 0.28 C ATOM 216 C GLU A 213 -3.262 3.621 0.036 1.00 0.19 C ATOM 217 O GLU A 213 -2.039 3.554 -0.085 1.00 0.22 O ATOM 218 CB GLU A 213 -4.297 3.591 2.316 1.00 0.42 C ATOM 219 CG GLU A 213 -4.584 4.367 3.592 1.00 0.59 C ATOM 220 CD GLU A 213 -4.877 3.463 4.773 1.00 0.94 C ATOM 221 OE1 GLU A 213 -3.920 2.901 5.350 1.00 1.48 O ATOM 222 OE2 GLU A 213 -6.061 3.321 5.143 1.00 1.79 O ATOM 223 H GLU A 213 -5.964 5.034 0.978 1.00 0.00 H ATOM 224 N ARG A 214 -4.106 2.983 -0.773 1.00 0.19 N ATOM 225 CA ARG A 214 -3.630 2.104 -1.839 1.00 0.21 C ATOM 226 C ARG A 214 -2.614 2.840 -2.711 1.00 0.21 C ATOM 227 O ARG A 214 -1.494 2.373 -2.894 1.00 0.31 O ATOM 228 CB ARG A 214 -4.800 1.606 -2.704 1.00 0.30 C ATOM 229 CG ARG A 214 -4.600 0.209 -3.293 1.00 0.52 C ATOM 230 CD ARG A 214 -3.370 0.110 -4.183 1.00 0.70 C ATOM 231 NE ARG A 214 -3.435 1.003 -5.342 1.00 1.03 N ATOM 232 CZ ARG A 214 -3.422 0.585 -6.606 1.00 1.43 C ATOM 233 NH1 ARG A 214 -3.481 -0.714 -6.887 1.00 1.51 N ATOM 234 NH2 ARG A 214 -3.382 1.472 -7.592 1.00 1.81 N ATOM 235 HE ARG A 214 -3.495 2.026 -5.167 1.00 0.00 H ATOM 236 HH12 ARG A 214 -3.470 -1.033 -7.877 1.00 0.00 H ATOM 237 HH11 ARG A 214 -3.538 -1.411 -6.117 1.00 0.00 H ATOM 238 HH22 ARG A 214 -3.372 1.150 -8.581 1.00 0.00 H ATOM 239 HH21 ARG A 214 -3.361 2.489 -7.376 1.00 0.00 H ATOM 240 H ARG A 214 -5.130 3.114 -0.643 1.00 0.00 H ATOM 241 N ASP A 215 -3.002 4.004 -3.220 1.00 0.20 N ATOM 242 CA ASP A 215 -2.147 4.752 -4.140 1.00 0.23 C ATOM 243 C ASP A 215 -1.112 5.596 -3.399 1.00 0.19 C ATOM 244 O ASP A 215 -0.064 5.927 -3.958 1.00 0.22 O ATOM 245 CB ASP A 215 -2.986 5.632 -5.067 1.00 0.33 C ATOM 246 CG ASP A 215 -3.792 4.813 -6.056 1.00 1.24 C ATOM 247 OD1 ASP A 215 -5.035 4.907 -6.043 1.00 1.97 O ATOM 248 OD2 ASP A 215 -3.186 4.054 -6.842 1.00 2.06 O ATOM 249 H ASP A 215 -3.932 4.390 -2.959 1.00 0.00 H ATOM 250 N PHE A 216 -1.402 5.932 -2.144 1.00 0.19 N ATOM 251 CA PHE A 216 -0.471 6.688 -1.304 1.00 0.21 C ATOM 252 C PHE A 216 0.840 5.923 -1.174 1.00 0.18 C ATOM 253 O PHE A 216 1.930 6.448 -1.428 1.00 0.23 O ATOM 254 CB PHE A 216 -1.092 6.908 0.090 1.00 0.26 C ATOM 255 CG PHE A 216 -0.357 7.871 1.003 1.00 0.33 C ATOM 256 CD1 PHE A 216 -0.822 9.170 1.190 1.00 1.28 C ATOM 257 CD2 PHE A 216 0.787 7.474 1.693 1.00 1.24 C ATOM 258 CE1 PHE A 216 -0.163 10.045 2.039 1.00 1.33 C ATOM 259 CE2 PHE A 216 1.446 8.350 2.538 1.00 1.27 C ATOM 260 CZ PHE A 216 0.967 9.633 2.709 1.00 0.58 C ATOM 261 H PHE A 216 -2.320 5.648 -1.747 1.00 0.00 H ATOM 262 N TYR A 217 0.726 4.664 -0.792 1.00 0.15 N ATOM 263 CA TYR A 217 1.893 3.826 -0.636 1.00 0.15 C ATOM 264 C TYR A 217 2.357 3.299 -1.984 1.00 0.15 C ATOM 265 O TYR A 217 3.533 3.017 -2.160 1.00 0.17 O ATOM 266 CB TYR A 217 1.608 2.666 0.320 1.00 0.16 C ATOM 267 CG TYR A 217 1.245 3.107 1.721 1.00 0.16 C ATOM 268 CD1 TYR A 217 -0.083 3.276 2.090 1.00 0.96 C ATOM 269 CD2 TYR A 217 2.230 3.351 2.675 1.00 0.98 C ATOM 270 CE1 TYR A 217 -0.427 3.674 3.368 1.00 0.98 C ATOM 271 CE2 TYR A 217 1.897 3.748 3.957 1.00 0.98 C ATOM 272 CZ TYR A 217 0.566 3.908 4.297 1.00 0.22 C ATOM 273 OH TYR A 217 0.227 4.304 5.570 1.00 0.26 O ATOM 274 HH TYR A 217 -0.758 4.369 5.643 1.00 0.00 H ATOM 275 H TYR A 217 -0.217 4.270 -0.601 1.00 0.00 H ATOM 276 N PHE A 218 1.437 3.197 -2.939 1.00 0.14 N ATOM 277 CA PHE A 218 1.764 2.666 -4.262 1.00 0.15 C ATOM 278 C PHE A 218 2.840 3.511 -4.930 1.00 0.15 C ATOM 279 O PHE A 218 3.803 2.980 -5.490 1.00 0.18 O ATOM 280 CB PHE A 218 0.519 2.601 -5.152 1.00 0.17 C ATOM 281 CG PHE A 218 0.511 1.406 -6.056 1.00 0.16 C ATOM 282 CD1 PHE A 218 0.762 1.524 -7.414 1.00 1.16 C ATOM 283 CD2 PHE A 218 0.272 0.155 -5.528 1.00 1.20 C ATOM 284 CE1 PHE A 218 0.777 0.401 -8.228 1.00 1.16 C ATOM 285 CE2 PHE A 218 0.279 -0.971 -6.333 1.00 1.23 C ATOM 286 CZ PHE A 218 0.536 -0.848 -7.684 1.00 0.25 C ATOM 287 H PHE A 218 0.463 3.502 -2.740 1.00 0.00 H ATOM 288 N GLY A 219 2.681 4.826 -4.851 1.00 0.13 N ATOM 289 CA GLY A 219 3.694 5.723 -5.366 1.00 0.15 C ATOM 290 C GLY A 219 4.987 5.598 -4.589 1.00 0.15 C ATOM 291 O GLY A 219 6.075 5.830 -5.122 1.00 0.19 O ATOM 292 H GLY A 219 1.821 5.216 -4.415 1.00 0.00 H ATOM 293 N LYS A 220 4.868 5.214 -3.321 1.00 0.13 N ATOM 294 CA LYS A 220 6.032 5.018 -2.474 1.00 0.14 C ATOM 295 C LYS A 220 6.903 3.864 -2.968 1.00 0.12 C ATOM 296 O LYS A 220 8.117 4.019 -3.048 1.00 0.13 O ATOM 297 CB LYS A 220 5.627 4.780 -1.015 1.00 0.18 C ATOM 298 CG LYS A 220 4.911 5.958 -0.374 1.00 0.46 C ATOM 299 CD LYS A 220 5.783 7.202 -0.354 1.00 0.63 C ATOM 300 CE LYS A 220 5.055 8.394 0.240 1.00 0.70 C ATOM 301 NZ LYS A 220 3.901 8.825 -0.603 1.00 1.19 N ATOM 302 HZ1 LYS A 220 4.244 9.092 -1.548 1.00 0.00 H ATOM 303 HZ2 LYS A 220 3.223 8.041 -0.688 1.00 0.00 H ATOM 304 HZ3 LYS A 220 3.434 9.641 -0.159 1.00 0.00 H ATOM 305 H LYS A 220 3.920 5.050 -2.927 1.00 0.00 H ATOM 306 N LEU A 221 6.296 2.716 -3.318 1.00 0.11 N ATOM 307 CA LEU A 221 7.081 1.557 -3.779 1.00 0.11 C ATOM 308 C LEU A 221 7.901 1.926 -5.002 1.00 0.11 C ATOM 309 O LEU A 221 9.029 1.469 -5.167 1.00 0.10 O ATOM 310 CB LEU A 221 6.222 0.321 -4.104 1.00 0.11 C ATOM 311 CG LEU A 221 5.491 -0.317 -2.925 1.00 0.11 C ATOM 312 CD1 LEU A 221 6.302 -0.183 -1.645 1.00 0.13 C ATOM 313 CD2 LEU A 221 4.119 0.298 -2.774 1.00 0.11 C ATOM 314 H LEU A 221 5.260 2.645 -3.263 1.00 0.00 H ATOM 315 N ARG A 222 7.333 2.768 -5.850 1.00 0.14 N ATOM 316 CA ARG A 222 8.040 3.259 -7.020 1.00 0.14 C ATOM 317 C ARG A 222 9.244 4.083 -6.602 1.00 0.14 C ATOM 318 O ARG A 222 10.306 3.978 -7.195 1.00 0.16 O ATOM 319 CB ARG A 222 7.107 4.085 -7.895 1.00 0.18 C ATOM 320 CG ARG A 222 6.029 3.251 -8.551 1.00 0.21 C ATOM 321 CD ARG A 222 6.551 2.506 -9.763 1.00 0.27 C ATOM 322 NE ARG A 222 6.648 3.381 -10.930 1.00 0.42 N ATOM 323 CZ ARG A 222 7.329 3.087 -12.037 1.00 0.60 C ATOM 324 NH1 ARG A 222 8.056 1.981 -12.106 1.00 0.67 N ATOM 325 NH2 ARG A 222 7.309 3.922 -13.066 1.00 0.78 N ATOM 326 HE ARG A 222 6.152 4.294 -10.894 1.00 0.00 H ATOM 327 HH12 ARG A 222 8.584 1.759 -12.974 1.00 0.00 H ATOM 328 HH11 ARG A 222 8.098 1.335 -11.292 1.00 0.00 H ATOM 329 HH22 ARG A 222 7.840 3.694 -13.931 1.00 0.00 H ATOM 330 HH21 ARG A 222 6.762 4.805 -13.009 1.00 0.00 H ATOM 331 H ARG A 222 6.358 3.085 -5.675 1.00 0.00 H ATOM 332 N ASN A 223 9.087 4.876 -5.553 1.00 0.15 N ATOM 333 CA ASN A 223 10.182 5.699 -5.059 1.00 0.18 C ATOM 334 C ASN A 223 11.315 4.813 -4.534 1.00 0.15 C ATOM 335 O ASN A 223 12.489 5.117 -4.737 1.00 0.18 O ATOM 336 CB ASN A 223 9.692 6.651 -3.962 1.00 0.25 C ATOM 337 CG ASN A 223 10.688 7.753 -3.641 1.00 0.85 C ATOM 338 OD1 ASN A 223 10.780 8.205 -2.501 1.00 1.68 O ATOM 339 ND2 ASN A 223 11.421 8.212 -4.640 1.00 1.58 N ATOM 340 HD22 ASN A 223 11.316 7.805 -5.591 1.00 0.00 H ATOM 341 HD21 ASN A 223 12.103 8.980 -4.475 1.00 0.00 H ATOM 342 H ASN A 223 8.165 4.912 -5.073 1.00 0.00 H ATOM 343 N ILE A 224 10.959 3.704 -3.881 1.00 0.12 N ATOM 344 CA ILE A 224 11.965 2.747 -3.412 1.00 0.11 C ATOM 345 C ILE A 224 12.598 2.034 -4.615 1.00 0.10 C ATOM 346 O ILE A 224 13.793 1.732 -4.616 1.00 0.14 O ATOM 347 CB ILE A 224 11.395 1.706 -2.379 1.00 0.10 C ATOM 348 CG1 ILE A 224 11.491 0.274 -2.898 1.00 0.23 C ATOM 349 CG2 ILE A 224 9.957 2.013 -2.000 1.00 0.15 C ATOM 350 CD1 ILE A 224 11.021 -0.764 -1.898 1.00 0.15 C ATOM 351 H ILE A 224 9.952 3.516 -3.702 1.00 0.00 H ATOM 352 N GLU A 225 11.789 1.804 -5.650 1.00 0.09 N ATOM 353 CA GLU A 225 12.260 1.178 -6.883 1.00 0.13 C ATOM 354 C GLU A 225 13.199 2.119 -7.640 1.00 0.12 C ATOM 355 O GLU A 225 14.144 1.679 -8.296 1.00 0.13 O ATOM 356 CB GLU A 225 11.068 0.794 -7.768 1.00 0.21 C ATOM 357 CG GLU A 225 11.459 0.099 -9.064 1.00 0.38 C ATOM 358 CD GLU A 225 10.259 -0.314 -9.894 1.00 0.76 C ATOM 359 OE1 GLU A 225 9.498 0.574 -10.330 1.00 1.56 O ATOM 360 OE2 GLU A 225 10.086 -1.525 -10.136 1.00 1.50 O ATOM 361 H GLU A 225 10.789 2.080 -5.577 1.00 0.00 H ATOM 362 N LEU A 226 12.936 3.414 -7.541 1.00 0.12 N ATOM 363 CA LEU A 226 13.781 4.420 -8.169 1.00 0.13 C ATOM 364 C LEU A 226 15.181 4.412 -7.556 1.00 0.13 C ATOM 365 O LEU A 226 16.173 4.586 -8.266 1.00 0.19 O ATOM 366 CB LEU A 226 13.139 5.807 -8.056 1.00 0.16 C ATOM 367 CG LEU A 226 12.304 6.253 -9.270 1.00 0.18 C ATOM 368 CD1 LEU A 226 11.307 5.181 -9.694 1.00 0.17 C ATOM 369 CD2 LEU A 226 11.570 7.544 -8.955 1.00 0.22 C ATOM 370 H LEU A 226 12.103 3.720 -7.000 1.00 0.00 H ATOM 371 N ILE A 227 15.262 4.178 -6.244 1.00 0.09 N ATOM 372 CA ILE A 227 16.550 4.034 -5.569 1.00 0.09 C ATOM 373 C ILE A 227 17.259 2.794 -6.100 1.00 0.11 C ATOM 374 O ILE A 227 18.485 2.757 -6.222 1.00 0.15 O ATOM 375 CB ILE A 227 16.386 3.907 -4.032 1.00 0.09 C ATOM 376 CG1 ILE A 227 15.607 5.100 -3.472 1.00 0.12 C ATOM 377 CG2 ILE A 227 17.746 3.800 -3.343 1.00 0.09 C ATOM 378 CD1 ILE A 227 15.335 5.002 -1.987 1.00 0.16 C ATOM 379 H ILE A 227 14.387 4.096 -5.689 1.00 0.00 H ATOM 380 N CYS A 228 16.465 1.785 -6.434 1.00 0.10 N ATOM 381 CA CYS A 228 16.987 0.551 -6.991 1.00 0.13 C ATOM 382 C CYS A 228 17.613 0.809 -8.352 1.00 0.15 C ATOM 383 O CYS A 228 18.756 0.438 -8.591 1.00 0.17 O ATOM 384 CB CYS A 228 15.877 -0.494 -7.096 1.00 0.15 C ATOM 385 SG CYS A 228 15.027 -0.818 -5.532 1.00 0.16 S ATOM 386 H CYS A 228 15.439 1.881 -6.293 1.00 0.00 H ATOM 387 N GLN A 229 16.876 1.490 -9.221 1.00 0.17 N ATOM 388 CA GLN A 229 17.361 1.816 -10.560 1.00 0.23 C ATOM 389 C GLN A 229 18.685 2.576 -10.495 1.00 0.28 C ATOM 390 O GLN A 229 19.508 2.493 -11.407 1.00 0.46 O ATOM 391 CB GLN A 229 16.323 2.651 -11.308 1.00 0.26 C ATOM 392 CG GLN A 229 14.990 1.944 -11.481 1.00 0.31 C ATOM 393 CD GLN A 229 13.956 2.813 -12.166 1.00 1.13 C ATOM 394 OE1 GLN A 229 13.966 4.036 -12.031 1.00 2.11 O ATOM 395 NE2 GLN A 229 13.055 2.187 -12.904 1.00 1.66 N ATOM 396 HE22 GLN A 229 13.083 1.151 -12.991 1.00 0.00 H ATOM 397 HE21 GLN A 229 12.318 2.731 -13.397 1.00 0.00 H ATOM 398 H GLN A 229 15.924 1.801 -8.940 1.00 0.00 H ATOM 399 N GLU A 230 18.883 3.306 -9.407 1.00 0.23 N ATOM 400 CA GLU A 230 20.103 4.069 -9.204 1.00 0.30 C ATOM 401 C GLU A 230 21.270 3.178 -8.779 1.00 0.19 C ATOM 402 O GLU A 230 22.389 3.334 -9.268 1.00 0.23 O ATOM 403 CB GLU A 230 19.883 5.144 -8.139 1.00 0.48 C ATOM 404 CG GLU A 230 18.928 6.246 -8.559 1.00 0.82 C ATOM 405 CD GLU A 230 18.739 7.286 -7.475 1.00 1.02 C ATOM 406 OE1 GLU A 230 19.750 7.835 -6.988 1.00 1.70 O ATOM 407 OE2 GLU A 230 17.581 7.574 -7.110 1.00 1.54 O ATOM 408 H GLU A 230 18.143 3.334 -8.677 1.00 0.00 H ATOM 409 N ASN A 231 21.015 2.240 -7.877 1.00 0.22 N ATOM 410 CA ASN A 231 22.105 1.523 -7.219 1.00 0.20 C ATOM 411 C ASN A 231 22.285 0.090 -7.714 1.00 0.21 C ATOM 412 O ASN A 231 23.370 -0.473 -7.557 1.00 0.24 O ATOM 413 CB ASN A 231 21.904 1.513 -5.702 1.00 0.23 C ATOM 414 CG ASN A 231 21.965 2.900 -5.091 1.00 0.23 C ATOM 415 OD1 ASN A 231 22.605 3.800 -5.630 1.00 0.26 O ATOM 416 ND2 ASN A 231 21.321 3.069 -3.946 1.00 0.21 N ATOM 417 HD22 ASN A 231 20.791 2.279 -3.526 1.00 0.00 H ATOM 418 HD21 ASN A 231 21.345 3.992 -3.467 1.00 0.00 H ATOM 419 H ASN A 231 20.029 2.012 -7.635 1.00 0.00 H ATOM 420 N GLU A 232 21.245 -0.502 -8.297 1.00 0.23 N ATOM 421 CA GLU A 232 21.304 -1.901 -8.730 1.00 0.26 C ATOM 422 C GLU A 232 22.454 -2.141 -9.699 1.00 0.28 C ATOM 423 O GLU A 232 22.503 -1.559 -10.782 1.00 0.35 O ATOM 424 CB GLU A 232 19.994 -2.346 -9.383 1.00 0.36 C ATOM 425 CG GLU A 232 18.871 -2.624 -8.397 1.00 0.50 C ATOM 426 CD GLU A 232 17.672 -3.265 -9.064 1.00 1.42 C ATOM 427 OE1 GLU A 232 17.571 -4.509 -9.039 1.00 2.13 O ATOM 428 OE2 GLU A 232 16.836 -2.532 -9.631 1.00 2.19 O ATOM 429 H GLU A 232 20.371 0.040 -8.449 1.00 0.00 H ATOM 430 N GLY A 233 23.390 -2.987 -9.283 1.00 0.33 N ATOM 431 CA GLY A 233 24.520 -3.334 -10.125 1.00 0.47 C ATOM 432 C GLY A 233 25.577 -2.249 -10.170 1.00 0.46 C ATOM 433 O GLY A 233 26.725 -2.504 -10.537 1.00 0.67 O ATOM 434 H GLY A 233 23.311 -3.409 -8.336 1.00 0.00 H ATOM 435 N GLU A 234 25.198 -1.040 -9.784 1.00 0.34 N ATOM 436 CA GLU A 234 26.082 0.095 -9.853 1.00 0.37 C ATOM 437 C GLU A 234 26.872 0.240 -8.555 1.00 0.37 C ATOM 438 O GLU A 234 28.100 0.329 -8.576 1.00 0.46 O ATOM 439 CB GLU A 234 25.252 1.351 -10.124 1.00 0.41 C ATOM 440 CG GLU A 234 26.075 2.610 -10.260 1.00 1.12 C ATOM 441 CD GLU A 234 27.021 2.569 -11.442 1.00 1.38 C ATOM 442 OE1 GLU A 234 26.542 2.636 -12.593 1.00 1.63 O ATOM 443 OE2 GLU A 234 28.246 2.478 -11.229 1.00 2.27 O ATOM 444 H GLU A 234 24.233 -0.906 -9.420 1.00 0.00 H ATOM 445 N ASN A 235 26.172 0.261 -7.427 1.00 0.32 N ATOM 446 CA ASN A 235 26.834 0.416 -6.136 1.00 0.41 C ATOM 447 C ASN A 235 26.311 -0.567 -5.098 1.00 0.35 C ATOM 448 O ASN A 235 27.052 -1.414 -4.605 1.00 0.46 O ATOM 449 CB ASN A 235 26.673 1.845 -5.608 1.00 0.52 C ATOM 450 CG ASN A 235 27.483 2.861 -6.391 1.00 1.41 C ATOM 451 OD1 ASN A 235 26.996 3.455 -7.350 1.00 2.13 O ATOM 452 ND2 ASN A 235 28.728 3.062 -5.989 1.00 2.23 N ATOM 453 HD22 ASN A 235 29.102 2.538 -5.172 1.00 0.00 H ATOM 454 HD21 ASN A 235 29.333 3.744 -6.490 1.00 0.00 H ATOM 455 H ASN A 235 25.137 0.166 -7.464 1.00 0.00 H ATOM 456 N ASP A 236 25.026 -0.461 -4.783 1.00 0.24 N ATOM 457 CA ASP A 236 24.464 -1.176 -3.641 1.00 0.22 C ATOM 458 C ASP A 236 23.515 -2.290 -4.072 1.00 0.19 C ATOM 459 O ASP A 236 22.489 -2.035 -4.703 1.00 0.24 O ATOM 460 CB ASP A 236 23.735 -0.199 -2.715 1.00 0.28 C ATOM 461 CG ASP A 236 24.637 0.913 -2.219 1.00 0.37 C ATOM 462 OD1 ASP A 236 25.552 0.625 -1.422 1.00 1.12 O ATOM 463 OD2 ASP A 236 24.435 2.078 -2.620 1.00 1.21 O ATOM 464 H ASP A 236 24.407 0.143 -5.361 1.00 0.00 H ATOM 465 N PRO A 237 23.841 -3.543 -3.713 1.00 0.17 N ATOM 466 CA PRO A 237 23.015 -4.713 -4.034 1.00 0.18 C ATOM 467 C PRO A 237 21.782 -4.829 -3.136 1.00 0.14 C ATOM 468 O PRO A 237 20.862 -5.606 -3.419 1.00 0.16 O ATOM 469 CB PRO A 237 23.965 -5.885 -3.802 1.00 0.24 C ATOM 470 CG PRO A 237 24.910 -5.405 -2.755 1.00 0.25 C ATOM 471 CD PRO A 237 25.065 -3.922 -2.973 1.00 0.22 C ATOM 472 N VAL A 238 21.769 -4.066 -2.047 1.00 0.10 N ATOM 473 CA VAL A 238 20.637 -4.074 -1.126 1.00 0.09 C ATOM 474 C VAL A 238 19.334 -3.773 -1.851 1.00 0.09 C ATOM 475 O VAL A 238 18.305 -4.355 -1.539 1.00 0.12 O ATOM 476 CB VAL A 238 20.814 -3.069 0.031 1.00 0.10 C ATOM 477 CG1 VAL A 238 21.911 -3.508 0.970 1.00 0.12 C ATOM 478 CG2 VAL A 238 21.111 -1.687 -0.504 1.00 0.10 C ATOM 479 H VAL A 238 22.583 -3.450 -1.847 1.00 0.00 H ATOM 480 N LEU A 239 19.392 -2.889 -2.845 1.00 0.09 N ATOM 481 CA LEU A 239 18.201 -2.495 -3.590 1.00 0.12 C ATOM 482 C LEU A 239 17.597 -3.686 -4.328 1.00 0.13 C ATOM 483 O LEU A 239 16.381 -3.777 -4.481 1.00 0.15 O ATOM 484 CB LEU A 239 18.513 -1.364 -4.578 1.00 0.15 C ATOM 485 CG LEU A 239 18.589 0.055 -3.985 1.00 0.15 C ATOM 486 CD1 LEU A 239 17.369 0.365 -3.160 1.00 0.22 C ATOM 487 CD2 LEU A 239 19.822 0.240 -3.134 1.00 0.08 C ATOM 488 H LEU A 239 20.309 -2.469 -3.097 1.00 0.00 H ATOM 489 N GLN A 240 18.452 -4.611 -4.747 1.00 0.15 N ATOM 490 CA GLN A 240 18.013 -5.809 -5.454 1.00 0.17 C ATOM 491 C GLN A 240 16.997 -6.590 -4.624 1.00 0.15 C ATOM 492 O GLN A 240 15.963 -7.025 -5.136 1.00 0.19 O ATOM 493 CB GLN A 240 19.225 -6.692 -5.772 1.00 0.22 C ATOM 494 CG GLN A 240 18.875 -8.063 -6.324 1.00 0.42 C ATOM 495 CD GLN A 240 18.220 -8.011 -7.691 1.00 0.71 C ATOM 496 OE1 GLN A 240 18.900 -8.049 -8.712 1.00 1.69 O ATOM 497 NE2 GLN A 240 16.901 -7.932 -7.722 1.00 1.01 N ATOM 498 HE22 GLN A 240 16.361 -7.902 -6.834 1.00 0.00 H ATOM 499 HE21 GLN A 240 16.403 -7.900 -8.635 1.00 0.00 H ATOM 500 H GLN A 240 19.467 -4.477 -4.565 1.00 0.00 H ATOM 501 N ARG A 241 17.277 -6.744 -3.337 1.00 0.14 N ATOM 502 CA ARG A 241 16.402 -7.531 -2.473 1.00 0.15 C ATOM 503 C ARG A 241 15.183 -6.726 -2.015 1.00 0.12 C ATOM 504 O ARG A 241 14.237 -7.283 -1.458 1.00 0.14 O ATOM 505 CB ARG A 241 17.179 -8.102 -1.281 1.00 0.17 C ATOM 506 CG ARG A 241 17.854 -7.061 -0.405 1.00 0.15 C ATOM 507 CD ARG A 241 19.015 -7.663 0.372 1.00 0.25 C ATOM 508 NE ARG A 241 20.033 -8.215 -0.521 1.00 1.00 N ATOM 509 CZ ARG A 241 21.343 -8.161 -0.286 1.00 1.39 C ATOM 510 NH1 ARG A 241 21.800 -7.594 0.823 1.00 1.29 N ATOM 511 NH2 ARG A 241 22.191 -8.683 -1.161 1.00 2.12 N ATOM 512 HE ARG A 241 19.714 -8.679 -1.395 1.00 0.00 H ATOM 513 HH12 ARG A 241 22.824 -7.554 1.003 1.00 0.00 H ATOM 514 HH11 ARG A 241 21.135 -7.190 1.513 1.00 0.00 H ATOM 515 HH22 ARG A 241 23.214 -8.643 -0.981 1.00 0.00 H ATOM 516 HH21 ARG A 241 21.833 -9.133 -2.028 1.00 0.00 H ATOM 517 H ARG A 241 18.129 -6.300 -2.939 1.00 0.00 H ATOM 518 N ILE A 242 15.181 -5.423 -2.269 1.00 0.10 N ATOM 519 CA ILE A 242 14.005 -4.616 -1.965 1.00 0.09 C ATOM 520 C ILE A 242 13.074 -4.609 -3.176 1.00 0.09 C ATOM 521 O ILE A 242 11.861 -4.452 -3.042 1.00 0.10 O ATOM 522 CB ILE A 242 14.350 -3.166 -1.563 1.00 0.10 C ATOM 523 CG1 ILE A 242 15.760 -3.081 -0.987 1.00 0.12 C ATOM 524 CG2 ILE A 242 13.352 -2.670 -0.526 1.00 0.10 C ATOM 525 CD1 ILE A 242 16.230 -1.665 -0.746 1.00 0.15 C ATOM 526 H ILE A 242 16.022 -4.976 -2.687 1.00 0.00 H ATOM 527 N VAL A 243 13.656 -4.790 -4.364 1.00 0.11 N ATOM 528 CA VAL A 243 12.873 -5.037 -5.575 1.00 0.11 C ATOM 529 C VAL A 243 12.104 -6.340 -5.412 1.00 0.11 C ATOM 530 O VAL A 243 10.958 -6.470 -5.847 1.00 0.13 O ATOM 531 CB VAL A 243 13.768 -5.121 -6.836 1.00 0.11 C ATOM 532 CG1 VAL A 243 12.970 -5.556 -8.050 1.00 0.14 C ATOM 533 CG2 VAL A 243 14.438 -3.789 -7.108 1.00 0.15 C ATOM 534 H VAL A 243 14.693 -4.754 -4.430 1.00 0.00 H ATOM 535 N ASP A 244 12.753 -7.299 -4.757 1.00 0.12 N ATOM 536 CA ASP A 244 12.128 -8.569 -4.407 1.00 0.15 C ATOM 537 C ASP A 244 10.851 -8.332 -3.608 1.00 0.14 C ATOM 538 O ASP A 244 9.866 -9.041 -3.774 1.00 0.18 O ATOM 539 CB ASP A 244 13.107 -9.432 -3.605 1.00 0.22 C ATOM 540 CG ASP A 244 12.479 -10.709 -3.078 1.00 0.99 C ATOM 541 OD1 ASP A 244 12.365 -11.685 -3.846 1.00 1.77 O ATOM 542 OD2 ASP A 244 12.114 -10.749 -1.886 1.00 1.76 O ATOM 543 H ASP A 244 13.743 -7.137 -4.484 1.00 0.00 H ATOM 544 N ILE A 245 10.881 -7.314 -2.753 1.00 0.12 N ATOM 545 CA ILE A 245 9.708 -6.919 -1.980 1.00 0.12 C ATOM 546 C ILE A 245 8.578 -6.438 -2.884 1.00 0.12 C ATOM 547 O ILE A 245 7.443 -6.906 -2.777 1.00 0.15 O ATOM 548 CB ILE A 245 10.049 -5.799 -0.975 1.00 0.11 C ATOM 549 CG1 ILE A 245 10.943 -6.343 0.138 1.00 0.11 C ATOM 550 CG2 ILE A 245 8.787 -5.175 -0.406 1.00 0.13 C ATOM 551 CD1 ILE A 245 11.237 -5.330 1.214 1.00 0.12 C ATOM 552 H ILE A 245 11.767 -6.783 -2.632 1.00 0.00 H ATOM 553 N LEU A 246 8.897 -5.506 -3.775 1.00 0.11 N ATOM 554 CA LEU A 246 7.902 -4.896 -4.647 1.00 0.14 C ATOM 555 C LEU A 246 7.307 -5.910 -5.615 1.00 0.17 C ATOM 556 O LEU A 246 6.290 -5.646 -6.248 1.00 0.21 O ATOM 557 CB LEU A 246 8.528 -3.750 -5.435 1.00 0.14 C ATOM 558 CG LEU A 246 9.392 -2.786 -4.620 1.00 0.12 C ATOM 559 CD1 LEU A 246 9.895 -1.663 -5.500 1.00 0.15 C ATOM 560 CD2 LEU A 246 8.625 -2.225 -3.428 1.00 0.12 C ATOM 561 H LEU A 246 9.889 -5.202 -3.853 1.00 0.00 H ATOM 562 N TYR A 247 7.944 -7.063 -5.732 1.00 0.18 N ATOM 563 CA TYR A 247 7.450 -8.115 -6.604 1.00 0.23 C ATOM 564 C TYR A 247 7.235 -9.395 -5.813 1.00 0.24 C ATOM 565 O TYR A 247 7.181 -10.491 -6.378 1.00 0.29 O ATOM 566 CB TYR A 247 8.406 -8.367 -7.788 1.00 0.30 C ATOM 567 CG TYR A 247 8.279 -7.362 -8.934 1.00 0.34 C ATOM 568 CD1 TYR A 247 7.319 -7.527 -9.943 1.00 1.02 C ATOM 569 CD2 TYR A 247 9.115 -6.243 -9.011 1.00 1.04 C ATOM 570 CE1 TYR A 247 7.205 -6.611 -10.974 1.00 1.05 C ATOM 571 CE2 TYR A 247 9.001 -5.331 -10.045 1.00 1.08 C ATOM 572 CZ TYR A 247 8.043 -5.520 -11.019 1.00 0.52 C ATOM 573 OH TYR A 247 7.920 -4.613 -12.045 1.00 0.63 O ATOM 574 HH TYR A 247 7.190 -4.898 -12.650 1.00 0.00 H ATOM 575 H TYR A 247 8.817 -7.220 -5.189 1.00 0.00 H ATOM 576 N ALA A 248 7.116 -9.257 -4.498 1.00 0.22 N ATOM 577 CA ALA A 248 6.804 -10.390 -3.653 1.00 0.25 C ATOM 578 C ALA A 248 5.302 -10.568 -3.604 1.00 0.30 C ATOM 579 O ALA A 248 4.576 -9.704 -3.109 1.00 0.33 O ATOM 580 CB ALA A 248 7.369 -10.194 -2.253 1.00 0.29 C ATOM 581 H ALA A 248 7.249 -8.319 -4.068 1.00 0.00 H ATOM 582 N THR A 249 4.834 -11.688 -4.111 1.00 0.37 N ATOM 583 CA THR A 249 3.416 -11.916 -4.213 1.00 0.47 C ATOM 584 C THR A 249 2.988 -13.108 -3.374 1.00 0.66 C ATOM 585 O THR A 249 3.038 -14.253 -3.819 1.00 0.79 O ATOM 586 CB THR A 249 2.993 -12.116 -5.679 1.00 0.51 C ATOM 587 OG1 THR A 249 3.892 -13.025 -6.331 1.00 0.59 O ATOM 588 CG2 THR A 249 2.978 -10.787 -6.426 1.00 0.53 C ATOM 589 HG1 THR A 249 3.873 -13.898 -5.864 1.00 0.00 H ATOM 590 H THR A 249 5.497 -12.418 -4.442 1.00 0.00 H ATOM 591 N ASP A 250 2.587 -12.832 -2.145 1.00 0.81 N ATOM 592 CA ASP A 250 2.097 -13.874 -1.259 1.00 1.08 C ATOM 593 C ASP A 250 0.661 -14.227 -1.619 1.00 1.33 C ATOM 594 O ASP A 250 -0.296 -13.714 -1.042 1.00 1.67 O ATOM 595 CB ASP A 250 2.215 -13.442 0.213 1.00 1.51 C ATOM 596 CG ASP A 250 1.761 -12.014 0.466 1.00 2.24 C ATOM 597 OD1 ASP A 250 2.493 -11.077 0.067 1.00 2.89 O ATOM 598 OD2 ASP A 250 0.695 -11.820 1.088 1.00 2.83 O ATOM 599 H ASP A 250 2.623 -11.850 -1.806 1.00 0.00 H ATOM 600 N GLU A 251 0.532 -15.131 -2.576 1.00 1.61 N ATOM 601 CA GLU A 251 -0.761 -15.571 -3.077 1.00 2.18 C ATOM 602 C GLU A 251 -0.811 -17.091 -3.120 1.00 2.92 C ATOM 603 O GLU A 251 0.185 -17.756 -2.818 1.00 3.52 O ATOM 604 CB GLU A 251 -1.001 -15.011 -4.486 1.00 2.54 C ATOM 605 CG GLU A 251 -1.290 -13.520 -4.525 1.00 3.10 C ATOM 606 CD GLU A 251 -2.746 -13.203 -4.252 1.00 3.55 C ATOM 607 OE1 GLU A 251 -3.466 -12.827 -5.205 1.00 4.06 O ATOM 608 OE2 GLU A 251 -3.188 -13.343 -3.095 1.00 3.90 O ATOM 609 H GLU A 251 1.392 -15.545 -2.988 1.00 0.00 H ATOM 610 N GLY A 252 -1.959 -17.639 -3.480 1.00 3.45 N ATOM 611 CA GLY A 252 -2.055 -19.069 -3.674 1.00 4.51 C ATOM 612 C GLY A 252 -1.351 -19.487 -4.945 1.00 5.19 C ATOM 613 O GLY A 252 -0.520 -20.399 -4.943 1.00 5.97 O ATOM 614 H GLY A 252 -2.796 -17.039 -3.624 1.00 0.00 H ATOM 615 N PHE A 253 -1.670 -18.790 -6.023 1.00 5.21 N ATOM 616 CA PHE A 253 -1.042 -19.027 -7.311 1.00 6.17 C ATOM 617 C PHE A 253 0.297 -18.298 -7.371 1.00 6.30 C ATOM 618 O PHE A 253 0.432 -17.192 -6.846 1.00 5.90 O ATOM 619 CB PHE A 253 -1.971 -18.543 -8.430 1.00 6.66 C ATOM 620 CG PHE A 253 -1.486 -18.852 -9.820 1.00 7.82 C ATOM 621 CD1 PHE A 253 -1.672 -20.109 -10.368 1.00 8.51 C ATOM 622 CD2 PHE A 253 -0.853 -17.882 -10.580 1.00 8.44 C ATOM 623 CE1 PHE A 253 -1.238 -20.393 -11.644 1.00 9.65 C ATOM 624 CE2 PHE A 253 -0.415 -18.163 -11.857 1.00 9.58 C ATOM 625 CZ PHE A 253 -0.609 -19.419 -12.387 1.00 10.13 C ATOM 626 H PHE A 253 -2.394 -18.048 -5.946 1.00 0.00 H ATOM 627 N VAL A 254 1.285 -18.925 -7.993 1.00 7.14 N ATOM 628 CA VAL A 254 2.609 -18.330 -8.108 1.00 7.71 C ATOM 629 C VAL A 254 2.645 -17.323 -9.251 1.00 8.58 C ATOM 630 O VAL A 254 2.517 -17.690 -10.420 1.00 9.33 O ATOM 631 CB VAL A 254 3.696 -19.402 -8.333 1.00 8.48 C ATOM 632 CG1 VAL A 254 5.072 -18.762 -8.463 1.00 9.29 C ATOM 633 CG2 VAL A 254 3.687 -20.415 -7.201 1.00 8.01 C ATOM 634 H VAL A 254 1.111 -19.863 -8.408 1.00 0.00 H ATOM 635 N ILE A 255 2.811 -16.058 -8.904 1.00 8.67 N ATOM 636 CA ILE A 255 2.858 -14.990 -9.890 1.00 9.68 C ATOM 637 C ILE A 255 4.253 -14.893 -10.505 1.00 10.78 C ATOM 638 O ILE A 255 5.235 -14.663 -9.795 1.00 10.98 O ATOM 639 CB ILE A 255 2.480 -13.631 -9.261 1.00 9.70 C ATOM 640 CG1 ILE A 255 1.108 -13.718 -8.581 1.00 8.77 C ATOM 641 CG2 ILE A 255 2.489 -12.528 -10.309 1.00 10.96 C ATOM 642 CD1 ILE A 255 -0.020 -14.109 -9.512 1.00 8.96 C ATOM 643 H ILE A 255 2.911 -15.820 -7.897 1.00 0.00 H ATOM 644 N PRO A 256 4.364 -15.092 -11.829 1.00 11.63 N ATOM 645 CA PRO A 256 5.642 -14.989 -12.540 1.00 12.76 C ATOM 646 C PRO A 256 6.173 -13.558 -12.559 1.00 13.55 C ATOM 647 O PRO A 256 5.464 -12.630 -12.951 1.00 13.79 O ATOM 648 CB PRO A 256 5.312 -15.452 -13.967 1.00 13.42 C ATOM 649 CG PRO A 256 3.972 -16.104 -13.879 1.00 12.89 C ATOM 650 CD PRO A 256 3.263 -15.442 -12.736 1.00 11.71 C ATOM 651 N ASP A 257 7.414 -13.382 -12.127 1.00 14.12 N ATOM 652 CA ASP A 257 8.042 -12.066 -12.113 1.00 15.03 C ATOM 653 C ASP A 257 9.512 -12.181 -12.482 1.00 16.02 C ATOM 654 O ASP A 257 10.079 -13.276 -12.472 1.00 16.56 O ATOM 655 CB ASP A 257 7.914 -11.407 -10.733 1.00 15.19 C ATOM 656 CG ASP A 257 8.855 -12.007 -9.704 1.00 15.24 C ATOM 657 OD1 ASP A 257 8.531 -13.075 -9.145 1.00 15.20 O ATOM 658 OD2 ASP A 257 9.925 -11.412 -9.447 1.00 15.49 O ATOM 659 H ASP A 257 7.954 -14.204 -11.789 1.00 0.00 H ATOM 660 N GLU A 258 10.118 -11.054 -12.817 1.00 16.36 N ATOM 661 CA GLU A 258 11.531 -11.009 -13.146 1.00 17.37 C ATOM 662 C GLU A 258 12.222 -9.925 -12.332 1.00 18.22 C ATOM 663 O GLU A 258 12.094 -8.738 -12.630 1.00 18.23 O ATOM 664 CB GLU A 258 11.724 -10.747 -14.641 1.00 17.51 C ATOM 665 CG GLU A 258 11.160 -11.843 -15.530 1.00 17.24 C ATOM 666 CD GLU A 258 11.333 -11.545 -17.001 1.00 17.44 C ATOM 667 OE1 GLU A 258 10.364 -11.081 -17.634 1.00 17.74 O ATOM 668 OE2 GLU A 258 12.440 -11.774 -17.531 1.00 17.42 O ATOM 669 H GLU A 258 9.565 -10.173 -12.846 1.00 0.00 H ATOM 670 N GLY A 259 12.942 -10.333 -11.297 1.00 19.02 N ATOM 671 CA GLY A 259 13.624 -9.377 -10.448 1.00 19.94 C ATOM 672 C GLY A 259 15.048 -9.121 -10.895 1.00 20.79 C ATOM 673 O GLY A 259 15.741 -8.271 -10.334 1.00 21.21 O ATOM 674 H GLY A 259 13.018 -11.350 -11.092 1.00 0.00 H ATOM 675 N GLY A 260 15.483 -9.856 -11.907 1.00 21.13 N ATOM 676 CA GLY A 260 16.821 -9.687 -12.430 1.00 22.03 C ATOM 677 C GLY A 260 17.810 -10.614 -11.758 1.00 22.55 C ATOM 678 O GLY A 260 19.003 -10.256 -11.666 1.00 22.91 O ATOM 679 OXT GLY A 260 17.395 -11.705 -11.311 1.00 22.67 O ATOM 680 H GLY A 260 14.853 -10.566 -12.332 1.00 0.00 H TER 681 GLY A 260 ATOM 682 N ASP B 191 -38.294 0.195 -6.751 1.00 1.75 N ATOM 683 CA ASP B 191 -37.167 -0.718 -6.434 1.00 1.05 C ATOM 684 C ASP B 191 -36.002 0.067 -5.847 1.00 0.85 C ATOM 685 O ASP B 191 -34.857 -0.076 -6.283 1.00 0.82 O ATOM 686 CB ASP B 191 -36.715 -1.459 -7.697 1.00 1.68 C ATOM 687 CG ASP B 191 -37.819 -2.292 -8.311 1.00 1.96 C ATOM 688 OD1 ASP B 191 -37.898 -3.500 -8.011 1.00 2.64 O ATOM 689 OD2 ASP B 191 -38.625 -1.739 -9.091 1.00 2.29 O ATOM 690 HN3 ASP B 191 -37.979 0.905 -7.442 1.00 0.00 H ATOM 691 HN2 ASP B 191 -38.608 0.671 -5.881 1.00 0.00 H ATOM 692 HN1 ASP B 191 -39.082 -0.354 -7.151 1.00 0.00 H ATOM 693 N GLU B 192 -36.299 0.891 -4.846 1.00 0.75 N ATOM 694 CA GLU B 192 -35.307 1.773 -4.246 1.00 0.64 C ATOM 695 C GLU B 192 -34.155 0.977 -3.647 1.00 0.51 C ATOM 696 O GLU B 192 -32.998 1.145 -4.041 1.00 0.53 O ATOM 697 CB GLU B 192 -35.959 2.634 -3.160 1.00 0.66 C ATOM 698 CG GLU B 192 -35.033 3.679 -2.558 1.00 0.69 C ATOM 699 CD GLU B 192 -34.648 4.752 -3.551 1.00 1.51 C ATOM 700 OE1 GLU B 192 -35.436 5.700 -3.742 1.00 2.10 O ATOM 701 OE2 GLU B 192 -33.560 4.651 -4.155 1.00 2.33 O ATOM 702 H GLU B 192 -37.272 0.906 -4.479 1.00 0.00 H ATOM 703 N ALA B 193 -34.477 0.093 -2.712 1.00 0.42 N ATOM 704 CA ALA B 193 -33.459 -0.664 -2.006 1.00 0.34 C ATOM 705 C ALA B 193 -32.724 -1.613 -2.937 1.00 0.44 C ATOM 706 O ALA B 193 -31.548 -1.890 -2.734 1.00 0.42 O ATOM 707 CB ALA B 193 -34.063 -1.436 -0.846 1.00 0.33 C ATOM 708 H ALA B 193 -35.479 -0.061 -2.480 1.00 0.00 H ATOM 709 N ALA B 194 -33.416 -2.098 -3.960 1.00 0.56 N ATOM 710 CA ALA B 194 -32.839 -3.052 -4.900 1.00 0.68 C ATOM 711 C ALA B 194 -31.573 -2.499 -5.548 1.00 0.69 C ATOM 712 O ALA B 194 -30.583 -3.216 -5.711 1.00 0.73 O ATOM 713 CB ALA B 194 -33.859 -3.424 -5.958 1.00 0.80 C ATOM 714 H ALA B 194 -34.400 -1.788 -4.096 1.00 0.00 H ATOM 715 N GLU B 195 -31.601 -1.218 -5.896 1.00 0.68 N ATOM 716 CA GLU B 195 -30.438 -0.565 -6.478 1.00 0.73 C ATOM 717 C GLU B 195 -29.335 -0.421 -5.433 1.00 0.63 C ATOM 718 O GLU B 195 -28.151 -0.559 -5.738 1.00 0.68 O ATOM 719 CB GLU B 195 -30.817 0.806 -7.040 1.00 0.80 C ATOM 720 CG GLU B 195 -31.906 0.747 -8.097 1.00 1.19 C ATOM 721 CD GLU B 195 -32.184 2.095 -8.725 1.00 2.09 C ATOM 722 OE1 GLU B 195 -31.695 2.349 -9.846 1.00 2.84 O ATOM 723 OE2 GLU B 195 -32.892 2.911 -8.106 1.00 2.59 O ATOM 724 H GLU B 195 -32.472 -0.670 -5.750 1.00 0.00 H ATOM 725 N LEU B 196 -29.739 -0.165 -4.194 1.00 0.49 N ATOM 726 CA LEU B 196 -28.799 -0.049 -3.086 1.00 0.39 C ATOM 727 C LEU B 196 -28.160 -1.398 -2.765 1.00 0.40 C ATOM 728 O LEU B 196 -27.021 -1.458 -2.301 1.00 0.38 O ATOM 729 CB LEU B 196 -29.500 0.516 -1.848 1.00 0.30 C ATOM 730 CG LEU B 196 -29.726 2.031 -1.864 1.00 0.35 C ATOM 731 CD1 LEU B 196 -31.188 2.372 -1.641 1.00 0.37 C ATOM 732 CD2 LEU B 196 -28.872 2.699 -0.805 1.00 0.35 C ATOM 733 H LEU B 196 -30.755 -0.044 -4.009 1.00 0.00 H ATOM 734 N MET B 197 -28.897 -2.479 -3.021 1.00 0.47 N ATOM 735 CA MET B 197 -28.369 -3.832 -2.839 1.00 0.55 C ATOM 736 C MET B 197 -27.168 -4.034 -3.751 1.00 0.62 C ATOM 737 O MET B 197 -26.173 -4.649 -3.370 1.00 0.66 O ATOM 738 CB MET B 197 -29.426 -4.892 -3.168 1.00 0.66 C ATOM 739 CG MET B 197 -30.749 -4.722 -2.443 1.00 0.61 C ATOM 740 SD MET B 197 -30.637 -4.993 -0.667 1.00 0.58 S ATOM 741 CE MET B 197 -32.349 -4.724 -0.208 1.00 0.57 C ATOM 742 H MET B 197 -29.873 -2.358 -3.359 1.00 0.00 H ATOM 743 N GLN B 198 -27.279 -3.513 -4.966 1.00 0.67 N ATOM 744 CA GLN B 198 -26.184 -3.566 -5.920 1.00 0.76 C ATOM 745 C GLN B 198 -25.029 -2.707 -5.427 1.00 0.64 C ATOM 746 O GLN B 198 -23.863 -3.089 -5.531 1.00 0.62 O ATOM 747 CB GLN B 198 -26.642 -3.069 -7.293 1.00 0.93 C ATOM 748 CG GLN B 198 -25.561 -3.141 -8.357 1.00 1.04 C ATOM 749 CD GLN B 198 -25.909 -2.348 -9.599 1.00 1.65 C ATOM 750 OE1 GLN B 198 -26.538 -2.860 -10.524 1.00 2.13 O ATOM 751 NE2 GLN B 198 -25.501 -1.089 -9.630 1.00 2.19 N ATOM 752 HE22 GLN B 198 -24.971 -0.694 -8.827 1.00 0.00 H ATOM 753 HE21 GLN B 198 -25.710 -0.495 -10.458 1.00 0.00 H ATOM 754 H GLN B 198 -28.171 -3.056 -5.242 1.00 0.00 H ATOM 755 N GLN B 199 -25.372 -1.550 -4.868 1.00 0.57 N ATOM 756 CA GLN B 199 -24.375 -0.593 -4.418 1.00 0.52 C ATOM 757 C GLN B 199 -23.528 -1.153 -3.286 1.00 0.42 C ATOM 758 O GLN B 199 -22.308 -1.060 -3.336 1.00 0.43 O ATOM 759 CB GLN B 199 -25.024 0.722 -3.989 1.00 0.52 C ATOM 760 CG GLN B 199 -25.696 1.472 -5.127 1.00 0.67 C ATOM 761 CD GLN B 199 -24.829 1.542 -6.370 1.00 1.34 C ATOM 762 OE1 GLN B 199 -24.914 0.682 -7.250 1.00 2.07 O ATOM 763 NE2 GLN B 199 -23.984 2.555 -6.448 1.00 2.03 N ATOM 764 HE22 GLN B 199 -23.944 3.259 -5.683 1.00 0.00 H ATOM 765 HE21 GLN B 199 -23.359 2.648 -7.274 1.00 0.00 H ATOM 766 H GLN B 199 -26.380 -1.324 -4.750 1.00 0.00 H ATOM 767 N VAL B 200 -24.157 -1.743 -2.270 1.00 0.36 N ATOM 768 CA VAL B 200 -23.391 -2.315 -1.168 1.00 0.32 C ATOM 769 C VAL B 200 -22.495 -3.438 -1.668 1.00 0.39 C ATOM 770 O VAL B 200 -21.411 -3.656 -1.140 1.00 0.38 O ATOM 771 CB VAL B 200 -24.257 -2.842 -0.004 1.00 0.33 C ATOM 772 CG1 VAL B 200 -25.034 -1.716 0.640 1.00 0.28 C ATOM 773 CG2 VAL B 200 -25.185 -3.946 -0.459 1.00 0.43 C ATOM 774 H VAL B 200 -25.196 -1.796 -2.263 1.00 0.00 H ATOM 775 N LYS B 201 -22.943 -4.130 -2.707 1.00 0.48 N ATOM 776 CA LYS B 201 -22.179 -5.226 -3.276 1.00 0.57 C ATOM 777 C LYS B 201 -20.935 -4.700 -3.985 1.00 0.59 C ATOM 778 O LYS B 201 -19.821 -5.116 -3.677 1.00 0.60 O ATOM 779 CB LYS B 201 -23.049 -6.037 -4.237 1.00 0.66 C ATOM 780 CG LYS B 201 -22.334 -7.227 -4.853 1.00 1.05 C ATOM 781 CD LYS B 201 -23.273 -8.060 -5.708 1.00 1.38 C ATOM 782 CE LYS B 201 -23.787 -7.284 -6.910 1.00 1.70 C ATOM 783 NZ LYS B 201 -24.642 -8.127 -7.786 1.00 2.28 N ATOM 784 HZ1 LYS B 201 -24.089 -8.937 -8.132 1.00 0.00 H ATOM 785 HZ2 LYS B 201 -25.460 -8.470 -7.243 1.00 0.00 H ATOM 786 HZ3 LYS B 201 -24.972 -7.561 -8.594 1.00 0.00 H ATOM 787 H LYS B 201 -23.863 -3.882 -3.124 1.00 0.00 H ATOM 788 N VAL B 202 -21.117 -3.765 -4.909 1.00 0.60 N ATOM 789 CA VAL B 202 -19.987 -3.206 -5.646 1.00 0.65 C ATOM 790 C VAL B 202 -19.062 -2.422 -4.712 1.00 0.57 C ATOM 791 O VAL B 202 -17.846 -2.377 -4.914 1.00 0.61 O ATOM 792 CB VAL B 202 -20.444 -2.303 -6.816 1.00 0.73 C ATOM 793 CG1 VAL B 202 -21.382 -3.064 -7.736 1.00 0.81 C ATOM 794 CG2 VAL B 202 -21.112 -1.029 -6.319 1.00 0.68 C ATOM 795 H VAL B 202 -22.079 -3.425 -5.111 1.00 0.00 H ATOM 796 N LEU B 203 -19.645 -1.828 -3.679 1.00 0.47 N ATOM 797 CA LEU B 203 -18.889 -1.077 -2.689 1.00 0.40 C ATOM 798 C LEU B 203 -18.053 -2.014 -1.824 1.00 0.36 C ATOM 799 O LEU B 203 -16.851 -1.807 -1.665 1.00 0.35 O ATOM 800 CB LEU B 203 -19.848 -0.259 -1.815 1.00 0.36 C ATOM 801 CG LEU B 203 -19.750 1.270 -1.936 1.00 0.27 C ATOM 802 CD1 LEU B 203 -19.591 1.706 -3.383 1.00 0.44 C ATOM 803 CD2 LEU B 203 -20.988 1.922 -1.339 1.00 0.29 C ATOM 804 H LEU B 203 -20.677 -1.902 -3.574 1.00 0.00 H ATOM 805 N LYS B 204 -18.686 -3.058 -1.288 1.00 0.40 N ATOM 806 CA LYS B 204 -18.000 -3.993 -0.398 1.00 0.44 C ATOM 807 C LYS B 204 -16.893 -4.739 -1.136 1.00 0.50 C ATOM 808 O LYS B 204 -15.850 -5.027 -0.563 1.00 0.52 O ATOM 809 CB LYS B 204 -18.980 -5.002 0.214 1.00 0.51 C ATOM 810 CG LYS B 204 -19.488 -6.045 -0.775 1.00 0.61 C ATOM 811 CD LYS B 204 -20.457 -7.026 -0.130 1.00 0.70 C ATOM 812 CE LYS B 204 -19.832 -7.760 1.047 1.00 0.83 C ATOM 813 NZ LYS B 204 -18.730 -8.669 0.632 1.00 1.57 N ATOM 814 HZ1 LYS B 204 -19.100 -9.381 -0.030 1.00 0.00 H ATOM 815 HZ2 LYS B 204 -17.983 -8.116 0.166 1.00 0.00 H ATOM 816 HZ3 LYS B 204 -18.339 -9.144 1.471 1.00 0.00 H ATOM 817 H LYS B 204 -19.691 -3.211 -1.508 1.00 0.00 H ATOM 818 N LEU B 205 -17.124 -5.047 -2.407 1.00 0.57 N ATOM 819 CA LEU B 205 -16.137 -5.756 -3.209 1.00 0.65 C ATOM 820 C LEU B 205 -14.919 -4.879 -3.438 1.00 0.59 C ATOM 821 O LEU B 205 -13.783 -5.348 -3.366 1.00 0.65 O ATOM 822 CB LEU B 205 -16.746 -6.198 -4.537 1.00 0.76 C ATOM 823 CG LEU B 205 -17.853 -7.246 -4.413 1.00 0.85 C ATOM 824 CD1 LEU B 205 -18.508 -7.493 -5.761 1.00 0.96 C ATOM 825 CD2 LEU B 205 -17.295 -8.543 -3.850 1.00 0.93 C ATOM 826 H LEU B 205 -18.030 -4.776 -2.839 1.00 0.00 H ATOM 827 N THR B 206 -15.158 -3.599 -3.692 1.00 0.50 N ATOM 828 CA THR B 206 -14.075 -2.640 -3.797 1.00 0.44 C ATOM 829 C THR B 206 -13.342 -2.553 -2.462 1.00 0.34 C ATOM 830 O THR B 206 -12.116 -2.479 -2.417 1.00 0.32 O ATOM 831 CB THR B 206 -14.592 -1.247 -4.204 1.00 0.42 C ATOM 832 OG1 THR B 206 -15.421 -1.355 -5.370 1.00 0.54 O ATOM 833 CG2 THR B 206 -13.433 -0.305 -4.491 1.00 0.44 C ATOM 834 HG1 THR B 206 -16.191 -1.945 -5.172 1.00 0.00 H ATOM 835 H THR B 206 -16.139 -3.278 -3.818 1.00 0.00 H ATOM 836 N VAL B 207 -14.112 -2.588 -1.378 1.00 0.31 N ATOM 837 CA VAL B 207 -13.557 -2.630 -0.033 1.00 0.28 C ATOM 838 C VAL B 207 -12.638 -3.835 0.137 1.00 0.36 C ATOM 839 O VAL B 207 -11.484 -3.685 0.514 1.00 0.35 O ATOM 840 CB VAL B 207 -14.674 -2.682 1.037 1.00 0.32 C ATOM 841 CG1 VAL B 207 -14.117 -3.079 2.395 1.00 0.40 C ATOM 842 CG2 VAL B 207 -15.389 -1.346 1.140 1.00 0.24 C ATOM 843 H VAL B 207 -15.145 -2.585 -1.495 1.00 0.00 H ATOM 844 N GLU B 208 -13.151 -5.019 -0.173 1.00 0.46 N ATOM 845 CA GLU B 208 -12.413 -6.261 0.028 1.00 0.55 C ATOM 846 C GLU B 208 -11.112 -6.291 -0.774 1.00 0.54 C ATOM 847 O GLU B 208 -10.073 -6.717 -0.265 1.00 0.58 O ATOM 848 CB GLU B 208 -13.297 -7.458 -0.330 1.00 0.66 C ATOM 849 CG GLU B 208 -14.512 -7.589 0.573 1.00 1.38 C ATOM 850 CD GLU B 208 -15.343 -8.815 0.269 1.00 1.66 C ATOM 851 OE1 GLU B 208 -16.266 -8.726 -0.568 1.00 2.23 O ATOM 852 OE2 GLU B 208 -15.086 -9.877 0.873 1.00 2.05 O ATOM 853 H GLU B 208 -14.110 -5.063 -0.572 1.00 0.00 H ATOM 854 N ASP B 209 -11.161 -5.829 -2.019 1.00 0.52 N ATOM 855 CA ASP B 209 -9.963 -5.794 -2.860 1.00 0.54 C ATOM 856 C ASP B 209 -8.995 -4.712 -2.393 1.00 0.47 C ATOM 857 O ASP B 209 -7.788 -4.822 -2.586 1.00 0.61 O ATOM 858 CB ASP B 209 -10.320 -5.578 -4.333 1.00 0.60 C ATOM 859 CG ASP B 209 -10.871 -6.827 -4.993 1.00 1.18 C ATOM 860 OD1 ASP B 209 -10.082 -7.757 -5.281 1.00 1.80 O ATOM 861 OD2 ASP B 209 -12.090 -6.883 -5.247 1.00 1.93 O ATOM 862 H ASP B 209 -12.065 -5.487 -2.402 1.00 0.00 H ATOM 863 N LEU B 210 -9.527 -3.671 -1.778 1.00 0.31 N ATOM 864 CA LEU B 210 -8.699 -2.595 -1.247 1.00 0.23 C ATOM 865 C LEU B 210 -8.108 -2.977 0.108 1.00 0.23 C ATOM 866 O LEU B 210 -6.959 -2.645 0.405 1.00 0.25 O ATOM 867 CB LEU B 210 -9.518 -1.309 -1.132 1.00 0.18 C ATOM 868 CG LEU B 210 -9.309 -0.285 -2.256 1.00 0.19 C ATOM 869 CD1 LEU B 210 -9.249 -0.961 -3.617 1.00 0.24 C ATOM 870 CD2 LEU B 210 -10.427 0.743 -2.244 1.00 0.25 C ATOM 871 H LEU B 210 -10.560 -3.618 -1.670 1.00 0.00 H ATOM 872 N GLU B 211 -8.896 -3.681 0.920 1.00 0.27 N ATOM 873 CA GLU B 211 -8.433 -4.165 2.217 1.00 0.33 C ATOM 874 C GLU B 211 -7.213 -5.050 2.047 1.00 0.35 C ATOM 875 O GLU B 211 -6.204 -4.873 2.735 1.00 0.38 O ATOM 876 CB GLU B 211 -9.525 -4.958 2.941 1.00 0.42 C ATOM 877 CG GLU B 211 -10.679 -4.117 3.455 1.00 0.43 C ATOM 878 CD GLU B 211 -11.575 -4.888 4.400 1.00 1.26 C ATOM 879 OE1 GLU B 211 -12.458 -5.634 3.927 1.00 1.93 O ATOM 880 OE2 GLU B 211 -11.390 -4.760 5.630 1.00 2.05 O ATOM 881 H GLU B 211 -9.869 -3.892 0.621 1.00 0.00 H ATOM 882 N LYS B 212 -7.309 -5.993 1.114 1.00 0.38 N ATOM 883 CA LYS B 212 -6.223 -6.926 0.870 1.00 0.43 C ATOM 884 C LYS B 212 -4.963 -6.171 0.464 1.00 0.29 C ATOM 885 O LYS B 212 -3.892 -6.444 0.985 1.00 0.27 O ATOM 886 CB LYS B 212 -6.608 -7.964 -0.200 1.00 0.58 C ATOM 887 CG LYS B 212 -6.701 -7.400 -1.607 1.00 0.69 C ATOM 888 CD LYS B 212 -7.145 -8.443 -2.616 1.00 0.80 C ATOM 889 CE LYS B 212 -7.050 -7.907 -4.036 1.00 1.01 C ATOM 890 NZ LYS B 212 -7.627 -8.843 -5.033 1.00 1.60 N ATOM 891 HZ1 LYS B 212 -7.114 -9.747 -4.995 1.00 0.00 H ATOM 892 HZ2 LYS B 212 -8.631 -9.003 -4.816 1.00 0.00 H ATOM 893 HZ3 LYS B 212 -7.538 -8.432 -5.984 1.00 0.00 H ATOM 894 H LYS B 212 -8.179 -6.064 0.548 1.00 0.00 H ATOM 895 N GLU B 213 -5.108 -5.186 -0.425 1.00 0.29 N ATOM 896 CA GLU B 213 -3.967 -4.424 -0.922 1.00 0.27 C ATOM 897 C GLU B 213 -3.348 -3.567 0.177 1.00 0.19 C ATOM 898 O GLU B 213 -2.125 -3.516 0.305 1.00 0.22 O ATOM 899 CB GLU B 213 -4.366 -3.544 -2.111 1.00 0.42 C ATOM 900 CG GLU B 213 -4.654 -4.326 -3.383 1.00 0.59 C ATOM 901 CD GLU B 213 -4.929 -3.427 -4.574 1.00 0.94 C ATOM 902 OE1 GLU B 213 -3.965 -2.876 -5.147 1.00 1.48 O ATOM 903 OE2 GLU B 213 -6.108 -3.275 -4.952 1.00 1.79 O ATOM 904 H GLU B 213 -6.060 -4.955 -0.773 1.00 0.00 H ATOM 905 N ARG B 214 -4.191 -2.911 0.974 1.00 0.19 N ATOM 906 CA ARG B 214 -3.712 -2.029 2.037 1.00 0.21 C ATOM 907 C ARG B 214 -2.711 -2.772 2.922 1.00 0.21 C ATOM 908 O ARG B 214 -1.586 -2.318 3.110 1.00 0.31 O ATOM 909 CB ARG B 214 -4.882 -1.510 2.892 1.00 0.30 C ATOM 910 CG ARG B 214 -4.665 -0.114 3.470 1.00 0.53 C ATOM 911 CD ARG B 214 -3.440 -0.022 4.366 1.00 0.71 C ATOM 912 NE ARG B 214 -3.526 -0.905 5.532 1.00 1.03 N ATOM 913 CZ ARG B 214 -3.516 -0.476 6.794 1.00 1.43 C ATOM 914 NH1 ARG B 214 -3.560 0.826 7.064 1.00 1.51 N ATOM 915 NH2 ARG B 214 -3.494 -1.355 7.786 1.00 1.81 N ATOM 916 HE ARG B 214 -3.599 -1.929 5.365 1.00 0.00 H ATOM 917 HH12 ARG B 214 -3.552 1.153 8.051 1.00 0.00 H ATOM 918 HH11 ARG B 214 -3.603 1.517 6.288 1.00 0.00 H ATOM 919 HH22 ARG B 214 -3.486 -1.026 8.772 1.00 0.00 H ATOM 920 HH21 ARG B 214 -3.485 -2.374 7.578 1.00 0.00 H ATOM 921 H ARG B 214 -5.215 -3.029 0.836 1.00 0.00 H ATOM 922 N ASP B 215 -3.115 -3.926 3.438 1.00 0.20 N ATOM 923 CA ASP B 215 -2.276 -4.678 4.368 1.00 0.23 C ATOM 924 C ASP B 215 -1.246 -5.539 3.641 1.00 0.19 C ATOM 925 O ASP B 215 -0.207 -5.880 4.211 1.00 0.22 O ATOM 926 CB ASP B 215 -3.132 -5.539 5.297 1.00 0.33 C ATOM 927 CG ASP B 215 -3.935 -4.704 6.273 1.00 1.24 C ATOM 928 OD1 ASP B 215 -5.179 -4.790 6.256 1.00 1.98 O ATOM 929 OD2 ASP B 215 -3.325 -3.945 7.057 1.00 2.06 O ATOM 930 H ASP B 215 -4.048 -4.303 3.175 1.00 0.00 H ATOM 931 N PHE B 216 -1.531 -5.882 2.387 1.00 0.18 N ATOM 932 CA PHE B 216 -0.605 -6.657 1.559 1.00 0.21 C ATOM 933 C PHE B 216 0.713 -5.912 1.430 1.00 0.18 C ATOM 934 O PHE B 216 1.789 -6.456 1.687 1.00 0.23 O ATOM 935 CB PHE B 216 -1.219 -6.882 0.163 1.00 0.26 C ATOM 936 CG PHE B 216 -0.488 -7.861 -0.737 1.00 0.33 C ATOM 937 CD1 PHE B 216 -0.969 -9.157 -0.916 1.00 1.28 C ATOM 938 CD2 PHE B 216 0.667 -7.485 -1.422 1.00 1.24 C ATOM 939 CE1 PHE B 216 -0.314 -10.046 -1.753 1.00 1.33 C ATOM 940 CE2 PHE B 216 1.320 -8.380 -2.254 1.00 1.27 C ATOM 941 CZ PHE B 216 0.827 -9.656 -2.416 1.00 0.57 C ATOM 942 H PHE B 216 -2.443 -5.589 1.981 1.00 0.00 H ATOM 943 N TYR B 217 0.621 -4.653 1.042 1.00 0.15 N ATOM 944 CA TYR B 217 1.800 -3.831 0.887 1.00 0.15 C ATOM 945 C TYR B 217 2.260 -3.299 2.233 1.00 0.15 C ATOM 946 O TYR B 217 3.439 -3.029 2.414 1.00 0.17 O ATOM 947 CB TYR B 217 1.534 -2.678 -0.081 1.00 0.16 C ATOM 948 CG TYR B 217 1.174 -3.128 -1.480 1.00 0.16 C ATOM 949 CD1 TYR B 217 -0.154 -3.279 -1.858 1.00 0.96 C ATOM 950 CD2 TYR B 217 2.159 -3.396 -2.422 1.00 0.98 C ATOM 951 CE1 TYR B 217 -0.494 -3.682 -3.138 1.00 0.97 C ATOM 952 CE2 TYR B 217 1.828 -3.799 -3.705 1.00 0.98 C ATOM 953 CZ TYR B 217 0.501 -3.936 -4.056 1.00 0.22 C ATOM 954 OH TYR B 217 0.169 -4.339 -5.327 1.00 0.26 O ATOM 955 HH TYR B 217 -0.816 -4.385 -5.410 1.00 0.00 H ATOM 956 H TYR B 217 -0.315 -4.246 0.845 1.00 0.00 H ATOM 957 N PHE B 218 1.335 -3.177 3.180 1.00 0.14 N ATOM 958 CA PHE B 218 1.660 -2.640 4.502 1.00 0.15 C ATOM 959 C PHE B 218 2.720 -3.492 5.184 1.00 0.15 C ATOM 960 O PHE B 218 3.684 -2.969 5.747 1.00 0.18 O ATOM 961 CB PHE B 218 0.410 -2.551 5.381 1.00 0.17 C ATOM 962 CG PHE B 218 0.409 -1.348 6.277 1.00 0.16 C ATOM 963 CD1 PHE B 218 0.648 -1.459 7.636 1.00 1.15 C ATOM 964 CD2 PHE B 218 0.188 -0.100 5.737 1.00 1.20 C ATOM 965 CE1 PHE B 218 0.669 -0.330 8.443 1.00 1.15 C ATOM 966 CE2 PHE B 218 0.202 1.034 6.534 1.00 1.23 C ATOM 967 CZ PHE B 218 0.446 0.917 7.889 1.00 0.25 C ATOM 968 H PHE B 218 0.358 -3.470 2.977 1.00 0.00 H ATOM 969 N GLY B 219 2.546 -4.806 5.115 1.00 0.13 N ATOM 970 CA GLY B 219 3.545 -5.709 5.646 1.00 0.15 C ATOM 971 C GLY B 219 4.845 -5.607 4.876 1.00 0.15 C ATOM 972 O GLY B 219 5.925 -5.849 5.418 1.00 0.19 O ATOM 973 H GLY B 219 1.685 -5.190 4.676 1.00 0.00 H ATOM 974 N LYS B 220 4.741 -5.226 3.608 1.00 0.13 N ATOM 975 CA LYS B 220 5.913 -5.057 2.766 1.00 0.15 C ATOM 976 C LYS B 220 6.793 -3.910 3.254 1.00 0.12 C ATOM 977 O LYS B 220 8.004 -4.079 3.343 1.00 0.13 O ATOM 978 CB LYS B 220 5.521 -4.828 1.302 1.00 0.18 C ATOM 979 CG LYS B 220 4.797 -6.002 0.664 1.00 0.46 C ATOM 980 CD LYS B 220 5.651 -7.259 0.662 1.00 0.63 C ATOM 981 CE LYS B 220 4.908 -8.446 0.071 1.00 0.71 C ATOM 982 NZ LYS B 220 3.744 -8.853 0.909 1.00 1.19 N ATOM 983 HZ1 LYS B 220 4.077 -9.119 1.858 1.00 0.00 H ATOM 984 HZ2 LYS B 220 3.078 -8.058 0.984 1.00 0.00 H ATOM 985 HZ3 LYS B 220 3.268 -9.665 0.468 1.00 0.00 H ATOM 986 H LYS B 220 3.798 -5.044 3.208 1.00 0.00 H ATOM 987 N LEU B 221 6.197 -2.752 3.590 1.00 0.12 N ATOM 988 CA LEU B 221 6.991 -1.597 4.047 1.00 0.11 C ATOM 989 C LEU B 221 7.799 -1.966 5.281 1.00 0.11 C ATOM 990 O LEU B 221 8.931 -1.523 5.448 1.00 0.10 O ATOM 991 CB LEU B 221 6.138 -0.350 4.352 1.00 0.11 C ATOM 992 CG LEU B 221 5.426 0.286 3.164 1.00 0.11 C ATOM 993 CD1 LEU B 221 6.246 0.134 1.891 1.00 0.14 C ATOM 994 CD2 LEU B 221 4.050 -0.304 3.007 1.00 0.11 C ATOM 995 H LEU B 221 5.162 -2.670 3.527 1.00 0.00 H ATOM 996 N ARG B 222 7.215 -2.796 6.130 1.00 0.14 N ATOM 997 CA ARG B 222 7.908 -3.286 7.310 1.00 0.14 C ATOM 998 C ARG B 222 9.105 -4.128 6.906 1.00 0.14 C ATOM 999 O ARG B 222 10.164 -4.030 7.506 1.00 0.16 O ATOM 1000 CB ARG B 222 6.956 -4.094 8.185 1.00 0.18 C ATOM 1001 CG ARG B 222 5.881 -3.242 8.827 1.00 0.21 C ATOM 1002 CD ARG B 222 6.407 -2.492 10.037 1.00 0.27 C ATOM 1003 NE ARG B 222 6.488 -3.358 11.211 1.00 0.42 N ATOM 1004 CZ ARG B 222 7.165 -3.063 12.319 1.00 0.59 C ATOM 1005 NH1 ARG B 222 7.902 -1.962 12.386 1.00 0.67 N ATOM 1006 NH2 ARG B 222 7.126 -3.889 13.355 1.00 0.78 N ATOM 1007 HE ARG B 222 5.983 -4.266 11.179 1.00 0.00 H ATOM 1008 HH12 ARG B 222 8.427 -1.740 13.256 1.00 0.00 H ATOM 1009 HH11 ARG B 222 7.955 -1.321 11.569 1.00 0.00 H ATOM 1010 HH22 ARG B 222 7.654 -3.661 14.222 1.00 0.00 H ATOM 1011 HH21 ARG B 222 6.568 -4.765 13.301 1.00 0.00 H ATOM 1012 H ARG B 222 6.238 -3.105 5.949 1.00 0.00 H ATOM 1013 N ASN B 223 8.945 -4.926 5.861 1.00 0.15 N ATOM 1014 CA ASN B 223 10.034 -5.767 5.381 1.00 0.18 C ATOM 1015 C ASN B 223 11.183 -4.902 4.859 1.00 0.15 C ATOM 1016 O ASN B 223 12.351 -5.218 5.071 1.00 0.18 O ATOM 1017 CB ASN B 223 9.539 -6.722 4.289 1.00 0.25 C ATOM 1018 CG ASN B 223 10.524 -7.839 3.985 1.00 0.85 C ATOM 1019 OD1 ASN B 223 10.619 -8.301 2.848 1.00 1.68 O ATOM 1020 ND2 ASN B 223 11.245 -8.301 4.995 1.00 1.58 N ATOM 1021 HD22 ASN B 223 11.138 -7.886 5.943 1.00 0.00 H ATOM 1022 HD21 ASN B 223 11.918 -9.079 4.841 1.00 0.00 H ATOM 1023 H ASN B 223 8.026 -4.953 5.375 1.00 0.00 H ATOM 1024 N ILE B 224 10.845 -3.793 4.194 1.00 0.12 N ATOM 1025 CA ILE B 224 11.866 -2.853 3.725 1.00 0.11 C ATOM 1026 C ILE B 224 12.498 -2.136 4.927 1.00 0.11 C ATOM 1027 O ILE B 224 13.697 -1.850 4.937 1.00 0.14 O ATOM 1028 CB ILE B 224 11.319 -1.816 2.679 1.00 0.10 C ATOM 1029 CG1 ILE B 224 11.428 -0.380 3.189 1.00 0.23 C ATOM 1030 CG2 ILE B 224 9.878 -2.110 2.298 1.00 0.16 C ATOM 1031 CD1 ILE B 224 10.982 0.654 2.179 1.00 0.15 C ATOM 1032 H ILE B 224 9.842 -3.594 4.007 1.00 0.00 H ATOM 1033 N GLU B 225 11.685 -1.887 5.954 1.00 0.09 N ATOM 1034 CA GLU B 225 12.153 -1.258 7.186 1.00 0.13 C ATOM 1035 C GLU B 225 13.075 -2.204 7.958 1.00 0.12 C ATOM 1036 O GLU B 225 14.021 -1.770 8.616 1.00 0.13 O ATOM 1037 CB GLU B 225 10.961 -0.851 8.059 1.00 0.21 C ATOM 1038 CG GLU B 225 11.351 -0.150 9.351 1.00 0.38 C ATOM 1039 CD GLU B 225 10.151 0.283 10.168 1.00 0.76 C ATOM 1040 OE1 GLU B 225 9.377 -0.590 10.607 1.00 1.56 O ATOM 1041 OE2 GLU B 225 9.986 1.499 10.395 1.00 1.50 O ATOM 1042 H GLU B 225 10.682 -2.150 5.875 1.00 0.00 H ATOM 1043 N LEU B 226 12.797 -3.496 7.867 1.00 0.12 N ATOM 1044 CA LEU B 226 13.627 -4.506 8.510 1.00 0.14 C ATOM 1045 C LEU B 226 15.030 -4.521 7.907 1.00 0.13 C ATOM 1046 O LEU B 226 16.014 -4.701 8.623 1.00 0.19 O ATOM 1047 CB LEU B 226 12.969 -5.887 8.404 1.00 0.17 C ATOM 1048 CG LEU B 226 12.121 -6.313 9.615 1.00 0.19 C ATOM 1049 CD1 LEU B 226 11.138 -5.227 10.022 1.00 0.18 C ATOM 1050 CD2 LEU B 226 11.374 -7.598 9.305 1.00 0.23 C ATOM 1051 H LEU B 226 11.964 -3.797 7.322 1.00 0.00 H ATOM 1052 N ILE B 227 15.119 -4.301 6.593 1.00 0.09 N ATOM 1053 CA ILE B 227 16.415 -4.176 5.926 1.00 0.09 C ATOM 1054 C ILE B 227 17.138 -2.941 6.451 1.00 0.11 C ATOM 1055 O ILE B 227 18.365 -2.918 6.579 1.00 0.16 O ATOM 1056 CB ILE B 227 16.264 -4.062 4.388 1.00 0.10 C ATOM 1057 CG1 ILE B 227 15.475 -5.248 3.833 1.00 0.12 C ATOM 1058 CG2 ILE B 227 17.629 -3.983 3.710 1.00 0.10 C ATOM 1059 CD1 ILE B 227 15.216 -5.156 2.345 1.00 0.17 C ATOM 1060 H ILE B 227 14.248 -4.217 6.031 1.00 0.00 H ATOM 1061 N CYS B 228 16.355 -1.919 6.771 1.00 0.10 N ATOM 1062 CA CYS B 228 16.887 -0.687 7.322 1.00 0.13 C ATOM 1063 C CYS B 228 17.501 -0.941 8.690 1.00 0.15 C ATOM 1064 O CYS B 228 18.648 -0.583 8.933 1.00 0.17 O ATOM 1065 CB CYS B 228 15.789 0.372 7.411 1.00 0.15 C ATOM 1066 SG CYS B 228 14.953 0.694 5.839 1.00 0.15 S ATOM 1067 H CYS B 228 15.329 -2.004 6.622 1.00 0.00 H ATOM 1068 N GLN B 229 16.750 -1.606 9.558 1.00 0.17 N ATOM 1069 CA GLN B 229 17.222 -1.926 10.904 1.00 0.23 C ATOM 1070 C GLN B 229 18.537 -2.703 10.854 1.00 0.28 C ATOM 1071 O GLN B 229 19.353 -2.627 11.772 1.00 0.45 O ATOM 1072 CB GLN B 229 16.167 -2.741 11.650 1.00 0.26 C ATOM 1073 CG GLN B 229 14.843 -2.018 11.811 1.00 0.31 C ATOM 1074 CD GLN B 229 13.794 -2.870 12.494 1.00 1.13 C ATOM 1075 OE1 GLN B 229 13.794 -4.096 12.371 1.00 2.11 O ATOM 1076 NE2 GLN B 229 12.896 -2.227 13.222 1.00 1.66 N ATOM 1077 HE22 GLN B 229 12.934 -1.190 13.298 1.00 0.00 H ATOM 1078 HE21 GLN B 229 12.152 -2.758 13.718 1.00 0.00 H ATOM 1079 H GLN B 229 15.797 -1.909 9.272 1.00 0.00 H ATOM 1080 N GLU B 230 18.733 -3.444 9.773 1.00 0.23 N ATOM 1081 CA GLU B 230 19.946 -4.223 9.585 1.00 0.30 C ATOM 1082 C GLU B 230 21.126 -3.351 9.160 1.00 0.19 C ATOM 1083 O GLU B 230 22.238 -3.518 9.658 1.00 0.24 O ATOM 1084 CB GLU B 230 19.717 -5.305 8.528 1.00 0.48 C ATOM 1085 CG GLU B 230 18.746 -6.392 8.952 1.00 0.83 C ATOM 1086 CD GLU B 230 18.554 -7.439 7.876 1.00 1.02 C ATOM 1087 OE1 GLU B 230 19.564 -8.000 7.399 1.00 1.71 O ATOM 1088 OE2 GLU B 230 17.395 -7.722 7.507 1.00 1.55 O ATOM 1089 H GLU B 230 17.998 -3.469 9.038 1.00 0.00 H ATOM 1090 N ASN B 231 20.888 -2.417 8.250 1.00 0.21 N ATOM 1091 CA ASN B 231 21.992 -1.719 7.595 1.00 0.20 C ATOM 1092 C ASN B 231 22.185 -0.284 8.078 1.00 0.21 C ATOM 1093 O ASN B 231 23.279 0.263 7.925 1.00 0.24 O ATOM 1094 CB ASN B 231 21.800 -1.719 6.077 1.00 0.23 C ATOM 1095 CG ASN B 231 21.850 -3.112 5.477 1.00 0.22 C ATOM 1096 OD1 ASN B 231 22.480 -4.015 6.024 1.00 0.26 O ATOM 1097 ND2 ASN B 231 21.209 -3.288 4.331 1.00 0.21 N ATOM 1098 HD22 ASN B 231 20.687 -2.498 3.900 1.00 0.00 H ATOM 1099 HD21 ASN B 231 21.228 -4.216 3.862 1.00 0.00 H ATOM 1100 H ASN B 231 19.907 -2.179 8.000 1.00 0.00 H ATOM 1101 N GLU B 232 21.148 0.324 8.651 1.00 0.23 N ATOM 1102 CA GLU B 232 21.222 1.725 9.073 1.00 0.26 C ATOM 1103 C GLU B 232 22.368 1.961 10.048 1.00 0.27 C ATOM 1104 O GLU B 232 22.402 1.388 11.139 1.00 0.35 O ATOM 1105 CB GLU B 232 19.912 2.192 9.711 1.00 0.36 C ATOM 1106 CG GLU B 232 18.801 2.476 8.715 1.00 0.50 C ATOM 1107 CD GLU B 232 17.606 3.138 9.366 1.00 1.42 C ATOM 1108 OE1 GLU B 232 17.526 4.383 9.333 1.00 2.13 O ATOM 1109 OE2 GLU B 232 16.752 2.419 9.926 1.00 2.20 O ATOM 1110 H GLU B 232 20.267 -0.207 8.802 1.00 0.00 H ATOM 1111 N GLY B 233 23.318 2.792 9.632 1.00 0.33 N ATOM 1112 CA GLY B 233 24.445 3.134 10.479 1.00 0.46 C ATOM 1113 C GLY B 233 25.490 2.037 10.542 1.00 0.46 C ATOM 1114 O GLY B 233 26.636 2.279 10.920 1.00 0.67 O ATOM 1115 H GLY B 233 23.252 3.205 8.680 1.00 0.00 H ATOM 1116 N GLU B 234 25.096 0.834 10.160 1.00 0.34 N ATOM 1117 CA GLU B 234 25.964 -0.320 10.242 1.00 0.37 C ATOM 1118 C GLU B 234 26.764 -0.483 8.954 1.00 0.37 C ATOM 1119 O GLU B 234 27.990 -0.582 8.982 1.00 0.46 O ATOM 1120 CB GLU B 234 25.119 -1.564 10.517 1.00 0.40 C ATOM 1121 CG GLU B 234 25.928 -2.837 10.672 1.00 1.12 C ATOM 1122 CD GLU B 234 26.864 -2.795 11.860 1.00 1.38 C ATOM 1123 OE1 GLU B 234 26.379 -2.835 13.009 1.00 1.63 O ATOM 1124 OE2 GLU B 234 28.090 -2.725 11.650 1.00 2.27 O ATOM 1125 H GLU B 234 24.132 0.714 9.789 1.00 0.00 H ATOM 1126 N ASN B 235 26.073 -0.496 7.820 1.00 0.32 N ATOM 1127 CA ASN B 235 26.742 -0.678 6.537 1.00 0.41 C ATOM 1128 C ASN B 235 26.235 0.301 5.486 1.00 0.35 C ATOM 1129 O ASN B 235 26.989 1.134 4.988 1.00 0.46 O ATOM 1130 CB ASN B 235 26.565 -2.111 6.020 1.00 0.52 C ATOM 1131 CG ASN B 235 27.357 -3.130 6.815 1.00 1.41 C ATOM 1132 OD1 ASN B 235 26.858 -3.711 7.777 1.00 2.13 O ATOM 1133 ND2 ASN B 235 28.602 -3.349 6.425 1.00 2.23 N ATOM 1134 HD22 ASN B 235 28.988 -2.837 5.606 1.00 0.00 H ATOM 1135 HD21 ASN B 235 29.195 -4.033 6.937 1.00 0.00 H ATOM 1136 H ASN B 235 25.040 -0.375 7.847 1.00 0.00 H ATOM 1137 N ASP B 236 24.952 0.207 5.162 1.00 0.24 N ATOM 1138 CA ASP B 236 24.411 0.921 4.011 1.00 0.22 C ATOM 1139 C ASP B 236 23.471 2.048 4.424 1.00 0.19 C ATOM 1140 O ASP B 236 22.437 1.810 5.050 1.00 0.24 O ATOM 1141 CB ASP B 236 23.675 -0.052 3.087 1.00 0.28 C ATOM 1142 CG ASP B 236 24.566 -1.178 2.606 1.00 0.37 C ATOM 1143 OD1 ASP B 236 25.491 -0.907 1.814 1.00 1.11 O ATOM 1144 OD2 ASP B 236 24.345 -2.336 3.014 1.00 1.22 O ATOM 1145 H ASP B 236 24.321 -0.386 5.738 1.00 0.00 H ATOM 1146 N PRO B 237 23.816 3.295 4.057 1.00 0.17 N ATOM 1147 CA PRO B 237 23.001 4.476 4.366 1.00 0.18 C ATOM 1148 C PRO B 237 21.782 4.605 3.455 1.00 0.14 C ATOM 1149 O PRO B 237 20.877 5.395 3.724 1.00 0.16 O ATOM 1150 CB PRO B 237 23.966 5.636 4.131 1.00 0.25 C ATOM 1151 CG PRO B 237 24.910 5.136 3.095 1.00 0.25 C ATOM 1152 CD PRO B 237 25.047 3.655 3.325 1.00 0.22 C ATOM 1153 N VAL B 238 21.760 3.828 2.375 1.00 0.10 N ATOM 1154 CA VAL B 238 20.636 3.846 1.443 1.00 0.08 C ATOM 1155 C VAL B 238 19.322 3.565 2.162 1.00 0.09 C ATOM 1156 O VAL B 238 18.302 4.159 1.839 1.00 0.11 O ATOM 1157 CB VAL B 238 20.810 2.829 0.292 1.00 0.09 C ATOM 1158 CG1 VAL B 238 21.924 3.252 -0.640 1.00 0.12 C ATOM 1159 CG2 VAL B 238 21.085 1.445 0.841 1.00 0.10 C ATOM 1160 H VAL B 238 22.562 3.193 2.190 1.00 0.00 H ATOM 1161 N LEU B 239 19.364 2.689 3.163 1.00 0.09 N ATOM 1162 CA LEU B 239 18.163 2.316 3.903 1.00 0.12 C ATOM 1163 C LEU B 239 17.568 3.520 4.628 1.00 0.12 C ATOM 1164 O LEU B 239 16.352 3.627 4.772 1.00 0.15 O ATOM 1165 CB LEU B 239 18.455 1.189 4.904 1.00 0.15 C ATOM 1166 CG LEU B 239 18.521 -0.236 4.321 1.00 0.16 C ATOM 1167 CD1 LEU B 239 17.300 -0.542 3.489 1.00 0.22 C ATOM 1168 CD2 LEU B 239 19.762 -0.437 3.485 1.00 0.09 C ATOM 1169 H LEU B 239 20.275 2.260 3.424 1.00 0.00 H ATOM 1170 N GLN B 240 18.431 4.439 5.045 1.00 0.14 N ATOM 1171 CA GLN B 240 18.003 5.648 5.738 1.00 0.17 C ATOM 1172 C GLN B 240 16.999 6.436 4.897 1.00 0.15 C ATOM 1173 O GLN B 240 15.970 6.890 5.399 1.00 0.18 O ATOM 1174 CB GLN B 240 19.221 6.519 6.059 1.00 0.22 C ATOM 1175 CG GLN B 240 18.883 7.902 6.597 1.00 0.42 C ATOM 1176 CD GLN B 240 18.220 7.867 7.959 1.00 0.71 C ATOM 1177 OE1 GLN B 240 18.894 7.900 8.984 1.00 1.69 O ATOM 1178 NE2 GLN B 240 16.898 7.804 7.981 1.00 1.02 N ATOM 1179 HE22 GLN B 240 16.364 7.778 7.089 1.00 0.00 H ATOM 1180 HE21 GLN B 240 16.394 7.781 8.890 1.00 0.00 H ATOM 1181 H GLN B 240 19.446 4.291 4.871 1.00 0.00 H ATOM 1182 N ARG B 241 17.287 6.575 3.609 1.00 0.14 N ATOM 1183 CA ARG B 241 16.432 7.366 2.735 1.00 0.14 C ATOM 1184 C ARG B 241 15.209 6.573 2.271 1.00 0.12 C ATOM 1185 O ARG B 241 14.281 7.137 1.696 1.00 0.15 O ATOM 1186 CB ARG B 241 17.224 7.917 1.542 1.00 0.17 C ATOM 1187 CG ARG B 241 17.892 6.860 0.680 1.00 0.14 C ATOM 1188 CD ARG B 241 19.065 7.440 -0.095 1.00 0.25 C ATOM 1189 NE ARG B 241 20.084 7.986 0.803 1.00 0.99 N ATOM 1190 CZ ARG B 241 21.394 7.916 0.577 1.00 1.39 C ATOM 1191 NH1 ARG B 241 21.854 7.333 -0.524 1.00 1.29 N ATOM 1192 NH2 ARG B 241 22.243 8.433 1.456 1.00 2.11 N ATOM 1193 HE ARG B 241 19.764 8.458 1.673 1.00 0.00 H ATOM 1194 HH12 ARG B 241 22.878 7.281 -0.696 1.00 0.00 H ATOM 1195 HH11 ARG B 241 21.190 6.928 -1.215 1.00 0.00 H ATOM 1196 HH22 ARG B 241 23.267 8.380 1.283 1.00 0.00 H ATOM 1197 HH21 ARG B 241 21.884 8.891 2.318 1.00 0.00 H ATOM 1198 H ARG B 241 18.134 6.113 3.219 1.00 0.00 H ATOM 1199 N ILE B 242 15.188 5.271 2.538 1.00 0.10 N ATOM 1200 CA ILE B 242 14.003 4.476 2.232 1.00 0.09 C ATOM 1201 C ILE B 242 13.064 4.489 3.437 1.00 0.09 C ATOM 1202 O ILE B 242 11.850 4.345 3.296 1.00 0.10 O ATOM 1203 CB ILE B 242 14.331 3.017 1.841 1.00 0.10 C ATOM 1204 CG1 ILE B 242 15.742 2.912 1.278 1.00 0.12 C ATOM 1205 CG2 ILE B 242 13.332 2.522 0.797 1.00 0.10 C ATOM 1206 CD1 ILE B 242 16.190 1.489 1.057 1.00 0.15 C ATOM 1207 H ILE B 242 16.020 4.817 2.967 1.00 0.00 H ATOM 1208 N VAL B 243 13.640 4.673 4.626 1.00 0.11 N ATOM 1209 CA VAL B 243 12.853 4.939 5.829 1.00 0.11 C ATOM 1210 C VAL B 243 12.101 6.250 5.651 1.00 0.11 C ATOM 1211 O VAL B 243 10.954 6.394 6.075 1.00 0.13 O ATOM 1212 CB VAL B 243 13.741 5.024 7.096 1.00 0.11 C ATOM 1213 CG1 VAL B 243 12.936 5.478 8.304 1.00 0.14 C ATOM 1214 CG2 VAL B 243 14.392 3.684 7.383 1.00 0.15 C ATOM 1215 H VAL B 243 14.676 4.626 4.699 1.00 0.00 H ATOM 1216 N ASP B 244 12.767 7.196 4.995 1.00 0.12 N ATOM 1217 CA ASP B 244 12.159 8.469 4.630 1.00 0.16 C ATOM 1218 C ASP B 244 10.885 8.242 3.822 1.00 0.15 C ATOM 1219 O ASP B 244 9.910 8.967 3.973 1.00 0.19 O ATOM 1220 CB ASP B 244 13.154 9.314 3.826 1.00 0.22 C ATOM 1221 CG ASP B 244 12.546 10.591 3.280 1.00 0.99 C ATOM 1222 OD1 ASP B 244 12.430 11.577 4.037 1.00 1.77 O ATOM 1223 OD2 ASP B 244 12.200 10.621 2.084 1.00 1.76 O ATOM 1224 H ASP B 244 13.758 7.021 4.733 1.00 0.00 H ATOM 1225 N ILE B 245 10.905 7.217 2.978 1.00 0.12 N ATOM 1226 CA ILE B 245 9.735 6.833 2.197 1.00 0.12 C ATOM 1227 C ILE B 245 8.593 6.371 3.096 1.00 0.13 C ATOM 1228 O ILE B 245 7.464 6.850 2.979 1.00 0.16 O ATOM 1229 CB ILE B 245 10.070 5.701 1.204 1.00 0.11 C ATOM 1230 CG1 ILE B 245 10.978 6.223 0.094 1.00 0.11 C ATOM 1231 CG2 ILE B 245 8.799 5.092 0.627 1.00 0.13 C ATOM 1232 CD1 ILE B 245 11.267 5.196 -0.971 1.00 0.13 C ATOM 1233 H ILE B 245 11.783 6.671 2.871 1.00 0.00 H ATOM 1234 N LEU B 246 8.897 5.447 3.998 1.00 0.12 N ATOM 1235 CA LEU B 246 7.888 4.851 4.868 1.00 0.14 C ATOM 1236 C LEU B 246 7.294 5.880 5.824 1.00 0.18 C ATOM 1237 O LEU B 246 6.261 5.638 6.446 1.00 0.22 O ATOM 1238 CB LEU B 246 8.494 3.705 5.672 1.00 0.14 C ATOM 1239 CG LEU B 246 9.350 2.726 4.872 1.00 0.12 C ATOM 1240 CD1 LEU B 246 9.835 1.604 5.766 1.00 0.15 C ATOM 1241 CD2 LEU B 246 8.578 2.172 3.682 1.00 0.12 C ATOM 1242 H LEU B 246 9.886 5.137 4.088 1.00 0.00 H ATOM 1243 N TYR B 247 7.947 7.026 5.936 1.00 0.19 N ATOM 1244 CA TYR B 247 7.460 8.092 6.796 1.00 0.24 C ATOM 1245 C TYR B 247 7.264 9.368 5.992 1.00 0.25 C ATOM 1246 O TYR B 247 7.222 10.465 6.548 1.00 0.30 O ATOM 1247 CB TYR B 247 8.411 8.342 7.983 1.00 0.30 C ATOM 1248 CG TYR B 247 8.264 7.350 9.137 1.00 0.35 C ATOM 1249 CD1 TYR B 247 7.299 7.532 10.138 1.00 1.02 C ATOM 1250 CD2 TYR B 247 9.085 6.220 9.229 1.00 1.05 C ATOM 1251 CE1 TYR B 247 7.165 6.626 11.175 1.00 1.05 C ATOM 1252 CE2 TYR B 247 8.949 5.318 10.269 1.00 1.08 C ATOM 1253 CZ TYR B 247 7.988 5.525 11.234 1.00 0.52 C ATOM 1254 OH TYR B 247 7.849 4.625 12.266 1.00 0.63 O ATOM 1255 HH TYR B 247 7.119 4.922 12.865 1.00 0.00 H ATOM 1256 H TYR B 247 8.826 7.166 5.398 1.00 0.00 H ATOM 1257 N ALA B 248 7.148 9.220 4.679 1.00 0.23 N ATOM 1258 CA ALA B 248 6.861 10.350 3.818 1.00 0.26 C ATOM 1259 C ALA B 248 5.363 10.552 3.751 1.00 0.30 C ATOM 1260 O ALA B 248 4.632 9.692 3.257 1.00 0.33 O ATOM 1261 CB ALA B 248 7.435 10.135 2.427 1.00 0.30 C ATOM 1262 H ALA B 248 7.265 8.276 4.260 1.00 0.00 H ATOM 1263 N THR B 249 4.906 11.673 4.260 1.00 0.38 N ATOM 1264 CA THR B 249 3.490 11.923 4.347 1.00 0.47 C ATOM 1265 C THR B 249 3.085 13.115 3.494 1.00 0.66 C ATOM 1266 O THR B 249 3.147 14.263 3.932 1.00 0.79 O ATOM 1267 CB THR B 249 3.058 12.139 5.809 1.00 0.52 C ATOM 1268 OG1 THR B 249 3.964 13.041 6.460 1.00 0.59 O ATOM 1269 CG2 THR B 249 3.022 10.817 6.564 1.00 0.53 C ATOM 1270 HG1 THR B 249 3.959 13.910 5.987 1.00 0.00 H ATOM 1271 H THR B 249 5.576 12.390 4.605 1.00 0.00 H ATOM 1272 N ASP B 250 2.688 12.833 2.265 1.00 0.82 N ATOM 1273 CA ASP B 250 2.215 13.869 1.362 1.00 1.09 C ATOM 1274 C ASP B 250 0.781 14.252 1.705 1.00 1.33 C ATOM 1275 O ASP B 250 -0.177 13.739 1.130 1.00 1.68 O ATOM 1276 CB ASP B 250 2.340 13.422 -0.102 1.00 1.51 C ATOM 1277 CG ASP B 250 1.868 11.999 -0.342 1.00 2.24 C ATOM 1278 OD1 ASP B 250 2.580 11.054 0.064 1.00 2.89 O ATOM 1279 OD2 ASP B 250 0.804 11.815 -0.971 1.00 2.83 O ATOM 1280 H ASP B 250 2.715 11.847 1.937 1.00 0.00 H ATOM 1281 N GLU B 251 0.658 15.154 2.665 1.00 1.61 N ATOM 1282 CA GLU B 251 -0.632 15.617 3.150 1.00 2.18 C ATOM 1283 C GLU B 251 -0.665 17.137 3.179 1.00 2.93 C ATOM 1284 O GLU B 251 0.343 17.788 2.888 1.00 3.53 O ATOM 1285 CB GLU B 251 -0.890 15.072 4.560 1.00 2.54 C ATOM 1286 CG GLU B 251 -1.198 13.585 4.610 1.00 3.10 C ATOM 1287 CD GLU B 251 -2.654 13.284 4.331 1.00 3.55 C ATOM 1288 OE1 GLU B 251 -3.383 12.921 5.280 1.00 4.07 O ATOM 1289 OE2 GLU B 251 -3.089 13.417 3.171 1.00 3.90 O ATOM 1290 H GLU B 251 1.521 15.549 3.091 1.00 0.00 H ATOM 1291 N GLY B 252 -1.809 17.704 3.527 1.00 3.46 N ATOM 1292 CA GLY B 252 -1.889 19.136 3.708 1.00 4.52 C ATOM 1293 C GLY B 252 -1.190 19.556 4.980 1.00 5.20 C ATOM 1294 O GLY B 252 -0.350 20.460 4.979 1.00 5.97 O ATOM 1295 H GLY B 252 -2.655 17.116 3.671 1.00 0.00 H ATOM 1296 N PHE B 253 -1.523 18.872 6.063 1.00 5.21 N ATOM 1297 CA PHE B 253 -0.903 19.111 7.353 1.00 6.18 C ATOM 1298 C PHE B 253 0.427 18.366 7.428 1.00 6.30 C ATOM 1299 O PHE B 253 0.554 17.255 6.911 1.00 5.90 O ATOM 1300 CB PHE B 253 -1.845 18.648 8.469 1.00 6.67 C ATOM 1301 CG PHE B 253 -1.365 18.962 9.860 1.00 7.83 C ATOM 1302 CD1 PHE B 253 -1.540 20.226 10.396 1.00 8.52 C ATOM 1303 CD2 PHE B 253 -0.750 17.991 10.634 1.00 8.44 C ATOM 1304 CE1 PHE B 253 -1.112 20.515 11.673 1.00 9.65 C ATOM 1305 CE2 PHE B 253 -0.319 18.277 11.912 1.00 9.58 C ATOM 1306 CZ PHE B 253 -0.500 19.540 12.430 1.00 10.13 C ATOM 1307 H PHE B 253 -2.255 18.137 5.987 1.00 0.00 H ATOM 1308 N VAL B 254 1.418 18.986 8.051 1.00 7.14 N ATOM 1309 CA VAL B 254 2.734 18.377 8.182 1.00 7.72 C ATOM 1310 C VAL B 254 2.751 17.380 9.334 1.00 8.58 C ATOM 1311 O VAL B 254 2.620 17.758 10.501 1.00 9.33 O ATOM 1312 CB VAL B 254 3.833 19.438 8.405 1.00 8.48 C ATOM 1313 CG1 VAL B 254 5.198 18.782 8.550 1.00 9.30 C ATOM 1314 CG2 VAL B 254 3.843 20.442 7.263 1.00 8.01 C ATOM 1315 H VAL B 254 1.252 19.930 8.456 1.00 0.00 H ATOM 1316 N ILE B 255 2.903 16.110 8.999 1.00 8.67 N ATOM 1317 CA ILE B 255 2.929 15.050 9.993 1.00 9.68 C ATOM 1318 C ILE B 255 4.319 14.940 10.619 1.00 10.78 C ATOM 1319 O ILE B 255 5.300 14.693 9.917 1.00 10.98 O ATOM 1320 CB ILE B 255 2.539 13.691 9.371 1.00 9.70 C ATOM 1321 CG1 ILE B 255 1.172 13.787 8.681 1.00 8.77 C ATOM 1322 CG2 ILE B 255 2.526 12.596 10.429 1.00 10.96 C ATOM 1323 CD1 ILE B 255 0.043 14.199 9.602 1.00 8.95 C ATOM 1324 H ILE B 255 3.007 15.862 7.994 1.00 0.00 H ATOM 1325 N PRO B 256 4.423 15.147 11.940 1.00 11.63 N ATOM 1326 CA PRO B 256 5.694 15.035 12.661 1.00 12.76 C ATOM 1327 C PRO B 256 6.209 13.597 12.696 1.00 13.55 C ATOM 1328 O PRO B 256 5.485 12.680 13.091 1.00 13.79 O ATOM 1329 CB PRO B 256 5.360 15.514 14.082 1.00 13.42 C ATOM 1330 CG PRO B 256 4.030 16.182 13.979 1.00 12.89 C ATOM 1331 CD PRO B 256 3.319 15.519 12.838 1.00 11.71 C ATOM 1332 N ASP B 257 7.450 13.404 12.277 1.00 14.11 N ATOM 1333 CA ASP B 257 8.062 12.079 12.277 1.00 15.03 C ATOM 1334 C ASP B 257 9.530 12.181 12.656 1.00 16.02 C ATOM 1335 O ASP B 257 10.110 13.268 12.637 1.00 16.56 O ATOM 1336 CB ASP B 257 7.935 11.411 10.902 1.00 15.18 C ATOM 1337 CG ASP B 257 8.890 11.993 9.876 1.00 15.24 C ATOM 1338 OD1 ASP B 257 8.580 13.058 9.304 1.00 15.20 O ATOM 1339 OD2 ASP B 257 9.951 11.386 9.624 1.00 15.49 O ATOM 1340 H ASP B 257 8.003 14.217 11.939 1.00 0.00 H ATOM 1341 N GLU B 258 10.120 11.050 13.003 1.00 16.36 N ATOM 1342 CA GLU B 258 11.530 10.990 13.343 1.00 17.37 C ATOM 1343 C GLU B 258 12.214 9.889 12.542 1.00 18.21 C ATOM 1344 O GLU B 258 12.071 8.707 12.849 1.00 18.22 O ATOM 1345 CB GLU B 258 11.708 10.737 14.841 1.00 17.51 C ATOM 1346 CG GLU B 258 11.152 11.847 15.717 1.00 17.24 C ATOM 1347 CD GLU B 258 11.315 11.561 17.193 1.00 17.44 C ATOM 1348 OE1 GLU B 258 10.335 11.121 17.827 1.00 17.74 O ATOM 1349 OE2 GLU B 258 12.425 11.774 17.726 1.00 17.42 O ATOM 1350 H GLU B 258 9.557 10.176 13.033 1.00 0.00 H ATOM 1351 N GLY B 259 12.947 10.281 11.510 1.00 19.02 N ATOM 1352 CA GLY B 259 13.623 9.309 10.673 1.00 19.94 C ATOM 1353 C GLY B 259 15.040 9.041 11.133 1.00 20.79 C ATOM 1354 O GLY B 259 15.726 8.176 10.584 1.00 21.21 O ATOM 1355 H GLY B 259 13.038 11.295 11.298 1.00 0.00 H ATOM 1356 N GLY B 260 15.477 9.781 12.141 1.00 21.13 N ATOM 1357 CA GLY B 260 16.809 9.600 12.674 1.00 22.03 C ATOM 1358 C GLY B 260 17.813 10.510 12.003 1.00 22.54 C ATOM 1359 O GLY B 260 19.001 10.138 11.924 1.00 22.91 O ATOM 1360 OXT GLY B 260 17.413 11.602 11.544 1.00 22.67 O ATOM 1361 H GLY B 260 14.853 10.503 12.555 1.00 0.00 H TER 1362 GLY B 260 HETATM 1363 N C A 5 2.768 -1.987 -11.369 1.00 -0.07 N HETATM 1364 N1 C A 5 1.876 -3.005 -11.540 1.00 -0.15 N HETATM 1365 N2 C A 5 2.216 -4.106 -10.731 1.00 -0.21 N HETATM 1366 C C A 5 3.284 -3.707 -10.128 1.00 0.23 C HETATM 1367 S C A 5 4.187 -4.687 -9.004 1.00 -0.01 S HETATM 1368 C6 C A 5 2.848 -5.355 -7.976 1.00 0.11 C HETATM 1369 C7 C A 5 2.441 -6.740 -8.388 1.00 0.19 C HETATM 1370 O C A 5 3.184 -7.511 -8.969 1.00 -0.40 O HETATM 1371 N4 C A 5 1.179 -7.067 -8.059 1.00 -0.27 N HETATM 1372 C9 C A 5 0.681 -8.429 -8.069 1.00 0.09 C HETATM 1373 C10 C A 5 -0.486 -8.547 -8.994 1.00 0.12 C HETATM 1374 O1 C A 5 -0.307 -8.765 -10.367 1.00 -0.27 O HETATM 1375 C13 C A 5 -1.665 -8.799 -10.768 1.00 0.07 C HETATM 1376 C12 C A 5 -2.542 -8.619 -9.739 1.00 -0.08 C HETATM 1377 C11 C A 5 -1.779 -8.453 -8.599 1.00 -0.07 C HETATM 1378 H17 C A 5 -2.143 -8.281 -7.587 1.00 0.02 H HETATM 1379 H18 C A 5 -3.629 -8.608 -9.803 1.00 0.03 H HETATM 1380 H19 C A 5 -1.979 -8.954 -11.799 1.00 0.09 H HETATM 1381 H15 C A 5 0.368 -8.709 -7.052 1.00 0.07 H HETATM 1382 H16 C A 5 1.481 -9.105 -8.405 1.00 0.07 H HETATM 1383 H8 C A 5 0.552 -6.334 -7.794 1.00 0.19 H HETATM 1384 C8 C A 5 3.246 -5.388 -6.518 1.00 -0.03 C HETATM 1385 H12 C A 5 2.417 -5.796 -5.921 1.00 0.03 H HETATM 1386 H13 C A 5 3.475 -4.368 -6.177 1.00 0.03 H HETATM 1387 H14 C A 5 4.135 -6.024 -6.395 1.00 0.03 H HETATM 1388 H11 C A 5 1.977 -4.692 -8.087 1.00 0.07 H HETATM 1389 N3 C A 5 3.639 -2.458 -10.445 1.00 -0.12 N HETATM 1390 C1 C A 5 4.779 -1.625 -9.925 1.00 0.09 C HETATM 1391 C2 C A 5 4.553 -1.170 -8.453 1.00 -0.02 C HETATM 1392 C3 C A 5 5.730 -1.691 -7.626 1.00 -0.05 C HETATM 1393 C4 C A 5 6.817 -2.090 -8.606 1.00 -0.05 C HETATM 1394 C5 C A 5 6.133 -2.344 -9.957 1.00 -0.02 C HETATM 1395 H9 C A 5 6.752 -1.944 -10.774 1.00 0.03 H HETATM 1396 H10 C A 5 5.983 -3.424 -10.106 1.00 0.03 H HETATM 1397 H6 C A 5 7.321 -3.005 -8.260 1.00 0.03 H HETATM 1398 H7 C A 5 7.554 -1.280 -8.703 1.00 0.03 H HETATM 1399 H4 C A 5 5.418 -2.563 -7.032 1.00 0.03 H HETATM 1400 H5 C A 5 6.098 -0.902 -6.954 1.00 0.03 H HETATM 1401 H2 C A 5 3.611 -1.589 -8.071 1.00 0.03 H HETATM 1402 H3 C A 5 4.514 -0.072 -8.401 1.00 0.03 H HETATM 1403 H1 C A 5 4.847 -0.731 -10.563 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 682 683 690 691 692 CONECT 690 682 CONECT 691 682 CONECT 692 682 CONECT 1363 1364 1389 CONECT 1364 1363 1365 CONECT 1365 1364 1366 CONECT 1366 1365 1367 1389 CONECT 1367 1366 1368 CONECT 1368 1367 1369 1384 1388 CONECT 1369 1368 1370 1371 CONECT 1370 1369 CONECT 1371 1369 1372 1383 CONECT 1372 1371 1373 1381 1382 CONECT 1373 1372 1374 1377 CONECT 1374 1373 1375 CONECT 1375 1374 1376 1380 CONECT 1376 1375 1377 1379 CONECT 1377 1373 1376 1378 CONECT 1378 1377 CONECT 1379 1376 CONECT 1380 1375 CONECT 1381 1372 CONECT 1382 1372 CONECT 1383 1371 CONECT 1384 1368 1385 1386 1387 CONECT 1385 1384 CONECT 1386 1384 CONECT 1387 1384 CONECT 1388 1368 CONECT 1389 1363 1366 1390 CONECT 1390 1389 1391 1394 1403 CONECT 1391 1390 1392 1401 1402 CONECT 1392 1391 1393 1399 1400 CONECT 1393 1392 1394 1397 1398 CONECT 1394 1390 1393 1395 1396 CONECT 1395 1394 CONECT 1396 1394 CONECT 1397 1393 CONECT 1398 1393 CONECT 1399 1392 CONECT 1400 1392 CONECT 1401 1391 CONECT 1402 1391 CONECT 1403 1390 MASTER 0 0 0 0 0 0 0 0 1401 2 49 12 END
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Structure:
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Related entries of code: 6evq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3tq7
RCSB PDB
PDBbind
78aa, >3TQ7_1|Chain... *
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
6evq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Microtubule-associated protein RP/EB family member 1
Ligand Name
C05
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=10mM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Sci Rep Vol. 7: pp. 15533-15533
Ligand Properties
Formula
C
1
4
H
1
9
N
5
O
2
S
Molecular Weight
321.398
Exact Mass
321.126
No. of atoms
41
No. of bonds
43
Polar Surface Area
111.14
LOGP Value
1.92 (
Computed with XLOGP3
)
2.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
O=C([C@H](Sc1nnnn1C1CCCC1)C)NCc1ccco1
InChI String
InChI=1S/C14H19N5O2S/c1-10(13(20)15-9-12-7-4-8-21-12)22-14-16-17-18-19(14)11-5-2-3-6-11/h4,7-8,10-11H,2-3,5-6,9H2,1H3,(H,15,20)/t10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q61166
Entrez Gene ID
NCBI Entrez Gene ID:
13589
ASD
Information of known allosteric effects of PDB entries
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