Browse entries in the PDBbind-CN Database
HEADER 4JYT_COMPLEX COMPND 4JYT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 241 VAL VAL GLY GLY THR ASP ALA ASP GLU GLY GLU TRP PRO SEQRES 2 A 241 TRP GLN VAL SER LEU HIS ALA LEU GLY GLN GLY HIS ILE SEQRES 3 A 241 CYS GLY ALA SER LEU ILE SER PRO ASN TRP LEU VAL SER SEQRES 4 A 241 ALA ALA HIS CYS TYR ILE ASP ASP ARG GLY PHE ARG TYR SEQRES 5 A 241 SER ASP PRO THR GLN TRP THR ALA PHE LEU GLY LEU HIS SEQRES 6 A 241 ASP GLN SER GLN ARG SER ALA PRO GLY VAL GLN GLU ARG SEQRES 7 A 241 ARG LEU LYS ARG ILE ILE SER HIS PRO PHE PHE ASN ASP SEQRES 8 A 241 PHE THR PHE ASP TYR ASP ILE ALA LEU LEU GLU LEU GLU SEQRES 9 A 241 LYS PRO ALA GLU TYR SER SER MET VAL ARG PRO ILE CYS SEQRES 10 A 241 LEU PRO ASP ALA SER HIS VAL PHE PRO ALA GLY LYS ALA SEQRES 11 A 241 ILE TRP VAL THR GLY TRP GLY HIS THR GLN TYR GLY GLY SEQRES 12 A 241 THR GLY ALA LEU ILE LEU GLN LYS GLY GLU ILE ARG VAL SEQRES 13 A 241 ILE ASN GLN THR THR CYS GLU ASN LEU LEU PRO GLN GLN SEQRES 14 A 241 ILE THR PRO ARG MET MET CYS VAL GLY PHE LEU SER GLY SEQRES 15 A 241 GLY VAL ASP SER CYS GLN GLY ASP SER GLY GLY PRO LEU SEQRES 16 A 241 SER SER VAL GLU ALA ASP GLY ARG ILE PHE GLN ALA GLY SEQRES 17 A 241 VAL VAL SER TRP GLY ASP GLY CYS ALA GLN ARG ASN LYS SEQRES 18 A 241 PRO GLY VAL TYR THR ARG LEU PRO LEU PHE ARG ASP TRP SEQRES 19 A 241 ILE LYS GLU ASN THR GLY VAL HET N A 4A 66 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 168 CYS A 182 SSBOND 3 CYS A 191 CYS A 220 ATOM 1 N VAL A 16 26.400 58.504 20.303 1.00 12.73 N ATOM 2 CA VAL A 16 26.771 57.223 20.969 1.00 13.07 C ATOM 3 C VAL A 16 27.948 57.497 21.888 1.00 13.19 C ATOM 4 O VAL A 16 28.972 58.037 21.433 1.00 12.76 O ATOM 5 CB VAL A 16 27.152 56.105 19.938 1.00 12.63 C ATOM 6 CG1 VAL A 16 27.414 54.771 20.637 1.00 11.95 C ATOM 7 CG2 VAL A 16 26.037 55.914 18.920 1.00 12.97 C ATOM 8 HN3 VAL A 16 27.211 58.856 19.755 1.00 0.00 H ATOM 9 HN2 VAL A 16 26.138 59.205 21.025 1.00 0.00 H ATOM 10 HN1 VAL A 16 25.594 58.342 19.667 1.00 0.00 H ATOM 11 N VAL A 17 27.782 57.146 23.164 1.00 13.07 N ATOM 12 CA VAL A 17 28.847 57.250 24.171 1.00 13.46 C ATOM 13 C VAL A 17 29.501 55.886 24.324 1.00 13.52 C ATOM 14 O VAL A 17 28.817 54.876 24.359 1.00 12.75 O ATOM 15 CB VAL A 17 28.312 57.650 25.552 1.00 13.58 C ATOM 16 CG1 VAL A 17 29.460 57.807 26.565 1.00 14.59 C ATOM 17 CG2 VAL A 17 27.468 58.945 25.494 1.00 13.10 C ATOM 18 H VAL A 17 26.854 56.781 23.460 1.00 0.00 H ATOM 19 N GLY A 18 30.822 55.862 24.428 1.00 13.72 N ATOM 20 CA GLY A 18 31.537 54.610 24.609 1.00 14.32 C ATOM 21 C GLY A 18 31.604 53.757 23.355 1.00 14.62 C ATOM 22 O GLY A 18 31.828 52.541 23.430 1.00 15.27 O ATOM 23 H GLY A 18 31.355 56.753 24.379 1.00 0.00 H ATOM 24 N GLY A 19 31.456 54.387 22.199 1.00 14.33 N ATOM 25 CA GLY A 19 31.474 53.649 20.923 1.00 14.81 C ATOM 26 C GLY A 19 32.748 53.872 20.128 1.00 14.42 C ATOM 27 O GLY A 19 33.680 54.515 20.607 1.00 14.10 O ATOM 28 H GLY A 19 31.325 55.419 22.192 1.00 0.00 H ATOM 29 N THR A 20 32.753 53.353 18.904 1.00 14.69 N ATOM 30 CA THR A 20 33.901 53.437 17.990 1.00 14.94 C ATOM 31 C THR A 20 33.397 53.858 16.613 1.00 14.82 C ATOM 32 O THR A 20 32.204 53.691 16.312 1.00 13.98 O ATOM 33 CB THR A 20 34.614 52.043 17.810 1.00 15.40 C ATOM 34 OG1 THR A 20 33.664 51.056 17.379 1.00 15.44 O ATOM 35 CG2 THR A 20 35.258 51.569 19.111 1.00 16.50 C ATOM 36 HG1 THR A 20 33.270 51.334 16.515 1.00 0.00 H ATOM 37 H THR A 20 31.898 52.861 18.575 1.00 0.00 H ATOM 38 N ASP A 21 34.294 54.408 15.786 1.00 14.24 N ATOM 39 CA ASP A 21 33.964 54.684 14.389 1.00 15.12 C ATOM 40 C ASP A 21 33.468 53.422 13.709 1.00 15.00 C ATOM 41 O ASP A 21 34.090 52.374 13.841 1.00 14.65 O ATOM 42 CB ASP A 21 35.190 55.160 13.604 1.00 14.91 C ATOM 43 CG ASP A 21 35.692 56.487 14.074 1.00 16.32 C ATOM 44 OD1 ASP A 21 35.040 57.113 14.930 1.00 16.08 O ATOM 45 OD2 ASP A 21 36.746 56.892 13.574 1.00 19.00 O ATOM 46 H ASP A 21 35.242 54.643 16.143 1.00 0.00 H ATOM 47 N ALA A 22 32.356 53.532 12.987 1.00 15.29 N ATOM 48 CA ALA A 22 31.899 52.454 12.121 1.00 15.78 C ATOM 49 C ALA A 22 32.820 52.404 10.909 1.00 16.09 C ATOM 50 O ALA A 22 33.473 53.391 10.588 1.00 15.52 O ATOM 51 CB ALA A 22 30.439 52.699 11.666 1.00 15.10 C ATOM 52 H ALA A 22 31.800 54.409 13.042 1.00 0.00 H ATOM 53 N ASP A 23 32.866 51.253 10.241 1.00 17.12 N ATOM 54 CA ASP A 23 33.505 51.165 8.929 1.00 17.47 C ATOM 55 C ASP A 23 32.534 51.732 7.927 1.00 17.60 C ATOM 56 O ASP A 23 31.320 51.663 8.118 1.00 16.84 O ATOM 57 CB ASP A 23 33.787 49.725 8.522 1.00 18.32 C ATOM 58 CG ASP A 23 34.681 49.013 9.472 1.00 19.65 C ATOM 59 OD1 ASP A 23 35.494 49.675 10.135 1.00 22.27 O ATOM 60 OD2 ASP A 23 34.556 47.769 9.541 1.00 24.63 O ATOM 61 H ASP A 23 32.440 50.402 10.660 1.00 0.00 H ATOM 62 N GLU A 24 33.073 52.298 6.855 1.00 18.04 N ATOM 63 CA GLU A 24 32.252 52.799 5.764 1.00 18.09 C ATOM 64 C GLU A 24 31.354 51.674 5.261 1.00 17.67 C ATOM 65 O GLU A 24 31.811 50.560 5.061 1.00 17.58 O ATOM 66 CB GLU A 24 33.144 53.331 4.635 1.00 18.64 C ATOM 67 CG GLU A 24 32.458 54.331 3.735 1.00 20.16 C ATOM 68 CD GLU A 24 33.266 55.239 2.874 1.00 19.89 C ATOM 69 OE1 GLU A 24 32.719 56.049 2.096 1.00 20.08 O ATOM 70 OE2 GLU A 24 34.390 54.741 2.654 1.00 20.08 O ATOM 71 H GLU A 24 34.107 52.386 6.793 1.00 0.00 H ATOM 72 N GLY A 25 30.059 51.948 5.127 1.00 17.26 N ATOM 73 CA GLY A 25 29.115 50.951 4.626 1.00 16.55 C ATOM 74 C GLY A 25 28.718 49.839 5.591 1.00 16.02 C ATOM 75 O GLY A 25 28.004 48.919 5.195 1.00 15.57 O ATOM 76 H GLY A 25 29.710 52.893 5.385 1.00 0.00 H ATOM 77 N GLU A 26 29.139 49.935 6.853 1.00 15.07 N ATOM 78 CA GLU A 26 28.894 48.882 7.839 1.00 14.51 C ATOM 79 C GLU A 26 27.428 48.828 8.252 1.00 14.16 C ATOM 80 O GLU A 26 26.926 47.765 8.560 1.00 14.28 O ATOM 81 CB GLU A 26 29.765 49.083 9.075 1.00 14.18 C ATOM 82 CG GLU A 26 29.740 47.938 10.060 1.00 14.33 C ATOM 83 CD GLU A 26 30.705 48.129 11.225 1.00 15.06 C ATOM 84 OE1 GLU A 26 31.141 49.281 11.477 1.00 12.43 O ATOM 85 OE2 GLU A 26 31.023 47.117 11.897 1.00 17.91 O ATOM 86 H GLU A 26 29.659 50.787 7.146 1.00 0.00 H ATOM 87 N TRP A 27 26.751 49.974 8.256 1.00 13.29 N ATOM 88 CA TRP A 27 25.351 50.060 8.614 1.00 12.85 C ATOM 89 C TRP A 27 24.616 50.800 7.483 1.00 12.35 C ATOM 90 O TRP A 27 24.235 51.965 7.619 1.00 12.09 O ATOM 91 CB TRP A 27 25.207 50.765 9.984 1.00 12.93 C ATOM 92 CG TRP A 27 26.222 50.280 10.973 1.00 13.03 C ATOM 93 CD1 TRP A 27 27.452 50.837 11.226 1.00 12.84 C ATOM 94 CD2 TRP A 27 26.132 49.109 11.804 1.00 12.35 C ATOM 95 NE1 TRP A 27 28.130 50.080 12.157 1.00 12.55 N ATOM 96 CE2 TRP A 27 27.336 49.028 12.544 1.00 12.96 C ATOM 97 CE3 TRP A 27 25.148 48.129 12.004 1.00 13.11 C ATOM 98 CZ2 TRP A 27 27.577 48.012 13.474 1.00 12.78 C ATOM 99 CZ3 TRP A 27 25.393 47.108 12.931 1.00 12.88 C ATOM 100 CH2 TRP A 27 26.597 47.062 13.650 1.00 13.29 C ATOM 101 HE1 TRP A 27 29.089 50.274 12.510 1.00 0.00 H ATOM 102 H TRP A 27 27.250 50.847 7.990 1.00 0.00 H ATOM 103 N PRO A 28 24.433 50.123 6.335 1.00 12.16 N ATOM 104 CA PRO A 28 23.858 50.758 5.151 1.00 12.04 C ATOM 105 C PRO A 28 22.358 51.120 5.241 1.00 11.96 C ATOM 106 O PRO A 28 21.824 51.773 4.329 1.00 11.14 O ATOM 107 CB PRO A 28 24.129 49.733 4.045 1.00 12.45 C ATOM 108 CG PRO A 28 24.240 48.419 4.766 1.00 12.39 C ATOM 109 CD PRO A 28 24.795 48.714 6.094 1.00 11.35 C ATOM 110 N TRP A 29 21.711 50.699 6.326 1.00 11.17 N ATOM 111 CA TRP A 29 20.355 51.105 6.668 1.00 11.56 C ATOM 112 C TRP A 29 20.316 52.350 7.556 1.00 11.44 C ATOM 113 O TRP A 29 19.235 52.912 7.776 1.00 10.35 O ATOM 114 CB TRP A 29 19.616 49.968 7.382 1.00 11.84 C ATOM 115 CG TRP A 29 20.487 49.190 8.316 1.00 12.69 C ATOM 116 CD1 TRP A 29 20.748 49.466 9.641 1.00 12.00 C ATOM 117 CD2 TRP A 29 21.243 48.012 7.995 1.00 13.10 C ATOM 118 NE1 TRP A 29 21.602 48.518 10.153 1.00 11.67 N ATOM 119 CE2 TRP A 29 21.941 47.632 9.164 1.00 11.90 C ATOM 120 CE3 TRP A 29 21.401 47.248 6.834 1.00 12.42 C ATOM 121 CZ2 TRP A 29 22.762 46.509 9.209 1.00 11.46 C ATOM 122 CZ3 TRP A 29 22.224 46.144 6.878 1.00 12.81 C ATOM 123 CH2 TRP A 29 22.901 45.784 8.064 1.00 12.13 C ATOM 124 HE1 TRP A 29 21.938 48.479 11.136 1.00 0.00 H ATOM 125 H TRP A 29 22.202 50.043 6.966 1.00 0.00 H ATOM 126 N GLN A 30 21.462 52.772 8.096 1.00 11.28 N ATOM 127 CA GLN A 30 21.477 53.966 8.953 1.00 12.04 C ATOM 128 C GLN A 30 21.366 55.237 8.097 1.00 12.66 C ATOM 129 O GLN A 30 22.127 55.423 7.138 1.00 12.64 O ATOM 130 CB GLN A 30 22.740 54.031 9.831 1.00 11.76 C ATOM 131 CG GLN A 30 22.899 55.356 10.597 1.00 11.20 C ATOM 132 CD GLN A 30 22.031 55.458 11.852 1.00 11.00 C ATOM 133 OE1 GLN A 30 22.070 54.587 12.715 1.00 10.24 O ATOM 134 NE2 GLN A 30 21.276 56.553 11.973 1.00 10.53 N ATOM 135 HE22 GLN A 30 21.272 57.268 11.218 1.00 0.00 H ATOM 136 HE21 GLN A 30 20.692 56.691 12.823 1.00 0.00 H ATOM 137 H GLN A 30 22.345 52.255 7.910 1.00 0.00 H ATOM 138 N VAL A 31 20.441 56.114 8.493 1.00 12.84 N ATOM 139 CA VAL A 31 20.072 57.308 7.725 1.00 12.82 C ATOM 140 C VAL A 31 20.216 58.522 8.642 1.00 12.95 C ATOM 141 O VAL A 31 19.985 58.416 9.848 1.00 12.13 O ATOM 142 CB VAL A 31 18.629 57.170 7.193 1.00 13.02 C ATOM 143 CG1 VAL A 31 18.192 58.411 6.442 1.00 13.73 C ATOM 144 CG2 VAL A 31 18.526 55.949 6.262 1.00 12.90 C ATOM 145 H VAL A 31 19.955 55.941 9.396 1.00 0.00 H ATOM 146 N SER A 32 20.645 59.648 8.073 1.00 13.37 N ATOM 147 CA SER A 32 20.757 60.924 8.783 1.00 13.39 C ATOM 148 C SER A 32 19.647 61.891 8.324 1.00 14.02 C ATOM 149 O SER A 32 19.533 62.200 7.127 1.00 14.27 O ATOM 150 CB SER A 32 22.134 61.541 8.515 1.00 13.43 C ATOM 151 OG SER A 32 22.316 62.793 9.170 1.00 11.69 O ATOM 152 HG SER A 32 22.225 62.669 10.148 1.00 0.00 H ATOM 153 H SER A 32 20.915 59.619 7.069 1.00 0.00 H ATOM 154 N LEU A 33 18.825 62.353 9.267 1.00 13.99 N ATOM 155 CA LEU A 33 17.852 63.405 8.988 1.00 14.67 C ATOM 156 C LEU A 33 18.354 64.793 9.402 1.00 14.77 C ATOM 157 O LEU A 33 18.636 65.055 10.593 1.00 14.88 O ATOM 158 CB LEU A 33 16.491 63.096 9.632 1.00 14.62 C ATOM 159 CG LEU A 33 15.543 62.225 8.792 1.00 15.24 C ATOM 160 CD1 LEU A 33 14.905 63.021 7.658 1.00 15.56 C ATOM 161 CD2 LEU A 33 16.242 60.984 8.240 1.00 13.83 C ATOM 162 H LEU A 33 18.878 61.954 10.226 1.00 0.00 H ATOM 163 N HIS A 34 18.449 65.668 8.401 1.00 15.28 N ATOM 164 CA HIS A 34 18.779 67.091 8.575 1.00 15.48 C ATOM 165 C HIS A 34 17.547 67.971 8.416 1.00 15.71 C ATOM 166 O HIS A 34 16.778 67.798 7.449 1.00 15.25 O ATOM 167 CB HIS A 34 19.779 67.536 7.510 1.00 15.55 C ATOM 168 CG HIS A 34 21.154 66.969 7.686 1.00 16.96 C ATOM 169 ND1 HIS A 34 22.297 67.708 7.461 1.00 16.87 N ATOM 170 CD2 HIS A 34 21.571 65.744 8.089 1.00 17.49 C ATOM 171 CE1 HIS A 34 23.357 66.964 7.717 1.00 18.14 C ATOM 172 NE2 HIS A 34 22.945 65.763 8.093 1.00 17.21 N ATOM 173 H HIS A 34 18.279 65.323 7.435 1.00 0.00 H ATOM 174 N ALA A 35 17.368 68.914 9.346 1.00 15.86 N ATOM 175 CA ALA A 35 16.326 69.933 9.235 1.00 16.79 C ATOM 176 C ALA A 35 16.971 71.145 8.575 1.00 17.61 C ATOM 177 O ALA A 35 18.111 71.489 8.886 1.00 17.93 O ATOM 178 CB ALA A 35 15.752 70.300 10.606 1.00 15.94 C ATOM 179 H ALA A 35 17.992 68.923 10.178 1.00 0.00 H ATOM 180 N LEU A 36 16.256 71.792 7.662 1.00 19.46 N ATOM 181 CA LEU A 36 16.877 72.816 6.828 1.00 19.63 C ATOM 182 C LEU A 36 17.540 73.900 7.679 1.00 19.94 C ATOM 183 O LEU A 36 16.916 74.492 8.558 1.00 19.77 O ATOM 184 CB LEU A 36 15.872 73.409 5.831 1.00 20.74 C ATOM 185 CG LEU A 36 16.463 74.113 4.594 1.00 21.53 C ATOM 186 CD1 LEU A 36 17.779 73.534 4.055 1.00 24.33 C ATOM 187 CD2 LEU A 36 15.774 74.772 3.587 1.00 20.01 C ATOM 188 H LEU A 36 15.248 71.568 7.541 1.00 0.00 H ATOM 189 N GLY A 37 18.841 74.073 7.463 1.00 20.28 N ATOM 190 CA GLY A 37 19.633 75.086 8.152 1.00 20.38 C ATOM 191 C GLY A 37 20.111 74.694 9.530 1.00 20.57 C ATOM 192 O GLY A 37 20.709 75.510 10.222 1.00 21.22 O ATOM 193 H GLY A 37 19.315 73.458 6.771 1.00 0.00 H ATOM 194 N GLN A 38 19.867 73.447 9.935 1.00 20.36 N ATOM 195 CA GLN A 38 20.226 72.990 11.277 1.00 20.21 C ATOM 196 C GLN A 38 21.195 71.812 11.310 1.00 19.71 C ATOM 197 O GLN A 38 21.675 71.451 12.374 1.00 20.38 O ATOM 198 CB GLN A 38 18.962 72.608 12.049 1.00 20.68 C ATOM 199 CG GLN A 38 18.015 73.762 12.304 1.00 22.61 C ATOM 200 CD GLN A 38 16.735 73.319 12.976 1.00 22.21 C ATOM 201 OE1 GLN A 38 16.733 72.388 13.778 1.00 25.75 O ATOM 202 NE2 GLN A 38 15.635 73.994 12.658 1.00 26.73 N ATOM 203 HE22 GLN A 38 15.684 74.775 11.974 1.00 0.00 H ATOM 204 HE21 GLN A 38 14.725 73.741 13.094 1.00 0.00 H ATOM 205 H GLN A 38 19.409 72.782 9.279 1.00 0.00 H ATOM 206 N GLY A 39 21.487 71.202 10.166 1.00 18.55 N ATOM 207 CA GLY A 39 22.310 70.004 10.137 1.00 17.83 C ATOM 208 C GLY A 39 21.593 68.782 10.687 1.00 17.01 C ATOM 209 O GLY A 39 20.364 68.775 10.828 1.00 16.99 O ATOM 210 H GLY A 39 21.119 71.589 9.274 1.00 0.00 H ATOM 211 N HIS A 40 22.365 67.748 11.000 1.00 16.03 N ATOM 212 CA HIS A 40 21.816 66.513 11.547 1.00 15.59 C ATOM 213 C HIS A 40 21.061 66.734 12.859 1.00 15.03 C ATOM 214 O HIS A 40 21.611 67.293 13.824 1.00 14.27 O ATOM 215 CB HIS A 40 22.913 65.487 11.807 1.00 15.62 C ATOM 216 CG HIS A 40 22.421 64.269 12.533 1.00 15.10 C ATOM 217 ND1 HIS A 40 22.046 63.116 11.882 1.00 13.53 N ATOM 218 CD2 HIS A 40 22.251 64.027 13.853 1.00 14.76 C ATOM 219 CE1 HIS A 40 21.649 62.221 12.770 1.00 15.06 C ATOM 220 NE2 HIS A 40 21.762 62.749 13.974 1.00 13.71 N ATOM 221 H HIS A 40 23.392 67.821 10.851 1.00 0.00 H ATOM 222 N ILE A 41 19.831 66.241 12.897 1.00 14.39 N ATOM 223 CA ILE A 41 18.986 66.291 14.097 1.00 14.07 C ATOM 224 C ILE A 41 18.625 64.893 14.644 1.00 13.16 C ATOM 225 O ILE A 41 18.631 64.659 15.860 1.00 12.41 O ATOM 226 CB ILE A 41 17.669 67.016 13.768 1.00 14.63 C ATOM 227 CG1 ILE A 41 17.935 68.440 13.271 1.00 16.51 C ATOM 228 CG2 ILE A 41 16.734 67.040 14.982 1.00 14.37 C ATOM 229 CD1 ILE A 41 18.554 69.375 14.345 1.00 17.91 C ATOM 230 H ILE A 41 19.447 65.799 12.038 1.00 0.00 H ATOM 231 N CYS A 42 18.221 63.986 13.757 1.00 12.39 N ATOM 232 CA CYS A 42 17.895 62.619 14.163 1.00 11.11 C ATOM 233 C CYS A 42 18.393 61.597 13.154 1.00 11.50 C ATOM 234 O CYS A 42 18.778 61.939 12.028 1.00 11.62 O ATOM 235 CB CYS A 42 16.391 62.462 14.334 1.00 11.17 C ATOM 236 SG CYS A 42 15.746 63.208 15.845 1.00 5.28 S ATOM 237 H CYS A 42 18.136 64.255 12.756 1.00 0.00 H ATOM 238 N GLY A 43 18.358 60.343 13.578 1.00 11.05 N ATOM 239 CA GLY A 43 18.612 59.218 12.702 1.00 10.94 C ATOM 240 C GLY A 43 17.315 58.648 12.224 1.00 10.81 C ATOM 241 O GLY A 43 16.212 59.048 12.665 1.00 11.29 O ATOM 242 H GLY A 43 18.140 60.159 14.578 1.00 0.00 H ATOM 243 N ALA A 44 17.452 57.693 11.326 1.00 11.04 N ATOM 244 CA ALA A 44 16.350 56.886 10.849 1.00 10.98 C ATOM 245 C ALA A 44 16.916 55.590 10.272 1.00 10.86 C ATOM 246 O ALA A 44 18.140 55.371 10.269 1.00 10.22 O ATOM 247 CB ALA A 44 15.532 57.649 9.826 1.00 10.95 C ATOM 248 H ALA A 44 18.401 57.510 10.941 1.00 0.00 H ATOM 249 N SER A 45 16.026 54.705 9.842 1.00 11.20 N ATOM 250 CA SER A 45 16.438 53.440 9.251 1.00 11.45 C ATOM 251 C SER A 45 15.671 53.213 7.967 1.00 11.93 C ATOM 252 O SER A 45 14.469 53.466 7.914 1.00 12.96 O ATOM 253 CB SER A 45 16.217 52.286 10.224 1.00 11.17 C ATOM 254 OG SER A 45 14.869 52.215 10.649 1.00 11.17 O ATOM 255 HG SER A 45 14.762 51.458 11.277 1.00 0.00 H ATOM 256 H SER A 45 15.012 54.920 9.929 1.00 0.00 H ATOM 257 N LEU A 46 16.372 52.755 6.936 1.00 11.81 N ATOM 258 CA LEU A 46 15.753 52.420 5.655 1.00 12.46 C ATOM 259 C LEU A 46 15.088 51.037 5.754 1.00 12.73 C ATOM 260 O LEU A 46 15.744 50.075 6.146 1.00 13.01 O ATOM 261 CB LEU A 46 16.841 52.409 4.569 1.00 12.55 C ATOM 262 CG LEU A 46 16.410 52.136 3.123 1.00 11.72 C ATOM 263 CD1 LEU A 46 15.584 53.269 2.539 1.00 12.71 C ATOM 264 CD2 LEU A 46 17.617 51.883 2.314 1.00 11.83 C ATOM 265 H LEU A 46 17.399 52.630 7.044 1.00 0.00 H ATOM 266 N ILE A 47 13.797 50.935 5.425 1.00 12.75 N ATOM 267 CA ILE A 47 13.094 49.645 5.499 1.00 12.98 C ATOM 268 C ILE A 47 12.573 49.115 4.168 1.00 12.81 C ATOM 269 O ILE A 47 12.214 47.954 4.066 1.00 13.11 O ATOM 270 CB ILE A 47 11.933 49.663 6.538 1.00 13.00 C ATOM 271 CG1 ILE A 47 10.853 50.669 6.149 1.00 12.93 C ATOM 272 CG2 ILE A 47 12.499 49.942 7.949 1.00 13.37 C ATOM 273 CD1 ILE A 47 9.568 50.498 6.920 1.00 13.61 C ATOM 274 H ILE A 47 13.281 51.782 5.111 1.00 0.00 H ATOM 275 N SER A 48 12.502 49.968 3.166 1.00 13.37 N ATOM 276 CA SER A 48 12.102 49.576 1.814 1.00 13.54 C ATOM 277 C SER A 48 12.640 50.699 0.934 1.00 13.70 C ATOM 278 O SER A 48 13.238 51.635 1.464 1.00 13.30 O ATOM 279 CB SER A 48 10.580 49.483 1.710 1.00 13.50 C ATOM 280 OG SER A 48 10.012 50.781 1.815 1.00 12.93 O ATOM 281 HG SER A 48 9.027 50.715 1.747 1.00 0.00 H ATOM 282 H SER A 48 12.741 50.964 3.344 1.00 0.00 H ATOM 283 N PRO A 49 12.448 50.614 -0.400 1.00 13.66 N ATOM 284 CA PRO A 49 12.942 51.732 -1.213 1.00 14.42 C ATOM 285 C PRO A 49 12.289 53.086 -0.908 1.00 14.33 C ATOM 286 O PRO A 49 12.900 54.119 -1.157 1.00 13.68 O ATOM 287 CB PRO A 49 12.644 51.286 -2.661 1.00 14.55 C ATOM 288 CG PRO A 49 12.451 49.795 -2.576 1.00 14.59 C ATOM 289 CD PRO A 49 11.844 49.555 -1.230 1.00 13.44 C ATOM 290 N ASN A 50 11.078 53.074 -0.339 1.00 15.25 N ATOM 291 CA ASN A 50 10.289 54.288 -0.143 1.00 15.14 C ATOM 292 C ASN A 50 10.062 54.747 1.294 1.00 14.98 C ATOM 293 O ASN A 50 9.509 55.832 1.514 1.00 14.96 O ATOM 294 CB ASN A 50 8.936 54.100 -0.813 1.00 16.31 C ATOM 295 CG ASN A 50 9.069 53.838 -2.303 1.00 17.83 C ATOM 296 OD1 ASN A 50 8.824 52.731 -2.771 1.00 23.01 O ATOM 297 ND2 ASN A 50 9.499 54.840 -3.039 1.00 18.83 N ATOM 298 HD22 ASN A 50 9.694 55.762 -2.599 1.00 0.00 H ATOM 299 HD21 ASN A 50 9.644 54.710 -4.061 1.00 0.00 H ATOM 300 H ASN A 50 10.683 52.165 -0.024 1.00 0.00 H ATOM 301 N TRP A 51 10.502 53.948 2.262 1.00 14.10 N ATOM 302 CA TRP A 51 10.140 54.186 3.645 1.00 13.59 C ATOM 303 C TRP A 51 11.313 54.088 4.616 1.00 12.74 C ATOM 304 O TRP A 51 12.183 53.233 4.473 1.00 12.23 O ATOM 305 CB TRP A 51 9.040 53.211 4.059 1.00 13.86 C ATOM 306 CG TRP A 51 7.748 53.515 3.402 1.00 13.97 C ATOM 307 CD1 TRP A 51 7.253 52.941 2.275 1.00 14.56 C ATOM 308 CD2 TRP A 51 6.776 54.480 3.824 1.00 14.85 C ATOM 309 NE1 TRP A 51 6.037 53.485 1.956 1.00 15.13 N ATOM 310 CE2 TRP A 51 5.707 54.424 2.897 1.00 15.94 C ATOM 311 CE3 TRP A 51 6.700 55.381 4.893 1.00 15.07 C ATOM 312 CZ2 TRP A 51 4.576 55.235 3.005 1.00 15.58 C ATOM 313 CZ3 TRP A 51 5.575 56.189 4.999 1.00 15.46 C ATOM 314 CH2 TRP A 51 4.524 56.108 4.052 1.00 15.04 C ATOM 315 HE1 TRP A 51 5.458 53.227 1.132 1.00 0.00 H ATOM 316 H TRP A 51 11.114 53.142 2.023 1.00 0.00 H ATOM 317 N LEU A 52 11.285 54.984 5.599 1.00 12.00 N ATOM 318 CA LEU A 52 12.184 54.971 6.734 1.00 11.65 C ATOM 319 C LEU A 52 11.385 54.855 8.027 1.00 11.22 C ATOM 320 O LEU A 52 10.251 55.310 8.100 1.00 11.21 O ATOM 321 CB LEU A 52 12.991 56.266 6.807 1.00 11.19 C ATOM 322 CG LEU A 52 13.591 56.888 5.541 1.00 10.85 C ATOM 323 CD1 LEU A 52 14.281 58.197 5.878 1.00 10.81 C ATOM 324 CD2 LEU A 52 14.541 55.923 4.841 1.00 10.71 C ATOM 325 H LEU A 52 10.573 55.741 5.549 1.00 0.00 H ATOM 326 N VAL A 53 12.000 54.254 9.037 1.00 11.32 N ATOM 327 CA VAL A 53 11.500 54.278 10.432 1.00 11.20 C ATOM 328 C VAL A 53 12.327 55.284 11.231 1.00 10.91 C ATOM 329 O VAL A 53 13.533 55.369 11.069 1.00 10.55 O ATOM 330 CB VAL A 53 11.591 52.868 11.082 1.00 10.97 C ATOM 331 CG1 VAL A 53 11.304 52.910 12.592 1.00 12.15 C ATOM 332 CG2 VAL A 53 10.620 51.926 10.424 1.00 11.30 C ATOM 333 H VAL A 53 12.881 53.738 8.839 1.00 0.00 H ATOM 334 N SER A 54 11.671 56.047 12.095 1.00 11.74 N ATOM 335 CA SER A 54 12.344 57.021 12.966 1.00 11.40 C ATOM 336 C SER A 54 11.497 57.199 14.232 1.00 11.71 C ATOM 337 O SER A 54 10.558 56.414 14.470 1.00 11.91 O ATOM 338 CB SER A 54 12.567 58.348 12.218 1.00 10.96 C ATOM 339 OG SER A 54 13.551 59.160 12.859 1.00 10.12 O ATOM 340 HG SER A 54 14.412 58.672 12.889 1.00 0.00 H ATOM 341 H SER A 54 10.637 55.952 12.159 1.00 0.00 H ATOM 342 N ALA A 55 11.850 58.197 15.046 1.00 11.62 N ATOM 343 CA ALA A 55 11.170 58.484 16.297 1.00 11.64 C ATOM 344 C ALA A 55 10.223 59.666 16.121 1.00 11.97 C ATOM 345 O ALA A 55 10.598 60.696 15.553 1.00 11.73 O ATOM 346 CB ALA A 55 12.183 58.782 17.396 1.00 12.06 C ATOM 347 H ALA A 55 12.652 58.799 14.770 1.00 0.00 H ATOM 348 N ALA A 56 9.072 59.649 16.752 1.00 11.73 N ATOM 349 CA ALA A 56 8.055 60.689 16.608 1.00 11.71 C ATOM 350 C ALA A 56 8.514 62.030 17.142 1.00 11.50 C ATOM 351 O ALA A 56 8.196 63.087 16.697 1.00 11.59 O ATOM 352 CB ALA A 56 6.797 60.289 17.331 1.00 11.81 C ATOM 353 H ALA A 56 8.873 58.852 17.389 1.00 0.00 H ATOM 354 N HIS A 57 9.210 61.878 18.197 1.00 11.45 N ATOM 355 CA HIS A 57 9.640 63.100 18.939 1.00 11.53 C ATOM 356 C HIS A 57 10.620 63.963 18.198 1.00 11.64 C ATOM 357 O HIS A 57 10.913 65.025 18.587 1.00 11.24 O ATOM 358 CB HIS A 57 10.163 62.850 20.360 1.00 10.93 C ATOM 359 CG HIS A 57 11.613 62.494 20.472 1.00 11.25 C ATOM 360 ND1 HIS A 57 12.049 61.198 20.593 1.00 12.80 N ATOM 361 CD2 HIS A 57 12.718 63.260 20.596 1.00 14.00 C ATOM 362 CE1 HIS A 57 13.358 61.185 20.762 1.00 13.20 C ATOM 363 NE2 HIS A 57 13.792 62.423 20.739 1.00 9.17 N ATOM 364 H HIS A 57 9.472 60.929 18.533 1.00 0.00 H ATOM 365 N CYS A 58 11.144 63.414 17.132 1.00 12.09 N ATOM 366 CA CYS A 58 11.967 64.268 16.362 1.00 12.87 C ATOM 367 C CYS A 58 11.116 65.233 15.450 1.00 13.55 C ATOM 368 O CYS A 58 11.724 66.105 14.860 1.00 12.64 O ATOM 369 CB CYS A 58 12.918 63.443 15.510 1.00 12.47 C ATOM 370 SG CYS A 58 14.101 62.436 16.396 1.00 13.72 S ATOM 371 H CYS A 58 10.968 62.423 16.870 1.00 0.00 H ATOM 372 N TYR A 59 9.793 64.976 15.297 1.00 13.01 N ATOM 373 CA TYR A 59 9.140 65.759 14.357 1.00 13.31 C ATOM 374 C TYR A 59 8.092 66.656 15.081 1.00 13.85 C ATOM 375 O TYR A 59 6.993 66.730 14.508 1.00 14.19 O ATOM 376 CB TYR A 59 8.671 64.792 13.250 1.00 12.89 C ATOM 377 CG TYR A 59 9.877 63.921 12.790 1.00 12.52 C ATOM 378 CD1 TYR A 59 10.831 64.442 11.960 1.00 11.12 C ATOM 379 CD2 TYR A 59 10.114 62.658 13.293 1.00 12.56 C ATOM 380 CE1 TYR A 59 11.923 63.722 11.592 1.00 11.88 C ATOM 381 CE2 TYR A 59 11.214 61.887 12.932 1.00 11.85 C ATOM 382 CZ TYR A 59 12.149 62.450 12.062 1.00 12.92 C ATOM 383 OH TYR A 59 13.259 61.796 11.696 1.00 12.07 O ATOM 384 HH TYR A 59 13.799 61.589 12.500 1.00 0.00 H ATOM 385 H TYR A 59 9.302 64.242 15.847 1.00 0.00 H ATOM 386 N ILE A 60 8.449 67.266 16.274 1.00 14.15 N ATOM 387 CA ILE A 60 7.514 68.135 17.017 1.00 15.00 C ATOM 388 C ILE A 60 7.862 69.607 16.781 1.00 15.33 C ATOM 389 O ILE A 60 9.004 70.016 16.976 1.00 14.39 O ATOM 390 CB ILE A 60 7.556 67.853 18.530 1.00 15.08 C ATOM 391 CG1 ILE A 60 7.126 66.417 18.824 1.00 15.44 C ATOM 392 CG2 ILE A 60 6.662 68.831 19.303 1.00 14.40 C ATOM 393 CD1 ILE A 60 7.417 65.992 20.234 1.00 15.77 C ATOM 394 H ILE A 60 9.403 67.107 16.657 1.00 0.00 H ATOM 395 N ASP A 60A 6.929 70.390 16.473 1.00 11.10 N ATOM 396 CA ASP A 60A 7.183 71.825 16.311 1.00 12.67 C ATOM 397 C ASP A 60A 7.586 72.520 17.597 1.00 14.42 C ATOM 398 O ASP A 60A 7.167 72.127 18.690 1.00 13.96 O ATOM 399 CB ASP A 60A 5.919 72.562 15.861 1.00 14.30 C ATOM 400 CG ASP A 60A 5.465 72.208 14.476 1.00 16.19 C ATOM 401 OD1 ASP A 60A 6.213 71.559 13.728 1.00 13.22 O ATOM 402 OD2 ASP A 60A 4.333 72.616 14.118 1.00 18.15 O ATOM 403 H ASP A 60A 5.968 70.017 16.332 1.00 0.00 H ATOM 404 N ASP A 60B 8.390 73.564 17.476 1.00 14.60 N ATOM 405 CA ASP A 60B 8.676 74.385 18.646 1.00 15.83 C ATOM 406 C ASP A 60B 8.442 75.812 18.142 1.00 16.11 C ATOM 407 O ASP A 60B 8.205 76.006 16.946 1.00 14.97 O ATOM 408 CB ASP A 60B 10.066 74.131 19.256 1.00 17.61 C ATOM 409 CG ASP A 60B 11.207 74.614 18.408 1.00 19.51 C ATOM 410 OD1 ASP A 60B 11.004 75.484 17.546 1.00 21.20 O ATOM 411 OD2 ASP A 60B 12.333 74.125 18.644 1.00 23.40 O ATOM 412 H ASP A 60B 8.814 73.796 16.555 1.00 0.00 H ATOM 413 N ARG A 60C 8.226 76.667 18.865 1.00 16.91 N ATOM 414 CA ARG A 60C 7.930 78.034 18.442 1.00 16.60 C ATOM 415 C ARG A 60C 8.758 78.619 17.313 1.00 15.80 C ATOM 416 O ARG A 60C 8.286 79.523 16.623 1.00 17.61 O ATOM 417 CB ARG A 60C 8.039 78.950 19.651 1.00 20.00 C ATOM 418 H ARG A 60C 8.241 76.462 19.884 1.00 0.00 H ATOM 419 N GLY A 60D 9.974 78.128 17.110 1.00 14.72 N ATOM 420 CA GLY A 60D 10.784 78.689 16.044 1.00 14.21 C ATOM 421 C GLY A 60D 10.998 77.827 14.813 1.00 13.88 C ATOM 422 O GLY A 60D 11.596 78.298 13.848 1.00 13.70 O ATOM 423 H GLY A 60D 10.340 77.356 17.703 1.00 0.00 H ATOM 424 N PHE A 60E 10.508 76.589 14.816 1.00 12.98 N ATOM 425 CA PHE A 60E 10.718 75.708 13.668 1.00 11.31 C ATOM 426 C PHE A 60E 9.660 74.603 13.578 1.00 10.45 C ATOM 427 O PHE A 60E 9.350 73.939 14.570 1.00 10.00 O ATOM 428 CB PHE A 60E 12.111 75.098 13.775 1.00 12.01 C ATOM 429 CG PHE A 60E 12.621 74.541 12.490 1.00 10.64 C ATOM 430 CD1 PHE A 60E 12.311 73.237 12.108 1.00 10.18 C ATOM 431 CD2 PHE A 60E 13.349 75.344 11.621 1.00 12.49 C ATOM 432 CE1 PHE A 60E 12.719 72.733 10.854 1.00 9.82 C ATOM 433 CE2 PHE A 60E 13.764 74.858 10.363 1.00 11.87 C ATOM 434 CZ PHE A 60E 13.446 73.548 9.983 1.00 11.42 C ATOM 435 H PHE A 60E 9.973 76.247 15.639 1.00 0.00 H ATOM 436 N ARG A 60F 9.115 74.406 12.375 1.00 9.90 N ATOM 437 CA ARG A 60F 8.090 73.400 12.158 1.00 9.82 C ATOM 438 C ARG A 60F 8.676 72.038 11.809 1.00 9.31 C ATOM 439 O ARG A 60F 8.653 71.610 10.645 1.00 10.09 O ATOM 440 CB ARG A 60F 7.136 73.823 11.038 1.00 13.72 C ATOM 441 CG ARG A 60F 6.198 74.985 11.371 1.00 19.81 C ATOM 442 CD ARG A 60F 4.877 74.819 10.611 1.00 24.21 C ATOM 443 NE ARG A 60F 5.082 74.726 9.168 1.00 28.36 N ATOM 444 CZ ARG A 60F 4.273 74.080 8.328 1.00 29.54 C ATOM 445 NH1 ARG A 60F 3.194 73.453 8.780 1.00 31.23 N ATOM 446 NH2 ARG A 60F 4.540 74.071 7.030 1.00 29.86 N ATOM 447 HE ARG A 60F 5.918 75.197 8.767 1.00 0.00 H ATOM 448 HH12 ARG A 60F 2.568 72.952 8.118 1.00 0.00 H ATOM 449 HH11 ARG A 60F 2.974 73.463 9.796 1.00 0.00 H ATOM 450 HH22 ARG A 60F 3.910 73.568 6.373 1.00 0.00 H ATOM 451 HH21 ARG A 60F 5.379 74.567 6.668 1.00 0.00 H ATOM 452 H ARG A 60F 9.432 74.987 11.573 1.00 0.00 H ATOM 453 N TYR A 60G 9.192 71.348 12.820 1.00 8.14 N ATOM 454 CA TYR A 60G 9.766 70.018 12.585 1.00 8.30 C ATOM 455 C TYR A 60G 8.750 69.006 12.065 1.00 7.10 C ATOM 456 O TYR A 60G 9.127 67.946 11.546 1.00 7.75 O ATOM 457 CB TYR A 60G 10.406 69.507 13.869 1.00 7.62 C ATOM 458 CG TYR A 60G 11.611 70.308 14.308 1.00 8.39 C ATOM 459 CD1 TYR A 60G 12.859 70.140 13.694 1.00 8.80 C ATOM 460 CD2 TYR A 60G 11.506 71.255 15.342 1.00 9.04 C ATOM 461 CE1 TYR A 60G 13.966 70.881 14.100 1.00 9.84 C ATOM 462 CE2 TYR A 60G 12.606 72.004 15.733 1.00 11.53 C ATOM 463 CZ TYR A 60G 13.824 71.809 15.118 1.00 10.12 C ATOM 464 OH TYR A 60G 14.930 72.523 15.514 1.00 14.62 O ATOM 465 HH TYR A 60G 15.709 72.254 14.966 1.00 0.00 H ATOM 466 H TYR A 60G 9.189 71.751 13.779 1.00 0.00 H ATOM 467 N SER A 60H 7.453 69.267 12.219 1.00 8.33 N ATOM 468 CA SER A 60H 6.439 68.338 11.732 1.00 8.84 C ATOM 469 C SER A 60H 6.170 68.437 10.232 1.00 8.86 C ATOM 470 O SER A 60H 5.471 67.601 9.683 1.00 10.64 O ATOM 471 CB SER A 60H 5.104 68.562 12.457 1.00 10.16 C ATOM 472 OG SER A 60H 4.534 69.814 12.087 1.00 12.47 O ATOM 473 HG SER A 60H 5.157 70.544 12.330 1.00 0.00 H ATOM 474 H SER A 60H 7.159 70.145 12.693 1.00 0.00 H ATOM 475 N ASP A 60I 6.725 69.453 9.576 1.00 8.93 N ATOM 476 CA ASP A 60I 6.499 69.688 8.148 1.00 9.20 C ATOM 477 C ASP A 60I 7.518 68.884 7.344 1.00 9.11 C ATOM 478 O ASP A 60I 8.705 69.162 7.419 1.00 7.35 O ATOM 479 CB ASP A 60I 6.649 71.196 7.892 1.00 11.42 C ATOM 480 CG ASP A 60I 6.516 71.583 6.429 1.00 13.78 C ATOM 481 OD1 ASP A 60I 6.328 70.690 5.574 1.00 13.11 O ATOM 482 OD2 ASP A 60I 6.598 72.813 6.161 1.00 16.76 O ATOM 483 H ASP A 60I 7.344 70.106 10.098 1.00 0.00 H ATOM 484 N PRO A 61 7.070 67.879 6.567 1.00 8.55 N ATOM 485 CA PRO A 61 8.004 67.067 5.780 1.00 8.98 C ATOM 486 C PRO A 61 8.918 67.837 4.850 1.00 8.46 C ATOM 487 O PRO A 61 10.042 67.409 4.593 1.00 8.15 O ATOM 488 CB PRO A 61 7.093 66.098 5.015 1.00 9.23 C ATOM 489 CG PRO A 61 5.812 66.824 4.921 1.00 12.79 C ATOM 490 CD PRO A 61 5.680 67.488 6.282 1.00 9.62 C ATOM 491 N THR A 62 8.458 68.997 4.379 1.00 8.82 N ATOM 492 CA THR A 62 9.267 69.791 3.447 1.00 10.35 C ATOM 493 C THR A 62 10.483 70.456 4.083 1.00 10.31 C ATOM 494 O THR A 62 11.348 70.975 3.369 1.00 11.66 O ATOM 495 CB THR A 62 8.414 70.879 2.726 1.00 11.10 C ATOM 496 OG1 THR A 62 8.053 71.896 3.661 1.00 12.84 O ATOM 497 CG2 THR A 62 7.178 70.251 2.086 1.00 13.74 C ATOM 498 HG1 THR A 62 7.525 71.495 4.396 1.00 0.00 H ATOM 499 H THR A 62 7.522 69.340 4.674 1.00 0.00 H ATOM 500 N GLN A 63 10.591 70.396 5.406 1.00 8.42 N ATOM 501 CA GLN A 63 11.715 71.009 6.119 1.00 9.73 C ATOM 502 C GLN A 63 12.885 70.059 6.306 1.00 10.50 C ATOM 503 O GLN A 63 13.876 70.440 6.936 1.00 13.93 O ATOM 504 CB GLN A 63 11.263 71.437 7.523 1.00 12.74 C ATOM 505 CG GLN A 63 10.012 72.300 7.558 1.00 14.33 C ATOM 506 CD GLN A 63 10.267 73.703 7.034 1.00 16.53 C ATOM 507 OE1 GLN A 63 11.022 74.468 7.631 1.00 17.74 O ATOM 508 NE2 GLN A 63 9.639 74.041 5.912 1.00 18.44 N ATOM 509 HE22 GLN A 63 9.010 73.359 5.443 1.00 0.00 H ATOM 510 HE21 GLN A 63 9.777 74.987 5.504 1.00 0.00 H ATOM 511 H GLN A 63 9.857 69.900 5.951 1.00 0.00 H ATOM 512 N TRP A 64 12.791 68.863 5.739 1.00 8.39 N ATOM 513 CA TRP A 64 13.796 67.830 5.965 1.00 7.49 C ATOM 514 C TRP A 64 14.547 67.329 4.754 1.00 8.67 C ATOM 515 O TRP A 64 14.082 67.430 3.627 1.00 9.33 O ATOM 516 CB TRP A 64 13.100 66.620 6.613 1.00 6.37 C ATOM 517 CG TRP A 64 12.570 66.902 7.974 1.00 6.68 C ATOM 518 CD1 TRP A 64 11.311 67.352 8.313 1.00 7.33 C ATOM 519 CD2 TRP A 64 13.277 66.744 9.192 1.00 5.66 C ATOM 520 NE1 TRP A 64 11.208 67.470 9.674 1.00 7.63 N ATOM 521 CE2 TRP A 64 12.400 67.101 10.247 1.00 6.11 C ATOM 522 CE3 TRP A 64 14.575 66.328 9.502 1.00 6.04 C ATOM 523 CZ2 TRP A 64 12.777 67.050 11.594 1.00 6.34 C ATOM 524 CZ3 TRP A 64 14.961 66.275 10.851 1.00 6.31 C ATOM 525 CH2 TRP A 64 14.056 66.633 11.882 1.00 5.78 C ATOM 526 HE1 TRP A 64 10.363 67.788 10.190 1.00 0.00 H ATOM 527 H TRP A 64 11.982 68.657 5.119 1.00 0.00 H ATOM 528 N THR A 65 15.724 66.777 5.019 1.00 7.26 N ATOM 529 CA THR A 65 16.525 66.106 3.993 1.00 8.23 C ATOM 530 C THR A 65 17.077 64.837 4.638 1.00 7.94 C ATOM 531 O THR A 65 17.559 64.874 5.760 1.00 8.17 O ATOM 532 CB THR A 65 17.729 66.931 3.513 1.00 9.10 C ATOM 533 OG1 THR A 65 17.263 68.165 2.955 1.00 12.35 O ATOM 534 CG2 THR A 65 18.490 66.177 2.431 1.00 11.43 C ATOM 535 HG1 THR A 65 18.037 68.699 2.645 1.00 0.00 H ATOM 536 H THR A 65 16.091 66.822 5.991 1.00 0.00 H ATOM 537 N ALA A 66 16.950 63.715 3.943 1.00 7.04 N ATOM 538 CA ALA A 66 17.496 62.442 4.426 1.00 6.55 C ATOM 539 C ALA A 66 18.743 62.113 3.624 1.00 7.53 C ATOM 540 O ALA A 66 18.755 62.224 2.389 1.00 9.23 O ATOM 541 CB ALA A 66 16.486 61.325 4.248 1.00 7.80 C ATOM 542 H ALA A 66 16.450 63.738 3.031 1.00 0.00 H ATOM 543 N PHE A 67 19.806 61.743 4.320 1.00 5.91 N ATOM 544 CA PHE A 67 21.028 61.316 3.648 1.00 6.62 C ATOM 545 C PHE A 67 21.208 59.816 3.895 1.00 7.02 C ATOM 546 O PHE A 67 21.299 59.367 5.049 1.00 6.78 O ATOM 547 CB PHE A 67 22.246 62.079 4.165 1.00 7.72 C ATOM 548 CG PHE A 67 22.230 63.529 3.805 1.00 8.57 C ATOM 549 CD1 PHE A 67 21.721 64.468 4.686 1.00 9.56 C ATOM 550 CD2 PHE A 67 22.716 63.957 2.556 1.00 10.05 C ATOM 551 CE1 PHE A 67 21.689 65.825 4.344 1.00 10.43 C ATOM 552 CE2 PHE A 67 22.688 65.304 2.207 1.00 12.14 C ATOM 553 CZ PHE A 67 22.173 66.239 3.104 1.00 11.93 C ATOM 554 H PHE A 67 19.770 61.757 5.359 1.00 0.00 H ATOM 555 N LEU A 68 21.220 59.046 2.819 1.00 7.37 N ATOM 556 CA LEU A 68 21.411 57.595 2.859 1.00 6.63 C ATOM 557 C LEU A 68 22.839 57.308 2.386 1.00 8.46 C ATOM 558 O LEU A 68 23.370 58.036 1.520 1.00 7.86 O ATOM 559 CB LEU A 68 20.404 56.909 1.920 1.00 7.98 C ATOM 560 CG LEU A 68 18.935 57.215 2.263 1.00 10.28 C ATOM 561 CD1 LEU A 68 18.456 58.324 1.370 1.00 14.86 C ATOM 562 CD2 LEU A 68 18.067 55.971 2.115 1.00 13.27 C ATOM 563 H LEU A 68 21.086 59.497 1.892 1.00 0.00 H ATOM 564 N GLY A 69 23.449 56.267 2.934 1.00 7.02 N ATOM 565 CA GLY A 69 24.813 55.935 2.549 1.00 7.98 C ATOM 566 C GLY A 69 25.852 56.891 3.101 1.00 9.00 C ATOM 567 O GLY A 69 26.989 56.922 2.616 1.00 9.42 O ATOM 568 H GLY A 69 22.953 55.687 3.640 1.00 0.00 H ATOM 569 N LEU A 70 25.480 57.670 4.112 1.00 7.92 N ATOM 570 CA LEU A 70 26.381 58.644 4.710 1.00 6.98 C ATOM 571 C LEU A 70 27.327 58.014 5.720 1.00 8.00 C ATOM 572 O LEU A 70 26.971 57.081 6.441 1.00 8.12 O ATOM 573 CB LEU A 70 25.558 59.740 5.420 1.00 7.03 C ATOM 574 CG LEU A 70 26.377 60.936 5.918 1.00 7.13 C ATOM 575 CD1 LEU A 70 26.943 61.697 4.719 1.00 8.50 C ATOM 576 CD2 LEU A 70 25.504 61.855 6.777 1.00 7.34 C ATOM 577 H LEU A 70 24.514 57.581 4.488 1.00 0.00 H ATOM 578 N HIS A 71 28.554 58.528 5.768 1.00 7.16 N ATOM 579 CA HIS A 71 29.522 58.064 6.733 1.00 7.51 C ATOM 580 C HIS A 71 29.983 59.243 7.616 1.00 7.05 C ATOM 581 O HIS A 71 29.939 59.163 8.850 1.00 7.30 O ATOM 582 CB HIS A 71 30.730 57.457 6.009 1.00 8.59 C ATOM 583 CG HIS A 71 31.765 56.902 6.927 1.00 9.68 C ATOM 584 ND1 HIS A 71 31.526 55.817 7.743 1.00 11.21 N ATOM 585 CD2 HIS A 71 33.042 57.285 7.168 1.00 10.51 C ATOM 586 CE1 HIS A 71 32.612 55.551 8.446 1.00 11.25 C ATOM 587 NE2 HIS A 71 33.546 56.427 8.119 1.00 12.94 N ATOM 588 H HIS A 71 28.820 59.278 5.098 1.00 0.00 H ATOM 589 N ASP A 72 30.423 60.322 6.963 1.00 7.21 N ATOM 590 CA ASP A 72 30.973 61.502 7.629 1.00 8.32 C ATOM 591 C ASP A 72 30.084 62.716 7.334 1.00 7.14 C ATOM 592 O ASP A 72 29.815 63.024 6.175 1.00 8.34 O ATOM 593 CB ASP A 72 32.407 61.682 7.073 1.00 9.43 C ATOM 594 CG ASP A 72 33.181 62.816 7.707 1.00 12.28 C ATOM 595 OD1 ASP A 72 34.428 62.762 7.618 1.00 16.01 O ATOM 596 OD2 ASP A 72 32.599 63.762 8.262 1.00 12.66 O ATOM 597 H ASP A 72 30.372 60.323 5.924 1.00 0.00 H ATOM 598 N GLN A 73 29.587 63.368 8.394 1.00 8.37 N ATOM 599 CA GLN A 73 28.721 64.541 8.265 1.00 8.83 C ATOM 600 C GLN A 73 29.374 65.698 7.504 1.00 9.25 C ATOM 601 O GLN A 73 28.675 66.580 6.989 1.00 11.00 O ATOM 602 CB GLN A 73 28.277 65.043 9.653 1.00 7.36 C ATOM 603 CG GLN A 73 27.267 64.123 10.373 1.00 7.95 C ATOM 604 CD GLN A 73 25.896 64.094 9.721 1.00 8.11 C ATOM 605 OE1 GLN A 73 25.511 65.000 9.011 1.00 8.81 O ATOM 606 NE2 GLN A 73 25.143 63.044 9.995 1.00 8.03 N ATOM 607 HE22 GLN A 73 25.509 62.288 10.608 1.00 0.00 H ATOM 608 HE21 GLN A 73 24.184 62.974 9.598 1.00 0.00 H ATOM 609 H GLN A 73 29.826 63.027 9.347 1.00 0.00 H ATOM 610 N SER A 74 30.711 65.715 7.458 1.00 9.44 N ATOM 611 CA SER A 74 31.414 66.771 6.734 1.00 10.85 C ATOM 612 C SER A 74 31.620 66.408 5.255 1.00 11.01 C ATOM 613 O SER A 74 32.130 67.225 4.483 1.00 13.59 O ATOM 614 CB SER A 74 32.767 67.065 7.381 1.00 12.96 C ATOM 615 OG SER A 74 33.664 65.974 7.298 1.00 14.88 O ATOM 616 HG SER A 74 33.272 65.190 7.759 1.00 0.00 H ATOM 617 H SER A 74 31.254 64.971 7.941 1.00 0.00 H ATOM 618 N GLN A 75 31.194 65.216 4.842 1.00 9.45 N ATOM 619 CA GLN A 75 31.359 64.763 3.455 1.00 9.44 C ATOM 620 C GLN A 75 30.040 64.196 2.950 1.00 9.46 C ATOM 621 O GLN A 75 29.940 63.012 2.582 1.00 9.56 O ATOM 622 CB GLN A 75 32.479 63.704 3.392 1.00 10.55 C ATOM 623 CG GLN A 75 33.863 64.206 3.856 1.00 12.76 C ATOM 624 CD GLN A 75 34.440 65.284 2.949 1.00 14.96 C ATOM 625 OE1 GLN A 75 34.255 65.241 1.740 1.00 18.39 O ATOM 626 NE2 GLN A 75 35.149 66.243 3.531 1.00 18.11 N ATOM 627 HE22 GLN A 75 35.280 66.239 4.563 1.00 0.00 H ATOM 628 HE21 GLN A 75 35.573 66.998 2.955 1.00 0.00 H ATOM 629 H GLN A 75 30.729 64.584 5.525 1.00 0.00 H ATOM 630 N ARG A 76 29.027 65.061 2.909 1.00 9.57 N ATOM 631 CA ARG A 76 27.695 64.620 2.512 1.00 10.82 C ATOM 632 C ARG A 76 27.488 64.449 1.027 1.00 11.33 C ATOM 633 O ARG A 76 26.446 63.975 0.600 1.00 14.25 O ATOM 634 CB ARG A 76 26.625 65.552 3.088 1.00 12.17 C ATOM 635 CG ARG A 76 26.664 65.561 4.602 1.00 13.76 C ATOM 636 CD ARG A 76 25.407 66.175 5.171 1.00 15.17 C ATOM 637 NE ARG A 76 25.306 67.605 4.885 1.00 15.91 N ATOM 638 CZ ARG A 76 25.829 68.565 5.644 1.00 18.13 C ATOM 639 NH1 ARG A 76 26.511 68.270 6.750 1.00 20.07 N ATOM 640 NH2 ARG A 76 25.627 69.837 5.317 1.00 21.04 N ATOM 641 HE ARG A 76 24.790 67.892 4.029 1.00 0.00 H ATOM 642 HH12 ARG A 76 26.913 69.032 7.332 1.00 0.00 H ATOM 643 HH11 ARG A 76 26.641 67.277 7.031 1.00 0.00 H ATOM 644 HH22 ARG A 76 26.031 70.595 5.903 1.00 0.00 H ATOM 645 HH21 ARG A 76 25.065 70.074 4.475 1.00 0.00 H ATOM 646 H ARG A 76 29.188 66.057 3.162 1.00 0.00 H ATOM 647 N SER A 77 28.490 64.843 0.246 1.00 11.73 N ATOM 648 CA SER A 77 28.428 64.698 -1.206 1.00 13.22 C ATOM 649 C SER A 77 29.401 63.623 -1.695 1.00 11.54 C ATOM 650 O SER A 77 29.655 63.497 -2.894 1.00 11.56 O ATOM 651 CB SER A 77 28.739 66.036 -1.892 1.00 14.36 C ATOM 652 OG SER A 77 27.701 66.971 -1.631 1.00 19.78 O ATOM 653 HG SER A 77 27.911 67.829 -2.077 1.00 0.00 H ATOM 654 H SER A 77 29.337 65.264 0.679 1.00 0.00 H ATOM 655 N ALA A 77A 29.930 62.843 -0.766 1.00 10.23 N ATOM 656 CA ALA A 77A 30.863 61.782 -1.123 1.00 9.77 C ATOM 657 C ALA A 77A 30.214 60.751 -2.034 1.00 9.75 C ATOM 658 O ALA A 77A 28.999 60.584 -2.052 1.00 9.34 O ATOM 659 CB ALA A 77A 31.375 61.114 0.128 1.00 10.28 C ATOM 660 H ALA A 77A 29.677 62.989 0.232 1.00 0.00 H ATOM 661 N PRO A 78 31.025 60.021 -2.815 1.00 9.47 N ATOM 662 CA PRO A 78 30.459 59.011 -3.711 1.00 10.36 C ATOM 663 C PRO A 78 29.590 58.035 -2.930 1.00 9.93 C ATOM 664 O PRO A 78 29.964 57.594 -1.851 1.00 10.43 O ATOM 665 CB PRO A 78 31.700 58.312 -4.285 1.00 11.37 C ATOM 666 CG PRO A 78 32.727 59.409 -4.291 1.00 11.74 C ATOM 667 CD PRO A 78 32.493 60.080 -2.945 1.00 11.14 C ATOM 668 N GLY A 79 28.427 57.721 -3.484 1.00 10.15 N ATOM 669 CA GLY A 79 27.539 56.778 -2.832 1.00 10.56 C ATOM 670 C GLY A 79 26.513 57.363 -1.875 1.00 9.36 C ATOM 671 O GLY A 79 25.551 56.674 -1.528 1.00 9.78 O ATOM 672 H GLY A 79 28.151 58.152 -4.389 1.00 0.00 H ATOM 673 N VAL A 80 26.704 58.598 -1.436 1.00 7.91 N ATOM 674 CA VAL A 80 25.721 59.209 -0.543 1.00 8.74 C ATOM 675 C VAL A 80 24.536 59.635 -1.396 1.00 8.98 C ATOM 676 O VAL A 80 24.711 60.192 -2.489 1.00 10.67 O ATOM 677 CB VAL A 80 26.294 60.432 0.180 1.00 7.85 C ATOM 678 CG1 VAL A 80 25.235 61.015 1.128 1.00 9.43 C ATOM 679 CG2 VAL A 80 27.516 60.041 0.971 1.00 8.89 C ATOM 680 H VAL A 80 27.549 59.130 -1.725 1.00 0.00 H ATOM 681 N GLN A 81 23.329 59.357 -0.918 1.00 7.93 N ATOM 682 CA GLN A 81 22.117 59.729 -1.639 1.00 7.83 C ATOM 683 C GLN A 81 21.327 60.723 -0.807 1.00 8.62 C ATOM 684 O GLN A 81 21.094 60.511 0.389 1.00 10.03 O ATOM 685 CB GLN A 81 21.249 58.500 -1.908 1.00 8.75 C ATOM 686 CG GLN A 81 21.861 57.518 -2.895 1.00 10.05 C ATOM 687 CD GLN A 81 21.086 56.228 -3.006 1.00 10.73 C ATOM 688 OE1 GLN A 81 19.858 56.218 -2.928 1.00 12.44 O ATOM 689 NE2 GLN A 81 21.789 55.133 -3.209 1.00 10.63 N ATOM 690 HE22 GLN A 81 22.826 55.184 -3.269 1.00 0.00 H ATOM 691 HE21 GLN A 81 21.307 54.217 -3.310 1.00 0.00 H ATOM 692 H GLN A 81 23.246 58.862 -0.007 1.00 0.00 H ATOM 693 N GLU A 82 20.899 61.800 -1.444 1.00 8.80 N ATOM 694 CA GLU A 82 20.120 62.840 -0.780 1.00 10.17 C ATOM 695 C GLU A 82 18.668 62.697 -1.221 1.00 8.67 C ATOM 696 O GLU A 82 18.380 62.536 -2.417 1.00 9.25 O ATOM 697 CB GLU A 82 20.670 64.220 -1.184 1.00 12.61 C ATOM 698 CG GLU A 82 19.880 65.405 -0.633 1.00 15.44 C ATOM 699 CD GLU A 82 20.423 66.769 -1.054 1.00 18.74 C ATOM 700 OE1 GLU A 82 19.830 67.780 -0.624 1.00 18.90 O ATOM 701 OE2 GLU A 82 21.422 66.841 -1.814 1.00 20.38 O ATOM 702 H GLU A 82 21.125 61.910 -2.453 1.00 0.00 H ATOM 703 N ARG A 83 17.741 62.745 -0.265 1.00 8.16 N ATOM 704 CA ARG A 83 16.329 62.626 -0.583 1.00 7.72 C ATOM 705 C ARG A 83 15.481 63.568 0.246 1.00 8.03 C ATOM 706 O ARG A 83 15.796 63.867 1.394 1.00 9.48 O ATOM 707 CB ARG A 83 15.833 61.195 -0.298 1.00 7.95 C ATOM 708 CG ARG A 83 16.399 60.125 -1.219 1.00 7.43 C ATOM 709 CD ARG A 83 15.902 60.289 -2.664 1.00 9.28 C ATOM 710 NE ARG A 83 16.325 59.165 -3.491 1.00 9.79 N ATOM 711 CZ ARG A 83 17.507 59.069 -4.090 1.00 10.14 C ATOM 712 NH1 ARG A 83 18.422 60.031 -3.973 1.00 9.70 N ATOM 713 NH2 ARG A 83 17.766 57.985 -4.831 1.00 11.25 N ATOM 714 HE ARG A 83 15.653 58.382 -3.621 1.00 0.00 H ATOM 715 HH12 ARG A 83 19.341 59.935 -4.450 1.00 0.00 H ATOM 716 HH11 ARG A 83 18.217 60.877 -3.404 1.00 0.00 H ATOM 717 HH22 ARG A 83 18.685 57.889 -5.309 1.00 0.00 H ATOM 718 HH21 ARG A 83 17.049 57.239 -4.929 1.00 0.00 H ATOM 719 H ARG A 83 18.033 62.870 0.725 1.00 0.00 H ATOM 720 N ARG A 84 14.388 64.034 -0.336 1.00 7.64 N ATOM 721 CA ARG A 84 13.433 64.814 0.428 1.00 7.07 C ATOM 722 C ARG A 84 12.334 63.873 0.920 1.00 7.21 C ATOM 723 O ARG A 84 12.285 62.688 0.536 1.00 8.26 O ATOM 724 CB ARG A 84 12.868 65.955 -0.414 1.00 9.03 C ATOM 725 CG ARG A 84 13.970 66.984 -0.619 1.00 12.34 C ATOM 726 CD ARG A 84 13.595 68.303 -1.232 1.00 15.76 C ATOM 727 NE ARG A 84 14.819 69.099 -1.273 1.00 14.80 N ATOM 728 CZ ARG A 84 14.985 70.224 -1.972 1.00 16.66 C ATOM 729 NH1 ARG A 84 14.014 70.746 -2.726 1.00 14.84 N ATOM 730 NH2 ARG A 84 16.160 70.837 -1.910 1.00 19.49 N ATOM 731 HE ARG A 84 15.627 68.762 -0.712 1.00 0.00 H ATOM 732 HH12 ARG A 84 14.183 71.625 -3.256 1.00 0.00 H ATOM 733 HH11 ARG A 84 13.089 70.274 -2.783 1.00 0.00 H ATOM 734 HH22 ARG A 84 16.317 71.715 -2.444 1.00 0.00 H ATOM 735 HH21 ARG A 84 16.924 70.439 -1.327 1.00 0.00 H ATOM 736 H ARG A 84 14.213 63.841 -1.343 1.00 0.00 H ATOM 737 N LEU A 85 11.498 64.389 1.815 1.00 7.39 N ATOM 738 CA LEU A 85 10.385 63.620 2.363 1.00 7.25 C ATOM 739 C LEU A 85 9.074 64.126 1.803 1.00 9.17 C ATOM 740 O LEU A 85 8.887 65.337 1.639 1.00 11.26 O ATOM 741 CB LEU A 85 10.341 63.738 3.891 1.00 8.67 C ATOM 742 CG LEU A 85 11.563 63.319 4.699 1.00 7.86 C ATOM 743 CD1 LEU A 85 11.225 63.413 6.206 1.00 9.08 C ATOM 744 CD2 LEU A 85 11.968 61.908 4.308 1.00 8.57 C ATOM 745 H LEU A 85 11.641 65.369 2.134 1.00 0.00 H ATOM 746 N LYS A 86 8.166 63.189 1.550 1.00 10.13 N ATOM 747 CA LYS A 86 6.830 63.486 1.050 1.00 12.81 C ATOM 748 C LYS A 86 5.824 63.514 2.211 1.00 10.98 C ATOM 749 O LYS A 86 4.833 64.253 2.160 1.00 12.81 O ATOM 750 CB LYS A 86 6.414 62.404 0.034 1.00 16.94 C ATOM 751 CG LYS A 86 4.953 62.401 -0.369 1.00 22.67 C ATOM 752 CD LYS A 86 4.592 63.625 -1.187 1.00 26.28 C ATOM 753 CE LYS A 86 3.125 63.592 -1.605 1.00 28.40 C ATOM 754 NZ LYS A 86 2.779 64.748 -2.475 1.00 31.17 N ATOM 755 HZ1 LYS A 86 2.955 65.634 -1.959 1.00 0.00 H ATOM 756 HZ2 LYS A 86 3.367 64.723 -3.333 1.00 0.00 H ATOM 757 HZ3 LYS A 86 1.775 64.693 -2.740 1.00 0.00 H ATOM 758 H LYS A 86 8.422 62.195 1.717 1.00 0.00 H ATOM 759 N ARG A 87 6.068 62.725 3.260 1.00 8.97 N ATOM 760 CA ARG A 87 5.121 62.632 4.367 1.00 9.48 C ATOM 761 C ARG A 87 5.821 62.089 5.611 1.00 7.14 C ATOM 762 O ARG A 87 6.816 61.367 5.495 1.00 7.89 O ATOM 763 CB ARG A 87 3.992 61.670 3.936 1.00 14.39 C ATOM 764 CG ARG A 87 3.007 61.216 4.986 1.00 19.15 C ATOM 765 CD ARG A 87 1.810 60.467 4.364 1.00 21.06 C ATOM 766 NE ARG A 87 2.141 59.426 3.382 1.00 24.74 N ATOM 767 CZ ARG A 87 1.346 58.383 3.123 1.00 24.59 C ATOM 768 NH1 ARG A 87 0.200 58.246 3.786 1.00 26.49 N ATOM 769 NH2 ARG A 87 1.662 57.499 2.183 1.00 24.31 N ATOM 770 HE ARG A 87 3.038 59.504 2.862 1.00 0.00 H ATOM 771 HH12 ARG A 87 -0.422 57.436 3.588 1.00 0.00 H ATOM 772 HH11 ARG A 87 -0.074 58.949 4.502 1.00 0.00 H ATOM 773 HH22 ARG A 87 1.032 56.693 1.994 1.00 0.00 H ATOM 774 HH21 ARG A 87 2.539 57.613 1.636 1.00 0.00 H ATOM 775 H ARG A 87 6.946 62.168 3.289 1.00 0.00 H ATOM 776 N ILE A 88 5.296 62.457 6.777 1.00 7.37 N ATOM 777 CA ILE A 88 5.766 61.957 8.065 1.00 7.91 C ATOM 778 C ILE A 88 4.495 61.408 8.712 1.00 8.48 C ATOM 779 O ILE A 88 3.522 62.162 8.885 1.00 10.85 O ATOM 780 CB ILE A 88 6.326 63.065 8.957 1.00 8.36 C ATOM 781 CG1 ILE A 88 7.593 63.653 8.333 1.00 9.39 C ATOM 782 CG2 ILE A 88 6.590 62.498 10.367 1.00 9.68 C ATOM 783 CD1 ILE A 88 8.059 64.947 9.009 1.00 10.67 C ATOM 784 H ILE A 88 4.509 63.137 6.770 1.00 0.00 H ATOM 785 N ILE A 89 4.465 60.112 9.023 1.00 8.27 N ATOM 786 CA ILE A 89 3.302 59.504 9.697 1.00 7.14 C ATOM 787 C ILE A 89 3.744 59.181 11.129 1.00 7.33 C ATOM 788 O ILE A 89 4.483 58.208 11.360 1.00 8.02 O ATOM 789 CB ILE A 89 2.859 58.199 9.045 1.00 8.17 C ATOM 790 CG1 ILE A 89 2.492 58.401 7.572 1.00 9.76 C ATOM 791 CG2 ILE A 89 1.614 57.658 9.781 1.00 8.85 C ATOM 792 CD1 ILE A 89 2.131 57.098 6.893 1.00 11.51 C ATOM 793 H ILE A 89 5.282 59.514 8.784 1.00 0.00 H ATOM 794 N SER A 90 3.328 59.999 12.086 1.00 8.02 N ATOM 795 CA SER A 90 3.679 59.758 13.484 1.00 8.52 C ATOM 796 C SER A 90 2.641 58.826 14.059 1.00 8.32 C ATOM 797 O SER A 90 1.470 58.902 13.711 1.00 8.73 O ATOM 798 CB SER A 90 3.704 61.068 14.260 1.00 12.73 C ATOM 799 OG SER A 90 4.880 61.763 13.884 1.00 17.53 O ATOM 800 HG SER A 90 4.925 62.622 14.374 1.00 0.00 H ATOM 801 H SER A 90 2.744 60.823 11.838 1.00 0.00 H ATOM 802 N HIS A 91 3.050 57.922 14.932 1.00 6.86 N ATOM 803 CA HIS A 91 2.076 57.014 15.493 1.00 6.02 C ATOM 804 C HIS A 91 0.942 57.783 16.146 1.00 6.51 C ATOM 805 O HIS A 91 1.176 58.698 16.915 1.00 5.93 O ATOM 806 CB HIS A 91 2.730 56.078 16.502 1.00 6.46 C ATOM 807 CG HIS A 91 1.904 54.876 16.766 1.00 5.91 C ATOM 808 ND1 HIS A 91 0.760 54.922 17.541 1.00 6.23 N ATOM 809 CD2 HIS A 91 1.974 53.627 16.254 1.00 7.10 C ATOM 810 CE1 HIS A 91 0.162 53.743 17.488 1.00 7.05 C ATOM 811 NE2 HIS A 91 0.876 52.939 16.715 1.00 7.68 N ATOM 812 H HIS A 91 4.051 57.865 15.209 1.00 0.00 H ATOM 813 N PRO A 92 -0.308 57.379 15.881 1.00 6.50 N ATOM 814 CA PRO A 92 -1.421 58.115 16.482 1.00 7.14 C ATOM 815 C PRO A 92 -1.465 58.155 17.993 1.00 7.74 C ATOM 816 O PRO A 92 -2.099 59.049 18.554 1.00 8.97 O ATOM 817 CB PRO A 92 -2.658 57.445 15.875 1.00 8.75 C ATOM 818 CG PRO A 92 -2.208 56.057 15.561 1.00 10.17 C ATOM 819 CD PRO A 92 -0.786 56.285 15.014 1.00 7.80 C ATOM 820 N PHE A 93 -0.806 57.205 18.648 1.00 6.11 N ATOM 821 CA PHE A 93 -0.842 57.161 20.100 1.00 6.40 C ATOM 822 C PHE A 93 0.389 57.788 20.729 1.00 6.72 C ATOM 823 O PHE A 93 0.548 57.734 21.950 1.00 7.43 O ATOM 824 CB PHE A 93 -1.020 55.718 20.597 1.00 6.78 C ATOM 825 CG PHE A 93 -2.264 55.020 20.057 1.00 7.71 C ATOM 826 CD1 PHE A 93 -2.299 53.628 19.967 1.00 8.82 C ATOM 827 CD2 PHE A 93 -3.383 55.742 19.629 1.00 8.29 C ATOM 828 CE1 PHE A 93 -3.427 52.962 19.453 1.00 9.69 C ATOM 829 CE2 PHE A 93 -4.514 55.072 19.115 1.00 9.48 C ATOM 830 CZ PHE A 93 -4.517 53.697 19.031 1.00 9.98 C ATOM 831 H PHE A 93 -0.263 56.492 18.120 1.00 0.00 H ATOM 832 N PHE A 94 1.240 58.410 19.918 1.00 6.16 N ATOM 833 CA PHE A 94 2.440 59.050 20.479 1.00 7.42 C ATOM 834 C PHE A 94 2.063 60.101 21.508 1.00 8.22 C ATOM 835 O PHE A 94 1.183 60.931 21.254 1.00 10.46 O ATOM 836 CB PHE A 94 3.291 59.697 19.380 1.00 8.35 C ATOM 837 CG PHE A 94 4.432 60.537 19.929 1.00 6.06 C ATOM 838 CD1 PHE A 94 5.479 59.955 20.625 1.00 6.19 C ATOM 839 CD2 PHE A 94 4.442 61.924 19.761 1.00 7.38 C ATOM 840 CE1 PHE A 94 6.507 60.728 21.140 1.00 6.15 C ATOM 841 CE2 PHE A 94 5.481 62.713 20.284 1.00 7.99 C ATOM 842 CZ PHE A 94 6.504 62.110 20.969 1.00 6.85 C ATOM 843 H PHE A 94 1.058 58.444 18.895 1.00 0.00 H ATOM 844 N ASN A 95 2.744 60.058 22.653 1.00 9.05 N ATOM 845 CA ASN A 95 2.528 60.963 23.780 1.00 11.76 C ATOM 846 C ASN A 95 3.832 61.769 23.951 1.00 9.93 C ATOM 847 O ASN A 95 4.845 61.187 24.312 1.00 8.71 O ATOM 848 CB ASN A 95 2.248 60.097 25.023 1.00 14.04 C ATOM 849 CG ASN A 95 2.009 60.907 26.282 1.00 16.69 C ATOM 850 OD1 ASN A 95 2.529 62.007 26.431 1.00 16.14 O ATOM 851 ND2 ASN A 95 1.237 60.346 27.210 1.00 17.86 N ATOM 852 HD22 ASN A 95 0.816 59.410 27.040 1.00 0.00 H ATOM 853 HD21 ASN A 95 1.055 60.844 28.105 1.00 0.00 H ATOM 854 H ASN A 95 3.480 59.330 22.751 1.00 0.00 H ATOM 855 N ASP A 96 3.808 63.075 23.696 1.00 11.12 N ATOM 856 CA ASP A 96 5.019 63.881 23.816 1.00 12.22 C ATOM 857 C ASP A 96 5.511 64.128 25.248 1.00 11.67 C ATOM 858 O ASP A 96 6.601 64.679 25.438 1.00 13.41 O ATOM 859 CB ASP A 96 4.842 65.229 23.082 1.00 17.75 C ATOM 860 CG ASP A 96 6.178 65.929 22.792 1.00 23.20 C ATOM 861 OD1 ASP A 96 6.188 67.173 22.623 1.00 26.72 O ATOM 862 OD2 ASP A 96 7.225 65.246 22.707 1.00 27.85 O ATOM 863 H ASP A 96 2.916 63.526 23.408 1.00 0.00 H ATOM 864 N PHE A 97 4.734 63.724 26.249 1.00 10.13 N ATOM 865 CA PHE A 97 5.135 63.882 27.650 1.00 11.12 C ATOM 866 C PHE A 97 5.804 62.582 28.129 1.00 11.65 C ATOM 867 O PHE A 97 6.889 62.604 28.685 1.00 13.73 O ATOM 868 CB PHE A 97 3.909 64.215 28.523 1.00 11.69 C ATOM 869 CG PHE A 97 4.245 64.495 29.964 1.00 14.78 C ATOM 870 CD1 PHE A 97 4.010 63.539 30.950 1.00 15.70 C ATOM 871 CD2 PHE A 97 4.797 65.717 30.341 1.00 15.08 C ATOM 872 CE1 PHE A 97 4.326 63.803 32.303 1.00 17.42 C ATOM 873 CE2 PHE A 97 5.111 65.985 31.680 1.00 16.07 C ATOM 874 CZ PHE A 97 4.876 65.032 32.656 1.00 15.06 C ATOM 875 H PHE A 97 3.817 63.284 26.032 1.00 0.00 H ATOM 876 N THR A 98 5.162 61.444 27.878 1.00 11.22 N ATOM 877 CA THR A 98 5.706 60.146 28.310 1.00 12.57 C ATOM 878 C THR A 98 6.612 59.484 27.268 1.00 10.25 C ATOM 879 O THR A 98 7.424 58.613 27.595 1.00 12.68 O ATOM 880 CB THR A 98 4.567 59.136 28.602 1.00 14.17 C ATOM 881 OG1 THR A 98 3.808 58.907 27.408 1.00 14.95 O ATOM 882 CG2 THR A 98 3.640 59.659 29.705 1.00 16.21 C ATOM 883 HG1 THR A 98 3.418 59.762 27.097 1.00 0.00 H ATOM 884 H THR A 98 4.257 61.472 27.366 1.00 0.00 H ATOM 885 N PHE A 99 6.485 59.931 26.027 1.00 8.35 N ATOM 886 CA PHE A 99 7.195 59.353 24.885 1.00 7.62 C ATOM 887 C PHE A 99 6.706 57.935 24.566 1.00 6.36 C ATOM 888 O PHE A 99 7.383 57.160 23.905 1.00 7.05 O ATOM 889 CB PHE A 99 8.712 59.404 25.075 1.00 9.08 C ATOM 890 CG PHE A 99 9.356 60.668 24.527 1.00 9.05 C ATOM 891 CD1 PHE A 99 8.659 61.881 24.469 1.00 10.89 C ATOM 892 CD2 PHE A 99 10.687 60.659 24.156 1.00 9.45 C ATOM 893 CE1 PHE A 99 9.312 63.065 24.055 1.00 10.97 C ATOM 894 CE2 PHE A 99 11.334 61.828 23.752 1.00 10.89 C ATOM 895 CZ PHE A 99 10.654 63.021 23.707 1.00 9.90 C ATOM 896 H PHE A 99 5.847 60.735 25.855 1.00 0.00 H ATOM 897 N ASP A 100 5.517 57.575 25.050 1.00 6.57 N ATOM 898 CA ASP A 100 4.961 56.287 24.679 1.00 6.21 C ATOM 899 C ASP A 100 4.699 56.352 23.150 1.00 5.13 C ATOM 900 O ASP A 100 4.423 57.428 22.593 1.00 5.84 O ATOM 901 CB ASP A 100 3.639 56.062 25.432 1.00 6.57 C ATOM 902 CG ASP A 100 3.222 54.610 25.452 1.00 7.43 C ATOM 903 OD1 ASP A 100 2.082 54.339 25.893 1.00 7.46 O ATOM 904 OD2 ASP A 100 4.016 53.730 25.042 1.00 6.52 O ATOM 905 H ASP A 100 4.994 58.210 25.686 1.00 0.00 H ATOM 906 N TYR A 101 4.794 55.200 22.497 1.00 4.81 N ATOM 907 CA TYR A 101 4.564 55.077 21.056 1.00 4.79 C ATOM 908 C TYR A 101 5.451 56.027 20.244 1.00 4.78 C ATOM 909 O TYR A 101 5.007 56.660 19.282 1.00 5.13 O ATOM 910 CB TYR A 101 3.077 55.301 20.724 1.00 6.08 C ATOM 911 CG TYR A 101 2.167 54.191 21.209 1.00 3.95 C ATOM 912 CD1 TYR A 101 1.594 54.252 22.477 1.00 4.24 C ATOM 913 CD2 TYR A 101 1.934 53.058 20.437 1.00 5.66 C ATOM 914 CE1 TYR A 101 0.814 53.199 22.971 1.00 6.07 C ATOM 915 CE2 TYR A 101 1.159 51.995 20.902 1.00 5.08 C ATOM 916 CZ TYR A 101 0.601 52.082 22.181 1.00 5.07 C ATOM 917 OH TYR A 101 -0.158 51.033 22.659 1.00 6.35 O ATOM 918 HH TYR A 101 -0.478 51.248 23.571 1.00 0.00 H ATOM 919 H TYR A 101 5.043 54.345 23.034 1.00 0.00 H ATOM 920 N ASP A 102 6.728 56.065 20.606 1.00 4.96 N ATOM 921 CA ASP A 102 7.666 56.964 19.942 1.00 5.10 C ATOM 922 C ASP A 102 8.210 56.335 18.653 1.00 4.95 C ATOM 923 O ASP A 102 9.318 55.760 18.622 1.00 6.14 O ATOM 924 CB ASP A 102 8.802 57.303 20.911 1.00 4.78 C ATOM 925 CG ASP A 102 9.666 58.456 20.413 1.00 5.34 C ATOM 926 OD1 ASP A 102 9.260 59.128 19.434 1.00 5.93 O ATOM 927 OD2 ASP A 102 10.762 58.683 20.992 1.00 5.74 O ATOM 928 H ASP A 102 7.064 55.447 21.372 1.00 0.00 H ATOM 929 N ILE A 103 7.414 56.404 17.591 1.00 4.88 N ATOM 930 CA ILE A 103 7.783 55.838 16.310 1.00 4.65 C ATOM 931 C ILE A 103 7.069 56.604 15.198 1.00 4.28 C ATOM 932 O ILE A 103 5.939 57.070 15.384 1.00 5.55 O ATOM 933 CB ILE A 103 7.480 54.302 16.267 1.00 5.00 C ATOM 934 CG1 ILE A 103 8.062 53.675 14.987 1.00 5.97 C ATOM 935 CG2 ILE A 103 5.966 54.038 16.433 1.00 6.40 C ATOM 936 CD1 ILE A 103 8.026 52.125 15.020 1.00 7.55 C ATOM 937 H ILE A 103 6.494 56.881 17.683 1.00 0.00 H ATOM 938 N ALA A 104 7.756 56.772 14.071 1.00 4.72 N ATOM 939 CA ALA A 104 7.205 57.461 12.917 1.00 4.70 C ATOM 940 C ALA A 104 7.696 56.781 11.656 1.00 5.50 C ATOM 941 O ALA A 104 8.751 56.115 11.648 1.00 6.42 O ATOM 942 CB ALA A 104 7.638 58.934 12.906 1.00 6.73 C ATOM 943 H ALA A 104 8.724 56.396 14.014 1.00 0.00 H ATOM 944 N LEU A 105 6.932 56.961 10.583 1.00 5.81 N ATOM 945 CA LEU A 105 7.266 56.439 9.266 1.00 5.78 C ATOM 946 C LEU A 105 7.471 57.649 8.364 1.00 6.00 C ATOM 947 O LEU A 105 6.643 58.564 8.338 1.00 7.76 O ATOM 948 CB LEU A 105 6.125 55.572 8.742 1.00 8.14 C ATOM 949 CG LEU A 105 5.813 54.362 9.605 1.00 11.08 C ATOM 950 CD1 LEU A 105 4.506 53.749 9.129 1.00 11.79 C ATOM 951 CD2 LEU A 105 6.942 53.367 9.546 1.00 15.02 C ATOM 952 H LEU A 105 6.051 57.503 10.690 1.00 0.00 H ATOM 953 N LEU A 106 8.572 57.650 7.630 1.00 5.54 N ATOM 954 CA LEU A 106 8.915 58.767 6.756 1.00 6.07 C ATOM 955 C LEU A 106 8.910 58.257 5.330 1.00 6.54 C ATOM 956 O LEU A 106 9.599 57.294 5.016 1.00 6.48 O ATOM 957 CB LEU A 106 10.321 59.298 7.079 1.00 6.81 C ATOM 958 CG LEU A 106 10.681 59.521 8.559 1.00 9.69 C ATOM 959 CD1 LEU A 106 12.101 60.074 8.664 1.00 10.04 C ATOM 960 CD2 LEU A 106 9.724 60.462 9.255 1.00 12.39 C ATOM 961 H LEU A 106 9.211 56.831 7.677 1.00 0.00 H ATOM 962 N GLU A 107 8.127 58.902 4.466 1.00 6.60 N ATOM 963 CA GLU A 107 8.048 58.509 3.067 1.00 6.87 C ATOM 964 C GLU A 107 8.997 59.350 2.224 1.00 7.47 C ATOM 965 O GLU A 107 8.906 60.578 2.201 1.00 8.39 O ATOM 966 CB GLU A 107 6.618 58.677 2.546 1.00 9.19 C ATOM 967 CG GLU A 107 6.406 58.064 1.157 1.00 11.85 C ATOM 968 CD GLU A 107 4.954 58.150 0.667 1.00 16.07 C ATOM 969 OE1 GLU A 107 4.661 57.527 -0.375 1.00 19.02 O ATOM 970 OE2 GLU A 107 4.124 58.823 1.316 1.00 16.26 O ATOM 971 H GLU A 107 7.558 59.706 4.800 1.00 0.00 H ATOM 972 N LEU A 108 9.936 58.677 1.568 1.00 7.64 N ATOM 973 CA LEU A 108 10.891 59.366 0.704 1.00 8.75 C ATOM 974 C LEU A 108 10.153 59.890 -0.516 1.00 9.45 C ATOM 975 O LEU A 108 9.247 59.245 -1.047 1.00 9.99 O ATOM 976 CB LEU A 108 11.991 58.408 0.259 1.00 9.09 C ATOM 977 CG LEU A 108 12.861 57.776 1.350 1.00 8.48 C ATOM 978 CD1 LEU A 108 13.873 56.839 0.689 1.00 10.91 C ATOM 979 CD2 LEU A 108 13.574 58.866 2.134 1.00 10.90 C ATOM 980 H LEU A 108 9.992 57.644 1.671 1.00 0.00 H ATOM 981 N GLU A 109 10.576 61.058 -0.985 1.00 9.36 N ATOM 982 CA GLU A 109 9.925 61.701 -2.120 1.00 12.00 C ATOM 983 C GLU A 109 10.266 60.976 -3.429 1.00 11.68 C ATOM 984 O GLU A 109 9.480 60.971 -4.367 1.00 12.92 O ATOM 985 CB GLU A 109 10.332 63.181 -2.118 1.00 13.69 C ATOM 986 CG GLU A 109 9.693 64.072 -3.154 1.00 19.48 C ATOM 987 CD GLU A 109 10.386 63.995 -4.494 1.00 20.91 C ATOM 988 OE1 GLU A 109 11.629 63.824 -4.524 1.00 21.77 O ATOM 989 OE2 GLU A 109 9.686 64.120 -5.519 1.00 20.88 O ATOM 990 H GLU A 109 11.389 61.524 -0.533 1.00 0.00 H ATOM 991 N LYS A 110 11.447 60.362 -3.475 1.00 11.06 N ATOM 992 CA LYS A 110 11.928 59.554 -4.613 1.00 12.12 C ATOM 993 C LYS A 110 12.572 58.313 -3.969 1.00 11.82 C ATOM 994 O LYS A 110 13.234 58.434 -2.933 1.00 11.54 O ATOM 995 CB LYS A 110 12.994 60.317 -5.414 1.00 14.82 C ATOM 996 CG LYS A 110 13.649 59.529 -6.514 1.00 20.42 C ATOM 997 CD LYS A 110 14.524 60.420 -7.376 1.00 23.18 C ATOM 998 CE LYS A 110 15.964 60.485 -6.884 1.00 21.90 C ATOM 999 NZ LYS A 110 16.751 61.313 -7.830 1.00 27.65 N ATOM 1000 HZ1 LYS A 110 16.719 60.882 -8.776 1.00 0.00 H ATOM 1001 HZ2 LYS A 110 16.347 62.270 -7.870 1.00 0.00 H ATOM 1002 HZ3 LYS A 110 17.738 61.365 -7.505 1.00 0.00 H ATOM 1003 H LYS A 110 12.074 60.459 -2.651 1.00 0.00 H ATOM 1004 N PRO A 111 12.417 57.120 -4.573 1.00 11.67 N ATOM 1005 CA PRO A 111 13.009 55.922 -3.970 1.00 11.78 C ATOM 1006 C PRO A 111 14.524 55.923 -3.819 1.00 12.41 C ATOM 1007 O PRO A 111 15.253 56.523 -4.613 1.00 11.26 O ATOM 1008 CB PRO A 111 12.560 54.790 -4.896 1.00 13.96 C ATOM 1009 CG PRO A 111 11.360 55.346 -5.639 1.00 15.99 C ATOM 1010 CD PRO A 111 11.688 56.794 -5.817 1.00 13.36 C ATOM 1011 N ALA A 112 14.991 55.254 -2.776 1.00 10.41 N ATOM 1012 CA ALA A 112 16.410 55.071 -2.547 1.00 11.00 C ATOM 1013 C ALA A 112 16.874 54.080 -3.613 1.00 12.15 C ATOM 1014 O ALA A 112 16.105 53.232 -4.053 1.00 12.60 O ATOM 1015 CB ALA A 112 16.638 54.448 -1.171 1.00 13.14 C ATOM 1016 H ALA A 112 14.316 54.846 -2.098 1.00 0.00 H ATOM 1017 N GLU A 113 18.130 54.178 -4.016 1.00 11.64 N ATOM 1018 CA GLU A 113 18.684 53.229 -4.978 1.00 12.99 C ATOM 1019 C GLU A 113 19.561 52.274 -4.171 1.00 11.74 C ATOM 1020 O GLU A 113 20.546 52.693 -3.582 1.00 13.29 O ATOM 1021 CB GLU A 113 19.532 53.952 -6.032 1.00 15.82 C ATOM 1022 CG GLU A 113 20.265 52.976 -6.946 1.00 21.09 C ATOM 1023 CD GLU A 113 21.173 53.642 -7.971 1.00 25.34 C ATOM 1024 OE1 GLU A 113 21.899 52.900 -8.679 1.00 28.79 O ATOM 1025 OE2 GLU A 113 21.172 54.888 -8.070 1.00 26.85 O ATOM 1026 H GLU A 113 18.731 54.941 -3.643 1.00 0.00 H ATOM 1027 N TYR A 114 19.221 50.990 -4.122 1.00 11.46 N ATOM 1028 CA TYR A 114 20.037 50.070 -3.335 1.00 11.09 C ATOM 1029 C TYR A 114 21.445 49.950 -3.908 1.00 11.90 C ATOM 1030 O TYR A 114 21.625 49.905 -5.125 1.00 13.47 O ATOM 1031 CB TYR A 114 19.364 48.692 -3.263 1.00 12.50 C ATOM 1032 CG TYR A 114 18.051 48.648 -2.485 1.00 10.48 C ATOM 1033 CD1 TYR A 114 17.289 47.492 -2.461 1.00 12.47 C ATOM 1034 CD2 TYR A 114 17.603 49.749 -1.740 1.00 12.17 C ATOM 1035 CE1 TYR A 114 16.111 47.412 -1.712 1.00 11.81 C ATOM 1036 CE2 TYR A 114 16.431 49.678 -0.991 1.00 11.36 C ATOM 1037 CZ TYR A 114 15.697 48.504 -0.979 1.00 11.23 C ATOM 1038 OH TYR A 114 14.556 48.423 -0.190 1.00 12.70 O ATOM 1039 HH TYR A 114 14.149 47.526 -0.292 1.00 0.00 H ATOM 1040 H TYR A 114 18.386 50.646 -4.637 1.00 0.00 H ATOM 1041 N SER A 115 22.431 49.886 -3.029 1.00 9.89 N ATOM 1042 CA SER A 115 23.843 49.782 -3.412 1.00 10.65 C ATOM 1043 C SER A 115 24.599 49.151 -2.252 1.00 12.53 C ATOM 1044 O SER A 115 24.006 48.789 -1.230 1.00 11.87 O ATOM 1045 CB SER A 115 24.414 51.178 -3.650 1.00 11.68 C ATOM 1046 OG SER A 115 24.494 51.858 -2.399 1.00 12.11 O ATOM 1047 HG SER A 115 24.863 52.765 -2.541 1.00 0.00 H ATOM 1048 H SER A 115 22.194 49.911 -2.017 1.00 0.00 H ATOM 1049 N SER A 116 25.918 49.051 -2.373 1.00 13.35 N ATOM 1050 CA SER A 116 26.667 48.469 -1.264 1.00 14.92 C ATOM 1051 C SER A 116 26.562 49.365 -0.019 1.00 14.20 C ATOM 1052 O SER A 116 26.668 48.884 1.102 1.00 16.73 O ATOM 1053 CB SER A 116 28.135 48.282 -1.646 1.00 16.42 C ATOM 1054 OG SER A 116 28.717 49.522 -1.979 1.00 21.75 O ATOM 1055 HG SER A 116 29.666 49.385 -2.224 1.00 0.00 H ATOM 1056 H SER A 116 26.403 49.378 -3.233 1.00 0.00 H ATOM 1057 N MET A 117 26.304 50.657 -0.237 1.00 12.49 N ATOM 1058 CA MET A 117 26.207 51.620 0.866 1.00 11.00 C ATOM 1059 C MET A 117 24.786 51.933 1.331 1.00 9.98 C ATOM 1060 O MET A 117 24.620 52.595 2.350 1.00 8.79 O ATOM 1061 CB MET A 117 26.870 52.938 0.452 1.00 14.59 C ATOM 1062 CG MET A 117 28.340 52.812 0.080 1.00 21.27 C ATOM 1063 SD MET A 117 29.394 52.560 1.516 1.00 28.40 S ATOM 1064 CE MET A 117 30.961 52.037 0.745 1.00 27.74 C ATOM 1065 H MET A 117 26.168 50.989 -1.213 1.00 0.00 H ATOM 1066 N VAL A 118 23.777 51.486 0.588 1.00 8.03 N ATOM 1067 CA VAL A 118 22.374 51.780 0.905 1.00 7.63 C ATOM 1068 C VAL A 118 21.597 50.473 0.783 1.00 8.44 C ATOM 1069 O VAL A 118 21.438 49.927 -0.310 1.00 9.01 O ATOM 1070 CB VAL A 118 21.849 52.846 -0.079 1.00 7.34 C ATOM 1071 CG1 VAL A 118 20.364 53.109 0.154 1.00 7.91 C ATOM 1072 CG2 VAL A 118 22.645 54.130 0.111 1.00 7.17 C ATOM 1073 H VAL A 118 23.990 50.906 -0.249 1.00 0.00 H ATOM 1074 N ARG A 119 21.107 49.967 1.911 1.00 7.13 N ATOM 1075 CA ARG A 119 20.428 48.670 1.938 1.00 7.96 C ATOM 1076 C ARG A 119 19.464 48.696 3.112 1.00 6.63 C ATOM 1077 O ARG A 119 19.813 49.221 4.167 1.00 7.45 O ATOM 1078 CB ARG A 119 21.483 47.582 2.170 1.00 9.29 C ATOM 1079 CG ARG A 119 20.988 46.152 2.234 1.00 11.10 C ATOM 1080 CD ARG A 119 22.151 45.214 2.587 1.00 12.89 C ATOM 1081 NE ARG A 119 21.700 43.830 2.735 1.00 14.15 N ATOM 1082 CZ ARG A 119 21.649 42.957 1.738 1.00 16.22 C ATOM 1083 NH1 ARG A 119 22.032 43.311 0.520 1.00 18.61 N ATOM 1084 NH2 ARG A 119 21.180 41.736 1.955 1.00 17.42 N ATOM 1085 HE ARG A 119 21.401 43.512 3.679 1.00 0.00 H ATOM 1086 HH12 ARG A 119 21.990 42.623 -0.259 1.00 0.00 H ATOM 1087 HH11 ARG A 119 22.374 44.277 0.343 1.00 0.00 H ATOM 1088 HH22 ARG A 119 21.139 41.049 1.176 1.00 0.00 H ATOM 1089 HH21 ARG A 119 20.854 41.465 2.905 1.00 0.00 H ATOM 1090 H ARG A 119 21.208 50.505 2.795 1.00 0.00 H ATOM 1091 N PRO A 120 18.261 48.122 2.951 1.00 6.52 N ATOM 1092 CA PRO A 120 17.292 48.120 4.053 1.00 6.84 C ATOM 1093 C PRO A 120 17.642 47.132 5.159 1.00 6.21 C ATOM 1094 O PRO A 120 18.331 46.118 4.935 1.00 7.48 O ATOM 1095 CB PRO A 120 15.992 47.721 3.370 1.00 7.90 C ATOM 1096 CG PRO A 120 16.463 46.758 2.295 1.00 8.58 C ATOM 1097 CD PRO A 120 17.701 47.469 1.745 1.00 8.15 C ATOM 1098 N ILE A 121 17.195 47.448 6.364 1.00 6.18 N ATOM 1099 CA ILE A 121 17.352 46.535 7.490 1.00 6.38 C ATOM 1100 C ILE A 121 16.110 45.613 7.477 1.00 6.94 C ATOM 1101 O ILE A 121 15.071 45.981 6.926 1.00 8.46 O ATOM 1102 CB ILE A 121 17.428 47.332 8.817 1.00 6.12 C ATOM 1103 CG1 ILE A 121 17.777 46.382 9.941 1.00 7.58 C ATOM 1104 CG2 ILE A 121 16.107 48.099 9.075 1.00 7.42 C ATOM 1105 CD1 ILE A 121 16.647 45.726 10.492 1.00 16.98 C ATOM 1106 H ILE A 121 16.724 48.363 6.510 1.00 0.00 H ATOM 1107 N CYS A 122 16.231 44.414 8.041 1.00 7.19 N ATOM 1108 CA CYS A 122 15.085 43.502 8.098 1.00 7.97 C ATOM 1109 C CYS A 122 14.185 43.843 9.281 1.00 6.94 C ATOM 1110 O CYS A 122 14.657 44.199 10.366 1.00 7.41 O ATOM 1111 CB CYS A 122 15.535 42.049 8.270 1.00 9.35 C ATOM 1112 SG CYS A 122 16.658 41.406 7.028 1.00 13.36 S ATOM 1113 H CYS A 122 17.144 44.122 8.444 1.00 0.00 H ATOM 1114 N LEU A 123 12.878 43.720 9.075 1.00 7.49 N ATOM 1115 CA LEU A 123 11.918 43.955 10.145 1.00 8.05 C ATOM 1116 C LEU A 123 11.513 42.632 10.800 1.00 6.45 C ATOM 1117 O LEU A 123 11.278 41.628 10.110 1.00 8.31 O ATOM 1118 CB LEU A 123 10.641 44.603 9.615 1.00 10.00 C ATOM 1119 CG LEU A 123 10.804 46.024 9.106 1.00 12.20 C ATOM 1120 CD1 LEU A 123 9.496 46.407 8.424 1.00 14.59 C ATOM 1121 CD2 LEU A 123 11.143 46.976 10.259 1.00 15.47 C ATOM 1122 H LEU A 123 12.534 43.451 8.131 1.00 0.00 H ATOM 1123 N PRO A 124 11.408 42.623 12.130 1.00 6.61 N ATOM 1124 CA PRO A 124 11.013 41.403 12.843 1.00 6.48 C ATOM 1125 C PRO A 124 9.496 41.195 12.838 1.00 7.60 C ATOM 1126 O PRO A 124 8.719 42.156 12.864 1.00 8.11 O ATOM 1127 CB PRO A 124 11.527 41.648 14.260 1.00 7.07 C ATOM 1128 CG PRO A 124 11.406 43.155 14.432 1.00 7.62 C ATOM 1129 CD PRO A 124 11.774 43.716 13.064 1.00 6.46 C ATOM 1130 N ASP A 125 9.097 39.931 12.798 1.00 7.56 N ATOM 1131 CA ASP A 125 7.686 39.571 12.853 1.00 7.32 C ATOM 1132 C ASP A 125 7.155 39.974 14.224 1.00 7.17 C ATOM 1133 O ASP A 125 7.900 40.055 15.219 1.00 8.17 O ATOM 1134 CB ASP A 125 7.523 38.062 12.673 1.00 9.25 C ATOM 1135 CG ASP A 125 7.598 37.638 11.218 1.00 11.62 C ATOM 1136 OD1 ASP A 125 7.658 36.417 10.969 1.00 14.06 O ATOM 1137 OD2 ASP A 125 7.584 38.489 10.307 1.00 13.95 O ATOM 1138 H ASP A 125 9.810 39.177 12.725 1.00 0.00 H ATOM 1139 N ALA A 126 5.842 40.205 14.301 1.00 9.00 N ATOM 1140 CA ALA A 126 5.206 40.617 15.546 1.00 9.86 C ATOM 1141 C ALA A 126 5.450 39.677 16.727 1.00 9.65 C ATOM 1142 O ALA A 126 5.525 40.120 17.875 1.00 11.77 O ATOM 1143 CB ALA A 126 3.703 40.781 15.327 1.00 12.10 C ATOM 1144 H ALA A 126 5.257 40.088 13.449 1.00 0.00 H ATOM 1145 N SER A 127 5.591 38.381 16.445 1.00 9.92 N ATOM 1146 CA SER A 127 5.803 37.408 17.516 1.00 11.51 C ATOM 1147 C SER A 127 7.249 37.239 17.972 1.00 10.68 C ATOM 1148 O SER A 127 7.512 36.532 18.936 1.00 12.55 O ATOM 1149 CB SER A 127 5.267 36.038 17.101 1.00 13.83 C ATOM 1150 OG SER A 127 5.876 35.615 15.893 1.00 17.89 O ATOM 1151 HG SER A 127 5.519 34.728 15.638 1.00 0.00 H ATOM 1152 H SER A 127 5.550 38.060 15.457 1.00 0.00 H ATOM 1153 N HIS A 128 8.193 37.896 17.306 1.00 8.24 N ATOM 1154 CA HIS A 128 9.578 37.699 17.697 1.00 8.44 C ATOM 1155 C HIS A 128 9.978 38.409 18.986 1.00 8.75 C ATOM 1156 O HIS A 128 9.672 39.595 19.170 1.00 10.86 O ATOM 1157 CB HIS A 128 10.512 38.161 16.582 1.00 7.79 C ATOM 1158 CG HIS A 128 11.950 37.868 16.872 1.00 7.30 C ATOM 1159 ND1 HIS A 128 12.442 36.578 16.896 1.00 8.96 N ATOM 1160 CD2 HIS A 128 12.967 38.671 17.265 1.00 9.33 C ATOM 1161 CE1 HIS A 128 13.701 36.605 17.291 1.00 8.75 C ATOM 1162 NE2 HIS A 128 14.047 37.858 17.523 1.00 9.48 N ATOM 1163 H HIS A 128 7.946 38.536 16.524 1.00 0.00 H ATOM 1164 N VAL A 129 10.685 37.694 19.853 1.00 8.18 N ATOM 1165 CA VAL A 129 11.175 38.223 21.116 1.00 10.10 C ATOM 1166 C VAL A 129 12.693 38.429 21.049 1.00 8.77 C ATOM 1167 O VAL A 129 13.441 37.520 20.692 1.00 9.46 O ATOM 1168 CB VAL A 129 10.873 37.240 22.285 1.00 10.82 C ATOM 1169 CG1 VAL A 129 11.590 37.694 23.573 1.00 14.07 C ATOM 1170 CG2 VAL A 129 9.360 37.135 22.496 1.00 14.33 C ATOM 1171 H VAL A 129 10.900 36.704 19.617 1.00 0.00 H ATOM 1172 N PHE A 130 13.142 39.652 21.311 1.00 9.18 N ATOM 1173 CA PHE A 130 14.592 39.929 21.376 1.00 8.96 C ATOM 1174 C PHE A 130 14.818 39.658 22.863 1.00 10.25 C ATOM 1175 O PHE A 130 14.405 40.431 23.729 1.00 11.32 O ATOM 1176 CB PHE A 130 14.880 41.389 21.014 1.00 8.87 C ATOM 1177 CG PHE A 130 14.738 41.670 19.540 1.00 7.04 C ATOM 1178 CD1 PHE A 130 15.741 41.294 18.656 1.00 7.52 C ATOM 1179 CD2 PHE A 130 13.583 42.262 19.025 1.00 8.79 C ATOM 1180 CE1 PHE A 130 15.604 41.496 17.292 1.00 7.88 C ATOM 1181 CE2 PHE A 130 13.436 42.469 17.664 1.00 9.01 C ATOM 1182 CZ PHE A 130 14.434 42.091 16.784 1.00 8.06 C ATOM 1183 H PHE A 130 12.464 40.424 21.472 1.00 0.00 H ATOM 1184 N PRO A 131 15.490 38.558 23.186 1.00 9.72 N ATOM 1185 CA PRO A 131 15.721 38.184 24.580 1.00 10.04 C ATOM 1186 C PRO A 131 16.615 39.010 25.473 1.00 10.00 C ATOM 1187 O PRO A 131 17.604 39.567 25.022 1.00 9.63 O ATOM 1188 CB PRO A 131 16.234 36.749 24.452 1.00 9.83 C ATOM 1189 CG PRO A 131 17.085 36.824 23.250 1.00 10.72 C ATOM 1190 CD PRO A 131 16.294 37.709 22.285 1.00 9.73 C ATOM 1191 N ALA A 132 16.276 39.045 26.760 1.00 10.47 N ATOM 1192 CA ALA A 132 17.099 39.755 27.725 1.00 10.23 C ATOM 1193 C ALA A 132 18.497 39.178 27.649 1.00 10.96 C ATOM 1194 O ALA A 132 18.670 37.967 27.565 1.00 10.58 O ATOM 1195 CB ALA A 132 16.547 39.607 29.134 1.00 11.71 C ATOM 1196 H ALA A 132 15.413 38.559 27.078 1.00 0.00 H ATOM 1197 N GLY A 133 19.495 40.056 27.680 1.00 9.67 N ATOM 1198 CA GLY A 133 20.882 39.642 27.611 1.00 10.13 C ATOM 1199 C GLY A 133 21.475 39.655 26.224 1.00 8.51 C ATOM 1200 O GLY A 133 22.695 39.638 26.097 1.00 10.73 O ATOM 1201 H GLY A 133 19.274 41.069 27.756 1.00 0.00 H ATOM 1202 N LYS A 134 20.659 39.719 25.176 1.00 8.10 N ATOM 1203 CA LYS A 134 21.237 39.694 23.842 1.00 8.22 C ATOM 1204 C LYS A 134 21.996 40.957 23.496 1.00 7.38 C ATOM 1205 O LYS A 134 21.525 42.070 23.785 1.00 7.17 O ATOM 1206 CB LYS A 134 20.177 39.470 22.775 1.00 9.63 C ATOM 1207 CG LYS A 134 20.802 39.149 21.409 1.00 10.35 C ATOM 1208 CD LYS A 134 19.766 38.762 20.365 1.00 10.79 C ATOM 1209 CE LYS A 134 20.398 38.333 19.027 1.00 8.29 C ATOM 1210 NZ LYS A 134 21.318 39.334 18.390 1.00 8.82 N ATOM 1211 HZ1 LYS A 134 20.794 40.211 18.197 1.00 0.00 H ATOM 1212 HZ2 LYS A 134 22.109 39.536 19.035 1.00 0.00 H ATOM 1213 HZ3 LYS A 134 21.687 38.946 17.498 1.00 0.00 H ATOM 1214 H LYS A 134 19.630 39.786 25.308 1.00 0.00 H ATOM 1215 N ALA A 135 23.152 40.782 22.854 1.00 8.71 N ATOM 1216 CA ALA A 135 23.975 41.898 22.401 1.00 8.44 C ATOM 1217 C ALA A 135 23.362 42.456 21.130 1.00 9.97 C ATOM 1218 O ALA A 135 22.946 41.713 20.215 1.00 13.05 O ATOM 1219 CB ALA A 135 25.384 41.419 22.106 1.00 12.10 C ATOM 1220 H ALA A 135 23.479 39.812 22.669 1.00 0.00 H ATOM 1221 N ILE A 136 23.238 43.774 21.093 1.00 8.12 N ATOM 1222 CA ILE A 136 22.728 44.433 19.912 1.00 9.51 C ATOM 1223 C ILE A 136 23.529 45.717 19.735 1.00 7.90 C ATOM 1224 O ILE A 136 24.295 46.127 20.620 1.00 8.59 O ATOM 1225 CB ILE A 136 21.213 44.641 19.982 1.00 13.37 C ATOM 1226 CG1 ILE A 136 20.863 45.445 21.209 1.00 14.67 C ATOM 1227 CG2 ILE A 136 20.491 43.266 19.986 1.00 14.93 C ATOM 1228 CD1 ILE A 136 20.994 44.685 22.522 1.00 22.41 C ATOM 1229 H ILE A 136 23.510 44.340 21.922 1.00 0.00 H ATOM 1230 N TRP A 137 23.401 46.327 18.573 1.00 6.68 N ATOM 1231 CA TRP A 137 24.185 47.507 18.267 1.00 7.02 C ATOM 1232 C TRP A 137 23.383 48.766 18.090 1.00 6.09 C ATOM 1233 O TRP A 137 22.299 48.742 17.513 1.00 8.79 O ATOM 1234 CB TRP A 137 24.978 47.249 16.980 1.00 8.99 C ATOM 1235 CG TRP A 137 25.973 46.159 17.150 1.00 10.39 C ATOM 1236 CD1 TRP A 137 25.746 44.808 17.099 1.00 13.22 C ATOM 1237 CD2 TRP A 137 27.350 46.327 17.495 1.00 10.65 C ATOM 1238 NE1 TRP A 137 26.910 44.134 17.394 1.00 15.27 N ATOM 1239 CE2 TRP A 137 27.907 45.045 17.643 1.00 12.09 C ATOM 1240 CE3 TRP A 137 28.169 47.453 17.695 1.00 11.58 C ATOM 1241 CZ2 TRP A 137 29.252 44.849 17.987 1.00 13.71 C ATOM 1242 CZ3 TRP A 137 29.495 47.262 18.034 1.00 12.28 C ATOM 1243 CH2 TRP A 137 30.027 45.971 18.178 1.00 14.29 C ATOM 1244 HE1 TRP A 137 27.017 43.100 17.424 1.00 0.00 H ATOM 1245 H TRP A 137 22.731 45.958 17.869 1.00 0.00 H ATOM 1246 N VAL A 138 23.902 49.864 18.613 1.00 5.84 N ATOM 1247 CA VAL A 138 23.277 51.159 18.393 1.00 6.63 C ATOM 1248 C VAL A 138 24.284 51.966 17.567 1.00 5.98 C ATOM 1249 O VAL A 138 25.516 51.827 17.742 1.00 6.74 O ATOM 1250 CB VAL A 138 22.925 51.871 19.723 1.00 8.40 C ATOM 1251 CG1 VAL A 138 24.164 52.152 20.544 1.00 10.06 C ATOM 1252 CG2 VAL A 138 22.144 53.133 19.431 1.00 10.77 C ATOM 1253 H VAL A 138 24.766 49.801 19.188 1.00 0.00 H ATOM 1254 N THR A 139 23.773 52.763 16.643 1.00 5.59 N ATOM 1255 CA THR A 139 24.601 53.561 15.753 1.00 5.89 C ATOM 1256 C THR A 139 24.031 54.960 15.593 1.00 6.14 C ATOM 1257 O THR A 139 22.812 55.179 15.701 1.00 7.42 O ATOM 1258 CB THR A 139 24.701 52.885 14.363 1.00 6.78 C ATOM 1259 OG1 THR A 139 23.383 52.565 13.881 1.00 7.70 O ATOM 1260 CG2 THR A 139 25.499 51.605 14.451 1.00 9.58 C ATOM 1261 HG1 THR A 139 22.850 53.396 13.804 1.00 0.00 H ATOM 1262 H THR A 139 22.739 52.821 16.549 1.00 0.00 H ATOM 1263 N GLY A 140 24.907 55.926 15.343 1.00 5.77 N ATOM 1264 CA GLY A 140 24.423 57.270 15.122 1.00 6.58 C ATOM 1265 C GLY A 140 25.510 58.315 15.138 1.00 6.17 C ATOM 1266 O GLY A 140 26.685 58.037 15.437 1.00 6.53 O ATOM 1267 H GLY A 140 25.926 55.719 15.307 1.00 0.00 H ATOM 1268 N TRP A 141 25.089 59.538 14.837 1.00 5.78 N ATOM 1269 CA TRP A 141 25.969 60.702 14.825 1.00 6.26 C ATOM 1270 C TRP A 141 25.701 61.605 16.023 1.00 8.05 C ATOM 1271 O TRP A 141 26.081 62.790 16.019 1.00 10.04 O ATOM 1272 CB TRP A 141 25.757 61.502 13.539 1.00 7.25 C ATOM 1273 CG TRP A 141 26.279 60.812 12.302 1.00 5.89 C ATOM 1274 CD1 TRP A 141 27.564 60.864 11.815 1.00 7.49 C ATOM 1275 CD2 TRP A 141 25.534 60.010 11.373 1.00 5.93 C ATOM 1276 NE1 TRP A 141 27.658 60.157 10.638 1.00 6.77 N ATOM 1277 CE2 TRP A 141 26.433 59.626 10.339 1.00 5.72 C ATOM 1278 CE3 TRP A 141 24.198 59.586 11.303 1.00 5.92 C ATOM 1279 CZ2 TRP A 141 26.035 58.838 9.246 1.00 5.95 C ATOM 1280 CZ3 TRP A 141 23.800 58.810 10.229 1.00 6.69 C ATOM 1281 CH2 TRP A 141 24.710 58.442 9.215 1.00 7.02 C ATOM 1282 HE1 TRP A 141 28.521 60.045 10.068 1.00 0.00 H ATOM 1283 H TRP A 141 24.086 59.672 14.599 1.00 0.00 H ATOM 1284 N GLY A 142 25.038 61.081 17.037 1.00 7.10 N ATOM 1285 CA GLY A 142 24.772 61.899 18.211 1.00 7.40 C ATOM 1286 C GLY A 142 25.976 62.199 19.081 1.00 8.06 C ATOM 1287 O GLY A 142 27.134 61.848 18.787 1.00 7.82 O ATOM 1288 H GLY A 142 24.710 60.095 16.997 1.00 0.00 H ATOM 1289 N HIS A 143 25.705 62.877 20.185 1.00 7.84 N ATOM 1290 CA HIS A 143 26.764 63.235 21.120 1.00 8.77 C ATOM 1291 C HIS A 143 27.564 62.036 21.603 1.00 8.46 C ATOM 1292 O HIS A 143 27.023 60.950 21.825 1.00 8.21 O ATOM 1293 CB HIS A 143 26.159 63.928 22.339 1.00 9.93 C ATOM 1294 CG HIS A 143 25.586 65.273 22.045 1.00 11.11 C ATOM 1295 ND1 HIS A 143 24.984 66.050 23.014 1.00 13.84 N ATOM 1296 CD2 HIS A 143 25.527 65.982 20.897 1.00 12.51 C ATOM 1297 CE1 HIS A 143 24.583 67.182 22.469 1.00 12.83 C ATOM 1298 NE2 HIS A 143 24.899 67.170 21.187 1.00 14.62 N ATOM 1299 H HIS A 143 24.724 63.158 20.388 1.00 0.00 H ATOM 1300 N THR A 144 28.867 62.242 21.800 1.00 8.75 N ATOM 1301 CA THR A 144 29.717 61.169 22.277 1.00 9.99 C ATOM 1302 C THR A 144 29.952 61.233 23.795 1.00 9.63 C ATOM 1303 O THR A 144 30.650 60.393 24.356 1.00 11.21 O ATOM 1304 CB THR A 144 31.031 61.144 21.510 1.00 9.59 C ATOM 1305 OG1 THR A 144 31.698 62.409 21.679 1.00 12.86 O ATOM 1306 CG2 THR A 144 30.750 60.938 20.012 1.00 11.61 C ATOM 1307 HG1 THR A 144 31.121 63.134 21.330 1.00 0.00 H ATOM 1308 H THR A 144 29.276 63.179 21.610 1.00 0.00 H ATOM 1309 N GLN A 145 29.351 62.235 24.431 1.00 11.25 N ATOM 1310 CA GLN A 145 29.346 62.391 25.896 1.00 13.84 C ATOM 1311 C GLN A 145 28.108 63.220 26.193 1.00 13.68 C ATOM 1312 O GLN A 145 27.718 64.053 25.376 1.00 13.23 O ATOM 1313 CB GLN A 145 30.579 63.135 26.439 1.00 16.85 C ATOM 1314 CG GLN A 145 31.874 62.321 26.454 1.00 20.08 C ATOM 1315 CD GLN A 145 32.791 62.681 27.617 1.00 23.82 C ATOM 1316 OE1 GLN A 145 32.608 62.196 28.747 1.00 26.05 O ATOM 1317 NE2 GLN A 145 33.763 63.542 27.358 1.00 23.93 N ATOM 1318 HE22 GLN A 145 33.879 63.922 26.397 1.00 0.00 H ATOM 1319 HE21 GLN A 145 34.411 63.838 28.116 1.00 0.00 H ATOM 1320 H GLN A 145 28.856 62.950 23.861 1.00 0.00 H ATOM 1321 N TYR A 146 27.482 63.000 27.349 1.00 15.00 N ATOM 1322 CA TYR A 146 26.303 63.788 27.682 1.00 17.30 C ATOM 1323 C TYR A 146 26.743 65.240 27.750 1.00 18.71 C ATOM 1324 O TYR A 146 27.755 65.556 28.377 1.00 18.83 O ATOM 1325 CB TYR A 146 25.696 63.362 29.029 1.00 18.17 C ATOM 1326 CG TYR A 146 24.551 64.261 29.448 1.00 21.03 C ATOM 1327 CD1 TYR A 146 23.309 64.190 28.815 1.00 21.68 C ATOM 1328 CD2 TYR A 146 24.744 65.249 30.414 1.00 23.10 C ATOM 1329 CE1 TYR A 146 22.287 65.084 29.126 1.00 24.09 C ATOM 1330 CE2 TYR A 146 23.730 66.151 30.728 1.00 24.73 C ATOM 1331 CZ TYR A 146 22.509 66.066 30.082 1.00 25.12 C ATOM 1332 OH TYR A 146 21.526 66.984 30.386 1.00 27.07 O ATOM 1333 HH TYR A 146 20.719 66.792 29.846 1.00 0.00 H ATOM 1334 H TYR A 146 27.832 62.274 28.006 1.00 0.00 H ATOM 1335 N GLY A 147 25.988 66.109 27.088 1.00 18.70 N ATOM 1336 CA GLY A 147 26.307 67.524 27.074 1.00 20.24 C ATOM 1337 C GLY A 147 27.511 67.790 26.193 1.00 21.21 C ATOM 1338 O GLY A 147 28.014 68.913 26.138 1.00 23.08 O ATOM 1339 H GLY A 147 25.153 65.769 26.570 1.00 0.00 H ATOM 1340 N GLY A 148 27.956 66.757 25.485 1.00 20.60 N ATOM 1341 CA GLY A 148 29.119 66.874 24.625 1.00 18.84 C ATOM 1342 C GLY A 148 28.815 67.305 23.205 1.00 18.19 C ATOM 1343 O GLY A 148 27.897 68.091 22.958 1.00 18.99 O ATOM 1344 H GLY A 148 27.460 65.845 25.549 1.00 0.00 H ATOM 1345 N THR A 150 29.584 66.784 22.255 1.00 18.41 N ATOM 1346 CA THR A 150 29.374 67.160 20.867 1.00 18.77 C ATOM 1347 C THR A 150 29.125 65.959 19.956 1.00 16.20 C ATOM 1348 O THR A 150 29.567 64.839 20.241 1.00 16.37 O ATOM 1349 CB THR A 150 30.568 67.981 20.345 1.00 21.40 C ATOM 1350 OG1 THR A 150 31.777 67.277 20.627 1.00 23.93 O ATOM 1351 CG2 THR A 150 30.618 69.347 21.030 1.00 23.87 C ATOM 1352 HG1 THR A 150 32.548 67.801 20.293 1.00 0.00 H ATOM 1353 H THR A 150 30.335 66.109 22.504 1.00 0.00 H ATOM 1354 N GLY A 151 28.405 66.220 18.878 1.00 16.12 N ATOM 1355 CA GLY A 151 28.065 65.184 17.915 1.00 15.51 C ATOM 1356 C GLY A 151 29.287 64.620 17.216 1.00 15.48 C ATOM 1357 O GLY A 151 30.361 65.243 17.183 1.00 17.18 O ATOM 1358 H GLY A 151 28.073 67.192 18.714 1.00 0.00 H ATOM 1359 N ALA A 152 29.143 63.431 16.651 1.00 12.75 N ATOM 1360 CA ALA A 152 30.252 62.813 15.948 1.00 11.83 C ATOM 1361 C ALA A 152 30.162 63.083 14.453 1.00 10.57 C ATOM 1362 O ALA A 152 29.074 63.006 13.871 1.00 12.37 O ATOM 1363 CB ALA A 152 30.241 61.324 16.199 1.00 13.91 C ATOM 1364 H ALA A 152 28.230 62.937 16.711 1.00 0.00 H ATOM 1365 N LEU A 153 31.292 63.435 13.837 1.00 9.66 N ATOM 1366 CA LEU A 153 31.291 63.631 12.388 1.00 10.12 C ATOM 1367 C LEU A 153 31.209 62.259 11.720 1.00 8.59 C ATOM 1368 O LEU A 153 30.458 62.068 10.767 1.00 8.71 O ATOM 1369 CB LEU A 153 32.569 64.337 11.923 1.00 12.31 C ATOM 1370 CG LEU A 153 32.665 65.800 12.372 1.00 15.69 C ATOM 1371 CD1 LEU A 153 33.999 66.389 11.899 1.00 16.34 C ATOM 1372 CD2 LEU A 153 31.497 66.600 11.836 1.00 16.11 C ATOM 1373 H LEU A 153 32.167 63.569 14.383 1.00 0.00 H ATOM 1374 N ILE A 154 31.968 61.300 12.244 1.00 8.86 N ATOM 1375 CA ILE A 154 31.988 59.940 11.708 1.00 8.31 C ATOM 1376 C ILE A 154 30.980 59.061 12.454 1.00 8.08 C ATOM 1377 O ILE A 154 30.940 59.076 13.672 1.00 7.25 O ATOM 1378 CB ILE A 154 33.396 59.318 11.838 1.00 9.80 C ATOM 1379 CG1 ILE A 154 34.399 60.146 11.029 1.00 12.45 C ATOM 1380 CG2 ILE A 154 33.380 57.878 11.361 1.00 9.50 C ATOM 1381 CD1 ILE A 154 34.149 60.139 9.567 1.00 16.01 C ATOM 1382 H ILE A 154 32.568 61.526 13.063 1.00 0.00 H ATOM 1383 N LEU A 155 30.161 58.325 11.707 1.00 7.03 N ATOM 1384 CA LEU A 155 29.150 57.449 12.308 1.00 6.91 C ATOM 1385 C LEU A 155 29.770 56.569 13.394 1.00 6.10 C ATOM 1386 O LEU A 155 30.819 55.959 13.164 1.00 6.90 O ATOM 1387 CB LEU A 155 28.535 56.569 11.221 1.00 5.88 C ATOM 1388 CG LEU A 155 27.432 55.604 11.678 1.00 6.49 C ATOM 1389 CD1 LEU A 155 26.203 56.354 12.216 1.00 6.79 C ATOM 1390 CD2 LEU A 155 27.064 54.712 10.489 1.00 8.89 C ATOM 1391 H LEU A 155 30.240 58.372 10.671 1.00 0.00 H ATOM 1392 N GLN A 156 29.137 56.516 14.568 1.00 6.16 N ATOM 1393 CA GLN A 156 29.614 55.693 15.680 1.00 5.50 C ATOM 1394 C GLN A 156 28.755 54.460 15.872 1.00 5.93 C ATOM 1395 O GLN A 156 27.569 54.466 15.535 1.00 6.65 O ATOM 1396 CB GLN A 156 29.558 56.486 16.986 1.00 6.64 C ATOM 1397 CG GLN A 156 30.376 57.757 16.962 1.00 7.77 C ATOM 1398 CD GLN A 156 31.858 57.454 16.934 1.00 7.77 C ATOM 1399 OE1 GLN A 156 32.422 56.890 17.896 1.00 9.24 O ATOM 1400 NE2 GLN A 156 32.498 57.798 15.819 1.00 8.78 N ATOM 1401 HE22 GLN A 156 31.982 58.266 15.047 1.00 0.00 H ATOM 1402 HE21 GLN A 156 33.514 57.599 15.720 1.00 0.00 H ATOM 1403 H GLN A 156 28.273 57.080 14.697 1.00 0.00 H ATOM 1404 N LYS A 157 29.348 53.422 16.441 1.00 5.69 N ATOM 1405 CA LYS A 157 28.632 52.202 16.764 1.00 5.85 C ATOM 1406 C LYS A 157 29.001 51.808 18.192 1.00 6.72 C ATOM 1407 O LYS A 157 30.115 52.063 18.654 1.00 7.59 O ATOM 1408 CB LYS A 157 29.005 51.052 15.822 1.00 6.81 C ATOM 1409 CG LYS A 157 30.501 50.688 15.833 1.00 7.52 C ATOM 1410 CD LYS A 157 30.810 49.524 14.914 1.00 9.41 C ATOM 1411 CE LYS A 157 32.299 49.248 14.893 1.00 10.45 C ATOM 1412 NZ LYS A 157 32.616 48.168 13.903 1.00 12.29 N ATOM 1413 HZ1 LYS A 157 32.113 47.297 14.169 1.00 0.00 H ATOM 1414 HZ2 LYS A 157 32.313 48.469 12.955 1.00 0.00 H ATOM 1415 HZ3 LYS A 157 33.641 47.991 13.901 1.00 0.00 H ATOM 1416 H LYS A 157 30.362 53.483 16.664 1.00 0.00 H ATOM 1417 N GLY A 158 28.069 51.167 18.879 1.00 7.18 N ATOM 1418 CA GLY A 158 28.299 50.705 20.237 1.00 8.18 C ATOM 1419 C GLY A 158 27.512 49.436 20.494 1.00 7.37 C ATOM 1420 O GLY A 158 26.382 49.318 20.008 1.00 7.49 O ATOM 1421 H GLY A 158 27.146 50.989 18.434 1.00 0.00 H ATOM 1422 N GLU A 159 28.088 48.497 21.246 1.00 6.46 N ATOM 1423 CA GLU A 159 27.415 47.245 21.565 1.00 7.33 C ATOM 1424 C GLU A 159 26.775 47.372 22.950 1.00 6.87 C ATOM 1425 O GLU A 159 27.427 47.760 23.932 1.00 7.40 O ATOM 1426 CB GLU A 159 28.432 46.101 21.556 1.00 9.38 C ATOM 1427 CG GLU A 159 27.816 44.724 21.697 1.00 14.31 C ATOM 1428 CD GLU A 159 28.825 43.615 21.426 1.00 17.76 C ATOM 1429 OE1 GLU A 159 29.985 43.763 21.858 1.00 22.03 O ATOM 1430 OE2 GLU A 159 28.459 42.611 20.786 1.00 20.66 O ATOM 1431 H GLU A 159 29.046 48.664 21.615 1.00 0.00 H ATOM 1432 N ILE A 160 25.483 47.055 23.025 1.00 6.59 N ATOM 1433 CA ILE A 160 24.711 47.152 24.273 1.00 6.77 C ATOM 1434 C ILE A 160 23.864 45.887 24.428 1.00 6.97 C ATOM 1435 O ILE A 160 23.749 45.121 23.467 1.00 9.63 O ATOM 1436 CB ILE A 160 23.826 48.436 24.261 1.00 5.19 C ATOM 1437 CG1 ILE A 160 23.072 48.579 22.931 1.00 6.17 C ATOM 1438 CG2 ILE A 160 24.706 49.658 24.511 1.00 7.38 C ATOM 1439 CD1 ILE A 160 22.077 49.708 22.922 1.00 6.25 C ATOM 1440 H ILE A 160 25.000 46.725 22.165 1.00 0.00 H ATOM 1441 N ARG A 161 23.303 45.638 25.606 1.00 6.66 N ATOM 1442 CA ARG A 161 22.524 44.406 25.782 1.00 6.57 C ATOM 1443 C ARG A 161 21.113 44.678 26.262 1.00 6.34 C ATOM 1444 O ARG A 161 20.864 45.620 27.013 1.00 6.43 O ATOM 1445 CB ARG A 161 23.221 43.461 26.779 1.00 8.21 C ATOM 1446 CG ARG A 161 24.536 42.920 26.227 1.00 10.31 C ATOM 1447 CD ARG A 161 25.189 41.863 27.114 1.00 14.25 C ATOM 1448 NE ARG A 161 26.437 41.388 26.510 1.00 16.20 N ATOM 1449 CZ ARG A 161 26.533 40.380 25.641 1.00 15.69 C ATOM 1450 NH1 ARG A 161 25.457 39.693 25.254 1.00 16.46 N ATOM 1451 NH2 ARG A 161 27.719 40.079 25.126 1.00 18.66 N ATOM 1452 HE ARG A 161 27.316 41.874 26.780 1.00 0.00 H ATOM 1453 HH12 ARG A 161 25.556 38.911 24.575 1.00 0.00 H ATOM 1454 HH11 ARG A 161 24.519 39.939 25.631 1.00 0.00 H ATOM 1455 HH22 ARG A 161 27.808 39.296 24.448 1.00 0.00 H ATOM 1456 HH21 ARG A 161 28.559 40.626 25.401 1.00 0.00 H ATOM 1457 H ARG A 161 23.414 46.308 26.394 1.00 0.00 H ATOM 1458 N VAL A 162 20.184 43.843 25.808 1.00 6.06 N ATOM 1459 CA VAL A 162 18.794 43.979 26.210 1.00 6.66 C ATOM 1460 C VAL A 162 18.683 43.738 27.706 1.00 6.72 C ATOM 1461 O VAL A 162 19.251 42.771 28.237 1.00 7.73 O ATOM 1462 CB VAL A 162 17.907 42.947 25.433 1.00 7.41 C ATOM 1463 CG1 VAL A 162 16.450 43.034 25.921 1.00 7.72 C ATOM 1464 CG2 VAL A 162 17.993 43.215 23.931 1.00 8.53 C ATOM 1465 H VAL A 162 20.456 43.081 25.155 1.00 0.00 H ATOM 1466 N ILE A 163 17.954 44.606 28.388 1.00 7.11 N ATOM 1467 CA ILE A 163 17.768 44.483 29.825 1.00 7.94 C ATOM 1468 C ILE A 163 16.344 43.990 30.098 1.00 8.06 C ATOM 1469 O ILE A 163 15.406 44.296 29.368 1.00 8.25 O ATOM 1470 CB ILE A 163 18.032 45.871 30.483 1.00 10.04 C ATOM 1471 CG1 ILE A 163 19.541 46.156 30.432 1.00 11.03 C ATOM 1472 CG2 ILE A 163 17.500 45.924 31.924 1.00 10.28 C ATOM 1473 CD1 ILE A 163 19.895 47.595 30.699 1.00 11.83 C ATOM 1474 H ILE A 163 17.503 45.396 27.884 1.00 0.00 H ATOM 1475 N ASN A 164 16.224 43.161 31.133 1.00 9.60 N ATOM 1476 CA ASN A 164 14.958 42.603 31.620 1.00 11.48 C ATOM 1477 C ASN A 164 13.955 43.762 31.863 1.00 10.78 C ATOM 1478 O ASN A 164 14.322 44.786 32.458 1.00 9.65 O ATOM 1479 CB ASN A 164 15.329 41.848 32.908 1.00 14.99 C ATOM 1480 CG ASN A 164 14.152 41.354 33.685 1.00 18.22 C ATOM 1481 OD1 ASN A 164 13.286 42.124 34.099 1.00 18.71 O ATOM 1482 ND2 ASN A 164 14.123 40.044 33.921 1.00 21.69 N ATOM 1483 HD22 ASN A 164 14.878 39.432 33.550 1.00 0.00 H ATOM 1484 HD21 ASN A 164 13.346 39.633 34.476 1.00 0.00 H ATOM 1485 H ASN A 164 17.094 42.889 31.634 1.00 0.00 H ATOM 1486 N GLN A 165 12.707 43.611 31.410 1.00 10.21 N ATOM 1487 CA GLN A 165 11.709 44.680 31.541 1.00 10.79 C ATOM 1488 C GLN A 165 11.382 45.084 32.977 1.00 10.78 C ATOM 1489 O GLN A 165 11.213 46.259 33.266 1.00 10.40 O ATOM 1490 CB GLN A 165 10.423 44.303 30.799 1.00 11.69 C ATOM 1491 CG GLN A 165 9.438 45.438 30.599 1.00 11.94 C ATOM 1492 CD GLN A 165 9.866 46.409 29.498 1.00 10.43 C ATOM 1493 OE1 GLN A 165 10.934 46.260 28.902 1.00 11.35 O ATOM 1494 NE2 GLN A 165 9.026 47.396 29.219 1.00 9.85 N ATOM 1495 HE22 GLN A 165 8.134 47.485 29.747 1.00 0.00 H ATOM 1496 HE21 GLN A 165 9.259 48.081 28.472 1.00 0.00 H ATOM 1497 H GLN A 165 12.436 42.716 30.954 1.00 0.00 H ATOM 1498 N THR A 166 11.315 44.118 33.890 1.00 11.04 N ATOM 1499 CA THR A 166 11.037 44.451 35.282 1.00 11.76 C ATOM 1500 C THR A 166 12.172 45.333 35.831 1.00 10.49 C ATOM 1501 O THR A 166 11.932 46.329 36.523 1.00 10.46 O ATOM 1502 CB THR A 166 10.894 43.162 36.115 1.00 13.76 C ATOM 1503 OG1 THR A 166 9.738 42.441 35.673 1.00 17.16 O ATOM 1504 CG2 THR A 166 10.716 43.492 37.577 1.00 16.30 C ATOM 1505 HG1 THR A 166 9.643 41.612 36.206 1.00 0.00 H ATOM 1506 H THR A 166 11.461 43.127 33.611 1.00 0.00 H ATOM 1507 N THR A 167 13.411 44.960 35.513 1.00 10.36 N ATOM 1508 CA THR A 167 14.564 45.748 35.937 1.00 9.99 C ATOM 1509 C THR A 167 14.446 47.168 35.356 1.00 10.73 C ATOM 1510 O THR A 167 14.629 48.163 36.059 1.00 10.99 O ATOM 1511 CB THR A 167 15.869 45.102 35.443 1.00 10.22 C ATOM 1512 OG1 THR A 167 15.997 43.803 36.042 1.00 14.52 O ATOM 1513 CG2 THR A 167 17.069 45.970 35.810 1.00 12.41 C ATOM 1514 HG1 THR A 167 16.835 43.378 35.730 1.00 0.00 H ATOM 1515 H THR A 167 13.559 44.095 34.955 1.00 0.00 H ATOM 1516 N CYS A 168 14.121 47.248 34.066 1.00 9.80 N ATOM 1517 CA CYS A 168 13.962 48.538 33.391 1.00 10.64 C ATOM 1518 C CYS A 168 12.933 49.421 34.116 1.00 10.21 C ATOM 1519 O CYS A 168 13.207 50.587 34.437 1.00 9.90 O ATOM 1520 CB CYS A 168 13.528 48.273 31.945 1.00 9.90 C ATOM 1521 SG CYS A 168 13.394 49.683 30.818 1.00 12.61 S ATOM 1522 H CYS A 168 13.977 46.372 33.525 1.00 0.00 H ATOM 1523 N GLU A 169 11.752 48.857 34.355 1.00 9.68 N ATOM 1524 CA GLU A 169 10.680 49.590 35.029 1.00 11.53 C ATOM 1525 C GLU A 169 11.119 50.094 36.403 1.00 11.41 C ATOM 1526 O GLU A 169 10.751 51.201 36.808 1.00 13.16 O ATOM 1527 CB GLU A 169 9.445 48.694 35.209 1.00 12.21 C ATOM 1528 CG GLU A 169 8.742 48.254 33.935 1.00 15.58 C ATOM 1529 CD GLU A 169 7.905 46.989 34.155 1.00 18.80 C ATOM 1530 OE1 GLU A 169 7.270 46.498 33.197 1.00 19.75 O ATOM 1531 OE2 GLU A 169 7.901 46.460 35.288 1.00 20.10 O ATOM 1532 H GLU A 169 11.587 47.874 34.056 1.00 0.00 H ATOM 1533 N ASN A 170 11.906 49.289 37.116 1.00 12.11 N ATOM 1534 CA ASN A 170 12.352 49.690 38.445 1.00 14.38 C ATOM 1535 C ASN A 170 13.446 50.758 38.420 1.00 12.50 C ATOM 1536 O ASN A 170 13.539 51.563 39.350 1.00 15.00 O ATOM 1537 CB ASN A 170 12.816 48.465 39.258 1.00 16.07 C ATOM 1538 CG ASN A 170 11.682 47.481 39.539 1.00 18.39 C ATOM 1539 OD1 ASN A 170 10.503 47.841 39.489 1.00 20.95 O ATOM 1540 ND2 ASN A 170 12.042 46.232 39.840 1.00 21.22 N ATOM 1541 HD22 ASN A 170 13.049 45.974 39.870 1.00 0.00 H ATOM 1542 HD21 ASN A 170 11.316 45.516 40.044 1.00 0.00 H ATOM 1543 H ASN A 170 12.203 48.373 36.724 1.00 0.00 H ATOM 1544 N LEU A 171 14.245 50.793 37.348 1.00 12.10 N ATOM 1545 CA LEU A 171 15.315 51.795 37.222 1.00 12.13 C ATOM 1546 C LEU A 171 14.766 53.185 36.888 1.00 11.77 C ATOM 1547 O LEU A 171 15.353 54.194 37.260 1.00 12.62 O ATOM 1548 CB LEU A 171 16.315 51.395 36.114 1.00 13.42 C ATOM 1549 CG LEU A 171 17.174 50.141 36.311 1.00 13.97 C ATOM 1550 CD1 LEU A 171 17.991 49.872 35.054 1.00 15.90 C ATOM 1551 CD2 LEU A 171 18.091 50.325 37.503 1.00 15.60 C ATOM 1552 H LEU A 171 14.107 50.097 36.587 1.00 0.00 H ATOM 1553 N LEU A 172 13.636 53.215 36.178 1.00 10.87 N ATOM 1554 CA LEU A 172 12.999 54.449 35.739 1.00 11.63 C ATOM 1555 C LEU A 172 11.518 54.367 36.120 1.00 10.80 C ATOM 1556 O LEU A 172 10.636 54.235 35.271 1.00 9.74 O ATOM 1557 CB LEU A 172 13.178 54.580 34.218 1.00 10.73 C ATOM 1558 CG LEU A 172 14.668 54.696 33.840 1.00 13.20 C ATOM 1559 CD1 LEU A 172 14.881 54.283 32.399 1.00 14.72 C ATOM 1560 CD2 LEU A 172 15.168 56.115 34.084 1.00 14.97 C ATOM 1561 H LEU A 172 13.188 52.311 35.925 1.00 0.00 H ATOM 1562 N PRO A 173 11.225 54.483 37.426 1.00 12.63 N ATOM 1563 CA PRO A 173 9.862 54.404 37.939 1.00 12.76 C ATOM 1564 C PRO A 173 8.856 55.343 37.318 1.00 9.23 C ATOM 1565 O PRO A 173 9.113 56.535 37.118 1.00 10.43 O ATOM 1566 CB PRO A 173 10.045 54.620 39.451 1.00 15.18 C ATOM 1567 CG PRO A 173 11.245 55.454 39.532 1.00 17.18 C ATOM 1568 CD PRO A 173 12.168 54.845 38.501 1.00 15.50 C ATOM 1569 N GLN A 174 7.694 54.764 37.019 1.00 10.33 N ATOM 1570 CA GLN A 174 6.559 55.468 36.431 1.00 11.48 C ATOM 1571 C GLN A 174 6.844 56.039 35.046 1.00 10.72 C ATOM 1572 O GLN A 174 6.170 56.982 34.602 1.00 10.81 O ATOM 1573 CB GLN A 174 6.095 56.631 37.336 1.00 14.73 C ATOM 1574 CG GLN A 174 5.936 56.280 38.809 1.00 19.46 C ATOM 1575 CD GLN A 174 5.227 54.975 39.019 1.00 22.32 C ATOM 1576 OE1 GLN A 174 4.131 54.768 38.510 1.00 25.25 O ATOM 1577 NE2 GLN A 174 5.848 54.078 39.774 1.00 22.52 N ATOM 1578 HE22 GLN A 174 6.778 54.298 40.185 1.00 0.00 H ATOM 1579 HE21 GLN A 174 5.405 53.154 39.955 1.00 0.00 H ATOM 1580 H GLN A 174 7.589 53.748 37.217 1.00 0.00 H ATOM 1581 N GLN A 175 7.831 55.475 34.355 1.00 9.05 N ATOM 1582 CA GLN A 175 8.198 55.998 33.047 1.00 8.65 C ATOM 1583 C GLN A 175 8.276 54.963 31.938 1.00 8.86 C ATOM 1584 O GLN A 175 8.304 55.338 30.776 1.00 10.49 O ATOM 1585 CB GLN A 175 9.560 56.693 33.118 1.00 9.54 C ATOM 1586 CG GLN A 175 9.572 57.912 34.034 1.00 11.90 C ATOM 1587 CD GLN A 175 10.968 58.362 34.391 1.00 13.10 C ATOM 1588 OE1 GLN A 175 11.617 59.058 33.626 1.00 15.69 O ATOM 1589 NE2 GLN A 175 11.442 57.945 35.552 1.00 15.19 N ATOM 1590 HE22 GLN A 175 10.853 57.353 36.172 1.00 0.00 H ATOM 1591 HE21 GLN A 175 12.404 58.209 35.846 1.00 0.00 H ATOM 1592 H GLN A 175 8.341 54.659 34.750 1.00 0.00 H ATOM 1593 N ILE A 176 8.321 53.687 32.277 1.00 7.88 N ATOM 1594 CA ILE A 176 8.488 52.662 31.257 1.00 7.20 C ATOM 1595 C ILE A 176 7.206 51.974 30.908 1.00 6.72 C ATOM 1596 O ILE A 176 6.596 51.332 31.769 1.00 7.78 O ATOM 1597 CB ILE A 176 9.506 51.617 31.753 1.00 7.91 C ATOM 1598 CG1 ILE A 176 10.823 52.327 32.048 1.00 10.28 C ATOM 1599 CG2 ILE A 176 9.640 50.460 30.763 1.00 8.86 C ATOM 1600 CD1 ILE A 176 11.849 51.446 32.483 1.00 19.06 C ATOM 1601 H ILE A 176 8.237 53.414 33.277 1.00 0.00 H ATOM 1602 N THR A 177 6.789 52.110 29.650 1.00 6.41 N ATOM 1603 CA THR A 177 5.585 51.440 29.183 1.00 6.31 C ATOM 1604 C THR A 177 5.985 50.180 28.417 1.00 7.23 C ATOM 1605 O THR A 177 7.162 49.973 28.077 1.00 6.23 O ATOM 1606 CB THR A 177 4.777 52.305 28.205 1.00 6.12 C ATOM 1607 OG1 THR A 177 5.460 52.324 26.932 1.00 6.36 O ATOM 1608 CG2 THR A 177 4.621 53.729 28.712 1.00 7.37 C ATOM 1609 HG1 THR A 177 4.948 52.879 26.292 1.00 0.00 H ATOM 1610 H THR A 177 7.332 52.704 28.992 1.00 0.00 H ATOM 1611 N PRO A 178 5.003 49.315 28.107 1.00 5.88 N ATOM 1612 CA PRO A 178 5.321 48.089 27.368 1.00 6.43 C ATOM 1613 C PRO A 178 5.831 48.329 25.946 1.00 5.63 C ATOM 1614 O PRO A 178 6.329 47.395 25.304 1.00 7.39 O ATOM 1615 CB PRO A 178 4.010 47.293 27.388 1.00 7.39 C ATOM 1616 CG PRO A 178 3.388 47.739 28.712 1.00 9.09 C ATOM 1617 CD PRO A 178 3.661 49.240 28.721 1.00 7.71 C ATOM 1618 N ARG A 179 5.706 49.559 25.444 1.00 5.78 N ATOM 1619 CA ARG A 179 6.251 49.862 24.100 1.00 5.50 C ATOM 1620 C ARG A 179 7.749 50.122 24.184 1.00 5.92 C ATOM 1621 O ARG A 179 8.414 50.180 23.157 1.00 7.42 O ATOM 1622 CB ARG A 179 5.604 51.112 23.479 1.00 5.52 C ATOM 1623 CG ARG A 179 4.301 50.816 22.719 1.00 7.10 C ATOM 1624 CD ARG A 179 3.244 50.157 23.609 1.00 6.51 C ATOM 1625 NE ARG A 179 2.799 51.058 24.668 1.00 6.06 N ATOM 1626 CZ ARG A 179 1.973 50.689 25.644 1.00 6.46 C ATOM 1627 NH1 ARG A 179 1.523 49.434 25.692 1.00 7.17 N ATOM 1628 NH2 ARG A 179 1.580 51.587 26.528 1.00 6.51 N ATOM 1629 HE ARG A 179 3.145 52.039 24.659 1.00 0.00 H ATOM 1630 HH12 ARG A 179 0.877 49.142 26.453 1.00 0.00 H ATOM 1631 HH11 ARG A 179 1.818 48.748 24.968 1.00 0.00 H ATOM 1632 HH22 ARG A 179 0.935 51.313 27.296 1.00 0.00 H ATOM 1633 HH21 ARG A 179 1.916 52.569 26.456 1.00 0.00 H ATOM 1634 H ARG A 179 5.228 50.302 25.994 1.00 0.00 H ATOM 1635 N MET A 180 8.265 50.252 25.405 1.00 4.83 N ATOM 1636 CA MET A 180 9.660 50.608 25.611 1.00 5.32 C ATOM 1637 C MET A 180 10.501 49.432 26.040 1.00 5.58 C ATOM 1638 O MET A 180 10.004 48.453 26.604 1.00 6.87 O ATOM 1639 CB MET A 180 9.732 51.688 26.672 1.00 5.95 C ATOM 1640 CG MET A 180 9.032 52.980 26.258 1.00 5.72 C ATOM 1641 SD MET A 180 8.927 54.095 27.687 1.00 6.19 S ATOM 1642 CE MET A 180 7.714 55.283 27.090 1.00 7.70 C ATOM 1643 H MET A 180 7.655 50.095 26.232 1.00 0.00 H ATOM 1644 N MET A 181 11.798 49.538 25.791 1.00 5.91 N ATOM 1645 CA MET A 181 12.754 48.510 26.190 1.00 6.53 C ATOM 1646 C MET A 181 14.051 49.198 26.598 1.00 6.05 C ATOM 1647 O MET A 181 14.500 50.129 25.927 1.00 6.76 O ATOM 1648 CB MET A 181 13.009 47.561 25.013 1.00 9.40 C ATOM 1649 CG MET A 181 14.086 46.508 25.224 1.00 12.88 C ATOM 1650 SD MET A 181 14.265 45.456 23.757 1.00 20.10 S ATOM 1651 CE MET A 181 14.444 46.645 22.554 1.00 18.14 C ATOM 1652 H MET A 181 12.147 50.383 25.294 1.00 0.00 H ATOM 1653 N CYS A 182 14.628 48.802 27.719 1.00 7.10 N ATOM 1654 CA CYS A 182 15.934 49.344 28.127 1.00 7.95 C ATOM 1655 C CYS A 182 17.021 48.477 27.489 1.00 6.28 C ATOM 1656 O CYS A 182 16.926 47.245 27.502 1.00 6.43 O ATOM 1657 CB CYS A 182 16.140 49.264 29.631 1.00 9.14 C ATOM 1658 SG CYS A 182 15.268 50.433 30.703 1.00 12.39 S ATOM 1659 H CYS A 182 14.153 48.099 28.320 1.00 0.00 H ATOM 1660 N VAL A 183 18.052 49.116 26.937 1.00 6.30 N ATOM 1661 CA VAL A 183 19.153 48.380 26.316 1.00 5.51 C ATOM 1662 C VAL A 183 20.407 49.145 26.688 1.00 6.30 C ATOM 1663 O VAL A 183 20.462 50.366 26.532 1.00 7.07 O ATOM 1664 CB VAL A 183 19.015 48.315 24.763 1.00 5.69 C ATOM 1665 CG1 VAL A 183 20.020 47.333 24.177 1.00 7.27 C ATOM 1666 CG2 VAL A 183 17.580 47.912 24.358 1.00 6.37 C ATOM 1667 H VAL A 183 18.074 50.156 26.948 1.00 0.00 H ATOM 1668 N GLY A 184 21.428 48.438 27.174 1.00 5.93 N ATOM 1669 CA GLY A 184 22.644 49.100 27.620 1.00 6.53 C ATOM 1670 C GLY A 184 23.269 48.260 28.701 1.00 6.92 C ATOM 1671 O GLY A 184 23.273 47.034 28.587 1.00 7.95 O ATOM 1672 H GLY A 184 21.354 47.402 27.235 1.00 0.00 H ATOM 1673 N PHE A 184A 23.811 48.921 29.723 1.00 7.93 N ATOM 1674 CA PHE A 184A 24.456 48.238 30.844 1.00 8.26 C ATOM 1675 C PHE A 184A 24.113 48.966 32.121 1.00 8.59 C ATOM 1676 O PHE A 184A 24.097 50.190 32.138 1.00 9.20 O ATOM 1677 CB PHE A 184A 25.987 48.269 30.689 1.00 8.94 C ATOM 1678 CG PHE A 184A 26.474 47.597 29.455 1.00 7.97 C ATOM 1679 CD1 PHE A 184A 26.592 46.225 29.415 1.00 8.63 C ATOM 1680 CD2 PHE A 184A 26.729 48.334 28.295 1.00 8.99 C ATOM 1681 CE1 PHE A 184A 26.954 45.571 28.240 1.00 9.02 C ATOM 1682 CE2 PHE A 184A 27.088 47.686 27.113 1.00 8.43 C ATOM 1683 CZ PHE A 184A 27.204 46.300 27.084 1.00 9.67 C ATOM 1684 H PHE A 184A 23.774 49.960 29.724 1.00 0.00 H ATOM 1685 N LEU A 185 23.850 48.228 33.205 1.00 9.96 N ATOM 1686 CA LEU A 185 23.596 48.890 34.472 1.00 11.38 C ATOM 1687 C LEU A 185 24.831 49.683 34.935 1.00 10.54 C ATOM 1688 O LEU A 185 24.706 50.655 35.676 1.00 11.59 O ATOM 1689 CB LEU A 185 23.229 47.881 35.557 1.00 14.62 C ATOM 1690 CG LEU A 185 22.079 46.932 35.231 1.00 18.06 C ATOM 1691 CD1 LEU A 185 21.693 46.184 36.496 1.00 21.17 C ATOM 1692 CD2 LEU A 185 20.906 47.709 34.658 1.00 19.63 C ATOM 1693 H LEU A 185 23.828 47.190 33.141 1.00 0.00 H ATOM 1694 N SER A 186 26.021 49.265 34.509 1.00 11.07 N ATOM 1695 CA SER A 186 27.230 50.001 34.896 1.00 11.54 C ATOM 1696 C SER A 186 27.463 51.232 34.031 1.00 11.57 C ATOM 1697 O SER A 186 28.385 51.995 34.281 1.00 12.07 O ATOM 1698 CB SER A 186 28.464 49.103 34.833 1.00 15.13 C ATOM 1699 OG SER A 186 28.599 48.524 33.555 1.00 19.77 O ATOM 1700 HG SER A 186 27.797 47.979 33.355 1.00 0.00 H ATOM 1701 H SER A 186 26.093 48.421 33.905 1.00 0.00 H ATOM 1702 N GLY A 186A 26.626 51.430 33.010 1.00 10.10 N ATOM 1703 CA GLY A 186A 26.782 52.555 32.113 1.00 10.55 C ATOM 1704 C GLY A 186A 27.864 52.306 31.071 1.00 10.00 C ATOM 1705 O GLY A 186A 28.054 51.185 30.612 1.00 10.86 O ATOM 1706 H GLY A 186A 25.845 50.761 32.856 1.00 0.00 H ATOM 1707 N GLY A 187 28.524 53.378 30.653 1.00 9.86 N ATOM 1708 CA GLY A 187 29.638 53.255 29.722 1.00 9.90 C ATOM 1709 C GLY A 187 29.361 53.369 28.237 1.00 10.11 C ATOM 1710 O GLY A 187 30.060 54.106 27.519 1.00 9.74 O ATOM 1711 H GLY A 187 28.242 54.319 30.994 1.00 0.00 H ATOM 1712 N VAL A 188 28.380 52.616 27.756 1.00 8.47 N ATOM 1713 CA VAL A 188 28.007 52.640 26.334 1.00 8.18 C ATOM 1714 C VAL A 188 26.522 52.947 26.302 1.00 7.22 C ATOM 1715 O VAL A 188 25.741 52.295 27.017 1.00 7.22 O ATOM 1716 CB VAL A 188 28.255 51.277 25.663 1.00 7.82 C ATOM 1717 CG1 VAL A 188 27.922 51.377 24.208 1.00 8.92 C ATOM 1718 CG2 VAL A 188 29.723 50.850 25.838 1.00 11.31 C ATOM 1719 H VAL A 188 27.860 51.991 28.404 1.00 0.00 H ATOM 1720 N ASP A 189 26.131 53.928 25.492 1.00 6.62 N ATOM 1721 CA ASP A 189 24.713 54.324 25.452 1.00 6.12 C ATOM 1722 C ASP A 189 24.497 55.234 24.245 1.00 7.53 C ATOM 1723 O ASP A 189 25.448 55.740 23.645 1.00 8.34 O ATOM 1724 CB ASP A 189 24.419 55.109 26.756 1.00 8.41 C ATOM 1725 CG ASP A 189 22.930 55.238 27.100 1.00 10.61 C ATOM 1726 OD1 ASP A 189 22.056 54.668 26.403 1.00 10.72 O ATOM 1727 OD2 ASP A 189 22.651 55.912 28.134 1.00 13.67 O ATOM 1728 H ASP A 189 26.825 54.414 24.889 1.00 0.00 H ATOM 1729 N SER A 190 23.241 55.404 23.844 1.00 7.03 N ATOM 1730 CA SER A 190 22.932 56.369 22.799 1.00 8.14 C ATOM 1731 C SER A 190 22.841 57.738 23.496 1.00 7.71 C ATOM 1732 O SER A 190 22.865 57.827 24.735 1.00 8.49 O ATOM 1733 CB SER A 190 21.620 56.017 22.095 1.00 10.30 C ATOM 1734 OG SER A 190 20.621 55.740 23.031 1.00 13.65 O ATOM 1735 HG SER A 190 20.900 54.974 23.593 1.00 0.00 H ATOM 1736 H SER A 190 22.478 54.846 24.278 1.00 0.00 H ATOM 1737 N CYS A 191 22.771 58.805 22.720 1.00 6.78 N ATOM 1738 CA CYS A 191 22.702 60.148 23.289 1.00 7.56 C ATOM 1739 C CYS A 191 22.047 61.108 22.313 1.00 8.71 C ATOM 1740 O CYS A 191 21.623 60.698 21.238 1.00 8.88 O ATOM 1741 CB CYS A 191 24.129 60.603 23.667 1.00 10.53 C ATOM 1742 SG CYS A 191 24.268 61.824 25.029 1.00 13.55 S ATOM 1743 H CYS A 191 22.765 58.686 21.687 1.00 0.00 H ATOM 1744 N GLN A 192 21.936 62.378 22.690 1.00 8.34 N ATOM 1745 CA GLN A 192 21.280 63.374 21.851 1.00 7.95 C ATOM 1746 C GLN A 192 21.745 63.296 20.410 1.00 8.07 C ATOM 1747 O GLN A 192 22.946 63.325 20.160 1.00 8.57 O ATOM 1748 CB GLN A 192 21.537 64.782 22.407 1.00 9.89 C ATOM 1749 CG GLN A 192 20.844 65.875 21.575 1.00 11.54 C ATOM 1750 CD GLN A 192 21.112 67.300 22.078 1.00 14.07 C ATOM 1751 OE1 GLN A 192 21.359 68.220 21.285 1.00 17.72 O ATOM 1752 NE2 GLN A 192 21.053 67.483 23.383 1.00 15.48 N ATOM 1753 HE22 GLN A 192 20.842 66.682 24.011 1.00 0.00 H ATOM 1754 HE21 GLN A 192 21.217 68.429 23.783 1.00 0.00 H ATOM 1755 H GLN A 192 22.328 62.669 23.608 1.00 0.00 H ATOM 1756 N GLY A 193 20.803 63.234 19.477 1.00 6.54 N ATOM 1757 CA GLY A 193 21.144 63.156 18.066 1.00 6.45 C ATOM 1758 C GLY A 193 21.123 61.740 17.509 1.00 5.56 C ATOM 1759 O GLY A 193 21.128 61.551 16.298 1.00 6.98 O ATOM 1760 H GLY A 193 19.802 63.241 19.761 1.00 0.00 H ATOM 1761 N ASP A 194 21.111 60.754 18.403 1.00 5.53 N ATOM 1762 CA ASP A 194 21.012 59.362 17.963 1.00 5.70 C ATOM 1763 C ASP A 194 19.534 58.964 17.829 1.00 5.69 C ATOM 1764 O ASP A 194 19.219 57.951 17.193 1.00 6.35 O ATOM 1765 CB ASP A 194 21.667 58.419 18.982 1.00 6.17 C ATOM 1766 CG ASP A 194 23.184 58.528 19.005 1.00 5.72 C ATOM 1767 OD1 ASP A 194 23.759 58.769 17.923 1.00 7.32 O ATOM 1768 OD2 ASP A 194 23.774 58.343 20.091 1.00 6.46 O ATOM 1769 H ASP A 194 21.172 60.974 19.418 1.00 0.00 H ATOM 1770 N SER A 195 18.634 59.757 18.425 1.00 5.37 N ATOM 1771 CA SER A 195 17.196 59.482 18.377 1.00 4.93 C ATOM 1772 C SER A 195 16.702 59.148 16.995 1.00 5.33 C ATOM 1773 O SER A 195 17.103 59.777 16.015 1.00 5.46 O ATOM 1774 CB SER A 195 16.405 60.682 18.858 1.00 7.99 C ATOM 1775 OG SER A 195 16.603 60.906 20.240 1.00 10.70 O ATOM 1776 HG SER A 195 16.075 61.694 20.524 1.00 0.00 H ATOM 1777 H SER A 195 18.968 60.597 18.940 1.00 0.00 H ATOM 1778 N GLY A 196 15.810 58.159 16.918 1.00 4.31 N ATOM 1779 CA GLY A 196 15.251 57.810 15.632 1.00 5.24 C ATOM 1780 C GLY A 196 16.002 56.728 14.897 1.00 4.40 C ATOM 1781 O GLY A 196 15.436 56.083 14.004 1.00 5.30 O ATOM 1782 H GLY A 196 15.520 57.645 17.774 1.00 0.00 H ATOM 1783 N GLY A 197 17.273 56.528 15.253 1.00 5.15 N ATOM 1784 CA GLY A 197 18.058 55.510 14.601 1.00 4.67 C ATOM 1785 C GLY A 197 17.679 54.115 15.046 1.00 4.84 C ATOM 1786 O GLY A 197 17.001 53.906 16.051 1.00 5.81 O ATOM 1787 H GLY A 197 17.698 57.109 16.004 1.00 0.00 H ATOM 1788 N PRO A 198 18.142 53.117 14.308 1.00 5.39 N ATOM 1789 CA PRO A 198 17.831 51.731 14.636 1.00 6.11 C ATOM 1790 C PRO A 198 18.768 51.006 15.571 1.00 7.56 C ATOM 1791 O PRO A 198 19.952 51.306 15.639 1.00 9.56 O ATOM 1792 CB PRO A 198 17.861 51.057 13.263 1.00 7.33 C ATOM 1793 CG PRO A 198 19.057 51.740 12.608 1.00 7.17 C ATOM 1794 CD PRO A 198 18.867 53.217 13.023 1.00 6.62 C ATOM 1795 N LEU A 199 18.198 50.083 16.338 1.00 6.33 N ATOM 1796 CA LEU A 199 19.008 49.109 17.076 1.00 6.69 C ATOM 1797 C LEU A 199 19.142 47.973 16.049 1.00 6.78 C ATOM 1798 O LEU A 199 18.147 47.533 15.464 1.00 7.64 O ATOM 1799 CB LEU A 199 18.284 48.557 18.298 1.00 8.85 C ATOM 1800 CG LEU A 199 18.218 49.556 19.440 1.00 10.16 C ATOM 1801 CD1 LEU A 199 17.487 48.890 20.600 1.00 14.56 C ATOM 1802 CD2 LEU A 199 19.649 50.016 19.831 1.00 12.00 C ATOM 1803 H LEU A 199 17.161 50.051 16.416 1.00 0.00 H ATOM 1804 N SER A 200 20.367 47.528 15.796 1.00 6.17 N ATOM 1805 CA SER A 200 20.656 46.447 14.856 1.00 5.99 C ATOM 1806 C SER A 200 20.993 45.160 15.627 1.00 7.00 C ATOM 1807 O SER A 200 21.899 45.141 16.465 1.00 7.91 O ATOM 1808 CB SER A 200 21.851 46.847 13.986 1.00 6.14 C ATOM 1809 OG SER A 200 21.527 47.945 13.163 1.00 8.55 O ATOM 1810 HG SER A 200 22.313 48.185 12.611 1.00 0.00 H ATOM 1811 H SER A 200 21.164 47.973 16.294 1.00 0.00 H ATOM 1812 N SER A 201 20.278 44.072 15.339 1.00 6.09 N ATOM 1813 CA SER A 201 20.498 42.791 15.994 1.00 6.05 C ATOM 1814 C SER A 201 20.876 41.704 14.989 1.00 5.69 C ATOM 1815 O SER A 201 20.180 41.483 14.017 1.00 6.00 O ATOM 1816 CB SER A 201 19.209 42.373 16.701 1.00 6.32 C ATOM 1817 OG SER A 201 19.383 41.104 17.332 1.00 7.93 O ATOM 1818 HG SER A 201 19.613 40.426 16.649 1.00 0.00 H ATOM 1819 H SER A 201 19.533 44.142 14.617 1.00 0.00 H ATOM 1820 N VAL A 202 22.008 41.051 15.231 1.00 6.03 N ATOM 1821 CA VAL A 202 22.473 39.958 14.372 1.00 6.73 C ATOM 1822 C VAL A 202 21.655 38.709 14.715 1.00 6.04 C ATOM 1823 O VAL A 202 21.666 38.234 15.849 1.00 7.17 O ATOM 1824 CB VAL A 202 23.952 39.674 14.616 1.00 7.52 C ATOM 1825 CG1 VAL A 202 24.397 38.481 13.772 1.00 9.47 C ATOM 1826 CG2 VAL A 202 24.774 40.907 14.291 1.00 9.69 C ATOM 1827 H VAL A 202 22.581 41.324 16.055 1.00 0.00 H ATOM 1828 N GLU A 203 20.931 38.200 13.727 1.00 6.86 N ATOM 1829 CA GLU A 203 20.085 37.052 13.961 1.00 7.01 C ATOM 1830 C GLU A 203 20.713 35.722 13.550 1.00 7.95 C ATOM 1831 O GLU A 203 21.924 35.671 13.295 1.00 7.91 O ATOM 1832 CB GLU A 203 18.692 37.355 13.406 1.00 7.90 C ATOM 1833 CG GLU A 203 17.982 38.452 14.258 1.00 8.28 C ATOM 1834 CD GLU A 203 17.859 38.111 15.761 1.00 11.06 C ATOM 1835 OE1 GLU A 203 17.667 36.918 16.115 1.00 12.26 O ATOM 1836 OE2 GLU A 203 17.950 39.029 16.623 1.00 10.17 O ATOM 1837 H GLU A 203 20.972 38.629 12.780 1.00 0.00 H ATOM 1838 N ALA A 204 19.917 34.649 13.476 1.00 8.18 N ATOM 1839 CA ALA A 204 20.483 33.302 13.302 1.00 8.64 C ATOM 1840 C ALA A 204 21.381 32.964 12.138 1.00 9.67 C ATOM 1841 O ALA A 204 22.227 32.076 12.270 1.00 10.65 O ATOM 1842 CB ALA A 204 19.364 32.253 13.439 1.00 9.44 C ATOM 1843 H ALA A 204 18.886 34.769 13.542 1.00 0.00 H ATOM 1844 N ASP A 204A 21.206 33.629 11.006 1.00 9.80 N ATOM 1845 CA ASP A 204A 22.099 33.383 9.869 1.00 11.39 C ATOM 1846 C ASP A 204A 22.957 34.606 9.567 1.00 10.12 C ATOM 1847 O ASP A 204A 23.490 34.730 8.470 1.00 12.18 O ATOM 1848 CB ASP A 204A 21.325 32.989 8.608 1.00 15.17 C ATOM 1849 CG ASP A 204A 20.299 34.007 8.198 1.00 17.21 C ATOM 1850 OD1 ASP A 204A 19.577 33.717 7.218 1.00 20.89 O ATOM 1851 OD2 ASP A 204A 20.192 35.089 8.823 1.00 15.84 O ATOM 1852 H ASP A 204A 20.437 34.324 10.924 1.00 0.00 H ATOM 1853 N GLY A 205 23.064 35.512 10.541 1.00 8.79 N ATOM 1854 CA GLY A 205 23.879 36.699 10.371 1.00 9.65 C ATOM 1855 C GLY A 205 23.150 37.912 9.828 1.00 9.88 C ATOM 1856 O GLY A 205 23.724 39.016 9.836 1.00 10.83 O ATOM 1857 H GLY A 205 22.555 35.364 11.436 1.00 0.00 H ATOM 1858 N ARG A 206 21.939 37.736 9.319 1.00 8.43 N ATOM 1859 CA ARG A 206 21.189 38.882 8.811 1.00 8.67 C ATOM 1860 C ARG A 206 20.808 39.783 9.974 1.00 8.28 C ATOM 1861 O ARG A 206 20.521 39.325 11.088 1.00 8.01 O ATOM 1862 CB ARG A 206 19.943 38.421 8.067 1.00 12.03 C ATOM 1863 CG ARG A 206 20.251 37.693 6.790 1.00 18.73 C ATOM 1864 CD ARG A 206 19.034 36.895 6.362 1.00 22.06 C ATOM 1865 NE ARG A 206 18.068 37.731 5.675 1.00 25.32 N ATOM 1866 CZ ARG A 206 16.759 37.709 5.899 1.00 25.22 C ATOM 1867 NH1 ARG A 206 16.241 36.894 6.812 1.00 26.00 N ATOM 1868 NH2 ARG A 206 15.963 38.487 5.178 1.00 27.25 N ATOM 1869 HE ARG A 206 18.425 38.394 4.957 1.00 0.00 H ATOM 1870 HH12 ARG A 206 15.215 36.885 6.979 1.00 0.00 H ATOM 1871 HH11 ARG A 206 16.862 36.265 7.360 1.00 0.00 H ATOM 1872 HH22 ARG A 206 14.937 38.478 5.345 1.00 0.00 H ATOM 1873 HH21 ARG A 206 16.365 39.106 4.446 1.00 0.00 H ATOM 1874 H ARG A 206 21.523 36.783 9.281 1.00 0.00 H ATOM 1875 N ILE A 207 20.791 41.082 9.708 1.00 8.00 N ATOM 1876 CA ILE A 207 20.478 42.047 10.742 1.00 7.70 C ATOM 1877 C ILE A 207 19.028 42.525 10.717 1.00 6.40 C ATOM 1878 O ILE A 207 18.478 42.892 9.659 1.00 7.38 O ATOM 1879 CB ILE A 207 21.481 43.221 10.630 1.00 9.68 C ATOM 1880 CG1 ILE A 207 22.879 42.673 10.981 1.00 14.23 C ATOM 1881 CG2 ILE A 207 21.060 44.393 11.542 1.00 9.33 C ATOM 1882 CD1 ILE A 207 24.001 43.656 10.841 1.00 18.46 C ATOM 1883 H ILE A 207 21.005 41.412 8.745 1.00 0.00 H ATOM 1884 N PHE A 208 18.418 42.470 11.899 1.00 5.36 N ATOM 1885 CA PHE A 208 17.042 42.888 12.116 1.00 5.67 C ATOM 1886 C PHE A 208 16.982 44.100 13.015 1.00 5.85 C ATOM 1887 O PHE A 208 17.827 44.279 13.897 1.00 6.26 O ATOM 1888 CB PHE A 208 16.240 41.736 12.754 1.00 6.09 C ATOM 1889 CG PHE A 208 15.856 40.670 11.783 1.00 6.91 C ATOM 1890 CD1 PHE A 208 16.805 39.838 11.226 1.00 8.31 C ATOM 1891 CD2 PHE A 208 14.534 40.544 11.388 1.00 7.59 C ATOM 1892 CE1 PHE A 208 16.441 38.873 10.268 1.00 9.34 C ATOM 1893 CE2 PHE A 208 14.160 39.590 10.438 1.00 9.19 C ATOM 1894 CZ PHE A 208 15.123 38.756 9.881 1.00 8.77 C ATOM 1895 H PHE A 208 18.955 42.108 12.713 1.00 0.00 H ATOM 1896 N GLN A 209 15.962 44.921 12.796 1.00 5.43 N ATOM 1897 CA GLN A 209 15.819 46.096 13.641 1.00 5.36 C ATOM 1898 C GLN A 209 15.110 45.698 14.931 1.00 6.30 C ATOM 1899 O GLN A 209 13.974 45.190 14.890 1.00 7.35 O ATOM 1900 CB GLN A 209 15.024 47.207 12.930 1.00 5.88 C ATOM 1901 CG GLN A 209 14.989 48.433 13.799 1.00 6.09 C ATOM 1902 CD GLN A 209 14.660 49.708 13.066 1.00 6.99 C ATOM 1903 OE1 GLN A 209 14.615 49.754 11.838 1.00 7.64 O ATOM 1904 NE2 GLN A 209 14.456 50.770 13.835 1.00 6.34 N ATOM 1905 HE22 GLN A 209 14.505 50.680 14.870 1.00 0.00 H ATOM 1906 HE21 GLN A 209 14.247 51.693 13.403 1.00 0.00 H ATOM 1907 H GLN A 209 15.279 44.728 12.036 1.00 0.00 H ATOM 1908 N ALA A 210 15.743 45.953 16.071 1.00 6.39 N ATOM 1909 CA ALA A 210 15.122 45.556 17.331 1.00 7.35 C ATOM 1910 C ALA A 210 14.339 46.703 17.931 1.00 10.58 C ATOM 1911 O ALA A 210 13.323 46.485 18.623 1.00 13.30 O ATOM 1912 CB ALA A 210 16.185 45.045 18.307 1.00 8.59 C ATOM 1913 H ALA A 210 16.668 46.429 16.066 1.00 0.00 H ATOM 1914 N GLY A 211 14.738 47.924 17.603 1.00 7.57 N ATOM 1915 CA GLY A 211 14.067 49.060 18.197 1.00 8.71 C ATOM 1916 C GLY A 211 14.499 50.371 17.600 1.00 5.17 C ATOM 1917 O GLY A 211 15.283 50.399 16.641 1.00 5.56 O ATOM 1918 H GLY A 211 15.519 48.063 16.931 1.00 0.00 H ATOM 1919 N VAL A 212 13.962 51.452 18.161 1.00 5.32 N ATOM 1920 CA VAL A 212 14.231 52.819 17.720 1.00 4.73 C ATOM 1921 C VAL A 212 14.779 53.615 18.905 1.00 4.37 C ATOM 1922 O VAL A 212 14.203 53.579 19.987 1.00 4.65 O ATOM 1923 CB VAL A 212 12.919 53.512 17.242 1.00 4.81 C ATOM 1924 CG1 VAL A 212 13.234 54.905 16.715 1.00 6.30 C ATOM 1925 CG2 VAL A 212 12.220 52.693 16.169 1.00 7.38 C ATOM 1926 H VAL A 212 13.312 51.316 18.961 1.00 0.00 H ATOM 1927 N VAL A 213 15.893 54.325 18.713 1.00 4.56 N ATOM 1928 CA VAL A 213 16.463 55.144 19.796 1.00 4.52 C ATOM 1929 C VAL A 213 15.400 56.176 20.209 1.00 4.48 C ATOM 1930 O VAL A 213 14.907 56.939 19.369 1.00 5.03 O ATOM 1931 CB VAL A 213 17.738 55.890 19.324 1.00 5.09 C ATOM 1932 CG1 VAL A 213 18.267 56.724 20.445 1.00 6.34 C ATOM 1933 CG2 VAL A 213 18.803 54.884 18.828 1.00 6.83 C ATOM 1934 H VAL A 213 16.365 54.299 17.786 1.00 0.00 H ATOM 1935 N SER A 214 15.079 56.233 21.505 1.00 4.51 N ATOM 1936 CA SER A 214 14.011 57.126 21.969 1.00 4.28 C ATOM 1937 C SER A 214 14.429 58.138 23.015 1.00 4.40 C ATOM 1938 O SER A 214 14.378 59.337 22.738 1.00 6.47 O ATOM 1939 CB SER A 214 12.818 56.276 22.471 1.00 4.89 C ATOM 1940 OG SER A 214 11.712 57.082 22.883 1.00 5.58 O ATOM 1941 HG SER A 214 11.400 57.628 22.118 1.00 0.00 H ATOM 1942 H SER A 214 15.590 55.640 22.190 1.00 0.00 H ATOM 1943 N TRP A 215 14.816 57.716 24.218 1.00 4.98 N ATOM 1944 CA TRP A 215 15.197 58.690 25.239 1.00 5.14 C ATOM 1945 C TRP A 215 16.038 58.041 26.326 1.00 6.91 C ATOM 1946 O TRP A 215 16.226 56.828 26.344 1.00 6.60 O ATOM 1947 CB TRP A 215 13.939 59.328 25.880 1.00 6.95 C ATOM 1948 CG TRP A 215 13.038 58.354 26.606 1.00 5.96 C ATOM 1949 CD1 TRP A 215 12.051 57.582 26.057 1.00 6.16 C ATOM 1950 CD2 TRP A 215 13.003 58.115 28.015 1.00 6.41 C ATOM 1951 NE1 TRP A 215 11.398 56.879 27.047 1.00 7.30 N ATOM 1952 CE2 TRP A 215 11.964 57.186 28.258 1.00 6.97 C ATOM 1953 CE3 TRP A 215 13.746 58.599 29.102 1.00 8.72 C ATOM 1954 CZ2 TRP A 215 11.650 56.729 29.557 1.00 8.57 C ATOM 1955 CZ3 TRP A 215 13.429 58.146 30.390 1.00 10.08 C ATOM 1956 CH2 TRP A 215 12.392 57.222 30.601 1.00 10.35 C ATOM 1957 HE1 TRP A 215 10.605 56.223 26.899 1.00 0.00 H ATOM 1958 H TRP A 215 14.847 56.698 24.430 1.00 0.00 H ATOM 1959 N GLY A 216 16.535 58.870 27.232 1.00 7.25 N ATOM 1960 CA GLY A 216 17.271 58.353 28.367 1.00 8.63 C ATOM 1961 C GLY A 216 17.426 59.456 29.395 1.00 9.60 C ATOM 1962 O GLY A 216 17.207 60.624 29.090 1.00 11.00 O ATOM 1963 H GLY A 216 16.396 59.895 27.128 1.00 0.00 H ATOM 1964 N ASP A 217 17.789 59.076 30.614 1.00 10.77 N ATOM 1965 CA ASP A 217 18.058 60.030 31.696 1.00 11.58 C ATOM 1966 C ASP A 217 19.584 60.213 31.602 1.00 11.48 C ATOM 1967 O ASP A 217 20.355 59.344 32.033 1.00 12.60 O ATOM 1968 CB ASP A 217 17.634 59.396 33.024 1.00 14.86 C ATOM 1969 CG ASP A 217 17.840 60.309 34.210 1.00 19.87 C ATOM 1970 OD1 ASP A 217 18.319 61.441 34.019 1.00 22.39 O ATOM 1971 OD2 ASP A 217 17.510 59.878 35.343 1.00 23.26 O ATOM 1972 H ASP A 217 17.887 58.059 30.810 1.00 0.00 H ATOM 1973 N GLY A 219 20.020 61.327 31.021 1.00 12.96 N ATOM 1974 CA GLY A 219 21.450 61.515 30.817 1.00 12.24 C ATOM 1975 C GLY A 219 21.930 60.502 29.771 1.00 12.39 C ATOM 1976 O GLY A 219 21.127 59.944 29.018 1.00 13.01 O ATOM 1977 H GLY A 219 19.346 62.057 30.715 1.00 0.00 H ATOM 1978 N CYS A 220 23.232 60.243 29.729 1.00 10.90 N ATOM 1979 CA CYS A 220 23.767 59.277 28.781 1.00 11.14 C ATOM 1980 C CYS A 220 24.905 58.521 29.435 1.00 10.56 C ATOM 1981 O CYS A 220 25.810 59.135 30.012 1.00 12.61 O ATOM 1982 CB CYS A 220 24.322 59.977 27.527 1.00 12.77 C ATOM 1983 SG CYS A 220 23.175 61.043 26.592 1.00 15.07 S ATOM 1984 H CYS A 220 23.876 60.736 30.380 1.00 0.00 H ATOM 1985 N ALA A 221 24.857 57.197 29.350 1.00 9.31 N ATOM 1986 CA ALA A 221 25.904 56.319 29.858 1.00 9.92 C ATOM 1987 C ALA A 221 26.112 56.324 31.348 1.00 10.32 C ATOM 1988 O ALA A 221 27.146 55.849 31.833 1.00 10.78 O ATOM 1989 CB ALA A 221 27.220 56.625 29.142 1.00 10.76 C ATOM 1990 H ALA A 221 24.028 56.763 28.897 1.00 0.00 H ATOM 1991 N GLN A 221A 25.133 56.820 32.087 1.00 10.23 N ATOM 1992 CA GLN A 221A 25.244 56.829 33.542 1.00 11.72 C ATOM 1993 C GLN A 221A 24.865 55.471 34.142 1.00 11.27 C ATOM 1994 O GLN A 221A 24.053 54.726 33.579 1.00 10.81 O ATOM 1995 CB GLN A 221A 24.311 57.855 34.158 1.00 13.42 C ATOM 1996 CG GLN A 221A 24.358 59.253 33.597 1.00 19.68 C ATOM 1997 CD GLN A 221A 23.593 60.225 34.484 1.00 22.34 C ATOM 1998 OE1 GLN A 221A 24.138 60.739 35.461 1.00 25.43 O ATOM 1999 NE2 GLN A 221A 22.315 60.458 34.164 1.00 23.49 N ATOM 2000 HE22 GLN A 221A 21.897 60.001 33.329 1.00 0.00 H ATOM 2001 HE21 GLN A 221A 21.740 61.096 34.751 1.00 0.00 H ATOM 2002 H GLN A 221A 24.282 57.205 31.630 1.00 0.00 H ATOM 2003 N ARG A 222 25.470 55.151 35.280 1.00 11.88 N ATOM 2004 CA ARG A 222 25.163 53.930 36.006 1.00 12.62 C ATOM 2005 C ARG A 222 23.650 53.904 36.328 1.00 10.60 C ATOM 2006 O ARG A 222 23.060 54.917 36.708 1.00 11.29 O ATOM 2007 CB ARG A 222 25.995 53.929 37.299 1.00 13.97 C ATOM 2008 CG ARG A 222 25.736 52.785 38.249 1.00 17.76 C ATOM 2009 CD ARG A 222 26.771 52.770 39.377 1.00 18.94 C ATOM 2010 NE ARG A 222 26.425 51.815 40.425 1.00 19.23 N ATOM 2011 CZ ARG A 222 25.383 51.945 41.240 1.00 19.50 C ATOM 2012 NH1 ARG A 222 24.580 52.994 41.133 1.00 19.62 N ATOM 2013 NH2 ARG A 222 25.144 51.024 42.165 1.00 19.62 N ATOM 2014 HE ARG A 222 27.033 50.979 40.542 1.00 0.00 H ATOM 2015 HH12 ARG A 222 23.766 53.093 41.772 1.00 0.00 H ATOM 2016 HH11 ARG A 222 24.764 53.718 40.410 1.00 0.00 H ATOM 2017 HH22 ARG A 222 24.329 51.126 42.802 1.00 0.00 H ATOM 2018 HH21 ARG A 222 25.772 50.200 42.253 1.00 0.00 H ATOM 2019 H ARG A 222 26.189 55.797 35.665 1.00 0.00 H ATOM 2020 N ASN A 223 23.045 52.730 36.159 1.00 10.56 N ATOM 2021 CA ASN A 223 21.622 52.488 36.425 1.00 11.47 C ATOM 2022 C ASN A 223 20.643 53.301 35.586 1.00 10.57 C ATOM 2023 O ASN A 223 19.448 53.355 35.899 1.00 12.26 O ATOM 2024 CB ASN A 223 21.329 52.648 37.927 1.00 13.21 C ATOM 2025 CG ASN A 223 21.992 51.566 38.750 1.00 14.34 C ATOM 2026 OD1 ASN A 223 22.091 50.426 38.311 1.00 16.46 O ATOM 2027 ND2 ASN A 223 22.448 51.914 39.950 1.00 19.38 N ATOM 2028 HD22 ASN A 223 22.342 52.894 40.282 1.00 0.00 H ATOM 2029 HD21 ASN A 223 22.910 51.206 40.556 1.00 0.00 H ATOM 2030 H ASN A 223 23.618 51.933 35.816 1.00 0.00 H ATOM 2031 N LYS A 224 21.132 53.870 34.489 1.00 10.29 N ATOM 2032 CA LYS A 224 20.297 54.665 33.589 1.00 10.31 C ATOM 2033 C LYS A 224 20.540 54.288 32.121 1.00 9.34 C ATOM 2034 O LYS A 224 21.048 55.072 31.325 1.00 9.60 O ATOM 2035 CB LYS A 224 20.548 56.163 33.812 1.00 11.97 C ATOM 2036 CG LYS A 224 20.136 56.603 35.212 1.00 13.84 C ATOM 2037 CD LYS A 224 20.499 58.043 35.517 1.00 19.04 C ATOM 2038 CE LYS A 224 20.069 58.397 36.935 1.00 21.53 C ATOM 2039 NZ LYS A 224 18.647 58.015 37.159 1.00 22.92 N ATOM 2040 HZ1 LYS A 224 18.042 58.525 36.484 1.00 0.00 H ATOM 2041 HZ2 LYS A 224 18.538 56.990 37.018 1.00 0.00 H ATOM 2042 HZ3 LYS A 224 18.371 58.264 38.131 1.00 0.00 H ATOM 2043 H LYS A 224 22.140 53.746 34.264 1.00 0.00 H ATOM 2044 N PRO A 225 20.194 53.051 31.755 1.00 10.53 N ATOM 2045 CA PRO A 225 20.383 52.614 30.371 1.00 9.83 C ATOM 2046 C PRO A 225 19.397 53.346 29.461 1.00 8.55 C ATOM 2047 O PRO A 225 18.347 53.822 29.906 1.00 10.45 O ATOM 2048 CB PRO A 225 20.062 51.133 30.429 1.00 10.68 C ATOM 2049 CG PRO A 225 18.990 51.082 31.499 1.00 12.79 C ATOM 2050 CD PRO A 225 19.557 51.994 32.565 1.00 11.83 C ATOM 2051 N GLY A 226 19.734 53.432 28.187 1.00 7.81 N ATOM 2052 CA GLY A 226 18.866 54.080 27.228 1.00 7.12 C ATOM 2053 C GLY A 226 17.558 53.324 27.030 1.00 5.29 C ATOM 2054 O GLY A 226 17.471 52.110 27.214 1.00 6.41 O ATOM 2055 H GLY A 226 20.638 53.028 27.868 1.00 0.00 H ATOM 2056 N VAL A 227 16.540 54.084 26.625 1.00 5.64 N ATOM 2057 CA VAL A 227 15.199 53.555 26.408 1.00 5.45 C ATOM 2058 C VAL A 227 14.899 53.615 24.917 1.00 5.50 C ATOM 2059 O VAL A 227 15.129 54.639 24.258 1.00 6.14 O ATOM 2060 CB VAL A 227 14.168 54.345 27.204 1.00 5.73 C ATOM 2061 CG1 VAL A 227 12.795 53.657 27.084 1.00 7.12 C ATOM 2062 CG2 VAL A 227 14.591 54.396 28.686 1.00 7.94 C ATOM 2063 H VAL A 227 16.710 55.096 26.457 1.00 0.00 H ATOM 2064 N TYR A 228 14.364 52.512 24.406 1.00 5.40 N ATOM 2065 CA TYR A 228 14.125 52.351 22.975 1.00 5.12 C ATOM 2066 C TYR A 228 12.715 51.891 22.696 1.00 5.39 C ATOM 2067 O TYR A 228 12.131 51.165 23.493 1.00 6.21 O ATOM 2068 CB TYR A 228 15.092 51.283 22.451 1.00 5.01 C ATOM 2069 CG TYR A 228 16.547 51.664 22.614 1.00 4.61 C ATOM 2070 CD1 TYR A 228 17.197 51.541 23.845 1.00 4.95 C ATOM 2071 CD2 TYR A 228 17.262 52.174 21.538 1.00 5.13 C ATOM 2072 CE1 TYR A 228 18.543 51.935 24.007 1.00 5.56 C ATOM 2073 CE2 TYR A 228 18.596 52.551 21.686 1.00 5.75 C ATOM 2074 CZ TYR A 228 19.209 52.435 22.898 1.00 5.48 C ATOM 2075 OH TYR A 228 20.518 52.837 23.021 1.00 8.23 O ATOM 2076 HH TYR A 228 20.820 52.692 23.952 1.00 0.00 H ATOM 2077 H TYR A 228 14.106 51.736 25.048 1.00 0.00 H ATOM 2078 N THR A 229 12.161 52.304 21.570 1.00 4.93 N ATOM 2079 CA THR A 229 10.811 51.828 21.201 1.00 5.10 C ATOM 2080 C THR A 229 10.960 50.437 20.580 1.00 5.73 C ATOM 2081 O THR A 229 11.808 50.235 19.689 1.00 7.02 O ATOM 2082 CB THR A 229 10.205 52.741 20.150 1.00 4.98 C ATOM 2083 OG1 THR A 229 10.200 54.069 20.666 1.00 6.67 O ATOM 2084 CG2 THR A 229 8.789 52.300 19.793 1.00 6.77 C ATOM 2085 HG1 THR A 229 9.808 54.681 19.994 1.00 0.00 H ATOM 2086 H THR A 229 12.672 52.961 20.946 1.00 0.00 H ATOM 2087 N ARG A 230 10.151 49.470 21.015 1.00 5.98 N ATOM 2088 CA ARG A 230 10.218 48.108 20.491 1.00 6.81 C ATOM 2089 C ARG A 230 9.657 48.081 19.083 1.00 8.24 C ATOM 2090 O ARG A 230 8.782 48.880 18.743 1.00 11.33 O ATOM 2091 CB ARG A 230 9.403 47.192 21.404 1.00 6.57 C ATOM 2092 CG ARG A 230 9.998 47.034 22.792 1.00 7.81 C ATOM 2093 CD ARG A 230 9.031 46.312 23.750 1.00 9.86 C ATOM 2094 NE ARG A 230 9.651 46.093 25.057 1.00 11.25 N ATOM 2095 CZ ARG A 230 10.400 45.036 25.344 1.00 11.41 C ATOM 2096 NH1 ARG A 230 10.612 44.096 24.426 1.00 14.16 N ATOM 2097 NH2 ARG A 230 10.973 44.921 26.538 1.00 13.01 N ATOM 2098 HE ARG A 230 9.496 46.804 25.801 1.00 0.00 H ATOM 2099 HH12 ARG A 230 11.200 43.269 24.655 1.00 0.00 H ATOM 2100 HH11 ARG A 230 10.190 44.188 23.480 1.00 0.00 H ATOM 2101 HH22 ARG A 230 11.559 44.090 26.756 1.00 0.00 H ATOM 2102 HH21 ARG A 230 10.836 45.662 27.254 1.00 0.00 H ATOM 2103 H ARG A 230 9.450 49.693 21.751 1.00 0.00 H ATOM 2104 N LEU A 231 10.188 47.211 18.245 1.00 7.03 N ATOM 2105 CA LEU A 231 9.718 47.095 16.869 1.00 6.68 C ATOM 2106 C LEU A 231 8.678 46.021 16.548 1.00 7.46 C ATOM 2107 O LEU A 231 7.776 46.283 15.776 1.00 7.24 O ATOM 2108 CB LEU A 231 10.897 46.860 15.923 1.00 9.75 C ATOM 2109 CG LEU A 231 11.233 47.966 14.937 1.00 14.03 C ATOM 2110 CD1 LEU A 231 10.038 48.362 14.110 1.00 15.33 C ATOM 2111 CD2 LEU A 231 11.715 49.147 15.733 1.00 14.70 C ATOM 2112 H LEU A 231 10.959 46.594 18.573 1.00 0.00 H ATOM 2113 N PRO A 232 8.801 44.795 17.098 1.00 7.63 N ATOM 2114 CA PRO A 232 7.808 43.749 16.766 1.00 7.45 C ATOM 2115 C PRO A 232 6.362 44.181 16.934 1.00 8.33 C ATOM 2116 O PRO A 232 5.500 43.863 16.106 1.00 7.99 O ATOM 2117 CB PRO A 232 8.198 42.581 17.678 1.00 8.95 C ATOM 2118 CG PRO A 232 9.701 42.761 17.788 1.00 7.99 C ATOM 2119 CD PRO A 232 9.874 44.262 17.959 1.00 7.86 C ATOM 2120 N LEU A 233 6.114 44.952 17.988 1.00 9.23 N ATOM 2121 CA LEU A 233 4.769 45.447 18.295 1.00 10.02 C ATOM 2122 C LEU A 233 4.159 46.266 17.173 1.00 10.53 C ATOM 2123 O LEU A 233 2.926 46.390 17.081 1.00 13.19 O ATOM 2124 CB LEU A 233 4.807 46.349 19.539 1.00 13.42 C ATOM 2125 CG LEU A 233 5.389 45.766 20.812 1.00 16.04 C ATOM 2126 CD1 LEU A 233 5.461 46.854 21.883 1.00 19.41 C ATOM 2127 CD2 LEU A 233 4.512 44.607 21.253 1.00 17.66 C ATOM 2128 H LEU A 233 6.901 45.213 18.616 1.00 0.00 H ATOM 2129 N PHE A 234 5.014 46.853 16.346 1.00 7.46 N ATOM 2130 CA PHE A 234 4.576 47.717 15.253 1.00 6.33 C ATOM 2131 C PHE A 234 4.643 47.106 13.877 1.00 7.01 C ATOM 2132 O PHE A 234 4.398 47.804 12.891 1.00 7.63 O ATOM 2133 CB PHE A 234 5.409 49.000 15.299 1.00 7.26 C ATOM 2134 CG PHE A 234 5.153 49.808 16.534 1.00 5.87 C ATOM 2135 CD1 PHE A 234 3.911 50.408 16.737 1.00 8.69 C ATOM 2136 CD2 PHE A 234 6.094 49.871 17.553 1.00 7.39 C ATOM 2137 CE1 PHE A 234 3.623 51.044 17.950 1.00 8.32 C ATOM 2138 CE2 PHE A 234 5.813 50.513 18.769 1.00 6.98 C ATOM 2139 CZ PHE A 234 4.571 51.097 18.964 1.00 8.10 C ATOM 2140 H PHE A 234 6.033 46.692 16.481 1.00 0.00 H ATOM 2141 N ARG A 235 4.940 45.811 13.783 1.00 7.78 N ATOM 2142 CA ARG A 235 5.034 45.209 12.466 1.00 7.75 C ATOM 2143 C ARG A 235 3.776 45.402 11.628 1.00 8.24 C ATOM 2144 O ARG A 235 3.852 45.738 10.448 1.00 9.16 O ATOM 2145 CB ARG A 235 5.319 43.701 12.560 1.00 8.22 C ATOM 2146 CG ARG A 235 5.603 43.056 11.188 1.00 10.56 C ATOM 2147 CD ARG A 235 6.880 43.634 10.562 1.00 10.00 C ATOM 2148 NE ARG A 235 7.105 43.175 9.191 1.00 13.18 N ATOM 2149 CZ ARG A 235 6.600 43.772 8.113 1.00 13.71 C ATOM 2150 NH1 ARG A 235 5.827 44.849 8.238 1.00 14.22 N ATOM 2151 NH2 ARG A 235 6.924 43.338 6.901 1.00 14.97 N ATOM 2152 HE ARG A 235 7.696 42.331 9.050 1.00 0.00 H ATOM 2153 HH12 ARG A 235 5.436 45.310 7.391 1.00 0.00 H ATOM 2154 HH11 ARG A 235 5.614 45.229 9.182 1.00 0.00 H ATOM 2155 HH22 ARG A 235 6.530 43.804 6.059 1.00 0.00 H ATOM 2156 HH21 ARG A 235 7.572 42.532 6.793 1.00 0.00 H ATOM 2157 H ARG A 235 5.102 45.242 14.638 1.00 0.00 H ATOM 2158 N ASP A 236 2.609 45.183 12.231 1.00 9.21 N ATOM 2159 CA ASP A 236 1.348 45.314 11.501 1.00 10.44 C ATOM 2160 C ASP A 236 1.040 46.765 11.152 1.00 9.25 C ATOM 2161 O ASP A 236 0.514 47.044 10.074 1.00 10.29 O ATOM 2162 CB ASP A 236 0.189 44.737 12.329 1.00 13.77 C ATOM 2163 CG ASP A 236 0.255 43.218 12.478 1.00 19.06 C ATOM 2164 OD1 ASP A 236 -0.577 42.673 13.242 1.00 23.07 O ATOM 2165 OD2 ASP A 236 1.109 42.572 11.839 1.00 20.74 O ATOM 2166 H ASP A 236 2.594 44.915 13.236 1.00 0.00 H ATOM 2167 N TRP A 237 1.339 47.670 12.078 1.00 8.39 N ATOM 2168 CA TRP A 237 1.114 49.093 11.838 1.00 8.38 C ATOM 2169 C TRP A 237 1.975 49.537 10.653 1.00 8.45 C ATOM 2170 O TRP A 237 1.531 50.297 9.782 1.00 8.67 O ATOM 2171 CB TRP A 237 1.462 49.890 13.100 1.00 9.84 C ATOM 2172 CG TRP A 237 1.260 51.373 12.955 1.00 9.87 C ATOM 2173 CD1 TRP A 237 0.064 52.041 12.867 1.00 10.22 C ATOM 2174 CD2 TRP A 237 2.278 52.368 12.889 1.00 9.66 C ATOM 2175 NE1 TRP A 237 0.283 53.392 12.750 1.00 11.42 N ATOM 2176 CE2 TRP A 237 1.634 53.623 12.759 1.00 9.97 C ATOM 2177 CE3 TRP A 237 3.682 52.329 12.931 1.00 9.55 C ATOM 2178 CZ2 TRP A 237 2.351 54.822 12.668 1.00 11.73 C ATOM 2179 CZ3 TRP A 237 4.385 53.519 12.839 1.00 10.26 C ATOM 2180 CH2 TRP A 237 3.719 54.746 12.708 1.00 11.49 C ATOM 2181 HE1 TRP A 237 -0.455 54.120 12.668 1.00 0.00 H ATOM 2182 H TRP A 237 1.739 47.361 12.987 1.00 0.00 H ATOM 2183 N ILE A 238 3.221 49.067 10.607 1.00 7.54 N ATOM 2184 CA ILE A 238 4.078 49.419 9.488 1.00 8.48 C ATOM 2185 C ILE A 238 3.487 48.864 8.187 1.00 8.32 C ATOM 2186 O ILE A 238 3.412 49.565 7.176 1.00 9.53 O ATOM 2187 CB ILE A 238 5.514 48.884 9.708 1.00 8.01 C ATOM 2188 CG1 ILE A 238 6.139 49.615 10.902 1.00 8.51 C ATOM 2189 CG2 ILE A 238 6.345 49.045 8.428 1.00 9.84 C ATOM 2190 CD1 ILE A 238 7.475 49.071 11.338 1.00 8.95 C ATOM 2191 H ILE A 238 3.577 48.453 11.367 1.00 0.00 H ATOM 2192 N LYS A 239 3.079 47.606 8.195 1.00 8.89 N ATOM 2193 CA LYS A 239 2.500 47.017 6.992 1.00 11.09 C ATOM 2194 C LYS A 239 1.258 47.777 6.523 1.00 11.52 C ATOM 2195 O LYS A 239 1.092 48.071 5.331 1.00 12.57 O ATOM 2196 CB LYS A 239 2.108 45.559 7.251 1.00 12.06 C ATOM 2197 CG LYS A 239 1.493 44.872 6.040 1.00 16.60 C ATOM 2198 CD LYS A 239 2.578 44.601 5.004 1.00 21.37 C ATOM 2199 CE LYS A 239 2.040 43.908 3.764 1.00 23.89 C ATOM 2200 NZ LYS A 239 1.228 44.825 2.922 1.00 27.71 N ATOM 2201 HZ1 LYS A 239 0.420 45.177 3.474 1.00 0.00 H ATOM 2202 HZ2 LYS A 239 1.817 45.626 2.617 1.00 0.00 H ATOM 2203 HZ3 LYS A 239 0.881 44.311 2.087 1.00 0.00 H ATOM 2204 H LYS A 239 3.171 47.036 9.060 1.00 0.00 H ATOM 2205 N GLU A 240 0.384 48.097 7.463 1.00 10.67 N ATOM 2206 CA GLU A 240 -0.858 48.799 7.140 1.00 12.92 C ATOM 2207 C GLU A 240 -0.651 50.176 6.533 1.00 13.64 C ATOM 2208 O GLU A 240 -1.376 50.578 5.617 1.00 15.10 O ATOM 2209 CB GLU A 240 -1.719 48.928 8.401 1.00 13.78 C ATOM 2210 CG GLU A 240 -2.549 47.689 8.760 1.00 20.08 C ATOM 2211 CD GLU A 240 -1.790 46.356 8.739 1.00 22.60 C ATOM 2212 OE1 GLU A 240 -2.299 45.391 9.347 1.00 21.76 O ATOM 2213 OE2 GLU A 240 -0.716 46.250 8.116 1.00 21.76 O ATOM 2214 H GLU A 240 0.584 47.844 8.452 1.00 0.00 H ATOM 2215 N ASN A 241 0.349 50.894 7.033 1.00 12.14 N ATOM 2216 CA ASN A 241 0.608 52.257 6.573 1.00 12.96 C ATOM 2217 C ASN A 241 1.566 52.412 5.405 1.00 13.55 C ATOM 2218 O ASN A 241 1.556 53.459 4.744 1.00 15.62 O ATOM 2219 CB ASN A 241 1.128 53.094 7.746 1.00 13.79 C ATOM 2220 CG ASN A 241 0.042 53.453 8.731 1.00 15.75 C ATOM 2221 OD1 ASN A 241 -0.577 54.514 8.614 1.00 19.10 O ATOM 2222 ND2 ASN A 241 -0.220 52.572 9.694 1.00 16.42 N ATOM 2223 HD22 ASN A 241 0.327 51.690 9.755 1.00 0.00 H ATOM 2224 HD21 ASN A 241 -0.972 52.766 10.386 1.00 0.00 H ATOM 2225 H ASN A 241 0.959 50.478 7.766 1.00 0.00 H ATOM 2226 N THR A 242 2.367 51.386 5.117 1.00 12.53 N ATOM 2227 CA THR A 242 3.366 51.485 4.055 1.00 13.24 C ATOM 2228 C THR A 242 3.328 50.401 2.998 1.00 14.11 C ATOM 2229 O THR A 242 3.900 50.570 1.917 1.00 16.41 O ATOM 2230 CB THR A 242 4.809 51.437 4.608 1.00 12.41 C ATOM 2231 OG1 THR A 242 5.102 50.115 5.085 1.00 12.46 O ATOM 2232 CG2 THR A 242 4.991 52.424 5.735 1.00 13.66 C ATOM 2233 HG1 THR A 242 4.466 49.877 5.806 1.00 0.00 H ATOM 2234 H THR A 242 2.280 50.501 5.657 1.00 0.00 H ATOM 2235 N GLY A 243 2.696 49.279 3.326 1.00 14.41 N ATOM 2236 CA GLY A 243 2.647 48.147 2.421 1.00 15.45 C ATOM 2237 C GLY A 243 3.853 47.244 2.628 1.00 15.90 C ATOM 2238 O GLY A 243 3.903 46.147 2.069 1.00 17.79 O ATOM 2239 H GLY A 243 2.226 49.211 4.252 1.00 0.00 H ATOM 2240 N VAL A 244 4.823 47.703 3.424 1.00 15.62 N ATOM 2241 CA VAL A 244 6.043 46.948 3.723 1.00 16.08 C ATOM 2242 C VAL A 244 5.795 45.902 4.814 1.00 18.08 C ATOM 2243 O VAL A 244 4.888 46.120 5.639 1.00 13.72 O ATOM 2244 CB VAL A 244 7.193 47.894 4.202 1.00 17.20 C ATOM 2245 CG1 VAL A 244 8.486 47.083 4.454 1.00 16.47 C ATOM 2246 CG2 VAL A 244 7.425 49.000 3.156 1.00 17.36 C ATOM 2247 OXT VAL A 244 6.537 44.898 4.842 1.00 13.72 O ATOM 2248 H VAL A 244 4.706 48.643 3.853 1.00 0.00 H TER 2249 VAL A 244 HETATM 2250 O HOH 1 8.158 50.610 -0.364 1.00 10.36 O HETATM 2251 O HOH 2 21.803 52.220 25.051 1.00 10.58 O HETATM 2252 O HOH 3 21.920 54.536 4.552 1.00 11.21 O HETATM 2253 O HOH 4 26.328 53.230 4.350 1.00 11.06 O HETATM 2254 O HOH 5 15.354 53.287 13.001 1.00 13.73 O HETATM 2255 O HOH 6 23.184 57.773 6.003 1.00 12.77 O HETATM 2256 O HOH 7 11.130 43.109 21.402 1.00 10.63 O HETATM 2257 O HOH 8 12.106 41.099 29.711 1.00 13.79 O HETATM 2258 O HOH 9 23.686 65.502 25.483 1.00 12.06 O HETATM 2259 O HOH 10 23.889 45.429 32.877 1.00 12.45 O HETATM 2260 O HOH 11 6.692 47.363 30.873 1.00 11.49 O HETATM 2261 O HOH 12 23.512 41.699 17.604 1.00 11.36 O HETATM 2262 O HOH 13 32.146 55.410 28.271 1.00 12.86 O HETATM 2263 O HOH 14 26.265 46.421 33.654 1.00 12.58 O HETATM 2264 O HOH 15 27.709 59.176 17.888 1.00 9.88 O HETATM 2265 O HOH 16 24.745 54.588 -2.701 1.00 11.25 O HETATM 2266 O HOH 17 33.212 55.064 0.000 1.00 10.25 O HETATM 2267 O HOH 18 13.507 46.370 29.106 1.00 13.23 O HETATM 2268 O HOH 19 22.099 59.575 14.452 1.00 10.11 O HETATM 2269 O HOH 20 23.300 44.713 30.161 1.00 14.69 O HETATM 2270 O HOH 21 22.264 57.471 30.976 1.00 11.44 O HETATM 2271 O HOH 22 32.540 58.077 24.416 1.00 10.37 O HETATM 2272 O HOH 23 21.095 56.998 15.087 1.00 10.71 O HETATM 2273 O HOH 24 18.024 56.310 31.001 1.00 13.29 O HETATM 2274 O HOH 25 7.763 43.907 20.935 1.00 15.49 O HETATM 2275 O HOH 26 33.212 51.513 25.663 1.00 11.69 O HETATM 2276 O HOH 27 16.486 38.326 18.760 1.00 12.72 O HETATM 2277 O HOH 28 13.287 46.148 0.026 1.00 12.28 O HETATM 2278 O HOH 29 38.629 56.673 15.563 1.00 12.94 O HETATM 2279 O HOH 30 36.858 51.889 14.471 1.00 14.45 O HETATM 2280 O4 N A 4 17.975 64.132 19.821 1.00 -0.15 O HETATM 2281 S1 N A 4 16.989 64.592 20.776 1.00 0.09 S HETATM 2282 O3 N A 4 17.756 65.422 21.650 1.00 -0.15 O HETATM 2283 C18 N A 4 15.913 65.613 20.173 1.00 0.11 C HETATM 2284 C23 N A 4 15.337 66.658 20.911 1.00 -0.03 C HETATM 2285 C22 N A 4 14.446 67.548 20.302 1.00 -0.05 C HETATM 2286 C21 N A 4 14.159 67.403 18.954 1.00 -0.02 C HETATM 2287 C27 N A 4 13.279 68.280 18.314 1.00 -0.05 C HETATM 2288 C26 N A 4 13.013 68.118 16.961 1.00 -0.06 C HETATM 2289 C25 N A 4 13.625 67.106 16.249 1.00 -0.06 C HETATM 2290 C24 N A 4 14.499 66.236 16.888 1.00 -0.05 C HETATM 2291 C20 N A 4 14.765 66.385 18.229 1.00 -0.02 C HETATM 2292 C19 N A 4 15.651 65.505 18.821 1.00 -0.03 C HETATM 2293 H N A 4 16.136 64.737 18.230 1.00 0.06 H HETATM 2294 H N A 4 14.973 65.438 16.328 1.00 0.06 H HETATM 2295 H N A 4 13.423 66.990 15.190 1.00 0.06 H HETATM 2296 H N A 4 12.322 68.788 16.462 1.00 0.06 H HETATM 2297 H N A 4 12.807 69.082 18.870 1.00 0.06 H HETATM 2298 H N A 4 13.985 68.342 20.878 1.00 0.06 H HETATM 2299 H N A 4 15.584 66.776 21.960 1.00 0.06 H HETATM 2300 N2 N A 4 16.836 63.517 21.905 1.00 -0.19 N HETATM 2301 C1 N A 4 16.192 63.519 23.081 1.00 0.11 C HETATM 2302 C2 N A 4 16.550 62.411 23.797 1.00 0.20 C HETATM 2303 O1 N A 4 17.498 61.634 23.185 1.00 -0.25 O HETATM 2304 C7 N A 4 18.165 60.689 23.903 1.00 0.12 C HETATM 2305 C12 N A 4 18.221 59.380 23.428 1.00 -0.03 C HETATM 2306 C11 N A 4 18.883 58.422 24.181 1.00 -0.06 C HETATM 2307 C10 N A 4 19.470 58.789 25.399 1.00 0.02 C HETATM 2308 C28 N A 4 20.178 57.735 26.168 1.00 0.23 C HETATM 2309 N4 N A 4 20.798 57.998 27.308 1.00 -0.27 N HETATM 2310 H N A 4 21.280 57.244 27.818 1.00 0.32 H HETATM 2311 H N A 4 20.798 58.956 27.685 1.00 0.32 H HETATM 2312 N3 N A 4 20.160 56.576 25.699 1.00 -0.27 N HETATM 2313 H N A 4 19.673 56.387 24.811 1.00 0.32 H HETATM 2314 H N A 4 20.632 55.810 26.201 1.00 0.32 H HETATM 2315 C9 N A 4 19.408 60.100 25.870 1.00 -0.06 C HETATM 2316 C8 N A 4 18.748 61.054 25.121 1.00 -0.03 C HETATM 2317 H N A 4 18.682 62.077 25.474 1.00 0.06 H HETATM 2318 H N A 4 19.872 60.367 26.812 1.00 0.06 H HETATM 2319 H N A 4 18.946 57.398 23.830 1.00 0.06 H HETATM 2320 H N A 4 17.755 59.115 22.486 1.00 0.06 H HETATM 2321 N1 N A 4 15.990 62.128 25.003 1.00 -0.26 N HETATM 2322 C3 N A 4 15.050 62.961 25.528 1.00 0.16 C HETATM 2323 C4 N A 4 14.667 64.108 24.811 1.00 -0.03 C HETATM 2324 C5 N A 4 15.236 64.398 23.577 1.00 -0.04 C HETATM 2325 H N A 4 14.944 65.281 23.019 1.00 0.05 H HETATM 2326 H N A 4 13.919 64.774 25.226 1.00 0.05 H HETATM 2327 O2 N A 4 14.491 62.675 26.765 1.00 -0.25 O HETATM 2328 C6 N A 4 14.726 63.516 27.837 1.00 0.12 C HETATM 2329 C17 N A 4 14.885 63.028 29.145 1.00 -0.03 C HETATM 2330 C16 N A 4 15.114 63.929 30.211 1.00 -0.06 C HETATM 2331 C15 N A 4 15.178 65.313 29.979 1.00 0.02 C HETATM 2332 C29 N A 4 15.400 66.354 31.045 1.00 0.23 C HETATM 2333 N6 N A 4 15.960 67.450 30.727 1.00 -0.27 N HETATM 2334 H N A 4 16.120 68.173 31.443 1.00 0.32 H HETATM 2335 H N A 4 16.254 67.615 29.754 1.00 0.32 H HETATM 2336 N5 N A 4 14.982 66.168 32.302 1.00 -0.27 N HETATM 2337 H N A 4 14.527 65.283 32.568 1.00 0.32 H HETATM 2338 H N A 4 15.115 66.910 33.004 1.00 0.32 H HETATM 2339 C14 N A 4 15.011 65.782 28.687 1.00 -0.06 C HETATM 2340 C13 N A 4 14.793 64.903 27.639 1.00 -0.03 C HETATM 2341 H N A 4 14.671 65.298 26.637 1.00 0.06 H HETATM 2342 H N A 4 15.051 66.848 28.494 1.00 0.06 H HETATM 2343 H N A 4 15.242 63.547 31.218 1.00 0.06 H HETATM 2344 H N A 4 14.832 61.962 29.337 1.00 0.06 H HETATM 2345 H N A 4 17.313 62.660 21.710 1.00 0.21 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 236 235 370 CONECT 370 236 369 CONECT 1521 1520 1658 CONECT 1658 1521 1657 CONECT 1742 1741 1983 CONECT 1983 1742 1982 CONECT 2280 2281 CONECT 2281 2280 2282 2283 2300 CONECT 2282 2281 CONECT 2283 2281 2284 2292 CONECT 2284 2283 2285 2299 CONECT 2285 2284 2286 2298 CONECT 2286 2285 2287 2291 CONECT 2287 2286 2288 2297 CONECT 2288 2287 2289 2296 CONECT 2289 2288 2290 2295 CONECT 2290 2289 2291 2294 CONECT 2291 2286 2290 2292 CONECT 2292 2283 2291 2293 CONECT 2293 2292 CONECT 2294 2290 CONECT 2295 2289 CONECT 2296 2288 CONECT 2297 2287 CONECT 2298 2285 CONECT 2299 2284 CONECT 2300 2281 2301 2345 CONECT 2301 2300 2302 2324 CONECT 2302 2301 2303 2321 CONECT 2303 2302 2304 CONECT 2304 2303 2305 2316 CONECT 2305 2304 2306 2320 CONECT 2306 2305 2307 2319 CONECT 2307 2306 2308 2315 CONECT 2308 2307 2309 2312 CONECT 2309 2308 2310 2311 CONECT 2310 2309 CONECT 2311 2309 CONECT 2312 2308 2313 2314 CONECT 2313 2312 CONECT 2314 2312 CONECT 2315 2307 2316 2318 CONECT 2316 2304 2315 2317 CONECT 2317 2316 CONECT 2318 2315 CONECT 2319 2306 CONECT 2320 2305 CONECT 2321 2302 2322 CONECT 2322 2321 2323 2327 CONECT 2323 2322 2324 2326 CONECT 2324 2301 2323 2325 CONECT 2325 2324 CONECT 2326 2323 CONECT 2327 2322 2328 CONECT 2328 2327 2329 2340 CONECT 2329 2328 2330 2344 CONECT 2330 2329 2331 2343 CONECT 2331 2330 2332 2339 CONECT 2332 2331 2333 2336 CONECT 2333 2332 2334 2335 CONECT 2334 2333 CONECT 2335 2333 CONECT 2336 2332 2337 2338 CONECT 2337 2336 CONECT 2338 2336 CONECT 2339 2331 2340 2342 CONECT 2340 2328 2339 2341 CONECT 2341 2340 CONECT 2342 2339 CONECT 2343 2330 CONECT 2344 2329 CONECT 2345 2300 MASTER 0 0 0 0 0 0 0 0 2344 1 76 19 END
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Related entries of code: 4jyt
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4jyt
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Suppressor of tumorigenicity 14 protein, Matriptase
Ligand Name
N4A
EC.Number
E.C.3.4.21.109
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Ki=0.04uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) ACS MED.CHEM.LETT. Vol. 4: pp. 1152-1157
Ligand Properties
Formula
C
2
9
H
2
6
N
6
O
4
S
Molecular Weight
554.620
Exact Mass
554.174
No. of atoms
66
No. of bonds
70
Polar Surface Area
189.12
LOGP Value
7.93 (
Computed with XLOGP3
)
4.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
NC(=[NH2+])c1ccc(cc1)Oc1nc(ccc1NS(=O)(=O)c1ccc2c(c1)cccc2)Oc1ccc(cc1)C(=[NH2+])N
InChI String
InChI=1S/C29H24N6O4S/c30-27(31)19-5-10-22(11-6-19)38-26-16-15-25(29(34-26)39-23-12-7-20(8-13-23)28(32)33)35-40(36,37)24-14-9-18-3-1-2-4-21(18)17-24/h1-17,35H,(H3,30,31)(H3,32,33)/p+2
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):
Q9Y5Y6
Entrez Gene ID
NCBI Entrez Gene ID:
6768
ASD
Information of known allosteric effects of PDB entries
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