Browse entries in the PDBbind-CN Database
HEADER 6MM2_COMPLEX COMPND 6MM2_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 SER SER GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU SEQRES 2 A 99 GLU ILE LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU SEQRES 3 A 99 ALA GLY ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY SEQRES 4 A 99 GLU GLY SER ARG ASN VAL ARG SER THR GLY GLU PRO SER SEQRES 5 A 99 VAL SER HIS ALA TYR SER ASN ILE LYS PHE GLU VAL LEU SEQRES 6 A 99 THR ALA SER ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS SEQRES 7 A 99 VAL VAL ALA LYS TYR PHE ASP ASP TYR SER CYS ILE THR SEQRES 8 A 99 TYR ILE SER THR VAL GLU ALA LEU SEQRES 1 B 99 SER SER GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU SEQRES 2 B 99 GLU ILE LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU SEQRES 3 B 99 ALA GLY ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY SEQRES 4 B 99 GLU GLY SER ARG ASN VAL ARG SER THR GLY GLU PRO SER SEQRES 5 B 99 VAL SER HIS ALA TYR SER ASN ILE LYS PHE GLU VAL LEU SEQRES 6 B 99 THR ALA SER ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS SEQRES 7 B 99 VAL VAL ALA LYS TYR PHE ASP ASP TYR SER CYS ILE THR SEQRES 8 B 99 TYR ILE SER THR VAL GLU ALA LEU SEQRES 1 C 99 SER SER GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU SEQRES 2 C 99 GLU ILE LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU SEQRES 3 C 99 ALA GLY ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY SEQRES 4 C 99 GLU GLY SER ARG ASN VAL ARG SER THR GLY GLU PRO SER SEQRES 5 C 99 VAL SER HIS ALA TYR SER ASN ILE LYS PHE GLU VAL LEU SEQRES 6 C 99 THR ALA SER ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS SEQRES 7 C 99 VAL VAL ALA LYS TYR PHE ASP ASP TYR SER CYS ILE THR SEQRES 8 C 99 TYR ILE SER THR VAL GLU ALA LEU HET CA A 1 1 HET CA A 2 1 HET CA A 3 1 HET ATP A 628 43 ATOM 1 N SER A 1 40.146 2.001 -12.835 1.00 37.53 N ATOM 2 CA SER A 1 39.131 1.994 -13.928 1.00 34.79 C ATOM 3 C SER A 1 37.790 2.365 -13.346 1.00 30.07 C ATOM 4 O SER A 1 37.602 2.308 -12.134 1.00 31.81 O ATOM 5 CB SER A 1 39.070 0.628 -14.587 1.00 36.30 C ATOM 6 OG SER A 1 40.373 0.234 -14.958 1.00 39.89 O ATOM 7 HG SER A 1 40.337 -0.657 -15.388 1.00 0.00 H ATOM 8 HN3 SER A 1 39.874 1.311 -12.106 1.00 0.00 H ATOM 9 HN2 SER A 1 40.194 2.951 -12.414 1.00 0.00 H ATOM 10 HN1 SER A 1 41.076 1.746 -13.225 1.00 0.00 H ATOM 11 N SER A 2 36.903 2.851 -14.196 1.00 28.66 N ATOM 12 CA SER A 2 35.613 3.451 -13.808 1.00 27.47 C ATOM 13 C SER A 2 34.415 2.555 -14.099 1.00 22.71 C ATOM 14 O SER A 2 34.484 1.661 -14.928 1.00 26.63 O ATOM 15 CB SER A 2 35.469 4.723 -14.562 1.00 31.94 C ATOM 16 OG SER A 2 35.248 4.412 -15.931 1.00 34.37 O ATOM 17 HG SER A 2 34.423 3.872 -16.016 1.00 0.00 H ATOM 18 H SER A 2 37.130 2.807 -15.210 1.00 0.00 H ATOM 19 N GLN A 3 33.340 2.815 -13.362 1.00 30.00 N ATOM 20 CA GLN A 3 32.048 2.176 -13.668 1.00 30.00 C ATOM 21 C GLN A 3 30.959 3.204 -13.370 1.00 30.00 C ATOM 22 O GLN A 3 30.963 3.759 -12.261 1.00 30.00 O ATOM 23 CB GLN A 3 31.801 0.929 -12.834 1.00 30.00 C ATOM 24 CG GLN A 3 30.462 0.282 -13.130 1.00 30.00 C ATOM 25 CD GLN A 3 30.350 -1.099 -12.541 1.00 30.00 C ATOM 26 OE1 GLN A 3 31.281 -1.877 -12.598 1.00 30.00 O ATOM 27 NE2 GLN A 3 29.202 -1.405 -11.962 1.00 30.00 N ATOM 28 HE22 GLN A 3 28.431 -0.708 -11.936 1.00 0.00 H ATOM 29 HE21 GLN A 3 29.070 -2.343 -11.532 1.00 0.00 H ATOM 30 H GLN A 3 33.411 3.476 -12.562 1.00 0.00 H ATOM 31 N GLN A 4 30.067 3.453 -14.315 1.00 16.07 N ATOM 32 CA GLN A 4 28.957 4.400 -14.084 1.00 16.16 C ATOM 33 C GLN A 4 27.933 3.730 -13.173 1.00 14.81 C ATOM 34 O GLN A 4 27.548 2.592 -13.406 1.00 17.79 O ATOM 35 CB GLN A 4 28.305 4.792 -15.399 1.00 21.90 C ATOM 36 CG GLN A 4 27.242 5.876 -15.264 1.00 25.10 C ATOM 37 CD GLN A 4 27.171 6.687 -16.527 1.00 32.23 C ATOM 38 OE1 GLN A 4 26.703 6.217 -17.541 1.00 33.78 O ATOM 39 NE2 GLN A 4 27.610 7.908 -16.464 1.00 34.70 N ATOM 40 HE22 GLN A 4 28.005 8.273 -15.574 1.00 0.00 H ATOM 41 HE21 GLN A 4 27.567 8.520 -17.304 1.00 0.00 H ATOM 42 H GLN A 4 30.149 2.975 -15.235 1.00 0.00 H ATOM 43 N VAL A 5 27.588 4.420 -12.089 1.00 13.95 N ATOM 44 CA VAL A 5 26.568 3.948 -11.169 1.00 14.18 C ATOM 45 C VAL A 5 25.575 5.074 -10.938 1.00 13.97 C ATOM 46 O VAL A 5 25.799 6.231 -11.307 1.00 15.25 O ATOM 47 CB VAL A 5 27.148 3.393 -9.856 1.00 16.24 C ATOM 48 CG1 VAL A 5 28.126 2.258 -10.140 1.00 17.68 C ATOM 49 CG2 VAL A 5 27.834 4.474 -9.076 1.00 16.85 C ATOM 50 H VAL A 5 28.063 5.325 -11.895 1.00 0.00 H ATOM 51 N TRP A 6 24.454 4.709 -10.342 1.00 13.82 N ATOM 52 CA TRP A 6 23.416 5.661 -10.004 1.00 13.53 C ATOM 53 C TRP A 6 23.445 5.910 -8.502 1.00 13.05 C ATOM 54 O TRP A 6 23.740 5.008 -7.717 1.00 14.71 O ATOM 55 CB TRP A 6 22.055 5.135 -10.461 1.00 14.95 C ATOM 56 CG TRP A 6 21.907 5.244 -11.932 1.00 16.02 C ATOM 57 CD1 TRP A 6 21.243 6.219 -12.614 1.00 17.66 C ATOM 58 CD2 TRP A 6 22.490 4.389 -12.924 1.00 17.08 C ATOM 59 NE1 TRP A 6 21.351 6.013 -13.964 1.00 18.43 N ATOM 60 CE2 TRP A 6 22.126 4.906 -14.186 1.00 18.28 C ATOM 61 CE3 TRP A 6 23.282 3.238 -12.874 1.00 17.39 C ATOM 62 CZ2 TRP A 6 22.508 4.293 -15.383 1.00 20.93 C ATOM 63 CZ3 TRP A 6 23.678 2.651 -14.056 1.00 19.17 C ATOM 64 CH2 TRP A 6 23.290 3.178 -15.287 1.00 21.08 C ATOM 65 HE1 TRP A 6 20.915 6.602 -14.701 1.00 0.00 H ATOM 66 H TRP A 6 24.312 3.706 -10.108 1.00 0.00 H ATOM 67 N LYS A 7 23.182 7.151 -8.111 1.00 13.03 N ATOM 68 CA LYS A 7 23.124 7.557 -6.715 1.00 12.55 C ATOM 69 C LYS A 7 21.700 8.024 -6.438 1.00 12.16 C ATOM 70 O LYS A 7 21.245 9.025 -7.006 1.00 13.48 O ATOM 71 CB LYS A 7 24.128 8.666 -6.426 1.00 13.15 C ATOM 72 CG LYS A 7 24.106 9.105 -4.969 1.00 15.26 C ATOM 73 CD LYS A 7 25.344 9.899 -4.588 1.00 18.32 C ATOM 74 CE LYS A 7 25.410 11.214 -5.328 1.00 21.17 C ATOM 75 NZ LYS A 7 24.348 12.153 -4.885 1.00 23.96 N ATOM 76 HZ1 LYS A 7 23.415 11.727 -5.059 1.00 0.00 H ATOM 77 HZ2 LYS A 7 24.458 12.345 -3.869 1.00 0.00 H ATOM 78 HZ3 LYS A 7 24.429 13.043 -5.418 1.00 0.00 H ATOM 79 H LYS A 7 23.008 7.871 -8.841 1.00 0.00 H ATOM 80 N LEU A 8 20.998 7.276 -5.587 1.00 11.79 N ATOM 81 CA LEU A 8 19.672 7.630 -5.106 1.00 11.33 C ATOM 82 C LEU A 8 19.812 8.308 -3.752 1.00 11.58 C ATOM 83 O LEU A 8 20.440 7.759 -2.835 1.00 12.50 O ATOM 84 CB LEU A 8 18.835 6.361 -4.957 1.00 12.80 C ATOM 85 CG LEU A 8 17.500 6.493 -4.213 1.00 13.53 C ATOM 86 CD1 LEU A 8 16.529 7.409 -4.935 1.00 13.81 C ATOM 87 CD2 LEU A 8 16.886 5.130 -3.979 1.00 14.53 C ATOM 88 H LEU A 8 21.422 6.389 -5.248 1.00 0.00 H ATOM 89 N VAL A 9 19.214 9.483 -3.614 1.00 11.21 N ATOM 90 CA VAL A 9 19.145 10.188 -2.343 1.00 11.36 C ATOM 91 C VAL A 9 17.699 10.181 -1.870 1.00 11.63 C ATOM 92 O VAL A 9 16.764 10.451 -2.645 1.00 12.31 O ATOM 93 CB VAL A 9 19.692 11.621 -2.475 1.00 12.11 C ATOM 94 CG1 VAL A 9 19.416 12.419 -1.203 1.00 13.03 C ATOM 95 CG2 VAL A 9 21.174 11.584 -2.775 1.00 13.64 C ATOM 96 H VAL A 9 18.775 9.920 -4.450 1.00 0.00 H ATOM 97 N ILE A 10 17.521 9.893 -0.578 1.00 11.91 N ATOM 98 CA ILE A 10 16.234 9.961 0.108 1.00 12.42 C ATOM 99 C ILE A 10 16.444 10.805 1.349 1.00 12.72 C ATOM 100 O ILE A 10 17.262 10.445 2.200 1.00 13.76 O ATOM 101 CB ILE A 10 15.731 8.568 0.516 1.00 15.05 C ATOM 102 CG1 ILE A 10 15.581 7.653 -0.698 1.00 17.35 C ATOM 103 CG2 ILE A 10 14.422 8.684 1.312 1.00 17.56 C ATOM 104 CD1 ILE A 10 15.591 6.191 -0.314 1.00 21.97 C ATOM 105 H ILE A 10 18.352 9.602 -0.025 1.00 0.00 H ATOM 106 N ILE A 11 15.721 11.914 1.468 1.00 12.64 N ATOM 107 CA ILE A 11 15.759 12.759 2.663 1.00 13.35 C ATOM 108 C ILE A 11 14.384 12.675 3.296 1.00 14.36 C ATOM 109 O ILE A 11 13.384 12.984 2.644 1.00 15.37 O ATOM 110 CB ILE A 11 16.143 14.205 2.316 1.00 13.83 C ATOM 111 CG1 ILE A 11 17.582 14.240 1.769 1.00 14.56 C ATOM 112 CG2 ILE A 11 16.004 15.115 3.541 1.00 15.05 C ATOM 113 CD1 ILE A 11 17.883 15.454 0.908 1.00 15.58 C ATOM 114 H ILE A 11 15.103 12.193 0.680 1.00 0.00 H ATOM 115 N THR A 12 14.317 12.210 4.540 1.00 14.39 N ATOM 116 CA THR A 12 13.029 11.928 5.160 1.00 15.14 C ATOM 117 C THR A 12 13.099 12.124 6.666 1.00 15.90 C ATOM 118 O THR A 12 14.147 12.423 7.228 1.00 16.17 O ATOM 119 CB THR A 12 12.538 10.532 4.749 1.00 16.60 C ATOM 120 OG1 THR A 12 11.171 10.354 5.127 1.00 18.53 O ATOM 121 CG2 THR A 12 13.379 9.423 5.352 1.00 17.56 C ATOM 122 HG1 THR A 12 10.614 11.038 4.678 1.00 0.00 H ATOM 123 H THR A 12 15.193 12.046 5.076 1.00 0.00 H ATOM 124 N GLU A 13 11.947 11.988 7.316 1.00 17.00 N ATOM 125 CA GLU A 13 11.877 12.155 8.762 1.00 17.69 C ATOM 126 C GLU A 13 12.821 11.193 9.469 1.00 18.79 C ATOM 127 O GLU A 13 12.942 10.019 9.105 1.00 19.27 O ATOM 128 CB GLU A 13 10.450 11.903 9.243 1.00 18.23 C ATOM 129 CG GLU A 13 9.425 12.804 8.600 1.00 17.91 C ATOM 130 CD GLU A 13 8.045 12.715 9.255 1.00 17.64 C ATOM 131 OE1 GLU A 13 7.945 12.345 10.452 1.00 19.61 O ATOM 132 OE2 GLU A 13 7.066 13.022 8.555 1.00 18.57 O ATOM 133 H GLU A 13 11.083 11.759 6.784 1.00 0.00 H ATOM 134 N GLU A 14 13.485 11.697 10.510 1.00 20.35 N ATOM 135 CA GLU A 14 14.458 10.875 11.222 1.00 20.98 C ATOM 136 C GLU A 14 13.821 9.607 11.783 1.00 21.73 C ATOM 137 O GLU A 14 14.503 8.585 11.931 1.00 23.98 O ATOM 138 CB GLU A 14 15.110 11.703 12.329 1.00 23.29 C ATOM 139 CG GLU A 14 16.204 10.981 13.101 1.00 26.91 C ATOM 140 CD GLU A 14 15.674 10.142 14.255 1.00 29.36 C ATOM 141 OE1 GLU A 14 14.531 10.377 14.706 1.00 29.93 O ATOM 142 OE2 GLU A 14 16.410 9.242 14.712 1.00 32.05 O ATOM 143 H GLU A 14 13.309 12.676 10.814 1.00 0.00 H ATOM 144 N ILE A 15 12.519 9.641 12.077 1.00 23.89 N ATOM 145 CA ILE A 15 11.862 8.482 12.666 1.00 26.66 C ATOM 146 C ILE A 15 11.807 7.290 11.717 1.00 26.23 C ATOM 147 O ILE A 15 11.575 6.163 12.165 1.00 27.08 O ATOM 148 CB ILE A 15 10.454 8.853 13.170 1.00 30.13 C ATOM 149 CG1 ILE A 15 10.541 9.965 14.219 1.00 32.12 C ATOM 150 CG2 ILE A 15 9.754 7.631 13.746 1.00 31.58 C ATOM 151 CD1 ILE A 15 9.198 10.535 14.633 1.00 32.80 C ATOM 152 H ILE A 15 11.969 10.502 11.884 1.00 0.00 H ATOM 153 N LEU A 16 12.017 7.496 10.421 1.00 23.60 N ATOM 154 CA LEU A 16 11.943 6.408 9.449 1.00 22.84 C ATOM 155 C LEU A 16 13.285 5.717 9.217 1.00 23.04 C ATOM 156 O LEU A 16 13.401 4.915 8.286 1.00 22.84 O ATOM 157 CB LEU A 16 11.390 6.911 8.113 1.00 21.72 C ATOM 158 CG LEU A 16 9.917 7.327 8.108 1.00 22.33 C ATOM 159 CD1 LEU A 16 9.507 7.823 6.723 1.00 22.79 C ATOM 160 CD2 LEU A 16 9.000 6.193 8.557 1.00 23.86 C ATOM 161 H LEU A 16 12.240 8.457 10.090 1.00 0.00 H ATOM 162 N LEU A 17 14.295 6.007 10.036 1.00 22.99 N ATOM 163 CA LEU A 17 15.629 5.468 9.799 1.00 23.12 C ATOM 164 C LEU A 17 15.623 3.951 9.606 1.00 22.78 C ATOM 165 O LEU A 17 16.149 3.438 8.610 1.00 22.82 O ATOM 166 CB LEU A 17 16.550 5.876 10.949 1.00 24.83 C ATOM 167 CG LEU A 17 17.946 5.276 10.992 1.00 25.19 C ATOM 168 CD1 LEU A 17 18.721 5.710 9.767 1.00 24.86 C ATOM 169 CD2 LEU A 17 18.672 5.692 12.254 1.00 27.45 C ATOM 170 H LEU A 17 14.130 6.626 10.855 1.00 0.00 H ATOM 171 N LYS A 18 15.056 3.207 10.548 1.00 26.05 N ATOM 172 CA LYS A 18 15.143 1.754 10.442 1.00 28.12 C ATOM 173 C LYS A 18 14.244 1.206 9.333 1.00 26.98 C ATOM 174 O LYS A 18 14.617 0.262 8.628 1.00 27.87 O ATOM 175 CB LYS A 18 14.773 1.123 11.777 1.00 34.06 C ATOM 176 CG LYS A 18 15.147 -0.346 11.890 1.00 39.88 C ATOM 177 CD LYS A 18 14.339 -1.073 12.962 1.00 45.68 C ATOM 178 CE LYS A 18 13.898 -0.114 14.043 1.00 49.14 C ATOM 179 NZ LYS A 18 12.934 -0.733 14.998 1.00 51.54 N ATOM 180 HZ1 LYS A 18 12.087 -1.044 14.481 1.00 0.00 H ATOM 181 HZ2 LYS A 18 13.381 -1.551 15.458 1.00 0.00 H ATOM 182 HZ3 LYS A 18 12.664 -0.033 15.718 1.00 0.00 H ATOM 183 H LYS A 18 14.559 3.651 11.346 1.00 0.00 H ATOM 184 N LYS A 19 13.055 1.777 9.154 1.00 25.94 N ATOM 185 CA LYS A 19 12.148 1.263 8.131 1.00 26.18 C ATOM 186 C LYS A 19 12.719 1.439 6.728 1.00 24.76 C ATOM 187 O LYS A 19 12.565 0.553 5.881 1.00 25.33 O ATOM 188 CB LYS A 19 10.784 1.947 8.224 1.00 27.70 C ATOM 189 CG LYS A 19 9.949 1.468 9.421 1.00 30.21 C ATOM 190 CD LYS A 19 10.655 1.771 10.739 1.00 33.14 C ATOM 191 CE LYS A 19 10.973 3.259 10.845 1.00 34.28 C ATOM 192 NZ LYS A 19 12.170 3.594 11.672 1.00 31.46 N ATOM 193 HZ1 LYS A 19 12.026 3.251 12.643 1.00 0.00 H ATOM 194 HZ2 LYS A 19 13.011 3.139 11.263 1.00 0.00 H ATOM 195 HZ3 LYS A 19 12.304 4.625 11.684 1.00 0.00 H ATOM 196 H LYS A 19 12.772 2.587 9.741 1.00 0.00 H ATOM 197 N VAL A 20 13.340 2.587 6.440 1.00 22.49 N ATOM 198 CA VAL A 20 13.868 2.811 5.094 1.00 21.29 C ATOM 199 C VAL A 20 15.140 2.001 4.877 1.00 21.60 C ATOM 200 O VAL A 20 15.384 1.484 3.779 1.00 21.95 O ATOM 201 CB VAL A 20 14.062 4.315 4.826 1.00 21.06 C ATOM 202 CG1 VAL A 20 14.830 4.560 3.514 1.00 20.71 C ATOM 203 CG2 VAL A 20 12.707 5.016 4.794 1.00 22.37 C ATOM 204 H VAL A 20 13.448 3.319 7.171 1.00 0.00 H ATOM 205 N SER A 21 15.968 1.869 5.917 1.00 22.59 N ATOM 206 CA SER A 21 17.151 1.023 5.802 1.00 23.76 C ATOM 207 C SER A 21 16.767 -0.396 5.389 1.00 24.59 C ATOM 208 O SER A 21 17.456 -1.028 4.583 1.00 25.04 O ATOM 209 CB SER A 21 17.918 1.016 7.127 1.00 25.19 C ATOM 210 OG SER A 21 18.301 2.329 7.520 1.00 25.67 O ATOM 211 HG SER A 21 18.793 2.285 8.378 1.00 0.00 H ATOM 212 H SER A 21 15.770 2.369 6.807 1.00 0.00 H ATOM 213 N LYS A 22 15.659 -0.911 5.930 1.00 26.17 N ATOM 214 CA LYS A 22 15.222 -2.267 5.605 1.00 27.47 C ATOM 215 C LYS A 22 14.785 -2.390 4.148 1.00 26.70 C ATOM 216 O LYS A 22 15.092 -3.392 3.490 1.00 28.00 O ATOM 217 CB LYS A 22 14.083 -2.649 6.541 1.00 29.97 C ATOM 218 CG LYS A 22 13.445 -3.982 6.294 1.00 33.68 C ATOM 219 CD LYS A 22 12.495 -4.267 7.448 1.00 37.71 C ATOM 220 CE LYS A 22 11.474 -5.320 7.092 1.00 40.75 C ATOM 221 NZ LYS A 22 10.536 -4.860 6.032 1.00 41.65 N ATOM 222 HZ1 LYS A 22 10.027 -4.016 6.364 1.00 0.00 H ATOM 223 HZ2 LYS A 22 11.073 -4.627 5.173 1.00 0.00 H ATOM 224 HZ3 LYS A 22 9.854 -5.617 5.822 1.00 0.00 H ATOM 225 H LYS A 22 15.099 -0.338 6.593 1.00 0.00 H ATOM 226 N ILE A 23 14.061 -1.394 3.627 1.00 24.31 N ATOM 227 CA ILE A 23 13.676 -1.420 2.216 1.00 23.64 C ATOM 228 C ILE A 23 14.911 -1.473 1.332 1.00 22.97 C ATOM 229 O ILE A 23 14.971 -2.244 0.364 1.00 23.75 O ATOM 230 CB ILE A 23 12.797 -0.206 1.870 1.00 23.43 C ATOM 231 CG1 ILE A 23 11.423 -0.338 2.526 1.00 25.05 C ATOM 232 CG2 ILE A 23 12.680 -0.062 0.350 1.00 24.27 C ATOM 233 CD1 ILE A 23 10.565 0.900 2.403 1.00 26.89 C ATOM 234 H ILE A 23 13.770 -0.597 4.228 1.00 0.00 H ATOM 235 N ILE A 24 15.906 -0.649 1.627 1.00 21.81 N ATOM 236 CA ILE A 24 17.133 -0.582 0.795 1.00 21.32 C ATOM 237 C ILE A 24 17.820 -1.947 0.767 1.00 22.86 C ATOM 238 O ILE A 24 18.151 -2.435 -0.299 1.00 24.11 O ATOM 239 CB ILE A 24 18.062 0.521 1.333 1.00 20.63 C ATOM 240 CG1 ILE A 24 17.407 1.896 1.207 1.00 19.52 C ATOM 241 CG2 ILE A 24 19.412 0.434 0.654 1.00 21.16 C ATOM 242 CD1 ILE A 24 18.087 2.986 1.999 1.00 19.72 C ATOM 243 H ILE A 24 15.825 -0.034 2.462 1.00 0.00 H ATOM 244 N LYS A 25 17.984 -2.536 1.950 1.00 30.00 N ATOM 245 CA LYS A 25 18.677 -3.841 2.037 1.00 30.00 C ATOM 246 C LYS A 25 17.819 -4.944 1.403 1.00 30.00 C ATOM 247 O LYS A 25 18.385 -5.688 0.631 1.00 30.00 O ATOM 248 CB LYS A 25 19.031 -4.131 3.493 1.00 30.00 C ATOM 249 CG LYS A 25 20.186 -3.319 4.059 1.00 30.00 C ATOM 250 CD LYS A 25 20.145 -3.218 5.580 1.00 30.00 C ATOM 251 CE LYS A 25 20.568 -4.444 6.334 1.00 30.00 C ATOM 252 NZ LYS A 25 20.736 -4.112 7.759 1.00 30.00 N ATOM 253 HZ1 LYS A 25 21.463 -3.375 7.859 1.00 0.00 H ATOM 254 HZ2 LYS A 25 19.834 -3.764 8.141 1.00 0.00 H ATOM 255 HZ3 LYS A 25 21.029 -4.963 8.280 1.00 0.00 H ATOM 256 H LYS A 25 17.625 -2.079 2.813 1.00 0.00 H ATOM 257 N GLU A 26 16.481 -4.988 1.665 1.00 27.53 N ATOM 258 CA GLU A 26 15.564 -6.026 1.119 1.00 29.48 C ATOM 259 C GLU A 26 15.514 -5.952 -0.411 1.00 29.30 C ATOM 260 O GLU A 26 15.371 -7.026 -1.029 1.00 30.86 O ATOM 261 CB GLU A 26 14.152 -5.880 1.691 1.00 31.82 C ATOM 262 CG GLU A 26 13.256 -7.072 1.405 1.00 34.30 C ATOM 263 CD GLU A 26 11.993 -7.130 2.247 1.00 36.11 C ATOM 264 OE1 GLU A 26 11.826 -6.257 3.122 1.00 35.45 O ATOM 265 OE2 GLU A 26 11.180 -8.049 2.027 1.00 37.88 O ATOM 266 H GLU A 26 16.078 -4.254 2.282 1.00 0.00 H ATOM 267 N ALA A 27 15.788 -4.786 -1.009 1.00 28.86 N ATOM 268 CA ALA A 27 15.754 -4.652 -2.455 1.00 29.71 C ATOM 269 C ALA A 27 17.016 -5.175 -3.126 1.00 29.78 C ATOM 270 O ALA A 27 17.020 -5.336 -4.352 1.00 31.81 O ATOM 271 CB ALA A 27 15.540 -3.193 -2.837 1.00 30.51 C ATOM 272 H ALA A 27 16.030 -3.959 -0.426 1.00 0.00 H ATOM 273 N GLY A 28 18.080 -5.436 -2.372 1.00 28.64 N ATOM 274 CA GLY A 28 19.299 -5.971 -2.937 1.00 28.20 C ATOM 275 C GLY A 28 20.397 -4.960 -3.165 1.00 25.96 C ATOM 276 O GLY A 28 21.363 -5.270 -3.874 1.00 26.47 O ATOM 277 H GLY A 28 18.034 -5.251 -1.350 1.00 0.00 H ATOM 278 N ALA A 29 20.284 -3.765 -2.600 1.00 23.34 N ATOM 279 CA ALA A 29 21.385 -2.827 -2.705 1.00 20.86 C ATOM 280 C ALA A 29 22.611 -3.415 -2.022 1.00 19.66 C ATOM 281 O ALA A 29 22.507 -4.180 -1.059 1.00 21.51 O ATOM 282 CB ALA A 29 21.023 -1.509 -2.031 1.00 21.11 C ATOM 283 H ALA A 29 19.417 -3.504 -2.088 1.00 0.00 H ATOM 284 N SER A 30 23.791 -3.020 -2.493 1.00 17.89 N ATOM 285 CA SER A 30 25.028 -3.503 -1.890 1.00 18.67 C ATOM 286 C SER A 30 25.352 -2.783 -0.590 1.00 18.32 C ATOM 287 O SER A 30 26.212 -3.245 0.163 1.00 18.91 O ATOM 288 CB SER A 30 26.183 -3.366 -2.884 1.00 19.89 C ATOM 289 OG SER A 30 26.427 -2.015 -3.177 1.00 18.78 O ATOM 290 HG SER A 30 27.176 -1.948 -3.821 1.00 0.00 H ATOM 291 H SER A 30 23.832 -2.362 -3.297 1.00 0.00 H ATOM 292 N GLY A 31 24.670 -1.679 -0.310 1.00 16.71 N ATOM 293 CA GLY A 31 24.926 -0.902 0.878 1.00 15.69 C ATOM 294 C GLY A 31 24.120 0.382 0.836 1.00 14.94 C ATOM 295 O GLY A 31 23.326 0.607 -0.074 1.00 15.29 O ATOM 296 H GLY A 31 23.928 -1.365 -0.968 1.00 0.00 H ATOM 297 N TYR A 32 24.371 1.225 1.832 1.00 14.21 N ATOM 298 CA TYR A 32 23.777 2.550 1.931 1.00 13.40 C ATOM 299 C TYR A 32 24.640 3.364 2.889 1.00 13.02 C ATOM 300 O TYR A 32 25.330 2.816 3.754 1.00 13.54 O ATOM 301 CB TYR A 32 22.298 2.524 2.413 1.00 14.75 C ATOM 302 CG TYR A 32 22.160 2.057 3.838 1.00 14.84 C ATOM 303 CD1 TYR A 32 22.213 2.952 4.904 1.00 15.22 C ATOM 304 CD2 TYR A 32 22.050 0.700 4.127 1.00 16.90 C ATOM 305 CE1 TYR A 32 22.165 2.511 6.219 1.00 16.50 C ATOM 306 CE2 TYR A 32 22.005 0.250 5.440 1.00 17.45 C ATOM 307 CZ TYR A 32 22.051 1.158 6.484 1.00 18.04 C ATOM 308 OH TYR A 32 22.009 0.731 7.804 1.00 19.17 O ATOM 309 HH TYR A 32 22.779 0.135 7.982 1.00 0.00 H ATOM 310 H TYR A 32 25.027 0.922 2.580 1.00 0.00 H ATOM 311 N THR A 33 24.548 4.678 2.752 1.00 12.91 N ATOM 312 CA THR A 33 25.128 5.636 3.680 1.00 12.71 C ATOM 313 C THR A 33 24.001 6.528 4.186 1.00 13.09 C ATOM 314 O THR A 33 23.084 6.868 3.427 1.00 14.17 O ATOM 315 CB THR A 33 26.221 6.449 2.977 1.00 12.68 C ATOM 316 OG1 THR A 33 27.244 5.552 2.543 1.00 13.07 O ATOM 317 CG2 THR A 33 26.859 7.487 3.890 1.00 14.13 C ATOM 318 HG1 THR A 33 27.958 6.064 2.086 1.00 0.00 H ATOM 319 H THR A 33 24.029 5.048 1.930 1.00 0.00 H ATOM 320 N VAL A 34 24.037 6.884 5.463 1.00 12.81 N ATOM 321 CA VAL A 34 23.010 7.733 6.060 1.00 13.23 C ATOM 322 C VAL A 34 23.676 8.786 6.933 1.00 13.40 C ATOM 323 O VAL A 34 24.676 8.518 7.613 1.00 14.45 O ATOM 324 CB VAL A 34 21.937 6.886 6.789 1.00 14.87 C ATOM 325 CG1 VAL A 34 22.518 6.159 7.990 1.00 16.24 C ATOM 326 CG2 VAL A 34 20.734 7.730 7.175 1.00 16.02 C ATOM 327 H VAL A 34 24.821 6.548 6.058 1.00 0.00 H ATOM 328 N LEU A 35 23.125 9.997 6.890 1.00 12.98 N ATOM 329 CA LEU A 35 23.623 11.145 7.629 1.00 13.40 C ATOM 330 C LEU A 35 22.470 11.829 8.346 1.00 13.39 C ATOM 331 O LEU A 35 21.338 11.851 7.867 1.00 14.47 O ATOM 332 CB LEU A 35 24.288 12.166 6.707 1.00 14.26 C ATOM 333 CG LEU A 35 25.408 11.620 5.817 1.00 14.37 C ATOM 334 CD1 LEU A 35 24.916 11.235 4.425 1.00 16.18 C ATOM 335 CD2 LEU A 35 26.575 12.597 5.697 1.00 15.67 C ATOM 336 H LEU A 35 22.286 10.130 6.290 1.00 0.00 H ATOM 337 N ALA A 36 22.753 12.379 9.525 1.00 13.99 N ATOM 338 CA ALA A 36 21.783 13.237 10.192 1.00 14.80 C ATOM 339 C ALA A 36 21.637 14.552 9.447 1.00 13.92 C ATOM 340 O ALA A 36 22.620 15.125 8.972 1.00 15.70 O ATOM 341 CB ALA A 36 22.227 13.524 11.624 1.00 16.83 C ATOM 342 H ALA A 36 23.673 12.195 9.973 1.00 0.00 H ATOM 343 N ALA A 37 20.410 15.051 9.369 1.00 14.56 N ATOM 344 CA ALA A 37 20.148 16.271 8.628 1.00 14.29 C ATOM 345 C ALA A 37 18.969 16.996 9.259 1.00 14.75 C ATOM 346 O ALA A 37 18.285 16.485 10.145 1.00 15.86 O ATOM 347 CB ALA A 37 19.864 15.990 7.154 1.00 15.40 C ATOM 348 H ALA A 37 19.626 14.561 9.845 1.00 0.00 H ATOM 349 N ALA A 38 18.730 18.204 8.782 1.00 15.34 N ATOM 350 CA ALA A 38 17.554 18.975 9.151 1.00 15.79 C ATOM 351 C ALA A 38 17.067 19.682 7.893 1.00 14.60 C ATOM 352 O ALA A 38 17.784 19.754 6.889 1.00 15.23 O ATOM 353 CB ALA A 38 17.861 19.980 10.270 1.00 17.83 C ATOM 354 H ALA A 38 19.411 18.621 8.115 1.00 0.00 H ATOM 355 N GLY A 39 15.854 20.208 7.919 1.00 15.23 N ATOM 356 CA GLY A 39 15.386 20.902 6.740 1.00 15.09 C ATOM 357 C GLY A 39 13.977 21.419 6.893 1.00 14.71 C ATOM 358 O GLY A 39 13.315 21.231 7.922 1.00 15.98 O ATOM 359 H GLY A 39 15.253 20.125 8.764 1.00 0.00 H ATOM 360 N GLU A 40 13.537 22.107 5.843 1.00 14.64 N ATOM 361 CA GLU A 40 12.153 22.516 5.674 1.00 15.28 C ATOM 362 C GLU A 40 11.736 22.245 4.236 1.00 15.65 C ATOM 363 O GLU A 40 12.570 22.237 3.321 1.00 15.67 O ATOM 364 CB GLU A 40 11.962 24.002 6.009 1.00 17.64 C ATOM 365 CG GLU A 40 12.393 24.367 7.438 1.00 19.03 C ATOM 366 CD GLU A 40 12.212 25.840 7.762 1.00 20.83 C ATOM 367 OE1 GLU A 40 11.061 26.312 7.754 1.00 24.68 O ATOM 368 OE2 GLU A 40 13.214 26.527 8.038 1.00 21.56 O ATOM 369 H GLU A 40 14.220 22.366 5.103 1.00 0.00 H ATOM 370 N GLY A 41 10.433 22.023 4.044 1.00 16.25 N ATOM 371 CA GLY A 41 9.851 21.755 2.743 1.00 17.20 C ATOM 372 C GLY A 41 8.442 22.314 2.659 1.00 17.71 C ATOM 373 O GLY A 41 7.915 22.891 3.616 1.00 19.07 O ATOM 374 H GLY A 41 9.803 22.043 4.871 1.00 0.00 H ATOM 375 N SER A 42 7.830 22.128 1.485 1.00 19.07 N ATOM 376 CA SER A 42 6.561 22.756 1.173 1.00 20.33 C ATOM 377 C SER A 42 5.367 21.808 1.091 1.00 20.86 C ATOM 378 O SER A 42 4.244 22.293 0.940 1.00 23.18 O ATOM 379 CB SER A 42 6.689 23.527 -0.150 1.00 23.12 C ATOM 380 OG SER A 42 7.559 24.634 -0.023 1.00 24.26 O ATOM 381 HG SER A 42 8.458 24.317 0.243 1.00 0.00 H ATOM 382 H SER A 42 8.278 21.515 0.774 1.00 0.00 H ATOM 383 N ARG A 43 5.549 20.487 1.183 1.00 21.10 N ATOM 384 CA ARG A 43 4.395 19.596 1.057 1.00 21.68 C ATOM 385 C ARG A 43 3.528 19.601 2.311 1.00 22.43 C ATOM 386 O ARG A 43 2.324 19.299 2.245 1.00 23.71 O ATOM 387 CB ARG A 43 4.842 18.167 0.778 1.00 20.70 C ATOM 388 CG ARG A 43 5.526 17.959 -0.527 1.00 21.42 C ATOM 389 CD ARG A 43 5.454 16.519 -0.927 1.00 22.20 C ATOM 390 NE ARG A 43 6.209 15.611 -0.071 1.00 20.43 N ATOM 391 CZ ARG A 43 5.700 14.549 0.546 1.00 19.28 C ATOM 392 NH1 ARG A 43 4.408 14.263 0.470 1.00 19.46 N ATOM 393 NH2 ARG A 43 6.504 13.763 1.241 1.00 18.86 N ATOM 394 HE ARG A 43 7.221 15.809 0.067 1.00 0.00 H ATOM 395 HH12 ARG A 43 4.031 13.427 0.961 1.00 0.00 H ATOM 396 HH11 ARG A 43 3.772 14.874 -0.080 1.00 0.00 H ATOM 397 HH22 ARG A 43 6.121 12.928 1.729 1.00 0.00 H ATOM 398 HH21 ARG A 43 7.520 13.979 1.300 1.00 0.00 H ATOM 399 H ARG A 43 6.500 20.097 1.342 1.00 0.00 H ATOM 400 N ASN A 44 4.140 19.896 3.457 1.00 21.07 N ATOM 401 CA ASN A 44 3.466 20.045 4.744 1.00 21.94 C ATOM 402 C ASN A 44 2.710 18.781 5.145 1.00 21.58 C ATOM 403 O ASN A 44 1.505 18.794 5.420 1.00 24.99 O ATOM 404 CB ASN A 44 2.587 21.294 4.769 1.00 24.45 C ATOM 405 CG ASN A 44 3.375 22.553 4.475 1.00 26.02 C ATOM 406 OD1 ASN A 44 4.601 22.589 4.655 1.00 25.07 O ATOM 407 ND2 ASN A 44 2.687 23.595 4.032 1.00 28.96 N ATOM 408 HD22 ASN A 44 1.659 23.519 3.896 1.00 0.00 H ATOM 409 HD21 ASN A 44 3.175 24.489 3.821 1.00 0.00 H ATOM 410 H ASN A 44 5.171 20.030 3.433 1.00 0.00 H ATOM 411 N VAL A 45 3.463 17.684 5.214 1.00 19.63 N ATOM 412 CA VAL A 45 2.903 16.389 5.567 1.00 19.22 C ATOM 413 C VAL A 45 3.565 15.765 6.792 1.00 19.36 C ATOM 414 O VAL A 45 3.254 14.626 7.134 1.00 21.65 O ATOM 415 CB VAL A 45 2.949 15.406 4.380 1.00 19.85 C ATOM 416 CG1 VAL A 45 2.141 15.915 3.189 1.00 21.79 C ATOM 417 CG2 VAL A 45 4.406 15.129 3.993 1.00 20.22 C ATOM 418 H VAL A 45 4.480 17.756 5.010 1.00 0.00 H ATOM 419 N ARG A 46 4.460 16.482 7.479 1.00 18.56 N ATOM 420 CA ARG A 46 5.262 15.866 8.538 1.00 17.77 C ATOM 421 C ARG A 46 4.392 15.147 9.575 1.00 17.87 C ATOM 422 O ARG A 46 3.423 15.710 10.101 1.00 19.99 O ATOM 423 CB ARG A 46 6.108 16.926 9.247 1.00 18.86 C ATOM 424 CG ARG A 46 7.009 16.334 10.328 1.00 18.67 C ATOM 425 CD ARG A 46 8.214 17.177 10.644 1.00 19.20 C ATOM 426 NE ARG A 46 9.098 17.345 9.493 1.00 17.51 N ATOM 427 CZ ARG A 46 10.260 16.717 9.314 1.00 16.03 C ATOM 428 NH1 ARG A 46 10.714 15.833 10.202 1.00 17.42 N ATOM 429 NH2 ARG A 46 10.976 16.982 8.219 1.00 16.85 N ATOM 430 HE ARG A 46 8.796 18.009 8.752 1.00 0.00 H ATOM 431 HH12 ARG A 46 11.624 15.355 10.042 1.00 0.00 H ATOM 432 HH11 ARG A 46 10.159 15.621 11.055 1.00 0.00 H ATOM 433 HH22 ARG A 46 11.885 16.501 8.063 1.00 0.00 H ATOM 434 HH21 ARG A 46 10.625 17.669 7.522 1.00 0.00 H ATOM 435 H ARG A 46 4.588 17.490 7.258 1.00 0.00 H ATOM 436 N SER A 47 4.773 13.918 9.919 1.00 18.75 N ATOM 437 CA SER A 47 3.902 13.074 10.732 1.00 19.17 C ATOM 438 C SER A 47 3.758 13.623 12.142 1.00 20.17 C ATOM 439 O SER A 47 2.717 13.423 12.766 1.00 22.95 O ATOM 440 CB SER A 47 4.320 11.593 10.666 1.00 20.42 C ATOM 441 OG SER A 47 5.536 11.405 11.451 1.00 20.34 O ATOM 442 HG SER A 47 6.258 11.972 11.080 1.00 0.00 H ATOM 443 H SER A 47 5.697 13.557 9.606 1.00 0.00 H ATOM 444 N THR A 48 4.751 14.346 12.630 1.00 20.42 N ATOM 445 CA THR A 48 4.741 14.910 13.966 1.00 21.14 C ATOM 446 C THR A 48 4.275 16.366 13.985 1.00 22.20 C ATOM 447 O THR A 48 4.328 17.009 15.043 1.00 24.25 O ATOM 448 CB THR A 48 6.149 14.790 14.555 1.00 22.51 C ATOM 449 OG1 THR A 48 7.101 15.384 13.653 1.00 22.11 O ATOM 450 CG2 THR A 48 6.524 13.310 14.759 1.00 25.70 C ATOM 451 HG1 THR A 48 7.067 14.914 12.782 1.00 0.00 H ATOM 452 H THR A 48 5.580 14.519 12.026 1.00 0.00 H ATOM 453 N GLY A 49 3.856 16.903 12.837 1.00 21.41 N ATOM 454 CA GLY A 49 3.301 18.234 12.730 1.00 22.85 C ATOM 455 C GLY A 49 4.353 19.295 12.465 1.00 23.31 C ATOM 456 O GLY A 49 5.562 19.048 12.500 1.00 26.49 O ATOM 457 H GLY A 49 3.933 16.332 11.971 1.00 0.00 H ATOM 458 N GLU A 50 3.871 20.499 12.148 1.00 20.86 N ATOM 459 CA GLU A 50 4.676 21.722 12.028 1.00 23.32 C ATOM 460 C GLU A 50 3.993 22.920 12.694 1.00 20.73 C ATOM 461 O GLU A 50 2.761 23.047 12.610 1.00 31.15 O ATOM 462 CB GLU A 50 4.897 22.094 10.547 1.00 24.03 C ATOM 463 CG GLU A 50 5.490 21.017 9.636 1.00 24.71 C ATOM 464 CD GLU A 50 5.823 21.529 8.223 1.00 25.02 C ATOM 465 OE1 GLU A 50 5.929 22.754 7.998 1.00 27.46 O ATOM 466 OE2 GLU A 50 5.974 20.677 7.318 1.00 19.93 O ATOM 467 H GLU A 50 2.849 20.577 11.973 1.00 0.00 H ATOM 468 N PRO A 51 4.742 23.825 13.333 1.00 25.09 N ATOM 469 CA PRO A 51 4.126 25.022 13.924 1.00 26.86 C ATOM 470 C PRO A 51 3.978 26.145 12.900 1.00 28.15 C ATOM 471 O PRO A 51 4.512 26.102 11.791 1.00 29.53 O ATOM 472 CB PRO A 51 5.129 25.412 15.012 1.00 27.07 C ATOM 473 CG PRO A 51 6.482 25.021 14.364 1.00 25.95 C ATOM 474 CD PRO A 51 6.180 23.725 13.660 1.00 25.94 C ATOM 475 N SER A 52 3.241 27.181 13.312 1.00 29.32 N ATOM 476 CA SER A 52 2.965 28.312 12.432 1.00 32.44 C ATOM 477 C SER A 52 4.244 29.029 12.030 1.00 31.94 C ATOM 478 O SER A 52 4.413 29.414 10.865 1.00 34.90 O ATOM 479 CB SER A 52 2.001 29.271 13.128 1.00 35.17 C ATOM 480 OG SER A 52 2.655 29.933 14.201 1.00 37.89 O ATOM 481 HG SER A 52 2.020 30.551 14.643 1.00 0.00 H ATOM 482 H SER A 52 2.857 27.181 14.278 1.00 0.00 H ATOM 483 N VAL A 53 5.146 29.228 12.986 1.00 30.14 N ATOM 484 CA VAL A 53 6.436 29.852 12.723 1.00 27.73 C ATOM 485 C VAL A 53 7.415 28.704 12.500 1.00 26.93 C ATOM 486 O VAL A 53 7.822 28.026 13.443 1.00 23.66 O ATOM 487 CB VAL A 53 6.851 30.774 13.870 1.00 29.22 C ATOM 488 CG1 VAL A 53 8.166 31.451 13.554 1.00 30.62 C ATOM 489 CG2 VAL A 53 5.763 31.808 14.104 1.00 30.90 C ATOM 490 H VAL A 53 4.923 28.928 13.956 1.00 0.00 H ATOM 491 N SER A 54 7.745 28.445 11.236 1.00 28.03 N ATOM 492 CA SER A 54 8.534 27.274 10.883 1.00 29.67 C ATOM 493 C SER A 54 9.977 27.411 11.361 1.00 27.23 C ATOM 494 O SER A 54 10.501 28.508 11.597 1.00 29.50 O ATOM 495 CB SER A 54 8.487 27.037 9.363 1.00 34.26 C ATOM 496 OG SER A 54 8.938 25.750 8.936 1.00 36.64 O ATOM 497 HG SER A 54 8.872 25.689 7.950 1.00 0.00 H ATOM 498 H SER A 54 7.432 29.093 10.485 1.00 0.00 H ATOM 499 N HIS A 55 10.603 26.253 11.519 1.00 24.16 N ATOM 500 CA HIS A 55 12.005 26.114 11.875 1.00 21.66 C ATOM 501 C HIS A 55 12.477 24.807 11.253 1.00 20.26 C ATOM 502 O HIS A 55 11.673 24.031 10.745 1.00 21.24 O ATOM 503 CB HIS A 55 12.156 26.077 13.390 1.00 23.87 C ATOM 504 CG HIS A 55 11.388 24.974 14.043 1.00 25.73 C ATOM 505 ND1 HIS A 55 11.841 23.673 14.090 1.00 26.42 N ATOM 506 CD2 HIS A 55 10.198 24.981 14.687 1.00 27.13 C ATOM 507 CE1 HIS A 55 10.970 22.929 14.751 1.00 27.64 C ATOM 508 NE2 HIS A 55 9.961 23.698 15.121 1.00 28.08 N ATOM 509 H HIS A 55 10.052 25.383 11.378 1.00 0.00 H ATOM 510 N ALA A 56 13.786 24.556 11.265 1.00 19.49 N ATOM 511 CA ALA A 56 14.271 23.320 10.643 1.00 18.37 C ATOM 512 C ALA A 56 13.820 22.102 11.450 1.00 17.64 C ATOM 513 O ALA A 56 13.819 22.146 12.681 1.00 20.03 O ATOM 514 CB ALA A 56 15.792 23.351 10.520 1.00 21.19 C ATOM 515 H ALA A 56 14.450 25.223 11.707 1.00 0.00 H ATOM 516 N TYR A 57 13.417 21.023 10.761 1.00 15.96 N ATOM 517 CA TYR A 57 12.926 19.779 11.352 1.00 16.12 C ATOM 518 C TYR A 57 13.945 18.656 11.190 1.00 16.48 C ATOM 519 O TYR A 57 14.786 18.683 10.292 1.00 18.85 O ATOM 520 CB TYR A 57 11.584 19.355 10.736 1.00 17.28 C ATOM 521 CG TYR A 57 10.563 20.494 10.785 1.00 19.33 C ATOM 522 CD1 TYR A 57 9.934 20.872 11.965 1.00 22.93 C ATOM 523 CD2 TYR A 57 10.286 21.230 9.650 1.00 20.01 C ATOM 524 CE1 TYR A 57 9.025 21.949 11.980 1.00 24.62 C ATOM 525 CE2 TYR A 57 9.417 22.290 9.645 1.00 22.41 C ATOM 526 CZ TYR A 57 8.791 22.653 10.809 1.00 23.43 C ATOM 527 OH TYR A 57 7.920 23.718 10.815 1.00 26.75 O ATOM 528 HH TYR A 57 8.400 24.537 10.534 1.00 0.00 H ATOM 529 H TYR A 57 13.457 21.076 9.723 1.00 0.00 H ATOM 530 N SER A 58 13.846 17.656 12.057 1.00 17.91 N ATOM 531 CA SER A 58 14.852 16.604 12.118 1.00 17.72 C ATOM 532 C SER A 58 14.634 15.558 11.034 1.00 16.27 C ATOM 533 O SER A 58 13.549 14.970 10.930 1.00 18.34 O ATOM 534 CB SER A 58 14.816 15.924 13.485 1.00 19.72 C ATOM 535 OG SER A 58 15.276 16.786 14.508 1.00 22.86 O ATOM 536 HG SER A 58 15.239 16.314 15.377 1.00 0.00 H ATOM 537 H SER A 58 13.034 17.623 12.706 1.00 0.00 H ATOM 538 N ASN A 59 15.694 15.290 10.268 1.00 15.20 N ATOM 539 CA ASN A 59 15.662 14.380 9.138 1.00 14.87 C ATOM 540 C ASN A 59 16.861 13.438 9.154 1.00 14.43 C ATOM 541 O ASN A 59 17.800 13.574 9.943 1.00 14.92 O ATOM 542 CB ASN A 59 15.711 15.164 7.818 1.00 15.92 C ATOM 543 CG ASN A 59 14.486 16.006 7.590 1.00 15.69 C ATOM 544 OD1 ASN A 59 13.404 15.688 8.073 1.00 18.08 O ATOM 545 ND2 ASN A 59 14.634 17.072 6.826 1.00 15.95 N ATOM 546 HD22 ASN A 59 15.569 17.307 6.436 1.00 0.00 H ATOM 547 HD21 ASN A 59 13.815 17.677 6.614 1.00 0.00 H ATOM 548 H ASN A 59 16.594 15.760 10.494 1.00 0.00 H ATOM 549 N ILE A 60 16.836 12.500 8.215 1.00 15.13 N ATOM 550 CA ILE A 60 18.012 11.747 7.815 1.00 14.59 C ATOM 551 C ILE A 60 18.119 11.822 6.297 1.00 14.17 C ATOM 552 O ILE A 60 17.118 11.982 5.586 1.00 14.77 O ATOM 553 CB ILE A 60 17.946 10.290 8.301 1.00 17.15 C ATOM 554 CG1 ILE A 60 16.592 9.706 7.873 1.00 21.85 C ATOM 555 CG2 ILE A 60 18.149 10.252 9.812 1.00 17.62 C ATOM 556 CD1 ILE A 60 16.249 8.365 8.387 1.00 23.21 C ATOM 557 H ILE A 60 15.932 12.295 7.744 1.00 0.00 H ATOM 558 N LYS A 61 19.360 11.731 5.808 1.00 13.58 N ATOM 559 CA LYS A 61 19.664 11.715 4.382 1.00 12.68 C ATOM 560 C LYS A 61 20.339 10.388 4.072 1.00 12.51 C ATOM 561 O LYS A 61 21.417 10.104 4.597 1.00 13.94 O ATOM 562 CB LYS A 61 20.592 12.872 3.996 1.00 13.51 C ATOM 563 CG LYS A 61 21.081 12.785 2.561 1.00 13.59 C ATOM 564 CD LYS A 61 22.008 13.925 2.166 1.00 15.48 C ATOM 565 CE LYS A 61 22.595 13.686 0.798 1.00 16.83 C ATOM 566 NZ LYS A 61 23.568 14.739 0.403 1.00 18.76 N ATOM 567 HZ1 LYS A 61 23.091 15.663 0.390 1.00 0.00 H ATOM 568 HZ2 LYS A 61 24.350 14.761 1.088 1.00 0.00 H ATOM 569 HZ3 LYS A 61 23.941 14.527 -0.544 1.00 0.00 H ATOM 570 H LYS A 61 20.151 11.668 6.481 1.00 0.00 H ATOM 571 N PHE A 62 19.711 9.584 3.210 1.00 12.47 N ATOM 572 CA PHE A 62 20.316 8.372 2.686 1.00 12.84 C ATOM 573 C PHE A 62 20.910 8.653 1.318 1.00 12.90 C ATOM 574 O PHE A 62 20.322 9.382 0.504 1.00 13.13 O ATOM 575 CB PHE A 62 19.275 7.285 2.446 1.00 14.00 C ATOM 576 CG PHE A 62 18.671 6.711 3.693 1.00 15.03 C ATOM 577 CD1 PHE A 62 17.515 7.252 4.237 1.00 16.35 C ATOM 578 CD2 PHE A 62 19.212 5.578 4.281 1.00 16.30 C ATOM 579 CE1 PHE A 62 16.919 6.694 5.356 1.00 17.82 C ATOM 580 CE2 PHE A 62 18.627 5.016 5.411 1.00 17.80 C ATOM 581 CZ PHE A 62 17.475 5.578 5.939 1.00 18.08 C ATOM 582 H PHE A 62 18.750 9.836 2.902 1.00 0.00 H ATOM 583 N GLU A 63 22.023 7.981 1.039 1.00 12.73 N ATOM 584 CA GLU A 63 22.619 7.889 -0.286 1.00 12.46 C ATOM 585 C GLU A 63 22.802 6.410 -0.598 1.00 12.55 C ATOM 586 O GLU A 63 23.416 5.692 0.209 1.00 13.49 O ATOM 587 CB GLU A 63 23.984 8.563 -0.300 1.00 15.94 C ATOM 588 CG GLU A 63 23.954 10.042 -0.005 1.00 18.07 C ATOM 589 CD GLU A 63 25.271 10.720 -0.381 1.00 23.02 C ATOM 590 OE1 GLU A 63 26.256 9.993 -0.625 1.00 25.48 O ATOM 591 OE2 GLU A 63 25.324 11.964 -0.447 1.00 27.05 O ATOM 592 H GLU A 63 22.500 7.488 1.820 1.00 0.00 H ATOM 593 N VAL A 64 22.285 5.957 -1.731 1.00 12.13 N ATOM 594 CA VAL A 64 22.368 4.561 -2.135 1.00 12.47 C ATOM 595 C VAL A 64 22.943 4.503 -3.543 1.00 12.36 C ATOM 596 O VAL A 64 22.329 5.016 -4.487 1.00 13.09 O ATOM 597 CB VAL A 64 20.994 3.873 -2.103 1.00 13.92 C ATOM 598 CG1 VAL A 64 21.146 2.384 -2.410 1.00 15.29 C ATOM 599 CG2 VAL A 64 20.292 4.108 -0.778 1.00 15.37 C ATOM 600 H VAL A 64 21.799 6.628 -2.359 1.00 0.00 H ATOM 601 N LEU A 65 24.098 3.862 -3.692 1.00 12.63 N ATOM 602 CA LEU A 65 24.704 3.654 -5.001 1.00 13.04 C ATOM 603 C LEU A 65 24.206 2.331 -5.551 1.00 13.11 C ATOM 604 O LEU A 65 24.230 1.313 -4.846 1.00 14.69 O ATOM 605 CB LEU A 65 26.226 3.624 -4.902 1.00 14.12 C ATOM 606 CG LEU A 65 26.887 4.868 -4.337 1.00 16.22 C ATOM 607 CD1 LEU A 65 28.370 4.633 -4.160 1.00 21.09 C ATOM 608 CD2 LEU A 65 26.638 6.061 -5.214 1.00 16.34 C ATOM 609 H LEU A 65 24.584 3.498 -2.848 1.00 0.00 H ATOM 610 N THR A 66 23.796 2.329 -6.822 1.00 13.84 N ATOM 611 CA THR A 66 23.278 1.135 -7.481 1.00 14.50 C ATOM 612 C THR A 66 23.946 0.940 -8.837 1.00 15.30 C ATOM 613 O THR A 66 24.271 1.898 -9.538 1.00 16.04 O ATOM 614 CB THR A 66 21.758 1.190 -7.657 1.00 15.76 C ATOM 615 OG1 THR A 66 21.400 2.246 -8.552 1.00 16.57 O ATOM 616 CG2 THR A 66 21.047 1.429 -6.340 1.00 15.91 C ATOM 617 HG1 THR A 66 21.822 2.088 -9.433 1.00 0.00 H ATOM 618 H THR A 66 23.848 3.215 -7.364 1.00 0.00 H ATOM 619 N ALA A 67 24.129 -0.322 -9.209 1.00 16.69 N ATOM 620 CA ALA A 67 24.780 -0.639 -10.474 1.00 17.80 C ATOM 621 C ALA A 67 23.871 -0.447 -11.677 1.00 17.62 C ATOM 622 O ALA A 67 24.356 -0.485 -12.814 1.00 19.67 O ATOM 623 CB ALA A 67 25.292 -2.077 -10.449 1.00 21.53 C ATOM 624 H ALA A 67 23.804 -1.093 -8.591 1.00 0.00 H ATOM 625 N SER A 68 22.572 -0.274 -11.469 1.00 18.14 N ATOM 626 CA SER A 68 21.622 -0.039 -12.542 1.00 18.43 C ATOM 627 C SER A 68 20.659 1.068 -12.136 1.00 17.85 C ATOM 628 O SER A 68 20.371 1.271 -10.947 1.00 17.78 O ATOM 629 CB SER A 68 20.816 -1.301 -12.853 1.00 20.26 C ATOM 630 OG SER A 68 19.972 -1.640 -11.755 1.00 20.01 O ATOM 631 HG SER A 68 20.527 -1.803 -10.952 1.00 0.00 H ATOM 632 H SER A 68 22.218 -0.308 -10.492 1.00 0.00 H ATOM 633 N ARG A 69 20.127 1.757 -13.151 1.00 19.15 N ATOM 634 CA ARG A 69 19.064 2.720 -12.893 1.00 19.27 C ATOM 635 C ARG A 69 17.819 2.013 -12.382 1.00 18.67 C ATOM 636 O ARG A 69 17.101 2.535 -11.521 1.00 19.25 O ATOM 637 CB ARG A 69 18.742 3.490 -14.175 1.00 21.36 C ATOM 638 CG ARG A 69 17.565 4.429 -14.044 1.00 23.59 C ATOM 639 CD ARG A 69 17.806 5.441 -12.973 1.00 25.04 C ATOM 640 NE ARG A 69 16.635 6.275 -12.723 1.00 28.35 N ATOM 641 CZ ARG A 69 16.475 7.503 -13.197 1.00 30.22 C ATOM 642 NH1 ARG A 69 17.421 8.029 -13.960 1.00 30.11 N ATOM 643 NH2 ARG A 69 15.380 8.202 -12.903 1.00 32.45 N ATOM 644 HE ARG A 69 15.875 5.880 -12.133 1.00 0.00 H ATOM 645 HH12 ARG A 69 17.309 8.991 -14.339 1.00 0.00 H ATOM 646 HH11 ARG A 69 18.276 7.480 -14.181 1.00 0.00 H ATOM 647 HH22 ARG A 69 15.261 9.165 -13.278 1.00 0.00 H ATOM 648 HH21 ARG A 69 14.644 7.785 -12.298 1.00 0.00 H ATOM 649 H ARG A 69 20.471 1.606 -14.121 1.00 0.00 H ATOM 650 N GLU A 70 17.594 0.808 -12.912 1.00 18.50 N ATOM 651 CA GLU A 70 16.441 -0.071 -12.586 1.00 19.52 C ATOM 652 C GLU A 70 16.344 -0.272 -11.070 1.00 18.02 C ATOM 653 O GLU A 70 15.225 -0.141 -10.537 1.00 18.34 O ATOM 654 CB GLU A 70 16.584 -1.417 -13.299 1.00 22.64 C ATOM 655 CG GLU A 70 16.228 -1.361 -14.774 1.00 25.20 C ATOM 656 CD GLU A 70 17.257 -0.662 -15.645 1.00 27.34 C ATOM 657 OE1 GLU A 70 16.864 -0.098 -16.685 1.00 31.65 O ATOM 658 OE2 GLU A 70 18.450 -0.682 -15.281 1.00 26.31 O ATOM 659 H GLU A 70 18.281 0.456 -13.609 1.00 0.00 H ATOM 660 N LEU A 71 17.462 -0.578 -10.399 1.00 17.38 N ATOM 661 CA LEU A 71 17.455 -0.831 -8.964 1.00 16.69 C ATOM 662 C LEU A 71 17.216 0.459 -8.179 1.00 16.28 C ATOM 663 O LEU A 71 16.469 0.464 -7.190 1.00 16.24 O ATOM 664 CB LEU A 71 18.760 -1.499 -8.539 1.00 17.63 C ATOM 665 CG LEU A 71 18.885 -1.757 -7.037 1.00 18.75 C ATOM 666 CD1 LEU A 71 17.766 -2.654 -6.533 1.00 20.67 C ATOM 667 CD2 LEU A 71 20.246 -2.364 -6.728 1.00 20.61 C ATOM 668 H LEU A 71 18.362 -0.637 -10.917 1.00 0.00 H ATOM 669 N ALA A 72 17.833 1.566 -8.593 1.00 15.49 N ATOM 670 CA ALA A 72 17.557 2.840 -7.935 1.00 14.95 C ATOM 671 C ALA A 72 16.073 3.183 -8.024 1.00 15.82 C ATOM 672 O ALA A 72 15.458 3.605 -7.035 1.00 15.94 O ATOM 673 CB ALA A 72 18.389 3.951 -8.563 1.00 15.59 C ATOM 674 H ALA A 72 18.509 1.522 -9.382 1.00 0.00 H ATOM 675 N ASP A 73 15.476 2.992 -9.206 1.00 16.62 N ATOM 676 CA ASP A 73 14.062 3.299 -9.386 1.00 17.60 C ATOM 677 C ASP A 73 13.195 2.420 -8.493 1.00 17.27 C ATOM 678 O ASP A 73 12.181 2.871 -7.951 1.00 17.58 O ATOM 679 CB ASP A 73 13.638 3.069 -10.845 1.00 20.64 C ATOM 680 CG ASP A 73 14.150 4.122 -11.804 1.00 25.06 C ATOM 681 OD1 ASP A 73 14.488 5.242 -11.370 1.00 25.65 O ATOM 682 OD2 ASP A 73 14.178 3.822 -13.018 1.00 29.55 O ATOM 683 H ASP A 73 16.027 2.620 -10.006 1.00 0.00 H ATOM 684 N GLN A 74 13.566 1.148 -8.353 1.00 17.36 N ATOM 685 CA GLN A 74 12.786 0.224 -7.543 1.00 17.89 C ATOM 686 C GLN A 74 12.808 0.610 -6.071 1.00 16.51 C ATOM 687 O GLN A 74 11.770 0.584 -5.397 1.00 17.62 O ATOM 688 CB GLN A 74 13.324 -1.193 -7.708 1.00 19.61 C ATOM 689 CG GLN A 74 12.575 -2.221 -6.871 1.00 26.25 C ATOM 690 CD GLN A 74 13.172 -3.616 -6.959 1.00 30.63 C ATOM 691 OE1 GLN A 74 12.786 -4.419 -7.811 1.00 33.15 O ATOM 692 NE2 GLN A 74 14.115 -3.914 -6.070 1.00 32.22 N ATOM 693 HE22 GLN A 74 14.411 -3.206 -5.368 1.00 0.00 H ATOM 694 HE21 GLN A 74 14.557 -4.855 -6.076 1.00 0.00 H ATOM 695 H GLN A 74 14.426 0.810 -8.830 1.00 0.00 H ATOM 696 N ILE A 75 13.993 0.922 -5.542 1.00 16.03 N ATOM 697 CA ILE A 75 14.093 1.333 -4.146 1.00 15.60 C ATOM 698 C ILE A 75 13.302 2.612 -3.930 1.00 16.01 C ATOM 699 O ILE A 75 12.536 2.745 -2.966 1.00 16.48 O ATOM 700 CB ILE A 75 15.568 1.497 -3.740 1.00 15.42 C ATOM 701 CG1 ILE A 75 16.285 0.150 -3.791 1.00 16.86 C ATOM 702 CG2 ILE A 75 15.662 2.112 -2.339 1.00 16.09 C ATOM 703 CD1 ILE A 75 17.795 0.240 -3.686 1.00 18.44 C ATOM 704 H ILE A 75 14.850 0.872 -6.129 1.00 0.00 H ATOM 705 N GLN A 76 13.490 3.579 -4.828 1.00 15.25 N ATOM 706 CA GLN A 76 12.776 4.844 -4.735 1.00 15.41 C ATOM 707 C GLN A 76 11.274 4.608 -4.716 1.00 16.19 C ATOM 708 O GLN A 76 10.544 5.171 -3.893 1.00 17.28 O ATOM 709 CB GLN A 76 13.166 5.732 -5.913 1.00 15.34 C ATOM 710 CG GLN A 76 12.514 7.090 -5.882 1.00 15.95 C ATOM 711 CD GLN A 76 12.932 7.917 -7.065 1.00 16.96 C ATOM 712 OE1 GLN A 76 13.542 8.985 -6.928 1.00 19.04 O ATOM 713 NE2 GLN A 76 12.651 7.415 -8.243 1.00 18.31 N ATOM 714 HE22 GLN A 76 12.136 6.514 -8.315 1.00 0.00 H ATOM 715 HE21 GLN A 76 12.943 7.918 -9.105 1.00 0.00 H ATOM 716 H GLN A 76 14.159 3.427 -5.609 1.00 0.00 H ATOM 717 N ASP A 77 10.791 3.750 -5.607 1.00 16.64 N ATOM 718 CA ASP A 77 9.354 3.534 -5.700 1.00 17.36 C ATOM 719 C ASP A 77 8.804 2.847 -4.456 1.00 17.69 C ATOM 720 O ASP A 77 7.671 3.121 -4.044 1.00 18.43 O ATOM 721 CB ASP A 77 9.023 2.713 -6.939 1.00 19.50 C ATOM 722 CG ASP A 77 7.548 2.432 -7.050 1.00 24.06 C ATOM 723 OD1 ASP A 77 6.793 3.382 -7.338 1.00 26.93 O ATOM 724 OD2 ASP A 77 7.143 1.270 -6.832 1.00 25.87 O ATOM 725 H ASP A 77 11.438 3.234 -6.237 1.00 0.00 H ATOM 726 N LYS A 78 9.567 1.927 -3.868 1.00 17.82 N ATOM 727 CA LYS A 78 9.098 1.262 -2.658 1.00 18.72 C ATOM 728 C LYS A 78 9.007 2.234 -1.489 1.00 17.85 C ATOM 729 O LYS A 78 8.034 2.201 -0.723 1.00 19.23 O ATOM 730 CB LYS A 78 10.019 0.095 -2.317 1.00 20.29 C ATOM 731 CG LYS A 78 9.817 -1.121 -3.192 1.00 23.39 C ATOM 732 CD LYS A 78 10.600 -2.329 -2.696 1.00 29.64 C ATOM 733 CE LYS A 78 10.272 -3.585 -3.506 1.00 33.44 C ATOM 734 NZ LYS A 78 8.815 -3.714 -3.824 1.00 36.06 N ATOM 735 HZ1 LYS A 78 8.271 -3.758 -2.939 1.00 0.00 H ATOM 736 HZ2 LYS A 78 8.509 -2.890 -4.380 1.00 0.00 H ATOM 737 HZ3 LYS A 78 8.657 -4.583 -4.373 1.00 0.00 H ATOM 738 H LYS A 78 10.494 1.684 -4.271 1.00 0.00 H ATOM 739 N VAL A 79 10.009 3.099 -1.320 1.00 16.98 N ATOM 740 CA VAL A 79 9.973 4.078 -0.237 1.00 17.28 C ATOM 741 C VAL A 79 8.817 5.052 -0.440 1.00 17.63 C ATOM 742 O VAL A 79 8.055 5.347 0.490 1.00 18.81 O ATOM 743 CB VAL A 79 11.326 4.800 -0.125 1.00 18.39 C ATOM 744 CG1 VAL A 79 11.224 5.959 0.862 1.00 19.35 C ATOM 745 CG2 VAL A 79 12.422 3.825 0.290 1.00 19.06 C ATOM 746 H VAL A 79 10.824 3.076 -1.966 1.00 0.00 H ATOM 747 N VAL A 80 8.671 5.567 -1.661 1.00 17.50 N ATOM 748 CA VAL A 80 7.643 6.561 -1.945 1.00 18.13 C ATOM 749 C VAL A 80 6.253 5.960 -1.775 1.00 19.27 C ATOM 750 O VAL A 80 5.373 6.560 -1.145 1.00 19.66 O ATOM 751 CB VAL A 80 7.876 7.159 -3.342 1.00 20.65 C ATOM 752 CG1 VAL A 80 6.654 7.896 -3.836 1.00 22.19 C ATOM 753 CG2 VAL A 80 9.105 8.065 -3.306 1.00 21.43 C ATOM 754 H VAL A 80 9.303 5.254 -2.426 1.00 0.00 H ATOM 755 N ALA A 81 6.043 4.754 -2.307 1.00 19.55 N ATOM 756 CA ALA A 81 4.729 4.131 -2.214 1.00 20.94 C ATOM 757 C ALA A 81 4.331 3.913 -0.760 1.00 22.23 C ATOM 758 O ALA A 81 3.158 4.064 -0.400 1.00 24.23 O ATOM 759 CB ALA A 81 4.719 2.805 -2.972 1.00 22.11 C ATOM 760 H ALA A 81 6.819 4.258 -2.789 1.00 0.00 H ATOM 761 N LYS A 82 5.294 3.562 0.090 1.00 22.38 N ATOM 762 CA LYS A 82 4.973 3.236 1.473 1.00 23.07 C ATOM 763 C LYS A 82 4.826 4.481 2.342 1.00 23.29 C ATOM 764 O LYS A 82 3.964 4.511 3.230 1.00 25.54 O ATOM 765 CB LYS A 82 6.060 2.326 2.045 1.00 26.45 C ATOM 766 CG LYS A 82 5.571 1.311 3.067 1.00 32.34 C ATOM 767 CD LYS A 82 6.636 0.242 3.329 1.00 36.36 C ATOM 768 CE LYS A 82 6.069 -1.171 3.202 1.00 39.70 C ATOM 769 NZ LYS A 82 5.044 -1.466 4.244 1.00 41.18 N ATOM 770 HZ1 LYS A 82 5.473 -1.374 5.187 1.00 0.00 H ATOM 771 HZ2 LYS A 82 4.256 -0.793 4.154 1.00 0.00 H ATOM 772 HZ3 LYS A 82 4.690 -2.435 4.116 1.00 0.00 H ATOM 773 H LYS A 82 6.281 3.520 -0.235 1.00 0.00 H ATOM 774 N TYR A 83 5.652 5.509 2.126 1.00 21.27 N ATOM 775 CA TYR A 83 5.796 6.575 3.113 1.00 21.04 C ATOM 776 C TYR A 83 5.557 8.000 2.617 1.00 20.23 C ATOM 777 O TYR A 83 5.319 8.871 3.454 1.00 21.80 O ATOM 778 CB TYR A 83 7.191 6.509 3.766 1.00 22.10 C ATOM 779 CG TYR A 83 7.430 5.216 4.516 1.00 21.68 C ATOM 780 CD1 TYR A 83 6.588 4.841 5.550 1.00 23.48 C ATOM 781 CD2 TYR A 83 8.469 4.358 4.180 1.00 23.73 C ATOM 782 CE1 TYR A 83 6.761 3.655 6.228 1.00 24.89 C ATOM 783 CE2 TYR A 83 8.664 3.165 4.872 1.00 25.04 C ATOM 784 CZ TYR A 83 7.800 2.821 5.893 1.00 25.15 C ATOM 785 OH TYR A 83 7.949 1.641 6.597 1.00 27.80 O ATOM 786 HH TYR A 83 7.238 1.575 7.283 1.00 0.00 H ATOM 787 H TYR A 83 6.200 5.550 1.243 1.00 0.00 H ATOM 788 N PHE A 84 5.611 8.279 1.314 1.00 19.88 N ATOM 789 CA PHE A 84 5.643 9.668 0.853 1.00 19.59 C ATOM 790 C PHE A 84 4.391 10.442 1.266 1.00 19.52 C ATOM 791 O PHE A 84 4.468 11.636 1.572 1.00 20.33 O ATOM 792 CB PHE A 84 5.828 9.652 -0.663 1.00 20.09 C ATOM 793 CG PHE A 84 5.911 10.999 -1.317 1.00 21.60 C ATOM 794 CD1 PHE A 84 7.122 11.656 -1.441 1.00 24.91 C ATOM 795 CD2 PHE A 84 4.781 11.578 -1.861 1.00 23.43 C ATOM 796 CE1 PHE A 84 7.196 12.878 -2.086 1.00 26.35 C ATOM 797 CE2 PHE A 84 4.851 12.796 -2.507 1.00 25.73 C ATOM 798 CZ PHE A 84 6.058 13.444 -2.616 1.00 26.32 C ATOM 799 H PHE A 84 5.631 7.504 0.620 1.00 0.00 H ATOM 800 N ASP A 85 3.225 9.793 1.263 1.00 22.23 N ATOM 801 CA ASP A 85 1.997 10.518 1.580 1.00 25.35 C ATOM 802 C ASP A 85 1.858 10.787 3.078 1.00 25.28 C ATOM 803 O ASP A 85 1.156 11.724 3.480 1.00 28.68 O ATOM 804 CB ASP A 85 0.780 9.728 1.094 1.00 28.00 C ATOM 805 CG ASP A 85 0.653 9.686 -0.426 1.00 30.96 C ATOM 806 OD1 ASP A 85 1.270 10.522 -1.119 1.00 35.28 O ATOM 807 OD2 ASP A 85 -0.098 8.813 -0.930 1.00 33.54 O ATOM 808 H ASP A 85 3.191 8.779 1.037 1.00 0.00 H ATOM 809 N ASP A 86 2.490 9.968 3.918 1.00 24.31 N ATOM 810 CA ASP A 86 2.295 10.046 5.358 1.00 23.98 C ATOM 811 C ASP A 86 3.459 10.675 6.107 1.00 22.42 C ATOM 812 O ASP A 86 3.310 10.981 7.298 1.00 23.42 O ATOM 813 CB ASP A 86 2.031 8.648 5.935 1.00 27.02 C ATOM 814 CG ASP A 86 0.728 8.063 5.453 1.00 31.64 C ATOM 815 OD1 ASP A 86 -0.275 8.803 5.430 1.00 32.84 O ATOM 816 OD2 ASP A 86 0.712 6.872 5.078 1.00 33.89 O ATOM 817 H ASP A 86 3.141 9.253 3.534 1.00 0.00 H ATOM 818 N TYR A 87 4.594 10.894 5.443 1.00 20.12 N ATOM 819 CA TYR A 87 5.815 11.377 6.075 1.00 18.30 C ATOM 820 C TYR A 87 6.505 12.354 5.134 1.00 17.14 C ATOM 821 O TYR A 87 6.483 12.169 3.914 1.00 18.24 O ATOM 822 CB TYR A 87 6.790 10.219 6.388 1.00 18.56 C ATOM 823 CG TYR A 87 6.251 9.216 7.394 1.00 19.09 C ATOM 824 CD1 TYR A 87 5.447 8.168 6.994 1.00 20.54 C ATOM 825 CD2 TYR A 87 6.533 9.331 8.748 1.00 20.07 C ATOM 826 CE1 TYR A 87 4.941 7.261 7.907 1.00 22.13 C ATOM 827 CE2 TYR A 87 6.033 8.434 9.663 1.00 22.59 C ATOM 828 CZ TYR A 87 5.233 7.400 9.245 1.00 23.48 C ATOM 829 OH TYR A 87 4.724 6.492 10.157 1.00 26.63 O ATOM 830 HH TYR A 87 4.164 6.970 10.819 1.00 0.00 H ATOM 831 H TYR A 87 4.609 10.710 4.419 1.00 0.00 H ATOM 832 N SER A 88 7.121 13.383 5.705 1.00 16.64 N ATOM 833 CA SER A 88 7.968 14.279 4.927 1.00 16.23 C ATOM 834 C SER A 88 9.064 13.462 4.248 1.00 15.76 C ATOM 835 O SER A 88 9.643 12.558 4.854 1.00 16.83 O ATOM 836 CB SER A 88 8.594 15.317 5.864 1.00 16.78 C ATOM 837 OG SER A 88 7.603 16.051 6.566 1.00 18.48 O ATOM 838 HG SER A 88 7.023 16.524 5.918 1.00 0.00 H ATOM 839 H SER A 88 6.997 13.552 6.724 1.00 0.00 H ATOM 840 N CYS A 89 9.328 13.761 2.973 1.00 15.41 N ATOM 841 CA CYS A 89 10.202 12.924 2.159 1.00 15.72 C ATOM 842 C CYS A 89 10.432 13.580 0.814 1.00 15.65 C ATOM 843 O CYS A 89 9.472 14.029 0.175 1.00 16.87 O ATOM 844 CB CYS A 89 9.507 11.584 1.915 1.00 18.03 C ATOM 845 SG CYS A 89 10.453 10.369 1.027 1.00 20.49 S ATOM 846 H CYS A 89 8.900 14.610 2.551 1.00 0.00 H ATOM 847 N ILE A 90 11.695 13.626 0.383 1.00 14.83 N ATOM 848 CA ILE A 90 12.047 14.044 -0.968 1.00 13.88 C ATOM 849 C ILE A 90 13.146 13.120 -1.472 1.00 13.14 C ATOM 850 O ILE A 90 13.945 12.595 -0.694 1.00 13.34 O ATOM 851 CB ILE A 90 12.458 15.527 -1.033 1.00 14.65 C ATOM 852 CG1 ILE A 90 12.420 16.011 -2.480 1.00 16.23 C ATOM 853 CG2 ILE A 90 13.816 15.752 -0.435 1.00 13.82 C ATOM 854 CD1 ILE A 90 12.409 17.514 -2.601 1.00 17.09 C ATOM 855 H ILE A 90 12.457 13.353 1.036 1.00 0.00 H ATOM 856 N THR A 91 13.184 12.918 -2.787 1.00 13.20 N ATOM 857 CA THR A 91 14.092 11.930 -3.356 1.00 12.91 C ATOM 858 C THR A 91 14.550 12.354 -4.744 1.00 12.83 C ATOM 859 O THR A 91 13.781 12.934 -5.519 1.00 13.85 O ATOM 860 CB THR A 91 13.426 10.544 -3.373 1.00 13.93 C ATOM 861 OG1 THR A 91 14.312 9.590 -3.953 1.00 14.66 O ATOM 862 CG2 THR A 91 12.124 10.551 -4.156 1.00 16.26 C ATOM 863 HG1 THR A 91 15.145 9.547 -3.419 1.00 0.00 H ATOM 864 H THR A 91 12.562 13.469 -3.413 1.00 0.00 H ATOM 865 N TYR A 92 15.813 12.053 -5.050 1.00 12.39 N ATOM 866 CA TYR A 92 16.355 12.389 -6.357 1.00 12.26 C ATOM 867 C TYR A 92 17.433 11.390 -6.735 1.00 12.00 C ATOM 868 O TYR A 92 17.967 10.675 -5.883 1.00 12.57 O ATOM 869 CB TYR A 92 16.856 13.828 -6.409 1.00 13.32 C ATOM 870 CG TYR A 92 17.938 14.206 -5.399 1.00 14.59 C ATOM 871 CD1 TYR A 92 19.278 13.972 -5.664 1.00 15.47 C ATOM 872 CD2 TYR A 92 17.627 14.855 -4.211 1.00 17.12 C ATOM 873 CE1 TYR A 92 20.275 14.360 -4.790 1.00 17.21 C ATOM 874 CE2 TYR A 92 18.637 15.248 -3.307 1.00 17.80 C ATOM 875 CZ TYR A 92 19.957 14.982 -3.609 1.00 18.52 C ATOM 876 OH TYR A 92 20.955 15.355 -2.738 1.00 21.78 O ATOM 877 HH TYR A 92 20.932 16.337 -2.613 1.00 0.00 H ATOM 878 H TYR A 92 16.414 11.575 -4.349 1.00 0.00 H ATOM 879 N ILE A 93 17.737 11.350 -8.032 1.00 11.89 N ATOM 880 CA ILE A 93 18.712 10.420 -8.585 1.00 12.04 C ATOM 881 C ILE A 93 19.694 11.178 -9.468 1.00 12.61 C ATOM 882 O ILE A 93 19.315 12.089 -10.214 1.00 13.38 O ATOM 883 CB ILE A 93 18.011 9.303 -9.388 1.00 12.99 C ATOM 884 CG1 ILE A 93 17.201 8.406 -8.453 1.00 14.31 C ATOM 885 CG2 ILE A 93 19.011 8.495 -10.229 1.00 15.19 C ATOM 886 CD1 ILE A 93 16.289 7.423 -9.161 1.00 16.33 C ATOM 887 H ILE A 93 17.258 12.011 -8.676 1.00 0.00 H ATOM 888 N SER A 94 20.953 10.775 -9.419 1.00 13.72 N ATOM 889 CA SER A 94 21.936 11.239 -10.393 1.00 15.84 C ATOM 890 C SER A 94 22.918 10.115 -10.650 1.00 14.49 C ATOM 891 O SER A 94 22.769 9.017 -10.126 1.00 16.12 O ATOM 892 CB SER A 94 22.644 12.487 -9.903 1.00 19.13 C ATOM 893 OG SER A 94 23.320 12.193 -8.703 1.00 22.40 O ATOM 894 HG SER A 94 22.667 11.892 -8.023 1.00 0.00 H ATOM 895 H SER A 94 21.248 10.115 -8.672 1.00 0.00 H ATOM 896 N THR A 95 23.898 10.373 -11.513 1.00 16.07 N ATOM 897 CA THR A 95 24.920 9.389 -11.812 1.00 15.42 C ATOM 898 C THR A 95 26.285 9.876 -11.345 1.00 14.34 C ATOM 899 O THR A 95 26.582 11.080 -11.338 1.00 16.49 O ATOM 900 CB THR A 95 24.943 9.057 -13.306 1.00 20.37 C ATOM 901 OG1 THR A 95 25.133 10.261 -14.059 1.00 25.13 O ATOM 902 CG2 THR A 95 23.653 8.382 -13.717 1.00 22.08 C ATOM 903 HG1 THR A 95 24.390 10.887 -13.871 1.00 0.00 H ATOM 904 H THR A 95 23.931 11.300 -11.983 1.00 0.00 H ATOM 905 N VAL A 96 27.110 8.917 -10.953 1.00 13.09 N ATOM 906 CA VAL A 96 28.480 9.159 -10.526 1.00 12.32 C ATOM 907 C VAL A 96 29.349 8.033 -11.069 1.00 12.61 C ATOM 908 O VAL A 96 28.853 7.008 -11.547 1.00 14.15 O ATOM 909 CB VAL A 96 28.605 9.254 -8.984 1.00 13.77 C ATOM 910 CG1 VAL A 96 27.710 10.363 -8.427 1.00 15.22 C ATOM 911 CG2 VAL A 96 28.287 7.941 -8.312 1.00 14.93 C ATOM 912 H VAL A 96 26.760 7.938 -10.950 1.00 0.00 H ATOM 913 N GLU A 97 30.668 8.220 -10.973 1.00 12.52 N ATOM 914 CA GLU A 97 31.642 7.235 -11.438 1.00 13.55 C ATOM 915 C GLU A 97 32.293 6.551 -10.240 1.00 12.56 C ATOM 916 O GLU A 97 33.055 7.183 -9.499 1.00 13.59 O ATOM 917 CB GLU A 97 32.708 7.922 -12.290 1.00 17.00 C ATOM 918 CG GLU A 97 33.785 7.007 -12.809 1.00 19.65 C ATOM 919 CD GLU A 97 34.826 7.736 -13.629 1.00 22.79 C ATOM 920 OE1 GLU A 97 34.519 8.792 -14.218 1.00 24.03 O ATOM 921 OE2 GLU A 97 35.987 7.275 -13.652 1.00 26.14 O ATOM 922 H GLU A 97 31.016 9.104 -10.550 1.00 0.00 H ATOM 923 N ALA A 98 31.986 5.268 -10.044 1.00 14.34 N ATOM 924 CA ALA A 98 32.604 4.472 -9.004 1.00 16.52 C ATOM 925 C ALA A 98 33.907 3.877 -9.530 1.00 18.58 C ATOM 926 O ALA A 98 34.139 3.796 -10.742 1.00 21.73 O ATOM 927 CB ALA A 98 31.654 3.361 -8.560 1.00 20.77 C ATOM 928 H ALA A 98 31.277 4.823 -10.661 1.00 0.00 H ATOM 929 N LEU A 99 34.763 3.481 -8.605 1.00 21.72 N ATOM 930 CA LEU A 99 36.040 2.893 -8.949 1.00 24.94 C ATOM 931 C LEU A 99 35.858 1.385 -9.086 1.00 27.91 C ATOM 932 O LEU A 99 35.370 0.717 -8.162 1.00 29.35 O ATOM 933 CB LEU A 99 37.041 3.224 -7.848 1.00 26.73 C ATOM 934 CG LEU A 99 38.513 2.933 -8.100 1.00 27.23 C ATOM 935 CD1 LEU A 99 39.031 3.710 -9.281 1.00 28.42 C ATOM 936 CD2 LEU A 99 39.268 3.289 -6.829 1.00 27.48 C ATOM 937 H LEU A 99 34.512 3.595 -7.602 1.00 0.00 H TER 938 LEU A 99 ATOM 939 N SER B 1 30.252 33.767 -12.835 1.00 37.53 N ATOM 940 CA SER B 1 30.766 32.891 -13.928 1.00 34.79 C ATOM 941 C SER B 1 31.115 31.545 -13.346 1.00 30.07 C ATOM 942 O SER B 1 31.258 31.410 -12.134 1.00 31.81 O ATOM 943 CB SER B 1 31.979 33.522 -14.587 1.00 36.30 C ATOM 944 OG SER B 1 31.669 34.847 -14.958 1.00 39.89 O ATOM 945 HG SER B 1 32.459 35.261 -15.388 1.00 0.00 H ATOM 946 HN3 SER B 1 30.986 33.876 -12.106 1.00 0.00 H ATOM 947 HN2 SER B 1 29.405 33.334 -12.414 1.00 0.00 H ATOM 948 HN1 SER B 1 30.008 34.699 -13.226 1.00 0.00 H ATOM 949 N SER B 2 31.137 30.533 -14.196 1.00 28.66 N ATOM 950 CA SER B 2 31.263 29.116 -13.808 1.00 27.47 C ATOM 951 C SER B 2 32.638 28.527 -14.099 1.00 22.71 C ATOM 952 O SER B 2 33.378 29.034 -14.928 1.00 26.63 O ATOM 953 CB SER B 2 30.233 28.356 -14.562 1.00 31.94 C ATOM 954 OG SER B 2 30.613 28.320 -15.931 1.00 34.37 O ATOM 955 HG SER B 2 31.493 27.874 -16.016 1.00 0.00 H ATOM 956 H SER B 2 31.060 30.752 -15.210 1.00 0.00 H ATOM 957 N GLN B 3 32.950 27.466 -13.362 1.00 30.00 N ATOM 958 CA GLN B 3 34.150 26.666 -13.668 1.00 30.00 C ATOM 959 C GLN B 3 33.804 25.209 -13.370 1.00 30.00 C ATOM 960 O GLN B 3 33.321 24.935 -12.261 1.00 30.00 O ATOM 961 CB GLN B 3 35.353 27.076 -12.834 1.00 30.00 C ATOM 962 CG GLN B 3 36.583 26.240 -13.130 1.00 30.00 C ATOM 963 CD GLN B 3 37.835 26.833 -12.541 1.00 30.00 C ATOM 964 OE1 GLN B 3 38.043 28.029 -12.598 1.00 30.00 O ATOM 965 NE2 GLN B 3 38.674 25.992 -11.962 1.00 30.00 N ATOM 966 HE22 GLN B 3 38.456 24.975 -11.936 1.00 0.00 H ATOM 967 HE21 GLN B 3 39.552 26.347 -11.532 1.00 0.00 H ATOM 968 H GLN B 3 32.342 27.198 -12.562 1.00 0.00 H ATOM 969 N GLN B 4 34.034 24.312 -14.315 1.00 16.07 N ATOM 970 CA GLN B 4 33.769 22.877 -14.084 1.00 16.16 C ATOM 971 C GLN B 4 34.861 22.326 -13.173 1.00 14.81 C ATOM 972 O GLN B 4 36.039 22.561 -13.406 1.00 17.79 O ATOM 973 CB GLN B 4 33.756 22.117 -15.399 1.00 21.90 C ATOM 974 CG GLN B 4 33.348 20.654 -15.264 1.00 25.10 C ATOM 975 CD GLN B 4 32.681 20.187 -16.527 1.00 32.23 C ATOM 976 OE1 GLN B 4 33.322 20.017 -17.541 1.00 33.78 O ATOM 977 NE2 GLN B 4 31.404 19.957 -16.464 1.00 34.70 N ATOM 978 HE22 GLN B 4 30.890 20.116 -15.574 1.00 0.00 H ATOM 979 HE21 GLN B 4 30.895 19.614 -17.304 1.00 0.00 H ATOM 980 H GLN B 4 34.407 24.622 -15.235 1.00 0.00 H ATOM 981 N VAL B 5 34.436 21.682 -12.089 1.00 13.95 N ATOM 982 CA VAL B 5 35.355 21.035 -11.169 1.00 14.18 C ATOM 983 C VAL B 5 34.876 19.612 -10.938 1.00 13.97 C ATOM 984 O VAL B 5 33.762 19.227 -11.307 1.00 15.25 O ATOM 985 CB VAL B 5 35.546 21.814 -9.856 1.00 16.24 C ATOM 986 CG1 VAL B 5 36.040 23.229 -10.140 1.00 17.68 C ATOM 987 CG2 VAL B 5 34.266 21.868 -9.076 1.00 16.85 C ATOM 988 H VAL B 5 33.415 21.641 -11.895 1.00 0.00 H ATOM 989 N TRP B 6 35.753 18.823 -10.342 1.00 13.82 N ATOM 990 CA TRP B 6 35.447 17.448 -10.004 1.00 13.53 C ATOM 991 C TRP B 6 35.217 17.349 -8.502 1.00 13.05 C ATOM 992 O TRP B 6 35.851 18.055 -7.717 1.00 14.71 O ATOM 993 CB TRP B 6 36.583 16.533 -10.461 1.00 14.95 C ATOM 994 CG TRP B 6 36.563 16.350 -11.932 1.00 16.02 C ATOM 995 CD1 TRP B 6 36.051 15.287 -12.614 1.00 17.66 C ATOM 996 CD2 TRP B 6 37.012 17.282 -12.924 1.00 17.08 C ATOM 997 NE1 TRP B 6 36.175 15.484 -13.964 1.00 18.43 N ATOM 998 CE2 TRP B 6 36.746 16.709 -14.186 1.00 18.28 C ATOM 999 CE3 TRP B 6 37.613 18.544 -12.874 1.00 17.39 C ATOM 1000 CZ2 TRP B 6 37.086 17.346 -15.383 1.00 20.93 C ATOM 1001 CZ3 TRP B 6 37.923 19.180 -14.056 1.00 19.17 C ATOM 1002 CH2 TRP B 6 37.661 18.581 -15.287 1.00 21.08 C ATOM 1003 HE1 TRP B 6 35.883 14.812 -14.702 1.00 0.00 H ATOM 1004 H TRP B 6 36.693 19.201 -10.108 1.00 0.00 H ATOM 1005 N LYS B 7 34.274 16.501 -8.111 1.00 13.03 N ATOM 1006 CA LYS B 7 33.951 16.247 -6.715 1.00 12.55 C ATOM 1007 C LYS B 7 34.259 14.781 -6.438 1.00 12.16 C ATOM 1008 O LYS B 7 33.620 13.886 -7.006 1.00 13.48 O ATOM 1009 CB LYS B 7 32.489 16.562 -6.426 1.00 13.15 C ATOM 1010 CG LYS B 7 32.120 16.324 -4.969 1.00 15.26 C ATOM 1011 CD LYS B 7 30.813 16.999 -4.588 1.00 18.32 C ATOM 1012 CE LYS B 7 29.641 16.399 -5.328 1.00 21.17 C ATOM 1013 NZ LYS B 7 29.359 15.009 -4.885 1.00 23.96 N ATOM 1014 HZ1 LYS B 7 30.194 14.415 -5.060 1.00 0.00 H ATOM 1015 HZ2 LYS B 7 29.138 15.008 -3.869 1.00 0.00 H ATOM 1016 HZ3 LYS B 7 28.548 14.635 -5.417 1.00 0.00 H ATOM 1017 H LYS B 7 33.737 15.991 -8.841 1.00 0.00 H ATOM 1018 N LEU B 8 35.258 14.547 -5.587 1.00 11.79 N ATOM 1019 CA LEU B 8 35.614 13.221 -5.106 1.00 11.33 C ATOM 1020 C LEU B 8 34.957 13.004 -3.752 1.00 11.58 C ATOM 1021 O LEU B 8 35.119 13.822 -2.835 1.00 12.50 O ATOM 1022 CB LEU B 8 37.132 13.131 -4.957 1.00 12.80 C ATOM 1023 CG LEU B 8 37.685 11.909 -4.213 1.00 13.53 C ATOM 1024 CD1 LEU B 8 37.377 10.610 -4.935 1.00 13.81 C ATOM 1025 CD2 LEU B 8 39.172 12.059 -3.979 1.00 14.53 C ATOM 1026 H LEU B 8 35.814 15.358 -5.248 1.00 0.00 H ATOM 1027 N VAL B 9 34.238 11.898 -3.614 1.00 11.21 N ATOM 1028 CA VAL B 9 33.662 11.486 -2.343 1.00 11.36 C ATOM 1029 C VAL B 9 34.391 10.237 -1.870 1.00 11.63 C ATOM 1030 O VAL B 9 34.625 9.293 -2.645 1.00 12.31 O ATOM 1031 CB VAL B 9 32.148 11.243 -2.475 1.00 12.11 C ATOM 1032 CG1 VAL B 9 31.595 10.605 -1.203 1.00 13.03 C ATOM 1033 CG2 VAL B 9 31.439 12.545 -2.775 1.00 13.64 C ATOM 1034 H VAL B 9 34.079 11.300 -4.450 1.00 0.00 H ATOM 1035 N ILE B 10 34.730 10.227 -0.578 1.00 11.91 N ATOM 1036 CA ILE B 10 35.315 9.079 0.108 1.00 12.42 C ATOM 1037 C ILE B 10 34.479 8.838 1.349 1.00 12.72 C ATOM 1038 O ILE B 10 34.381 9.727 2.200 1.00 13.76 O ATOM 1039 CB ILE B 10 36.772 9.339 0.516 1.00 15.05 C ATOM 1040 CG1 ILE B 10 37.640 9.667 -0.698 1.00 17.35 C ATOM 1041 CG2 ILE B 10 37.326 8.148 1.312 1.00 17.56 C ATOM 1042 CD1 ILE B 10 38.901 10.407 -0.314 1.00 21.97 C ATOM 1043 H ILE B 10 34.567 11.093 -0.025 1.00 0.00 H ATOM 1044 N ILE B 11 33.880 7.658 1.468 1.00 12.64 N ATOM 1045 CA ILE B 11 33.129 7.268 2.663 1.00 13.35 C ATOM 1046 C ILE B 11 33.889 6.119 3.296 1.00 14.36 C ATOM 1047 O ILE B 11 34.122 5.099 2.644 1.00 15.37 O ATOM 1048 CB ILE B 11 31.685 6.878 2.316 1.00 13.83 C ATOM 1049 CG1 ILE B 11 30.935 8.106 1.769 1.00 14.56 C ATOM 1050 CG2 ILE B 11 30.966 6.302 3.541 1.00 15.05 C ATOM 1051 CD1 ILE B 11 29.733 7.760 0.908 1.00 15.58 C ATOM 1052 H ILE B 11 33.947 6.983 0.680 1.00 0.00 H ATOM 1053 N THR B 12 34.325 6.294 4.540 1.00 14.39 N ATOM 1054 CA THR B 12 35.214 5.319 5.160 1.00 15.14 C ATOM 1055 C THR B 12 35.009 5.282 6.666 1.00 15.90 C ATOM 1056 O THR B 12 34.226 6.040 7.228 1.00 16.17 O ATOM 1057 CB THR B 12 36.668 5.592 4.749 1.00 16.60 C ATOM 1058 OG1 THR B 12 37.506 4.497 5.127 1.00 18.53 O ATOM 1059 CG2 THR B 12 37.208 6.875 5.352 1.00 17.56 C ATOM 1060 HG1 THR B 12 37.192 3.673 4.678 1.00 0.00 H ATOM 1061 H THR B 12 34.029 7.135 5.076 1.00 0.00 H ATOM 1062 N GLU B 13 35.703 4.352 7.316 1.00 17.00 N ATOM 1063 CA GLU B 13 35.593 4.208 8.762 1.00 17.69 C ATOM 1064 C GLU B 13 35.954 5.507 9.469 1.00 18.79 C ATOM 1065 O GLU B 13 36.910 6.199 9.105 1.00 19.27 O ATOM 1066 CB GLU B 13 36.525 3.098 9.243 1.00 18.23 C ATOM 1067 CG GLU B 13 36.257 1.760 8.600 1.00 17.91 C ATOM 1068 CD GLU B 13 37.024 0.610 9.255 1.00 17.64 C ATOM 1069 OE1 GLU B 13 37.394 0.708 10.452 1.00 19.61 O ATOM 1070 OE2 GLU B 13 37.248 -0.392 8.555 1.00 18.57 O ATOM 1071 H GLU B 13 36.333 3.718 6.784 1.00 0.00 H ATOM 1072 N GLU B 14 35.186 5.830 10.510 1.00 20.35 N ATOM 1073 CA GLU B 14 35.411 7.083 11.222 1.00 20.98 C ATOM 1074 C GLU B 14 36.828 7.166 11.783 1.00 21.73 C ATOM 1075 O GLU B 14 37.372 8.267 11.931 1.00 23.98 O ATOM 1076 CB GLU B 14 34.368 7.234 12.329 1.00 23.29 C ATOM 1077 CG GLU B 14 34.446 8.543 13.101 1.00 26.91 C ATOM 1078 CD GLU B 14 35.438 8.503 14.255 1.00 29.36 C ATOM 1079 OE1 GLU B 14 35.806 7.396 14.706 1.00 29.93 O ATOM 1080 OE2 GLU B 14 35.849 9.590 14.712 1.00 32.05 O ATOM 1081 H GLU B 14 34.426 5.188 10.814 1.00 0.00 H ATOM 1082 N ILE B 15 37.449 6.021 12.077 1.00 23.89 N ATOM 1083 CA ILE B 15 38.781 6.032 12.666 1.00 26.66 C ATOM 1084 C ILE B 15 39.841 6.580 11.717 1.00 26.23 C ATOM 1085 O ILE B 15 40.933 6.943 12.165 1.00 27.08 O ATOM 1086 CB ILE B 15 39.164 4.627 13.170 1.00 30.13 C ATOM 1087 CG1 ILE B 15 38.158 4.146 14.219 1.00 32.12 C ATOM 1088 CG2 ILE B 15 40.572 4.632 13.746 1.00 31.58 C ATOM 1089 CD1 ILE B 15 38.335 2.698 14.633 1.00 32.80 C ATOM 1090 H ILE B 15 36.978 5.114 11.884 1.00 0.00 H ATOM 1091 N LEU B 16 39.558 6.659 10.421 1.00 23.60 N ATOM 1092 CA LEU B 16 40.537 7.139 9.449 1.00 22.84 C ATOM 1093 C LEU B 16 40.464 8.647 9.217 1.00 23.04 C ATOM 1094 O LEU B 16 41.101 9.148 8.286 1.00 22.84 O ATOM 1095 CB LEU B 16 40.378 6.409 8.113 1.00 21.72 C ATOM 1096 CG LEU B 16 40.754 4.925 8.108 1.00 22.33 C ATOM 1097 CD1 LEU B 16 40.530 4.322 6.723 1.00 22.79 C ATOM 1098 CD2 LEU B 16 42.195 4.698 8.557 1.00 23.86 C ATOM 1099 H LEU B 16 38.615 6.372 10.090 1.00 0.00 H ATOM 1100 N LEU B 17 39.708 9.376 10.036 1.00 22.99 N ATOM 1101 CA LEU B 17 39.508 10.801 9.799 1.00 23.12 C ATOM 1102 C LEU B 17 40.825 11.554 9.606 1.00 22.78 C ATOM 1103 O LEU B 17 41.006 12.266 8.610 1.00 22.82 O ATOM 1104 CB LEU B 17 38.694 11.395 10.949 1.00 24.83 C ATOM 1105 CG LEU B 17 38.516 12.904 10.992 1.00 25.19 C ATOM 1106 CD1 LEU B 17 37.752 13.358 9.767 1.00 24.86 C ATOM 1107 CD2 LEU B 17 37.793 13.324 12.254 1.00 27.45 C ATOM 1108 H LEU B 17 39.254 8.923 10.855 1.00 0.00 H ATOM 1109 N LYS B 18 41.753 11.435 10.548 1.00 26.05 N ATOM 1110 CA LYS B 18 42.967 12.237 10.442 1.00 28.12 C ATOM 1111 C LYS B 18 43.892 11.733 9.333 1.00 26.98 C ATOM 1112 O LYS B 18 44.523 12.528 8.628 1.00 27.87 O ATOM 1113 CB LYS B 18 43.699 12.232 11.777 1.00 34.06 C ATOM 1114 CG LYS B 18 44.784 13.291 11.890 1.00 39.88 C ATOM 1115 CD LYS B 18 45.818 12.954 12.962 1.00 45.68 C ATOM 1116 CE LYS B 18 45.208 12.093 14.043 1.00 49.14 C ATOM 1117 NZ LYS B 18 46.226 11.568 14.998 1.00 51.54 N ATOM 1118 HZ1 LYS B 18 46.919 10.990 14.481 1.00 0.00 H ATOM 1119 HZ2 LYS B 18 46.711 12.365 15.458 1.00 0.00 H ATOM 1120 HZ3 LYS B 18 45.755 10.984 15.719 1.00 0.00 H ATOM 1121 H LYS B 18 41.617 10.782 11.346 1.00 0.00 H ATOM 1122 N LYS B 19 43.992 10.417 9.154 1.00 25.94 N ATOM 1123 CA LYS B 19 44.890 9.889 8.131 1.00 26.18 C ATOM 1124 C LYS B 19 44.452 10.295 6.728 1.00 24.76 C ATOM 1125 O LYS B 19 45.297 10.605 5.881 1.00 25.33 O ATOM 1126 CB LYS B 19 44.980 8.366 8.224 1.00 27.70 C ATOM 1127 CG LYS B 19 45.812 7.882 9.421 1.00 30.21 C ATOM 1128 CD LYS B 19 45.197 8.342 10.739 1.00 33.14 C ATOM 1129 CE LYS B 19 43.749 7.873 10.845 1.00 34.28 C ATOM 1130 NZ LYS B 19 42.861 8.743 11.672 1.00 31.46 N ATOM 1131 HZ1 LYS B 19 43.231 8.790 12.643 1.00 0.00 H ATOM 1132 HZ2 LYS B 19 42.835 9.699 11.263 1.00 0.00 H ATOM 1133 HZ3 LYS B 19 41.901 8.344 11.684 1.00 0.00 H ATOM 1134 H LYS B 19 43.432 9.767 9.742 1.00 0.00 H ATOM 1135 N VAL B 20 43.148 10.259 6.440 1.00 22.49 N ATOM 1136 CA VAL B 20 42.690 10.605 5.094 1.00 21.29 C ATOM 1137 C VAL B 20 42.755 12.111 4.877 1.00 21.60 C ATOM 1138 O VAL B 20 43.081 12.581 3.779 1.00 21.95 O ATOM 1139 CB VAL B 20 41.290 10.021 4.826 1.00 21.06 C ATOM 1140 CG1 VAL B 20 40.694 10.563 3.514 1.00 20.71 C ATOM 1141 CG2 VAL B 20 41.361 8.497 4.794 1.00 22.37 C ATOM 1142 H VAL B 20 42.460 9.986 7.171 1.00 0.00 H ATOM 1143 N SER B 21 42.455 12.894 5.917 1.00 22.59 N ATOM 1144 CA SER B 21 42.597 14.342 5.802 1.00 23.76 C ATOM 1145 C SER B 21 44.017 14.719 5.389 1.00 24.59 C ATOM 1146 O SER B 21 44.220 15.631 4.583 1.00 25.04 O ATOM 1147 CB SER B 21 42.219 15.009 7.127 1.00 25.19 C ATOM 1148 OG SER B 21 40.891 14.685 7.520 1.00 25.67 O ATOM 1149 HG SER B 21 40.683 15.133 8.378 1.00 0.00 H ATOM 1150 H SER B 21 42.121 12.472 6.807 1.00 0.00 H ATOM 1151 N LYS B 22 45.017 14.017 5.930 1.00 26.17 N ATOM 1152 CA LYS B 22 46.410 14.316 5.605 1.00 27.47 C ATOM 1153 C LYS B 22 46.735 13.999 4.148 1.00 26.70 C ATOM 1154 O LYS B 22 47.450 14.766 3.490 1.00 28.00 O ATOM 1155 CB LYS B 22 47.311 13.521 6.541 1.00 29.97 C ATOM 1156 CG LYS B 22 48.784 13.635 6.294 1.00 33.68 C ATOM 1157 CD LYS B 22 49.506 12.954 7.448 1.00 37.71 C ATOM 1158 CE LYS B 22 50.928 12.597 7.092 1.00 40.75 C ATOM 1159 NZ LYS B 22 50.999 11.554 6.032 1.00 41.65 N ATOM 1160 HZ1 LYS B 22 50.523 10.691 6.364 1.00 0.00 H ATOM 1161 HZ2 LYS B 22 50.528 11.902 5.172 1.00 0.00 H ATOM 1162 HZ3 LYS B 22 51.995 11.342 5.822 1.00 0.00 H ATOM 1163 H LYS B 22 44.800 13.246 6.593 1.00 0.00 H ATOM 1164 N ILE B 23 46.235 12.874 3.627 1.00 24.31 N ATOM 1165 CA ILE B 23 46.450 12.554 2.216 1.00 23.64 C ATOM 1166 C ILE B 23 45.878 13.650 1.332 1.00 22.97 C ATOM 1167 O ILE B 23 46.516 14.087 0.364 1.00 23.75 O ATOM 1168 CB ILE B 23 45.838 11.186 1.870 1.00 23.43 C ATOM 1169 CG1 ILE B 23 46.639 10.062 2.526 1.00 25.05 C ATOM 1170 CG2 ILE B 23 45.772 11.012 0.350 1.00 24.27 C ATOM 1171 CD1 ILE B 23 45.996 8.700 2.403 1.00 26.89 C ATOM 1172 H ILE B 23 45.690 12.223 4.228 1.00 0.00 H ATOM 1173 N ILE B 24 44.667 14.100 1.627 1.00 21.81 N ATOM 1174 CA ILE B 24 43.996 15.129 0.795 1.00 21.32 C ATOM 1175 C ILE B 24 44.834 16.406 0.767 1.00 22.86 C ATOM 1176 O ILE B 24 45.091 16.937 -0.299 1.00 24.11 O ATOM 1177 CB ILE B 24 42.576 15.382 1.333 1.00 20.63 C ATOM 1178 CG1 ILE B 24 41.713 14.127 1.207 1.00 19.52 C ATOM 1179 CG2 ILE B 24 41.976 16.594 0.654 1.00 21.16 C ATOM 1180 CD1 ILE B 24 40.429 14.171 1.999 1.00 19.72 C ATOM 1181 H ILE B 24 44.175 13.723 2.462 1.00 0.00 H ATOM 1182 N LYS B 25 45.262 16.843 1.950 1.00 30.00 N ATOM 1183 CA LYS B 25 46.046 18.095 2.037 1.00 30.00 C ATOM 1184 C LYS B 25 47.430 17.904 1.403 1.00 30.00 C ATOM 1185 O LYS B 25 47.791 18.766 0.631 1.00 30.00 O ATOM 1186 CB LYS B 25 46.120 18.547 3.493 1.00 30.00 C ATOM 1187 CG LYS B 25 44.839 19.141 4.059 1.00 30.00 C ATOM 1188 CD LYS B 25 44.772 19.055 5.580 1.00 30.00 C ATOM 1189 CE LYS B 25 45.623 20.034 6.334 1.00 30.00 C ATOM 1190 NZ LYS B 25 45.251 20.014 7.759 1.00 30.00 N ATOM 1191 HZ1 LYS B 25 44.250 20.276 7.858 1.00 0.00 H ATOM 1192 HZ2 LYS B 25 45.400 19.058 8.142 1.00 0.00 H ATOM 1193 HZ3 LYS B 25 45.842 20.693 8.280 1.00 0.00 H ATOM 1194 H LYS B 25 45.045 16.304 2.813 1.00 0.00 H ATOM 1195 N GLU B 26 48.137 16.767 1.665 1.00 27.53 N ATOM 1196 CA GLU B 26 49.495 16.492 1.119 1.00 29.48 C ATOM 1197 C GLU B 26 49.456 16.412 -0.411 1.00 29.30 C ATOM 1198 O GLU B 26 50.457 16.825 -1.029 1.00 30.86 O ATOM 1199 CB GLU B 26 50.074 15.196 1.691 1.00 31.82 C ATOM 1200 CG GLU B 26 51.555 15.016 1.405 1.00 34.30 C ATOM 1201 CD GLU B 26 52.236 13.951 2.247 1.00 36.11 C ATOM 1202 OE1 GLU B 26 51.564 13.370 3.122 1.00 35.45 O ATOM 1203 OE2 GLU B 26 53.439 13.707 2.027 1.00 37.88 O ATOM 1204 H GLU B 26 47.703 16.051 2.282 1.00 0.00 H ATOM 1205 N ALA B 27 48.309 16.066 -1.009 1.00 28.86 N ATOM 1206 CA ALA B 27 48.210 15.969 -2.455 1.00 29.71 C ATOM 1207 C ALA B 27 48.032 17.324 -3.126 1.00 29.78 C ATOM 1208 O ALA B 27 48.169 17.408 -4.352 1.00 31.81 O ATOM 1209 CB ALA B 27 47.053 15.055 -2.837 1.00 30.51 C ATOM 1210 H ALA B 27 47.472 15.863 -0.426 1.00 0.00 H ATOM 1211 N GLY B 28 47.726 18.376 -2.372 1.00 28.64 N ATOM 1212 CA GLY B 28 47.580 19.699 -2.937 1.00 28.20 C ATOM 1213 C GLY B 28 46.155 20.144 -3.165 1.00 25.96 C ATOM 1214 O GLY B 28 45.940 21.136 -3.874 1.00 26.47 O ATOM 1215 H GLY B 28 47.588 18.244 -1.350 1.00 0.00 H ATOM 1216 N ALA B 29 45.177 19.449 -2.600 1.00 23.34 N ATOM 1217 CA ALA B 29 43.814 19.933 -2.705 1.00 20.86 C ATOM 1218 C ALA B 29 43.710 21.289 -2.022 1.00 19.66 C ATOM 1219 O ALA B 29 44.424 21.582 -1.059 1.00 21.51 O ATOM 1220 CB ALA B 29 42.853 18.961 -2.031 1.00 21.11 C ATOM 1221 H ALA B 29 45.385 18.568 -2.088 1.00 0.00 H ATOM 1222 N SER B 30 42.778 22.114 -2.493 1.00 17.89 N ATOM 1223 CA SER B 30 42.578 23.426 -1.890 1.00 18.67 C ATOM 1224 C SER B 30 41.792 23.347 -0.590 1.00 18.32 C ATOM 1225 O SER B 30 41.762 24.323 0.163 1.00 18.91 O ATOM 1226 CB SER B 30 41.882 24.358 -2.884 1.00 19.89 C ATOM 1227 OG SER B 30 40.590 23.894 -3.177 1.00 18.78 O ATOM 1228 HG SER B 30 40.158 24.510 -3.820 1.00 0.00 H ATOM 1229 H SER B 30 42.188 21.820 -3.297 1.00 0.00 H ATOM 1230 N GLY B 31 41.177 22.204 -0.310 1.00 16.71 N ATOM 1231 CA GLY B 31 40.376 22.038 0.878 1.00 15.69 C ATOM 1232 C GLY B 31 39.667 20.698 0.836 1.00 14.94 C ATOM 1233 O GLY B 31 39.869 19.897 -0.074 1.00 15.29 O ATOM 1234 H GLY B 31 41.276 21.404 -0.967 1.00 0.00 H ATOM 1235 N TYR B 32 38.812 20.493 1.832 1.00 14.21 N ATOM 1236 CA TYR B 32 37.961 19.316 1.931 1.00 13.40 C ATOM 1237 C TYR B 32 36.825 19.657 2.889 1.00 13.02 C ATOM 1238 O TYR B 32 36.954 20.528 3.754 1.00 13.54 O ATOM 1239 CB TYR B 32 38.723 18.049 2.413 1.00 14.75 C ATOM 1240 CG TYR B 32 39.197 18.163 3.838 1.00 14.84 C ATOM 1241 CD1 TYR B 32 38.395 17.761 4.904 1.00 15.22 C ATOM 1242 CD2 TYR B 32 40.427 18.746 4.127 1.00 16.90 C ATOM 1243 CE1 TYR B 32 38.801 17.940 6.219 1.00 16.50 C ATOM 1244 CE2 TYR B 32 40.839 18.932 5.440 1.00 17.45 C ATOM 1245 CZ TYR B 32 40.030 18.518 6.484 1.00 18.04 C ATOM 1246 OH TYR B 32 40.420 18.695 7.804 1.00 19.17 O ATOM 1247 HH TYR B 32 40.550 19.660 7.982 1.00 0.00 H ATOM 1248 H TYR B 32 38.747 21.212 2.581 1.00 0.00 H ATOM 1249 N THR B 33 35.733 18.920 2.752 1.00 12.91 N ATOM 1250 CA THR B 33 34.613 18.943 3.680 1.00 12.71 C ATOM 1251 C THR B 33 34.404 17.521 4.186 1.00 13.09 C ATOM 1252 O THR B 33 34.568 16.557 3.427 1.00 14.17 O ATOM 1253 CB THR B 33 33.363 19.484 2.977 1.00 12.68 C ATOM 1254 OG1 THR B 33 33.628 20.818 2.543 1.00 13.07 O ATOM 1255 CG2 THR B 33 32.145 19.517 3.890 1.00 14.13 C ATOM 1256 HG1 THR B 33 32.828 21.180 2.086 1.00 0.00 H ATOM 1257 H THR B 33 35.673 18.286 1.930 1.00 0.00 H ATOM 1258 N VAL B 34 34.078 17.375 5.463 1.00 12.81 N ATOM 1259 CA VAL B 34 33.856 16.061 6.060 1.00 13.23 C ATOM 1260 C VAL B 34 32.611 16.111 6.933 1.00 13.40 C ATOM 1261 O VAL B 34 32.343 17.111 7.613 1.00 14.45 O ATOM 1262 CB VAL B 34 35.126 15.555 6.789 1.00 14.87 C ATOM 1263 CG1 VAL B 34 35.465 16.422 7.990 1.00 16.24 C ATOM 1264 CG2 VAL B 34 34.997 14.091 7.175 1.00 16.02 C ATOM 1265 H VAL B 34 33.977 18.222 6.058 1.00 0.00 H ATOM 1266 N LEU B 35 31.838 15.028 6.890 1.00 12.98 N ATOM 1267 CA LEU B 35 30.595 14.886 7.629 1.00 13.40 C ATOM 1268 C LEU B 35 30.579 13.545 8.346 1.00 13.39 C ATOM 1269 O LEU B 35 31.126 12.554 7.867 1.00 14.47 O ATOM 1270 CB LEU B 35 29.378 14.951 6.707 1.00 14.26 C ATOM 1271 CG LEU B 35 29.291 16.194 5.817 1.00 14.37 C ATOM 1272 CD1 LEU B 35 29.870 15.960 4.425 1.00 16.18 C ATOM 1273 CD2 LEU B 35 27.861 16.716 5.697 1.00 15.67 C ATOM 1274 H LEU B 35 32.143 14.235 6.290 1.00 0.00 H ATOM 1275 N ALA B 36 29.961 13.515 9.525 1.00 13.99 N ATOM 1276 CA ALA B 36 29.703 12.246 10.192 1.00 14.80 C ATOM 1277 C ALA B 36 28.637 11.462 9.447 1.00 13.92 C ATOM 1278 O ALA B 36 27.649 12.027 8.972 1.00 15.70 O ATOM 1279 CB ALA B 36 29.232 12.487 11.624 1.00 16.83 C ATOM 1280 H ALA B 36 29.660 14.404 9.973 1.00 0.00 H ATOM 1281 N ALA B 37 28.818 10.150 9.369 1.00 14.56 N ATOM 1282 CA ALA B 37 27.893 9.313 8.628 1.00 14.29 C ATOM 1283 C ALA B 37 27.855 7.930 9.259 1.00 14.75 C ATOM 1284 O ALA B 37 28.639 7.593 10.145 1.00 15.86 O ATOM 1285 CB ALA B 37 28.278 9.208 7.154 1.00 15.40 C ATOM 1286 H ALA B 37 29.634 9.716 9.845 1.00 0.00 H ATOM 1287 N ALA B 38 26.928 7.119 8.782 1.00 15.34 N ATOM 1288 CA ALA B 38 26.848 5.715 9.151 1.00 15.79 C ATOM 1289 C ALA B 38 26.479 4.939 7.893 1.00 14.60 C ATOM 1290 O ALA B 38 26.059 5.524 6.889 1.00 15.23 O ATOM 1291 CB ALA B 38 25.824 5.478 10.270 1.00 17.83 C ATOM 1292 H ALA B 38 26.227 7.500 8.115 1.00 0.00 H ATOM 1293 N GLY B 39 26.630 3.626 7.919 1.00 15.23 N ATOM 1294 CA GLY B 39 26.263 2.874 6.740 1.00 15.09 C ATOM 1295 C GLY B 39 26.520 1.395 6.893 1.00 14.71 C ATOM 1296 O GLY B 39 27.014 0.916 7.922 1.00 15.98 O ATOM 1297 H GLY B 39 27.002 3.147 8.764 1.00 0.00 H ATOM 1298 N GLU B 40 26.144 0.670 5.843 1.00 14.64 N ATOM 1299 CA GLU B 40 26.482 -0.733 5.674 1.00 15.28 C ATOM 1300 C GLU B 40 26.925 -0.959 4.236 1.00 15.65 C ATOM 1301 O GLU B 40 26.515 -0.233 3.321 1.00 15.67 O ATOM 1302 CB GLU B 40 25.291 -1.642 6.009 1.00 17.64 C ATOM 1303 CG GLU B 40 24.759 -1.451 7.438 1.00 19.03 C ATOM 1304 CD GLU B 40 23.574 -2.344 7.762 1.00 20.83 C ATOM 1305 OE1 GLU B 40 23.741 -3.577 7.754 1.00 24.68 O ATOM 1306 OE2 GLU B 40 22.478 -1.820 8.038 1.00 21.56 O ATOM 1307 H GLU B 40 25.578 1.132 5.103 1.00 0.00 H ATOM 1308 N GLY B 41 27.769 -1.976 4.044 1.00 16.25 N ATOM 1309 CA GLY B 41 28.292 -2.346 2.743 1.00 17.20 C ATOM 1310 C GLY B 41 28.513 -3.846 2.659 1.00 17.71 C ATOM 1311 O GLY B 41 28.276 -4.591 3.616 1.00 19.07 O ATOM 1312 H GLY B 41 28.067 -2.532 4.871 1.00 0.00 H ATOM 1313 N SER B 42 28.980 -4.283 1.485 1.00 19.07 N ATOM 1314 CA SER B 42 29.070 -5.696 1.173 1.00 20.33 C ATOM 1315 C SER B 42 30.488 -6.256 1.091 1.00 20.86 C ATOM 1316 O SER B 42 30.630 -7.471 0.940 1.00 23.18 O ATOM 1317 CB SER B 42 28.339 -5.971 -0.150 1.00 23.12 C ATOM 1318 OG SER B 42 26.945 -5.771 -0.023 1.00 24.26 O ATOM 1319 HG SER B 42 26.770 -4.834 0.243 1.00 0.00 H ATOM 1320 H SER B 42 29.288 -3.589 0.774 1.00 0.00 H ATOM 1321 N ARG B 43 31.541 -5.438 1.183 1.00 21.10 N ATOM 1322 CA ARG B 43 32.890 -5.992 1.057 1.00 21.68 C ATOM 1323 C ARG B 43 33.319 -6.745 2.311 1.00 22.43 C ATOM 1324 O ARG B 43 34.183 -7.637 2.245 1.00 23.71 O ATOM 1325 CB ARG B 43 33.904 -4.890 0.778 1.00 20.70 C ATOM 1326 CG ARG B 43 33.742 -4.194 -0.527 1.00 21.42 C ATOM 1327 CD ARG B 43 35.025 -3.536 -0.927 1.00 22.20 C ATOM 1328 NE ARG B 43 35.434 -2.428 -0.071 1.00 20.43 N ATOM 1329 CZ ARG B 43 36.608 -2.338 0.546 1.00 19.28 C ATOM 1330 NH1 ARG B 43 37.502 -3.314 0.470 1.00 19.46 N ATOM 1331 NH2 ARG B 43 36.887 -1.249 1.241 1.00 18.86 N ATOM 1332 HE ARG B 43 34.757 -1.651 0.067 1.00 0.00 H ATOM 1333 HH12 ARG B 43 38.414 -3.223 0.961 1.00 0.00 H ATOM 1334 HH11 ARG B 43 37.291 -4.171 -0.080 1.00 0.00 H ATOM 1335 HH22 ARG B 43 37.801 -1.164 1.729 1.00 0.00 H ATOM 1336 HH21 ARG B 43 36.192 -0.477 1.300 1.00 0.00 H ATOM 1337 H ARG B 43 31.403 -4.420 1.342 1.00 0.00 H ATOM 1338 N ASN B 44 32.758 -6.363 3.457 1.00 21.07 N ATOM 1339 CA ASN B 44 32.966 -7.021 4.744 1.00 21.94 C ATOM 1340 C ASN B 44 34.438 -7.044 5.145 1.00 21.58 C ATOM 1341 O ASN B 44 35.029 -8.094 5.420 1.00 24.99 O ATOM 1342 CB ASN B 44 32.323 -8.407 4.769 1.00 24.45 C ATOM 1343 CG ASN B 44 30.839 -8.354 4.475 1.00 26.02 C ATOM 1344 OD1 ASN B 44 30.195 -7.310 4.655 1.00 25.07 O ATOM 1345 ND2 ASN B 44 30.281 -9.470 4.032 1.00 28.96 N ATOM 1346 HD22 ASN B 44 30.861 -10.323 3.896 1.00 0.00 H ATOM 1347 HD21 ASN B 44 29.263 -9.494 3.820 1.00 0.00 H ATOM 1348 H ASN B 44 32.127 -5.537 3.434 1.00 0.00 H ATOM 1349 N VAL B 45 35.012 -5.843 5.214 1.00 19.63 N ATOM 1350 CA VAL B 45 36.413 -5.680 5.567 1.00 19.22 C ATOM 1351 C VAL B 45 36.623 -4.795 6.792 1.00 19.36 C ATOM 1352 O VAL B 45 37.765 -4.495 7.134 1.00 21.65 O ATOM 1353 CB VAL B 45 37.242 -5.149 4.380 1.00 19.85 C ATOM 1354 CG1 VAL B 45 37.205 -6.103 3.189 1.00 21.79 C ATOM 1355 CG2 VAL B 45 36.753 -3.749 3.993 1.00 20.22 C ATOM 1356 H VAL B 45 34.441 -4.998 5.009 1.00 0.00 H ATOM 1357 N ARG B 46 35.554 -4.379 7.479 1.00 18.56 N ATOM 1358 CA ARG B 46 35.687 -3.376 8.538 1.00 17.77 C ATOM 1359 C ARG B 46 36.744 -3.770 9.575 1.00 17.87 C ATOM 1360 O ARG B 46 36.741 -4.891 10.101 1.00 19.99 O ATOM 1361 CB ARG B 46 34.346 -3.173 9.247 1.00 18.86 C ATOM 1362 CG ARG B 46 34.408 -2.097 10.328 1.00 18.67 C ATOM 1363 CD ARG B 46 33.075 -1.475 10.644 1.00 19.20 C ATOM 1364 NE ARG B 46 32.488 -0.793 9.493 1.00 17.51 N ATOM 1365 CZ ARG B 46 32.451 0.527 9.314 1.00 16.03 C ATOM 1366 NH1 ARG B 46 32.989 1.362 10.202 1.00 17.42 N ATOM 1367 NH2 ARG B 46 31.863 1.014 8.219 1.00 16.85 N ATOM 1368 HE ARG B 46 32.064 -1.387 8.752 1.00 0.00 H ATOM 1369 HH12 ARG B 46 32.948 2.389 10.041 1.00 0.00 H ATOM 1370 HH11 ARG B 46 33.450 0.987 11.056 1.00 0.00 H ATOM 1371 HH22 ARG B 46 31.825 2.041 8.063 1.00 0.00 H ATOM 1372 HH21 ARG B 46 31.443 0.366 7.522 1.00 0.00 H ATOM 1373 H ARG B 46 34.617 -4.772 7.259 1.00 0.00 H ATOM 1374 N SER B 47 37.618 -2.825 9.919 1.00 18.75 N ATOM 1375 CA SER B 47 38.785 -3.158 10.732 1.00 19.17 C ATOM 1376 C SER B 47 38.381 -3.557 12.142 1.00 20.17 C ATOM 1377 O SER B 47 39.075 -4.359 12.766 1.00 22.95 O ATOM 1378 CB SER B 47 39.858 -2.055 10.666 1.00 20.42 C ATOM 1379 OG SER B 47 39.413 -0.908 11.451 1.00 20.34 O ATOM 1380 HG SER B 47 38.561 -0.567 11.081 1.00 0.00 H ATOM 1381 H SER B 47 37.468 -1.844 9.607 1.00 0.00 H ATOM 1382 N THR B 48 37.258 -3.059 12.630 1.00 20.42 N ATOM 1383 CA THR B 48 36.775 -3.349 13.966 1.00 21.14 C ATOM 1384 C THR B 48 35.747 -4.481 13.985 1.00 22.20 C ATOM 1385 O THR B 48 35.164 -4.756 15.043 1.00 24.25 O ATOM 1386 CB THR B 48 36.175 -2.070 14.555 1.00 22.51 C ATOM 1387 OG1 THR B 48 35.185 -1.542 13.653 1.00 22.11 O ATOM 1388 CG2 THR B 48 37.269 -1.005 14.759 1.00 25.70 C ATOM 1389 HG1 THR B 48 35.609 -1.337 12.782 1.00 0.00 H ATOM 1390 H THR B 48 36.693 -2.428 12.026 1.00 0.00 H ATOM 1391 N GLY B 49 35.492 -5.112 12.837 1.00 21.41 N ATOM 1392 CA GLY B 49 34.616 -6.258 12.730 1.00 22.85 C ATOM 1393 C GLY B 49 33.172 -5.878 12.465 1.00 23.31 C ATOM 1394 O GLY B 49 32.781 -4.707 12.500 1.00 26.49 O ATOM 1395 H GLY B 49 35.948 -4.760 11.971 1.00 0.00 H ATOM 1396 N GLU B 50 32.370 -6.897 12.148 1.00 20.86 N ATOM 1397 CA GLU B 50 30.908 -6.811 12.028 1.00 23.32 C ATOM 1398 C GLU B 50 30.212 -8.002 12.694 1.00 20.73 C ATOM 1399 O GLU B 50 30.718 -9.132 12.610 1.00 31.15 O ATOM 1400 CB GLU B 50 30.476 -6.806 10.547 1.00 24.03 C ATOM 1401 CG GLU B 50 31.112 -5.754 9.636 1.00 24.71 C ATOM 1402 CD GLU B 50 30.502 -5.722 8.223 1.00 25.02 C ATOM 1403 OE1 GLU B 50 29.388 -6.242 7.998 1.00 27.46 O ATOM 1404 OE2 GLU B 50 31.164 -5.165 7.318 1.00 19.93 O ATOM 1405 H GLU B 50 32.813 -7.821 11.973 1.00 0.00 H ATOM 1406 N PRO B 51 29.054 -7.806 13.333 1.00 25.09 N ATOM 1407 CA PRO B 51 28.325 -8.938 13.924 1.00 26.86 C ATOM 1408 C PRO B 51 27.427 -9.627 12.900 1.00 28.15 C ATOM 1409 O PRO B 51 27.197 -9.143 11.791 1.00 29.53 O ATOM 1410 CB PRO B 51 27.486 -8.264 15.012 1.00 27.07 C ATOM 1411 CG PRO B 51 27.148 -6.897 14.364 1.00 25.95 C ATOM 1412 CD PRO B 51 28.422 -6.510 13.660 1.00 25.94 C ATOM 1413 N SER B 52 26.898 -10.784 13.312 1.00 29.32 N ATOM 1414 CA SER B 52 26.057 -11.588 12.432 1.00 32.44 C ATOM 1415 C SER B 52 24.796 -10.839 12.030 1.00 31.94 C ATOM 1416 O SER B 52 24.378 -10.885 10.865 1.00 34.90 O ATOM 1417 CB SER B 52 25.708 -12.903 13.128 1.00 35.17 C ATOM 1418 OG SER B 52 24.808 -12.667 14.201 1.00 37.89 O ATOM 1419 HG SER B 52 24.590 -13.526 14.643 1.00 0.00 H ATOM 1420 H SER B 52 27.090 -11.117 14.278 1.00 0.00 H ATOM 1421 N VAL B 53 24.173 -10.157 12.986 1.00 30.14 N ATOM 1422 CA VAL B 53 22.987 -9.352 12.723 1.00 27.73 C ATOM 1423 C VAL B 53 23.492 -7.930 12.500 1.00 26.93 C ATOM 1424 O VAL B 53 23.876 -7.239 13.443 1.00 23.66 O ATOM 1425 CB VAL B 53 21.981 -9.454 13.870 1.00 29.22 C ATOM 1426 CG1 VAL B 53 20.738 -8.654 13.554 1.00 30.62 C ATOM 1427 CG2 VAL B 53 21.630 -10.913 14.104 1.00 30.90 C ATOM 1428 H VAL B 53 24.545 -10.199 13.956 1.00 0.00 H ATOM 1429 N SER B 54 23.551 -7.515 11.236 1.00 28.03 N ATOM 1430 CA SER B 54 24.171 -6.246 10.883 1.00 29.67 C ATOM 1431 C SER B 54 23.331 -5.065 11.361 1.00 27.23 C ATOM 1432 O SER B 54 22.119 -5.160 11.597 1.00 29.50 O ATOM 1433 CB SER B 54 24.400 -6.169 9.363 1.00 34.26 C ATOM 1434 OG SER B 54 25.289 -5.134 8.936 1.00 36.64 O ATOM 1435 HG SER B 54 25.375 -5.161 7.950 1.00 0.00 H ATOM 1436 H SER B 54 23.146 -8.110 10.485 1.00 0.00 H ATOM 1437 N HIS B 55 24.021 -3.944 11.519 1.00 24.16 N ATOM 1438 CA HIS B 55 23.440 -2.660 11.875 1.00 21.66 C ATOM 1439 C HIS B 55 24.336 -1.598 11.253 1.00 20.26 C ATOM 1440 O HIS B 55 25.410 -1.906 10.745 1.00 21.24 O ATOM 1441 CB HIS B 55 23.397 -2.511 13.390 1.00 23.87 C ATOM 1442 CG HIS B 55 24.736 -2.625 14.043 1.00 25.73 C ATOM 1443 ND1 HIS B 55 25.636 -1.582 14.090 1.00 26.42 N ATOM 1444 CD2 HIS B 55 25.325 -3.659 14.687 1.00 27.13 C ATOM 1445 CE1 HIS B 55 26.716 -1.964 14.751 1.00 27.64 C ATOM 1446 NE2 HIS B 55 26.554 -3.223 15.121 1.00 28.08 N ATOM 1447 H HIS B 55 25.051 -3.986 11.378 1.00 0.00 H ATOM 1448 N ALA B 56 23.899 -0.339 11.265 1.00 19.49 N ATOM 1449 CA ALA B 56 24.727 0.699 10.643 1.00 18.37 C ATOM 1450 C ALA B 56 26.007 0.917 11.450 1.00 17.64 C ATOM 1451 O ALA B 56 25.970 0.895 12.681 1.00 20.03 O ATOM 1452 CB ALA B 56 23.939 2.001 10.520 1.00 21.19 C ATOM 1453 H ALA B 56 22.989 -0.098 11.707 1.00 0.00 H ATOM 1454 N TYR B 57 27.143 1.108 10.761 1.00 15.96 N ATOM 1455 CA TYR B 57 28.466 1.305 11.352 1.00 16.12 C ATOM 1456 C TYR B 57 28.929 2.749 11.190 1.00 16.48 C ATOM 1457 O TYR B 57 28.485 3.464 10.292 1.00 18.85 O ATOM 1458 CB TYR B 57 29.504 0.355 10.736 1.00 17.28 C ATOM 1459 CG TYR B 57 29.028 -1.099 10.785 1.00 19.33 C ATOM 1460 CD1 TYR B 57 29.015 -1.833 11.965 1.00 22.93 C ATOM 1461 CD2 TYR B 57 28.529 -1.707 9.650 1.00 20.01 C ATOM 1462 CE1 TYR B 57 28.537 -3.159 11.980 1.00 24.62 C ATOM 1463 CE2 TYR B 57 28.046 -2.990 9.645 1.00 22.41 C ATOM 1464 CZ TYR B 57 28.044 -3.713 10.809 1.00 23.43 C ATOM 1465 OH TYR B 57 27.558 -5.000 10.815 1.00 26.75 O ATOM 1466 HH TYR B 57 26.609 -4.994 10.533 1.00 0.00 H ATOM 1467 H TYR B 57 27.077 1.117 9.723 1.00 0.00 H ATOM 1468 N SER B 58 29.844 3.163 12.057 1.00 17.91 N ATOM 1469 CA SER B 58 30.253 4.560 12.118 1.00 17.72 C ATOM 1470 C SER B 58 31.267 4.894 11.034 1.00 16.27 C ATOM 1471 O SER B 58 32.319 4.249 10.930 1.00 18.34 O ATOM 1472 CB SER B 58 30.859 4.869 13.485 1.00 19.72 C ATOM 1473 OG SER B 58 29.883 4.836 14.508 1.00 22.86 O ATOM 1474 HG SER B 58 30.311 5.040 15.377 1.00 0.00 H ATOM 1475 H SER B 58 30.278 2.476 12.706 1.00 0.00 H ATOM 1476 N ASN B 59 30.969 5.946 10.268 1.00 15.20 N ATOM 1477 CA ASN B 59 31.774 6.374 9.138 1.00 14.87 C ATOM 1478 C ASN B 59 31.990 7.883 9.154 1.00 14.43 C ATOM 1479 O ASN B 59 31.403 8.628 9.943 1.00 14.92 O ATOM 1480 CB ASN B 59 31.070 6.024 7.818 1.00 15.92 C ATOM 1481 CG ASN B 59 30.953 4.542 7.590 1.00 15.69 C ATOM 1482 OD1 ASN B 59 31.770 3.764 8.073 1.00 18.08 O ATOM 1483 ND2 ASN B 59 29.956 4.137 6.826 1.00 15.95 N ATOM 1484 HD22 ASN B 59 29.285 4.829 6.436 1.00 0.00 H ATOM 1485 HD21 ASN B 59 29.841 3.125 6.614 1.00 0.00 H ATOM 1486 H ASN B 59 30.112 6.490 10.493 1.00 0.00 H ATOM 1487 N ILE B 60 32.815 8.330 8.215 1.00 15.13 N ATOM 1488 CA ILE B 60 32.879 9.725 7.815 1.00 14.59 C ATOM 1489 C ILE B 60 32.760 9.781 6.297 1.00 14.17 C ATOM 1490 O ILE B 60 33.122 8.834 5.586 1.00 14.77 O ATOM 1491 CB ILE B 60 34.174 10.397 8.301 1.00 17.15 C ATOM 1492 CG1 ILE B 60 35.356 9.516 7.873 1.00 21.85 C ATOM 1493 CG2 ILE B 60 34.105 10.591 9.812 1.00 17.62 C ATOM 1494 CD1 ILE B 60 36.689 9.890 8.387 1.00 23.21 C ATOM 1495 H ILE B 60 33.445 7.650 7.744 1.00 0.00 H ATOM 1496 N LYS B 61 32.219 10.901 5.808 1.00 13.58 N ATOM 1497 CA LYS B 61 32.081 11.172 4.382 1.00 12.68 C ATOM 1498 C LYS B 61 32.892 12.420 4.072 1.00 12.51 C ATOM 1499 O LYS B 61 32.599 13.496 4.597 1.00 13.94 O ATOM 1500 CB LYS B 61 30.615 11.397 3.996 1.00 13.51 C ATOM 1501 CG LYS B 61 30.445 11.864 2.561 1.00 13.59 C ATOM 1502 CD LYS B 61 28.995 12.097 2.166 1.00 15.48 C ATOM 1503 CE LYS B 61 28.908 12.725 0.798 1.00 16.83 C ATOM 1504 NZ LYS B 61 27.510 13.041 0.403 1.00 18.76 N ATOM 1505 HZ1 LYS B 61 26.948 12.166 0.390 1.00 0.00 H ATOM 1506 HZ2 LYS B 61 27.100 13.707 1.088 1.00 0.00 H ATOM 1507 HZ3 LYS B 61 27.507 13.470 -0.544 1.00 0.00 H ATOM 1508 H LYS B 61 31.878 11.617 6.480 1.00 0.00 H ATOM 1509 N PHE B 62 33.903 12.278 3.210 1.00 12.47 N ATOM 1510 CA PHE B 62 34.650 13.408 2.686 1.00 12.84 C ATOM 1511 C PHE B 62 34.109 13.782 1.318 1.00 12.90 C ATOM 1512 O PHE B 62 33.772 12.908 0.504 1.00 13.13 O ATOM 1513 CB PHE B 62 36.112 13.050 2.446 1.00 14.00 C ATOM 1514 CG PHE B 62 36.911 12.814 3.693 1.00 15.03 C ATOM 1515 CD1 PHE B 62 37.020 11.542 4.237 1.00 16.35 C ATOM 1516 CD2 PHE B 62 37.621 13.849 4.281 1.00 16.30 C ATOM 1517 CE1 PHE B 62 37.801 11.305 5.356 1.00 17.82 C ATOM 1518 CE2 PHE B 62 38.401 13.623 5.411 1.00 17.80 C ATOM 1519 CZ PHE B 62 38.490 12.345 5.939 1.00 18.08 C ATOM 1520 H PHE B 62 34.166 11.320 2.902 1.00 0.00 H ATOM 1521 N GLU B 63 34.135 15.082 1.039 1.00 12.73 N ATOM 1522 CA GLU B 63 33.916 15.644 -0.286 1.00 12.46 C ATOM 1523 C GLU B 63 35.106 16.542 -0.598 1.00 12.55 C ATOM 1524 O GLU B 63 35.421 17.433 0.209 1.00 13.49 O ATOM 1525 CB GLU B 63 32.650 16.489 -0.300 1.00 15.94 C ATOM 1526 CG GLU B 63 31.384 15.724 -0.005 1.00 18.07 C ATOM 1527 CD GLU B 63 30.139 16.525 -0.381 1.00 23.02 C ATOM 1528 OE1 GLU B 63 30.276 17.742 -0.625 1.00 25.48 O ATOM 1529 OE2 GLU B 63 29.035 15.949 -0.447 1.00 27.05 O ATOM 1530 H GLU B 63 34.325 15.742 1.820 1.00 0.00 H ATOM 1531 N VAL B 64 35.757 16.321 -1.731 1.00 12.13 N ATOM 1532 CA VAL B 64 36.924 17.091 -2.135 1.00 12.47 C ATOM 1533 C VAL B 64 36.687 17.618 -3.543 1.00 12.36 C ATOM 1534 O VAL B 64 36.550 16.829 -4.487 1.00 13.09 O ATOM 1535 CB VAL B 64 38.207 16.245 -2.103 1.00 13.92 C ATOM 1536 CG1 VAL B 64 39.420 17.121 -2.410 1.00 15.29 C ATOM 1537 CG2 VAL B 64 38.354 15.519 -0.778 1.00 15.37 C ATOM 1538 H VAL B 64 35.419 15.564 -2.359 1.00 0.00 H ATOM 1539 N LEU B 65 36.664 18.938 -3.692 1.00 12.63 N ATOM 1540 CA LEU B 65 36.542 19.567 -5.001 1.00 13.04 C ATOM 1541 C LEU B 65 37.936 19.798 -5.551 1.00 13.11 C ATOM 1542 O LEU B 65 38.806 20.327 -4.846 1.00 14.69 O ATOM 1543 CB LEU B 65 35.807 20.900 -4.902 1.00 14.12 C ATOM 1544 CG LEU B 65 34.399 20.851 -4.337 1.00 16.22 C ATOM 1545 CD1 LEU B 65 33.861 22.253 -4.160 1.00 21.09 C ATOM 1546 CD2 LEU B 65 33.490 20.039 -5.214 1.00 16.34 C ATOM 1547 H LEU B 65 36.735 19.541 -2.848 1.00 0.00 H ATOM 1548 N THR B 66 38.143 19.443 -6.822 1.00 13.84 N ATOM 1549 CA THR B 66 39.436 19.592 -7.481 1.00 14.50 C ATOM 1550 C THR B 66 39.271 20.268 -8.837 1.00 15.30 C ATOM 1551 O THR B 66 38.279 20.070 -9.538 1.00 16.04 O ATOM 1552 CB THR B 66 40.148 18.248 -7.657 1.00 15.76 C ATOM 1553 OG1 THR B 66 39.413 17.410 -8.552 1.00 16.57 O ATOM 1554 CG2 THR B 66 40.297 17.513 -6.340 1.00 15.91 C ATOM 1555 HG1 THR B 66 39.339 17.855 -9.433 1.00 0.00 H ATOM 1556 H THR B 66 37.350 19.044 -7.364 1.00 0.00 H ATOM 1557 N ALA B 67 40.272 21.057 -9.209 1.00 16.69 N ATOM 1558 CA ALA B 67 40.221 21.780 -10.474 1.00 17.80 C ATOM 1559 C ALA B 67 40.510 20.896 -11.677 1.00 17.62 C ATOM 1560 O ALA B 67 40.300 21.335 -12.814 1.00 19.67 O ATOM 1561 CB ALA B 67 41.211 22.942 -10.449 1.00 21.53 C ATOM 1562 H ALA B 67 41.102 21.160 -8.591 1.00 0.00 H ATOM 1563 N SER B 68 41.009 19.685 -11.469 1.00 18.14 N ATOM 1564 CA SER B 68 41.281 18.745 -12.542 1.00 18.43 C ATOM 1565 C SER B 68 40.804 17.357 -12.136 1.00 17.85 C ATOM 1566 O SER B 68 40.772 17.006 -10.947 1.00 17.78 O ATOM 1567 CB SER B 68 42.777 18.678 -12.853 1.00 20.26 C ATOM 1568 OG SER B 68 43.492 18.116 -11.755 1.00 20.01 O ATOM 1569 HG SER B 68 43.355 18.678 -10.951 1.00 0.00 H ATOM 1570 H SER B 68 41.215 19.395 -10.492 1.00 0.00 H ATOM 1571 N ARG B 69 40.473 16.552 -13.151 1.00 19.15 N ATOM 1572 CA ARG B 69 40.170 15.150 -12.893 1.00 19.27 C ATOM 1573 C ARG B 69 41.405 14.425 -12.382 1.00 18.67 C ATOM 1574 O ARG B 69 41.312 13.542 -11.521 1.00 19.25 O ATOM 1575 CB ARG B 69 39.665 14.486 -14.175 1.00 21.36 C ATOM 1576 CG ARG B 69 39.440 12.997 -14.044 1.00 23.59 C ATOM 1577 CD ARG B 69 38.443 12.700 -12.973 1.00 25.04 C ATOM 1578 NE ARG B 69 38.306 11.269 -12.723 1.00 28.35 N ATOM 1579 CZ ARG B 69 37.323 10.516 -13.197 1.00 30.22 C ATOM 1580 NH1 ARG B 69 36.394 11.073 -13.960 1.00 30.11 N ATOM 1581 NH2 ARG B 69 37.265 9.218 -12.903 1.00 32.45 N ATOM 1582 HE ARG B 69 39.028 10.809 -12.133 1.00 0.00 H ATOM 1583 HH12 ARG B 69 35.617 10.495 -14.339 1.00 0.00 H ATOM 1584 HH11 ARG B 69 36.442 12.088 -14.180 1.00 0.00 H ATOM 1585 HH22 ARG B 69 36.491 8.634 -13.279 1.00 0.00 H ATOM 1586 HH21 ARG B 69 37.994 8.789 -12.298 1.00 0.00 H ATOM 1587 H ARG B 69 40.432 16.925 -14.121 1.00 0.00 H ATOM 1588 N GLU B 70 42.561 14.833 -12.912 1.00 18.50 N ATOM 1589 CA GLU B 70 43.899 14.274 -12.586 1.00 19.52 C ATOM 1590 C GLU B 70 44.122 14.290 -11.070 1.00 18.02 C ATOM 1591 O GLU B 70 44.568 13.256 -10.537 1.00 18.34 O ATOM 1592 CB GLU B 70 44.993 15.071 -13.299 1.00 22.64 C ATOM 1593 CG GLU B 70 45.123 14.734 -14.774 1.00 25.20 C ATOM 1594 CD GLU B 70 44.003 15.276 -15.645 1.00 27.34 C ATOM 1595 OE1 GLU B 70 43.711 14.654 -16.685 1.00 31.65 O ATOM 1596 OE2 GLU B 70 43.424 16.319 -15.281 1.00 26.31 O ATOM 1597 H GLU B 70 42.522 15.604 -13.609 1.00 0.00 H ATOM 1598 N LEU B 71 43.828 15.412 -10.399 1.00 17.38 N ATOM 1599 CA LEU B 71 44.050 15.532 -8.964 1.00 16.69 C ATOM 1600 C LEU B 71 43.052 14.680 -8.179 1.00 16.28 C ATOM 1601 O LEU B 71 43.422 14.031 -7.190 1.00 16.24 O ATOM 1602 CB LEU B 71 43.976 16.996 -8.539 1.00 17.63 C ATOM 1603 CG LEU B 71 44.137 17.233 -7.037 1.00 18.75 C ATOM 1604 CD1 LEU B 71 45.473 16.713 -6.533 1.00 20.67 C ATOM 1605 CD2 LEU B 71 43.982 18.716 -6.728 1.00 20.61 C ATOM 1606 H LEU B 71 43.430 16.221 -10.918 1.00 0.00 H ATOM 1607 N ALA B 72 41.785 14.661 -8.593 1.00 15.49 N ATOM 1608 CA ALA B 72 40.820 13.785 -7.935 1.00 14.95 C ATOM 1609 C ALA B 72 41.265 12.328 -8.024 1.00 15.82 C ATOM 1610 O ALA B 72 41.207 11.585 -7.035 1.00 15.94 O ATOM 1611 CB ALA B 72 39.442 13.950 -8.563 1.00 15.59 C ATOM 1612 H ALA B 72 41.485 15.268 -9.382 1.00 0.00 H ATOM 1613 N ASP B 73 41.729 11.907 -9.206 1.00 16.62 N ATOM 1614 CA ASP B 73 42.170 10.529 -9.386 1.00 17.60 C ATOM 1615 C ASP B 73 43.365 10.217 -8.493 1.00 17.27 C ATOM 1616 O ASP B 73 43.481 9.114 -7.951 1.00 17.58 O ATOM 1617 CB ASP B 73 42.581 10.276 -10.845 1.00 20.64 C ATOM 1618 CG ASP B 73 41.413 10.193 -11.804 1.00 25.06 C ATOM 1619 OD1 ASP B 73 40.274 9.926 -11.370 1.00 25.65 O ATOM 1620 OD2 ASP B 73 41.659 10.368 -13.018 1.00 29.55 O ATOM 1621 H ASP B 73 41.776 12.570 -10.006 1.00 0.00 H ATOM 1622 N GLN B 74 44.281 11.175 -8.353 1.00 17.36 N ATOM 1623 CA GLN B 74 45.471 10.961 -7.543 1.00 17.89 C ATOM 1624 C GLN B 74 45.126 10.787 -6.071 1.00 16.51 C ATOM 1625 O GLN B 74 45.667 9.901 -5.397 1.00 17.62 O ATOM 1626 CB GLN B 74 46.429 12.135 -7.708 1.00 19.61 C ATOM 1627 CG GLN B 74 47.694 12.001 -6.871 1.00 26.25 C ATOM 1628 CD GLN B 74 48.604 13.215 -6.959 1.00 30.63 C ATOM 1629 OE1 GLN B 74 49.492 13.283 -7.811 1.00 33.15 O ATOM 1630 NE2 GLN B 74 48.390 14.181 -6.070 1.00 32.22 N ATOM 1631 HE22 GLN B 74 47.629 14.082 -5.368 1.00 0.00 H ATOM 1632 HE21 GLN B 74 48.984 15.035 -6.077 1.00 0.00 H ATOM 1633 H GLN B 74 44.143 12.089 -8.830 1.00 0.00 H ATOM 1634 N ILE B 75 44.263 11.657 -5.542 1.00 16.03 N ATOM 1635 CA ILE B 75 43.857 11.538 -4.146 1.00 15.60 C ATOM 1636 C ILE B 75 43.145 10.214 -3.930 1.00 16.01 C ATOM 1637 O ILE B 75 43.413 9.484 -2.966 1.00 16.48 O ATOM 1638 CB ILE B 75 42.978 12.734 -3.740 1.00 15.42 C ATOM 1639 CG1 ILE B 75 43.786 14.028 -3.791 1.00 16.86 C ATOM 1640 CG2 ILE B 75 42.398 12.508 -2.339 1.00 16.09 C ATOM 1641 CD1 ILE B 75 42.953 15.291 -3.686 1.00 18.44 C ATOM 1642 H ILE B 75 43.878 12.424 -6.129 1.00 0.00 H ATOM 1643 N GLN B 76 42.213 9.893 -4.828 1.00 15.25 N ATOM 1644 CA GLN B 76 41.475 8.642 -4.735 1.00 15.41 C ATOM 1645 C GLN B 76 42.430 7.460 -4.716 1.00 16.19 C ATOM 1646 O GLN B 76 42.308 6.546 -3.893 1.00 17.28 O ATOM 1647 CB GLN B 76 40.511 8.536 -5.913 1.00 15.34 C ATOM 1648 CG GLN B 76 39.661 7.292 -5.882 1.00 15.95 C ATOM 1649 CD GLN B 76 38.736 7.241 -7.065 1.00 16.96 C ATOM 1650 OE1 GLN B 76 37.506 7.235 -6.928 1.00 19.04 O ATOM 1651 NE2 GLN B 76 39.311 7.249 -8.243 1.00 18.31 N ATOM 1652 HE22 GLN B 76 40.348 7.254 -8.315 1.00 0.00 H ATOM 1653 HE21 GLN B 76 38.730 7.250 -9.105 1.00 0.00 H ATOM 1654 H GLN B 76 42.010 10.549 -5.609 1.00 0.00 H ATOM 1655 N ASP B 77 43.415 7.470 -5.607 1.00 16.64 N ATOM 1656 CA ASP B 77 44.320 6.334 -5.700 1.00 17.36 C ATOM 1657 C ASP B 77 45.190 6.201 -4.456 1.00 17.69 C ATOM 1658 O ASP B 77 45.520 5.083 -4.044 1.00 18.43 O ATOM 1659 CB ASP B 77 45.197 6.458 -6.939 1.00 19.50 C ATOM 1660 CG ASP B 77 46.178 5.321 -7.050 1.00 24.06 C ATOM 1661 OD1 ASP B 77 45.733 4.192 -7.338 1.00 26.93 O ATOM 1662 OD2 ASP B 77 47.387 5.551 -6.832 1.00 25.87 O ATOM 1663 H ASP B 77 43.539 8.288 -6.237 1.00 0.00 H ATOM 1664 N LYS B 78 45.606 7.322 -3.868 1.00 17.82 N ATOM 1665 CA LYS B 78 46.416 7.248 -2.658 1.00 18.72 C ATOM 1666 C LYS B 78 45.620 6.683 -1.489 1.00 17.85 C ATOM 1667 O LYS B 78 46.135 5.857 -0.723 1.00 19.23 O ATOM 1668 CB LYS B 78 46.966 8.629 -2.317 1.00 20.29 C ATOM 1669 CG LYS B 78 48.120 9.062 -3.192 1.00 23.39 C ATOM 1670 CD LYS B 78 48.775 10.344 -2.696 1.00 29.64 C ATOM 1671 CE LYS B 78 50.027 10.688 -3.506 1.00 33.44 C ATOM 1672 NZ LYS B 78 50.867 9.491 -3.824 1.00 36.06 N ATOM 1673 HZ1 LYS B 78 51.177 9.042 -2.939 1.00 0.00 H ATOM 1674 HZ2 LYS B 78 50.307 8.814 -4.380 1.00 0.00 H ATOM 1675 HZ3 LYS B 78 51.699 9.789 -4.373 1.00 0.00 H ATOM 1676 H LYS B 78 45.354 8.247 -4.271 1.00 0.00 H ATOM 1677 N VAL B 79 44.370 7.119 -1.320 1.00 16.98 N ATOM 1678 CA VAL B 79 43.540 6.598 -0.237 1.00 17.28 C ATOM 1679 C VAL B 79 43.274 5.110 -0.440 1.00 17.63 C ATOM 1680 O VAL B 79 43.400 4.302 0.490 1.00 18.81 O ATOM 1681 CB VAL B 79 42.238 7.409 -0.125 1.00 18.39 C ATOM 1682 CG1 VAL B 79 41.285 6.741 0.862 1.00 19.35 C ATOM 1683 CG2 VAL B 79 42.534 8.845 0.290 1.00 19.06 C ATOM 1684 H VAL B 79 43.983 7.837 -1.966 1.00 0.00 H ATOM 1685 N VAL B 80 42.901 4.726 -1.661 1.00 17.50 N ATOM 1686 CA VAL B 80 42.555 3.339 -1.945 1.00 18.13 C ATOM 1687 C VAL B 80 43.770 2.435 -1.775 1.00 19.27 C ATOM 1688 O VAL B 80 43.690 1.373 -1.145 1.00 19.66 O ATOM 1689 CB VAL B 80 41.920 3.241 -3.342 1.00 20.65 C ATOM 1690 CG1 VAL B 80 41.893 1.815 -3.836 1.00 22.19 C ATOM 1691 CG2 VAL B 80 40.521 3.853 -3.306 1.00 21.43 C ATOM 1692 H VAL B 80 42.856 5.430 -2.425 1.00 0.00 H ATOM 1693 N ALA B 81 44.919 2.856 -2.307 1.00 19.55 N ATOM 1694 CA ALA B 81 46.116 2.030 -2.214 1.00 20.94 C ATOM 1695 C ALA B 81 46.504 1.794 -0.760 1.00 22.23 C ATOM 1696 O ALA B 81 46.959 0.703 -0.400 1.00 24.23 O ATOM 1697 CB ALA B 81 47.269 2.684 -2.972 1.00 22.11 C ATOM 1698 H ALA B 81 44.960 3.776 -2.789 1.00 0.00 H ATOM 1699 N LYS B 82 46.326 2.804 0.090 1.00 22.38 N ATOM 1700 CA LYS B 82 46.769 2.689 1.473 1.00 23.07 C ATOM 1701 C LYS B 82 45.764 1.939 2.342 1.00 23.29 C ATOM 1702 O LYS B 82 46.169 1.177 3.230 1.00 25.54 O ATOM 1703 CB LYS B 82 47.014 4.085 2.045 1.00 26.45 C ATOM 1704 CG LYS B 82 48.137 4.169 3.067 1.00 32.34 C ATOM 1705 CD LYS B 82 48.530 5.626 3.329 1.00 36.36 C ATOM 1706 CE LYS B 82 50.038 5.841 3.202 1.00 39.70 C ATOM 1707 NZ LYS B 82 50.806 5.101 4.244 1.00 41.18 N ATOM 1708 HZ1 LYS B 82 50.512 5.427 5.187 1.00 0.00 H ATOM 1709 HZ2 LYS B 82 50.617 4.082 4.154 1.00 0.00 H ATOM 1710 HZ3 LYS B 82 51.823 5.279 4.115 1.00 0.00 H ATOM 1711 H LYS B 82 45.868 3.679 -0.235 1.00 0.00 H ATOM 1712 N TYR B 83 44.461 2.140 2.126 1.00 21.27 N ATOM 1713 CA TYR B 83 43.466 1.732 3.113 1.00 21.04 C ATOM 1714 C TYR B 83 42.351 0.813 2.617 1.00 20.23 C ATOM 1715 O TYR B 83 41.716 0.171 3.454 1.00 21.80 O ATOM 1716 CB TYR B 83 42.826 2.973 3.766 1.00 22.10 C ATOM 1717 CG TYR B 83 43.826 3.827 4.516 1.00 21.68 C ATOM 1718 CD1 TYR B 83 44.572 3.285 5.550 1.00 23.48 C ATOM 1719 CD2 TYR B 83 44.049 5.155 4.180 1.00 23.73 C ATOM 1720 CE1 TYR B 83 45.512 4.028 6.228 1.00 24.89 C ATOM 1721 CE2 TYR B 83 44.985 5.921 4.872 1.00 25.04 C ATOM 1722 CZ TYR B 83 45.715 5.344 5.893 1.00 25.15 C ATOM 1723 OH TYR B 83 46.662 6.064 6.597 1.00 27.80 O ATOM 1724 HH TYR B 83 47.075 5.482 7.283 1.00 0.00 H ATOM 1725 H TYR B 83 44.151 2.593 1.243 1.00 0.00 H ATOM 1726 N PHE B 84 42.083 0.720 1.314 1.00 19.88 N ATOM 1727 CA PHE B 84 40.864 0.053 0.853 1.00 19.59 C ATOM 1728 C PHE B 84 40.819 -1.418 1.266 1.00 19.52 C ATOM 1729 O PHE B 84 39.747 -1.949 1.572 1.00 20.33 O ATOM 1730 CB PHE B 84 40.785 0.221 -0.663 1.00 20.09 C ATOM 1731 CG PHE B 84 39.577 -0.380 -1.317 1.00 21.60 C ATOM 1732 CD1 PHE B 84 38.403 0.340 -1.441 1.00 24.91 C ATOM 1733 CD2 PHE B 84 39.641 -1.649 -1.861 1.00 23.43 C ATOM 1734 CE1 PHE B 84 37.307 -0.207 -2.086 1.00 26.35 C ATOM 1735 CE2 PHE B 84 38.551 -2.197 -2.507 1.00 25.73 C ATOM 1736 CZ PHE B 84 37.386 -1.476 -2.616 1.00 26.32 C ATOM 1737 H PHE B 84 42.744 1.124 0.621 1.00 0.00 H ATOM 1738 N ASP B 85 41.965 -2.104 1.263 1.00 22.23 N ATOM 1739 CA ASP B 85 41.951 -3.530 1.580 1.00 25.35 C ATOM 1740 C ASP B 85 41.787 -3.784 3.078 1.00 25.28 C ATOM 1741 O ASP B 85 41.327 -4.861 3.480 1.00 28.68 O ATOM 1742 CB ASP B 85 43.243 -4.189 1.094 1.00 28.00 C ATOM 1743 CG ASP B 85 43.343 -4.277 -0.426 1.00 30.96 C ATOM 1744 OD1 ASP B 85 42.311 -4.161 -1.119 1.00 35.28 O ATOM 1745 OD2 ASP B 85 44.475 -4.491 -0.930 1.00 33.54 O ATOM 1746 H ASP B 85 42.861 -1.626 1.037 1.00 0.00 H ATOM 1747 N ASP B 86 42.180 -2.828 3.918 1.00 24.31 N ATOM 1748 CA ASP B 86 42.210 -3.035 5.358 1.00 23.98 C ATOM 1749 C ASP B 86 41.084 -2.342 6.107 1.00 22.42 C ATOM 1750 O ASP B 86 40.893 -2.624 7.298 1.00 23.42 O ATOM 1751 CB ASP B 86 43.553 -2.565 5.935 1.00 27.02 C ATOM 1752 CG ASP B 86 44.711 -3.401 5.453 1.00 31.64 C ATOM 1753 OD1 ASP B 86 44.572 -4.640 5.430 1.00 32.84 O ATOM 1754 OD2 ASP B 86 45.751 -2.819 5.078 1.00 33.89 O ATOM 1755 H ASP B 86 42.474 -1.907 3.534 1.00 0.00 H ATOM 1756 N TYR B 87 40.327 -1.468 5.443 1.00 20.12 N ATOM 1757 CA TYR B 87 39.298 -0.653 6.075 1.00 18.30 C ATOM 1758 C TYR B 87 38.107 -0.544 5.134 1.00 17.14 C ATOM 1759 O TYR B 87 38.278 -0.470 3.914 1.00 18.24 O ATOM 1760 CB TYR B 87 39.813 0.771 6.388 1.00 18.56 C ATOM 1761 CG TYR B 87 40.951 0.806 7.394 1.00 19.09 C ATOM 1762 CD1 TYR B 87 42.261 0.633 6.994 1.00 20.54 C ATOM 1763 CD2 TYR B 87 40.711 0.992 8.748 1.00 20.07 C ATOM 1764 CE1 TYR B 87 43.299 0.649 7.907 1.00 22.13 C ATOM 1765 CE2 TYR B 87 41.737 1.008 9.663 1.00 22.59 C ATOM 1766 CZ TYR B 87 43.033 0.832 9.245 1.00 23.48 C ATOM 1767 OH TYR B 87 44.074 0.845 10.157 1.00 26.63 O ATOM 1768 HH TYR B 87 43.940 0.121 10.819 1.00 0.00 H ATOM 1769 H TYR B 87 40.479 -1.362 4.420 1.00 0.00 H ATOM 1770 N SER B 88 36.907 -0.525 5.705 1.00 16.64 N ATOM 1771 CA SER B 88 35.708 -0.239 4.927 1.00 16.23 C ATOM 1772 C SER B 88 35.868 1.119 4.248 1.00 15.76 C ATOM 1773 O SER B 88 36.361 2.072 4.854 1.00 16.83 O ATOM 1774 CB SER B 88 34.496 -0.216 5.864 1.00 16.78 C ATOM 1775 OG SER B 88 34.356 -1.441 6.566 1.00 18.48 O ATOM 1776 HG SER B 88 33.566 -1.391 7.160 1.00 0.00 H ATOM 1777 H SER B 88 36.822 -0.717 6.724 1.00 0.00 H ATOM 1778 N CYS B 89 35.477 1.198 2.973 1.00 15.41 N ATOM 1779 CA CYS B 89 35.764 2.373 2.159 1.00 15.72 C ATOM 1780 C CYS B 89 35.081 2.244 0.814 1.00 15.65 C ATOM 1781 O CYS B 89 35.173 1.188 0.175 1.00 16.87 O ATOM 1782 CB CYS B 89 37.272 2.441 1.915 1.00 18.03 C ATOM 1783 SG CYS B 89 37.852 3.868 1.027 1.00 20.49 S ATOM 1784 H CYS B 89 34.956 0.403 2.551 1.00 0.00 H ATOM 1785 N ILE B 90 34.410 3.315 0.383 1.00 14.83 N ATOM 1786 CA ILE B 90 33.872 3.411 -0.968 1.00 13.88 C ATOM 1787 C ILE B 90 34.123 4.825 -1.472 1.00 13.14 C ATOM 1788 O ILE B 90 34.178 5.779 -0.694 1.00 13.34 O ATOM 1789 CB ILE B 90 32.382 3.025 -1.033 1.00 14.65 C ATOM 1790 CG1 ILE B 90 31.982 2.751 -2.480 1.00 16.23 C ATOM 1791 CG2 ILE B 90 31.508 4.089 -0.435 1.00 13.82 C ATOM 1792 CD1 ILE B 90 30.686 1.990 -2.601 1.00 17.09 C ATOM 1793 H ILE B 90 34.266 4.111 1.036 1.00 0.00 H ATOM 1794 N THR B 91 34.279 4.959 -2.787 1.00 13.20 N ATOM 1795 CA THR B 91 34.680 6.239 -3.356 1.00 12.91 C ATOM 1796 C THR B 91 34.084 6.424 -4.744 1.00 12.83 C ATOM 1797 O THR B 91 33.966 5.468 -5.519 1.00 13.85 O ATOM 1798 CB THR B 91 36.214 6.355 -3.373 1.00 13.93 C ATOM 1799 OG1 THR B 91 36.597 7.600 -3.953 1.00 14.66 O ATOM 1800 CG2 THR B 91 36.859 5.224 -4.156 1.00 16.26 C ATOM 1801 HG1 THR B 91 36.218 8.342 -3.419 1.00 0.00 H ATOM 1802 H THR B 91 34.114 4.145 -3.412 1.00 0.00 H ATOM 1803 N TYR B 92 33.713 7.668 -5.050 1.00 12.39 N ATOM 1804 CA TYR B 92 33.151 7.969 -6.357 1.00 12.26 C ATOM 1805 C TYR B 92 33.477 9.402 -6.735 1.00 12.00 C ATOM 1806 O TYR B 92 33.830 10.222 -5.883 1.00 12.57 O ATOM 1807 CB TYR B 92 31.655 7.684 -6.409 1.00 13.32 C ATOM 1808 CG TYR B 92 30.786 8.432 -5.399 1.00 14.59 C ATOM 1809 CD1 TYR B 92 30.319 9.709 -5.664 1.00 15.47 C ATOM 1810 CD2 TYR B 92 30.380 7.838 -4.211 1.00 17.12 C ATOM 1811 CE1 TYR B 92 29.484 10.379 -4.790 1.00 17.21 C ATOM 1812 CE2 TYR B 92 29.534 8.516 -3.307 1.00 17.80 C ATOM 1813 CZ TYR B 92 29.105 9.792 -3.609 1.00 18.52 C ATOM 1814 OH TYR B 92 28.283 10.470 -2.738 1.00 21.78 O ATOM 1815 HH TYR B 92 27.444 9.960 -2.613 1.00 0.00 H ATOM 1816 H TYR B 92 33.826 8.428 -4.349 1.00 0.00 H ATOM 1817 N ILE B 93 33.360 9.686 -8.032 1.00 11.89 N ATOM 1818 CA ILE B 93 33.678 10.995 -8.585 1.00 12.04 C ATOM 1819 C ILE B 93 32.531 11.467 -9.468 1.00 12.61 C ATOM 1820 O ILE B 93 31.931 10.683 -10.214 1.00 13.38 O ATOM 1821 CB ILE B 93 34.996 10.946 -9.388 1.00 12.99 C ATOM 1822 CG1 ILE B 93 36.178 10.694 -8.453 1.00 14.31 C ATOM 1823 CG2 ILE B 93 35.196 12.217 -10.229 1.00 15.19 C ATOM 1824 CD1 ILE B 93 37.485 10.395 -9.161 1.00 16.33 C ATOM 1825 H ILE B 93 33.027 8.941 -8.677 1.00 0.00 H ATOM 1826 N SER B 94 32.250 12.758 -9.419 1.00 13.72 N ATOM 1827 CA SER B 94 31.357 13.378 -10.393 1.00 15.84 C ATOM 1828 C SER B 94 31.839 14.790 -10.650 1.00 14.49 C ATOM 1829 O SER B 94 32.865 15.210 -10.126 1.00 16.12 O ATOM 1830 CB SER B 94 29.922 13.367 -9.903 1.00 19.13 C ATOM 1831 OG SER B 94 29.839 14.099 -8.703 1.00 22.40 O ATOM 1832 HG SER B 94 30.427 13.684 -8.023 1.00 0.00 H ATOM 1833 H SER B 94 32.674 13.344 -8.671 1.00 0.00 H ATOM 1834 N THR B 95 31.126 15.510 -11.513 1.00 16.07 N ATOM 1835 CA THR B 95 31.467 16.887 -11.812 1.00 15.42 C ATOM 1836 C THR B 95 30.363 17.825 -11.345 1.00 14.34 C ATOM 1837 O THR B 95 29.171 17.481 -11.338 1.00 16.49 O ATOM 1838 CB THR B 95 31.743 17.073 -13.306 1.00 20.37 C ATOM 1839 OG1 THR B 95 30.605 16.635 -14.059 1.00 25.13 O ATOM 1840 CG2 THR B 95 32.972 16.293 -13.717 1.00 22.08 C ATOM 1841 HG1 THR B 95 30.434 15.678 -13.871 1.00 0.00 H ATOM 1842 H THR B 95 30.306 15.075 -11.983 1.00 0.00 H ATOM 1843 N VAL B 96 30.781 19.019 -10.953 1.00 13.09 N ATOM 1844 CA VAL B 96 29.886 20.085 -10.526 1.00 12.32 C ATOM 1845 C VAL B 96 30.427 21.400 -11.069 1.00 12.61 C ATOM 1846 O VAL B 96 31.562 21.483 -11.547 1.00 14.15 O ATOM 1847 CB VAL B 96 29.741 20.146 -8.984 1.00 13.77 C ATOM 1848 CG1 VAL B 96 29.228 18.816 -8.427 1.00 15.22 C ATOM 1849 CG2 VAL B 96 31.037 20.527 -8.312 1.00 14.93 C ATOM 1850 H VAL B 96 31.804 19.205 -10.950 1.00 0.00 H ATOM 1851 N GLU B 97 29.605 22.449 -10.973 1.00 12.52 N ATOM 1852 CA GLU B 97 29.971 23.785 -11.438 1.00 13.55 C ATOM 1853 C GLU B 97 30.238 24.691 -10.240 1.00 12.56 C ATOM 1854 O GLU B 97 29.310 25.035 -9.499 1.00 13.59 O ATOM 1855 CB GLU B 97 28.843 24.365 -12.290 1.00 17.00 C ATOM 1856 CG GLU B 97 29.097 25.755 -12.809 1.00 19.65 C ATOM 1857 CD GLU B 97 27.945 26.292 -13.629 1.00 22.79 C ATOM 1858 OE1 GLU B 97 27.184 25.498 -14.218 1.00 24.03 O ATOM 1859 OE2 GLU B 97 27.764 27.528 -13.652 1.00 26.14 O ATOM 1860 H GLU B 97 28.665 22.309 -10.550 1.00 0.00 H ATOM 1861 N ALA B 98 31.503 25.067 -10.044 1.00 14.34 N ATOM 1862 CA ALA B 98 31.883 26.000 -9.004 1.00 16.52 C ATOM 1863 C ALA B 98 31.747 27.426 -9.530 1.00 18.58 C ATOM 1864 O ALA B 98 31.701 27.667 -10.742 1.00 21.73 O ATOM 1865 CB ALA B 98 33.320 25.733 -8.560 1.00 20.77 C ATOM 1866 H ALA B 98 32.243 24.676 -10.661 1.00 0.00 H ATOM 1867 N LEU B 99 31.662 28.365 -8.605 1.00 21.72 N ATOM 1868 CA LEU B 99 31.533 29.765 -8.949 1.00 24.94 C ATOM 1869 C LEU B 99 32.930 30.361 -9.086 1.00 27.91 C ATOM 1870 O LEU B 99 33.752 30.273 -8.162 1.00 29.35 O ATOM 1871 CB LEU B 99 30.745 30.466 -7.848 1.00 26.73 C ATOM 1872 CG LEU B 99 30.261 31.887 -8.100 1.00 27.23 C ATOM 1873 CD1 LEU B 99 29.330 31.947 -9.281 1.00 28.42 C ATOM 1874 CD2 LEU B 99 29.576 32.363 -6.829 1.00 27.48 C ATOM 1875 H LEU B 99 31.688 28.091 -7.602 1.00 0.00 H TER 1876 LEU B 99 ATOM 1877 N SER C 1 7.689 9.316 -12.835 1.00 37.53 N ATOM 1878 CA SER C 1 8.190 10.198 -13.928 1.00 34.79 C ATOM 1879 C SER C 1 9.182 11.174 -13.346 1.00 30.07 C ATOM 1880 O SER C 1 9.227 11.365 -12.134 1.00 31.81 O ATOM 1881 CB SER C 1 7.038 10.934 -14.587 1.00 36.30 C ATOM 1882 OG SER C 1 6.045 10.003 -14.958 1.00 39.89 O ATOM 1883 HG SER C 1 5.292 10.480 -15.388 1.00 0.00 H ATOM 1884 HN3 SER C 1 7.228 9.897 -12.106 1.00 0.00 H ATOM 1885 HN2 SER C 1 8.488 8.800 -12.414 1.00 0.00 H ATOM 1886 HN1 SER C 1 7.003 8.638 -13.225 1.00 0.00 H ATOM 1887 N SER C 2 10.047 11.699 -14.196 1.00 28.66 N ATOM 1888 CA SER C 2 11.211 12.516 -13.808 1.00 27.47 C ATOM 1889 C SER C 2 11.034 14.002 -14.099 1.00 22.71 C ATOM 1890 O SER C 2 10.225 14.389 -14.928 1.00 26.63 O ATOM 1891 CB SER C 2 12.385 12.005 -14.562 1.00 31.94 C ATOM 1892 OG SER C 2 12.226 12.352 -15.931 1.00 34.37 O ATOM 1893 HG SER C 2 12.171 13.337 -16.016 1.00 0.00 H ATOM 1894 H SER C 2 9.896 11.523 -15.210 1.00 0.00 H ATOM 1895 N GLN C 3 11.797 14.803 -13.362 1.00 30.00 N ATOM 1896 CA GLN C 3 11.889 16.241 -13.668 1.00 30.00 C ATOM 1897 C GLN C 3 13.324 16.670 -13.370 1.00 30.00 C ATOM 1898 O GLN C 3 13.803 16.389 -12.261 1.00 30.00 O ATOM 1899 CB GLN C 3 10.933 17.079 -12.834 1.00 30.00 C ATOM 1900 CG GLN C 3 11.042 18.562 -13.130 1.00 30.00 C ATOM 1901 CD GLN C 3 9.902 19.349 -12.541 1.00 30.00 C ATOM 1902 OE1 GLN C 3 8.763 18.932 -12.598 1.00 30.00 O ATOM 1903 NE2 GLN C 3 10.211 20.496 -11.962 1.00 30.00 N ATOM 1904 HE22 GLN C 3 11.200 20.815 -11.936 1.00 0.00 H ATOM 1905 HE21 GLN C 3 9.465 21.079 -11.532 1.00 0.00 H ATOM 1906 H GLN C 3 12.334 14.411 -12.562 1.00 0.00 H ATOM 1907 N GLN C 4 13.986 17.318 -14.315 1.00 16.07 N ATOM 1908 CA GLN C 4 15.361 17.806 -14.084 1.00 16.16 C ATOM 1909 C GLN C 4 15.293 19.028 -13.173 1.00 14.81 C ATOM 1910 O GLN C 4 14.500 19.930 -13.406 1.00 17.79 O ATOM 1911 CB GLN C 4 16.026 18.175 -15.399 1.00 21.90 C ATOM 1912 CG GLN C 4 17.497 18.553 -15.264 1.00 25.10 C ATOM 1913 CD GLN C 4 18.235 18.209 -16.527 1.00 32.23 C ATOM 1914 OE1 GLN C 4 18.062 18.850 -17.541 1.00 33.78 O ATOM 1915 NE2 GLN C 4 19.073 17.219 -16.464 1.00 34.70 N ATOM 1916 HE22 GLN C 4 19.192 16.694 -15.574 1.00 0.00 H ATOM 1917 HE21 GLN C 4 19.625 16.951 -17.304 1.00 0.00 H ATOM 1918 H GLN C 4 13.531 17.486 -15.235 1.00 0.00 H ATOM 1919 N VAL C 5 16.063 18.982 -12.089 1.00 13.95 N ATOM 1920 CA VAL C 5 16.164 20.101 -11.169 1.00 14.18 C ATOM 1921 C VAL C 5 17.636 20.398 -10.938 1.00 13.97 C ATOM 1922 O VAL C 5 18.526 19.625 -11.307 1.00 15.25 O ATOM 1923 CB VAL C 5 15.393 19.876 -9.856 1.00 16.24 C ATOM 1924 CG1 VAL C 5 13.921 19.597 -10.140 1.00 17.68 C ATOM 1925 CG2 VAL C 5 15.987 18.742 -9.076 1.00 16.85 C ATOM 1926 H VAL C 5 16.609 18.119 -11.895 1.00 0.00 H ATOM 1927 N TRP C 6 17.880 21.551 -10.342 1.00 13.82 N ATOM 1928 CA TRP C 6 19.224 21.974 -10.004 1.00 13.53 C ATOM 1929 C TRP C 6 19.425 21.825 -8.502 1.00 13.05 C ATOM 1930 O TRP C 6 18.496 22.020 -7.717 1.00 14.71 O ATOM 1931 CB TRP C 6 19.449 23.416 -10.461 1.00 14.95 C ATOM 1932 CG TRP C 6 19.617 23.490 -11.932 1.00 16.02 C ATOM 1933 CD1 TRP C 6 20.793 23.577 -12.614 1.00 17.66 C ATOM 1934 CD2 TRP C 6 18.585 23.412 -12.924 1.00 17.08 C ATOM 1935 NE1 TRP C 6 20.561 23.587 -13.964 1.00 18.43 N ATOM 1936 CE2 TRP C 6 19.215 23.469 -14.186 1.00 18.28 C ATOM 1937 CE3 TRP C 6 17.192 23.302 -12.874 1.00 17.39 C ATOM 1938 CZ2 TRP C 6 18.493 23.445 -15.383 1.00 20.93 C ATOM 1939 CZ3 TRP C 6 16.486 23.252 -14.056 1.00 19.17 C ATOM 1940 CH2 TRP C 6 17.136 23.325 -15.287 1.00 21.08 C ATOM 1941 HE1 TRP C 6 21.290 23.671 -14.701 1.00 0.00 H ATOM 1942 H TRP C 6 17.082 22.175 -10.108 1.00 0.00 H ATOM 1943 N LYS C 7 20.631 21.432 -8.111 1.00 13.03 N ATOM 1944 CA LYS C 7 21.012 21.279 -6.715 1.00 12.55 C ATOM 1945 C LYS C 7 22.128 22.279 -6.438 1.00 12.16 C ATOM 1946 O LYS C 7 23.222 22.172 -7.006 1.00 13.48 O ATOM 1947 CB LYS C 7 21.470 19.855 -6.426 1.00 13.15 C ATOM 1948 CG LYS C 7 21.861 19.655 -4.969 1.00 15.26 C ATOM 1949 CD LYS C 7 21.930 18.186 -4.588 1.00 18.32 C ATOM 1950 CE LYS C 7 23.036 17.471 -5.328 1.00 21.17 C ATOM 1951 NZ LYS C 7 24.380 17.921 -4.885 1.00 23.96 N ATOM 1952 HZ1 LYS C 7 24.477 18.942 -5.060 1.00 0.00 H ATOM 1953 HZ2 LYS C 7 24.491 17.730 -3.869 1.00 0.00 H ATOM 1954 HZ3 LYS C 7 25.110 17.406 -5.418 1.00 0.00 H ATOM 1955 H LYS C 7 21.341 21.222 -8.841 1.00 0.00 H ATOM 1956 N LEU C 8 21.831 23.261 -5.587 1.00 11.79 N ATOM 1957 CA LEU C 8 22.801 24.232 -5.106 1.00 11.33 C ATOM 1958 C LEU C 8 23.318 23.772 -3.752 1.00 11.58 C ATOM 1959 O LEU C 8 22.528 23.502 -2.835 1.00 12.50 O ATOM 1960 CB LEU C 8 22.120 25.591 -4.957 1.00 12.80 C ATOM 1961 CG LEU C 8 22.902 26.682 -4.213 1.00 13.53 C ATOM 1962 CD1 LEU C 8 24.181 27.065 -4.935 1.00 13.81 C ATOM 1963 CD2 LEU C 8 22.029 27.895 -3.979 1.00 14.53 C ATOM 1964 H LEU C 8 20.851 23.337 -5.248 1.00 0.00 H ATOM 1965 N VAL C 9 24.635 23.702 -3.614 1.00 11.21 N ATOM 1966 CA VAL C 9 25.280 23.409 -2.343 1.00 11.36 C ATOM 1967 C VAL C 9 25.997 24.665 -1.870 1.00 11.63 C ATOM 1968 O VAL C 9 26.698 25.340 -2.645 1.00 12.31 O ATOM 1969 CB VAL C 9 26.247 22.219 -2.475 1.00 12.11 C ATOM 1970 CG1 VAL C 9 27.076 22.059 -1.203 1.00 13.03 C ATOM 1971 CG2 VAL C 9 25.474 20.954 -2.775 1.00 13.64 C ATOM 1972 H VAL C 9 25.232 23.863 -4.450 1.00 0.00 H ATOM 1973 N ILE C 10 25.836 24.963 -0.578 1.00 11.91 N ATOM 1974 CA ILE C 10 26.538 26.044 0.108 1.00 12.42 C ATOM 1975 C ILE C 10 27.164 25.440 1.349 1.00 12.72 C ATOM 1976 O ILE C 10 26.444 24.912 2.200 1.00 13.76 O ATOM 1977 CB ILE C 10 25.584 27.176 0.516 1.00 15.05 C ATOM 1978 CG1 ILE C 10 24.866 27.764 -0.698 1.00 17.35 C ATOM 1979 CG2 ILE C 10 26.339 28.252 1.312 1.00 17.56 C ATOM 1980 CD1 ILE C 10 23.595 28.486 -0.314 1.00 21.97 C ATOM 1981 H ILE C 10 25.168 24.388 -0.025 1.00 0.00 H ATOM 1982 N ILE C 11 28.486 25.512 1.468 1.00 12.64 N ATOM 1983 CA ILE C 11 29.199 25.056 2.663 1.00 13.35 C ATOM 1984 C ILE C 11 29.814 26.289 3.296 1.00 14.36 C ATOM 1985 O ILE C 11 30.581 27.001 2.644 1.00 15.37 O ATOM 1986 CB ILE C 11 30.259 24.001 2.316 1.00 13.83 C ATOM 1987 CG1 ILE C 11 29.570 22.737 1.769 1.00 14.56 C ATOM 1988 CG2 ILE C 11 31.117 23.666 3.541 1.00 15.05 C ATOM 1989 CD1 ILE C 11 30.471 21.869 0.908 1.00 15.58 C ATOM 1990 H ILE C 11 29.037 25.909 0.680 1.00 0.00 H ATOM 1991 N THR C 12 29.445 26.580 4.540 1.00 14.39 N ATOM 1992 CA THR C 12 29.844 27.836 5.160 1.00 15.14 C ATOM 1993 C THR C 12 29.979 27.677 6.666 1.00 15.90 C ATOM 1994 O THR C 12 29.714 26.620 7.228 1.00 16.17 O ATOM 1995 CB THR C 12 28.881 28.959 4.749 1.00 16.60 C ATOM 1996 OG1 THR C 12 29.410 30.232 5.127 1.00 18.53 O ATOM 1997 CG2 THR C 12 27.500 28.785 5.352 1.00 17.56 C ATOM 1998 HG1 THR C 12 30.281 30.373 4.678 1.00 0.00 H ATOM 1999 H THR C 12 28.865 25.903 5.076 1.00 0.00 H ATOM 2000 N GLU C 13 30.437 28.743 7.316 1.00 17.00 N ATOM 2001 CA GLU C 13 30.617 28.720 8.762 1.00 17.69 C ATOM 2002 C GLU C 13 29.312 28.384 9.469 1.00 18.79 C ATOM 2003 O GLU C 13 28.235 28.866 9.105 1.00 19.27 O ATOM 2004 CB GLU C 13 31.112 30.082 9.243 1.00 18.23 C ATOM 2005 CG GLU C 13 32.405 30.519 8.600 1.00 17.91 C ATOM 2006 CD GLU C 13 33.018 31.759 9.255 1.00 17.64 C ATOM 2007 OE1 GLU C 13 32.748 32.030 10.452 1.00 19.61 O ATOM 2008 OE2 GLU C 13 33.773 32.453 8.555 1.00 18.57 O ATOM 2009 H GLU C 13 30.670 29.606 6.784 1.00 0.00 H ATOM 2010 N GLU C 14 29.416 27.557 10.510 1.00 20.35 N ATOM 2011 CA GLU C 14 28.218 27.125 11.222 1.00 20.98 C ATOM 2012 C GLU C 14 27.438 28.311 11.783 1.00 21.73 C ATOM 2013 O GLU C 14 26.212 28.231 11.931 1.00 23.98 O ATOM 2014 CB GLU C 14 28.609 26.146 12.329 1.00 23.29 C ATOM 2015 CG GLU C 14 27.437 25.560 13.101 1.00 26.91 C ATOM 2016 CD GLU C 14 26.975 26.438 14.255 1.00 29.36 C ATOM 2017 OE1 GLU C 14 27.750 27.311 14.706 1.00 29.93 O ATOM 2018 OE2 GLU C 14 25.828 26.251 14.712 1.00 32.05 O ATOM 2019 H GLU C 14 30.352 27.220 10.814 1.00 0.00 H ATOM 2020 N ILE C 15 28.119 29.421 12.077 1.00 23.89 N ATOM 2021 CA ILE C 15 27.444 30.570 12.666 1.00 26.66 C ATOM 2022 C ILE C 15 26.439 31.213 11.717 1.00 26.23 C ATOM 2023 O ILE C 15 25.579 31.978 12.165 1.00 27.08 O ATOM 2024 CB ILE C 15 28.469 31.604 13.170 1.00 30.13 C ATOM 2025 CG1 ILE C 15 29.388 30.972 14.219 1.00 32.12 C ATOM 2026 CG2 ILE C 15 27.761 32.821 13.746 1.00 31.58 C ATOM 2027 CD1 ILE C 15 30.554 31.850 14.633 1.00 32.80 C ATOM 2028 H ILE C 15 29.140 29.466 11.884 1.00 0.00 H ATOM 2029 N LEU C 16 26.512 30.929 10.421 1.00 23.60 N ATOM 2030 CA LEU C 16 25.607 31.537 9.449 1.00 22.84 C ATOM 2031 C LEU C 16 24.338 30.720 9.217 1.00 23.04 C ATOM 2032 O LEU C 16 23.585 31.020 8.286 1.00 22.84 O ATOM 2033 CB LEU C 16 26.319 31.764 8.113 1.00 21.72 C ATOM 2034 CG LEU C 16 27.416 32.832 8.108 1.00 22.33 C ATOM 2035 CD1 LEU C 16 28.050 32.939 6.723 1.00 22.79 C ATOM 2036 CD2 LEU C 16 26.892 34.193 8.557 1.00 23.86 C ATOM 2037 H LEU C 16 27.233 30.256 10.090 1.00 0.00 H ATOM 2038 N LEU C 17 24.084 29.700 10.036 1.00 22.99 N ATOM 2039 CA LEU C 17 22.950 28.814 9.799 1.00 23.12 C ATOM 2040 C LEU C 17 21.639 29.578 9.606 1.00 22.78 C ATOM 2041 O LEU C 17 20.932 29.379 8.610 1.00 22.82 O ATOM 2042 CB LEU C 17 22.843 27.813 10.949 1.00 24.83 C ATOM 2043 CG LEU C 17 21.625 26.904 10.992 1.00 25.19 C ATOM 2044 CD1 LEU C 17 21.614 26.016 9.767 1.00 24.86 C ATOM 2045 CD2 LEU C 17 21.622 26.067 12.254 1.00 27.45 C ATOM 2046 H LEU C 17 24.703 29.533 10.855 1.00 0.00 H ATOM 2047 N LYS C 18 21.278 30.441 10.548 1.00 26.05 N ATOM 2048 CA LYS C 18 19.977 31.092 10.442 1.00 28.12 C ATOM 2049 C LYS C 18 19.951 32.145 9.333 1.00 26.98 C ATOM 2050 O LYS C 18 18.947 32.294 8.628 1.00 27.87 O ATOM 2051 CB LYS C 18 19.615 31.728 11.777 1.00 34.06 C ATOM 2052 CG LYS C 18 18.156 32.139 11.890 1.00 39.88 C ATOM 2053 CD LYS C 18 17.930 33.202 12.962 1.00 45.68 C ATOM 2054 CE LYS C 18 18.981 33.105 14.043 1.00 49.14 C ATOM 2055 NZ LYS C 18 18.927 34.249 14.998 1.00 51.54 N ATOM 2056 HZ1 LYS C 18 19.080 35.138 14.481 1.00 0.00 H ATOM 2057 HZ2 LYS C 18 17.995 34.271 15.459 1.00 0.00 H ATOM 2058 HZ3 LYS C 18 19.668 34.133 15.718 1.00 0.00 H ATOM 2059 H LYS C 18 21.911 30.649 11.347 1.00 0.00 H ATOM 2060 N LYS C 19 21.040 32.889 9.154 1.00 25.94 N ATOM 2061 CA LYS C 19 21.049 33.932 8.131 1.00 26.18 C ATOM 2062 C LYS C 19 20.916 33.349 6.728 1.00 24.76 C ATOM 2063 O LYS C 19 20.225 33.925 5.881 1.00 25.33 O ATOM 2064 CB LYS C 19 22.323 34.771 8.224 1.00 27.70 C ATOM 2065 CG LYS C 19 22.326 35.733 9.421 1.00 30.21 C ATOM 2066 CD LYS C 19 22.235 34.971 10.739 1.00 33.14 C ATOM 2067 CE LYS C 19 23.365 33.951 10.845 1.00 34.28 C ATOM 2068 NZ LYS C 19 23.056 32.747 11.672 1.00 31.46 N ATOM 2069 HZ1 LYS C 19 22.831 33.043 12.643 1.00 0.00 H ATOM 2070 HZ2 LYS C 19 22.241 32.247 11.263 1.00 0.00 H ATOM 2071 HZ3 LYS C 19 23.882 32.115 11.684 1.00 0.00 H ATOM 2072 H LYS C 19 21.883 32.728 9.741 1.00 0.00 H ATOM 2073 N VAL C 20 21.599 32.237 6.440 1.00 22.49 N ATOM 2074 CA VAL C 20 21.529 31.668 5.094 1.00 21.29 C ATOM 2075 C VAL C 20 20.192 30.971 4.877 1.00 21.60 C ATOM 2076 O VAL C 20 19.622 31.019 3.779 1.00 21.95 O ATOM 2077 CB VAL C 20 22.735 30.748 4.826 1.00 21.06 C ATOM 2078 CG1 VAL C 20 22.563 29.960 3.514 1.00 20.71 C ATOM 2079 CG2 VAL C 20 24.019 31.571 4.794 1.00 22.37 C ATOM 2080 H VAL C 20 22.179 31.777 7.171 1.00 0.00 H ATOM 2081 N SER C 21 19.664 30.320 5.917 1.00 22.59 N ATOM 2082 CA SER C 21 18.339 29.719 5.802 1.00 23.76 C ATOM 2083 C SER C 21 17.303 30.761 5.389 1.00 24.59 C ATOM 2084 O SER C 21 16.411 30.480 4.583 1.00 25.04 O ATOM 2085 CB SER C 21 17.950 29.058 7.127 1.00 25.19 C ATOM 2086 OG SER C 21 18.895 28.070 7.520 1.00 25.67 O ATOM 2087 HG SER C 21 18.611 27.666 8.378 1.00 0.00 H ATOM 2088 H SER C 21 20.196 30.242 6.807 1.00 0.00 H ATOM 2089 N LYS C 22 17.411 31.978 5.930 1.00 26.17 N ATOM 2090 CA LYS C 22 16.455 33.034 5.605 1.00 27.47 C ATOM 2091 C LYS C 22 16.567 33.474 4.148 1.00 26.70 C ATOM 2092 O LYS C 22 15.545 33.709 3.490 1.00 28.00 O ATOM 2093 CB LYS C 22 16.693 34.212 6.541 1.00 29.97 C ATOM 2094 CG LYS C 22 15.858 35.431 6.294 1.00 33.68 C ATOM 2095 CD LYS C 22 16.086 36.396 7.448 1.00 37.71 C ATOM 2096 CE LYS C 22 15.685 37.807 7.092 1.00 40.75 C ATOM 2097 NZ LYS C 22 16.552 38.389 6.032 1.00 41.65 N ATOM 2098 HZ1 LYS C 22 17.538 38.407 6.363 1.00 0.00 H ATOM 2099 HZ2 LYS C 22 16.484 37.807 5.172 1.00 0.00 H ATOM 2100 HZ3 LYS C 22 16.238 39.358 5.822 1.00 0.00 H ATOM 2101 H LYS C 22 18.188 32.177 6.593 1.00 0.00 H ATOM 2102 N ILE C 23 17.791 33.603 3.627 1.00 24.31 N ATOM 2103 CA ILE C 23 17.961 33.950 2.216 1.00 23.64 C ATOM 2104 C ILE C 23 17.298 32.907 1.332 1.00 22.97 C ATOM 2105 O ILE C 23 16.600 33.240 0.364 1.00 23.75 O ATOM 2106 CB ILE C 23 19.452 34.104 1.870 1.00 23.43 C ATOM 2107 CG1 ILE C 23 20.025 35.360 2.526 1.00 25.05 C ATOM 2108 CG2 ILE C 23 19.635 34.133 0.350 1.00 24.27 C ATOM 2109 CD1 ILE C 23 21.526 35.484 2.403 1.00 26.89 C ATOM 2110 H ILE C 23 18.627 33.456 4.228 1.00 0.00 H ATOM 2111 N ILE C 24 17.514 31.633 1.627 1.00 21.81 N ATOM 2112 CA ILE C 24 16.958 30.537 0.795 1.00 21.32 C ATOM 2113 C ILE C 24 15.433 30.624 0.767 1.00 22.86 C ATOM 2114 O ILE C 24 14.845 30.582 -0.299 1.00 24.11 O ATOM 2115 CB ILE C 24 17.449 29.181 1.333 1.00 20.63 C ATOM 2116 CG1 ILE C 24 18.967 29.061 1.207 1.00 19.52 C ATOM 2117 CG2 ILE C 24 16.699 28.055 0.654 1.00 21.16 C ATOM 2118 CD1 ILE C 24 19.571 27.927 1.999 1.00 19.72 C ATOM 2119 H ILE C 24 18.087 31.396 2.462 1.00 0.00 H ATOM 2120 N LYS C 25 14.841 30.777 1.950 1.00 30.00 N ATOM 2121 CA LYS C 25 13.364 30.829 2.037 1.00 30.00 C ATOM 2122 C LYS C 25 12.838 32.124 1.403 1.00 30.00 C ATOM 2123 O LYS C 25 11.911 32.006 0.631 1.00 30.00 O ATOM 2124 CB LYS C 25 12.936 30.668 3.493 1.00 30.00 C ATOM 2125 CG LYS C 25 13.062 29.261 4.059 1.00 30.00 C ATOM 2126 CD LYS C 25 13.170 29.246 5.580 1.00 30.00 C ATOM 2127 CE LYS C 25 11.896 29.493 6.334 1.00 30.00 C ATOM 2128 NZ LYS C 25 12.100 29.182 7.759 1.00 30.00 N ATOM 2129 HZ1 LYS C 25 12.374 28.184 7.859 1.00 0.00 H ATOM 2130 HZ2 LYS C 25 12.853 29.790 8.141 1.00 0.00 H ATOM 2131 HZ3 LYS C 25 11.216 29.354 8.280 1.00 0.00 H ATOM 2132 H LYS C 25 15.416 30.860 2.813 1.00 0.00 H ATOM 2133 N GLU C 26 13.469 33.305 1.665 1.00 27.53 N ATOM 2134 CA GLU C 26 13.028 34.618 1.119 1.00 29.48 C ATOM 2135 C GLU C 26 13.117 34.624 -0.411 1.00 29.30 C ATOM 2136 O GLU C 26 12.259 35.285 -1.029 1.00 30.86 O ATOM 2137 CB GLU C 26 13.861 35.768 1.691 1.00 31.82 C ATOM 2138 CG GLU C 26 13.276 37.140 1.405 1.00 34.30 C ATOM 2139 CD GLU C 26 13.858 38.262 2.247 1.00 36.11 C ATOM 2140 OE1 GLU C 26 14.697 37.970 3.122 1.00 35.45 O ATOM 2141 OE2 GLU C 26 13.468 39.426 2.027 1.00 37.88 O ATOM 2142 H GLU C 26 14.306 33.287 2.282 1.00 0.00 H ATOM 2143 N ALA C 27 13.990 33.804 -1.009 1.00 28.86 N ATOM 2144 CA ALA C 27 14.123 33.766 -2.455 1.00 29.71 C ATOM 2145 C ALA C 27 13.039 32.935 -3.126 1.00 29.78 C ATOM 2146 O ALA C 27 12.898 33.012 -4.352 1.00 31.81 O ATOM 2147 CB ALA C 27 15.494 33.222 -2.837 1.00 30.51 C ATOM 2148 H ALA C 27 14.585 33.181 -0.426 1.00 0.00 H ATOM 2149 N GLY C 28 12.281 32.144 -2.372 1.00 28.64 N ATOM 2150 CA GLY C 28 11.208 31.356 -2.937 1.00 28.20 C ATOM 2151 C GLY C 28 11.535 29.899 -3.165 1.00 25.96 C ATOM 2152 O GLY C 28 10.784 29.218 -3.874 1.00 26.47 O ATOM 2153 H GLY C 28 12.465 32.091 -1.350 1.00 0.00 H ATOM 2154 N ALA C 29 12.626 29.400 -2.600 1.00 23.34 N ATOM 2155 CA ALA C 29 12.888 27.977 -2.705 1.00 20.86 C ATOM 2156 C ALA C 29 11.766 27.209 -2.022 1.00 19.66 C ATOM 2157 O ALA C 29 11.156 27.682 -1.059 1.00 21.51 O ATOM 2158 CB ALA C 29 14.211 27.632 -2.031 1.00 21.11 C ATOM 2159 H ALA C 29 13.285 30.021 -2.088 1.00 0.00 H ATOM 2160 N SER C 30 11.518 25.990 -2.493 1.00 17.89 N ATOM 2161 CA SER C 30 10.481 25.160 -1.890 1.00 18.67 C ATOM 2162 C SER C 30 10.943 24.520 -0.590 1.00 18.32 C ATOM 2163 O SER C 30 10.113 24.006 0.163 1.00 18.91 O ATOM 2164 CB SER C 30 10.022 24.091 -2.884 1.00 19.89 C ATOM 2165 OG SER C 30 11.070 23.205 -3.177 1.00 18.78 O ATOM 2166 HG SER C 30 10.753 22.522 -3.820 1.00 0.00 H ATOM 2167 H SER C 30 12.068 25.626 -3.297 1.00 0.00 H ATOM 2168 N GLY C 31 12.240 24.558 -0.310 1.00 16.71 N ATOM 2169 CA GLY C 31 12.785 23.948 0.878 1.00 15.69 C ATOM 2170 C GLY C 31 14.300 24.004 0.836 1.00 14.94 C ATOM 2171 O GLY C 31 14.892 24.579 -0.074 1.00 15.29 O ATOM 2172 H GLY C 31 12.883 25.043 -0.968 1.00 0.00 H ATOM 2173 N TYR C 32 14.904 23.365 1.832 1.00 14.21 N ATOM 2174 CA TYR C 32 16.349 23.217 1.931 1.00 13.40 C ATOM 2175 C TYR C 32 16.622 22.063 2.889 1.00 13.02 C ATOM 2176 O TYR C 32 15.803 21.739 3.754 1.00 13.54 O ATOM 2177 CB TYR C 32 17.066 24.511 2.413 1.00 14.75 C ATOM 2178 CG TYR C 32 16.730 24.864 3.838 1.00 14.84 C ATOM 2179 CD1 TYR C 32 17.479 24.371 4.904 1.00 15.22 C ATOM 2180 CD2 TYR C 32 15.610 25.638 4.127 1.00 16.90 C ATOM 2181 CE1 TYR C 32 17.121 24.633 6.219 1.00 16.50 C ATOM 2182 CE2 TYR C 32 15.243 25.902 5.440 1.00 17.45 C ATOM 2183 CZ TYR C 32 16.006 25.408 6.484 1.00 18.04 C ATOM 2184 OH TYR C 32 15.658 25.658 7.804 1.00 19.17 O ATOM 2185 HH TYR C 32 14.757 25.289 7.982 1.00 0.00 H ATOM 2186 H TYR C 32 14.314 22.949 2.580 1.00 0.00 H ATOM 2187 N THR C 33 17.806 21.485 2.752 1.00 12.91 N ATOM 2188 CA THR C 33 18.346 20.504 3.680 1.00 12.71 C ATOM 2189 C THR C 33 19.682 21.034 4.186 1.00 13.09 C ATOM 2190 O THR C 33 20.435 21.658 3.427 1.00 14.17 O ATOM 2191 CB THR C 33 18.503 19.151 2.977 1.00 12.68 C ATOM 2192 OG1 THR C 33 17.215 18.714 2.543 1.00 13.07 O ATOM 2193 CG2 THR C 33 19.083 18.079 3.890 1.00 14.13 C ATOM 2194 HG1 THR C 33 16.618 18.621 3.327 1.00 0.00 H ATOM 2195 H THR C 33 18.385 21.749 1.930 1.00 0.00 H ATOM 2196 N VAL C 34 19.972 20.825 5.463 1.00 12.81 N ATOM 2197 CA VAL C 34 21.221 21.290 6.060 1.00 13.23 C ATOM 2198 C VAL C 34 21.800 20.187 6.933 1.00 13.40 C ATOM 2199 O VAL C 34 21.068 19.455 7.613 1.00 14.45 O ATOM 2200 CB VAL C 34 21.024 22.643 6.789 1.00 14.87 C ATOM 2201 CG1 VAL C 34 20.104 22.503 7.990 1.00 16.24 C ATOM 2202 CG2 VAL C 34 22.356 23.262 7.175 1.00 16.02 C ATOM 2203 H VAL C 34 19.289 20.314 6.058 1.00 0.00 H ATOM 2204 N LEU C 35 23.124 20.058 6.890 1.00 12.98 N ATOM 2205 CA LEU C 35 23.869 19.053 7.629 1.00 13.40 C ATOM 2206 C LEU C 35 25.038 19.709 8.346 1.00 13.39 C ATOM 2207 O LEU C 35 25.623 20.679 7.867 1.00 14.47 O ATOM 2208 CB LEU C 35 24.421 17.967 6.707 1.00 14.26 C ATOM 2209 CG LEU C 35 23.388 17.270 5.817 1.00 14.37 C ATOM 2210 CD1 LEU C 35 23.301 17.888 4.425 1.00 16.18 C ATOM 2211 CD2 LEU C 35 23.651 15.770 5.697 1.00 15.67 C ATOM 2212 H LEU C 35 23.659 20.718 6.290 1.00 0.00 H ATOM 2213 N ALA C 36 25.373 19.189 9.525 1.00 13.99 N ATOM 2214 CA ALA C 36 26.601 19.600 10.192 1.00 14.80 C ATOM 2215 C ALA C 36 27.813 19.069 9.447 1.00 13.92 C ATOM 2216 O ALA C 36 27.818 17.932 8.972 1.00 15.70 O ATOM 2217 CB ALA C 36 26.628 19.072 11.624 1.00 16.83 C ATOM 2218 H ALA C 36 24.753 18.484 9.973 1.00 0.00 H ATOM 2219 N ALA C 37 28.859 19.882 9.369 1.00 14.56 N ATOM 2220 CA ALA C 37 30.046 19.499 8.628 1.00 14.29 C ATOM 2221 C ALA C 37 31.263 20.158 9.259 1.00 14.75 C ATOM 2222 O ALA C 37 31.163 21.006 10.145 1.00 15.86 O ATOM 2223 CB ALA C 37 29.945 19.886 7.154 1.00 15.40 C ATOM 2224 H ALA C 37 28.827 20.806 9.845 1.00 0.00 H ATOM 2225 N ALA C 38 32.429 19.761 8.782 1.00 15.34 N ATOM 2226 CA ALA C 38 33.685 20.394 9.151 1.00 15.79 C ATOM 2227 C ALA C 38 34.541 20.462 7.893 1.00 14.60 C ATOM 2228 O ALA C 38 34.244 19.805 6.889 1.00 15.23 O ATOM 2229 CB ALA C 38 34.402 19.625 10.270 1.00 17.83 C ATOM 2230 H ALA C 38 32.450 18.963 8.115 1.00 0.00 H ATOM 2231 N GLY C 39 35.603 21.250 7.919 1.00 15.23 N ATOM 2232 CA GLY C 39 36.438 21.308 6.740 1.00 15.09 C ATOM 2233 C GLY C 39 37.590 22.270 6.893 1.00 14.71 C ATOM 2234 O GLY C 39 37.758 22.937 7.922 1.00 15.98 O ATOM 2235 H GLY C 39 35.831 21.812 8.764 1.00 0.00 H ATOM 2236 N GLU C 40 38.406 22.307 5.843 1.00 14.64 N ATOM 2237 CA GLU C 40 39.452 23.301 5.674 1.00 15.28 C ATOM 2238 C GLU C 40 39.426 23.797 4.236 1.00 15.65 C ATOM 2239 O GLU C 40 39.002 23.079 3.321 1.00 15.67 O ATOM 2240 CB GLU C 40 40.834 22.723 6.009 1.00 17.64 C ATOM 2241 CG GLU C 40 40.935 22.167 7.438 1.00 19.03 C ATOM 2242 CD GLU C 40 42.301 21.588 7.762 1.00 20.83 C ATOM 2243 OE1 GLU C 40 43.285 22.348 7.754 1.00 24.68 O ATOM 2244 OE2 GLU C 40 42.395 20.376 8.038 1.00 21.56 O ATOM 2245 H GLU C 40 38.289 21.585 5.103 1.00 0.00 H ATOM 2246 N GLY C 41 39.885 25.037 4.044 1.00 16.25 N ATOM 2247 CA GLY C 41 39.944 25.675 2.743 1.00 17.20 C ATOM 2248 C GLY C 41 41.132 26.616 2.659 1.00 17.71 C ATOM 2249 O GLY C 41 41.896 26.783 3.616 1.00 19.07 O ATOM 2250 H GLY C 41 40.217 25.573 4.871 1.00 0.00 H ATOM 2251 N SER C 42 41.277 27.239 1.485 1.00 19.07 N ATOM 2252 CA SER C 42 42.456 28.024 1.173 1.00 20.33 C ATOM 2253 C SER C 42 42.232 29.532 1.091 1.00 20.86 C ATOM 2254 O SER C 42 43.213 30.262 0.940 1.00 23.18 O ATOM 2255 CB SER C 42 43.059 27.527 -0.150 1.00 23.12 C ATOM 2256 OG SER C 42 43.583 26.220 -0.023 1.00 24.26 O ATOM 2257 HG SER C 42 42.859 25.600 0.244 1.00 0.00 H ATOM 2258 H SER C 42 40.522 27.158 0.774 1.00 0.00 H ATOM 2259 N ARG C 43 40.997 30.034 1.183 1.00 21.10 N ATOM 2260 CA ARG C 43 40.802 31.479 1.057 1.00 21.68 C ATOM 2261 C ARG C 43 41.240 32.228 2.311 1.00 22.43 C ATOM 2262 O ARG C 43 41.580 33.421 2.245 1.00 23.71 O ATOM 2263 CB ARG C 43 39.341 31.807 0.778 1.00 20.70 C ATOM 2264 CG ARG C 43 38.819 31.318 -0.527 1.00 21.42 C ATOM 2265 CD ARG C 43 37.608 32.101 -0.927 1.00 22.20 C ATOM 2266 NE ARG C 43 36.444 31.901 -0.071 1.00 20.43 N ATOM 2267 CZ ARG C 43 35.779 32.873 0.546 1.00 19.28 C ATOM 2268 NH1 ARG C 43 36.177 34.135 0.470 1.00 19.46 N ATOM 2269 NH2 ARG C 43 34.696 32.569 1.241 1.00 18.86 N ATOM 2270 HE ARG C 43 36.110 30.926 0.067 1.00 0.00 H ATOM 2271 HH12 ARG C 43 35.642 34.880 0.961 1.00 0.00 H ATOM 2272 HH11 ARG C 43 37.025 34.381 -0.080 1.00 0.00 H ATOM 2273 HH22 ARG C 43 34.164 33.318 1.730 1.00 0.00 H ATOM 2274 HH21 ARG C 43 34.376 31.581 1.299 1.00 0.00 H ATOM 2275 H ARG C 43 40.184 29.405 1.342 1.00 0.00 H ATOM 2276 N ASN C 44 41.189 31.550 3.457 1.00 21.07 N ATOM 2277 CA ASN C 44 41.655 32.059 4.744 1.00 21.94 C ATOM 2278 C ASN C 44 40.939 33.346 5.145 1.00 21.58 C ATOM 2279 O ASN C 44 41.553 34.383 5.420 1.00 24.99 O ATOM 2280 CB ASN C 44 43.177 32.196 4.769 1.00 24.45 C ATOM 2281 CG ASN C 44 43.873 30.884 4.475 1.00 26.02 C ATOM 2282 OD1 ASN C 44 43.291 29.804 4.655 1.00 25.07 O ATOM 2283 ND2 ASN C 44 45.119 30.959 4.032 1.00 28.96 N ATOM 2284 HD22 ASN C 44 45.567 31.887 3.896 1.00 0.00 H ATOM 2285 HD21 ASN C 44 45.649 30.089 3.820 1.00 0.00 H ATOM 2286 H ASN C 44 40.789 30.590 3.433 1.00 0.00 H ATOM 2287 N VAL C 45 39.612 33.243 5.214 1.00 19.63 N ATOM 2288 CA VAL C 45 38.771 34.375 5.567 1.00 19.22 C ATOM 2289 C VAL C 45 37.899 34.114 6.792 1.00 19.36 C ATOM 2290 O VAL C 45 37.068 34.953 7.134 1.00 21.65 O ATOM 2291 CB VAL C 45 37.896 34.827 4.380 1.00 19.85 C ATOM 2292 CG1 VAL C 45 38.741 35.272 3.189 1.00 21.79 C ATOM 2293 CG2 VAL C 45 36.928 33.703 3.993 1.00 20.22 C ATOM 2294 H VAL C 45 39.165 32.326 5.009 1.00 0.00 H ATOM 2295 N ARG C 46 38.073 32.980 7.479 1.00 18.56 N ATOM 2296 CA ARG C 46 37.138 32.594 8.538 1.00 17.77 C ATOM 2297 C ARG C 46 36.951 33.706 9.575 1.00 17.87 C ATOM 2298 O ARG C 46 37.923 34.264 10.101 1.00 19.99 O ATOM 2299 CB ARG C 46 37.633 31.331 9.247 1.00 18.86 C ATOM 2300 CG ARG C 46 36.670 30.847 10.328 1.00 18.67 C ATOM 2301 CD ARG C 46 36.798 29.382 10.644 1.00 19.20 C ATOM 2302 NE ARG C 46 36.501 28.532 9.493 1.00 17.51 N ATOM 2303 CZ ARG C 46 35.376 27.840 9.314 1.00 16.03 C ATOM 2304 NH1 ARG C 46 34.384 27.888 10.202 1.00 17.42 N ATOM 2305 NH2 ARG C 46 35.248 27.087 8.219 1.00 16.85 N ATOM 2306 HE ARG C 46 37.228 28.461 8.752 1.00 0.00 H ATOM 2307 HH12 ARG C 46 33.515 27.339 10.041 1.00 0.00 H ATOM 2308 HH11 ARG C 46 34.478 28.474 11.056 1.00 0.00 H ATOM 2309 HH22 ARG C 46 34.377 26.540 8.063 1.00 0.00 H ATOM 2310 HH21 ARG C 46 36.019 27.047 7.522 1.00 0.00 H ATOM 2311 H ARG C 46 38.882 32.365 7.259 1.00 0.00 H ATOM 2312 N SER C 47 35.696 33.991 9.919 1.00 18.75 N ATOM 2313 CA SER C 47 35.400 35.167 10.732 1.00 19.17 C ATOM 2314 C SER C 47 35.948 35.018 12.142 1.00 20.17 C ATOM 2315 O SER C 47 36.295 36.019 12.766 1.00 22.95 O ATOM 2316 CB SER C 47 33.909 35.546 10.666 1.00 20.42 C ATOM 2317 OG SER C 47 33.138 34.587 11.451 1.00 20.34 O ATOM 2318 HG SER C 47 33.268 33.678 11.080 1.00 0.00 H ATOM 2319 H SER C 47 34.922 33.371 9.606 1.00 0.00 H ATOM 2320 N THR C 48 36.078 33.796 12.630 1.00 20.42 N ATOM 2321 CA THR C 48 36.571 33.523 13.966 1.00 21.14 C ATOM 2322 C THR C 48 38.065 33.198 13.985 1.00 22.20 C ATOM 2323 O THR C 48 38.595 32.831 15.043 1.00 24.25 O ATOM 2324 CB THR C 48 35.763 32.363 14.555 1.00 22.51 C ATOM 2325 OG1 THR C 48 35.801 31.242 13.653 1.00 22.11 O ATOM 2326 CG2 THR C 48 34.294 32.779 14.759 1.00 25.70 C ATOM 2327 HG1 THR C 48 35.411 31.507 12.782 1.00 0.00 H ATOM 2328 H THR C 48 35.814 32.992 12.026 1.00 0.00 H ATOM 2329 N GLY C 49 38.739 33.293 12.837 1.00 21.41 N ATOM 2330 CA GLY C 49 40.170 33.108 12.730 1.00 22.85 C ATOM 2331 C GLY C 49 40.562 31.666 12.465 1.00 23.31 C ATOM 2332 O GLY C 49 39.744 30.743 12.500 1.00 26.49 O ATOM 2333 H GLY C 49 38.206 33.512 11.971 1.00 0.00 H ATOM 2334 N GLU C 50 41.846 31.482 12.148 1.00 20.86 N ATOM 2335 CA GLU C 50 42.503 30.173 12.028 1.00 23.32 C ATOM 2336 C GLU C 50 43.882 30.166 12.694 1.00 20.73 C ATOM 2337 O GLU C 50 44.608 31.169 12.610 1.00 31.15 O ATOM 2338 CB GLU C 50 42.714 29.796 10.547 1.00 24.03 C ATOM 2339 CG GLU C 50 41.485 29.821 9.636 1.00 24.71 C ATOM 2340 CD GLU C 50 41.762 29.276 8.223 1.00 25.02 C ATOM 2341 OE1 GLU C 50 42.770 28.572 7.998 1.00 27.46 O ATOM 2342 OE2 GLU C 50 40.949 29.571 7.318 1.00 19.93 O ATOM 2343 H GLU C 50 42.424 32.328 11.973 1.00 0.00 H ATOM 2344 N PRO C 51 44.291 29.064 13.333 1.00 25.09 N ATOM 2345 CA PRO C 51 45.636 28.999 13.924 1.00 26.86 C ATOM 2346 C PRO C 51 46.682 28.566 12.900 1.00 28.15 C ATOM 2347 O PRO C 51 46.378 28.125 11.791 1.00 29.53 O ATOM 2348 CB PRO C 51 45.472 27.936 15.012 1.00 27.07 C ATOM 2349 CG PRO C 51 44.457 26.959 14.364 1.00 25.95 C ATOM 2350 CD PRO C 51 43.485 27.869 13.660 1.00 25.94 C ATOM 2351 N SER C 52 47.948 28.686 13.312 1.00 29.32 N ATOM 2352 CA SER C 52 49.065 28.360 12.432 1.00 32.44 C ATOM 2353 C SER C 52 49.047 26.894 12.030 1.00 31.94 C ATOM 2354 O SER C 52 49.296 26.555 10.865 1.00 34.90 O ATOM 2355 CB SER C 52 50.378 28.715 13.128 1.00 35.17 C ATOM 2356 OG SER C 52 50.624 27.818 14.201 1.00 37.89 O ATOM 2357 HG SER C 52 51.477 28.059 14.642 1.00 0.00 H ATOM 2358 H SER C 52 48.140 29.018 14.279 1.00 0.00 H ATOM 2359 N VAL C 53 48.768 26.013 12.986 1.00 30.14 N ATOM 2360 CA VAL C 53 48.664 24.584 12.723 1.00 27.73 C ATOM 2361 C VAL C 53 47.180 24.310 12.500 1.00 26.93 C ATOM 2362 O VAL C 53 46.389 24.296 13.443 1.00 23.66 O ATOM 2363 CB VAL C 53 49.255 23.763 13.870 1.00 29.22 C ATOM 2364 CG1 VAL C 53 49.183 22.286 13.554 1.00 30.62 C ATOM 2365 CG2 VAL C 53 50.694 24.189 14.104 1.00 30.90 C ATOM 2366 H VAL C 53 48.619 26.356 13.956 1.00 0.00 H ATOM 2367 N SER C 54 46.791 24.154 11.236 1.00 28.03 N ATOM 2368 CA SER C 54 45.382 24.056 10.883 1.00 29.67 C ATOM 2369 C SER C 54 44.779 22.738 11.361 1.00 27.23 C ATOM 2370 O SER C 54 45.467 21.735 11.597 1.00 29.50 O ATOM 2371 CB SER C 54 45.200 24.215 9.363 1.00 34.26 C ATOM 2372 OG SER C 54 43.860 24.468 8.936 1.00 36.64 O ATOM 2373 HG SER C 54 43.840 24.555 7.950 1.00 0.00 H ATOM 2374 H SER C 54 47.509 24.101 10.485 1.00 0.00 H ATOM 2375 N HIS C 55 43.463 22.775 11.519 1.00 24.16 N ATOM 2376 CA HIS C 55 42.642 21.630 11.875 1.00 21.66 C ATOM 2377 C HIS C 55 41.274 21.875 11.253 1.00 20.26 C ATOM 2378 O HIS C 55 41.004 22.959 10.745 1.00 21.24 O ATOM 2379 CB HIS C 55 42.534 21.518 13.390 1.00 23.87 C ATOM 2380 CG HIS C 55 41.963 22.734 14.043 1.00 25.73 C ATOM 2381 ND1 HIS C 55 40.610 22.992 14.090 1.00 26.42 N ATOM 2382 CD2 HIS C 55 42.564 23.761 14.687 1.00 27.13 C ATOM 2383 CE1 HIS C 55 40.401 24.119 14.751 1.00 27.64 C ATOM 2384 NE2 HIS C 55 41.572 24.608 15.121 1.00 28.08 N ATOM 2385 H HIS C 55 42.985 23.688 11.378 1.00 0.00 H ATOM 2386 N ALA C 56 40.402 20.867 11.265 1.00 19.49 N ATOM 2387 CA ALA C 56 39.089 21.065 10.643 1.00 18.37 C ATOM 2388 C ALA C 56 38.260 22.064 11.450 1.00 17.64 C ATOM 2389 O ALA C 56 38.298 22.043 12.681 1.00 20.03 O ATOM 2390 CB ALA C 56 38.356 19.732 10.520 1.00 21.19 C ATOM 2391 H ALA C 56 40.648 19.958 11.707 1.00 0.00 H ATOM 2392 N TYR C 57 37.527 22.953 10.761 1.00 15.96 N ATOM 2393 CA TYR C 57 36.695 24.000 11.352 1.00 16.12 C ATOM 2394 C TYR C 57 35.213 23.679 11.190 1.00 16.48 C ATOM 2395 O TYR C 57 34.816 22.937 10.292 1.00 18.85 O ATOM 2396 CB TYR C 57 36.999 25.374 10.736 1.00 17.28 C ATOM 2397 CG TYR C 57 38.496 25.689 10.785 1.00 19.33 C ATOM 2398 CD1 TYR C 57 39.138 26.044 11.965 1.00 22.93 C ATOM 2399 CD2 TYR C 57 39.272 25.561 9.650 1.00 20.01 C ATOM 2400 CE1 TYR C 57 40.525 26.293 11.980 1.00 24.62 C ATOM 2401 CE2 TYR C 57 40.624 25.783 9.645 1.00 22.41 C ATOM 2402 CZ TYR C 57 41.252 26.144 10.809 1.00 23.43 C ATOM 2403 OH TYR C 57 42.609 26.366 10.815 1.00 26.75 O ATOM 2404 HH TYR C 57 43.078 25.541 10.534 1.00 0.00 H ATOM 2405 H TYR C 57 37.553 22.892 9.723 1.00 0.00 H ATOM 2406 N SER C 58 34.397 24.265 12.057 1.00 17.91 N ATOM 2407 CA SER C 58 32.982 23.919 12.118 1.00 17.72 C ATOM 2408 C SER C 58 32.186 24.631 11.034 1.00 16.27 C ATOM 2409 O SER C 58 32.219 25.865 10.930 1.00 18.34 O ATOM 2410 CB SER C 58 32.412 24.291 13.485 1.00 19.72 C ATOM 2411 OG SER C 58 32.928 23.461 14.508 1.00 22.86 O ATOM 2412 HG SER C 58 32.538 23.730 15.377 1.00 0.00 H ATOM 2413 H SER C 58 34.774 24.985 12.706 1.00 0.00 H ATOM 2414 N ASN C 59 31.424 23.847 10.268 1.00 15.20 N ATOM 2415 CA ASN C 59 30.651 24.330 9.138 1.00 14.87 C ATOM 2416 C ASN C 59 29.236 23.762 9.154 1.00 14.43 C ATOM 2417 O ASN C 59 28.884 22.881 9.943 1.00 14.92 O ATOM 2418 CB ASN C 59 31.306 23.895 7.818 1.00 15.92 C ATOM 2419 CG ASN C 59 32.648 24.535 7.590 1.00 15.69 C ATOM 2420 OD1 ASN C 59 32.913 25.631 8.073 1.00 18.08 O ATOM 2421 ND2 ASN C 59 33.497 23.874 6.826 1.00 15.95 N ATOM 2422 HD22 ASN C 59 33.233 22.947 6.436 1.00 0.00 H ATOM 2423 HD21 ASN C 59 34.431 24.280 6.614 1.00 0.00 H ATOM 2424 H ASN C 59 31.382 22.833 10.494 1.00 0.00 H ATOM 2425 N ILE C 60 28.436 24.253 8.215 1.00 15.13 N ATOM 2426 CA ILE C 60 27.196 23.611 7.815 1.00 14.59 C ATOM 2427 C ILE C 60 27.208 23.481 6.297 1.00 14.17 C ATOM 2428 O ILE C 60 27.847 24.268 5.586 1.00 14.77 O ATOM 2429 CB ILE C 60 25.967 24.397 8.301 1.00 17.15 C ATOM 2430 CG1 ILE C 60 26.139 25.861 7.873 1.00 21.85 C ATOM 2431 CG2 ILE C 60 25.833 24.240 9.812 1.00 17.62 C ATOM 2432 CD1 ILE C 60 25.149 26.829 8.387 1.00 23.21 C ATOM 2433 H ILE C 60 28.710 25.139 7.744 1.00 0.00 H ATOM 2434 N LYS C 61 26.508 22.452 5.808 1.00 13.58 N ATOM 2435 CA LYS C 61 26.342 22.197 4.382 1.00 12.68 C ATOM 2436 C LYS C 61 24.856 22.275 4.072 1.00 12.51 C ATOM 2437 O LYS C 61 24.071 21.484 4.597 1.00 13.94 O ATOM 2438 CB LYS C 61 26.880 20.814 3.996 1.00 13.51 C ATOM 2439 CG LYS C 61 26.561 20.434 2.561 1.00 13.59 C ATOM 2440 CD LYS C 61 27.084 19.062 2.166 1.00 15.48 C ATOM 2441 CE LYS C 61 26.584 18.673 0.798 1.00 16.83 C ATOM 2442 NZ LYS C 61 27.009 17.304 0.403 1.00 18.76 N ATOM 2443 HZ1 LYS C 61 28.048 17.255 0.390 1.00 0.00 H ATOM 2444 HZ2 LYS C 61 26.637 16.616 1.088 1.00 0.00 H ATOM 2445 HZ3 LYS C 61 26.639 17.087 -0.544 1.00 0.00 H ATOM 2446 H LYS C 61 26.058 21.799 6.481 1.00 0.00 H ATOM 2447 N PHE C 62 24.473 23.221 3.210 1.00 12.47 N ATOM 2448 CA PHE C 62 23.121 23.303 2.686 1.00 12.84 C ATOM 2449 C PHE C 62 23.068 22.648 1.318 1.00 12.90 C ATOM 2450 O PHE C 62 23.993 22.793 0.504 1.00 13.13 O ATOM 2451 CB PHE C 62 22.700 24.748 2.446 1.00 14.00 C ATOM 2452 CG PHE C 62 22.505 25.558 3.693 1.00 15.03 C ATOM 2453 CD1 PHE C 62 23.552 26.289 4.237 1.00 16.35 C ATOM 2454 CD2 PHE C 62 21.254 25.656 4.281 1.00 16.30 C ATOM 2455 CE1 PHE C 62 23.367 27.084 5.356 1.00 17.82 C ATOM 2456 CE2 PHE C 62 21.059 26.444 5.411 1.00 17.80 C ATOM 2457 CZ PHE C 62 22.122 27.161 5.939 1.00 18.08 C ATOM 2458 H PHE C 62 25.171 23.927 2.902 1.00 0.00 H ATOM 2459 N GLU C 63 21.929 22.021 1.039 1.00 12.73 N ATOM 2460 CA GLU C 63 21.552 21.550 -0.286 1.00 12.46 C ATOM 2461 C GLU C 63 20.179 22.131 -0.598 1.00 12.55 C ATOM 2462 O GLU C 63 19.250 21.959 0.209 1.00 13.49 O ATOM 2463 CB GLU C 63 21.453 20.031 -0.300 1.00 15.94 C ATOM 2464 CG GLU C 63 22.749 19.318 -0.005 1.00 18.07 C ATOM 2465 CD GLU C 63 22.677 17.838 -0.381 1.00 23.02 C ATOM 2466 OE1 GLU C 63 21.555 17.349 -0.625 1.00 25.48 O ATOM 2467 OE2 GLU C 63 23.728 17.170 -0.447 1.00 27.05 O ATOM 2468 H GLU C 63 21.262 21.856 1.820 1.00 0.00 H ATOM 2469 N VAL C 64 20.045 22.806 -1.731 1.00 12.13 N ATOM 2470 CA VAL C 64 18.795 23.432 -2.135 1.00 12.47 C ATOM 2471 C VAL C 64 18.457 22.963 -3.543 1.00 12.36 C ATOM 2472 O VAL C 64 19.208 23.238 -4.487 1.00 13.09 O ATOM 2473 CB VAL C 64 18.886 24.966 -2.103 1.00 13.92 C ATOM 2474 CG1 VAL C 64 17.521 25.579 -2.410 1.00 15.29 C ATOM 2475 CG2 VAL C 64 19.441 25.456 -0.778 1.00 15.37 C ATOM 2476 H VAL C 64 20.870 22.892 -2.359 1.00 0.00 H ATOM 2477 N LEU C 65 17.325 22.283 -3.692 1.00 12.63 N ATOM 2478 CA LEU C 65 16.841 21.862 -5.001 1.00 13.04 C ATOM 2479 C LEU C 65 15.945 22.955 -5.551 1.00 13.11 C ATOM 2480 O LEU C 65 15.051 23.443 -4.846 1.00 14.69 O ATOM 2481 CB LEU C 65 16.054 20.559 -4.902 1.00 14.12 C ATOM 2482 CG LEU C 65 16.801 19.365 -4.337 1.00 16.22 C ATOM 2483 CD1 LEU C 65 15.856 18.198 -4.160 1.00 21.09 C ATOM 2484 CD2 LEU C 65 17.959 18.984 -5.214 1.00 16.34 C ATOM 2485 H LEU C 65 16.767 22.044 -2.848 1.00 0.00 H ATOM 2486 N THR C 66 16.148 23.311 -6.822 1.00 13.84 N ATOM 2487 CA THR C 66 15.373 24.357 -7.481 1.00 14.50 C ATOM 2488 C THR C 66 14.870 23.876 -8.837 1.00 15.30 C ATOM 2489 O THR C 66 15.537 23.115 -9.538 1.00 16.04 O ATOM 2490 CB THR C 66 16.181 25.646 -7.657 1.00 15.76 C ATOM 2491 OG1 THR C 66 17.274 25.428 -8.552 1.00 16.57 O ATOM 2492 CG2 THR C 66 16.743 26.142 -6.340 1.00 15.91 C ATOM 2493 HG1 THR C 66 16.925 25.142 -9.433 1.00 0.00 H ATOM 2494 H THR C 66 16.889 22.823 -7.364 1.00 0.00 H ATOM 2495 N ALA C 67 13.686 24.348 -9.209 1.00 16.69 N ATOM 2496 CA ALA C 67 13.086 23.943 -10.474 1.00 17.80 C ATOM 2497 C ALA C 67 13.706 24.634 -11.677 1.00 17.62 C ATOM 2498 O ALA C 67 13.431 24.233 -12.814 1.00 19.67 O ATOM 2499 CB ALA C 67 11.584 24.219 -10.449 1.00 21.53 C ATOM 2500 H ALA C 67 13.181 25.014 -8.591 1.00 0.00 H ATOM 2501 N SER C 68 14.506 25.673 -11.469 1.00 18.14 N ATOM 2502 CA SER C 68 15.184 26.378 -12.542 1.00 18.43 C ATOM 2503 C SER C 68 16.624 26.658 -12.136 1.00 17.85 C ATOM 2504 O SER C 68 16.944 26.806 -10.947 1.00 17.78 O ATOM 2505 CB SER C 68 14.494 27.707 -12.853 1.00 20.26 C ATOM 2506 OG SER C 68 14.623 28.607 -11.755 1.00 20.01 O ATOM 2507 HG SER C 68 14.205 28.208 -10.952 1.00 0.00 H ATOM 2508 H SER C 68 14.654 25.997 -10.492 1.00 0.00 H ATOM 2509 N ARG C 69 17.487 26.775 -13.151 1.00 19.15 N ATOM 2510 CA ARG C 69 18.853 27.214 -12.893 1.00 19.27 C ATOM 2511 C ARG C 69 18.863 28.645 -12.382 1.00 18.67 C ATOM 2512 O ARG C 69 19.674 29.006 -11.521 1.00 19.25 O ATOM 2513 CB ARG C 69 19.680 27.108 -14.175 1.00 21.36 C ATOM 2514 CG ARG C 69 21.082 27.657 -14.044 1.00 23.59 C ATOM 2515 CD ARG C 69 21.838 26.943 -12.973 1.00 25.04 C ATOM 2516 NE ARG C 69 23.146 27.540 -12.723 1.00 28.35 N ATOM 2517 CZ ARG C 69 24.289 27.064 -13.197 1.00 30.22 C ATOM 2518 NH1 ARG C 69 24.272 25.982 -13.960 1.00 30.11 N ATOM 2519 NH2 ARG C 69 25.442 27.663 -12.903 1.00 32.45 N ATOM 2520 HE ARG C 69 23.184 28.396 -12.134 1.00 0.00 H ATOM 2521 HH12 ARG C 69 25.162 25.598 -14.338 1.00 0.00 H ATOM 2522 HH11 ARG C 69 23.369 25.516 -14.181 1.00 0.00 H ATOM 2523 HH22 ARG C 69 26.335 27.284 -13.278 1.00 0.00 H ATOM 2524 HH21 ARG C 69 25.449 28.509 -12.298 1.00 0.00 H ATOM 2525 H ARG C 69 17.185 26.554 -14.121 1.00 0.00 H ATOM 2526 N GLU C 70 17.932 29.443 -12.912 1.00 18.50 N ATOM 2527 CA GLU C 70 17.747 30.881 -12.586 1.00 19.52 C ATOM 2528 C GLU C 70 17.621 31.065 -11.070 1.00 18.02 C ATOM 2529 O GLU C 70 18.294 31.969 -10.537 1.00 18.34 O ATOM 2530 CB GLU C 70 16.510 31.430 -13.299 1.00 22.64 C ATOM 2531 CG GLU C 70 16.736 31.710 -14.774 1.00 25.20 C ATOM 2532 CD GLU C 70 16.827 30.470 -15.645 1.00 27.34 C ATOM 2533 OE1 GLU C 70 17.512 30.528 -16.685 1.00 31.65 O ATOM 2534 OE2 GLU C 70 16.213 29.446 -15.281 1.00 26.31 O ATOM 2535 H GLU C 70 17.284 29.024 -13.609 1.00 0.00 H ATOM 2536 N LEU C 71 16.797 30.250 -10.399 1.00 17.38 N ATOM 2537 CA LEU C 71 16.582 30.383 -8.964 1.00 16.69 C ATOM 2538 C LEU C 71 17.819 29.945 -8.179 1.00 16.28 C ATOM 2539 O LEU C 71 18.196 30.589 -7.190 1.00 16.24 O ATOM 2540 CB LEU C 71 15.351 29.586 -8.539 1.00 17.63 C ATOM 2541 CG LEU C 71 15.065 29.607 -7.037 1.00 18.75 C ATOM 2542 CD1 LEU C 71 14.848 31.025 -6.533 1.00 20.67 C ATOM 2543 CD2 LEU C 71 13.859 28.732 -6.728 1.00 20.61 C ATOM 2544 H LEU C 71 16.296 29.500 -10.917 1.00 0.00 H ATOM 2545 N ALA C 72 18.469 28.857 -8.593 1.00 15.49 N ATOM 2546 CA ALA C 72 19.710 28.459 -7.935 1.00 14.95 C ATOM 2547 C ALA C 72 20.749 29.572 -8.024 1.00 15.82 C ATOM 2548 O ALA C 72 21.422 29.894 -7.035 1.00 15.94 O ATOM 2549 CB ALA C 72 20.256 27.183 -8.563 1.00 15.59 C ATOM 2550 H ALA C 72 18.093 28.294 -9.382 1.00 0.00 H ATOM 2551 N ASP C 73 20.882 30.185 -9.206 1.00 16.62 N ATOM 2552 CA ASP C 73 21.855 31.256 -9.386 1.00 17.60 C ATOM 2553 C ASP C 73 21.527 32.446 -8.493 1.00 17.27 C ATOM 2554 O ASP C 73 22.425 33.099 -7.951 1.00 17.58 O ATOM 2555 CB ASP C 73 21.868 31.738 -10.845 1.00 20.64 C ATOM 2556 CG ASP C 73 22.524 30.768 -11.804 1.00 25.06 C ATOM 2557 OD1 ASP C 73 23.325 29.916 -11.370 1.00 25.65 O ATOM 2558 OD2 ASP C 73 22.250 30.894 -13.018 1.00 29.55 O ATOM 2559 H ASP C 73 20.284 29.894 -10.006 1.00 0.00 H ATOM 2560 N GLN C 74 20.240 32.761 -8.353 1.00 17.36 N ATOM 2561 CA GLN C 74 19.830 33.899 -7.543 1.00 17.89 C ATOM 2562 C GLN C 74 20.153 33.686 -6.071 1.00 16.51 C ATOM 2563 O GLN C 74 20.650 34.598 -5.397 1.00 17.62 O ATOM 2564 CB GLN C 74 18.334 34.141 -7.708 1.00 19.61 C ATOM 2565 CG GLN C 74 17.818 35.304 -6.871 1.00 26.25 C ATOM 2566 CD GLN C 74 16.311 35.484 -6.959 1.00 30.63 C ATOM 2567 OE1 GLN C 74 15.809 36.220 -7.811 1.00 33.15 O ATOM 2568 NE2 GLN C 74 15.582 34.817 -6.070 1.00 32.22 N ATOM 2569 HE22 GLN C 74 16.048 34.207 -5.368 1.00 0.00 H ATOM 2570 HE21 GLN C 74 14.546 34.905 -6.076 1.00 0.00 H ATOM 2571 H GLN C 74 19.517 32.185 -8.830 1.00 0.00 H ATOM 2572 N ILE C 75 19.831 32.504 -5.542 1.00 16.03 N ATOM 2573 CA ILE C 75 20.137 32.212 -4.146 1.00 15.60 C ATOM 2574 C ILE C 75 21.640 32.258 -3.930 1.00 16.01 C ATOM 2575 O ILE C 75 22.138 32.855 -2.966 1.00 16.48 O ATOM 2576 CB ILE C 75 19.541 30.853 -3.740 1.00 15.42 C ATOM 2577 CG1 ILE C 75 18.016 30.905 -3.791 1.00 16.86 C ATOM 2578 CG2 ILE C 75 20.027 30.464 -2.339 1.00 16.09 C ATOM 2579 CD1 ILE C 75 17.339 29.553 -3.686 1.00 18.44 C ATOM 2580 H ILE C 75 19.359 31.787 -6.129 1.00 0.00 H ATOM 2581 N GLN C 76 22.384 31.611 -4.828 1.00 15.25 N ATOM 2582 CA GLN C 76 23.836 31.597 -4.735 1.00 15.41 C ATOM 2583 C GLN C 76 24.383 33.016 -4.716 1.00 16.19 C ATOM 2584 O GLN C 76 25.235 33.367 -3.893 1.00 17.28 O ATOM 2585 CB GLN C 76 24.410 30.815 -5.913 1.00 15.34 C ATOM 2586 CG GLN C 76 25.912 30.701 -5.882 1.00 15.95 C ATOM 2587 CD GLN C 76 26.419 29.926 -7.065 1.00 16.96 C ATOM 2588 OE1 GLN C 76 27.039 28.863 -6.928 1.00 19.04 O ATOM 2589 NE2 GLN C 76 26.125 30.420 -8.243 1.00 18.31 N ATOM 2590 HE22 GLN C 76 25.602 31.316 -8.315 1.00 0.00 H ATOM 2591 HE21 GLN C 76 26.414 29.916 -9.105 1.00 0.00 H ATOM 2592 H GLN C 76 21.918 31.107 -5.609 1.00 0.00 H ATOM 2593 N ASP C 77 23.881 33.863 -5.607 1.00 16.64 N ATOM 2594 CA ASP C 77 24.413 35.216 -5.700 1.00 17.36 C ATOM 2595 C ASP C 77 24.093 36.036 -4.456 1.00 17.69 C ATOM 2596 O ASP C 77 24.896 36.880 -4.044 1.00 18.43 O ATOM 2597 CB ASP C 77 23.867 35.913 -6.939 1.00 19.50 C ATOM 2598 CG ASP C 77 24.361 37.331 -7.050 1.00 24.06 C ATOM 2599 OD1 ASP C 77 25.561 37.510 -7.338 1.00 26.93 O ATOM 2600 OD2 ASP C 77 23.557 38.263 -6.832 1.00 25.87 O ATOM 2601 H ASP C 77 23.110 33.561 -6.237 1.00 0.00 H ATOM 2602 N LYS C 78 22.914 35.835 -3.868 1.00 17.82 N ATOM 2603 CA LYS C 78 22.573 36.573 -2.658 1.00 18.72 C ATOM 2604 C LYS C 78 23.460 36.166 -1.489 1.00 17.85 C ATOM 2605 O LYS C 78 23.918 37.025 -0.723 1.00 19.23 O ATOM 2606 CB LYS C 78 21.102 36.359 -2.317 1.00 20.29 C ATOM 2607 CG LYS C 78 20.150 37.142 -3.192 1.00 23.39 C ATOM 2608 CD LYS C 78 18.712 37.068 -2.696 1.00 29.64 C ATOM 2609 CE LYS C 78 17.788 37.980 -3.506 1.00 33.44 C ATOM 2610 NZ LYS C 78 18.405 39.307 -3.824 1.00 36.06 N ATOM 2611 HZ1 LYS C 78 18.639 39.800 -2.939 1.00 0.00 H ATOM 2612 HZ2 LYS C 78 19.271 39.161 -4.380 1.00 0.00 H ATOM 2613 HZ3 LYS C 78 17.731 39.878 -4.373 1.00 0.00 H ATOM 2614 H LYS C 78 22.239 35.154 -4.271 1.00 0.00 H ATOM 2615 N VAL C 79 23.708 34.866 -1.320 1.00 16.98 N ATOM 2616 CA VAL C 79 24.574 34.408 -0.237 1.00 17.28 C ATOM 2617 C VAL C 79 25.996 34.922 -0.440 1.00 17.63 C ATOM 2618 O VAL C 79 26.632 35.434 0.490 1.00 18.81 O ATOM 2619 CB VAL C 79 24.523 32.875 -0.125 1.00 18.39 C ATOM 2620 CG1 VAL C 79 25.578 32.384 0.862 1.00 19.35 C ATOM 2621 CG2 VAL C 79 23.131 32.413 0.290 1.00 19.06 C ATOM 2622 H VAL C 79 23.280 34.172 -1.966 1.00 0.00 H ATOM 2623 N VAL C 80 26.515 34.791 -1.661 1.00 17.50 N ATOM 2624 CA VAL C 80 27.889 35.184 -1.945 1.00 18.13 C ATOM 2625 C VAL C 80 28.064 36.688 -1.775 1.00 19.27 C ATOM 2626 O VAL C 80 29.024 37.150 -1.145 1.00 19.66 O ATOM 2627 CB VAL C 80 28.291 34.683 -3.342 1.00 20.65 C ATOM 2628 CG1 VAL C 80 29.540 35.373 -3.836 1.00 22.19 C ATOM 2629 CG2 VAL C 80 28.461 33.166 -3.306 1.00 21.43 C ATOM 2630 H VAL C 80 25.928 34.401 -2.426 1.00 0.00 H ATOM 2631 N ALA C 81 27.125 37.473 -2.307 1.00 19.55 N ATOM 2632 CA ALA C 81 27.242 38.923 -2.214 1.00 20.94 C ATOM 2633 C ALA C 81 27.252 39.376 -0.760 1.00 22.23 C ATOM 2634 O ALA C 81 27.970 40.317 -0.400 1.00 24.23 O ATOM 2635 CB ALA C 81 26.099 39.594 -2.972 1.00 22.11 C ATOM 2636 H ALA C 81 26.307 37.049 -2.789 1.00 0.00 H ATOM 2637 N LYS C 82 26.467 38.718 0.090 1.00 22.38 N ATOM 2638 CA LYS C 82 26.345 39.159 1.473 1.00 23.07 C ATOM 2639 C LYS C 82 27.497 38.664 2.342 1.00 23.29 C ATOM 2640 O LYS C 82 27.954 39.395 3.230 1.00 25.54 O ATOM 2641 CB LYS C 82 25.013 38.672 2.045 1.00 26.45 C ATOM 2642 CG LYS C 82 24.379 39.603 3.067 1.00 32.34 C ATOM 2643 CD LYS C 82 22.921 39.216 3.329 1.00 36.36 C ATOM 2644 CE LYS C 82 21.980 40.413 3.202 1.00 39.70 C ATOM 2645 NZ LYS C 82 22.237 41.448 4.244 1.00 41.18 N ATOM 2646 HZ1 LYS C 82 22.102 41.030 5.187 1.00 0.00 H ATOM 2647 HZ2 LYS C 82 23.213 41.794 4.154 1.00 0.00 H ATOM 2648 HZ3 LYS C 82 21.574 42.239 4.116 1.00 0.00 H ATOM 2649 H LYS C 82 25.938 37.884 -0.235 1.00 0.00 H ATOM 2650 N TYR C 83 27.974 37.434 2.126 1.00 21.27 N ATOM 2651 CA TYR C 83 28.825 36.777 3.113 1.00 21.04 C ATOM 2652 C TYR C 83 30.179 36.271 2.617 1.00 20.23 C ATOM 2653 O TYR C 83 31.052 36.042 3.454 1.00 21.80 O ATOM 2654 CB TYR C 83 28.070 35.601 3.766 1.00 22.10 C ATOM 2655 CG TYR C 83 26.831 36.041 4.516 1.00 21.68 C ATOM 2656 CD1 TYR C 83 26.927 36.958 5.550 1.00 23.48 C ATOM 2657 CD2 TYR C 83 25.569 35.570 4.180 1.00 23.73 C ATOM 2658 CE1 TYR C 83 25.814 37.401 6.228 1.00 24.89 C ATOM 2659 CE2 TYR C 83 24.438 35.998 4.872 1.00 25.04 C ATOM 2660 CZ TYR C 83 24.572 36.918 5.893 1.00 25.15 C ATOM 2661 OH TYR C 83 23.476 37.379 6.597 1.00 27.80 O ATOM 2662 HH TYR C 83 23.775 38.027 7.283 1.00 0.00 H ATOM 2663 H TYR C 83 27.736 36.939 1.243 1.00 0.00 H ATOM 2664 N PHE C 84 30.393 36.085 1.314 1.00 19.88 N ATOM 2665 CA PHE C 84 31.580 35.363 0.853 1.00 19.59 C ATOM 2666 C PHE C 84 32.877 36.060 1.266 1.00 19.52 C ATOM 2667 O PHE C 84 33.872 35.396 1.572 1.00 20.33 O ATOM 2668 CB PHE C 84 31.474 35.210 -0.663 1.00 20.09 C ATOM 2669 CG PHE C 84 32.599 34.465 -1.317 1.00 21.60 C ATOM 2670 CD1 PHE C 84 32.562 33.088 -1.441 1.00 24.91 C ATOM 2671 CD2 PHE C 84 33.665 35.154 -1.861 1.00 23.43 C ATOM 2672 CE1 PHE C 84 33.584 32.413 -2.086 1.00 26.35 C ATOM 2673 CE2 PHE C 84 34.685 34.484 -2.507 1.00 25.73 C ATOM 2674 CZ PHE C 84 34.643 33.115 -2.616 1.00 26.32 C ATOM 2675 H PHE C 84 29.712 36.455 0.621 1.00 0.00 H ATOM 2676 N ASP C 85 32.897 37.394 1.263 1.00 22.23 N ATOM 2677 CA ASP C 85 34.139 38.095 1.580 1.00 25.35 C ATOM 2678 C ASP C 85 34.442 38.081 3.078 1.00 25.28 C ATOM 2679 O ASP C 85 35.604 38.220 3.480 1.00 28.68 O ATOM 2680 CB ASP C 85 34.064 39.544 1.094 1.00 28.00 C ATOM 2681 CG ASP C 85 34.091 39.675 -0.426 1.00 30.96 C ATOM 2682 OD1 ASP C 85 34.506 38.723 -1.119 1.00 35.28 O ATOM 2683 OD2 ASP C 85 33.710 40.762 -0.930 1.00 33.54 O ATOM 2684 H ASP C 85 32.035 37.931 1.037 1.00 0.00 H ATOM 2685 N ASP C 86 33.417 37.943 3.918 1.00 24.31 N ATOM 2686 CA ASP C 86 33.582 38.073 5.358 1.00 23.98 C ATOM 2687 C ASP C 86 33.544 36.750 6.107 1.00 22.42 C ATOM 2688 O ASP C 86 33.884 36.727 7.298 1.00 23.42 O ATOM 2689 CB ASP C 86 32.503 39.001 5.935 1.00 27.02 C ATOM 2690 CG ASP C 86 32.648 40.422 5.453 1.00 31.64 C ATOM 2691 OD1 ASP C 86 33.790 40.920 5.430 1.00 32.84 O ATOM 2692 OD2 ASP C 86 31.624 41.031 5.078 1.00 33.89 O ATOM 2693 H ASP C 86 32.473 37.737 3.534 1.00 0.00 H ATOM 2694 N TYR C 87 33.166 35.658 5.443 1.00 20.12 N ATOM 2695 CA TYR C 87 32.974 34.359 6.075 1.00 18.30 C ATOM 2696 C TYR C 87 33.475 33.273 5.134 1.00 17.14 C ATOM 2697 O TYR C 87 33.326 33.385 3.914 1.00 18.24 O ATOM 2698 CB TYR C 87 31.484 34.094 6.388 1.00 18.56 C ATOM 2699 CG TYR C 87 30.885 35.062 7.394 1.00 19.09 C ATOM 2700 CD1 TYR C 87 30.379 36.282 6.994 1.00 20.54 C ATOM 2701 CD2 TYR C 87 30.843 34.760 8.748 1.00 20.07 C ATOM 2702 CE1 TYR C 87 29.847 37.174 7.907 1.00 22.13 C ATOM 2703 CE2 TYR C 87 30.317 35.642 9.663 1.00 22.59 C ATOM 2704 CZ TYR C 87 29.821 36.852 9.245 1.00 23.48 C ATOM 2705 OH TYR C 87 29.289 37.746 10.157 1.00 26.63 O ATOM 2706 HH TYR C 87 29.983 37.992 10.819 1.00 0.00 H ATOM 2707 H TYR C 87 32.999 35.737 4.420 1.00 0.00 H ATOM 2708 N SER C 88 34.059 32.225 5.705 1.00 16.64 N ATOM 2709 CA SER C 88 34.411 31.044 4.927 1.00 16.23 C ATOM 2710 C SER C 88 33.155 30.503 4.248 1.00 15.76 C ATOM 2711 O SER C 88 32.083 30.453 4.854 1.00 16.83 O ATOM 2712 CB SER C 88 34.997 29.982 5.864 1.00 16.78 C ATOM 2713 OG SER C 88 36.128 30.474 6.566 1.00 18.48 O ATOM 2714 HG SER C 88 36.480 29.765 7.160 1.00 0.00 H ATOM 2715 H SER C 88 34.268 32.248 6.723 1.00 0.00 H ATOM 2716 N CYS C 89 33.282 30.125 2.973 1.00 15.41 N ATOM 2717 CA CYS C 89 32.121 29.786 2.159 1.00 15.72 C ATOM 2718 C CYS C 89 32.574 29.259 0.814 1.00 15.65 C ATOM 2719 O CYS C 89 33.442 29.866 0.175 1.00 16.87 O ATOM 2720 CB CYS C 89 31.308 31.058 1.915 1.00 18.03 C ATOM 2721 SG CYS C 89 29.782 30.846 1.027 1.00 20.49 S ATOM 2722 H CYS C 89 34.231 30.071 2.551 1.00 0.00 H ATOM 2723 N ILE C 90 31.982 28.142 0.383 1.00 14.83 N ATOM 2724 CA ILE C 90 32.168 27.629 -0.968 1.00 13.88 C ATOM 2725 C ILE C 90 30.818 27.139 -1.472 1.00 13.14 C ATOM 2726 O ILE C 90 29.964 26.709 -0.694 1.00 13.34 O ATOM 2727 CB ILE C 90 33.247 26.531 -1.033 1.00 14.65 C ATOM 2728 CG1 ILE C 90 33.685 26.322 -2.480 1.00 16.23 C ATOM 2729 CG2 ILE C 90 32.763 25.243 -0.435 1.00 13.82 C ATOM 2730 CD1 ILE C 90 34.992 25.580 -2.601 1.00 17.09 C ATOM 2731 H ILE C 90 31.365 27.619 1.036 1.00 0.00 H ATOM 2732 N THR C 91 30.624 27.207 -2.787 1.00 13.20 N ATOM 2733 CA THR C 91 29.315 26.915 -3.356 1.00 12.91 C ATOM 2734 C THR C 91 29.453 26.306 -4.744 1.00 12.83 C ATOM 2735 O THR C 91 30.340 26.682 -5.519 1.00 13.85 O ATOM 2736 CB THR C 91 28.447 28.184 -3.373 1.00 13.93 C ATOM 2737 OG1 THR C 91 27.178 27.894 -3.953 1.00 14.66 O ATOM 2738 CG2 THR C 91 29.104 29.308 -4.156 1.00 16.26 C ATOM 2739 HG1 THR C 91 26.725 27.194 -3.419 1.00 0.00 H ATOM 2740 H THR C 91 31.412 27.470 -3.412 1.00 0.00 H ATOM 2741 N TYR C 92 28.561 25.363 -5.050 1.00 12.39 N ATOM 2742 CA TYR C 92 28.581 24.725 -6.357 1.00 12.26 C ATOM 2743 C TYR C 92 27.177 24.291 -6.735 1.00 12.00 C ATOM 2744 O TYR C 92 26.290 24.186 -5.883 1.00 12.57 O ATOM 2745 CB TYR C 92 29.576 23.572 -6.409 1.00 13.32 C ATOM 2746 CG TYR C 92 29.363 22.446 -5.399 1.00 14.59 C ATOM 2747 CD1 TYR C 92 28.490 21.402 -5.664 1.00 15.47 C ATOM 2748 CD2 TYR C 92 30.080 22.391 -4.211 1.00 17.12 C ATOM 2749 CE1 TYR C 92 28.328 20.345 -4.790 1.00 17.21 C ATOM 2750 CE2 TYR C 92 29.916 21.319 -3.307 1.00 17.80 C ATOM 2751 CZ TYR C 92 29.025 20.309 -3.609 1.00 18.52 C ATOM 2752 OH TYR C 92 28.849 19.258 -2.738 1.00 21.78 O ATOM 2753 HH TYR C 92 29.710 18.786 -2.613 1.00 0.00 H ATOM 2754 H TYR C 92 27.846 25.082 -4.349 1.00 0.00 H ATOM 2755 N ILE C 93 26.990 24.048 -8.032 1.00 11.89 N ATOM 2756 CA ILE C 93 25.697 23.668 -8.585 1.00 12.04 C ATOM 2757 C ILE C 93 25.862 22.439 -9.468 1.00 12.61 C ATOM 2758 O ILE C 93 26.841 22.312 -10.214 1.00 13.38 O ATOM 2759 CB ILE C 93 25.080 24.834 -9.388 1.00 12.99 C ATOM 2760 CG1 ILE C 93 24.708 25.984 -8.453 1.00 14.31 C ATOM 2761 CG2 ILE C 93 23.880 24.372 -10.229 1.00 15.19 C ATOM 2762 CD1 ILE C 93 24.313 27.265 -9.161 1.00 16.33 C ATOM 2763 H ILE C 93 27.802 24.133 -8.677 1.00 0.00 H ATOM 2764 N SER C 94 24.884 21.550 -9.419 1.00 13.72 N ATOM 2765 CA SER C 94 24.794 20.467 -10.393 1.00 15.84 C ATOM 2766 C SER C 94 23.330 20.178 -10.650 1.00 14.49 C ATOM 2767 O SER C 94 22.453 20.857 -10.126 1.00 16.12 O ATOM 2768 CB SER C 94 25.521 19.230 -9.903 1.00 19.13 C ATOM 2769 OG SER C 94 24.928 18.791 -8.703 1.00 22.40 O ATOM 2770 HG SER C 94 24.993 19.507 -8.023 1.00 0.00 H ATOM 2771 H SER C 94 24.165 21.624 -8.671 1.00 0.00 H ATOM 2772 N THR C 95 23.063 19.201 -11.513 1.00 16.07 N ATOM 2773 CA THR C 95 21.700 18.808 -11.812 1.00 15.42 C ATOM 2774 C THR C 95 21.439 17.382 -11.345 1.00 14.34 C ATOM 2775 O THR C 95 22.334 16.523 -11.338 1.00 16.49 O ATOM 2776 CB THR C 95 21.401 18.954 -13.306 1.00 20.37 C ATOM 2777 OG1 THR C 95 22.349 18.187 -14.059 1.00 25.13 O ATOM 2778 CG2 THR C 95 21.462 20.408 -13.717 1.00 22.08 C ATOM 2779 HG1 THR C 95 23.263 18.517 -13.871 1.00 0.00 H ATOM 2780 H THR C 95 23.849 18.709 -11.983 1.00 0.00 H ATOM 2781 N VAL C 96 20.196 17.147 -10.953 1.00 13.09 N ATOM 2782 CA VAL C 96 19.721 15.840 -10.526 1.00 12.32 C ATOM 2783 C VAL C 96 18.311 15.650 -11.069 1.00 12.61 C ATOM 2784 O VAL C 96 17.672 16.592 -11.547 1.00 14.15 O ATOM 2785 CB VAL C 96 19.741 15.684 -8.984 1.00 13.77 C ATOM 2786 CG1 VAL C 96 21.149 15.904 -8.427 1.00 15.22 C ATOM 2787 CG2 VAL C 96 18.763 16.616 -8.312 1.00 14.93 C ATOM 2788 H VAL C 96 19.523 17.940 -10.950 1.00 0.00 H ATOM 2789 N GLU C 97 17.814 14.414 -10.973 1.00 12.52 N ATOM 2790 CA GLU C 97 16.474 14.063 -11.438 1.00 13.55 C ATOM 2791 C GLU C 97 15.556 13.841 -10.240 1.00 12.56 C ATOM 2792 O GLU C 97 15.722 12.866 -9.499 1.00 13.59 O ATOM 2793 CB GLU C 97 16.536 12.797 -12.290 1.00 17.00 C ATOM 2794 CG GLU C 97 15.205 12.321 -12.809 1.00 19.65 C ATOM 2795 CD GLU C 97 15.316 11.055 -13.629 1.00 22.79 C ATOM 2796 OE1 GLU C 97 16.384 10.793 -14.218 1.00 24.03 O ATOM 2797 OE2 GLU C 97 14.336 10.280 -13.652 1.00 26.14 O ATOM 2798 H GLU C 97 18.405 13.671 -10.550 1.00 0.00 H ATOM 2799 N ALA C 98 14.598 14.749 -10.044 1.00 14.34 N ATOM 2800 CA ALA C 98 13.600 14.612 -9.004 1.00 16.52 C ATOM 2801 C ALA C 98 12.433 13.781 -9.530 1.00 18.58 C ATOM 2802 O ALA C 98 12.247 13.620 -10.742 1.00 21.73 O ATOM 2803 CB ALA C 98 13.113 15.990 -8.560 1.00 20.77 C ATOM 2804 H ALA C 98 14.567 15.586 -10.661 1.00 0.00 H ATOM 2805 N LEU C 99 11.662 13.237 -8.605 1.00 21.72 N ATOM 2806 CA LEU C 99 10.514 12.425 -8.949 1.00 24.94 C ATOM 2807 C LEU C 99 9.299 13.337 -9.086 1.00 27.91 C ATOM 2808 O LEU C 99 8.965 14.094 -8.162 1.00 29.35 O ATOM 2809 CB LEU C 99 10.301 11.393 -7.848 1.00 26.73 C ATOM 2810 CG LEU C 99 9.313 10.264 -8.100 1.00 27.23 C ATOM 2811 CD1 LEU C 99 9.726 9.427 -9.281 1.00 28.42 C ATOM 2812 CD2 LEU C 99 9.243 9.432 -6.829 1.00 27.48 C ATOM 2813 H LEU C 99 11.886 13.397 -7.602 1.00 0.00 H TER 2814 LEU C 99 HETATM 2815 CA CA A 1 6.757 22.283 5.581 1.00 20.38 CA HETATM 2816 CA CA A 2 29.382 -5.290 5.581 1.00 20.38 CA HETATM 2817 CA CA A 3 41.948 28.090 5.581 1.00 20.38 CA HETATM 2818 O HOH 4 24.543 13.227 -2.114 1.00 36.63 O HETATM 2819 O HOH 5 1.401 13.377 7.550 1.00 38.90 O HETATM 2820 O HOH 6 5.926 4.842 -5.678 1.00 46.49 O HETATM 2821 O HOH 7 32.328 11.267 -13.081 1.00 43.32 O HETATM 2822 O HOH 8 11.586 14.105 -5.959 1.00 26.47 O HETATM 2823 O HOH 9 2.854 5.181 5.472 1.00 47.60 O HETATM 2824 O HOH 10 26.936 0.072 -13.338 1.00 29.99 O HETATM 2825 O HOH 11 35.782 -0.329 -5.822 1.00 46.16 O HETATM 2826 O HOH 12 14.809 -0.790 -18.118 1.00 43.54 O HETATM 2827 O HOH 13 1.694 17.550 9.344 1.00 49.73 O HETATM 2828 O HOH 14 12.908 -0.517 -11.756 1.00 43.47 O HETATM 2829 O HOH 15 4.296 2.508 -7.267 1.00 61.21 O HETATM 2830 O HOH 16 8.719 16.493 -1.350 1.00 21.81 O HETATM 2831 O HOH 17 10.944 2.083 13.511 1.00 42.27 O HETATM 2832 O HOH 18 1.511 10.327 9.176 1.00 43.30 O HETATM 2833 O HOH 19 21.047 -6.165 -6.383 1.00 69.88 O HETATM 2834 O HOH 20 5.000 9.746 13.501 1.00 33.74 O HETATM 2835 O HOH 21 21.997 11.767 -6.398 1.00 23.12 O HETATM 2836 O HOH 22 9.340 20.697 -0.581 1.00 19.96 O HETATM 2837 O HOH 23 25.803 13.117 -9.277 1.00 41.47 O HETATM 2838 O HOH 24 20.293 2.156 9.363 1.00 33.77 O HETATM 2839 O HOH 25 21.077 -6.025 0.351 1.00 41.37 O HETATM 2840 O HOH 26 27.913 -1.927 -5.472 1.00 29.19 O HETATM 2841 O HOH 27 9.195 14.086 12.152 1.00 20.70 O HETATM 2842 O HOH 28 5.156 7.083 12.793 1.00 47.07 O HETATM 2843 O HOH 29 14.696 -7.317 5.662 1.00 51.60 O HETATM 2844 O HOH 30 35.790 6.915 -9.221 1.00 18.67 O HETATM 2845 O HOH 31 10.216 -0.889 6.097 1.00 51.34 O HETATM 2846 O HOH 32 39.698 -0.026 -10.996 1.00 64.78 O HETATM 2847 O HOH 33 13.322 1.322 -13.867 1.00 50.69 O HETATM 2848 O HOH 34 1.106 4.439 -2.232 1.00 69.06 O HETATM 2849 O HOH 35 1.488 26.939 15.466 1.00 49.10 O HETATM 2850 O HOH 36 1.839 2.713 3.396 1.00 50.10 O HETATM 2851 O HOH 37 21.743 -3.228 -10.294 1.00 43.01 O HETATM 2852 O HOH 38 23.388 -1.349 -4.746 1.00 19.30 O HETATM 2853 O HOH 39 36.210 -0.249 -16.048 1.00 52.98 O HETATM 2854 O HOH 40 20.721 0.881 -15.828 1.00 32.72 O HETATM 2855 O HOH 41 18.320 14.339 12.600 1.00 36.34 O HETATM 2856 O HOH 42 15.344 26.882 11.646 1.00 47.63 O HETATM 2857 O HOH 43 25.446 12.482 10.460 1.00 24.28 O HETATM 2858 O HOH 44 6.405 -0.147 -0.788 1.00 27.49 O HETATM 2859 O HOH 45 14.818 6.816 14.172 1.00 43.89 O HETATM 2860 O HOH 46 2.786 7.194 -0.014 1.00 31.58 O HETATM 2861 O HOH 47 33.671 2.860 -17.796 1.00 26.98 O HETATM 2862 O HOH 48 2.472 7.065 2.767 1.00 53.38 O HETATM 2863 O HOH 49 9.610 -1.064 -6.444 1.00 51.41 O HETATM 2864 O HOH 50 7.135 27.387 -0.898 1.00 48.63 O HETATM 2865 O HOH 51 23.966 -2.503 -7.270 1.00 22.73 O HETATM 2866 O HOH 52 7.739 24.420 6.405 1.00 26.11 O HETATM 2867 O HOH 53 -0.513 19.163 2.969 1.00 42.71 O HETATM 2868 O HOH 54 0.714 13.353 -0.599 1.00 53.96 O HETATM 2869 O HOH 55 19.587 7.265 -15.969 1.00 29.24 O HETATM 2870 O HOH 56 11.725 13.246 12.738 1.00 25.33 O HETATM 2871 O HOH 57 13.603 5.848 -15.102 1.00 59.88 O HETATM 2872 O HOH 58 23.357 -1.181 -15.521 1.00 54.86 O HETATM 2873 O HOH 59 23.137 11.751 -15.744 1.00 33.63 O HETATM 2874 O HOH 60 0.631 11.709 11.437 1.00 48.47 O HETATM 2875 O HOH 61 14.941 -9.877 -0.143 1.00 30.64 O HETATM 2876 O HOH 62 23.655 13.003 -13.027 1.00 54.16 O HETATM 2877 O HOH 63 24.408 14.888 -6.251 1.00 44.49 O HETATM 2878 O HOH 64 28.321 -4.327 -11.580 1.00 63.34 O HETATM 2879 O HOH 65 18.481 -6.659 -6.735 1.00 51.12 O HETATM 2880 O HOH 66 1.817 14.022 15.706 1.00 53.91 O HETATM 2881 O HOH 67 11.006 4.059 -13.554 1.00 73.94 O HETATM 2882 O HOH 68 26.029 15.028 -1.700 1.00 44.65 O HETATM 2883 O HOH 69 2.835 7.354 -3.026 1.00 50.48 O HETATM 2884 O HOH 70 12.578 12.958 15.358 1.00 52.94 O HETATM 2885 O HOH 71 38.884 5.909 -14.463 1.00 59.26 O HETATM 2886 O HOH 72 12.809 2.644 14.970 1.00 51.50 O HETATM 2887 O HOH 73 15.714 23.974 14.817 1.00 50.07 O HETATM 2888 O HOH 74 0.246 21.918 10.612 1.00 74.31 O HETATM 2889 O HOH 75 28.666 10.274 -13.911 1.00 46.76 O HETATM 2890 O HOH 76 32.202 -0.571 -7.978 1.00 50.88 O HETATM 2891 O HOH 77 34.547 -2.241 -13.628 1.00 72.95 O HETATM 2892 O HOH 78 39.515 5.362 -12.415 1.00 47.82 O HETATM 2893 O HOH 79 26.491 2.318 -16.715 1.00 65.90 O HETATM 2894 O HOH 80 12.532 -5.408 -2.309 1.00 52.11 O HETATM 2895 O HOH 81 26.953 -0.061 -6.723 1.00 32.04 O HETATM 2896 O HOH 82 9.588 -2.003 8.584 1.00 80.96 O HETATM 2897 O HOH 83 21.680 8.834 10.971 1.00 49.32 O HETATM 2898 O HOH 84 35.355 -1.142 -11.743 1.00 51.50 O HETATM 2899 O HOH 85 17.043 -4.617 -10.463 1.00 61.79 O HETATM 2900 O HOH 86 23.198 9.557 12.429 1.00 59.46 O HETATM 2901 O HOH 87 26.029 15.028 -10.441 1.00 77.99 O HETATM 2902 O HOH 88 18.834 -0.650 10.306 1.00 67.07 O HETATM 2903 O HOH 89 22.869 -4.451 -12.600 1.00 66.66 O HETATM 2904 O HOH 90 3.312 5.254 -5.406 1.00 67.95 O HETATM 2905 O HOH 91 38.259 0.648 -5.141 1.00 48.90 O HETATM 2906 O HOH 92 1.995 19.222 -1.967 1.00 60.23 O HETATM 2907 O HOH 93 26.029 15.028 11.499 1.00 24.47 O HETATM 2908 O HOH 94 5.828 -0.750 -3.242 1.00 54.36 O HETATM 2909 O HOH 95 26.351 -3.747 -7.111 1.00 53.09 O HETATM 2910 O HOH 96 6.406 23.179 -3.923 1.00 51.08 O HETATM 2911 O HOH 97 3.744 -0.710 0.192 1.00 65.72 O HETATM 2912 O HOH 98 12.541 0.059 -16.547 1.00 60.67 O HETATM 2913 O HOH 99 7.801 20.586 -2.963 1.00 48.54 O HETATM 2914 O HOH 100 35.041 -2.476 -5.098 1.00 44.91 O HETATM 2915 O HOH 101 6.993 -1.674 9.394 1.00 61.72 O HETATM 2916 O HOH 102 18.076 25.608 11.834 1.00 51.53 O HETATM 2917 O HOH 103 2.679 1.684 -5.984 1.00 67.41 O HETATM 2918 O HOH 104 22.622 -4.647 -8.235 1.00 36.43 O HETATM 2919 O HOH 105 -0.019 18.879 10.161 1.00 73.37 O HETATM 2920 O HOH 106 8.513 16.933 -3.903 1.00 42.90 O HETATM 2921 O HOH 107 10.463 16.356 -5.880 1.00 46.12 O HETATM 2922 O HOH 108 19.203 -5.457 -9.123 1.00 60.15 O HETATM 2923 O HOH 109 -1.994 19.873 8.367 1.00 67.28 O HETATM 2924 O HOH 110 22.750 3.913 -19.045 1.00 53.18 O HETATM 2925 O HOH 111 24.595 -5.296 5.050 1.00 41.51 O HETATM 2926 O HOH 112 22.679 7.379 12.320 1.00 50.18 O HETATM 2927 O HOH 113 18.670 24.287 13.710 1.00 66.04 O HETATM 2928 O HOH 114 24.984 -5.755 -9.755 1.00 53.46 O HETATM 2929 O HOH 115 28.332 14.641 -2.114 1.00 36.63 O HETATM 2930 O HOH 116 39.773 -5.475 7.550 1.00 38.90 O HETATM 2931 O HOH 117 44.902 2.711 -5.678 1.00 46.49 O HETATM 2932 O HOH 118 26.136 22.363 -13.081 1.00 43.32 O HETATM 2933 O HOH 119 34.050 2.981 -5.959 1.00 26.47 O HETATM 2934 O HOH 120 46.144 -0.119 5.472 1.00 47.60 O HETATM 2935 O HOH 121 38.528 23.291 -13.338 1.00 29.99 O HETATM 2936 O HOH 122 34.452 31.153 -5.822 1.00 46.16 O HETATM 2937 O HOH 123 45.338 13.220 -18.118 1.00 43.54 O HETATM 2938 O HOH 124 36.012 -7.308 9.344 1.00 49.73 O HETATM 2939 O HOH 125 46.052 11.437 -11.756 1.00 43.47 O HETATM 2940 O HOH 126 47.738 2.466 -7.267 1.00 61.21 O HETATM 2941 O HOH 127 33.415 -0.696 -1.350 1.00 21.81 O HETATM 2942 O HOH 128 44.782 8.436 13.511 1.00 42.27 O HETATM 2943 O HOH 129 42.359 -3.855 9.176 1.00 43.30 O HETATM 2944 O HOH 130 46.874 21.310 -6.383 1.00 69.88 O HETATM 2945 O HOH 131 41.118 -0.543 13.501 1.00 33.74 O HETATM 2946 O HOH 132 30.869 13.166 -6.398 1.00 23.12 O HETATM 2947 O HOH 133 29.464 -2.260 -0.581 1.00 19.96 O HETATM 2948 O HOH 134 27.797 15.788 -9.277 1.00 41.47 O HETATM 2949 O HOH 135 40.044 16.496 9.363 1.00 33.77 O HETATM 2950 O HOH 136 46.737 21.266 0.351 1.00 41.37 O HETATM 2951 O HOH 137 39.770 25.137 -5.472 1.00 29.19 O HETATM 2952 O HOH 138 35.262 0.920 12.152 1.00 20.70 O HETATM 2953 O HOH 139 43.346 0.924 12.793 1.00 47.07 O HETATM 2954 O HOH 140 51.047 16.386 5.662 1.00 51.60 O HETATM 2955 O HOH 141 28.174 27.538 -9.221 1.00 18.67 O HETATM 2956 O HOH 142 47.720 9.292 6.097 1.00 51.34 O HETATM 2957 O HOH 143 32.232 34.392 -10.996 1.00 64.78 O HETATM 2958 O HOH 144 44.252 10.876 -13.867 1.00 50.69 O HETATM 2959 O HOH 145 47.661 -1.262 -2.232 1.00 69.06 O HETATM 2960 O HOH 146 27.984 -12.181 15.466 1.00 49.10 O HETATM 2961 O HOH 147 48.789 0.236 3.396 1.00 50.10 O HETATM 2962 O HOH 148 43.982 20.444 -10.294 1.00 43.01 O HETATM 2963 O HOH 149 41.532 20.929 -4.746 1.00 19.30 O HETATM 2964 O HOH 150 34.169 31.483 -16.048 1.00 52.98 O HETATM 2965 O HOH 151 40.935 17.504 -15.828 1.00 32.72 O HETATM 2966 O HOH 152 30.480 8.696 12.600 1.00 36.34 O HETATM 2967 O HOH 153 21.106 -0.153 11.646 1.00 47.63 O HETATM 2968 O HOH 154 28.525 15.796 10.460 1.00 24.28 O HETATM 2969 O HOH 155 48.983 5.620 -0.788 1.00 27.49 O HETATM 2970 O HOH 156 38.746 9.425 14.172 1.00 43.89 O HETATM 2971 O HOH 157 44.435 -1.184 -0.014 1.00 31.58 O HETATM 2972 O HOH 158 32.746 27.730 -17.796 1.00 26.98 O HETATM 2973 O HOH 159 44.704 -1.392 2.767 1.00 53.38 O HETATM 2974 O HOH 160 48.174 8.855 -6.444 1.00 51.41 O HETATM 2975 O HOH 161 24.773 -7.514 -0.898 1.00 48.63 O HETATM 2976 O HOH 162 42.243 22.007 -7.270 1.00 22.73 O HETATM 2977 O HOH 163 27.040 -5.508 6.405 1.00 26.11 O HETATM 2978 O HOH 164 35.719 -10.026 2.969 1.00 42.71 O HETATM 2979 O HOH 165 40.137 -6.058 -0.599 1.00 53.96 O HETATM 2980 O HOH 166 35.973 13.330 -15.969 1.00 29.24 O HETATM 2981 O HOH 167 34.724 3.531 12.738 1.00 25.33 O HETATM 2982 O HOH 168 40.192 8.857 -15.102 1.00 59.88 O HETATM 2983 O HOH 169 41.402 20.818 -15.521 1.00 54.86 O HETATM 2984 O HOH 170 30.313 14.162 -15.744 1.00 33.63 O HETATM 2985 O HOH 171 41.602 -5.308 11.437 1.00 48.47 O HETATM 2986 O HOH 172 53.141 17.878 -0.143 1.00 30.64 O HETATM 2987 O HOH 173 28.970 13.984 -13.027 1.00 54.16 O HETATM 2988 O HOH 174 26.961 13.694 -6.251 1.00 44.49 O HETATM 2989 O HOH 175 41.645 26.690 -11.580 1.00 63.34 O HETATM 2990 O HOH 176 48.584 19.335 -6.735 1.00 51.12 O HETATM 2991 O HOH 177 39.006 -5.437 15.706 1.00 53.91 O HETATM 2992 O HOH 178 43.040 7.502 -13.554 1.00 73.94 O HETATM 2993 O HOH 179 44.272 -1.222 -3.026 1.00 50.48 O HETATM 2994 O HOH 180 34.547 4.414 15.358 1.00 52.94 O HETATM 2995 O HOH 181 27.499 30.720 -14.463 1.00 59.26 O HETATM 2996 O HOH 182 43.364 9.771 14.970 1.00 51.50 O HETATM 2997 O HOH 183 23.439 1.622 14.817 1.00 50.07 O HETATM 2998 O HOH 184 32.953 -10.746 10.612 1.00 74.31 O HETATM 2999 O HOH 185 28.827 19.688 -13.911 1.00 46.76 O HETATM 3000 O HOH 186 36.452 28.173 -7.978 1.00 50.88 O HETATM 3001 O HOH 187 36.725 31.039 -13.628 1.00 72.95 O HETATM 3002 O HOH 188 27.657 31.540 -12.415 1.00 47.82 O HETATM 3003 O HOH 189 36.805 21.783 -16.715 1.00 65.90 O HETATM 3004 O HOH 190 50.475 13.557 -2.309 1.00 52.11 O HETATM 3005 O HOH 191 38.634 23.372 -6.723 1.00 32.04 O HETATM 3006 O HOH 192 48.999 9.305 8.584 1.00 80.96 O HETATM 3007 O HOH 193 33.568 14.358 10.971 1.00 49.32 O HETATM 3008 O HOH 194 35.370 31.189 -11.743 1.00 51.50 O HETATM 3009 O HOH 195 47.535 17.068 -10.463 1.00 61.79 O HETATM 3010 O HOH 196 32.182 15.312 12.429 1.00 59.46 O HETATM 3011 O HOH 197 43.204 16.636 10.306 1.00 67.07 O HETATM 3012 O HOH 198 44.478 22.031 -12.600 1.00 66.66 O HETATM 3013 O HOH 199 45.852 0.241 -5.406 1.00 67.95 O HETATM 3014 O HOH 200 32.367 32.809 -5.141 1.00 48.90 O HETATM 3015 O HOH 201 34.414 -7.883 -1.967 1.00 60.23 O HETATM 3016 O HOH 202 49.794 5.422 -3.242 1.00 54.36 O HETATM 3017 O HOH 203 42.127 24.694 -7.111 1.00 53.09 O HETATM 3018 O HOH 204 28.781 -6.042 -3.923 1.00 51.08 O HETATM 3019 O HOH 205 50.801 3.597 0.192 1.00 65.72 O HETATM 3020 O HOH 206 45.736 10.831 -16.547 1.00 60.67 O HETATM 3021 O HOH 207 30.330 -3.537 -2.963 1.00 48.54 O HETATM 3022 O HOH 208 36.682 31.584 -5.098 1.00 44.91 O HETATM 3023 O HOH 209 50.011 6.893 9.394 1.00 61.72 O HETATM 3024 O HOH 210 20.843 2.850 11.834 1.00 51.53 O HETATM 3025 O HOH 211 49.260 1.478 -5.984 1.00 67.41 O HETATM 3026 O HOH 212 44.771 21.915 -8.235 1.00 36.43 O HETATM 3027 O HOH 213 35.718 -9.456 10.161 1.00 73.37 O HETATM 3028 O HOH 214 33.137 -1.094 -3.903 1.00 42.90 O HETATM 3029 O HOH 215 32.662 0.883 -5.880 1.00 46.12 O HETATM 3030 O HOH 216 47.182 19.359 -9.123 1.00 60.15 O HETATM 3031 O HOH 217 35.844 -11.663 8.367 1.00 67.28 O HETATM 3032 O HOH 218 37.294 17.746 -19.045 1.00 53.18 O HETATM 3033 O HOH 219 44.347 23.948 5.050 1.00 41.51 O HETATM 3034 O HOH 220 34.328 15.951 12.320 1.00 50.18 O HETATM 3035 O HOH 221 21.690 4.025 13.710 1.00 66.04 O HETATM 3036 O HOH 222 44.550 24.514 -9.755 1.00 53.46 O HETATM 3037 O HOH 223 25.212 17.215 -2.114 1.00 36.63 O HETATM 3038 O HOH 224 36.913 37.182 7.550 1.00 38.90 O HETATM 3039 O HOH 225 27.259 37.530 -5.678 1.00 46.49 O HETATM 3040 O HOH 226 19.623 11.453 -13.081 1.00 43.32 O HETATM 3041 O HOH 227 32.451 27.997 -5.959 1.00 26.47 O HETATM 3042 O HOH 228 29.089 40.021 5.472 1.00 47.60 O HETATM 3043 O HOH 229 12.623 21.720 -13.338 1.00 29.99 O HETATM 3044 O HOH 230 7.853 14.260 -5.822 1.00 46.16 O HETATM 3045 O HOH 231 17.940 32.654 -18.118 1.00 43.54 O HETATM 3046 O HOH 232 40.381 34.842 9.344 1.00 49.73 O HETATM 3047 O HOH 233 19.127 34.163 -11.756 1.00 43.47 O HETATM 3048 O HOH 234 26.053 40.109 -7.267 1.00 61.21 O HETATM 3049 O HOH 235 35.953 29.286 -1.350 1.00 21.81 O HETATM 3050 O HOH 236 22.361 34.564 13.511 1.00 42.27 O HETATM 3051 O HOH 237 34.217 38.611 9.176 1.00 43.30 O HETATM 3052 O HOH 238 10.166 29.939 -6.383 1.00 69.88 O HETATM 3053 O HOH 239 31.969 35.880 13.501 1.00 33.74 O HETATM 3054 O HOH 240 25.221 20.150 -6.398 1.00 23.12 O HETATM 3055 O HOH 241 39.283 26.646 -0.581 1.00 19.96 O HETATM 3056 O HOH 242 24.487 16.179 -9.277 1.00 41.47 O HETATM 3057 O HOH 243 17.750 26.431 9.363 1.00 33.77 O HETATM 3058 O HOH 244 10.273 29.843 0.351 1.00 41.37 O HETATM 3059 O HOH 245 10.404 21.874 -5.472 1.00 29.19 O HETATM 3060 O HOH 246 33.630 30.077 12.152 1.00 20.70 O HETATM 3061 O HOH 247 29.585 37.077 12.793 1.00 47.07 O HETATM 3062 O HOH 248 12.344 36.015 5.662 1.00 51.60 O HETATM 3063 O HOH 249 14.123 10.631 -9.221 1.00 18.67 O HETATM 3064 O HOH 250 20.151 36.681 6.097 1.00 51.34 O HETATM 3065 O HOH 251 6.157 10.717 -10.996 1.00 64.78 O HETATM 3066 O HOH 252 20.513 32.885 -13.867 1.00 50.69 O HETATM 3067 O HOH 253 29.320 41.906 -2.232 1.00 69.06 O HETATM 3068 O HOH 254 48.615 30.325 15.466 1.00 49.10 O HETATM 3069 O HOH 255 27.459 42.134 3.396 1.00 50.10 O HETATM 3070 O HOH 256 12.362 27.868 -10.294 1.00 43.01 O HETATM 3071 O HOH 257 13.167 25.503 -4.746 1.00 19.30 O HETATM 3072 O HOH 258 7.708 13.849 -16.048 1.00 52.98 O HETATM 3073 O HOH 259 16.431 26.698 -15.828 1.00 32.72 O HETATM 3074 O HOH 260 29.287 22.048 12.600 1.00 36.34 O HETATM 3075 O HOH 261 41.637 18.354 11.646 1.00 47.63 O HETATM 3076 O HOH 262 24.116 16.806 10.460 1.00 24.28 O HETATM 3077 O HOH 263 22.699 39.610 -0.788 1.00 27.49 O HETATM 3078 O HOH 264 24.523 28.843 14.172 1.00 43.89 O HETATM 3079 O HOH 265 30.866 39.074 -0.014 1.00 31.58 O HETATM 3080 O HOH 266 11.670 14.494 -17.796 1.00 26.98 O HETATM 3081 O HOH 267 30.911 39.410 2.767 1.00 53.38 O HETATM 3082 O HOH 268 20.303 37.293 -6.444 1.00 51.41 O HETATM 3083 O HOH 269 46.179 25.211 -0.898 1.00 48.63 O HETATM 3084 O HOH 270 11.878 25.580 -7.270 1.00 22.73 O HETATM 3085 O HOH 271 43.308 26.171 6.405 1.00 26.11 O HETATM 3086 O HOH 272 42.881 35.946 2.969 1.00 42.71 O HETATM 3087 O HOH 273 37.236 37.789 -0.599 1.00 53.96 O HETATM 3088 O HOH 274 22.527 24.488 -15.969 1.00 29.24 O HETATM 3089 O HOH 275 31.638 28.306 12.738 1.00 25.33 O HETATM 3090 O HOH 276 24.292 30.379 -15.102 1.00 59.88 O HETATM 3091 O HOH 277 13.328 25.446 -15.521 1.00 54.86 O HETATM 3092 O HOH 278 24.637 19.171 -15.744 1.00 33.63 O HETATM 3093 O HOH 279 35.854 38.683 11.437 1.00 48.47 O HETATM 3094 O HOH 280 10.005 37.083 -0.143 1.00 30.64 O HETATM 3095 O HOH 281 25.462 18.096 -13.027 1.00 54.16 O HETATM 3096 O HOH 282 26.718 16.502 -6.251 1.00 44.49 O HETATM 3097 O HOH 283 8.121 22.720 -11.580 1.00 63.34 O HETATM 3098 O HOH 284 11.022 32.408 -6.735 1.00 51.12 O HETATM 3099 O HOH 285 37.264 36.499 15.706 1.00 53.91 O HETATM 3100 O HOH 286 24.041 33.523 -13.554 1.00 73.94 O HETATM 3101 O HOH 287 30.980 38.951 -3.026 1.00 50.48 O HETATM 3102 O HOH 288 30.962 27.712 15.358 1.00 52.94 O HETATM 3103 O HOH 289 11.704 8.455 -14.463 1.00 59.26 O HETATM 3104 O HOH 290 21.914 32.669 14.970 1.00 51.50 O HETATM 3105 O HOH 291 38.934 19.488 14.817 1.00 50.07 O HETATM 3106 O HOH 292 44.888 33.912 10.612 1.00 74.31 O HETATM 3107 O HOH 293 20.594 15.121 -13.911 1.00 46.76 O HETATM 3108 O HOH 294 9.433 17.481 -7.978 1.00 50.88 O HETATM 3109 O HOH 295 6.815 16.285 -13.628 1.00 72.95 O HETATM 3110 O HOH 296 10.915 8.182 -12.415 1.00 47.82 O HETATM 3111 O HOH 297 14.791 20.983 -16.715 1.00 65.90 O HETATM 3112 O HOH 298 15.080 36.935 -2.309 1.00 52.11 O HETATM 3113 O HOH 299 12.500 21.772 -6.723 1.00 32.04 O HETATM 3114 O HOH 300 19.500 37.782 8.584 1.00 80.96 O HETATM 3115 O HOH 301 22.839 21.891 10.971 1.00 49.32 O HETATM 3116 O HOH 302 7.362 15.036 -11.743 1.00 51.50 O HETATM 3117 O HOH 303 13.509 32.632 -10.463 1.00 61.79 O HETATM 3118 O HOH 304 22.707 20.215 12.429 1.00 59.46 O HETATM 3119 O HOH 305 16.049 29.098 10.306 1.00 67.07 O HETATM 3120 O HOH 306 10.740 27.504 -12.600 1.00 66.66 O HETATM 3121 O HOH 307 28.923 39.588 -5.406 1.00 67.95 O HETATM 3122 O HOH 308 7.461 11.626 -5.141 1.00 48.90 O HETATM 3123 O HOH 309 41.678 33.745 -1.967 1.00 60.23 O HETATM 3124 O HOH 310 22.465 40.411 -3.242 1.00 54.36 O HETATM 3125 O HOH 311 9.609 24.136 -7.111 1.00 53.09 O HETATM 3126 O HOH 312 42.900 27.946 -3.923 1.00 51.08 O HETATM 3127 O HOH 313 23.542 42.196 0.192 1.00 65.72 O HETATM 3128 O HOH 314 19.810 34.193 -16.547 1.00 60.67 O HETATM 3129 O HOH 315 39.956 28.035 -2.963 1.00 48.54 O HETATM 3130 O HOH 316 6.364 15.975 -5.098 1.00 44.91 O HETATM 3131 O HOH 317 21.083 39.864 9.394 1.00 61.72 O HETATM 3132 O HOH 318 39.168 16.625 11.834 1.00 51.53 O HETATM 3133 O HOH 319 26.148 41.921 -5.984 1.00 67.41 O HETATM 3134 O HOH 320 10.694 27.816 -8.235 1.00 36.43 O HETATM 3135 O HOH 321 42.388 35.661 10.161 1.00 73.37 O HETATM 3136 O HOH 322 36.437 29.245 -3.903 1.00 42.90 O HETATM 3137 O HOH 323 34.962 27.844 -5.880 1.00 46.12 O HETATM 3138 O HOH 324 11.702 31.182 -9.123 1.00 60.15 O HETATM 3139 O HOH 325 44.237 36.874 8.367 1.00 67.28 O HETATM 3140 O HOH 326 18.043 23.425 -19.045 1.00 53.18 O HETATM 3141 O HOH 327 9.145 26.432 5.050 1.00 41.51 O HETATM 3142 O HOH 328 21.080 21.753 12.320 1.00 50.18 O HETATM 3143 O HOH 329 37.727 16.771 13.710 1.00 66.04 O HETATM 3144 O HOH 330 8.553 26.324 -9.755 1.00 53.46 O HETATM 3145 PG ATP A 331 9.066 19.770 6.497 1.00 0.19 P HETATM 3146 O1G ATP A 331 8.807 21.202 6.206 1.00 -0.61 O HETATM 3147 O2G ATP A 331 8.121 19.271 7.604 1.00 -0.61 O HETATM 3148 O3G ATP A 331 10.462 19.370 6.810 1.00 -0.61 O HETATM 3149 O3B ATP A 331 8.688 18.930 5.156 1.00 -0.15 O HETATM 3150 PB ATP A 331 7.289 18.967 4.342 1.00 0.36 P HETATM 3151 O1B ATP A 331 6.414 17.890 4.803 1.00 -0.57 O HETATM 3152 O2B ATP A 331 6.722 20.332 4.310 1.00 -0.57 O HETATM 3153 O3A ATP A 331 7.781 18.802 2.769 1.00 -0.12 O HETATM 3154 PA ATP A 331 8.781 17.780 2.047 1.00 0.33 P HETATM 3155 O1A ATP A 331 8.895 18.295 0.593 1.00 -0.57 O HETATM 3156 O2A ATP A 331 8.397 16.390 2.199 1.00 -0.57 O HETATM 3157 O5' ATP A 331 10.245 18.090 2.736 1.00 -0.24 O HETATM 3158 C5' ATP A 331 10.846 17.139 3.578 1.00 0.11 C HETATM 3159 C4' ATP A 331 12.346 17.458 3.618 1.00 0.12 C HETATM 3160 O4' ATP A 331 12.854 17.353 2.343 1.00 -0.34 O HETATM 3161 C1' ATP A 331 13.943 18.441 2.232 1.00 0.20 C HETATM 3162 C2' ATP A 331 14.042 19.037 3.446 1.00 0.14 C HETATM 3163 C3' ATP A 331 12.675 18.839 4.182 1.00 0.11 C HETATM 3164 O3' ATP A 331 12.742 18.880 5.560 1.00 -0.39 O HETATM 3165 H5 ATP A 331 11.904 18.619 5.925 1.00 0.21 H HETATM 3166 H4 ATP A 331 11.939 19.589 3.857 1.00 0.06 H HETATM 3167 O2' ATP A 331 15.052 18.382 4.283 1.00 -0.38 O HETATM 3168 H7 ATP A 331 15.906 18.474 3.877 1.00 0.21 H HETATM 3169 H6 ATP A 331 14.278 20.105 3.325 1.00 0.07 H HETATM 3170 N9 ATP A 331 13.518 19.309 1.112 1.00 -0.19 N HETATM 3171 C8 ATP A 331 12.251 19.640 0.726 1.00 0.11 C HETATM 3172 N7 ATP A 331 12.295 20.500 -0.294 1.00 -0.30 N HETATM 3173 C5 ATP A 331 13.635 20.705 -0.519 1.00 0.10 C HETATM 3174 C6 ATP A 331 14.293 21.462 -1.442 1.00 0.13 C HETATM 3175 N6 ATP A 331 13.697 22.302 -2.415 1.00 -0.32 N HETATM 3176 H10 ATP A 331 14.289 22.834 -3.069 1.00 0.18 H HETATM 3177 H11 ATP A 331 12.671 22.381 -2.469 1.00 0.18 H HETATM 3178 N1 ATP A 331 15.636 21.463 -1.448 1.00 -0.27 N HETATM 3179 C2 ATP A 331 16.298 20.720 -0.559 1.00 0.05 C HETATM 3180 N3 ATP A 331 15.716 19.939 0.379 1.00 -0.27 N HETATM 3181 C4 ATP A 331 14.374 19.960 0.342 1.00 0.16 C HETATM 3182 H12 ATP A 331 17.381 20.744 -0.591 1.00 0.10 H HETATM 3183 H9 ATP A 331 11.339 19.259 1.183 1.00 0.13 H HETATM 3184 H8 ATP A 331 14.916 17.992 1.984 1.00 0.10 H HETATM 3185 H3 ATP A 331 12.834 16.709 4.258 1.00 0.07 H HETATM 3186 H1 ATP A 331 10.686 16.127 3.179 1.00 0.06 H HETATM 3187 H2 ATP A 331 10.419 17.206 4.589 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 373 372 2815 CONECT 406 405 2815 CONECT 465 464 2815 CONECT 466 464 2815 CONECT 939 940 946 947 948 CONECT 946 939 CONECT 947 939 CONECT 948 939 CONECT 1311 1310 2816 CONECT 1344 1343 2816 CONECT 1403 1402 2816 CONECT 1404 1402 2816 CONECT 1877 1878 1884 1885 1886 CONECT 1884 1877 CONECT 1885 1877 CONECT 1886 1877 CONECT 2249 2248 2817 CONECT 2282 2281 2817 CONECT 2341 2340 2817 CONECT 2342 2340 2817 CONECT 2815 373 406 465 466 CONECT 2816 1311 1344 1403 1404 CONECT 2817 2249 2282 2341 2342 CONECT 3145 3146 3147 3148 3149 CONECT 3146 3145 CONECT 3147 3145 CONECT 3148 3145 CONECT 3149 3145 3150 CONECT 3150 3149 3151 3152 3153 CONECT 3151 3150 CONECT 3152 3150 CONECT 3153 3150 3154 CONECT 3154 3153 3155 3156 3157 CONECT 3155 3154 CONECT 3156 3154 CONECT 3157 3154 3158 CONECT 3158 3157 3159 3186 3187 CONECT 3159 3158 3160 3163 3185 CONECT 3160 3159 3161 CONECT 3161 3160 3162 3170 3184 CONECT 3162 3161 3163 3167 3169 CONECT 3163 3159 3162 3164 3166 CONECT 3164 3163 3165 CONECT 3165 3164 CONECT 3166 3163 CONECT 3167 3162 3168 CONECT 3168 3167 CONECT 3169 3162 CONECT 3170 3161 3171 3181 CONECT 3171 3170 3172 3183 CONECT 3172 3171 3173 CONECT 3173 3172 3174 3181 CONECT 3174 3173 3175 3178 CONECT 3175 3174 3176 3177 CONECT 3176 3175 CONECT 3177 3175 CONECT 3178 3174 3179 CONECT 3179 3178 3180 3182 CONECT 3180 3179 3181 CONECT 3181 3170 3173 3180 CONECT 3182 3179 CONECT 3183 3171 CONECT 3184 3161 CONECT 3185 3159 CONECT 3186 3158 CONECT 3187 3158 MASTER 0 0 0 0 0 0 0 0 3184 3 70 24 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 6mm2
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6ntb
RCSB PDB
PDBbind
104aa, >6NTB_1|Chains... at 100%
6mmq
RCSB PDB
PDBbind
104aa, >6MMQ_1|Chains... at 100%
6mmo
RCSB PDB
PDBbind
104aa, >6MMO_1|Chains... at 100%
6mmc
RCSB PDB
PDBbind
104aa, >6MMC_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1b38
RCSB PDB
PDBbind
ATP
1b39
RCSB PDB
PDBbind
ATP
1gz3
RCSB PDB
PDBbind
ATP
1gz4
RCSB PDB
PDBbind
ATP
1m83
RCSB PDB
PDBbind
ATP
1mau
RCSB PDB
PDBbind
ATP
1maw
RCSB PDB
PDBbind
ATP
1r0x
RCSB PDB
PDBbind
ATP
1r10
RCSB PDB
PDBbind
ATP
1vjc
RCSB PDB
PDBbind
ATP
1vjd
RCSB PDB
PDBbind
ATP
1xsc
RCSB PDB
PDBbind
ATP
1y8p
RCSB PDB
PDBbind
ATP
1yid
RCSB PDB
PDBbind
ATP
2cbz
RCSB PDB
PDBbind
ATP
2e5y
RCSB PDB
PDBbind
ATP
2fgh
RCSB PDB
PDBbind
ATP
2hmu
RCSB PDB
PDBbind
ATP
2hmw
RCSB PDB
PDBbind
ATP
2j9l
RCSB PDB
PDBbind
ATP
2kmx
RCSB PDB
PDBbind
ATP
2p09
RCSB PDB
PDBbind
ATP
2p0x
RCSB PDB
PDBbind
ATP
2pze
RCSB PDB
PDBbind
ATP
2vhq
RCSB PDB
PDBbind
ATP
2vt3
RCSB PDB
PDBbind
ATP
2w5g
RCSB PDB
PDBbind
ATP
2w5i
RCSB PDB
PDBbind
ATP
2xbp
RCSB PDB
PDBbind
ATP
2ych
RCSB PDB
PDBbind
ATP
3b2q
RCSB PDB
PDBbind
ATP
3d2e
RCSB PDB
PDBbind
ATP
3dgl
RCSB PDB
PDBbind
ATP
3dgo
RCSB PDB
PDBbind
ATP
3dnt
RCSB PDB
PDBbind
ATP
3efs
RCSB PDB
PDBbind
ATP
3lf0
RCSB PDB
PDBbind
ATP
3ncq
RCSB PDB
PDBbind
ATP
3qo3
RCSB PDB
PDBbind
ATP
3qx9
RCSB PDB
PDBbind
ATP
3qxc
RCSB PDB
PDBbind
ATP
3ta0
RCSB PDB
PDBbind
ATP
3umo
RCSB PDB
PDBbind
ATP
3ump
RCSB PDB
PDBbind
ATP
4fut
RCSB PDB
PDBbind
ATP
4fvq
RCSB PDB
PDBbind
ATP
4fvr
RCSB PDB
PDBbind
ATP
4jn4
RCSB PDB
PDBbind
ATP
4jne
RCSB PDB
PDBbind
ATP
4k8o
RCSB PDB
PDBbind
ATP
4ozn
RCSB PDB
PDBbind
ATP
4usw
RCSB PDB
PDBbind
ATP
4wz6
RCSB PDB
PDBbind
ATP
4yb7
RCSB PDB
PDBbind
ATP
5d6j
RCSB PDB
PDBbind
ATP
5eou
RCSB PDB
PDBbind
ATP
5f1c
RCSB PDB
PDBbind
ATP
5f1x
RCSB PDB
PDBbind
ATP
5ldk
RCSB PDB
PDBbind
ATP
5ldp
RCSB PDB
PDBbind
ATP
5svk
RCSB PDB
PDBbind
ATP
5svl
RCSB PDB
PDBbind
ATP
5tgc
RCSB PDB
PDBbind
ATP
5v2l
RCSB PDB
PDBbind
ATP
5wrs
RCSB PDB
PDBbind
ATP
5x9h
RCSB PDB
PDBbind
ATP
5z68
RCSB PDB
PDBbind
ATP
6cvv
RCSB PDB
PDBbind
ATP
6r4s
RCSB PDB
PDBbind
ATP
6ntb
RCSB PDB
PDBbind
ATP
6h78
RCSB PDB
PDBbind
ATP
6h77
RCSB PDB
PDBbind
ATP
6aec
RCSB PDB
PDBbind
ATP
5xvu
RCSB PDB
PDBbind
ATP
Entry Information
PDB ID
6mm2
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Carbon regulatory PII-like protein SbtB
Ligand Name
ATP
EC.Number
E.C.-.-.-.-
Resolution
1.04(Å)
Affinity (Kd/Ki/IC50)
Kd=3.92uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Biorxiv Vol. 58: pp. 5030-039
Ligand Properties
Formula
C
1
0
H
1
9
N
5
O
1
3
P
3
Molecular Weight
510.205
Exact Mass
510.019
No. of atoms
50
No. of bonds
52
Polar Surface Area
329.38
LOGP Value
-6.07 (
Computed with XLOGP3
)
-2.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(OP(O)(O)O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H22N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-24,29-31H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
B5II98
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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