Browse entries in the PDBbind-CN Database
HEADER 6MMQ_COMPLEX COMPND 6MMQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 39 GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU GLU ILE SEQRES 2 A 39 LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU ALA GLY SEQRES 3 A 39 ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY GLU GLY SEQRES 1 A 43 ALA TYR SER ASN ILE LYS PHE GLU VAL LEU THR ALA SER SEQRES 2 A 43 ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS VAL VAL ALA SEQRES 3 A 43 LYS TYR PHE ASP ASP TYR SER CYS ILE THR TYR ILE SER SEQRES 4 A 43 THR VAL GLU ALA SEQRES 1 B 41 SER SER GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU SEQRES 2 B 41 GLU ILE LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU SEQRES 3 B 41 ALA GLY ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY SEQRES 4 B 41 GLU GLY SEQRES 1 B 49 ALA TYR SER ASN ILE LYS PHE GLU VAL LEU THR ALA SER SEQRES 2 B 49 ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS VAL VAL ALA SEQRES 3 B 49 LYS TYR PHE ASP ASP TYR SER CYS ILE THR TYR ILE SER SEQRES 4 B 49 THR VAL GLU ALA LEU ARG ALA HIS LYS PHE SEQRES 1 D 40 SER GLN GLN VAL TRP LYS LEU VAL ILE ILE THR GLU GLU SEQRES 2 D 40 ILE LEU LEU LYS LYS VAL SER LYS ILE ILE LYS GLU ALA SEQRES 3 D 40 GLY ALA SER GLY TYR THR VAL LEU ALA ALA ALA GLY GLU SEQRES 4 D 40 GLY SEQRES 1 D 44 ALA TYR SER ASN ILE LYS PHE GLU VAL LEU THR ALA SER SEQRES 2 D 44 ARG GLU LEU ALA ASP GLN ILE GLN ASP LYS VAL VAL ALA SEQRES 3 D 44 LYS TYR PHE ASP ASP TYR SER CYS ILE THR TYR ILE SER SEQRES 4 D 44 THR VAL GLU ALA LEU HET CMP A 277 33 ATOM 1 N GLN A 3 9.312 -13.410 16.169 1.00 73.15 N ATOM 2 CA GLN A 3 8.055 -13.643 15.467 1.00 70.57 C ATOM 3 C GLN A 3 7.180 -12.382 15.429 1.00 76.34 C ATOM 4 O GLN A 3 6.032 -12.435 15.002 1.00 73.70 O ATOM 5 CB GLN A 3 7.282 -14.814 16.098 1.00 75.82 C ATOM 6 CG GLN A 3 6.832 -14.635 17.541 1.00 76.43 C ATOM 7 CD GLN A 3 7.995 -14.487 18.510 1.00 82.40 C ATOM 8 OE1 GLN A 3 9.101 -14.966 18.245 1.00 93.29 O ATOM 9 NE2 GLN A 3 7.752 -13.824 19.635 1.00 84.31 N ATOM 10 HE22 GLN A 3 6.804 -13.437 19.816 1.00 0.00 H ATOM 11 HE21 GLN A 3 8.510 -13.692 20.335 1.00 0.00 H ATOM 12 HN3 GLN A 3 9.113 -13.121 17.148 1.00 0.00 H ATOM 13 HN2 GLN A 3 9.843 -12.658 15.686 1.00 0.00 H ATOM 14 HN1 GLN A 3 9.873 -14.286 16.172 1.00 0.00 H ATOM 15 N GLN A 4 7.734 -11.251 15.862 1.00 71.68 N ATOM 16 CA GLN A 4 7.049 -9.967 15.790 1.00 73.79 C ATOM 17 C GLN A 4 7.383 -9.312 14.453 1.00 71.49 C ATOM 18 O GLN A 4 8.540 -8.971 14.192 1.00 70.09 O ATOM 19 CB GLN A 4 7.451 -9.076 16.962 1.00 70.17 C ATOM 20 CG GLN A 4 6.544 -7.866 17.146 1.00 78.20 C ATOM 21 CD GLN A 4 7.314 -6.606 17.490 1.00 80.86 C ATOM 22 OE1 GLN A 4 8.514 -6.511 17.232 1.00 83.83 O ATOM 23 NE2 GLN A 4 6.624 -5.627 18.065 1.00 78.16 N ATOM 24 HE22 GLN A 4 5.611 -5.752 18.264 1.00 0.00 H ATOM 25 HE21 GLN A 4 7.097 -4.735 18.316 1.00 0.00 H ATOM 26 H GLN A 4 8.691 -11.286 16.267 1.00 0.00 H ATOM 27 N VAL A 5 6.371 -9.138 13.603 1.00 64.89 N ATOM 28 CA VAL A 5 6.554 -8.546 12.285 1.00 63.31 C ATOM 29 C VAL A 5 5.649 -7.321 12.169 1.00 65.23 C ATOM 30 O VAL A 5 4.807 -7.052 13.025 1.00 61.16 O ATOM 31 CB VAL A 5 6.274 -9.540 11.134 1.00 60.20 C ATOM 32 CG1 VAL A 5 7.098 -10.820 11.307 1.00 69.20 C ATOM 33 CG2 VAL A 5 4.793 -9.860 11.039 1.00 60.63 C ATOM 34 H VAL A 5 5.417 -9.436 13.891 1.00 0.00 H ATOM 35 N TRP A 6 5.838 -6.583 11.085 1.00 59.88 N ATOM 36 CA TRP A 6 5.113 -5.354 10.846 1.00 59.44 C ATOM 37 C TRP A 6 4.159 -5.572 9.685 1.00 58.08 C ATOM 38 O TRP A 6 4.488 -6.285 8.728 1.00 56.35 O ATOM 39 CB TRP A 6 6.082 -4.205 10.566 1.00 53.95 C ATOM 40 CG TRP A 6 6.719 -3.732 11.822 1.00 59.48 C ATOM 41 CD1 TRP A 6 6.331 -2.668 12.597 1.00 62.40 C ATOM 42 CD2 TRP A 6 7.822 -4.343 12.501 1.00 64.15 C ATOM 43 NE1 TRP A 6 7.146 -2.569 13.698 1.00 67.69 N ATOM 44 CE2 TRP A 6 8.071 -3.584 13.659 1.00 61.63 C ATOM 45 CE3 TRP A 6 8.640 -5.450 12.228 1.00 68.75 C ATOM 46 CZ2 TRP A 6 9.102 -3.897 14.551 1.00 70.18 C ATOM 47 CZ3 TRP A 6 9.667 -5.763 13.122 1.00 71.98 C ATOM 48 CH2 TRP A 6 9.884 -4.988 14.268 1.00 74.24 C ATOM 49 HE1 TRP A 6 7.075 -1.844 14.440 1.00 0.00 H ATOM 50 H TRP A 6 6.534 -6.899 10.379 1.00 0.00 H ATOM 51 N LYS A 7 2.965 -4.981 9.794 1.00 55.99 N ATOM 52 CA LYS A 7 1.927 -5.069 8.773 1.00 47.61 C ATOM 53 C LYS A 7 1.751 -3.683 8.171 1.00 46.20 C ATOM 54 O LYS A 7 1.314 -2.753 8.857 1.00 45.20 O ATOM 55 CB LYS A 7 0.630 -5.602 9.374 1.00 50.56 C ATOM 56 CG LYS A 7 -0.614 -5.492 8.504 1.00 54.94 C ATOM 57 CD LYS A 7 -1.611 -6.597 8.892 1.00 49.72 C ATOM 58 CE LYS A 7 -3.056 -6.091 8.942 1.00 61.63 C ATOM 59 NZ LYS A 7 -4.066 -7.205 8.944 1.00 51.51 N ATOM 60 HZ1 LYS A 7 -3.958 -7.771 8.078 1.00 0.00 H ATOM 61 HZ2 LYS A 7 -3.912 -7.809 9.776 1.00 0.00 H ATOM 62 HZ3 LYS A 7 -5.024 -6.802 8.979 1.00 0.00 H ATOM 63 H LYS A 7 2.765 -4.429 10.653 1.00 0.00 H ATOM 64 N LEU A 8 2.114 -3.540 6.904 1.00 47.39 N ATOM 65 CA LEU A 8 1.918 -2.289 6.194 1.00 46.58 C ATOM 66 C LEU A 8 0.593 -2.357 5.466 1.00 46.54 C ATOM 67 O LEU A 8 0.264 -3.367 4.850 1.00 45.79 O ATOM 68 CB LEU A 8 3.050 -2.024 5.199 1.00 41.35 C ATOM 69 CG LEU A 8 2.867 -0.884 4.190 1.00 44.31 C ATOM 70 CD1 LEU A 8 2.831 0.521 4.832 1.00 40.33 C ATOM 71 CD2 LEU A 8 3.936 -0.919 3.132 1.00 45.26 C ATOM 72 H LEU A 8 2.549 -4.343 6.407 1.00 0.00 H ATOM 73 N VAL A 9 -0.173 -1.280 5.532 1.00 43.72 N ATOM 74 CA VAL A 9 -1.439 -1.219 4.827 1.00 39.57 C ATOM 75 C VAL A 9 -1.331 -0.102 3.812 1.00 40.21 C ATOM 76 O VAL A 9 -0.850 0.985 4.137 1.00 45.24 O ATOM 77 CB VAL A 9 -2.623 -0.976 5.788 1.00 40.43 C ATOM 78 CG1 VAL A 9 -3.854 -0.546 4.983 1.00 39.26 C ATOM 79 CG2 VAL A 9 -2.911 -2.235 6.569 1.00 43.23 C ATOM 80 H VAL A 9 0.138 -0.465 6.098 1.00 0.00 H ATOM 81 N ILE A 10 -1.753 -0.365 2.587 1.00 40.31 N ATOM 82 CA ILE A 10 -1.922 0.692 1.606 1.00 40.98 C ATOM 83 C ILE A 10 -3.303 0.532 0.978 1.00 43.47 C ATOM 84 O ILE A 10 -3.645 -0.548 0.477 1.00 43.30 O ATOM 85 CB ILE A 10 -0.824 0.658 0.530 1.00 42.86 C ATOM 86 CG1 ILE A 10 0.558 0.701 1.195 1.00 43.73 C ATOM 87 CG2 ILE A 10 -0.967 1.866 -0.413 1.00 43.88 C ATOM 88 CD1 ILE A 10 1.694 0.404 0.227 1.00 52.40 C ATOM 89 H ILE A 10 -1.968 -1.347 2.321 1.00 0.00 H ATOM 90 N ILE A 11 -4.092 1.597 1.016 1.00 44.13 N ATOM 91 CA ILE A 11 -5.418 1.622 0.409 1.00 48.36 C ATOM 92 C ILE A 11 -5.376 2.660 -0.686 1.00 48.79 C ATOM 93 O ILE A 11 -5.096 3.824 -0.415 1.00 51.96 O ATOM 94 CB ILE A 11 -6.510 1.946 1.429 1.00 44.55 C ATOM 95 CG1 ILE A 11 -6.743 0.726 2.318 1.00 40.81 C ATOM 96 CG2 ILE A 11 -7.809 2.374 0.702 1.00 43.72 C ATOM 97 CD1 ILE A 11 -7.306 1.086 3.699 1.00 47.16 C ATOM 98 H ILE A 11 -3.750 2.452 1.500 1.00 0.00 H ATOM 99 N THR A 12 -5.622 2.243 -1.921 1.00 51.75 N ATOM 100 CA THR A 12 -5.451 3.151 -3.039 1.00 55.78 C ATOM 101 C THR A 12 -6.424 2.746 -4.146 1.00 61.54 C ATOM 102 O THR A 12 -7.128 1.736 -4.046 1.00 59.24 O ATOM 103 CB THR A 12 -3.960 3.161 -3.475 1.00 60.24 C ATOM 104 OG1 THR A 12 -3.749 4.082 -4.551 1.00 66.51 O ATOM 105 CG2 THR A 12 -3.502 1.790 -3.902 1.00 56.22 C ATOM 106 HG1 THR A 12 -2.794 4.071 -4.811 1.00 0.00 H ATOM 107 H THR A 12 -5.937 1.266 -2.087 1.00 0.00 H ATOM 108 N GLU A 13 -6.489 3.568 -5.194 1.00 61.21 N ATOM 109 CA GLU A 13 -7.362 3.273 -6.330 1.00 70.85 C ATOM 110 C GLU A 13 -6.995 1.948 -7.001 1.00 65.78 C ATOM 111 O GLU A 13 -5.814 1.582 -7.098 1.00 60.31 O ATOM 112 CB GLU A 13 -7.286 4.401 -7.358 1.00 72.34 C ATOM 113 CG GLU A 13 -7.525 5.786 -6.794 1.00 67.06 C ATOM 114 CD GLU A 13 -7.571 6.845 -7.879 1.00 76.61 C ATOM 115 OE1 GLU A 13 -7.723 8.038 -7.546 1.00 75.66 O ATOM 116 OE2 GLU A 13 -7.463 6.480 -9.072 1.00 78.93 O ATOM 117 H GLU A 13 -5.910 4.432 -5.204 1.00 0.00 H ATOM 118 N GLU A 14 -8.022 1.233 -7.489 1.00 60.22 N ATOM 119 CA GLU A 14 -7.805 -0.071 -8.123 1.00 67.81 C ATOM 120 C GLU A 14 -6.896 0.010 -9.352 1.00 68.38 C ATOM 121 O GLU A 14 -6.298 -1.006 -9.732 1.00 65.75 O ATOM 122 CB GLU A 14 -9.150 -0.725 -8.519 1.00 66.80 C ATOM 123 CG GLU A 14 -9.038 -2.222 -8.932 1.00 73.74 C ATOM 124 CD GLU A 14 -10.275 -3.068 -8.603 1.00 81.51 C ATOM 125 OE1 GLU A 14 -10.481 -3.400 -7.414 1.00 87.27 O ATOM 126 OE2 GLU A 14 -11.023 -3.437 -9.538 1.00 84.54 O ATOM 127 H GLU A 14 -8.988 1.611 -7.416 1.00 0.00 H ATOM 128 N ILE A 15 -6.774 1.191 -9.974 1.00 68.54 N ATOM 129 CA ILE A 15 -5.941 1.348 -11.168 1.00 72.86 C ATOM 130 C ILE A 15 -4.477 1.035 -10.868 1.00 75.86 C ATOM 131 O ILE A 15 -3.728 0.599 -11.755 1.00 76.13 O ATOM 132 CB ILE A 15 -6.111 2.772 -11.740 1.00 68.79 C ATOM 133 CG1 ILE A 15 -5.055 3.073 -12.805 1.00 81.20 C ATOM 134 CG2 ILE A 15 -6.000 3.799 -10.651 1.00 77.60 C ATOM 135 CD1 ILE A 15 -5.371 4.293 -13.660 1.00 86.04 C ATOM 136 H ILE A 15 -7.284 2.016 -9.599 1.00 0.00 H ATOM 137 N LEU A 16 -4.051 1.225 -9.625 1.00 73.53 N ATOM 138 CA LEU A 16 -2.657 1.094 -9.225 1.00 61.89 C ATOM 139 C LEU A 16 -2.268 -0.329 -8.840 1.00 58.83 C ATOM 140 O LEU A 16 -1.159 -0.533 -8.340 1.00 66.92 O ATOM 141 CB LEU A 16 -2.358 2.046 -8.054 1.00 60.97 C ATOM 142 CG LEU A 16 -2.448 3.542 -8.342 1.00 64.40 C ATOM 143 CD1 LEU A 16 -1.818 4.361 -7.227 1.00 57.12 C ATOM 144 CD2 LEU A 16 -1.740 3.818 -9.653 1.00 67.95 C ATOM 145 H LEU A 16 -4.750 1.481 -8.899 1.00 0.00 H ATOM 146 N LEU A 17 -3.131 -1.315 -9.085 1.00 63.61 N ATOM 147 CA LEU A 17 -2.872 -2.685 -8.628 1.00 64.53 C ATOM 148 C LEU A 17 -1.501 -3.217 -9.058 1.00 69.11 C ATOM 149 O LEU A 17 -0.765 -3.797 -8.246 1.00 63.20 O ATOM 150 CB LEU A 17 -3.976 -3.611 -9.139 1.00 58.70 C ATOM 151 CG LEU A 17 -3.777 -5.102 -8.890 1.00 63.45 C ATOM 152 CD1 LEU A 17 -3.508 -5.396 -7.421 1.00 62.54 C ATOM 153 CD2 LEU A 17 -4.997 -5.851 -9.356 1.00 70.51 C ATOM 154 H LEU A 17 -4.005 -1.109 -9.610 1.00 0.00 H ATOM 155 N LYS A 18 -1.157 -3.070 -10.345 1.00 69.75 N ATOM 156 CA LYS A 18 0.094 -3.633 -10.849 1.00 65.36 C ATOM 157 C LYS A 18 1.301 -2.813 -10.408 1.00 61.04 C ATOM 158 O LYS A 18 2.327 -3.372 -9.991 1.00 65.16 O ATOM 159 CB LYS A 18 0.060 -3.724 -12.380 1.00 77.40 C ATOM 160 CG LYS A 18 -0.677 -4.943 -12.935 1.00 81.37 C ATOM 161 CD LYS A 18 -0.438 -5.147 -14.439 1.00 80.05 C ATOM 162 CE LYS A 18 0.919 -5.774 -14.743 1.00 86.93 C ATOM 163 NZ LYS A 18 2.017 -4.772 -14.940 1.00 80.29 N ATOM 164 HZ1 LYS A 18 1.778 -4.150 -15.738 1.00 0.00 H ATOM 165 HZ2 LYS A 18 2.125 -4.204 -14.076 1.00 0.00 H ATOM 166 HZ3 LYS A 18 2.907 -5.270 -15.142 1.00 0.00 H ATOM 167 H LYS A 18 -1.786 -2.551 -10.991 1.00 0.00 H ATOM 168 N LYS A 19 1.188 -1.491 -10.492 1.00 60.99 N ATOM 169 CA LYS A 19 2.300 -0.619 -10.137 1.00 66.73 C ATOM 170 C LYS A 19 2.686 -0.751 -8.668 1.00 65.75 C ATOM 171 O LYS A 19 3.877 -0.840 -8.343 1.00 64.67 O ATOM 172 CB LYS A 19 1.946 0.825 -10.483 1.00 66.40 C ATOM 173 CG LYS A 19 2.086 1.144 -11.978 1.00 69.33 C ATOM 174 CD LYS A 19 0.931 1.973 -12.491 1.00 74.95 C ATOM 175 CE LYS A 19 1.391 2.934 -13.575 1.00 68.23 C ATOM 176 NZ LYS A 19 0.355 3.957 -13.887 1.00 66.71 N ATOM 177 HZ1 LYS A 19 -0.510 3.483 -14.217 1.00 0.00 H ATOM 178 HZ2 LYS A 19 0.145 4.508 -13.030 1.00 0.00 H ATOM 179 HZ3 LYS A 19 0.709 4.592 -14.631 1.00 0.00 H ATOM 180 H LYS A 19 0.292 -1.073 -10.816 1.00 0.00 H ATOM 181 N VAL A 20 1.701 -0.774 -7.763 1.00 58.23 N ATOM 182 CA VAL A 20 2.028 -0.875 -6.344 1.00 55.01 C ATOM 183 C VAL A 20 2.568 -2.262 -6.019 1.00 54.64 C ATOM 184 O VAL A 20 3.548 -2.400 -5.274 1.00 56.48 O ATOM 185 CB VAL A 20 0.806 -0.526 -5.472 1.00 56.81 C ATOM 186 CG1 VAL A 20 1.065 -0.939 -4.030 1.00 52.59 C ATOM 187 CG2 VAL A 20 0.521 0.956 -5.534 1.00 51.45 C ATOM 188 H VAL A 20 0.708 -0.720 -8.069 1.00 0.00 H ATOM 189 N SER A 21 1.950 -3.311 -6.578 1.00 55.60 N ATOM 190 CA SER A 21 2.446 -4.667 -6.344 1.00 62.98 C ATOM 191 C SER A 21 3.856 -4.855 -6.893 1.00 61.62 C ATOM 192 O SER A 21 4.619 -5.682 -6.377 1.00 59.59 O ATOM 193 CB SER A 21 1.500 -5.689 -6.962 1.00 64.46 C ATOM 194 OG SER A 21 0.251 -5.649 -6.311 1.00 73.56 O ATOM 195 HG SER A 21 -0.140 -4.745 -6.406 1.00 0.00 H ATOM 196 H SER A 21 1.115 -3.161 -7.180 1.00 0.00 H ATOM 197 N LYS A 22 4.226 -4.093 -7.926 1.00 67.13 N ATOM 198 CA LYS A 22 5.613 -4.102 -8.395 1.00 67.09 C ATOM 199 C LYS A 22 6.557 -3.549 -7.332 1.00 63.37 C ATOM 200 O LYS A 22 7.577 -4.168 -7.009 1.00 68.23 O ATOM 201 CB LYS A 22 5.744 -3.294 -9.688 1.00 71.41 C ATOM 202 CG LYS A 22 7.198 -3.089 -10.143 1.00 79.43 C ATOM 203 CD LYS A 22 7.283 -2.237 -11.403 1.00 76.96 C ATOM 204 CE LYS A 22 6.380 -2.784 -12.500 1.00 87.28 C ATOM 205 NZ LYS A 22 7.138 -3.003 -13.768 1.00 89.75 N ATOM 206 HZ1 LYS A 22 7.541 -2.100 -14.090 1.00 0.00 H ATOM 207 HZ2 LYS A 22 7.905 -3.685 -13.599 1.00 0.00 H ATOM 208 HZ3 LYS A 22 6.495 -3.376 -14.495 1.00 0.00 H ATOM 209 H LYS A 22 3.524 -3.489 -8.400 1.00 0.00 H ATOM 210 N ILE A 23 6.225 -2.380 -6.773 1.00 66.73 N ATOM 211 CA ILE A 23 7.053 -1.771 -5.735 1.00 57.95 C ATOM 212 C ILE A 23 7.251 -2.730 -4.572 1.00 55.93 C ATOM 213 O ILE A 23 8.367 -2.894 -4.055 1.00 61.42 O ATOM 214 CB ILE A 23 6.426 -0.442 -5.287 1.00 57.18 C ATOM 215 CG1 ILE A 23 6.334 0.509 -6.484 1.00 58.72 C ATOM 216 CG2 ILE A 23 7.213 0.174 -4.166 1.00 53.68 C ATOM 217 CD1 ILE A 23 5.817 1.882 -6.145 1.00 63.09 C ATOM 218 H ILE A 23 5.359 -1.895 -7.084 1.00 0.00 H ATOM 219 N ILE A 24 6.182 -3.404 -4.165 1.00 53.20 N ATOM 220 CA ILE A 24 6.281 -4.399 -3.107 1.00 53.85 C ATOM 221 C ILE A 24 7.236 -5.521 -3.514 1.00 57.54 C ATOM 222 O ILE A 24 8.170 -5.857 -2.784 1.00 54.89 O ATOM 223 CB ILE A 24 4.884 -4.950 -2.771 1.00 56.39 C ATOM 224 CG1 ILE A 24 3.957 -3.834 -2.272 1.00 52.60 C ATOM 225 CG2 ILE A 24 4.973 -6.066 -1.756 1.00 43.59 C ATOM 226 CD1 ILE A 24 2.482 -4.254 -2.303 1.00 47.12 C ATOM 227 H ILE A 24 5.260 -3.218 -4.609 1.00 0.00 H ATOM 228 N LYS A 25 6.995 -6.134 -4.675 1.00 58.45 N ATOM 229 CA LYS A 25 7.748 -7.332 -5.040 1.00 68.90 C ATOM 230 C LYS A 25 9.231 -7.024 -5.199 1.00 65.37 C ATOM 231 O LYS A 25 10.088 -7.760 -4.695 1.00 68.13 O ATOM 232 CB LYS A 25 7.167 -7.933 -6.322 1.00 63.61 C ATOM 233 CG LYS A 25 6.443 -9.258 -6.119 1.00 65.72 C ATOM 234 CD LYS A 25 7.422 -10.352 -5.691 1.00 84.18 C ATOM 235 CE LYS A 25 6.734 -11.703 -5.519 1.00 82.07 C ATOM 236 NZ LYS A 25 7.662 -12.741 -4.975 1.00 79.01 N ATOM 237 HZ1 LYS A 25 8.462 -12.865 -5.628 1.00 0.00 H ATOM 238 HZ2 LYS A 25 8.015 -12.436 -4.046 1.00 0.00 H ATOM 239 HZ3 LYS A 25 7.152 -13.642 -4.875 1.00 0.00 H ATOM 240 H LYS A 25 6.271 -5.759 -5.320 1.00 0.00 H ATOM 241 N GLU A 26 9.554 -5.910 -5.852 1.00 68.08 N ATOM 242 CA GLU A 26 10.956 -5.600 -6.105 1.00 72.84 C ATOM 243 C GLU A 26 11.677 -5.210 -4.820 1.00 74.64 C ATOM 244 O GLU A 26 12.830 -5.606 -4.603 1.00 72.20 O ATOM 245 CB GLU A 26 11.074 -4.483 -7.150 1.00 74.31 C ATOM 246 CG GLU A 26 10.353 -4.722 -8.508 1.00 75.87 C ATOM 247 CD GLU A 26 10.189 -6.194 -8.929 1.00 87.76 C ATOM 248 OE1 GLU A 26 11.118 -7.018 -8.730 1.00 93.03 O ATOM 249 OE2 GLU A 26 9.105 -6.525 -9.474 1.00 86.16 O ATOM 250 H GLU A 26 8.809 -5.263 -6.181 1.00 0.00 H ATOM 251 N ALA A 27 11.018 -4.437 -3.950 1.00 71.33 N ATOM 252 CA ALA A 27 11.666 -3.963 -2.729 1.00 62.82 C ATOM 253 C ALA A 27 12.133 -5.107 -1.841 1.00 60.41 C ATOM 254 O ALA A 27 12.950 -4.887 -0.943 1.00 69.85 O ATOM 255 CB ALA A 27 10.721 -3.050 -1.943 1.00 63.01 C ATOM 256 H ALA A 27 10.032 -4.170 -4.145 1.00 0.00 H ATOM 257 N GLY A 28 11.642 -6.317 -2.069 1.00 64.61 N ATOM 258 CA GLY A 28 12.092 -7.472 -1.329 1.00 67.20 C ATOM 259 C GLY A 28 11.083 -8.077 -0.386 1.00 59.80 C ATOM 260 O GLY A 28 11.467 -8.898 0.457 1.00 56.09 O ATOM 261 H GLY A 28 10.913 -6.438 -2.801 1.00 0.00 H ATOM 262 N ALA A 29 9.809 -7.708 -0.487 1.00 63.97 N ATOM 263 CA ALA A 29 8.812 -8.294 0.396 1.00 57.81 C ATOM 264 C ALA A 29 8.530 -9.725 -0.028 1.00 51.82 C ATOM 265 O ALA A 29 8.470 -10.037 -1.220 1.00 58.49 O ATOM 266 CB ALA A 29 7.520 -7.473 0.381 1.00 59.41 C ATOM 267 H ALA A 29 9.526 -7.002 -1.196 1.00 0.00 H ATOM 268 N SER A 30 8.344 -10.602 0.955 1.00 55.13 N ATOM 269 CA SER A 30 8.085 -12.002 0.639 1.00 57.95 C ATOM 270 C SER A 30 6.696 -12.243 0.054 1.00 69.10 C ATOM 271 O SER A 30 6.394 -13.403 -0.283 1.00 66.19 O ATOM 272 CB SER A 30 8.267 -12.851 1.891 1.00 59.61 C ATOM 273 OG SER A 30 7.208 -12.603 2.803 1.00 71.86 O ATOM 274 HG SER A 30 7.334 -13.158 3.613 1.00 0.00 H ATOM 275 H SER A 30 8.383 -10.290 1.946 1.00 0.00 H ATOM 276 N GLY A 31 5.868 -11.210 -0.063 1.00 59.05 N ATOM 277 CA GLY A 31 4.520 -11.358 -0.588 1.00 54.33 C ATOM 278 C GLY A 31 3.618 -10.230 -0.140 1.00 52.24 C ATOM 279 O GLY A 31 4.017 -9.311 0.589 1.00 50.19 O ATOM 280 H GLY A 31 6.194 -10.267 0.230 1.00 0.00 H ATOM 281 N TYR A 32 2.365 -10.310 -0.593 1.00 52.40 N ATOM 282 CA TYR A 32 1.376 -9.306 -0.221 1.00 52.74 C ATOM 283 C TYR A 32 -0.011 -9.902 -0.362 1.00 59.15 C ATOM 284 O TYR A 32 -0.205 -10.926 -1.018 1.00 54.83 O ATOM 285 CB TYR A 32 1.494 -8.048 -1.078 1.00 46.86 C ATOM 286 CG TYR A 32 1.165 -8.289 -2.539 1.00 58.54 C ATOM 287 CD1 TYR A 32 -0.089 -7.965 -3.058 1.00 55.90 C ATOM 288 CD2 TYR A 32 2.111 -8.848 -3.404 1.00 57.33 C ATOM 289 CE1 TYR A 32 -0.389 -8.186 -4.401 1.00 66.06 C ATOM 290 CE2 TYR A 32 1.818 -9.079 -4.752 1.00 58.64 C ATOM 291 CZ TYR A 32 0.570 -8.752 -5.240 1.00 68.46 C ATOM 292 OH TYR A 32 0.273 -8.971 -6.564 1.00 71.92 O ATOM 293 HH TYR A 32 -0.657 -8.682 -6.745 1.00 0.00 H ATOM 294 H TYR A 32 2.092 -11.096 -1.217 1.00 0.00 H ATOM 295 N THR A 33 -0.980 -9.236 0.275 1.00 58.26 N ATOM 296 CA THR A 33 -2.386 -9.586 0.182 1.00 47.19 C ATOM 297 C THR A 33 -3.163 -8.354 -0.269 1.00 55.41 C ATOM 298 O THR A 33 -2.786 -7.215 0.017 1.00 51.89 O ATOM 299 CB THR A 33 -2.904 -10.090 1.528 1.00 58.70 C ATOM 300 OG1 THR A 33 -2.193 -11.272 1.890 1.00 50.12 O ATOM 301 CG2 THR A 33 -4.410 -10.382 1.504 1.00 56.31 C ATOM 302 HG1 THR A 33 -1.227 -11.066 1.961 1.00 0.00 H ATOM 303 H THR A 33 -0.712 -8.425 0.868 1.00 0.00 H ATOM 304 N VAL A 34 -4.242 -8.575 -1.001 1.00 50.95 N ATOM 305 CA VAL A 34 -4.977 -7.459 -1.560 1.00 47.44 C ATOM 306 C VAL A 34 -6.450 -7.835 -1.531 1.00 52.99 C ATOM 307 O VAL A 34 -6.810 -8.990 -1.772 1.00 54.08 O ATOM 308 CB VAL A 34 -4.459 -7.088 -2.965 1.00 52.35 C ATOM 309 CG1 VAL A 34 -4.696 -8.195 -3.961 1.00 53.18 C ATOM 310 CG2 VAL A 34 -5.097 -5.785 -3.428 1.00 56.87 C ATOM 311 H VAL A 34 -4.562 -9.549 -1.175 1.00 0.00 H ATOM 312 N LEU A 35 -7.285 -6.872 -1.132 1.00 51.27 N ATOM 313 CA LEU A 35 -8.721 -7.082 -0.974 1.00 52.80 C ATOM 314 C LEU A 35 -9.472 -5.921 -1.610 1.00 49.62 C ATOM 315 O LEU A 35 -8.983 -4.793 -1.641 1.00 51.71 O ATOM 316 CB LEU A 35 -9.117 -7.211 0.506 1.00 55.05 C ATOM 317 CG LEU A 35 -8.266 -8.082 1.439 1.00 57.68 C ATOM 318 CD1 LEU A 35 -7.308 -7.236 2.281 1.00 53.88 C ATOM 319 CD2 LEU A 35 -9.161 -8.921 2.343 1.00 60.82 C ATOM 320 H LEU A 35 -6.895 -5.931 -0.925 1.00 0.00 H ATOM 321 N ALA A 36 -10.659 -6.199 -2.133 1.00 55.18 N ATOM 322 CA ALA A 36 -11.435 -5.136 -2.746 1.00 53.59 C ATOM 323 C ALA A 36 -12.039 -4.282 -1.635 1.00 51.79 C ATOM 324 O ALA A 36 -12.451 -4.802 -0.597 1.00 48.86 O ATOM 325 CB ALA A 36 -12.511 -5.717 -3.667 1.00 50.58 C ATOM 326 H ALA A 36 -11.030 -7.170 -2.104 1.00 0.00 H ATOM 327 N ALA A 37 -12.035 -2.964 -1.822 1.00 48.84 N ATOM 328 CA ALA A 37 -12.495 -2.051 -0.779 1.00 52.03 C ATOM 329 C ALA A 37 -13.247 -0.878 -1.389 1.00 58.67 C ATOM 330 O ALA A 37 -12.994 -0.484 -2.527 1.00 54.75 O ATOM 331 CB ALA A 37 -11.330 -1.505 0.057 1.00 54.96 C ATOM 332 H ALA A 37 -11.698 -2.578 -2.727 1.00 0.00 H ATOM 333 N ALA A 38 -14.159 -0.303 -0.609 1.00 51.36 N ATOM 334 CA ALA A 38 -14.812 0.934 -0.996 1.00 54.38 C ATOM 335 C ALA A 38 -14.638 1.936 0.131 1.00 51.88 C ATOM 336 O ALA A 38 -14.129 1.606 1.195 1.00 49.56 O ATOM 337 CB ALA A 38 -16.298 0.712 -1.301 1.00 55.43 C ATOM 338 H ALA A 38 -14.409 -0.749 0.297 1.00 0.00 H ATOM 339 N GLY A 39 -15.081 3.160 -0.096 1.00 55.48 N ATOM 340 CA GLY A 39 -15.104 4.139 0.972 1.00 62.49 C ATOM 341 C GLY A 39 -15.053 5.556 0.439 1.00 54.10 C ATOM 342 O GLY A 39 -15.191 5.801 -0.758 1.00 54.90 O ATOM 343 H GLY A 39 -15.415 3.422 -1.046 1.00 0.00 H ATOM 344 N GLU A 40 -14.858 6.487 1.379 1.00 56.96 N ATOM 345 CA GLU A 40 -14.804 7.918 1.107 1.00 58.06 C ATOM 346 C GLU A 40 -13.654 8.524 1.891 1.00 61.01 C ATOM 347 O GLU A 40 -13.219 7.978 2.909 1.00 61.26 O ATOM 348 CB GLU A 40 -16.111 8.638 1.498 1.00 59.74 C ATOM 349 CG GLU A 40 -17.360 7.776 1.402 1.00 60.70 C ATOM 350 CD GLU A 40 -18.644 8.595 1.424 1.00 70.91 C ATOM 351 OE1 GLU A 40 -18.780 9.515 0.588 1.00 65.04 O ATOM 352 OE2 GLU A 40 -19.514 8.315 2.280 1.00 68.07 O ATOM 353 H GLU A 40 -14.738 6.171 2.363 1.00 0.00 H ATOM 354 N GLY A 41 -13.178 9.674 1.421 1.00 61.57 N ATOM 355 CA GLY A 41 -12.124 10.405 2.108 1.00 58.16 C ATOM 356 C GLY A 41 -12.033 11.868 1.723 1.00 65.17 C ATOM 357 O GLY A 41 -12.943 12.643 2.027 1.00 74.47 O ATOM 358 H GLY A 41 -13.570 10.061 0.539 1.00 0.00 H TER 359 GLY A 41 ATOM 360 N ALA A 56 -19.328 1.524 -3.791 1.00 71.35 N ATOM 361 CA ALA A 56 -18.729 0.907 -4.978 1.00 69.96 C ATOM 362 C ALA A 56 -17.276 0.486 -4.743 1.00 67.94 C ATOM 363 O ALA A 56 -16.411 1.319 -4.466 1.00 70.75 O ATOM 364 CB ALA A 56 -18.809 1.851 -6.163 1.00 73.88 C ATOM 365 HN3 ALA A 56 -18.784 2.372 -3.531 1.00 0.00 H ATOM 366 HN2 ALA A 56 -19.312 0.845 -3.003 1.00 0.00 H ATOM 367 HN1 ALA A 56 -20.311 1.792 -4.000 1.00 0.00 H ATOM 368 N TYR A 57 -17.006 -0.817 -4.885 1.00 64.90 N ATOM 369 CA TYR A 57 -15.706 -1.383 -4.526 1.00 65.35 C ATOM 370 C TYR A 57 -14.684 -1.075 -5.627 1.00 62.87 C ATOM 371 O TYR A 57 -14.253 -1.939 -6.395 1.00 70.16 O ATOM 372 CB TYR A 57 -15.853 -2.873 -4.248 1.00 58.75 C ATOM 373 CG TYR A 57 -16.712 -3.143 -3.032 1.00 59.34 C ATOM 374 CD1 TYR A 57 -16.152 -3.160 -1.755 1.00 61.67 C ATOM 375 CD2 TYR A 57 -18.086 -3.343 -3.149 1.00 62.02 C ATOM 376 CE1 TYR A 57 -16.932 -3.391 -0.627 1.00 54.59 C ATOM 377 CE2 TYR A 57 -18.881 -3.566 -2.020 1.00 65.42 C ATOM 378 CZ TYR A 57 -18.289 -3.586 -0.769 1.00 56.21 C ATOM 379 OH TYR A 57 -19.039 -3.832 0.338 1.00 64.58 O ATOM 380 HH TYR A 57 -19.459 -4.725 0.259 1.00 0.00 H ATOM 381 H TYR A 57 -17.743 -1.446 -5.262 1.00 0.00 H ATOM 382 N SER A 58 -14.281 0.200 -5.667 1.00 59.89 N ATOM 383 CA SER A 58 -13.373 0.743 -6.674 1.00 64.82 C ATOM 384 C SER A 58 -11.926 0.852 -6.199 1.00 64.40 C ATOM 385 O SER A 58 -11.071 1.306 -6.962 1.00 60.79 O ATOM 386 CB SER A 58 -13.856 2.130 -7.108 1.00 67.18 C ATOM 387 OG SER A 58 -14.143 2.939 -5.980 1.00 69.74 O ATOM 388 HG SER A 58 -14.851 2.509 -5.438 1.00 0.00 H ATOM 389 H SER A 58 -14.637 0.846 -4.934 1.00 0.00 H ATOM 390 N ASN A 59 -11.639 0.494 -4.954 1.00 60.82 N ATOM 391 CA ASN A 59 -10.313 0.616 -4.372 1.00 49.89 C ATOM 392 C ASN A 59 -9.827 -0.770 -4.001 1.00 49.28 C ATOM 393 O ASN A 59 -10.584 -1.740 -3.992 1.00 52.69 O ATOM 394 CB ASN A 59 -10.302 1.504 -3.107 1.00 52.39 C ATOM 395 CG ASN A 59 -10.874 2.897 -3.342 1.00 63.04 C ATOM 396 OD1 ASN A 59 -10.645 3.517 -4.381 1.00 64.24 O ATOM 397 ND2 ASN A 59 -11.603 3.404 -2.358 1.00 63.36 N ATOM 398 HD22 ASN A 59 -11.773 2.847 -1.496 1.00 0.00 H ATOM 399 HD21 ASN A 59 -12.005 4.359 -2.448 1.00 0.00 H ATOM 400 H ASN A 59 -12.403 0.106 -4.364 1.00 0.00 H ATOM 401 N ILE A 60 -8.560 -0.842 -3.638 1.00 50.60 N ATOM 402 CA ILE A 60 -7.962 -2.066 -3.134 1.00 49.23 C ATOM 403 C ILE A 60 -7.206 -1.715 -1.867 1.00 47.37 C ATOM 404 O ILE A 60 -6.673 -0.613 -1.710 1.00 45.76 O ATOM 405 CB ILE A 60 -7.011 -2.737 -4.160 1.00 53.48 C ATOM 406 CG1 ILE A 60 -5.778 -1.858 -4.398 1.00 58.88 C ATOM 407 CG2 ILE A 60 -7.741 -3.013 -5.466 1.00 50.57 C ATOM 408 CD1 ILE A 60 -5.047 -2.147 -5.692 1.00 57.94 C ATOM 409 H ILE A 60 -7.968 0.009 -3.716 1.00 0.00 H ATOM 410 N LYS A 61 -7.153 -2.665 -0.967 1.00 42.25 N ATOM 411 CA LYS A 61 -6.404 -2.514 0.259 1.00 45.02 C ATOM 412 C LYS A 61 -5.226 -3.474 0.178 1.00 46.97 C ATOM 413 O LYS A 61 -5.426 -4.683 0.061 1.00 44.63 O ATOM 414 CB LYS A 61 -7.284 -2.819 1.469 1.00 45.11 C ATOM 415 CG LYS A 61 -6.563 -2.918 2.784 1.00 48.10 C ATOM 416 CD LYS A 61 -7.525 -3.477 3.830 1.00 54.73 C ATOM 417 CE LYS A 61 -7.189 -2.975 5.228 1.00 56.84 C ATOM 418 NZ LYS A 61 -7.799 -3.815 6.304 1.00 50.54 N ATOM 419 HZ1 LYS A 61 -8.834 -3.808 6.202 1.00 0.00 H ATOM 420 HZ2 LYS A 61 -7.448 -4.790 6.222 1.00 0.00 H ATOM 421 HZ3 LYS A 61 -7.538 -3.428 7.234 1.00 0.00 H ATOM 422 H LYS A 61 -7.665 -3.554 -1.140 1.00 0.00 H ATOM 423 N PHE A 62 -4.013 -2.935 0.257 1.00 41.75 N ATOM 424 CA PHE A 62 -2.802 -3.746 0.323 1.00 45.06 C ATOM 425 C PHE A 62 -2.437 -4.051 1.763 1.00 49.29 C ATOM 426 O PHE A 62 -2.534 -3.178 2.637 1.00 49.57 O ATOM 427 CB PHE A 62 -1.645 -3.014 -0.352 1.00 50.52 C ATOM 428 CG PHE A 62 -1.672 -3.122 -1.831 1.00 51.64 C ATOM 429 CD1 PHE A 62 -1.219 -4.281 -2.460 1.00 55.30 C ATOM 430 CD2 PHE A 62 -2.146 -2.077 -2.605 1.00 51.66 C ATOM 431 CE1 PHE A 62 -1.251 -4.398 -3.843 1.00 56.57 C ATOM 432 CE2 PHE A 62 -2.173 -2.183 -3.990 1.00 57.40 C ATOM 433 CZ PHE A 62 -1.721 -3.346 -4.613 1.00 58.39 C ATOM 434 H PHE A 62 -3.924 -1.899 0.272 1.00 0.00 H ATOM 435 N GLU A 63 -2.059 -5.307 2.020 1.00 42.99 N ATOM 436 CA GLU A 63 -1.509 -5.706 3.317 1.00 47.92 C ATOM 437 C GLU A 63 -0.172 -6.401 3.071 1.00 53.52 C ATOM 438 O GLU A 63 -0.138 -7.481 2.474 1.00 44.99 O ATOM 439 CB GLU A 63 -2.452 -6.631 4.069 1.00 46.72 C ATOM 440 CG GLU A 63 -3.896 -6.128 4.212 1.00 55.66 C ATOM 441 CD GLU A 63 -4.604 -6.834 5.333 1.00 54.65 C ATOM 442 OE1 GLU A 63 -5.032 -6.159 6.298 1.00 73.02 O ATOM 443 OE2 GLU A 63 -4.705 -8.075 5.266 1.00 57.85 O ATOM 444 H GLU A 63 -2.159 -6.025 1.274 1.00 0.00 H ATOM 445 N VAL A 64 0.918 -5.791 3.520 1.00 50.91 N ATOM 446 CA VAL A 64 2.255 -6.341 3.334 1.00 48.86 C ATOM 447 C VAL A 64 2.846 -6.585 4.710 1.00 48.02 C ATOM 448 O VAL A 64 3.049 -5.638 5.477 1.00 51.02 O ATOM 449 CB VAL A 64 3.166 -5.407 2.519 1.00 50.12 C ATOM 450 CG1 VAL A 64 4.341 -6.196 1.921 1.00 50.25 C ATOM 451 CG2 VAL A 64 2.394 -4.695 1.415 1.00 43.36 C ATOM 452 H VAL A 64 0.814 -4.887 4.023 1.00 0.00 H ATOM 453 N LEU A 65 3.097 -7.844 5.028 1.00 42.57 N ATOM 454 CA LEU A 65 3.816 -8.228 6.231 1.00 50.63 C ATOM 455 C LEU A 65 5.306 -8.291 5.917 1.00 53.52 C ATOM 456 O LEU A 65 5.698 -8.832 4.881 1.00 52.05 O ATOM 457 CB LEU A 65 3.330 -9.584 6.734 1.00 56.17 C ATOM 458 CG LEU A 65 1.844 -9.621 7.082 1.00 63.97 C ATOM 459 CD1 LEU A 65 1.327 -11.055 7.019 1.00 62.89 C ATOM 460 CD2 LEU A 65 1.593 -8.993 8.434 1.00 53.33 C ATOM 461 H LEU A 65 2.765 -8.593 4.388 1.00 0.00 H ATOM 462 N THR A 66 6.125 -7.695 6.785 1.00 57.46 N ATOM 463 CA THR A 66 7.573 -7.640 6.592 1.00 53.27 C ATOM 464 C THR A 66 8.266 -7.892 7.920 1.00 55.77 C ATOM 465 O THR A 66 7.815 -7.432 8.974 1.00 55.12 O ATOM 466 CB THR A 66 8.070 -6.281 6.079 1.00 51.02 C ATOM 467 OG1 THR A 66 8.112 -5.370 7.183 1.00 60.16 O ATOM 468 CG2 THR A 66 7.159 -5.709 5.016 1.00 54.96 C ATOM 469 HG1 THR A 66 8.730 -5.719 7.874 1.00 0.00 H ATOM 470 H THR A 66 5.717 -7.252 7.633 1.00 0.00 H ATOM 471 N ALA A 67 9.410 -8.578 7.852 1.00 60.24 N ATOM 472 CA ALA A 67 10.129 -8.933 9.066 1.00 51.13 C ATOM 473 C ALA A 67 10.759 -7.721 9.723 1.00 58.01 C ATOM 474 O ALA A 67 10.976 -7.730 10.939 1.00 65.61 O ATOM 475 CB ALA A 67 11.200 -9.988 8.758 1.00 61.36 C ATOM 476 H ALA A 67 9.789 -8.860 6.926 1.00 0.00 H ATOM 477 N SER A 68 11.020 -6.664 8.971 1.00 50.22 N ATOM 478 CA SER A 68 11.640 -5.493 9.551 1.00 54.62 C ATOM 479 C SER A 68 10.773 -4.272 9.292 1.00 56.40 C ATOM 480 O SER A 68 10.195 -4.138 8.209 1.00 53.65 O ATOM 481 CB SER A 68 13.032 -5.271 8.980 1.00 54.29 C ATOM 482 OG SER A 68 12.940 -4.817 7.650 1.00 58.28 O ATOM 483 HG SER A 68 12.438 -3.964 7.628 1.00 0.00 H ATOM 484 H SER A 68 10.779 -6.675 7.959 1.00 0.00 H ATOM 485 N ARG A 69 10.707 -3.392 10.302 1.00 50.67 N ATOM 486 CA ARG A 69 10.058 -2.091 10.160 1.00 52.30 C ATOM 487 C ARG A 69 10.678 -1.298 9.030 1.00 55.24 C ATOM 488 O ARG A 69 9.971 -0.651 8.253 1.00 49.62 O ATOM 489 CB ARG A 69 10.144 -1.298 11.482 1.00 46.95 C ATOM 490 CG ARG A 69 9.638 0.118 11.393 1.00 54.36 C ATOM 491 CD ARG A 69 8.143 0.091 11.047 1.00 54.55 C ATOM 492 NE ARG A 69 7.535 1.418 10.966 1.00 59.55 N ATOM 493 CZ ARG A 69 6.936 2.010 11.997 1.00 59.57 C ATOM 494 NH1 ARG A 69 6.905 1.390 13.158 1.00 54.49 N ATOM 495 NH2 ARG A 69 6.378 3.206 11.878 1.00 57.70 N ATOM 496 HE ARG A 69 7.572 1.924 10.058 1.00 0.00 H ATOM 497 HH12 ARG A 69 6.441 1.838 13.974 1.00 0.00 H ATOM 498 HH11 ARG A 69 7.344 0.453 13.259 1.00 0.00 H ATOM 499 HH22 ARG A 69 5.916 3.648 12.698 1.00 0.00 H ATOM 500 HH21 ARG A 69 6.402 3.703 10.965 1.00 0.00 H ATOM 501 H ARG A 69 11.132 -3.644 11.217 1.00 0.00 H ATOM 502 N GLU A 70 12.006 -1.366 8.893 1.00 54.92 N ATOM 503 CA GLU A 70 12.669 -0.557 7.882 1.00 46.79 C ATOM 504 C GLU A 70 12.223 -0.944 6.480 1.00 43.75 C ATOM 505 O GLU A 70 12.016 -0.073 5.634 1.00 46.55 O ATOM 506 CB GLU A 70 14.193 -0.692 8.024 1.00 58.01 C ATOM 507 CG GLU A 70 14.982 -0.075 6.892 1.00 49.84 C ATOM 508 CD GLU A 70 14.910 1.456 6.851 1.00 63.28 C ATOM 509 OE1 GLU A 70 14.371 2.090 7.810 1.00 58.69 O ATOM 510 OE2 GLU A 70 15.418 2.022 5.850 1.00 56.86 O ATOM 511 H GLU A 70 12.563 -1.995 9.507 1.00 0.00 H ATOM 512 N LEU A 71 12.068 -2.240 6.203 1.00 46.18 N ATOM 513 CA LEU A 71 11.498 -2.634 4.911 1.00 54.67 C ATOM 514 C LEU A 71 10.090 -2.041 4.711 1.00 52.99 C ATOM 515 O LEU A 71 9.794 -1.427 3.673 1.00 47.34 O ATOM 516 CB LEU A 71 11.462 -4.160 4.799 1.00 52.22 C ATOM 517 CG LEU A 71 10.930 -4.774 3.493 1.00 50.38 C ATOM 518 CD1 LEU A 71 11.650 -4.240 2.254 1.00 55.21 C ATOM 519 CD2 LEU A 71 10.974 -6.311 3.530 1.00 62.40 C ATOM 520 H LEU A 71 12.349 -2.963 6.896 1.00 0.00 H ATOM 521 N ALA A 72 9.204 -2.229 5.688 1.00 50.71 N ATOM 522 CA ALA A 72 7.851 -1.660 5.572 1.00 51.81 C ATOM 523 C ALA A 72 7.915 -0.170 5.271 1.00 49.00 C ATOM 524 O ALA A 72 7.279 0.313 4.332 1.00 46.18 O ATOM 525 CB ALA A 72 7.080 -1.908 6.860 1.00 46.59 C ATOM 526 H ALA A 72 9.468 -2.777 6.532 1.00 0.00 H ATOM 527 N ASP A 73 8.774 0.545 6.004 1.00 57.13 N ATOM 528 CA ASP A 73 8.994 1.968 5.785 1.00 52.63 C ATOM 529 C ASP A 73 9.530 2.271 4.396 1.00 47.38 C ATOM 530 O ASP A 73 9.243 3.336 3.842 1.00 56.26 O ATOM 531 CB ASP A 73 9.976 2.499 6.829 1.00 52.91 C ATOM 532 CG ASP A 73 9.295 2.863 8.122 1.00 63.69 C ATOM 533 OD1 ASP A 73 8.040 2.916 8.115 1.00 67.10 O ATOM 534 OD2 ASP A 73 9.995 3.095 9.137 1.00 62.50 O ATOM 535 H ASP A 73 9.306 0.067 6.759 1.00 0.00 H ATOM 536 N GLN A 74 10.345 1.387 3.831 1.00 55.16 N ATOM 537 CA GLN A 74 10.914 1.689 2.519 1.00 53.99 C ATOM 538 C GLN A 74 9.877 1.513 1.428 1.00 47.57 C ATOM 539 O GLN A 74 9.838 2.288 0.465 1.00 44.55 O ATOM 540 CB GLN A 74 12.144 0.804 2.248 1.00 47.92 C ATOM 541 CG GLN A 74 13.304 1.124 3.189 1.00 53.86 C ATOM 542 CD GLN A 74 14.684 0.763 2.621 1.00 58.63 C ATOM 543 OE1 GLN A 74 14.815 0.418 1.451 1.00 57.72 O ATOM 544 NE2 GLN A 74 15.711 0.845 3.462 1.00 50.92 N ATOM 545 HE22 GLN A 74 15.555 1.142 4.446 1.00 0.00 H ATOM 546 HE21 GLN A 74 16.670 0.612 3.135 1.00 0.00 H ATOM 547 H GLN A 74 10.574 0.495 4.314 1.00 0.00 H ATOM 548 N ILE A 75 9.032 0.493 1.559 1.00 48.64 N ATOM 549 CA ILE A 75 7.969 0.296 0.583 1.00 52.72 C ATOM 550 C ILE A 75 6.987 1.455 0.639 1.00 46.24 C ATOM 551 O ILE A 75 6.620 2.029 -0.393 1.00 49.93 O ATOM 552 CB ILE A 75 7.275 -1.056 0.812 1.00 51.04 C ATOM 553 CG1 ILE A 75 8.185 -2.181 0.324 1.00 49.94 C ATOM 554 CG2 ILE A 75 5.971 -1.082 0.060 1.00 51.31 C ATOM 555 CD1 ILE A 75 7.821 -3.575 0.835 1.00 47.95 C ATOM 556 H ILE A 75 9.131 -0.164 2.359 1.00 0.00 H ATOM 557 N GLN A 76 6.616 1.868 1.855 1.00 52.63 N ATOM 558 CA GLN A 76 5.644 2.949 2.021 1.00 51.04 C ATOM 559 C GLN A 76 6.197 4.277 1.516 1.00 54.11 C ATOM 560 O GLN A 76 5.488 5.045 0.849 1.00 51.05 O ATOM 561 CB GLN A 76 5.259 3.057 3.490 1.00 46.69 C ATOM 562 CG GLN A 76 4.548 4.353 3.890 1.00 56.72 C ATOM 563 CD GLN A 76 4.373 4.466 5.398 1.00 54.15 C ATOM 564 OE1 GLN A 76 5.312 4.828 6.107 1.00 53.39 O ATOM 565 NE2 GLN A 76 3.167 4.134 5.898 1.00 44.83 N ATOM 566 HE22 GLN A 76 2.404 3.834 5.259 1.00 0.00 H ATOM 567 HE21 GLN A 76 2.999 4.178 6.923 1.00 0.00 H ATOM 568 H GLN A 76 7.025 1.414 2.697 1.00 0.00 H ATOM 569 N ASP A 77 7.463 4.562 1.824 1.00 49.81 N ATOM 570 CA ASP A 77 8.072 5.811 1.372 1.00 53.41 C ATOM 571 C ASP A 77 8.136 5.893 -0.150 1.00 52.13 C ATOM 572 O ASP A 77 7.968 6.974 -0.719 1.00 56.29 O ATOM 573 CB ASP A 77 9.474 5.964 1.973 1.00 57.77 C ATOM 574 CG ASP A 77 9.449 6.309 3.474 1.00 80.69 C ATOM 575 OD1 ASP A 77 10.428 5.934 4.161 1.00 78.33 O ATOM 576 OD2 ASP A 77 8.467 6.942 3.969 1.00 78.35 O ATOM 577 H ASP A 77 8.021 3.891 2.390 1.00 0.00 H ATOM 578 N LYS A 78 8.356 4.768 -0.832 1.00 56.68 N ATOM 579 CA LYS A 78 8.353 4.809 -2.289 1.00 54.83 C ATOM 580 C LYS A 78 6.939 4.976 -2.833 1.00 58.69 C ATOM 581 O LYS A 78 6.699 5.816 -3.711 1.00 54.92 O ATOM 582 CB LYS A 78 9.007 3.552 -2.861 1.00 56.50 C ATOM 583 CG LYS A 78 9.215 3.629 -4.376 1.00 59.78 C ATOM 584 CD LYS A 78 9.825 4.980 -4.764 1.00 66.56 C ATOM 585 CE LYS A 78 11.349 4.919 -4.829 1.00 73.33 C ATOM 586 NZ LYS A 78 12.009 6.250 -4.645 1.00 83.64 N ATOM 587 HZ1 LYS A 78 11.691 6.900 -5.392 1.00 0.00 H ATOM 588 HZ2 LYS A 78 11.752 6.637 -3.715 1.00 0.00 H ATOM 589 HZ3 LYS A 78 13.041 6.134 -4.701 1.00 0.00 H ATOM 590 H LYS A 78 8.527 3.873 -0.331 1.00 0.00 H ATOM 591 N VAL A 79 5.988 4.176 -2.332 1.00 53.44 N ATOM 592 CA VAL A 79 4.605 4.291 -2.804 1.00 49.12 C ATOM 593 C VAL A 79 4.083 5.700 -2.577 1.00 55.55 C ATOM 594 O VAL A 79 3.441 6.289 -3.454 1.00 61.49 O ATOM 595 CB VAL A 79 3.710 3.244 -2.114 1.00 59.04 C ATOM 596 CG1 VAL A 79 2.219 3.554 -2.372 1.00 60.57 C ATOM 597 CG2 VAL A 79 4.058 1.853 -2.592 1.00 49.86 C ATOM 598 H VAL A 79 6.232 3.472 -1.607 1.00 0.00 H ATOM 599 N VAL A 80 4.362 6.268 -1.401 1.00 57.56 N ATOM 600 CA VAL A 80 3.889 7.613 -1.097 1.00 56.63 C ATOM 601 C VAL A 80 4.535 8.629 -2.037 1.00 61.83 C ATOM 602 O VAL A 80 3.849 9.461 -2.643 1.00 64.86 O ATOM 603 CB VAL A 80 4.158 7.955 0.380 1.00 53.31 C ATOM 604 CG1 VAL A 80 4.092 9.476 0.590 1.00 60.45 C ATOM 605 CG2 VAL A 80 3.160 7.237 1.305 1.00 59.72 C ATOM 606 H VAL A 80 4.921 5.746 -0.696 1.00 0.00 H ATOM 607 N ALA A 81 5.867 8.578 -2.170 1.00 51.41 N ATOM 608 CA ALA A 81 6.559 9.542 -3.024 1.00 59.61 C ATOM 609 C ALA A 81 6.035 9.503 -4.455 1.00 60.04 C ATOM 610 O ALA A 81 5.809 10.553 -5.069 1.00 63.08 O ATOM 611 CB ALA A 81 8.071 9.287 -3.003 1.00 53.27 C ATOM 612 H ALA A 81 6.411 7.850 -1.664 1.00 0.00 H ATOM 613 N LYS A 82 5.809 8.300 -4.996 1.00 58.24 N ATOM 614 CA LYS A 82 5.396 8.180 -6.390 1.00 66.36 C ATOM 615 C LYS A 82 3.909 8.469 -6.604 1.00 66.56 C ATOM 616 O LYS A 82 3.533 8.924 -7.691 1.00 66.77 O ATOM 617 CB LYS A 82 5.727 6.778 -6.936 1.00 61.62 C ATOM 618 CG LYS A 82 7.206 6.541 -7.221 1.00 76.25 C ATOM 619 CD LYS A 82 7.493 5.107 -7.689 1.00 73.73 C ATOM 620 CE LYS A 82 7.373 4.964 -9.198 1.00 79.40 C ATOM 621 NZ LYS A 82 7.991 3.686 -9.659 1.00 84.01 N ATOM 622 HZ1 LYS A 82 8.998 3.676 -9.399 1.00 0.00 H ATOM 623 HZ2 LYS A 82 7.507 2.885 -9.206 1.00 0.00 H ATOM 624 HZ3 LYS A 82 7.897 3.610 -10.692 1.00 0.00 H ATOM 625 H LYS A 82 5.929 7.444 -4.418 1.00 0.00 H ATOM 626 N TYR A 83 3.045 8.231 -5.609 1.00 72.92 N ATOM 627 CA TYR A 83 1.609 8.201 -5.915 1.00 66.09 C ATOM 628 C TYR A 83 0.672 8.961 -4.985 1.00 60.95 C ATOM 629 O TYR A 83 -0.496 9.108 -5.350 1.00 70.74 O ATOM 630 CB TYR A 83 1.113 6.743 -5.976 1.00 68.70 C ATOM 631 CG TYR A 83 1.762 5.887 -7.032 1.00 60.55 C ATOM 632 CD1 TYR A 83 1.624 6.190 -8.381 1.00 65.79 C ATOM 633 CD2 TYR A 83 2.485 4.755 -6.690 1.00 65.88 C ATOM 634 CE1 TYR A 83 2.205 5.403 -9.356 1.00 71.73 C ATOM 635 CE2 TYR A 83 3.084 3.948 -7.675 1.00 71.14 C ATOM 636 CZ TYR A 83 2.934 4.284 -8.999 1.00 69.96 C ATOM 637 OH TYR A 83 3.504 3.516 -9.981 1.00 71.56 O ATOM 638 HH TYR A 83 3.294 3.905 -10.867 1.00 0.00 H ATOM 639 H TYR A 83 3.384 8.071 -4.639 1.00 0.00 H ATOM 640 N PHE A 84 1.121 9.450 -3.829 1.00 65.78 N ATOM 641 CA PHE A 84 0.204 10.034 -2.852 1.00 68.51 C ATOM 642 C PHE A 84 -0.430 11.337 -3.345 1.00 70.75 C ATOM 643 O PHE A 84 -1.582 11.631 -3.001 1.00 66.54 O ATOM 644 CB PHE A 84 0.949 10.258 -1.534 1.00 66.90 C ATOM 645 CG PHE A 84 0.051 10.466 -0.344 1.00 67.85 C ATOM 646 CD1 PHE A 84 -0.305 11.749 0.062 1.00 71.19 C ATOM 647 CD2 PHE A 84 -0.411 9.385 0.386 1.00 65.03 C ATOM 648 CE1 PHE A 84 -1.125 11.949 1.172 1.00 69.25 C ATOM 649 CE2 PHE A 84 -1.225 9.571 1.489 1.00 68.62 C ATOM 650 CZ PHE A 84 -1.586 10.857 1.885 1.00 71.23 C ATOM 651 H PHE A 84 2.139 9.415 -3.619 1.00 0.00 H ATOM 652 N ASP A 85 0.293 12.127 -4.142 1.00 68.75 N ATOM 653 CA ASP A 85 -0.245 13.406 -4.599 1.00 68.54 C ATOM 654 C ASP A 85 -1.232 13.246 -5.757 1.00 63.69 C ATOM 655 O ASP A 85 -2.225 13.972 -5.830 1.00 70.84 O ATOM 656 CB ASP A 85 0.896 14.348 -4.998 1.00 75.54 C ATOM 657 CG ASP A 85 1.689 14.851 -3.800 1.00 80.24 C ATOM 658 OD1 ASP A 85 1.195 14.709 -2.664 1.00 85.30 O ATOM 659 OD2 ASP A 85 2.800 15.397 -3.991 1.00 81.98 O ATOM 660 H ASP A 85 1.244 11.830 -4.439 1.00 0.00 H ATOM 661 N ASP A 86 -0.978 12.336 -6.683 1.00 72.13 N ATOM 662 CA ASP A 86 -1.790 12.275 -7.892 1.00 74.23 C ATOM 663 C ASP A 86 -2.897 11.240 -7.814 1.00 71.36 C ATOM 664 O ASP A 86 -3.724 11.170 -8.727 1.00 72.91 O ATOM 665 CB ASP A 86 -0.912 11.986 -9.120 1.00 73.14 C ATOM 666 CG ASP A 86 0.341 12.844 -9.156 1.00 81.12 C ATOM 667 OD1 ASP A 86 0.350 13.926 -8.528 1.00 78.19 O ATOM 668 OD2 ASP A 86 1.322 12.436 -9.815 1.00 88.20 O ATOM 669 H ASP A 86 -0.197 11.663 -6.548 1.00 0.00 H ATOM 670 N TYR A 87 -2.924 10.433 -6.761 1.00 64.37 N ATOM 671 CA TYR A 87 -3.969 9.446 -6.559 1.00 67.37 C ATOM 672 C TYR A 87 -4.348 9.465 -5.087 1.00 61.89 C ATOM 673 O TYR A 87 -3.528 9.797 -4.231 1.00 67.98 O ATOM 674 CB TYR A 87 -3.515 8.041 -6.996 1.00 67.66 C ATOM 675 CG TYR A 87 -3.018 7.968 -8.430 1.00 71.87 C ATOM 676 CD1 TYR A 87 -1.728 8.382 -8.764 1.00 69.27 C ATOM 677 CD2 TYR A 87 -3.831 7.480 -9.446 1.00 72.50 C ATOM 678 CE1 TYR A 87 -1.272 8.326 -10.067 1.00 70.55 C ATOM 679 CE2 TYR A 87 -3.378 7.419 -10.761 1.00 69.34 C ATOM 680 CZ TYR A 87 -2.095 7.838 -11.062 1.00 78.38 C ATOM 681 OH TYR A 87 -1.630 7.776 -12.362 1.00 80.73 O ATOM 682 HH TYR A 87 -0.700 8.113 -12.395 1.00 0.00 H ATOM 683 H TYR A 87 -2.167 10.511 -6.053 1.00 0.00 H ATOM 684 N SER A 88 -5.600 9.133 -4.796 1.00 64.29 N ATOM 685 CA SER A 88 -6.082 9.153 -3.418 1.00 62.50 C ATOM 686 C SER A 88 -5.648 7.874 -2.718 1.00 59.09 C ATOM 687 O SER A 88 -5.959 6.771 -3.176 1.00 69.72 O ATOM 688 CB SER A 88 -7.599 9.314 -3.382 1.00 70.81 C ATOM 689 OG SER A 88 -8.222 8.257 -4.080 1.00 71.68 O ATOM 690 HG SER A 88 -7.978 7.395 -3.658 1.00 0.00 H ATOM 691 H SER A 88 -6.247 8.855 -5.561 1.00 0.00 H ATOM 692 N CYS A 89 -4.904 8.016 -1.633 1.00 59.00 N ATOM 693 CA CYS A 89 -4.324 6.866 -0.966 1.00 59.23 C ATOM 694 C CYS A 89 -4.204 7.188 0.511 1.00 56.88 C ATOM 695 O CYS A 89 -4.063 8.347 0.896 1.00 60.22 O ATOM 696 CB CYS A 89 -2.955 6.495 -1.576 1.00 57.38 C ATOM 697 SG CYS A 89 -1.470 6.220 -0.458 1.00 84.14 S ATOM 698 H CYS A 89 -4.732 8.968 -1.252 1.00 0.00 H ATOM 699 N ILE A 90 -4.300 6.157 1.338 1.00 55.11 N ATOM 700 CA ILE A 90 -3.870 6.252 2.724 1.00 49.99 C ATOM 701 C ILE A 90 -2.978 5.051 3.020 1.00 51.69 C ATOM 702 O ILE A 90 -3.006 4.035 2.323 1.00 51.48 O ATOM 703 CB ILE A 90 -5.044 6.314 3.717 1.00 52.40 C ATOM 704 CG1 ILE A 90 -5.597 4.926 4.019 1.00 49.54 C ATOM 705 CG2 ILE A 90 -6.178 7.205 3.195 1.00 58.37 C ATOM 706 CD1 ILE A 90 -6.799 4.991 4.989 1.00 50.68 C ATOM 707 H ILE A 90 -4.692 5.259 0.988 1.00 0.00 H ATOM 708 N THR A 91 -2.170 5.175 4.062 1.00 43.97 N ATOM 709 CA THR A 91 -1.335 4.044 4.430 1.00 43.69 C ATOM 710 C THR A 91 -1.080 4.127 5.922 1.00 38.15 C ATOM 711 O THR A 91 -1.045 5.207 6.482 1.00 40.85 O ATOM 712 CB THR A 91 -0.023 4.040 3.619 1.00 47.68 C ATOM 713 OG1 THR A 91 0.866 3.059 4.154 1.00 52.02 O ATOM 714 CG2 THR A 91 0.640 5.420 3.653 1.00 47.56 C ATOM 715 HG1 THR A 91 0.442 2.166 4.100 1.00 0.00 H ATOM 716 H THR A 91 -2.134 6.062 4.605 1.00 0.00 H ATOM 717 N TYR A 92 -0.940 2.977 6.568 1.00 42.46 N ATOM 718 CA TYR A 92 -0.525 2.984 7.958 1.00 45.67 C ATOM 719 C TYR A 92 0.213 1.683 8.254 1.00 45.66 C ATOM 720 O TYR A 92 0.246 0.768 7.443 1.00 47.95 O ATOM 721 CB TYR A 92 -1.731 3.181 8.885 1.00 42.17 C ATOM 722 CG TYR A 92 -2.864 2.182 8.633 1.00 37.44 C ATOM 723 CD1 TYR A 92 -2.892 0.945 9.257 1.00 38.97 C ATOM 724 CD2 TYR A 92 -3.879 2.490 7.761 1.00 44.99 C ATOM 725 CE1 TYR A 92 -3.926 0.056 9.024 1.00 43.15 C ATOM 726 CE2 TYR A 92 -4.908 1.617 7.518 1.00 38.62 C ATOM 727 CZ TYR A 92 -4.942 0.413 8.151 1.00 40.87 C ATOM 728 OH TYR A 92 -6.004 -0.435 7.871 1.00 50.46 O ATOM 729 HH TYR A 92 -5.906 -1.269 8.395 1.00 0.00 H ATOM 730 H TYR A 92 -1.126 2.077 6.082 1.00 0.00 H ATOM 731 N ILE A 93 0.784 1.594 9.445 1.00 46.85 N ATOM 732 CA ILE A 93 1.595 0.446 9.819 1.00 44.54 C ATOM 733 C ILE A 93 1.234 0.015 11.231 1.00 39.24 C ATOM 734 O ILE A 93 1.075 0.855 12.122 1.00 44.57 O ATOM 735 CB ILE A 93 3.113 0.765 9.739 1.00 46.34 C ATOM 736 CG1 ILE A 93 3.599 0.754 8.291 1.00 45.59 C ATOM 737 CG2 ILE A 93 3.905 -0.248 10.538 1.00 53.75 C ATOM 738 CD1 ILE A 93 4.950 1.515 8.083 1.00 50.42 C ATOM 739 H ILE A 93 0.649 2.364 10.131 1.00 0.00 H ATOM 740 N SER A 94 1.155 -1.296 11.442 1.00 47.15 N ATOM 741 CA SER A 94 0.965 -1.863 12.768 1.00 54.91 C ATOM 742 C SER A 94 1.848 -3.096 12.903 1.00 48.57 C ATOM 743 O SER A 94 2.471 -3.545 11.941 1.00 55.91 O ATOM 744 CB SER A 94 -0.521 -2.189 13.031 1.00 47.61 C ATOM 745 OG SER A 94 -1.085 -2.943 11.972 1.00 57.69 O ATOM 746 HG SER A 94 -2.035 -3.133 12.174 1.00 0.00 H ATOM 747 H SER A 94 1.232 -1.940 10.629 1.00 0.00 H ATOM 748 N THR A 95 1.889 -3.650 14.109 1.00 54.95 N ATOM 749 CA THR A 95 2.706 -4.815 14.425 1.00 67.03 C ATOM 750 C THR A 95 1.823 -6.019 14.752 1.00 62.84 C ATOM 751 O THR A 95 0.776 -5.878 15.384 1.00 66.49 O ATOM 752 CB THR A 95 3.652 -4.492 15.599 1.00 66.80 C ATOM 753 OG1 THR A 95 4.610 -5.545 15.766 1.00 80.66 O ATOM 754 CG2 THR A 95 2.876 -4.305 16.892 1.00 64.28 C ATOM 755 HG1 THR A 95 5.142 -5.640 14.937 1.00 0.00 H ATOM 756 H THR A 95 1.310 -3.232 14.865 1.00 0.00 H ATOM 757 N VAL A 96 2.217 -7.206 14.286 1.00 67.32 N ATOM 758 CA VAL A 96 1.503 -8.440 14.606 1.00 67.17 C ATOM 759 C VAL A 96 2.519 -9.514 15.001 1.00 66.86 C ATOM 760 O VAL A 96 3.727 -9.353 14.828 1.00 64.33 O ATOM 761 CB VAL A 96 0.602 -8.922 13.442 1.00 58.37 C ATOM 762 CG1 VAL A 96 -0.365 -7.789 12.959 1.00 57.98 C ATOM 763 CG2 VAL A 96 1.424 -9.496 12.282 1.00 63.28 C ATOM 764 H VAL A 96 3.058 -7.254 13.676 1.00 0.00 H ATOM 765 N GLU A 97 2.016 -10.618 15.549 1.00 71.31 N ATOM 766 CA GLU A 97 2.857 -11.741 15.956 1.00 75.12 C ATOM 767 C GLU A 97 2.640 -12.916 15.019 1.00 69.76 C ATOM 768 O GLU A 97 1.511 -13.394 14.862 1.00 67.21 O ATOM 769 CB GLU A 97 2.574 -12.160 17.397 1.00 68.89 C ATOM 770 CG GLU A 97 2.613 -11.016 18.368 1.00 71.18 C ATOM 771 CD GLU A 97 2.564 -11.486 19.803 1.00 87.72 C ATOM 772 OE1 GLU A 97 3.144 -12.559 20.084 1.00 88.20 O ATOM 773 OE2 GLU A 97 1.942 -10.792 20.643 1.00 89.20 O ATOM 774 H GLU A 97 0.988 -10.683 15.692 1.00 0.00 H ATOM 775 N ALA A 98 3.724 -13.384 14.413 1.00 67.13 N ATOM 776 CA ALA A 98 3.692 -14.547 13.538 1.00 70.63 C ATOM 777 C ALA A 98 4.420 -15.734 14.170 1.00 76.52 C ATOM 778 O ALA A 98 4.690 -16.738 13.497 1.00 78.28 O ATOM 779 CB ALA A 98 4.310 -14.209 12.192 1.00 68.40 C ATOM 780 H ALA A 98 4.632 -12.901 14.569 1.00 0.00 H TER 781 ALA A 98 ATOM 782 N SER B 1 8.774 10.659 13.672 1.00 69.61 N ATOM 783 CA SER B 1 8.329 10.648 12.284 1.00 72.85 C ATOM 784 C SER B 1 6.996 9.914 12.080 1.00 71.31 C ATOM 785 O SER B 1 6.420 9.992 11.001 1.00 74.95 O ATOM 786 CB SER B 1 9.399 10.019 11.390 1.00 75.90 C ATOM 787 OG SER B 1 9.831 8.774 11.920 1.00 78.30 O ATOM 788 HG SER B 1 10.522 8.386 11.327 1.00 0.00 H ATOM 789 HN3 SER B 1 8.900 9.681 14.002 1.00 0.00 H ATOM 790 HN2 SER B 1 8.060 11.135 14.260 1.00 0.00 H ATOM 791 HN1 SER B 1 9.678 11.169 13.741 1.00 0.00 H ATOM 792 N SER B 2 6.513 9.206 13.101 1.00 68.88 N ATOM 793 CA SER B 2 5.216 8.535 13.080 1.00 62.21 C ATOM 794 C SER B 2 4.291 9.168 14.120 1.00 58.04 C ATOM 795 O SER B 2 4.753 9.758 15.096 1.00 56.17 O ATOM 796 CB SER B 2 5.373 7.033 13.375 1.00 56.66 C ATOM 797 OG SER B 2 5.672 6.275 12.213 1.00 68.03 O ATOM 798 HG SER B 2 5.762 5.320 12.458 1.00 0.00 H ATOM 799 H SER B 2 7.092 9.127 13.961 1.00 0.00 H ATOM 800 N GLN B 3 2.975 9.019 13.921 1.00 55.04 N ATOM 801 CA GLN B 3 1.965 9.466 14.885 1.00 55.69 C ATOM 802 C GLN B 3 0.956 8.349 15.125 1.00 55.60 C ATOM 803 O GLN B 3 0.686 7.530 14.241 1.00 51.14 O ATOM 804 CB GLN B 3 1.206 10.722 14.403 1.00 53.91 C ATOM 805 CG GLN B 3 0.421 10.473 13.109 1.00 64.50 C ATOM 806 CD GLN B 3 -0.714 11.468 12.822 1.00 66.71 C ATOM 807 OE1 GLN B 3 -1.406 11.952 13.723 1.00 72.83 O ATOM 808 NE2 GLN B 3 -0.897 11.776 11.539 1.00 67.11 N ATOM 809 HE22 GLN B 3 -0.293 11.346 10.810 1.00 0.00 H ATOM 810 HE21 GLN B 3 -1.644 12.446 11.267 1.00 0.00 H ATOM 811 H GLN B 3 2.655 8.565 13.042 1.00 0.00 H ATOM 812 N GLN B 4 0.394 8.320 16.328 1.00 50.41 N ATOM 813 CA GLN B 4 -0.563 7.284 16.676 1.00 49.99 C ATOM 814 C GLN B 4 -1.937 7.641 16.126 1.00 50.76 C ATOM 815 O GLN B 4 -2.429 8.745 16.346 1.00 53.30 O ATOM 816 CB GLN B 4 -0.639 7.116 18.195 1.00 55.47 C ATOM 817 CG GLN B 4 -1.695 6.108 18.622 1.00 54.93 C ATOM 818 CD GLN B 4 -1.336 5.384 19.889 1.00 61.83 C ATOM 819 OE1 GLN B 4 -0.448 4.522 19.902 1.00 66.82 O ATOM 820 NE2 GLN B 4 -2.047 5.705 20.971 1.00 66.78 N ATOM 821 HE22 GLN B 4 -2.784 6.437 20.911 1.00 0.00 H ATOM 822 HE21 GLN B 4 -1.865 5.224 21.875 1.00 0.00 H ATOM 823 H GLN B 4 0.642 9.047 17.029 1.00 0.00 H ATOM 824 N VAL B 5 -2.568 6.719 15.410 1.00 52.84 N ATOM 825 CA VAL B 5 -3.968 6.922 15.059 1.00 49.61 C ATOM 826 C VAL B 5 -4.739 5.686 15.486 1.00 49.12 C ATOM 827 O VAL B 5 -4.167 4.613 15.690 1.00 51.08 O ATOM 828 CB VAL B 5 -4.181 7.285 13.558 1.00 53.34 C ATOM 829 CG1 VAL B 5 -2.873 7.617 12.884 1.00 50.09 C ATOM 830 CG2 VAL B 5 -5.037 6.257 12.778 1.00 49.27 C ATOM 831 H VAL B 5 -2.069 5.860 15.102 1.00 0.00 H ATOM 832 N TRP B 6 -6.027 5.869 15.735 1.00 51.99 N ATOM 833 CA TRP B 6 -6.870 4.780 16.187 1.00 47.05 C ATOM 834 C TRP B 6 -7.663 4.277 15.007 1.00 39.02 C ATOM 835 O TRP B 6 -8.047 5.047 14.122 1.00 43.96 O ATOM 836 CB TRP B 6 -7.816 5.224 17.313 1.00 52.13 C ATOM 837 CG TRP B 6 -7.093 5.853 18.449 1.00 52.99 C ATOM 838 CD1 TRP B 6 -6.639 7.135 18.521 1.00 56.78 C ATOM 839 CD2 TRP B 6 -6.709 5.218 19.674 1.00 52.56 C ATOM 840 NE1 TRP B 6 -5.992 7.339 19.718 1.00 59.09 N ATOM 841 CE2 TRP B 6 -6.017 6.173 20.438 1.00 54.99 C ATOM 842 CE3 TRP B 6 -6.864 3.927 20.187 1.00 58.22 C ATOM 843 CZ2 TRP B 6 -5.501 5.887 21.700 1.00 69.25 C ATOM 844 CZ3 TRP B 6 -6.343 3.642 21.439 1.00 64.04 C ATOM 845 CH2 TRP B 6 -5.678 4.621 22.183 1.00 69.73 C ATOM 846 HE1 TRP B 6 -5.556 8.231 20.026 1.00 0.00 H ATOM 847 H TRP B 6 -6.442 6.814 15.603 1.00 0.00 H ATOM 848 N LYS B 7 -7.913 2.979 15.015 1.00 39.49 N ATOM 849 CA LYS B 7 -8.652 2.296 13.968 1.00 45.72 C ATOM 850 C LYS B 7 -9.848 1.593 14.595 1.00 47.70 C ATOM 851 O LYS B 7 -9.684 0.644 15.379 1.00 43.77 O ATOM 852 CB LYS B 7 -7.765 1.299 13.232 1.00 47.51 C ATOM 853 CG LYS B 7 -8.482 0.465 12.189 1.00 46.87 C ATOM 854 CD LYS B 7 -7.430 -0.359 11.404 1.00 47.15 C ATOM 855 CE LYS B 7 -8.038 -1.536 10.676 1.00 63.37 C ATOM 856 NZ LYS B 7 -7.012 -2.372 9.947 1.00 55.03 N ATOM 857 HZ1 LYS B 7 -6.523 -1.783 9.244 1.00 0.00 H ATOM 858 HZ2 LYS B 7 -6.321 -2.744 10.630 1.00 0.00 H ATOM 859 HZ3 LYS B 7 -7.488 -3.163 9.468 1.00 0.00 H ATOM 860 H LYS B 7 -7.561 2.416 15.815 1.00 0.00 H ATOM 861 N LEU B 8 -11.032 2.049 14.224 1.00 43.31 N ATOM 862 CA LEU B 8 -12.303 1.511 14.697 1.00 41.02 C ATOM 863 C LEU B 8 -12.867 0.588 13.632 1.00 40.25 C ATOM 864 O LEU B 8 -12.964 0.976 12.464 1.00 45.66 O ATOM 865 CB LEU B 8 -13.294 2.659 15.000 1.00 44.68 C ATOM 866 CG LEU B 8 -14.761 2.259 15.219 1.00 48.62 C ATOM 867 CD1 LEU B 8 -14.831 1.239 16.349 1.00 43.58 C ATOM 868 CD2 LEU B 8 -15.683 3.489 15.572 1.00 44.22 C ATOM 869 H LEU B 8 -11.059 2.842 13.552 1.00 0.00 H ATOM 870 N VAL B 9 -13.210 -0.636 14.024 1.00 38.22 N ATOM 871 CA VAL B 9 -13.815 -1.612 13.126 1.00 41.45 C ATOM 872 C VAL B 9 -15.259 -1.862 13.567 1.00 42.99 C ATOM 873 O VAL B 9 -15.526 -2.070 14.757 1.00 44.57 O ATOM 874 CB VAL B 9 -13.035 -2.942 13.104 1.00 45.85 C ATOM 875 CG1 VAL B 9 -13.887 -4.049 12.498 1.00 42.49 C ATOM 876 CG2 VAL B 9 -11.707 -2.812 12.333 1.00 45.49 C ATOM 877 H VAL B 9 -13.039 -0.908 15.013 1.00 0.00 H ATOM 878 N ILE B 10 -16.179 -1.884 12.611 1.00 47.20 N ATOM 879 CA ILE B 10 -17.563 -2.292 12.872 1.00 45.85 C ATOM 880 C ILE B 10 -17.998 -3.263 11.788 1.00 42.38 C ATOM 881 O ILE B 10 -17.939 -2.931 10.604 1.00 47.92 O ATOM 882 CB ILE B 10 -18.538 -1.103 12.913 1.00 46.07 C ATOM 883 CG1 ILE B 10 -18.024 0.020 13.812 1.00 44.06 C ATOM 884 CG2 ILE B 10 -19.920 -1.612 13.332 1.00 41.32 C ATOM 885 CD1 ILE B 10 -18.765 1.406 13.591 1.00 47.65 C ATOM 886 H ILE B 10 -15.910 -1.603 11.646 1.00 0.00 H ATOM 887 N ILE B 11 -18.461 -4.440 12.188 1.00 37.00 N ATOM 888 CA ILE B 11 -18.934 -5.456 11.261 1.00 46.62 C ATOM 889 C ILE B 11 -20.443 -5.582 11.458 1.00 53.36 C ATOM 890 O ILE B 11 -20.912 -5.902 12.561 1.00 50.72 O ATOM 891 CB ILE B 11 -18.207 -6.796 11.468 1.00 51.14 C ATOM 892 CG1 ILE B 11 -16.715 -6.629 11.160 1.00 48.36 C ATOM 893 CG2 ILE B 11 -18.824 -7.884 10.605 1.00 45.44 C ATOM 894 CD1 ILE B 11 -15.841 -7.822 11.589 1.00 43.35 C ATOM 895 H ILE B 11 -18.487 -4.645 13.207 1.00 0.00 H ATOM 896 N THR B 12 -21.199 -5.279 10.397 1.00 53.03 N ATOM 897 CA THR B 12 -22.660 -5.240 10.435 1.00 53.62 C ATOM 898 C THR B 12 -23.230 -5.879 9.174 1.00 53.61 C ATOM 899 O THR B 12 -22.509 -6.170 8.217 1.00 45.48 O ATOM 900 CB THR B 12 -23.208 -3.808 10.534 1.00 52.41 C ATOM 901 OG1 THR B 12 -22.865 -3.075 9.350 1.00 52.98 O ATOM 902 CG2 THR B 12 -22.672 -3.081 11.743 1.00 50.95 C ATOM 903 HG1 THR B 12 -23.259 -3.523 8.560 1.00 0.00 H ATOM 904 H THR B 12 -20.723 -5.060 9.499 1.00 0.00 H ATOM 905 N GLU B 13 -24.556 -6.049 9.160 1.00 48.47 N ATOM 906 CA GLU B 13 -25.241 -6.469 7.952 1.00 50.68 C ATOM 907 C GLU B 13 -25.190 -5.360 6.920 1.00 43.67 C ATOM 908 O GLU B 13 -25.226 -4.180 7.263 1.00 47.15 O ATOM 909 CB GLU B 13 -26.701 -6.836 8.256 1.00 60.65 C ATOM 910 CG GLU B 13 -26.807 -7.868 9.357 1.00 65.96 C ATOM 911 CD GLU B 13 -28.192 -7.960 9.931 1.00 69.97 C ATOM 912 OE1 GLU B 13 -29.147 -7.683 9.172 1.00 70.87 O ATOM 913 OE2 GLU B 13 -28.313 -8.305 11.135 1.00 70.54 O ATOM 914 H GLU B 13 -25.104 -5.878 10.027 1.00 0.00 H ATOM 915 N GLU B 14 -25.106 -5.759 5.644 1.00 44.46 N ATOM 916 CA GLU B 14 -24.963 -4.802 4.545 1.00 53.15 C ATOM 917 C GLU B 14 -26.067 -3.753 4.528 1.00 51.43 C ATOM 918 O GLU B 14 -25.827 -2.617 4.102 1.00 55.49 O ATOM 919 CB GLU B 14 -24.923 -5.558 3.207 1.00 51.19 C ATOM 920 CG GLU B 14 -24.711 -4.731 1.881 1.00 51.81 C ATOM 921 CD GLU B 14 -25.834 -3.743 1.488 1.00 67.57 C ATOM 922 OE1 GLU B 14 -26.985 -4.193 1.285 1.00 69.85 O ATOM 923 OE2 GLU B 14 -25.568 -2.530 1.327 1.00 66.80 O ATOM 924 H GLU B 14 -25.143 -6.776 5.428 1.00 0.00 H ATOM 925 N ILE B 15 -27.281 -4.109 4.966 1.00 52.67 N ATOM 926 CA ILE B 15 -28.402 -3.176 4.906 1.00 54.85 C ATOM 927 C ILE B 15 -28.122 -1.914 5.717 1.00 51.56 C ATOM 928 O ILE B 15 -28.725 -0.868 5.463 1.00 52.13 O ATOM 929 CB ILE B 15 -29.717 -3.864 5.370 1.00 56.97 C ATOM 930 CG1 ILE B 15 -30.938 -3.062 4.894 1.00 60.80 C ATOM 931 CG2 ILE B 15 -29.766 -4.017 6.888 1.00 51.38 C ATOM 932 CD1 ILE B 15 -30.955 -2.833 3.382 1.00 60.89 C ATOM 933 H ILE B 15 -27.427 -5.063 5.354 1.00 0.00 H ATOM 934 N LEU B 16 -27.196 -1.972 6.670 1.00 47.56 N ATOM 935 CA LEU B 16 -26.861 -0.808 7.479 1.00 51.91 C ATOM 936 C LEU B 16 -25.796 0.097 6.851 1.00 49.62 C ATOM 937 O LEU B 16 -25.361 1.040 7.512 1.00 44.13 O ATOM 938 CB LEU B 16 -26.406 -1.254 8.864 1.00 49.36 C ATOM 939 CG LEU B 16 -27.548 -1.568 9.810 1.00 50.81 C ATOM 940 CD1 LEU B 16 -27.048 -1.991 11.189 1.00 52.63 C ATOM 941 CD2 LEU B 16 -28.445 -0.323 9.928 1.00 54.58 C ATOM 942 H LEU B 16 -26.699 -2.870 6.842 1.00 0.00 H ATOM 943 N LEU B 17 -25.420 -0.128 5.585 1.00 47.24 N ATOM 944 CA LEU B 17 -24.356 0.664 4.951 1.00 54.08 C ATOM 945 C LEU B 17 -24.637 2.162 5.010 1.00 54.14 C ATOM 946 O LEU B 17 -23.777 2.953 5.419 1.00 47.79 O ATOM 947 CB LEU B 17 -24.171 0.239 3.488 1.00 53.95 C ATOM 948 CG LEU B 17 -23.112 0.998 2.666 1.00 55.02 C ATOM 949 CD1 LEU B 17 -21.704 0.796 3.267 1.00 46.52 C ATOM 950 CD2 LEU B 17 -23.124 0.544 1.204 1.00 55.34 C ATOM 951 H LEU B 17 -25.890 -0.878 5.040 1.00 0.00 H ATOM 952 N LYS B 18 -25.829 2.582 4.572 1.00 53.70 N ATOM 953 CA LYS B 18 -26.105 4.016 4.473 1.00 51.72 C ATOM 954 C LYS B 18 -26.174 4.670 5.853 1.00 51.16 C ATOM 955 O LYS B 18 -25.568 5.728 6.077 1.00 51.55 O ATOM 956 CB LYS B 18 -27.398 4.253 3.678 1.00 53.84 C ATOM 957 CG LYS B 18 -27.274 3.836 2.195 1.00 69.31 C ATOM 958 CD LYS B 18 -28.579 4.013 1.418 1.00 73.21 C ATOM 959 CE LYS B 18 -28.386 3.787 -0.075 1.00 74.08 C ATOM 960 NZ LYS B 18 -27.149 4.436 -0.613 1.00 86.62 N ATOM 961 HZ1 LYS B 18 -27.200 5.462 -0.453 1.00 0.00 H ATOM 962 HZ2 LYS B 18 -26.316 4.049 -0.125 1.00 0.00 H ATOM 963 HZ3 LYS B 18 -27.075 4.246 -1.633 1.00 0.00 H ATOM 964 H LYS B 18 -26.558 1.891 4.302 1.00 0.00 H ATOM 965 N LYS B 19 -26.873 4.040 6.803 1.00 51.45 N ATOM 966 CA LYS B 19 -27.001 4.626 8.144 1.00 51.98 C ATOM 967 C LYS B 19 -25.641 4.732 8.833 1.00 48.81 C ATOM 968 O LYS B 19 -25.300 5.780 9.411 1.00 43.93 O ATOM 969 CB LYS B 19 -27.975 3.809 9.008 1.00 45.61 C ATOM 970 CG LYS B 19 -29.512 3.976 8.665 1.00 53.11 C ATOM 971 CD LYS B 19 -30.087 5.317 9.143 1.00 56.65 C ATOM 972 CE LYS B 19 -31.633 5.359 9.030 1.00 61.04 C ATOM 973 NZ LYS B 19 -32.053 5.345 7.604 1.00 56.56 N ATOM 974 HZ1 LYS B 19 -31.656 6.175 7.119 1.00 0.00 H ATOM 975 HZ2 LYS B 19 -31.705 4.477 7.150 1.00 0.00 H ATOM 976 HZ3 LYS B 19 -33.091 5.374 7.549 1.00 0.00 H ATOM 977 H LYS B 19 -27.329 3.130 6.591 1.00 0.00 H ATOM 978 N VAL B 20 -24.848 3.651 8.799 1.00 50.72 N ATOM 979 CA VAL B 20 -23.578 3.688 9.531 1.00 47.29 C ATOM 980 C VAL B 20 -22.609 4.662 8.874 1.00 44.51 C ATOM 981 O VAL B 20 -21.926 5.434 9.562 1.00 48.56 O ATOM 982 CB VAL B 20 -22.984 2.276 9.673 1.00 44.13 C ATOM 983 CG1 VAL B 20 -21.531 2.358 10.157 1.00 42.68 C ATOM 984 CG2 VAL B 20 -23.804 1.474 10.682 1.00 44.84 C ATOM 985 H VAL B 20 -25.128 2.804 8.264 1.00 0.00 H ATOM 986 N SER B 21 -22.519 4.636 7.543 1.00 49.34 N ATOM 987 CA SER B 21 -21.729 5.636 6.824 1.00 45.47 C ATOM 988 C SER B 21 -22.060 7.049 7.283 1.00 51.36 C ATOM 989 O SER B 21 -21.162 7.841 7.594 1.00 42.50 O ATOM 990 CB SER B 21 -21.971 5.494 5.320 1.00 50.26 C ATOM 991 OG SER B 21 -21.511 4.226 4.885 1.00 57.78 O ATOM 992 HG SER B 21 -22.002 3.515 5.367 1.00 0.00 H ATOM 993 H SER B 21 -23.017 3.895 7.009 1.00 0.00 H ATOM 994 N LYS B 22 -23.361 7.381 7.335 1.00 48.47 N ATOM 995 CA LYS B 22 -23.780 8.716 7.731 1.00 48.89 C ATOM 996 C LYS B 22 -23.347 9.040 9.154 1.00 45.66 C ATOM 997 O LYS B 22 -22.942 10.171 9.454 1.00 49.78 O ATOM 998 CB LYS B 22 -25.304 8.832 7.597 1.00 59.82 C ATOM 999 CG LYS B 22 -25.912 10.069 8.286 1.00 64.20 C ATOM 1000 CD LYS B 22 -27.435 9.924 8.439 1.00 72.01 C ATOM 1001 CE LYS B 22 -28.113 9.590 7.118 1.00 79.97 C ATOM 1002 NZ LYS B 22 -29.294 8.691 7.284 1.00 82.57 N ATOM 1003 HZ1 LYS B 22 -28.989 7.797 7.720 1.00 0.00 H ATOM 1004 HZ2 LYS B 22 -29.997 9.154 7.894 1.00 0.00 H ATOM 1005 HZ3 LYS B 22 -29.715 8.498 6.353 1.00 0.00 H ATOM 1006 H LYS B 22 -24.080 6.671 7.088 1.00 0.00 H ATOM 1007 N ILE B 23 -23.422 8.063 10.057 1.00 47.50 N ATOM 1008 CA ILE B 23 -22.990 8.348 11.427 1.00 48.20 C ATOM 1009 C ILE B 23 -21.480 8.584 11.474 1.00 50.27 C ATOM 1010 O ILE B 23 -20.984 9.383 12.278 1.00 52.41 O ATOM 1011 CB ILE B 23 -23.407 7.194 12.351 1.00 53.54 C ATOM 1012 CG1 ILE B 23 -24.912 7.222 12.649 1.00 41.92 C ATOM 1013 CG2 ILE B 23 -22.589 7.177 13.629 1.00 49.39 C ATOM 1014 CD1 ILE B 23 -25.340 5.896 13.286 1.00 43.98 C ATOM 1015 H ILE B 23 -23.778 7.122 9.795 1.00 0.00 H ATOM 1016 N ILE B 24 -20.723 7.901 10.620 1.00 44.49 N ATOM 1017 CA ILE B 24 -19.271 8.114 10.598 1.00 46.82 C ATOM 1018 C ILE B 24 -18.968 9.538 10.145 1.00 44.11 C ATOM 1019 O ILE B 24 -18.248 10.286 10.813 1.00 47.49 O ATOM 1020 CB ILE B 24 -18.599 7.045 9.705 1.00 38.50 C ATOM 1021 CG1 ILE B 24 -18.666 5.685 10.415 1.00 36.30 C ATOM 1022 CG2 ILE B 24 -17.125 7.408 9.370 1.00 47.84 C ATOM 1023 CD1 ILE B 24 -18.330 4.452 9.509 1.00 41.15 C ATOM 1024 H ILE B 24 -21.159 7.217 9.969 1.00 0.00 H ATOM 1025 N LYS B 25 -19.575 9.956 9.034 1.00 49.14 N ATOM 1026 CA LYS B 25 -19.276 11.274 8.488 1.00 53.09 C ATOM 1027 C LYS B 25 -19.773 12.381 9.406 1.00 57.82 C ATOM 1028 O LYS B 25 -19.088 13.395 9.585 1.00 55.21 O ATOM 1029 CB LYS B 25 -19.888 11.406 7.094 1.00 54.68 C ATOM 1030 CG LYS B 25 -19.116 10.646 6.030 1.00 58.25 C ATOM 1031 CD LYS B 25 -19.705 10.852 4.647 1.00 73.31 C ATOM 1032 CE LYS B 25 -21.078 10.209 4.515 1.00 74.01 C ATOM 1033 NZ LYS B 25 -21.589 10.310 3.125 1.00 80.68 N ATOM 1034 HZ1 LYS B 25 -21.665 11.312 2.857 1.00 0.00 H ATOM 1035 HZ2 LYS B 25 -20.933 9.826 2.480 1.00 0.00 H ATOM 1036 HZ3 LYS B 25 -22.526 9.863 3.068 1.00 0.00 H ATOM 1037 H LYS B 25 -20.263 9.340 8.556 1.00 0.00 H ATOM 1038 N GLU B 26 -20.957 12.203 10.010 1.00 60.77 N ATOM 1039 CA GLU B 26 -21.518 13.263 10.846 1.00 66.08 C ATOM 1040 C GLU B 26 -20.671 13.512 12.081 1.00 67.21 C ATOM 1041 O GLU B 26 -20.651 14.636 12.592 1.00 65.43 O ATOM 1042 CB GLU B 26 -22.961 12.947 11.249 1.00 68.48 C ATOM 1043 CG GLU B 26 -23.999 13.259 10.152 1.00 77.12 C ATOM 1044 CD GLU B 26 -23.713 14.576 9.432 1.00 89.26 C ATOM 1045 OE1 GLU B 26 -23.027 14.529 8.382 1.00 89.86 O ATOM 1046 OE2 GLU B 26 -24.143 15.651 9.929 1.00 88.95 O ATOM 1047 H GLU B 26 -21.476 11.311 9.884 1.00 0.00 H ATOM 1048 N ALA B 27 -19.947 12.498 12.562 1.00 63.06 N ATOM 1049 CA ALA B 27 -19.081 12.727 13.713 1.00 60.09 C ATOM 1050 C ALA B 27 -17.780 13.439 13.348 1.00 54.76 C ATOM 1051 O ALA B 27 -17.022 13.803 14.252 1.00 59.69 O ATOM 1052 CB ALA B 27 -18.776 11.399 14.416 1.00 51.08 C ATOM 1053 H ALA B 27 -20.000 11.557 12.122 1.00 0.00 H ATOM 1054 N GLY B 28 -17.505 13.662 12.069 1.00 55.12 N ATOM 1055 CA GLY B 28 -16.304 14.363 11.659 1.00 60.15 C ATOM 1056 C GLY B 28 -15.117 13.492 11.282 1.00 60.60 C ATOM 1057 O GLY B 28 -13.980 13.976 11.325 1.00 59.83 O ATOM 1058 H GLY B 28 -18.168 13.325 11.342 1.00 0.00 H ATOM 1059 N ALA B 29 -15.339 12.230 10.928 1.00 62.77 N ATOM 1060 CA ALA B 29 -14.243 11.379 10.482 1.00 53.49 C ATOM 1061 C ALA B 29 -13.760 11.812 9.106 1.00 51.05 C ATOM 1062 O ALA B 29 -14.555 12.198 8.248 1.00 57.04 O ATOM 1063 CB ALA B 29 -14.688 9.916 10.457 1.00 52.40 C ATOM 1064 H ALA B 29 -16.305 11.846 10.970 1.00 0.00 H ATOM 1065 N SER B 30 -12.440 11.755 8.891 1.00 54.72 N ATOM 1066 CA SER B 30 -11.907 12.110 7.573 1.00 58.65 C ATOM 1067 C SER B 30 -12.344 11.119 6.501 1.00 60.38 C ATOM 1068 O SER B 30 -12.424 11.480 5.317 1.00 54.49 O ATOM 1069 CB SER B 30 -10.377 12.195 7.604 1.00 56.72 C ATOM 1070 OG SER B 30 -9.803 10.987 8.049 1.00 56.11 O ATOM 1071 HG SER B 30 -8.817 11.075 8.057 1.00 0.00 H ATOM 1072 H SER B 30 -11.797 11.461 9.654 1.00 0.00 H ATOM 1073 N GLY B 31 -12.625 9.880 6.886 1.00 53.75 N ATOM 1074 CA GLY B 31 -13.138 8.915 5.936 1.00 49.09 C ATOM 1075 C GLY B 31 -13.361 7.576 6.600 1.00 51.05 C ATOM 1076 O GLY B 31 -13.360 7.462 7.827 1.00 52.30 O ATOM 1077 H GLY B 31 -12.476 9.601 7.877 1.00 0.00 H ATOM 1078 N TYR B 32 -13.543 6.557 5.766 1.00 48.60 N ATOM 1079 CA TYR B 32 -13.778 5.198 6.231 1.00 44.23 C ATOM 1080 C TYR B 32 -13.580 4.291 5.040 1.00 45.50 C ATOM 1081 O TYR B 32 -13.710 4.713 3.890 1.00 42.49 O ATOM 1082 CB TYR B 32 -15.198 5.015 6.830 1.00 42.08 C ATOM 1083 CG TYR B 32 -16.334 5.310 5.855 1.00 46.10 C ATOM 1084 CD1 TYR B 32 -16.858 6.608 5.716 1.00 44.08 C ATOM 1085 CD2 TYR B 32 -16.876 4.298 5.071 1.00 46.10 C ATOM 1086 CE1 TYR B 32 -17.883 6.874 4.805 1.00 50.34 C ATOM 1087 CE2 TYR B 32 -17.892 4.555 4.163 1.00 47.09 C ATOM 1088 CZ TYR B 32 -18.394 5.837 4.043 1.00 54.61 C ATOM 1089 OH TYR B 32 -19.392 6.062 3.141 1.00 59.74 O ATOM 1090 HH TYR B 32 -19.648 7.018 3.166 1.00 0.00 H ATOM 1091 H TYR B 32 -13.516 6.738 4.742 1.00 0.00 H ATOM 1092 N THR B 33 -13.255 3.043 5.330 1.00 45.48 N ATOM 1093 CA THR B 33 -13.119 2.009 4.324 1.00 41.21 C ATOM 1094 C THR B 33 -14.152 0.938 4.616 1.00 40.91 C ATOM 1095 O THR B 33 -14.395 0.604 5.782 1.00 46.42 O ATOM 1096 CB THR B 33 -11.693 1.417 4.346 1.00 46.53 C ATOM 1097 OG1 THR B 33 -10.754 2.455 4.066 1.00 43.55 O ATOM 1098 CG2 THR B 33 -11.541 0.309 3.303 1.00 44.46 C ATOM 1099 HG1 THR B 33 -9.837 2.081 4.079 1.00 0.00 H ATOM 1100 H THR B 33 -13.089 2.792 6.326 1.00 0.00 H ATOM 1101 N VAL B 34 -14.753 0.388 3.569 1.00 40.51 N ATOM 1102 CA VAL B 34 -15.687 -0.726 3.710 1.00 42.12 C ATOM 1103 C VAL B 34 -15.205 -1.910 2.885 1.00 43.79 C ATOM 1104 O VAL B 34 -14.910 -1.767 1.699 1.00 45.53 O ATOM 1105 CB VAL B 34 -17.110 -0.321 3.282 1.00 48.85 C ATOM 1106 CG1 VAL B 34 -18.062 -1.485 3.476 1.00 47.61 C ATOM 1107 CG2 VAL B 34 -17.561 0.857 4.099 1.00 43.50 C ATOM 1108 H VAL B 34 -14.553 0.761 2.619 1.00 0.00 H ATOM 1109 N LEU B 35 -15.219 -3.089 3.490 1.00 43.81 N ATOM 1110 CA LEU B 35 -15.000 -4.326 2.769 1.00 50.65 C ATOM 1111 C LEU B 35 -16.224 -5.228 2.904 1.00 54.05 C ATOM 1112 O LEU B 35 -16.960 -5.169 3.899 1.00 46.91 O ATOM 1113 CB LEU B 35 -13.738 -5.021 3.289 1.00 41.95 C ATOM 1114 CG LEU B 35 -12.501 -4.105 3.234 1.00 48.70 C ATOM 1115 CD1 LEU B 35 -12.238 -3.436 4.549 1.00 49.38 C ATOM 1116 CD2 LEU B 35 -11.254 -4.884 2.792 1.00 46.47 C ATOM 1117 H LEU B 35 -15.393 -3.127 4.515 1.00 0.00 H ATOM 1118 N ALA B 36 -16.447 -6.061 1.893 1.00 51.41 N ATOM 1119 CA ALA B 36 -17.530 -7.031 1.959 1.00 49.42 C ATOM 1120 C ALA B 36 -17.063 -8.216 2.774 1.00 52.75 C ATOM 1121 O ALA B 36 -15.887 -8.574 2.757 1.00 53.09 O ATOM 1122 CB ALA B 36 -17.942 -7.491 0.564 1.00 54.60 C ATOM 1123 H ALA B 36 -15.843 -6.019 1.048 1.00 0.00 H ATOM 1124 N ALA B 37 -17.979 -8.815 3.513 1.00 45.96 N ATOM 1125 CA ALA B 37 -17.547 -9.804 4.479 1.00 46.93 C ATOM 1126 C ALA B 37 -18.652 -10.823 4.681 1.00 55.83 C ATOM 1127 O ALA B 37 -19.828 -10.546 4.445 1.00 54.42 O ATOM 1128 CB ALA B 37 -17.176 -9.148 5.816 1.00 51.24 C ATOM 1129 H ALA B 37 -18.987 -8.582 3.404 1.00 0.00 H ATOM 1130 N ALA B 38 -18.255 -12.007 5.131 1.00 46.96 N ATOM 1131 CA ALA B 38 -19.186 -13.035 5.543 1.00 46.83 C ATOM 1132 C ALA B 38 -18.709 -13.521 6.893 1.00 54.10 C ATOM 1133 O ALA B 38 -17.585 -13.229 7.301 1.00 53.44 O ATOM 1134 CB ALA B 38 -19.275 -14.186 4.527 1.00 55.91 C ATOM 1135 H ALA B 38 -17.235 -12.203 5.190 1.00 0.00 H ATOM 1136 N GLY B 39 -19.578 -14.217 7.611 1.00 54.26 N ATOM 1137 CA GLY B 39 -19.191 -14.690 8.924 1.00 59.02 C ATOM 1138 C GLY B 39 -20.324 -15.409 9.617 1.00 70.69 C ATOM 1139 O GLY B 39 -21.377 -15.664 9.032 1.00 69.02 O ATOM 1140 H GLY B 39 -20.526 -14.421 7.236 1.00 0.00 H ATOM 1141 N GLU B 40 -20.077 -15.720 10.890 1.00 74.17 N ATOM 1142 CA GLU B 40 -20.993 -16.449 11.758 1.00 69.93 C ATOM 1143 C GLU B 40 -20.788 -15.961 13.183 1.00 70.41 C ATOM 1144 O GLU B 40 -19.676 -15.598 13.565 1.00 72.24 O ATOM 1145 CB GLU B 40 -20.744 -17.955 11.686 1.00 74.53 C ATOM 1146 CG GLU B 40 -21.983 -18.797 11.769 1.00 84.13 C ATOM 1147 CD GLU B 40 -21.890 -20.014 10.884 1.00 91.14 C ATOM 1148 OE1 GLU B 40 -20.753 -20.501 10.664 1.00 88.03 O ATOM 1149 OE2 GLU B 40 -22.950 -20.473 10.403 1.00 96.78 O ATOM 1150 H GLU B 40 -19.166 -15.421 11.292 1.00 0.00 H ATOM 1151 N GLY B 41 -21.858 -15.949 13.967 1.00 65.69 N ATOM 1152 CA GLY B 41 -21.763 -15.441 15.323 1.00 73.27 C ATOM 1153 C GLY B 41 -22.522 -16.263 16.342 1.00 76.07 C ATOM 1154 O GLY B 41 -22.997 -17.351 16.019 1.00 75.52 O ATOM 1155 H GLY B 41 -22.767 -16.305 13.609 1.00 0.00 H TER 1156 GLY B 41 ATOM 1157 N ALA B 56 -22.856 -14.795 -0.473 1.00 72.85 N ATOM 1158 CA ALA B 56 -22.429 -15.157 0.877 1.00 77.50 C ATOM 1159 C ALA B 56 -21.899 -13.938 1.626 1.00 70.52 C ATOM 1160 O ALA B 56 -21.945 -13.889 2.853 1.00 65.30 O ATOM 1161 CB ALA B 56 -21.360 -16.257 0.831 1.00 79.04 C ATOM 1162 HN3 ALA B 56 -22.048 -14.405 -0.998 1.00 0.00 H ATOM 1163 HN2 ALA B 56 -23.611 -14.082 -0.417 1.00 0.00 H ATOM 1164 HN1 ALA B 56 -23.212 -15.641 -0.961 1.00 0.00 H ATOM 1165 N TYR B 57 -21.380 -12.964 0.874 1.00 71.89 N ATOM 1166 CA TYR B 57 -20.751 -11.776 1.455 1.00 64.05 C ATOM 1167 C TYR B 57 -21.808 -10.696 1.692 1.00 64.16 C ATOM 1168 O TYR B 57 -21.862 -9.658 1.027 1.00 65.93 O ATOM 1169 CB TYR B 57 -19.632 -11.273 0.554 1.00 64.40 C ATOM 1170 CG TYR B 57 -18.397 -12.152 0.530 1.00 63.92 C ATOM 1171 CD1 TYR B 57 -17.990 -12.778 -0.643 1.00 71.01 C ATOM 1172 CD2 TYR B 57 -17.624 -12.327 1.666 1.00 62.60 C ATOM 1173 CE1 TYR B 57 -16.849 -13.579 -0.678 1.00 75.00 C ATOM 1174 CE2 TYR B 57 -16.474 -13.122 1.642 1.00 62.52 C ATOM 1175 CZ TYR B 57 -16.100 -13.743 0.472 1.00 70.55 C ATOM 1176 OH TYR B 57 -14.969 -14.526 0.450 1.00 77.47 O ATOM 1177 HH TYR B 57 -14.843 -14.896 -0.460 1.00 0.00 H ATOM 1178 H TYR B 57 -21.424 -13.052 -0.161 1.00 0.00 H ATOM 1179 N SER B 58 -22.653 -10.956 2.685 1.00 57.07 N ATOM 1180 CA SER B 58 -23.794 -10.095 2.970 1.00 63.77 C ATOM 1181 C SER B 58 -23.576 -9.243 4.214 1.00 60.47 C ATOM 1182 O SER B 58 -24.525 -8.614 4.695 1.00 56.44 O ATOM 1183 CB SER B 58 -25.054 -10.939 3.120 1.00 53.60 C ATOM 1184 OG SER B 58 -24.874 -11.861 4.179 1.00 59.44 O ATOM 1185 HG SER B 58 -25.691 -12.411 4.279 1.00 0.00 H ATOM 1186 H SER B 58 -22.495 -11.798 3.275 1.00 0.00 H ATOM 1187 N ASN B 59 -22.355 -9.224 4.751 1.00 55.10 N ATOM 1188 CA ASN B 59 -21.962 -8.318 5.814 1.00 48.41 C ATOM 1189 C ASN B 59 -20.972 -7.307 5.269 1.00 49.08 C ATOM 1190 O ASN B 59 -20.463 -7.428 4.150 1.00 50.91 O ATOM 1191 CB ASN B 59 -21.323 -9.061 6.991 1.00 50.38 C ATOM 1192 CG ASN B 59 -22.298 -9.907 7.745 1.00 59.35 C ATOM 1193 OD1 ASN B 59 -23.507 -9.659 7.720 1.00 63.23 O ATOM 1194 ND2 ASN B 59 -21.785 -10.930 8.429 1.00 61.01 N ATOM 1195 HD22 ASN B 59 -20.759 -11.099 8.420 1.00 0.00 H ATOM 1196 HD21 ASN B 59 -22.411 -11.559 8.972 1.00 0.00 H ATOM 1197 H ASN B 59 -21.647 -9.894 4.388 1.00 0.00 H ATOM 1198 N ILE B 60 -20.704 -6.297 6.082 1.00 47.75 N ATOM 1199 CA ILE B 60 -19.745 -5.266 5.728 1.00 53.24 C ATOM 1200 C ILE B 60 -18.890 -4.988 6.939 1.00 48.62 C ATOM 1201 O ILE B 60 -19.360 -5.036 8.080 1.00 50.30 O ATOM 1202 CB ILE B 60 -20.391 -3.965 5.240 1.00 46.88 C ATOM 1203 CG1 ILE B 60 -21.605 -3.616 6.116 1.00 54.34 C ATOM 1204 CG2 ILE B 60 -20.754 -4.056 3.766 1.00 49.35 C ATOM 1205 CD1 ILE B 60 -22.172 -2.309 5.779 1.00 51.16 C ATOM 1206 H ILE B 60 -21.193 -6.241 6.998 1.00 0.00 H ATOM 1207 N LYS B 61 -17.626 -4.732 6.675 1.00 42.79 N ATOM 1208 CA LYS B 61 -16.658 -4.371 7.681 1.00 43.43 C ATOM 1209 C LYS B 61 -16.258 -2.941 7.386 1.00 45.11 C ATOM 1210 O LYS B 61 -15.726 -2.670 6.306 1.00 47.56 O ATOM 1211 CB LYS B 61 -15.447 -5.303 7.625 1.00 47.95 C ATOM 1212 CG LYS B 61 -14.267 -4.819 8.425 1.00 49.46 C ATOM 1213 CD LYS B 61 -13.232 -5.933 8.572 1.00 45.17 C ATOM 1214 CE LYS B 61 -12.042 -5.457 9.386 1.00 54.10 C ATOM 1215 NZ LYS B 61 -10.872 -6.409 9.270 1.00 56.41 N ATOM 1216 HZ1 LYS B 61 -11.154 -7.347 9.618 1.00 0.00 H ATOM 1217 HZ2 LYS B 61 -10.582 -6.480 8.274 1.00 0.00 H ATOM 1218 HZ3 LYS B 61 -10.078 -6.052 9.839 1.00 0.00 H ATOM 1219 H LYS B 61 -17.308 -4.793 5.687 1.00 0.00 H ATOM 1220 N PHE B 62 -16.530 -2.041 8.338 1.00 36.78 N ATOM 1221 CA PHE B 62 -16.043 -0.671 8.297 1.00 43.05 C ATOM 1222 C PHE B 62 -14.702 -0.600 9.010 1.00 42.90 C ATOM 1223 O PHE B 62 -14.518 -1.227 10.053 1.00 42.91 O ATOM 1224 CB PHE B 62 -16.991 0.290 9.017 1.00 40.06 C ATOM 1225 CG PHE B 62 -18.276 0.565 8.299 1.00 39.40 C ATOM 1226 CD1 PHE B 62 -19.388 -0.239 8.501 1.00 48.01 C ATOM 1227 CD2 PHE B 62 -18.390 1.677 7.472 1.00 44.35 C ATOM 1228 CE1 PHE B 62 -20.595 0.032 7.842 1.00 39.03 C ATOM 1229 CE2 PHE B 62 -19.592 1.973 6.827 1.00 47.69 C ATOM 1230 CZ PHE B 62 -20.693 1.151 7.013 1.00 44.65 C ATOM 1231 H PHE B 62 -17.117 -2.335 9.145 1.00 0.00 H ATOM 1232 N GLU B 63 -13.793 0.204 8.472 1.00 44.88 N ATOM 1233 CA GLU B 63 -12.562 0.593 9.155 1.00 41.51 C ATOM 1234 C GLU B 63 -12.501 2.103 9.148 1.00 44.66 C ATOM 1235 O GLU B 63 -12.559 2.723 8.084 1.00 44.25 O ATOM 1236 CB GLU B 63 -11.311 0.021 8.478 1.00 43.30 C ATOM 1237 CG GLU B 63 -11.406 -1.421 8.090 1.00 51.55 C ATOM 1238 CD GLU B 63 -10.038 -2.004 7.707 1.00 60.48 C ATOM 1239 OE1 GLU B 63 -9.601 -2.990 8.341 1.00 64.91 O ATOM 1240 OE2 GLU B 63 -9.391 -1.451 6.789 1.00 56.78 O ATOM 1241 H GLU B 63 -13.966 0.576 7.516 1.00 0.00 H ATOM 1242 N VAL B 64 -12.406 2.694 10.329 1.00 43.77 N ATOM 1243 CA VAL B 64 -12.435 4.129 10.479 1.00 42.44 C ATOM 1244 C VAL B 64 -11.174 4.518 11.224 1.00 40.92 C ATOM 1245 O VAL B 64 -11.017 4.172 12.403 1.00 48.41 O ATOM 1246 CB VAL B 64 -13.699 4.566 11.253 1.00 44.78 C ATOM 1247 CG1 VAL B 64 -13.835 6.057 11.281 1.00 48.56 C ATOM 1248 CG2 VAL B 64 -14.917 3.954 10.614 1.00 44.17 C ATOM 1249 H VAL B 64 -12.307 2.103 11.179 1.00 0.00 H ATOM 1250 N LEU B 65 -10.302 5.267 10.568 1.00 37.32 N ATOM 1251 CA LEU B 65 -9.084 5.747 11.203 1.00 40.16 C ATOM 1252 C LEU B 65 -9.286 7.152 11.733 1.00 50.50 C ATOM 1253 O LEU B 65 -9.816 8.015 11.025 1.00 47.23 O ATOM 1254 CB LEU B 65 -7.932 5.736 10.213 1.00 36.32 C ATOM 1255 CG LEU B 65 -7.841 4.316 9.658 1.00 50.91 C ATOM 1256 CD1 LEU B 65 -7.255 4.339 8.307 1.00 56.41 C ATOM 1257 CD2 LEU B 65 -7.013 3.490 10.576 1.00 48.04 C ATOM 1258 H LEU B 65 -10.492 5.518 9.577 1.00 0.00 H ATOM 1259 N THR B 66 -8.826 7.397 12.953 1.00 47.85 N ATOM 1260 CA THR B 66 -8.886 8.759 13.453 1.00 55.88 C ATOM 1261 C THR B 66 -7.743 9.018 14.422 1.00 54.69 C ATOM 1262 O THR B 66 -7.265 8.109 15.101 1.00 56.53 O ATOM 1263 CB THR B 66 -10.225 9.066 14.134 1.00 60.31 C ATOM 1264 OG1 THR B 66 -10.149 10.369 14.720 1.00 60.00 O ATOM 1265 CG2 THR B 66 -10.540 8.043 15.211 1.00 50.35 C ATOM 1266 HG1 THR B 66 -9.968 11.038 14.013 1.00 0.00 H ATOM 1267 H THR B 66 -8.432 6.632 13.537 1.00 0.00 H ATOM 1268 N ALA B 67 -7.318 10.277 14.490 1.00 59.23 N ATOM 1269 CA ALA B 67 -6.217 10.652 15.365 1.00 58.23 C ATOM 1270 C ALA B 67 -6.659 10.963 16.788 1.00 60.59 C ATOM 1271 O ALA B 67 -5.805 11.223 17.635 1.00 60.57 O ATOM 1272 CB ALA B 67 -5.455 11.853 14.792 1.00 57.42 C ATOM 1273 H ALA B 67 -7.780 11.005 13.908 1.00 0.00 H ATOM 1274 N SER B 68 -7.956 10.966 17.087 1.00 60.12 N ATOM 1275 CA SER B 68 -8.388 11.128 18.472 1.00 69.10 C ATOM 1276 C SER B 68 -9.242 9.939 18.879 1.00 56.85 C ATOM 1277 O SER B 68 -10.202 9.584 18.187 1.00 59.70 O ATOM 1278 CB SER B 68 -9.128 12.461 18.717 1.00 61.86 C ATOM 1279 OG SER B 68 -10.482 12.439 18.325 1.00 61.75 O ATOM 1280 HG SER B 68 -10.961 11.738 18.835 1.00 0.00 H ATOM 1281 H SER B 68 -8.663 10.853 16.333 1.00 0.00 H ATOM 1282 N ARG B 69 -8.849 9.310 19.984 1.00 53.93 N ATOM 1283 CA ARG B 69 -9.621 8.219 20.566 1.00 60.63 C ATOM 1284 C ARG B 69 -11.026 8.669 20.941 1.00 56.13 C ATOM 1285 O ARG B 69 -11.955 7.852 20.945 1.00 56.73 O ATOM 1286 CB ARG B 69 -8.869 7.669 21.783 1.00 60.60 C ATOM 1287 CG ARG B 69 -9.630 6.713 22.675 1.00 62.52 C ATOM 1288 CD ARG B 69 -9.916 5.421 21.941 1.00 57.03 C ATOM 1289 NE ARG B 69 -10.658 4.452 22.740 1.00 59.12 N ATOM 1290 CZ ARG B 69 -10.176 3.277 23.136 1.00 68.99 C ATOM 1291 NH1 ARG B 69 -8.940 2.908 22.809 1.00 60.19 N ATOM 1292 NH2 ARG B 69 -10.940 2.465 23.853 1.00 67.98 N ATOM 1293 HE ARG B 69 -11.630 4.696 23.019 1.00 0.00 H ATOM 1294 HH12 ARG B 69 -8.572 1.987 23.123 1.00 0.00 H ATOM 1295 HH11 ARG B 69 -8.342 3.540 22.239 1.00 0.00 H ATOM 1296 HH22 ARG B 69 -10.570 1.545 24.166 1.00 0.00 H ATOM 1297 HH21 ARG B 69 -11.909 2.748 24.102 1.00 0.00 H ATOM 1298 H ARG B 69 -7.965 9.605 20.446 1.00 0.00 H ATOM 1299 N GLU B 70 -11.205 9.964 21.226 1.00 64.94 N ATOM 1300 CA GLU B 70 -12.530 10.504 21.536 1.00 63.73 C ATOM 1301 C GLU B 70 -13.465 10.402 20.341 1.00 64.69 C ATOM 1302 O GLU B 70 -14.622 9.987 20.477 1.00 58.74 O ATOM 1303 CB GLU B 70 -12.423 11.969 21.975 1.00 73.62 C ATOM 1304 CG GLU B 70 -12.623 12.227 23.457 1.00 81.51 C ATOM 1305 CD GLU B 70 -11.401 11.877 24.287 1.00 92.07 C ATOM 1306 OE1 GLU B 70 -11.543 11.744 25.526 1.00 98.68 O ATOM 1307 OE2 GLU B 70 -10.301 11.737 23.703 1.00 92.83 O ATOM 1308 H GLU B 70 -10.384 10.602 21.227 1.00 0.00 H ATOM 1309 N LEU B 71 -12.986 10.815 19.161 1.00 63.87 N ATOM 1310 CA LEU B 71 -13.752 10.659 17.925 1.00 63.84 C ATOM 1311 C LEU B 71 -14.177 9.211 17.710 1.00 61.75 C ATOM 1312 O LEU B 71 -15.348 8.928 17.416 1.00 54.06 O ATOM 1313 CB LEU B 71 -12.922 11.156 16.740 1.00 64.72 C ATOM 1314 CG LEU B 71 -13.680 11.596 15.494 1.00 62.48 C ATOM 1315 CD1 LEU B 71 -15.026 12.127 15.885 1.00 64.95 C ATOM 1316 CD2 LEU B 71 -12.898 12.679 14.778 1.00 73.78 C ATOM 1317 H LEU B 71 -12.046 11.258 19.122 1.00 0.00 H ATOM 1318 N ALA B 72 -13.233 8.276 17.858 1.00 55.96 N ATOM 1319 CA ALA B 72 -13.564 6.861 17.715 1.00 60.57 C ATOM 1320 C ALA B 72 -14.603 6.438 18.746 1.00 57.49 C ATOM 1321 O ALA B 72 -15.517 5.661 18.438 1.00 51.89 O ATOM 1322 CB ALA B 72 -12.300 5.994 17.844 1.00 47.52 C ATOM 1323 H ALA B 72 -12.256 8.558 18.076 1.00 0.00 H ATOM 1324 N ASP B 73 -14.479 6.936 19.980 1.00 60.49 N ATOM 1325 CA ASP B 73 -15.420 6.546 21.027 1.00 61.62 C ATOM 1326 C ASP B 73 -16.831 7.037 20.719 1.00 52.63 C ATOM 1327 O ASP B 73 -17.794 6.287 20.885 1.00 55.57 O ATOM 1328 CB ASP B 73 -14.944 7.057 22.392 1.00 60.76 C ATOM 1329 CG ASP B 73 -13.908 6.132 23.030 1.00 65.11 C ATOM 1330 OD1 ASP B 73 -13.870 4.938 22.649 1.00 69.06 O ATOM 1331 OD2 ASP B 73 -13.133 6.594 23.903 1.00 72.58 O ATOM 1332 H ASP B 73 -13.711 7.603 20.195 1.00 0.00 H ATOM 1333 N GLN B 74 -16.963 8.270 20.222 1.00 54.06 N ATOM 1334 CA GLN B 74 -18.274 8.809 19.859 1.00 52.85 C ATOM 1335 C GLN B 74 -18.944 7.976 18.773 1.00 58.80 C ATOM 1336 O GLN B 74 -20.125 7.597 18.898 1.00 52.37 O ATOM 1337 CB GLN B 74 -18.130 10.262 19.403 1.00 63.24 C ATOM 1338 CG GLN B 74 -17.468 11.162 20.438 1.00 69.31 C ATOM 1339 CD GLN B 74 -17.441 12.642 20.049 1.00 76.21 C ATOM 1340 OE1 GLN B 74 -17.336 12.996 18.872 1.00 71.59 O ATOM 1341 NE2 GLN B 74 -17.528 13.515 21.055 1.00 85.45 N ATOM 1342 HE22 GLN B 74 -17.615 13.174 22.034 1.00 0.00 H ATOM 1343 HE21 GLN B 74 -17.508 14.536 20.860 1.00 0.00 H ATOM 1344 H GLN B 74 -16.116 8.859 20.090 1.00 0.00 H ATOM 1345 N ILE B 75 -18.211 7.702 17.676 1.00 50.07 N ATOM 1346 CA ILE B 75 -18.763 6.871 16.609 1.00 45.09 C ATOM 1347 C ILE B 75 -19.183 5.518 17.163 1.00 44.03 C ATOM 1348 O ILE B 75 -20.298 5.055 16.924 1.00 44.29 O ATOM 1349 CB ILE B 75 -17.757 6.701 15.449 1.00 46.63 C ATOM 1350 CG1 ILE B 75 -17.527 8.035 14.720 1.00 45.68 C ATOM 1351 CG2 ILE B 75 -18.281 5.634 14.489 1.00 39.93 C ATOM 1352 CD1 ILE B 75 -16.419 7.985 13.593 1.00 45.73 C ATOM 1353 H ILE B 75 -17.248 8.084 17.589 1.00 0.00 H ATOM 1354 N GLN B 76 -18.292 4.851 17.894 1.00 39.04 N ATOM 1355 CA GLN B 76 -18.643 3.522 18.385 1.00 44.17 C ATOM 1356 C GLN B 76 -19.877 3.558 19.296 1.00 51.94 C ATOM 1357 O GLN B 76 -20.759 2.700 19.182 1.00 50.88 O ATOM 1358 CB GLN B 76 -17.466 2.907 19.125 1.00 46.43 C ATOM 1359 CG GLN B 76 -17.636 1.435 19.420 1.00 45.89 C ATOM 1360 CD GLN B 76 -16.512 0.892 20.288 1.00 59.88 C ATOM 1361 OE1 GLN B 76 -16.195 1.466 21.332 1.00 62.68 O ATOM 1362 NE2 GLN B 76 -15.885 -0.207 19.845 1.00 51.00 N ATOM 1363 HE22 GLN B 76 -16.188 -0.657 18.958 1.00 0.00 H ATOM 1364 HE21 GLN B 76 -15.095 -0.610 20.389 1.00 0.00 H ATOM 1365 H GLN B 76 -17.365 5.269 18.111 1.00 0.00 H ATOM 1366 N ASP B 77 -19.947 4.536 20.215 1.00 51.96 N ATOM 1367 CA ASP B 77 -21.038 4.574 21.187 1.00 48.80 C ATOM 1368 C ASP B 77 -22.380 4.761 20.491 1.00 55.34 C ATOM 1369 O ASP B 77 -23.363 4.086 20.821 1.00 55.34 O ATOM 1370 CB ASP B 77 -20.796 5.702 22.195 1.00 51.69 C ATOM 1371 CG ASP B 77 -19.676 5.390 23.175 1.00 61.02 C ATOM 1372 OD1 ASP B 77 -19.263 4.215 23.268 1.00 71.18 O ATOM 1373 OD2 ASP B 77 -19.192 6.330 23.845 1.00 69.48 O ATOM 1374 H ASP B 77 -19.216 5.275 20.235 1.00 0.00 H ATOM 1375 N LYS B 78 -22.424 5.650 19.493 1.00 47.05 N ATOM 1376 CA LYS B 78 -23.649 5.879 18.750 1.00 48.13 C ATOM 1377 C LYS B 78 -24.081 4.659 17.945 1.00 55.78 C ATOM 1378 O LYS B 78 -25.280 4.347 17.906 1.00 53.20 O ATOM 1379 CB LYS B 78 -23.487 7.094 17.842 1.00 54.59 C ATOM 1380 CG LYS B 78 -24.760 7.511 17.128 1.00 54.72 C ATOM 1381 CD LYS B 78 -24.709 8.980 16.756 1.00 62.28 C ATOM 1382 CE LYS B 78 -24.897 9.854 18.005 1.00 70.68 C ATOM 1383 NZ LYS B 78 -24.847 11.313 17.697 1.00 78.14 N ATOM 1384 HZ1 LYS B 78 -23.924 11.546 17.279 1.00 0.00 H ATOM 1385 HZ2 LYS B 78 -25.603 11.550 17.024 1.00 0.00 H ATOM 1386 HZ3 LYS B 78 -24.979 11.856 18.574 1.00 0.00 H ATOM 1387 H LYS B 78 -21.567 6.185 19.246 1.00 0.00 H ATOM 1388 N VAL B 79 -23.145 3.963 17.263 1.00 44.48 N ATOM 1389 CA VAL B 79 -23.589 2.823 16.467 1.00 40.02 C ATOM 1390 C VAL B 79 -24.040 1.694 17.380 1.00 46.26 C ATOM 1391 O VAL B 79 -25.030 1.016 17.100 1.00 49.76 O ATOM 1392 CB VAL B 79 -22.500 2.344 15.472 1.00 45.48 C ATOM 1393 CG1 VAL B 79 -22.884 1.002 14.919 1.00 47.77 C ATOM 1394 CG2 VAL B 79 -22.352 3.336 14.310 1.00 42.53 C ATOM 1395 H VAL B 79 -22.141 4.231 17.304 1.00 0.00 H ATOM 1396 N VAL B 80 -23.329 1.473 18.486 1.00 48.91 N ATOM 1397 CA VAL B 80 -23.729 0.414 19.415 1.00 54.79 C ATOM 1398 C VAL B 80 -25.120 0.709 19.970 1.00 55.36 C ATOM 1399 O VAL B 80 -26.022 -0.140 19.940 1.00 53.72 O ATOM 1400 CB VAL B 80 -22.694 0.267 20.547 1.00 49.32 C ATOM 1401 CG1 VAL B 80 -23.269 -0.541 21.718 1.00 52.73 C ATOM 1402 CG2 VAL B 80 -21.377 -0.366 20.014 1.00 54.82 C ATOM 1403 H VAL B 80 -22.490 2.053 18.689 1.00 0.00 H ATOM 1404 N ALA B 81 -25.311 1.936 20.451 1.00 51.70 N ATOM 1405 CA ALA B 81 -26.598 2.347 21.009 1.00 54.14 C ATOM 1406 C ALA B 81 -27.720 2.161 20.004 1.00 57.05 C ATOM 1407 O ALA B 81 -28.791 1.636 20.341 1.00 58.04 O ATOM 1408 CB ALA B 81 -26.524 3.810 21.460 1.00 47.48 C ATOM 1409 H ALA B 81 -24.526 2.618 20.429 1.00 0.00 H ATOM 1410 N LYS B 82 -27.485 2.559 18.754 1.00 55.19 N ATOM 1411 CA LYS B 82 -28.562 2.521 17.782 1.00 50.98 C ATOM 1412 C LYS B 82 -28.843 1.111 17.270 1.00 59.67 C ATOM 1413 O LYS B 82 -30.008 0.742 17.104 1.00 53.05 O ATOM 1414 CB LYS B 82 -28.244 3.455 16.625 1.00 55.90 C ATOM 1415 CG LYS B 82 -28.348 4.928 16.999 1.00 58.88 C ATOM 1416 CD LYS B 82 -28.648 5.780 15.779 1.00 65.13 C ATOM 1417 CE LYS B 82 -29.580 6.925 16.148 1.00 74.08 C ATOM 1418 NZ LYS B 82 -28.932 7.804 17.167 1.00 74.10 N ATOM 1419 HZ1 LYS B 82 -28.720 7.247 18.019 1.00 0.00 H ATOM 1420 HZ2 LYS B 82 -28.050 8.193 16.777 1.00 0.00 H ATOM 1421 HZ3 LYS B 82 -29.577 8.582 17.412 1.00 0.00 H ATOM 1422 H LYS B 82 -26.540 2.893 18.478 1.00 0.00 H ATOM 1423 N TYR B 83 -27.818 0.292 16.995 1.00 49.33 N ATOM 1424 CA TYR B 83 -28.104 -0.910 16.222 1.00 50.81 C ATOM 1425 C TYR B 83 -27.697 -2.217 16.872 1.00 51.58 C ATOM 1426 O TYR B 83 -28.110 -3.267 16.379 1.00 56.00 O ATOM 1427 CB TYR B 83 -27.463 -0.824 14.816 1.00 51.09 C ATOM 1428 CG TYR B 83 -27.988 0.363 14.065 1.00 48.58 C ATOM 1429 CD1 TYR B 83 -29.329 0.431 13.707 1.00 55.22 C ATOM 1430 CD2 TYR B 83 -27.176 1.452 13.791 1.00 48.64 C ATOM 1431 CE1 TYR B 83 -29.844 1.541 13.060 1.00 53.05 C ATOM 1432 CE2 TYR B 83 -27.666 2.551 13.152 1.00 52.73 C ATOM 1433 CZ TYR B 83 -29.007 2.596 12.790 1.00 52.24 C ATOM 1434 OH TYR B 83 -29.496 3.705 12.172 1.00 49.33 O ATOM 1435 HH TYR B 83 -30.459 3.578 11.983 1.00 0.00 H ATOM 1436 H TYR B 83 -26.854 0.506 17.321 1.00 0.00 H ATOM 1437 N PHE B 84 -26.912 -2.205 17.944 1.00 49.19 N ATOM 1438 CA PHE B 84 -26.407 -3.486 18.403 1.00 58.64 C ATOM 1439 C PHE B 84 -27.487 -4.307 19.096 1.00 57.96 C ATOM 1440 O PHE B 84 -27.327 -5.523 19.232 1.00 62.58 O ATOM 1441 CB PHE B 84 -25.181 -3.285 19.303 1.00 58.96 C ATOM 1442 CG PHE B 84 -23.854 -3.217 18.533 1.00 53.29 C ATOM 1443 CD1 PHE B 84 -23.762 -2.516 17.337 1.00 47.99 C ATOM 1444 CD2 PHE B 84 -22.711 -3.820 19.028 1.00 50.79 C ATOM 1445 CE1 PHE B 84 -22.546 -2.431 16.644 1.00 54.49 C ATOM 1446 CE2 PHE B 84 -21.489 -3.754 18.326 1.00 54.41 C ATOM 1447 CZ PHE B 84 -21.416 -3.055 17.146 1.00 47.44 C ATOM 1448 H PHE B 84 -26.671 -1.319 18.432 1.00 0.00 H ATOM 1449 N ASP B 85 -28.598 -3.689 19.500 1.00 61.04 N ATOM 1450 CA ASP B 85 -29.730 -4.477 19.977 1.00 67.62 C ATOM 1451 C ASP B 85 -30.399 -5.225 18.832 1.00 66.68 C ATOM 1452 O ASP B 85 -30.558 -6.448 18.887 1.00 70.00 O ATOM 1453 CB ASP B 85 -30.741 -3.581 20.685 1.00 73.79 C ATOM 1454 CG ASP B 85 -30.097 -2.684 21.714 1.00 75.94 C ATOM 1455 OD1 ASP B 85 -29.112 -3.118 22.355 1.00 74.58 O ATOM 1456 OD2 ASP B 85 -30.568 -1.537 21.868 1.00 74.26 O ATOM 1457 H ASP B 85 -28.657 -2.651 19.475 1.00 0.00 H ATOM 1458 N ASP B 86 -30.777 -4.513 17.775 1.00 65.98 N ATOM 1459 CA ASP B 86 -31.638 -5.086 16.745 1.00 60.25 C ATOM 1460 C ASP B 86 -30.884 -5.786 15.612 1.00 62.86 C ATOM 1461 O ASP B 86 -31.500 -6.547 14.857 1.00 57.65 O ATOM 1462 CB ASP B 86 -32.535 -3.988 16.154 1.00 63.74 C ATOM 1463 CG ASP B 86 -33.705 -3.620 17.074 1.00 75.99 C ATOM 1464 OD1 ASP B 86 -33.685 -4.027 18.259 1.00 69.42 O ATOM 1465 OD2 ASP B 86 -34.640 -2.925 16.607 1.00 78.54 O ATOM 1466 H ASP B 86 -30.453 -3.529 17.680 1.00 0.00 H ATOM 1467 N TYR B 87 -29.591 -5.541 15.444 1.00 54.90 N ATOM 1468 CA TYR B 87 -28.823 -6.218 14.404 1.00 55.01 C ATOM 1469 C TYR B 87 -27.653 -6.955 15.043 1.00 53.69 C ATOM 1470 O TYR B 87 -27.236 -6.634 16.156 1.00 55.97 O ATOM 1471 CB TYR B 87 -28.316 -5.228 13.355 1.00 56.13 C ATOM 1472 CG TYR B 87 -29.411 -4.467 12.669 1.00 50.13 C ATOM 1473 CD1 TYR B 87 -30.066 -3.428 13.318 1.00 61.02 C ATOM 1474 CD2 TYR B 87 -29.817 -4.796 11.394 1.00 49.24 C ATOM 1475 CE1 TYR B 87 -31.075 -2.724 12.714 1.00 57.21 C ATOM 1476 CE2 TYR B 87 -30.835 -4.088 10.773 1.00 58.97 C ATOM 1477 CZ TYR B 87 -31.463 -3.059 11.448 1.00 56.98 C ATOM 1478 OH TYR B 87 -32.481 -2.342 10.863 1.00 63.58 O ATOM 1479 HH TYR B 87 -32.803 -1.652 11.496 1.00 0.00 H ATOM 1480 H TYR B 87 -29.116 -4.854 16.064 1.00 0.00 H ATOM 1481 N SER B 88 -27.142 -7.974 14.353 1.00 49.61 N ATOM 1482 CA SER B 88 -26.011 -8.738 14.861 1.00 63.11 C ATOM 1483 C SER B 88 -24.746 -8.044 14.373 1.00 55.52 C ATOM 1484 O SER B 88 -24.444 -8.063 13.176 1.00 57.00 O ATOM 1485 CB SER B 88 -26.068 -10.186 14.392 1.00 68.44 C ATOM 1486 OG SER B 88 -26.267 -10.238 12.989 1.00 69.68 O ATOM 1487 HG SER B 88 -25.518 -9.778 12.533 1.00 0.00 H ATOM 1488 H SER B 88 -27.559 -8.228 13.435 1.00 0.00 H ATOM 1489 N CYS B 89 -24.045 -7.381 15.284 1.00 61.08 N ATOM 1490 CA CYS B 89 -22.847 -6.632 14.936 1.00 56.81 C ATOM 1491 C CYS B 89 -21.771 -6.874 15.975 1.00 57.04 C ATOM 1492 O CYS B 89 -22.037 -7.350 17.078 1.00 59.93 O ATOM 1493 CB CYS B 89 -23.108 -5.134 14.847 1.00 50.33 C ATOM 1494 SG CYS B 89 -24.728 -4.702 14.128 1.00 62.87 S ATOM 1495 H CYS B 89 -24.361 -7.397 16.275 1.00 0.00 H ATOM 1496 N ILE B 90 -20.533 -6.545 15.598 1.00 53.89 N ATOM 1497 CA ILE B 90 -19.413 -6.515 16.526 1.00 50.42 C ATOM 1498 C ILE B 90 -18.593 -5.270 16.222 1.00 44.40 C ATOM 1499 O ILE B 90 -18.655 -4.709 15.127 1.00 49.95 O ATOM 1500 CB ILE B 90 -18.533 -7.780 16.450 1.00 55.78 C ATOM 1501 CG1 ILE B 90 -17.780 -7.830 15.122 1.00 49.20 C ATOM 1502 CG2 ILE B 90 -19.368 -9.062 16.604 1.00 51.57 C ATOM 1503 CD1 ILE B 90 -16.737 -8.912 15.097 1.00 57.54 C ATOM 1504 H ILE B 90 -20.363 -6.301 14.602 1.00 0.00 H ATOM 1505 N THR B 91 -17.836 -4.823 17.217 1.00 47.31 N ATOM 1506 CA THR B 91 -16.956 -3.686 17.032 1.00 47.21 C ATOM 1507 C THR B 91 -15.703 -3.878 17.877 1.00 54.39 C ATOM 1508 O THR B 91 -15.736 -4.537 18.916 1.00 48.89 O ATOM 1509 CB THR B 91 -17.662 -2.380 17.381 1.00 45.04 C ATOM 1510 OG1 THR B 91 -16.770 -1.277 17.191 1.00 52.71 O ATOM 1511 CG2 THR B 91 -18.132 -2.382 18.839 1.00 52.20 C ATOM 1512 HG1 THR B 91 -16.479 -1.249 16.245 1.00 0.00 H ATOM 1513 H THR B 91 -17.875 -5.296 18.143 1.00 0.00 H ATOM 1514 N TYR B 92 -14.585 -3.330 17.399 1.00 54.04 N ATOM 1515 CA TYR B 92 -13.370 -3.295 18.198 1.00 51.84 C ATOM 1516 C TYR B 92 -12.526 -2.120 17.744 1.00 48.58 C ATOM 1517 O TYR B 92 -12.822 -1.469 16.741 1.00 49.12 O ATOM 1518 CB TYR B 92 -12.560 -4.600 18.118 1.00 51.16 C ATOM 1519 CG TYR B 92 -12.296 -5.147 16.730 1.00 53.00 C ATOM 1520 CD1 TYR B 92 -11.160 -4.773 16.001 1.00 43.40 C ATOM 1521 CD2 TYR B 92 -13.153 -6.085 16.166 1.00 45.85 C ATOM 1522 CE1 TYR B 92 -10.930 -5.303 14.707 1.00 41.58 C ATOM 1523 CE2 TYR B 92 -12.930 -6.606 14.896 1.00 46.87 C ATOM 1524 CZ TYR B 92 -11.822 -6.221 14.175 1.00 50.71 C ATOM 1525 OH TYR B 92 -11.633 -6.768 12.907 1.00 56.00 O ATOM 1526 HH TYR B 92 -10.803 -6.402 12.511 1.00 0.00 H ATOM 1527 H TYR B 92 -14.582 -2.922 16.442 1.00 0.00 H ATOM 1528 N ILE B 93 -11.471 -1.848 18.507 1.00 49.24 N ATOM 1529 CA ILE B 93 -10.571 -0.730 18.256 1.00 52.73 C ATOM 1530 C ILE B 93 -9.149 -1.222 18.466 1.00 50.26 C ATOM 1531 O ILE B 93 -8.907 -2.067 19.333 1.00 49.31 O ATOM 1532 CB ILE B 93 -10.865 0.458 19.197 1.00 49.48 C ATOM 1533 CG1 ILE B 93 -12.354 0.788 19.213 1.00 56.84 C ATOM 1534 CG2 ILE B 93 -10.054 1.680 18.784 1.00 51.17 C ATOM 1535 CD1 ILE B 93 -12.710 2.000 20.068 1.00 51.48 C ATOM 1536 H ILE B 93 -11.279 -2.464 19.323 1.00 0.00 H ATOM 1537 N SER B 94 -8.213 -0.708 17.667 1.00 48.20 N ATOM 1538 CA SER B 94 -6.781 -0.930 17.885 1.00 44.23 C ATOM 1539 C SER B 94 -6.039 0.347 17.498 1.00 53.66 C ATOM 1540 O SER B 94 -6.648 1.324 17.063 1.00 49.24 O ATOM 1541 CB SER B 94 -6.271 -2.150 17.105 1.00 51.33 C ATOM 1542 OG SER B 94 -6.599 -2.068 15.734 1.00 56.22 O ATOM 1543 HG SER B 94 -6.255 -2.869 15.265 1.00 0.00 H ATOM 1544 H SER B 94 -8.511 -0.127 16.858 1.00 0.00 H ATOM 1545 N THR B 95 -4.712 0.361 17.674 1.00 52.30 N ATOM 1546 CA THR B 95 -3.903 1.503 17.275 1.00 47.88 C ATOM 1547 C THR B 95 -2.994 1.116 16.118 1.00 48.72 C ATOM 1548 O THR B 95 -2.567 -0.028 15.997 1.00 50.53 O ATOM 1549 CB THR B 95 -3.039 2.046 18.418 1.00 57.92 C ATOM 1550 OG1 THR B 95 -2.037 1.087 18.762 1.00 59.29 O ATOM 1551 CG2 THR B 95 -3.887 2.326 19.636 1.00 59.65 C ATOM 1552 HG1 THR B 95 -1.466 0.911 17.973 1.00 0.00 H ATOM 1553 H THR B 95 -4.248 -0.464 18.106 1.00 0.00 H ATOM 1554 N VAL B 96 -2.719 2.096 15.265 1.00 44.56 N ATOM 1555 CA VAL B 96 -1.799 1.972 14.158 1.00 49.53 C ATOM 1556 C VAL B 96 -0.908 3.209 14.166 1.00 47.20 C ATOM 1557 O VAL B 96 -1.154 4.169 14.881 1.00 49.43 O ATOM 1558 CB VAL B 96 -2.532 1.836 12.808 1.00 47.43 C ATOM 1559 CG1 VAL B 96 -3.460 0.616 12.833 1.00 44.11 C ATOM 1560 CG2 VAL B 96 -3.308 3.127 12.523 1.00 47.59 C ATOM 1561 H VAL B 96 -3.196 3.010 15.402 1.00 0.00 H ATOM 1562 N GLU B 97 0.135 3.176 13.354 1.00 50.34 N ATOM 1563 CA GLU B 97 1.049 4.296 13.203 1.00 41.12 C ATOM 1564 C GLU B 97 0.941 4.840 11.787 1.00 42.50 C ATOM 1565 O GLU B 97 0.953 4.071 10.815 1.00 46.78 O ATOM 1566 CB GLU B 97 2.491 3.860 13.469 1.00 50.14 C ATOM 1567 CG GLU B 97 2.729 3.218 14.808 1.00 48.30 C ATOM 1568 CD GLU B 97 4.231 2.958 15.011 1.00 62.73 C ATOM 1569 OE1 GLU B 97 5.031 3.797 14.558 1.00 59.42 O ATOM 1570 OE2 GLU B 97 4.606 1.924 15.599 1.00 59.19 O ATOM 1571 H GLU B 97 0.309 2.313 12.800 1.00 0.00 H ATOM 1572 N ALA B 98 0.859 6.159 11.669 1.00 50.37 N ATOM 1573 CA ALA B 98 0.833 6.832 10.379 1.00 46.54 C ATOM 1574 C ALA B 98 1.947 7.871 10.336 1.00 52.05 C ATOM 1575 O ALA B 98 2.491 8.275 11.367 1.00 56.26 O ATOM 1576 CB ALA B 98 -0.514 7.502 10.114 1.00 50.27 C ATOM 1577 H ALA B 98 0.811 6.735 12.533 1.00 0.00 H ATOM 1578 N LEU B 99 2.278 8.307 9.129 1.00 55.08 N ATOM 1579 CA LEU B 99 3.245 9.380 8.962 1.00 57.78 C ATOM 1580 C LEU B 99 2.662 10.697 9.476 1.00 61.34 C ATOM 1581 O LEU B 99 1.483 10.987 9.265 1.00 58.98 O ATOM 1582 CB LEU B 99 3.626 9.504 7.488 1.00 59.51 C ATOM 1583 CG LEU B 99 4.214 8.238 6.850 1.00 54.42 C ATOM 1584 CD1 LEU B 99 3.662 8.000 5.434 1.00 54.75 C ATOM 1585 CD2 LEU B 99 5.736 8.311 6.834 1.00 61.56 C ATOM 1586 H LEU B 99 1.840 7.876 8.290 1.00 0.00 H ATOM 1587 N ARG B 100 3.497 11.492 10.162 1.00 60.58 N ATOM 1588 CA ARG B 100 3.061 12.807 10.622 1.00 67.53 C ATOM 1589 C ARG B 100 2.533 13.654 9.477 1.00 64.64 C ATOM 1590 O ARG B 100 1.615 14.458 9.672 1.00 71.37 O ATOM 1591 CB ARG B 100 4.203 13.559 11.306 1.00 76.13 C ATOM 1592 CG ARG B 100 5.256 12.692 11.907 1.00 75.65 C ATOM 1593 CD ARG B 100 6.083 13.435 12.939 1.00 74.02 C ATOM 1594 NE ARG B 100 5.252 13.914 14.039 1.00 80.39 N ATOM 1595 CZ ARG B 100 5.621 13.880 15.315 1.00 79.53 C ATOM 1596 NH1 ARG B 100 6.801 13.373 15.660 1.00 83.91 N ATOM 1597 NH2 ARG B 100 4.807 14.340 16.246 1.00 90.80 N ATOM 1598 HE ARG B 100 4.316 14.305 13.811 1.00 0.00 H ATOM 1599 HH12 ARG B 100 7.084 13.349 16.660 1.00 0.00 H ATOM 1600 HH11 ARG B 100 7.441 13.000 14.929 1.00 0.00 H ATOM 1601 HH22 ARG B 100 5.093 14.315 17.246 1.00 0.00 H ATOM 1602 HH21 ARG B 100 3.879 14.728 15.980 1.00 0.00 H ATOM 1603 H ARG B 100 4.464 11.168 10.368 1.00 0.00 H ATOM 1604 N ALA B 101 3.092 13.479 8.277 1.00 67.65 N ATOM 1605 CA ALA B 101 2.708 14.298 7.135 1.00 62.26 C ATOM 1606 C ALA B 101 1.262 14.077 6.728 1.00 65.83 C ATOM 1607 O ALA B 101 0.666 14.955 6.092 1.00 66.44 O ATOM 1608 CB ALA B 101 3.638 14.006 5.960 1.00 64.85 C ATOM 1609 H ALA B 101 3.816 12.743 8.155 1.00 0.00 H ATOM 1610 N HIS B 102 0.681 12.940 7.094 1.00 62.18 N ATOM 1611 CA HIS B 102 -0.697 12.642 6.741 1.00 66.06 C ATOM 1612 C HIS B 102 -1.659 13.077 7.847 1.00 73.04 C ATOM 1613 O HIS B 102 -1.324 13.067 9.037 1.00 68.50 O ATOM 1614 CB HIS B 102 -0.854 11.152 6.446 1.00 62.62 C ATOM 1615 CG HIS B 102 -0.045 10.690 5.274 1.00 70.94 C ATOM 1616 ND1 HIS B 102 0.599 11.566 4.424 1.00 71.37 N ATOM 1617 CD2 HIS B 102 0.250 9.446 4.827 1.00 60.60 C ATOM 1618 CE1 HIS B 102 1.245 10.883 3.497 1.00 67.68 C ATOM 1619 NE2 HIS B 102 1.040 9.594 3.713 1.00 68.91 N ATOM 1620 H HIS B 102 1.225 12.247 7.646 1.00 0.00 H ATOM 1621 N LYS B 103 -2.867 13.463 7.428 1.00 72.64 N ATOM 1622 CA LYS B 103 -3.917 13.970 8.309 1.00 74.68 C ATOM 1623 C LYS B 103 -5.047 12.952 8.377 1.00 75.30 C ATOM 1624 O LYS B 103 -5.621 12.582 7.346 1.00 78.59 O ATOM 1625 CB LYS B 103 -4.459 15.311 7.813 1.00 72.58 C ATOM 1626 CG LYS B 103 -3.476 16.470 7.898 1.00 84.92 C ATOM 1627 CD LYS B 103 -3.932 17.629 7.027 1.00 93.97 C ATOM 1628 CE LYS B 103 -3.589 17.389 5.559 1.00 89.40 C ATOM 1629 NZ LYS B 103 -3.346 18.669 4.831 1.00 96.41 N ATOM 1630 HZ1 LYS B 103 -4.201 19.259 4.875 1.00 0.00 H ATOM 1631 HZ2 LYS B 103 -2.552 19.173 5.275 1.00 0.00 H ATOM 1632 HZ3 LYS B 103 -3.116 18.463 3.838 1.00 0.00 H ATOM 1633 H LYS B 103 -3.073 13.399 6.411 1.00 0.00 H ATOM 1634 N PHE B 104 -5.375 12.516 9.586 1.00 67.78 N ATOM 1635 CA PHE B 104 -6.414 11.522 9.770 1.00 69.10 C ATOM 1636 C PHE B 104 -7.578 12.050 10.624 1.00 69.01 C ATOM 1637 O PHE B 104 -7.419 12.337 11.814 1.00 72.02 O ATOM 1638 CB PHE B 104 -5.803 10.261 10.384 1.00 58.77 C ATOM 1639 CG PHE B 104 -5.195 9.336 9.360 1.00 65.91 C ATOM 1640 CD1 PHE B 104 -6.002 8.540 8.569 1.00 59.27 C ATOM 1641 CD2 PHE B 104 -3.822 9.281 9.174 1.00 62.93 C ATOM 1642 CE1 PHE B 104 -5.450 7.691 7.616 1.00 65.81 C ATOM 1643 CE2 PHE B 104 -3.269 8.438 8.225 1.00 68.36 C ATOM 1644 CZ PHE B 104 -4.085 7.643 7.445 1.00 62.07 C ATOM 1645 H PHE B 104 -4.878 12.894 10.417 1.00 0.00 H TER 1646 PHE B 104 ATOM 1647 N SER D 2 -12.351 -1.313 27.038 1.00 91.72 N ATOM 1648 CA SER D 2 -12.156 -2.319 28.077 1.00 94.13 C ATOM 1649 C SER D 2 -12.223 -3.734 27.502 1.00 89.51 C ATOM 1650 O SER D 2 -12.973 -3.980 26.565 1.00 89.07 O ATOM 1651 CB SER D 2 -13.197 -2.143 29.179 1.00 94.23 C ATOM 1652 OG SER D 2 -13.113 -0.842 29.739 1.00103.22 O ATOM 1653 HG SER D 2 -13.794 -0.746 30.451 1.00 0.00 H ATOM 1654 HN3 SER D 2 -13.284 -1.447 26.598 1.00 0.00 H ATOM 1655 HN2 SER D 2 -11.608 -1.413 26.317 1.00 0.00 H ATOM 1656 HN1 SER D 2 -12.300 -0.365 27.462 1.00 0.00 H ATOM 1657 N GLN D 3 -11.428 -4.642 28.084 1.00 88.11 N ATOM 1658 CA GLN D 3 -11.271 -6.042 27.679 1.00 84.77 C ATOM 1659 C GLN D 3 -10.383 -6.166 26.439 1.00 83.68 C ATOM 1660 O GLN D 3 -10.727 -5.667 25.359 1.00 76.84 O ATOM 1661 CB GLN D 3 -12.637 -6.721 27.460 1.00 86.13 C ATOM 1662 CG GLN D 3 -12.621 -7.843 26.421 1.00 84.46 C ATOM 1663 CD GLN D 3 -13.730 -8.882 26.586 1.00 88.95 C ATOM 1664 OE1 GLN D 3 -13.530 -9.926 27.215 1.00 88.24 O ATOM 1665 NE2 GLN D 3 -14.894 -8.612 25.991 1.00 82.79 N ATOM 1666 HE22 GLN D 3 -15.018 -7.720 25.472 1.00 0.00 H ATOM 1667 HE21 GLN D 3 -15.677 -9.294 26.047 1.00 0.00 H ATOM 1668 H GLN D 3 -10.869 -4.323 28.901 1.00 0.00 H ATOM 1669 N GLN D 4 -9.237 -6.835 26.592 1.00 83.02 N ATOM 1670 CA GLN D 4 -8.251 -6.997 25.529 1.00 78.96 C ATOM 1671 C GLN D 4 -8.409 -8.384 24.926 1.00 76.65 C ATOM 1672 O GLN D 4 -8.196 -9.389 25.610 1.00 86.92 O ATOM 1673 CB GLN D 4 -6.832 -6.793 26.070 1.00 79.38 C ATOM 1674 CG GLN D 4 -5.701 -7.391 25.228 1.00 83.13 C ATOM 1675 CD GLN D 4 -4.546 -7.954 26.073 1.00 89.34 C ATOM 1676 OE1 GLN D 4 -4.328 -7.536 27.212 1.00 92.32 O ATOM 1677 NE2 GLN D 4 -3.808 -8.910 25.509 1.00 84.14 N ATOM 1678 HE22 GLN D 4 -4.026 -9.234 24.545 1.00 0.00 H ATOM 1679 HE21 GLN D 4 -3.015 -9.332 26.033 1.00 0.00 H ATOM 1680 H GLN D 4 -9.037 -7.263 27.518 1.00 0.00 H ATOM 1681 N VAL D 5 -8.781 -8.443 23.653 1.00 67.21 N ATOM 1682 CA VAL D 5 -9.000 -9.721 22.998 1.00 67.60 C ATOM 1683 C VAL D 5 -7.977 -9.886 21.887 1.00 68.09 C ATOM 1684 O VAL D 5 -7.323 -8.934 21.450 1.00 62.93 O ATOM 1685 CB VAL D 5 -10.434 -9.871 22.449 1.00 68.15 C ATOM 1686 CG1 VAL D 5 -11.454 -9.458 23.504 1.00 65.60 C ATOM 1687 CG2 VAL D 5 -10.613 -9.048 21.213 1.00 61.30 C ATOM 1688 H VAL D 5 -8.918 -7.562 23.117 1.00 0.00 H ATOM 1689 N TRP D 6 -7.855 -11.120 21.426 1.00 65.16 N ATOM 1690 CA TRP D 6 -6.864 -11.491 20.439 1.00 67.12 C ATOM 1691 C TRP D 6 -7.542 -11.683 19.095 1.00 67.32 C ATOM 1692 O TRP D 6 -8.654 -12.212 19.015 1.00 62.79 O ATOM 1693 CB TRP D 6 -6.124 -12.759 20.873 1.00 65.22 C ATOM 1694 CG TRP D 6 -5.432 -12.563 22.206 1.00 81.15 C ATOM 1695 CD1 TRP D 6 -6.004 -12.618 23.456 1.00 76.24 C ATOM 1696 CD2 TRP D 6 -4.050 -12.245 22.416 1.00 76.67 C ATOM 1697 NE1 TRP D 6 -5.056 -12.371 24.420 1.00 77.14 N ATOM 1698 CE2 TRP D 6 -3.851 -12.138 23.811 1.00 75.05 C ATOM 1699 CE3 TRP D 6 -2.962 -12.044 21.561 1.00 76.69 C ATOM 1700 CZ2 TRP D 6 -2.605 -11.843 24.366 1.00 81.62 C ATOM 1701 CZ3 TRP D 6 -1.727 -11.753 22.112 1.00 81.48 C ATOM 1702 CH2 TRP D 6 -1.559 -11.651 23.504 1.00 83.92 C ATOM 1703 HE1 TRP D 6 -5.226 -12.362 25.446 1.00 0.00 H ATOM 1704 H TRP D 6 -8.498 -11.853 21.788 1.00 0.00 H ATOM 1705 N LYS D 7 -6.862 -11.247 18.049 1.00 60.72 N ATOM 1706 CA LYS D 7 -7.335 -11.355 16.677 1.00 58.72 C ATOM 1707 C LYS D 7 -6.444 -12.350 15.960 1.00 56.86 C ATOM 1708 O LYS D 7 -5.299 -12.030 15.639 1.00 51.76 O ATOM 1709 CB LYS D 7 -7.295 -9.997 15.978 1.00 57.38 C ATOM 1710 CG LYS D 7 -7.899 -9.969 14.596 1.00 59.47 C ATOM 1711 CD LYS D 7 -7.833 -8.563 14.020 1.00 62.67 C ATOM 1712 CE LYS D 7 -8.928 -8.339 12.992 1.00 62.32 C ATOM 1713 NZ LYS D 7 -8.975 -6.918 12.512 1.00 59.53 N ATOM 1714 HZ1 LYS D 7 -9.155 -6.287 13.319 1.00 0.00 H ATOM 1715 HZ2 LYS D 7 -8.065 -6.671 12.074 1.00 0.00 H ATOM 1716 HZ3 LYS D 7 -9.738 -6.815 11.812 1.00 0.00 H ATOM 1717 H LYS D 7 -5.937 -10.802 18.216 1.00 0.00 H ATOM 1718 N LEU D 8 -6.969 -13.545 15.707 1.00 56.51 N ATOM 1719 CA LEU D 8 -6.290 -14.534 14.886 1.00 56.22 C ATOM 1720 C LEU D 8 -6.698 -14.331 13.434 1.00 60.29 C ATOM 1721 O LEU D 8 -7.891 -14.368 13.110 1.00 63.22 O ATOM 1722 CB LEU D 8 -6.630 -15.953 15.338 1.00 57.32 C ATOM 1723 CG LEU D 8 -6.255 -17.054 14.337 1.00 58.42 C ATOM 1724 CD1 LEU D 8 -4.754 -17.066 14.090 1.00 65.21 C ATOM 1725 CD2 LEU D 8 -6.727 -18.404 14.848 1.00 67.35 C ATOM 1726 H LEU D 8 -7.898 -13.780 16.111 1.00 0.00 H ATOM 1727 N VAL D 9 -5.712 -14.116 12.565 1.00 55.22 N ATOM 1728 CA VAL D 9 -5.924 -14.023 11.128 1.00 54.52 C ATOM 1729 C VAL D 9 -5.326 -15.259 10.476 1.00 65.78 C ATOM 1730 O VAL D 9 -4.200 -15.660 10.805 1.00 62.92 O ATOM 1731 CB VAL D 9 -5.306 -12.743 10.540 1.00 55.78 C ATOM 1732 CG1 VAL D 9 -5.354 -12.792 9.019 1.00 57.78 C ATOM 1733 CG2 VAL D 9 -6.037 -11.513 11.053 1.00 53.92 C ATOM 1734 H VAL D 9 -4.744 -14.009 12.931 1.00 0.00 H ATOM 1735 N ILE D 10 -6.086 -15.867 9.563 1.00 59.47 N ATOM 1736 CA ILE D 10 -5.619 -16.977 8.740 1.00 62.46 C ATOM 1737 C ILE D 10 -5.941 -16.642 7.300 1.00 57.24 C ATOM 1738 O ILE D 10 -7.057 -16.216 6.997 1.00 60.93 O ATOM 1739 CB ILE D 10 -6.284 -18.318 9.109 1.00 68.72 C ATOM 1740 CG1 ILE D 10 -6.034 -18.699 10.566 1.00 68.01 C ATOM 1741 CG2 ILE D 10 -5.801 -19.413 8.175 1.00 65.22 C ATOM 1742 CD1 ILE D 10 -7.063 -19.697 11.093 1.00 71.22 C ATOM 1743 H ILE D 10 -7.062 -15.532 9.431 1.00 0.00 H ATOM 1744 N ILE D 11 -4.984 -16.845 6.413 1.00 60.91 N ATOM 1745 CA ILE D 11 -5.191 -16.620 4.995 1.00 62.66 C ATOM 1746 C ILE D 11 -4.904 -17.938 4.292 1.00 71.23 C ATOM 1747 O ILE D 11 -3.756 -18.400 4.270 1.00 67.29 O ATOM 1748 CB ILE D 11 -4.303 -15.485 4.473 1.00 56.39 C ATOM 1749 CG1 ILE D 11 -4.455 -14.267 5.390 1.00 64.62 C ATOM 1750 CG2 ILE D 11 -4.653 -15.141 3.057 1.00 58.41 C ATOM 1751 CD1 ILE D 11 -4.076 -12.967 4.749 1.00 56.68 C ATOM 1752 H ILE D 11 -4.054 -17.176 6.741 1.00 0.00 H ATOM 1753 N THR D 12 -5.947 -18.567 3.752 1.00 68.71 N ATOM 1754 CA THR D 12 -5.802 -19.809 3.004 1.00 67.55 C ATOM 1755 C THR D 12 -6.599 -19.695 1.716 1.00 75.88 C ATOM 1756 O THR D 12 -7.247 -18.677 1.444 1.00 63.91 O ATOM 1757 CB THR D 12 -6.260 -21.031 3.811 1.00 72.33 C ATOM 1758 OG1 THR D 12 -7.632 -20.881 4.189 1.00 74.86 O ATOM 1759 CG2 THR D 12 -5.440 -21.177 5.070 1.00 74.37 C ATOM 1760 HG1 THR D 12 -7.918 -21.673 4.709 1.00 0.00 H ATOM 1761 H THR D 12 -6.896 -18.158 3.868 1.00 0.00 H ATOM 1762 N GLU D 13 -6.558 -20.755 0.915 1.00 69.53 N ATOM 1763 CA GLU D 13 -7.261 -20.701 -0.351 1.00 70.33 C ATOM 1764 C GLU D 13 -8.729 -21.089 -0.144 1.00 66.30 C ATOM 1765 O GLU D 13 -9.097 -21.682 0.871 1.00 70.49 O ATOM 1766 CB GLU D 13 -6.551 -21.602 -1.367 1.00 86.49 C ATOM 1767 CG GLU D 13 -7.044 -21.499 -2.799 1.00 91.35 C ATOM 1768 CD GLU D 13 -8.130 -22.506 -3.080 1.00 91.65 C ATOM 1769 OE1 GLU D 13 -8.100 -23.566 -2.431 1.00 99.21 O ATOM 1770 OE2 GLU D 13 -9.019 -22.209 -3.902 1.00 97.16 O ATOM 1771 H GLU D 13 -6.031 -21.608 1.192 1.00 0.00 H ATOM 1772 N GLU D 14 -9.567 -20.750 -1.134 1.00 70.98 N ATOM 1773 CA GLU D 14 -11.024 -20.782 -0.964 1.00 71.58 C ATOM 1774 C GLU D 14 -11.558 -22.164 -0.589 1.00 76.39 C ATOM 1775 O GLU D 14 -12.544 -22.258 0.151 1.00 73.43 O ATOM 1776 CB GLU D 14 -11.709 -20.283 -2.244 1.00 75.56 C ATOM 1777 CG GLU D 14 -13.259 -20.153 -2.176 1.00 83.17 C ATOM 1778 CD GLU D 14 -13.851 -19.217 -3.250 1.00 85.19 C ATOM 1779 OE1 GLU D 14 -13.074 -18.558 -3.973 1.00 88.84 O ATOM 1780 OE2 GLU D 14 -15.097 -19.143 -3.372 1.00 79.57 O ATOM 1781 H GLU D 14 -9.172 -20.455 -2.050 1.00 0.00 H ATOM 1782 N ILE D 15 -10.940 -23.248 -1.079 1.00 81.61 N ATOM 1783 CA ILE D 15 -11.531 -24.585 -0.904 1.00 75.79 C ATOM 1784 C ILE D 15 -11.478 -25.080 0.538 1.00 76.42 C ATOM 1785 O ILE D 15 -12.175 -26.043 0.884 1.00 71.85 O ATOM 1786 CB ILE D 15 -10.862 -25.629 -1.832 1.00 81.81 C ATOM 1787 CG1 ILE D 15 -10.508 -25.009 -3.200 1.00 79.86 C ATOM 1788 CG2 ILE D 15 -11.761 -26.853 -2.047 1.00 78.09 C ATOM 1789 CD1 ILE D 15 -9.513 -25.827 -4.021 1.00 85.51 C ATOM 1790 H ILE D 15 -10.038 -23.144 -1.586 1.00 0.00 H ATOM 1791 N LEU D 16 -10.667 -24.468 1.394 1.00 76.80 N ATOM 1792 CA LEU D 16 -10.610 -24.878 2.792 1.00 76.32 C ATOM 1793 C LEU D 16 -11.660 -24.176 3.650 1.00 79.12 C ATOM 1794 O LEU D 16 -11.703 -24.404 4.869 1.00 71.22 O ATOM 1795 CB LEU D 16 -9.208 -24.622 3.371 1.00 73.10 C ATOM 1796 CG LEU D 16 -8.076 -25.594 2.976 1.00 78.88 C ATOM 1797 CD1 LEU D 16 -6.783 -25.243 3.697 1.00 78.41 C ATOM 1798 CD2 LEU D 16 -8.429 -27.058 3.217 1.00 74.16 C ATOM 1799 H LEU D 16 -10.065 -23.687 1.063 1.00 0.00 H ATOM 1800 N LEU D 17 -12.515 -23.356 3.030 1.00 71.25 N ATOM 1801 CA LEU D 17 -13.457 -22.504 3.760 1.00 72.47 C ATOM 1802 C LEU D 17 -14.230 -23.275 4.831 1.00 73.72 C ATOM 1803 O LEU D 17 -14.213 -22.906 6.015 1.00 70.02 O ATOM 1804 CB LEU D 17 -14.414 -21.848 2.760 1.00 67.64 C ATOM 1805 CG LEU D 17 -15.636 -21.095 3.311 1.00 78.34 C ATOM 1806 CD1 LEU D 17 -15.226 -20.066 4.351 1.00 59.24 C ATOM 1807 CD2 LEU D 17 -16.428 -20.442 2.172 1.00 70.87 C ATOM 1808 H LEU D 17 -12.511 -23.322 1.991 1.00 0.00 H ATOM 1809 N LYS D 18 -14.904 -24.361 4.434 1.00 74.90 N ATOM 1810 CA LYS D 18 -15.748 -25.108 5.367 1.00 78.21 C ATOM 1811 C LYS D 18 -14.941 -25.926 6.367 1.00 74.53 C ATOM 1812 O LYS D 18 -15.388 -26.115 7.505 1.00 78.54 O ATOM 1813 CB LYS D 18 -16.706 -26.034 4.612 1.00 83.66 C ATOM 1814 CG LYS D 18 -17.370 -25.399 3.405 1.00 85.39 C ATOM 1815 CD LYS D 18 -16.582 -25.636 2.125 1.00 82.89 C ATOM 1816 CE LYS D 18 -16.701 -24.422 1.215 1.00 84.28 C ATOM 1817 NZ LYS D 18 -15.759 -24.435 0.070 1.00 74.99 N ATOM 1818 HZ1 LYS D 18 -14.782 -24.459 0.426 1.00 0.00 H ATOM 1819 HZ2 LYS D 18 -15.937 -25.277 -0.514 1.00 0.00 H ATOM 1820 HZ3 LYS D 18 -15.900 -23.578 -0.503 1.00 0.00 H ATOM 1821 H LYS D 18 -14.827 -24.679 3.447 1.00 0.00 H ATOM 1822 N LYS D 19 -13.768 -26.424 5.975 1.00 78.01 N ATOM 1823 CA LYS D 19 -12.974 -27.210 6.913 1.00 77.01 C ATOM 1824 C LYS D 19 -12.356 -26.324 7.983 1.00 70.65 C ATOM 1825 O LYS D 19 -12.321 -26.699 9.160 1.00 75.66 O ATOM 1826 CB LYS D 19 -11.892 -28.000 6.170 1.00 81.92 C ATOM 1827 CG LYS D 19 -12.275 -29.450 5.854 1.00 87.10 C ATOM 1828 CD LYS D 19 -13.495 -29.513 4.935 1.00 96.96 C ATOM 1829 CE LYS D 19 -14.448 -30.642 5.320 1.00 97.86 C ATOM 1830 NZ LYS D 19 -15.841 -30.395 4.828 1.00 90.08 N ATOM 1831 HZ1 LYS D 19 -16.201 -29.511 5.241 1.00 0.00 H ATOM 1832 HZ2 LYS D 19 -15.832 -30.317 3.791 1.00 0.00 H ATOM 1833 HZ3 LYS D 19 -16.453 -31.186 5.112 1.00 0.00 H ATOM 1834 H LYS D 19 -13.422 -26.254 5.009 1.00 0.00 H ATOM 1835 N VAL D 20 -11.859 -25.146 7.599 1.00 72.70 N ATOM 1836 CA VAL D 20 -11.261 -24.251 8.585 1.00 72.12 C ATOM 1837 C VAL D 20 -12.335 -23.665 9.489 1.00 69.37 C ATOM 1838 O VAL D 20 -12.174 -23.617 10.714 1.00 72.25 O ATOM 1839 CB VAL D 20 -10.435 -23.151 7.898 1.00 68.26 C ATOM 1840 CG1 VAL D 20 -10.106 -22.053 8.897 1.00 73.46 C ATOM 1841 CG2 VAL D 20 -9.151 -23.737 7.352 1.00 72.87 C ATOM 1842 H VAL D 20 -11.898 -24.866 6.598 1.00 0.00 H ATOM 1843 N SER D 21 -13.453 -23.224 8.904 1.00 72.65 N ATOM 1844 CA SER D 21 -14.545 -22.707 9.729 1.00 73.95 C ATOM 1845 C SER D 21 -15.009 -23.752 10.734 1.00 74.92 C ATOM 1846 O SER D 21 -15.318 -23.424 11.888 1.00 74.95 O ATOM 1847 CB SER D 21 -15.709 -22.246 8.852 1.00 69.00 C ATOM 1848 OG SER D 21 -16.147 -23.270 7.982 1.00 74.67 O ATOM 1849 HG SER D 21 -15.400 -23.542 7.391 1.00 0.00 H ATOM 1850 H SER D 21 -13.546 -23.248 7.868 1.00 0.00 H ATOM 1851 N LYS D 22 -15.029 -25.022 10.318 1.00 80.58 N ATOM 1852 CA LYS D 22 -15.344 -26.113 11.236 1.00 82.35 C ATOM 1853 C LYS D 22 -14.398 -26.107 12.430 1.00 81.37 C ATOM 1854 O LYS D 22 -14.836 -26.131 13.587 1.00 85.46 O ATOM 1855 CB LYS D 22 -15.277 -27.450 10.489 1.00 82.40 C ATOM 1856 CG LYS D 22 -14.761 -28.633 11.312 1.00 87.92 C ATOM 1857 CD LYS D 22 -15.831 -29.215 12.223 1.00 90.43 C ATOM 1858 CE LYS D 22 -15.511 -30.649 12.619 1.00 89.21 C ATOM 1859 NZ LYS D 22 -15.790 -31.602 11.506 1.00 96.51 N ATOM 1860 HZ1 LYS D 22 -16.797 -31.549 11.250 1.00 0.00 H ATOM 1861 HZ2 LYS D 22 -15.207 -31.351 10.682 1.00 0.00 H ATOM 1862 HZ3 LYS D 22 -15.560 -32.569 11.813 1.00 0.00 H ATOM 1863 H LYS D 22 -14.816 -25.237 9.323 1.00 0.00 H ATOM 1864 N ILE D 23 -13.090 -26.045 12.160 1.00 79.42 N ATOM 1865 CA ILE D 23 -12.099 -26.030 13.232 1.00 77.58 C ATOM 1866 C ILE D 23 -12.359 -24.873 14.187 1.00 82.24 C ATOM 1867 O ILE D 23 -12.303 -25.036 15.413 1.00 86.06 O ATOM 1868 CB ILE D 23 -10.680 -25.976 12.633 1.00 69.34 C ATOM 1869 CG1 ILE D 23 -10.396 -27.282 11.880 1.00 74.34 C ATOM 1870 CG2 ILE D 23 -9.662 -25.719 13.723 1.00 70.75 C ATOM 1871 CD1 ILE D 23 -9.179 -27.247 10.973 1.00 72.49 C ATOM 1872 H ILE D 23 -12.773 -26.007 11.170 1.00 0.00 H ATOM 1873 N ILE D 24 -12.672 -23.692 13.646 1.00 76.60 N ATOM 1874 CA ILE D 24 -12.934 -22.538 14.503 1.00 75.27 C ATOM 1875 C ILE D 24 -14.150 -22.798 15.383 1.00 83.50 C ATOM 1876 O ILE D 24 -14.111 -22.600 16.605 1.00 86.09 O ATOM 1877 CB ILE D 24 -13.118 -21.267 13.653 1.00 74.44 C ATOM 1878 CG1 ILE D 24 -11.799 -20.873 12.991 1.00 76.58 C ATOM 1879 CG2 ILE D 24 -13.649 -20.117 14.505 1.00 75.49 C ATOM 1880 CD1 ILE D 24 -11.983 -20.231 11.642 1.00 73.44 C ATOM 1881 H ILE D 24 -12.729 -23.594 12.612 1.00 0.00 H ATOM 1882 N LYS D 25 -15.253 -23.238 14.775 1.00 81.94 N ATOM 1883 CA LYS D 25 -16.465 -23.452 15.557 1.00 86.49 C ATOM 1884 C LYS D 25 -16.276 -24.583 16.554 1.00 84.04 C ATOM 1885 O LYS D 25 -16.665 -24.458 17.721 1.00 82.83 O ATOM 1886 CB LYS D 25 -17.650 -23.735 14.635 1.00 85.59 C ATOM 1887 CG LYS D 25 -18.342 -22.481 14.132 1.00 82.89 C ATOM 1888 CD LYS D 25 -19.214 -22.779 12.915 1.00 87.07 C ATOM 1889 CE LYS D 25 -18.402 -23.382 11.774 1.00 77.66 C ATOM 1890 NZ LYS D 25 -19.184 -23.485 10.512 1.00 73.91 N ATOM 1891 HZ1 LYS D 25 -20.015 -24.090 10.669 1.00 0.00 H ATOM 1892 HZ2 LYS D 25 -19.494 -22.536 10.219 1.00 0.00 H ATOM 1893 HZ3 LYS D 25 -18.587 -23.901 9.769 1.00 0.00 H ATOM 1894 H LYS D 25 -15.248 -23.427 13.752 1.00 0.00 H ATOM 1895 N GLU D 26 -15.645 -25.680 16.125 1.00 90.70 N ATOM 1896 CA GLU D 26 -15.472 -26.823 17.013 1.00 90.07 C ATOM 1897 C GLU D 26 -14.509 -26.535 18.155 1.00 88.16 C ATOM 1898 O GLU D 26 -14.508 -27.274 19.143 1.00 91.92 O ATOM 1899 CB GLU D 26 -14.995 -28.034 16.228 1.00 88.34 C ATOM 1900 CG GLU D 26 -15.644 -29.325 16.661 1.00 93.25 C ATOM 1901 CD GLU D 26 -14.964 -30.535 16.057 1.00 99.46 C ATOM 1902 OE1 GLU D 26 -13.729 -30.657 16.211 1.00105.94 O ATOM 1903 OE2 GLU D 26 -15.662 -31.367 15.438 1.00107.94 O ATOM 1904 H GLU D 26 -15.276 -25.718 15.154 1.00 0.00 H ATOM 1905 N ALA D 27 -13.688 -25.489 18.044 1.00 86.11 N ATOM 1906 CA ALA D 27 -12.861 -25.047 19.157 1.00 75.40 C ATOM 1907 C ALA D 27 -13.612 -24.136 20.119 1.00 84.89 C ATOM 1908 O ALA D 27 -13.071 -23.794 21.176 1.00 86.66 O ATOM 1909 CB ALA D 27 -11.617 -24.331 18.635 1.00 82.17 C ATOM 1910 H ALA D 27 -13.638 -24.977 17.140 1.00 0.00 H ATOM 1911 N GLY D 28 -14.835 -23.734 19.784 1.00 80.06 N ATOM 1912 CA GLY D 28 -15.636 -22.941 20.693 1.00 86.51 C ATOM 1913 C GLY D 28 -15.356 -21.454 20.632 1.00 82.54 C ATOM 1914 O GLY D 28 -15.307 -20.788 21.668 1.00 89.44 O ATOM 1915 H GLY D 28 -15.222 -23.993 18.854 1.00 0.00 H ATOM 1916 N ALA D 29 -15.163 -20.927 19.426 1.00 85.07 N ATOM 1917 CA ALA D 29 -15.022 -19.495 19.218 1.00 77.95 C ATOM 1918 C ALA D 29 -16.392 -18.856 19.034 1.00 74.21 C ATOM 1919 O ALA D 29 -17.300 -19.457 18.452 1.00 74.95 O ATOM 1920 CB ALA D 29 -14.146 -19.211 17.996 1.00 76.00 C ATOM 1921 H ALA D 29 -15.111 -21.561 18.603 1.00 0.00 H ATOM 1922 N SER D 30 -16.526 -17.617 19.530 1.00 74.67 N ATOM 1923 CA SER D 30 -17.764 -16.853 19.386 1.00 66.94 C ATOM 1924 C SER D 30 -18.255 -16.819 17.946 1.00 71.71 C ATOM 1925 O SER D 30 -19.461 -16.685 17.701 1.00 76.68 O ATOM 1926 CB SER D 30 -17.556 -15.417 19.868 1.00 70.97 C ATOM 1927 OG SER D 30 -17.063 -15.371 21.188 1.00 82.66 O ATOM 1928 HG SER D 30 -16.942 -14.427 21.461 1.00 0.00 H ATOM 1929 H SER D 30 -15.724 -17.186 20.033 1.00 0.00 H ATOM 1930 N GLY D 31 -17.345 -16.925 16.992 1.00 65.08 N ATOM 1931 CA GLY D 31 -17.655 -16.786 15.580 1.00 57.92 C ATOM 1932 C GLY D 31 -16.405 -16.386 14.818 1.00 66.11 C ATOM 1933 O GLY D 31 -15.286 -16.651 15.259 1.00 65.16 O ATOM 1934 H GLY D 31 -16.360 -17.117 17.266 1.00 0.00 H ATOM 1935 N TYR D 32 -16.616 -15.735 13.679 1.00 58.04 N ATOM 1936 CA TYR D 32 -15.485 -15.480 12.794 1.00 64.66 C ATOM 1937 C TYR D 32 -15.982 -14.717 11.584 1.00 58.07 C ATOM 1938 O TYR D 32 -17.174 -14.736 11.267 1.00 59.11 O ATOM 1939 CB TYR D 32 -14.807 -16.768 12.334 1.00 59.66 C ATOM 1940 CG TYR D 32 -15.680 -17.620 11.434 1.00 66.95 C ATOM 1941 CD1 TYR D 32 -16.665 -18.446 11.967 1.00 70.00 C ATOM 1942 CD2 TYR D 32 -15.519 -17.601 10.055 1.00 62.01 C ATOM 1943 CE1 TYR D 32 -17.468 -19.224 11.144 1.00 71.04 C ATOM 1944 CE2 TYR D 32 -16.316 -18.369 9.233 1.00 64.14 C ATOM 1945 CZ TYR D 32 -17.288 -19.176 9.783 1.00 63.40 C ATOM 1946 OH TYR D 32 -18.072 -19.931 8.954 1.00 73.33 O ATOM 1947 HH TYR D 32 -18.717 -20.452 9.495 1.00 0.00 H ATOM 1948 H TYR D 32 -17.571 -15.413 13.423 1.00 0.00 H ATOM 1949 N THR D 33 -15.044 -14.071 10.899 1.00 44.85 N ATOM 1950 CA THR D 33 -15.320 -13.210 9.763 1.00 55.44 C ATOM 1951 C THR D 33 -14.461 -13.667 8.597 1.00 56.06 C ATOM 1952 O THR D 33 -13.272 -13.944 8.773 1.00 63.09 O ATOM 1953 CB THR D 33 -15.038 -11.729 10.131 1.00 46.18 C ATOM 1954 OG1 THR D 33 -15.880 -11.336 11.217 1.00 53.95 O ATOM 1955 CG2 THR D 33 -15.245 -10.780 8.958 1.00 50.27 C ATOM 1956 HG1 THR D 33 -15.698 -10.391 11.449 1.00 0.00 H ATOM 1957 H THR D 33 -14.054 -14.189 11.194 1.00 0.00 H ATOM 1958 N VAL D 34 -15.052 -13.747 7.406 1.00 55.09 N ATOM 1959 CA VAL D 34 -14.324 -14.110 6.195 1.00 54.71 C ATOM 1960 C VAL D 34 -14.443 -12.977 5.181 1.00 53.69 C ATOM 1961 O VAL D 34 -15.537 -12.437 4.971 1.00 58.84 O ATOM 1962 CB VAL D 34 -14.834 -15.434 5.588 1.00 63.85 C ATOM 1963 CG1 VAL D 34 -13.883 -15.913 4.502 1.00 61.36 C ATOM 1964 CG2 VAL D 34 -14.972 -16.495 6.663 1.00 58.70 C ATOM 1965 H VAL D 34 -16.070 -13.543 7.337 1.00 0.00 H ATOM 1966 N LEU D 35 -13.316 -12.618 4.566 1.00 48.17 N ATOM 1967 CA LEU D 35 -13.252 -11.712 3.423 1.00 56.16 C ATOM 1968 C LEU D 35 -12.561 -12.382 2.232 1.00 57.56 C ATOM 1969 O LEU D 35 -11.647 -13.193 2.398 1.00 52.63 O ATOM 1970 CB LEU D 35 -12.498 -10.428 3.774 1.00 58.51 C ATOM 1971 CG LEU D 35 -13.164 -9.552 4.842 1.00 60.63 C ATOM 1972 CD1 LEU D 35 -12.774 -10.037 6.228 1.00 56.87 C ATOM 1973 CD2 LEU D 35 -12.840 -8.076 4.670 1.00 62.58 C ATOM 1974 H LEU D 35 -12.422 -13.010 4.925 1.00 0.00 H ATOM 1975 N ALA D 36 -12.989 -12.018 1.025 1.00 55.55 N ATOM 1976 CA ALA D 36 -12.318 -12.483 -0.175 1.00 57.86 C ATOM 1977 C ALA D 36 -11.036 -11.704 -0.353 1.00 62.34 C ATOM 1978 O ALA D 36 -10.998 -10.498 -0.125 1.00 58.77 O ATOM 1979 CB ALA D 36 -13.195 -12.305 -1.412 1.00 59.07 C ATOM 1980 H ALA D 36 -13.815 -11.392 0.941 1.00 0.00 H ATOM 1981 N ALA D 37 -9.985 -12.397 -0.778 1.00 56.92 N ATOM 1982 CA ALA D 37 -8.690 -11.762 -0.943 1.00 57.45 C ATOM 1983 C ALA D 37 -7.929 -12.466 -2.058 1.00 63.15 C ATOM 1984 O ALA D 37 -8.266 -13.580 -2.459 1.00 68.02 O ATOM 1985 CB ALA D 37 -7.885 -11.793 0.361 1.00 48.89 C ATOM 1986 H ALA D 37 -10.092 -13.408 -0.995 1.00 0.00 H ATOM 1987 N ALA D 38 -6.909 -11.782 -2.560 1.00 59.03 N ATOM 1988 CA ALA D 38 -5.941 -12.306 -3.509 1.00 62.22 C ATOM 1989 C ALA D 38 -4.561 -11.971 -2.972 1.00 58.77 C ATOM 1990 O ALA D 38 -4.421 -11.200 -2.019 1.00 53.90 O ATOM 1991 CB ALA D 38 -6.131 -11.703 -4.907 1.00 54.31 C ATOM 1992 H ALA D 38 -6.793 -10.796 -2.251 1.00 0.00 H ATOM 1993 N GLY D 39 -3.530 -12.536 -3.583 1.00 57.46 N ATOM 1994 CA GLY D 39 -2.186 -12.140 -3.216 1.00 59.25 C ATOM 1995 C GLY D 39 -1.129 -13.033 -3.834 1.00 67.98 C ATOM 1996 O GLY D 39 -1.421 -13.966 -4.586 1.00 60.65 O ATOM 1997 H GLY D 39 -3.684 -13.256 -4.318 1.00 0.00 H ATOM 1998 N GLU D 40 0.120 -12.701 -3.504 1.00 65.05 N ATOM 1999 CA GLU D 40 1.293 -13.476 -3.882 1.00 70.69 C ATOM 2000 C GLU D 40 2.106 -13.785 -2.634 1.00 70.45 C ATOM 2001 O GLU D 40 2.023 -13.085 -1.622 1.00 61.06 O ATOM 2002 CB GLU D 40 2.166 -12.732 -4.895 1.00 65.73 C ATOM 2003 CG GLU D 40 1.425 -12.337 -6.155 1.00 73.94 C ATOM 2004 CD GLU D 40 2.357 -12.014 -7.302 1.00 81.37 C ATOM 2005 OE1 GLU D 40 3.411 -11.386 -7.055 1.00 85.07 O ATOM 2006 OE2 GLU D 40 2.036 -12.392 -8.450 1.00 88.62 O ATOM 2007 H GLU D 40 0.264 -11.837 -2.943 1.00 0.00 H ATOM 2008 N GLY D 41 2.884 -14.854 -2.714 1.00 65.70 N ATOM 2009 CA GLY D 41 3.765 -15.245 -1.632 1.00 71.41 C ATOM 2010 C GLY D 41 4.917 -16.095 -2.139 1.00 80.15 C ATOM 2011 O GLY D 41 5.844 -15.587 -2.773 1.00 87.04 O ATOM 2012 H GLY D 41 2.862 -15.430 -3.580 1.00 0.00 H TER 2013 GLY D 41 ATOM 2014 N ALA D 56 -6.903 -13.705 -9.537 1.00 95.84 N ATOM 2015 CA ALA D 56 -6.192 -14.435 -8.486 1.00 97.53 C ATOM 2016 C ALA D 56 -7.032 -14.528 -7.200 1.00 95.12 C ATOM 2017 O ALA D 56 -6.695 -15.263 -6.266 1.00 86.90 O ATOM 2018 CB ALA D 56 -4.830 -13.771 -8.203 1.00 87.64 C ATOM 2019 HN3 ALA D 56 -7.111 -12.741 -9.208 1.00 0.00 H ATOM 2020 HN2 ALA D 56 -7.792 -14.197 -9.758 1.00 0.00 H ATOM 2021 HN1 ALA D 56 -6.309 -13.661 -10.389 1.00 0.00 H ATOM 2022 N TYR D 57 -8.148 -13.794 -7.182 1.00 90.68 N ATOM 2023 CA TYR D 57 -9.014 -13.686 -6.011 1.00 88.91 C ATOM 2024 C TYR D 57 -9.658 -15.001 -5.595 1.00 90.39 C ATOM 2025 O TYR D 57 -10.887 -15.071 -5.497 1.00 96.74 O ATOM 2026 CB TYR D 57 -10.158 -12.694 -6.254 1.00 86.34 C ATOM 2027 CG TYR D 57 -9.914 -11.240 -5.899 1.00 86.17 C ATOM 2028 CD1 TYR D 57 -9.507 -10.324 -6.866 1.00 89.81 C ATOM 2029 CD2 TYR D 57 -10.133 -10.774 -4.604 1.00 80.17 C ATOM 2030 CE1 TYR D 57 -9.302 -9.003 -6.549 1.00 83.51 C ATOM 2031 CE2 TYR D 57 -9.924 -9.452 -4.279 1.00 75.34 C ATOM 2032 CZ TYR D 57 -9.513 -8.572 -5.257 1.00 78.73 C ATOM 2033 OH TYR D 57 -9.307 -7.243 -4.958 1.00 66.68 O ATOM 2034 HH TYR D 57 -9.017 -6.763 -5.774 1.00 0.00 H ATOM 2035 H TYR D 57 -8.413 -13.275 -8.043 1.00 0.00 H ATOM 2036 N SER D 58 -8.877 -16.037 -5.340 1.00 85.01 N ATOM 2037 CA SER D 58 -9.447 -17.246 -4.771 1.00 88.17 C ATOM 2038 C SER D 58 -8.670 -17.660 -3.534 1.00 82.96 C ATOM 2039 O SER D 58 -8.378 -18.835 -3.322 1.00 88.13 O ATOM 2040 CB SER D 58 -9.519 -18.381 -5.788 1.00 93.87 C ATOM 2041 OG SER D 58 -10.324 -19.423 -5.269 1.00 96.57 O ATOM 2042 HG SER D 58 -9.926 -19.757 -4.426 1.00 0.00 H ATOM 2043 H SER D 58 -7.859 -15.987 -5.546 1.00 0.00 H ATOM 2044 N ASN D 59 -8.344 -16.691 -2.690 1.00 78.74 N ATOM 2045 CA ASN D 59 -7.952 -16.962 -1.316 1.00 69.44 C ATOM 2046 C ASN D 59 -8.960 -16.291 -0.388 1.00 72.34 C ATOM 2047 O ASN D 59 -9.758 -15.444 -0.806 1.00 61.02 O ATOM 2048 CB ASN D 59 -6.514 -16.484 -1.035 1.00 73.13 C ATOM 2049 CG ASN D 59 -5.481 -17.199 -1.907 1.00 83.87 C ATOM 2050 OD1 ASN D 59 -5.371 -18.431 -1.878 1.00 84.05 O ATOM 2051 ND2 ASN D 59 -4.760 -16.434 -2.725 1.00 81.29 N ATOM 2052 HD22 ASN D 59 -4.885 -15.402 -2.716 1.00 0.00 H ATOM 2053 HD21 ASN D 59 -4.072 -16.869 -3.372 1.00 0.00 H ATOM 2054 H ASN D 59 -8.369 -15.705 -3.021 1.00 0.00 H ATOM 2055 N ILE D 60 -8.963 -16.713 0.871 1.00 65.72 N ATOM 2056 CA ILE D 60 -9.868 -16.147 1.854 1.00 55.11 C ATOM 2057 C ILE D 60 -9.065 -15.760 3.084 1.00 66.17 C ATOM 2058 O ILE D 60 -8.022 -16.348 3.389 1.00 59.37 O ATOM 2059 CB ILE D 60 -11.035 -17.097 2.223 1.00 57.99 C ATOM 2060 CG1 ILE D 60 -10.558 -18.531 2.377 1.00 66.85 C ATOM 2061 CG2 ILE D 60 -12.085 -17.088 1.145 1.00 64.63 C ATOM 2062 CD1 ILE D 60 -9.978 -18.819 3.688 1.00 69.57 C ATOM 2063 H ILE D 60 -8.304 -17.464 1.158 1.00 0.00 H ATOM 2064 N LYS D 61 -9.545 -14.730 3.768 1.00 55.33 N ATOM 2065 CA LYS D 61 -8.943 -14.220 4.992 1.00 53.61 C ATOM 2066 C LYS D 61 -9.945 -14.400 6.116 1.00 57.77 C ATOM 2067 O LYS D 61 -11.008 -13.757 6.106 1.00 53.02 O ATOM 2068 CB LYS D 61 -8.565 -12.749 4.848 1.00 47.59 C ATOM 2069 CG LYS D 61 -8.137 -12.104 6.129 1.00 53.18 C ATOM 2070 CD LYS D 61 -7.507 -10.765 5.858 1.00 56.24 C ATOM 2071 CE LYS D 61 -7.184 -10.062 7.170 1.00 56.57 C ATOM 2072 NZ LYS D 61 -6.871 -8.643 6.950 1.00 55.33 N ATOM 2073 HZ1 LYS D 61 -6.048 -8.565 6.320 1.00 0.00 H ATOM 2074 HZ2 LYS D 61 -7.689 -8.172 6.514 1.00 0.00 H ATOM 2075 HZ3 LYS D 61 -6.655 -8.191 7.862 1.00 0.00 H ATOM 2076 H LYS D 61 -10.400 -14.260 3.410 1.00 0.00 H ATOM 2077 N PHE D 62 -9.607 -15.277 7.066 1.00 49.32 N ATOM 2078 CA PHE D 62 -10.325 -15.410 8.323 1.00 59.65 C ATOM 2079 C PHE D 62 -9.788 -14.420 9.346 1.00 57.38 C ATOM 2080 O PHE D 62 -8.580 -14.151 9.406 1.00 55.79 O ATOM 2081 CB PHE D 62 -10.192 -16.826 8.885 1.00 61.67 C ATOM 2082 CG PHE D 62 -10.931 -17.863 8.103 1.00 65.09 C ATOM 2083 CD1 PHE D 62 -10.311 -18.549 7.069 1.00 65.23 C ATOM 2084 CD2 PHE D 62 -12.251 -18.157 8.403 1.00 64.10 C ATOM 2085 CE1 PHE D 62 -10.997 -19.516 6.358 1.00 67.03 C ATOM 2086 CE2 PHE D 62 -12.940 -19.124 7.688 1.00 67.20 C ATOM 2087 CZ PHE D 62 -12.312 -19.803 6.666 1.00 62.65 C ATOM 2088 H PHE D 62 -8.788 -15.896 6.897 1.00 0.00 H ATOM 2089 N GLU D 63 -10.697 -13.870 10.137 1.00 51.23 N ATOM 2090 CA GLU D 63 -10.367 -13.102 11.329 1.00 50.38 C ATOM 2091 C GLU D 63 -11.207 -13.666 12.461 1.00 54.46 C ATOM 2092 O GLU D 63 -12.436 -13.737 12.351 1.00 58.30 O ATOM 2093 CB GLU D 63 -10.639 -11.609 11.137 1.00 52.19 C ATOM 2094 CG GLU D 63 -9.993 -10.997 9.892 1.00 57.60 C ATOM 2095 CD GLU D 63 -10.325 -9.504 9.707 1.00 66.06 C ATOM 2096 OE1 GLU D 63 -11.523 -9.133 9.795 1.00 64.39 O ATOM 2097 OE2 GLU D 63 -9.381 -8.701 9.483 1.00 63.50 O ATOM 2098 H GLU D 63 -11.701 -13.993 9.893 1.00 0.00 H ATOM 2099 N VAL D 64 -10.553 -14.080 13.534 1.00 53.08 N ATOM 2100 CA VAL D 64 -11.220 -14.722 14.656 1.00 56.60 C ATOM 2101 C VAL D 64 -10.783 -14.009 15.915 1.00 56.27 C ATOM 2102 O VAL D 64 -9.583 -13.920 16.197 1.00 60.35 O ATOM 2103 CB VAL D 64 -10.887 -16.223 14.748 1.00 61.17 C ATOM 2104 CG1 VAL D 64 -11.784 -16.909 15.778 1.00 60.32 C ATOM 2105 CG2 VAL D 64 -11.017 -16.878 13.390 1.00 59.25 C ATOM 2106 H VAL D 64 -9.523 -13.941 13.577 1.00 0.00 H ATOM 2107 N LEU D 65 -11.742 -13.511 16.676 1.00 62.21 N ATOM 2108 CA LEU D 65 -11.450 -12.778 17.891 1.00 57.40 C ATOM 2109 C LEU D 65 -11.813 -13.645 19.082 1.00 71.04 C ATOM 2110 O LEU D 65 -12.819 -14.361 19.052 1.00 73.87 O ATOM 2111 CB LEU D 65 -12.214 -11.466 17.935 1.00 61.55 C ATOM 2112 CG LEU D 65 -11.782 -10.307 17.032 1.00 56.02 C ATOM 2113 CD1 LEU D 65 -11.821 -10.656 15.543 1.00 69.21 C ATOM 2114 CD2 LEU D 65 -12.724 -9.190 17.318 1.00 65.48 C ATOM 2115 H LEU D 65 -12.734 -13.649 16.395 1.00 0.00 H ATOM 2116 N THR D 66 -10.974 -13.603 20.116 1.00 69.75 N ATOM 2117 CA THR D 66 -11.111 -14.507 21.248 1.00 69.20 C ATOM 2118 C THR D 66 -10.669 -13.792 22.512 1.00 76.92 C ATOM 2119 O THR D 66 -9.717 -13.006 22.490 1.00 74.64 O ATOM 2120 CB THR D 66 -10.262 -15.777 21.086 1.00 79.90 C ATOM 2121 OG1 THR D 66 -8.877 -15.417 21.123 1.00 77.53 O ATOM 2122 CG2 THR D 66 -10.557 -16.503 19.767 1.00 69.76 C ATOM 2123 HG1 THR D 66 -8.672 -14.985 21.990 1.00 0.00 H ATOM 2124 H THR D 66 -10.202 -12.907 20.114 1.00 0.00 H ATOM 2125 N ALA D 67 -11.342 -14.106 23.621 1.00 72.19 N ATOM 2126 CA ALA D 67 -10.961 -13.543 24.906 1.00 77.81 C ATOM 2127 C ALA D 67 -9.629 -14.094 25.402 1.00 81.57 C ATOM 2128 O ALA D 67 -8.923 -13.411 26.151 1.00 83.22 O ATOM 2129 CB ALA D 67 -12.062 -13.803 25.934 1.00 79.69 C ATOM 2130 H ALA D 67 -12.148 -14.761 23.565 1.00 0.00 H ATOM 2131 N SER D 68 -9.259 -15.305 24.996 1.00 80.56 N ATOM 2132 CA SER D 68 -8.087 -15.978 25.542 1.00 86.04 C ATOM 2133 C SER D 68 -7.087 -16.280 24.437 1.00 84.69 C ATOM 2134 O SER D 68 -7.417 -16.977 23.470 1.00 86.00 O ATOM 2135 CB SER D 68 -8.485 -17.268 26.257 1.00 84.31 C ATOM 2136 OG SER D 68 -8.817 -18.277 25.321 1.00 88.89 O ATOM 2137 HG SER D 68 -8.034 -18.459 24.743 1.00 0.00 H ATOM 2138 H SER D 68 -9.823 -15.787 24.267 1.00 0.00 H ATOM 2139 N ARG D 69 -5.860 -15.768 24.595 1.00 85.09 N ATOM 2140 CA ARG D 69 -4.762 -16.153 23.710 1.00 81.95 C ATOM 2141 C ARG D 69 -4.618 -17.669 23.622 1.00 84.63 C ATOM 2142 O ARG D 69 -4.173 -18.194 22.590 1.00 83.63 O ATOM 2143 CB ARG D 69 -3.453 -15.501 24.180 1.00 82.53 C ATOM 2144 CG ARG D 69 -2.191 -16.041 23.498 1.00 85.54 C ATOM 2145 CD ARG D 69 -1.864 -15.225 22.266 1.00 80.46 C ATOM 2146 NE ARG D 69 -0.943 -15.895 21.356 1.00 84.85 N ATOM 2147 CZ ARG D 69 0.160 -15.325 20.885 1.00 87.39 C ATOM 2148 NH1 ARG D 69 0.458 -14.091 21.259 1.00 82.22 N ATOM 2149 NH2 ARG D 69 0.966 -15.980 20.054 1.00 84.67 N ATOM 2150 HE ARG D 69 -1.161 -16.868 21.061 1.00 0.00 H ATOM 2151 HH12 ARG D 69 1.319 -13.632 20.898 1.00 0.00 H ATOM 2152 HH11 ARG D 69 -0.168 -13.580 21.914 1.00 0.00 H ATOM 2153 HH22 ARG D 69 1.826 -15.520 19.694 1.00 0.00 H ATOM 2154 HH21 ARG D 69 0.736 -16.952 19.765 1.00 0.00 H ATOM 2155 H ARG D 69 -5.685 -15.085 25.360 1.00 0.00 H ATOM 2156 N GLU D 70 -4.999 -18.377 24.690 1.00 89.07 N ATOM 2157 CA GLU D 70 -5.139 -19.829 24.646 1.00 89.22 C ATOM 2158 C GLU D 70 -5.940 -20.269 23.427 1.00 87.77 C ATOM 2159 O GLU D 70 -5.436 -20.981 22.551 1.00 86.22 O ATOM 2160 CB GLU D 70 -5.826 -20.317 25.927 1.00 94.80 C ATOM 2161 CG GLU D 70 -4.960 -20.390 27.167 1.00 95.34 C ATOM 2162 CD GLU D 70 -4.444 -19.040 27.608 1.00 92.69 C ATOM 2163 OE1 GLU D 70 -5.276 -18.148 27.880 1.00 91.98 O ATOM 2164 OE2 GLU D 70 -3.206 -18.874 27.693 1.00 86.22 O ATOM 2165 H GLU D 70 -5.202 -17.878 25.580 1.00 0.00 H ATOM 2166 N LEU D 71 -7.213 -19.857 23.379 1.00 86.93 N ATOM 2167 CA LEU D 71 -8.120 -20.262 22.310 1.00 87.05 C ATOM 2168 C LEU D 71 -7.531 -19.965 20.933 1.00 80.75 C ATOM 2169 O LEU D 71 -7.596 -20.800 20.024 1.00 80.08 O ATOM 2170 CB LEU D 71 -9.472 -19.558 22.492 1.00 87.15 C ATOM 2171 CG LEU D 71 -10.618 -19.965 21.549 1.00 85.67 C ATOM 2172 CD1 LEU D 71 -10.502 -21.443 21.186 1.00 79.16 C ATOM 2173 CD2 LEU D 71 -11.970 -19.653 22.193 1.00 68.46 C ATOM 2174 H LEU D 71 -7.567 -19.228 24.128 1.00 0.00 H ATOM 2175 N ALA D 72 -6.950 -18.779 20.762 1.00 79.83 N ATOM 2176 CA ALA D 72 -6.408 -18.414 19.458 1.00 81.92 C ATOM 2177 C ALA D 72 -5.278 -19.355 19.063 1.00 80.76 C ATOM 2178 O ALA D 72 -5.211 -19.827 17.923 1.00 78.98 O ATOM 2179 CB ALA D 72 -5.932 -16.959 19.477 1.00 71.27 C ATOM 2180 H ALA D 72 -6.883 -18.113 21.558 1.00 0.00 H ATOM 2181 N ASP D 73 -4.398 -19.666 20.015 1.00 84.54 N ATOM 2182 CA ASP D 73 -3.236 -20.487 19.703 1.00 84.59 C ATOM 2183 C ASP D 73 -3.625 -21.925 19.367 1.00 85.77 C ATOM 2184 O ASP D 73 -3.034 -22.533 18.467 1.00 82.02 O ATOM 2185 CB ASP D 73 -2.245 -20.433 20.860 1.00 88.37 C ATOM 2186 CG ASP D 73 -1.375 -19.186 20.810 1.00 89.85 C ATOM 2187 OD1 ASP D 73 -1.133 -18.683 19.688 1.00 91.42 O ATOM 2188 OD2 ASP D 73 -0.930 -18.711 21.878 1.00 89.52 O ATOM 2189 H ASP D 73 -4.542 -19.321 20.985 1.00 0.00 H ATOM 2190 N GLN D 74 -4.615 -22.494 20.060 1.00 88.22 N ATOM 2191 CA GLN D 74 -5.040 -23.845 19.692 1.00 82.68 C ATOM 2192 C GLN D 74 -5.586 -23.865 18.275 1.00 80.73 C ATOM 2193 O GLN D 74 -5.039 -24.552 17.402 1.00 85.90 O ATOM 2194 CB GLN D 74 -6.072 -24.406 20.675 1.00 88.97 C ATOM 2195 CG GLN D 74 -5.685 -24.300 22.141 1.00 97.10 C ATOM 2196 CD GLN D 74 -6.733 -23.589 22.996 1.00 99.01 C ATOM 2197 OE1 GLN D 74 -7.858 -23.356 22.552 1.00105.99 O ATOM 2198 NE2 GLN D 74 -6.358 -23.235 24.229 1.00 95.30 N ATOM 2199 HE22 GLN D 74 -5.397 -23.452 24.563 1.00 0.00 H ATOM 2200 HE21 GLN D 74 -7.027 -22.742 24.855 1.00 0.00 H ATOM 2201 H GLN D 74 -5.074 -21.988 20.844 1.00 0.00 H ATOM 2202 N ILE D 75 -6.626 -23.059 18.012 1.00 83.89 N ATOM 2203 CA ILE D 75 -7.206 -22.954 16.677 1.00 78.83 C ATOM 2204 C ILE D 75 -6.087 -22.852 15.650 1.00 73.57 C ATOM 2205 O ILE D 75 -6.106 -23.523 14.607 1.00 73.45 O ATOM 2206 CB ILE D 75 -8.143 -21.738 16.564 1.00 76.85 C ATOM 2207 CG1 ILE D 75 -9.293 -21.811 17.574 1.00 77.20 C ATOM 2208 CG2 ILE D 75 -8.641 -21.603 15.122 1.00 67.57 C ATOM 2209 CD1 ILE D 75 -10.230 -20.591 17.544 1.00 73.95 C ATOM 2210 H ILE D 75 -7.031 -22.491 18.784 1.00 0.00 H ATOM 2211 N GLN D 76 -5.073 -22.046 15.980 1.00 75.48 N ATOM 2212 CA GLN D 76 -3.992 -21.756 15.045 1.00 76.45 C ATOM 2213 C GLN D 76 -3.173 -23.005 14.753 1.00 76.04 C ATOM 2214 O GLN D 76 -2.955 -23.366 13.589 1.00 78.14 O ATOM 2215 CB GLN D 76 -3.086 -20.659 15.616 1.00 75.76 C ATOM 2216 CG GLN D 76 -1.862 -20.398 14.754 1.00 77.23 C ATOM 2217 CD GLN D 76 -1.036 -19.233 15.243 1.00 71.45 C ATOM 2218 OE1 GLN D 76 -0.600 -18.411 14.450 1.00 71.41 O ATOM 2219 NE2 GLN D 76 -0.818 -19.155 16.552 1.00 82.05 N ATOM 2220 HE22 GLN D 76 -1.210 -19.878 17.188 1.00 0.00 H ATOM 2221 HE21 GLN D 76 -0.256 -18.371 16.940 1.00 0.00 H ATOM 2222 H GLN D 76 -5.054 -21.615 16.926 1.00 0.00 H ATOM 2223 N ASP D 77 -2.694 -23.675 15.809 1.00 78.90 N ATOM 2224 CA ASP D 77 -1.863 -24.870 15.616 1.00 86.87 C ATOM 2225 C ASP D 77 -2.623 -25.977 14.899 1.00 80.16 C ATOM 2226 O ASP D 77 -2.042 -26.721 14.094 1.00 82.99 O ATOM 2227 CB ASP D 77 -1.333 -25.407 16.953 1.00 82.52 C ATOM 2228 CG ASP D 77 -0.863 -24.310 17.869 1.00 85.13 C ATOM 2229 OD1 ASP D 77 -0.885 -24.499 19.103 1.00 83.23 O ATOM 2230 OD2 ASP D 77 -0.517 -23.238 17.330 1.00 88.49 O ATOM 2231 H ASP D 77 -2.912 -23.347 16.772 1.00 0.00 H ATOM 2232 N LYS D 78 -3.912 -26.137 15.218 1.00 83.53 N ATOM 2233 CA LYS D 78 -4.682 -27.206 14.594 1.00 82.26 C ATOM 2234 C LYS D 78 -4.857 -26.946 13.107 1.00 77.49 C ATOM 2235 O LYS D 78 -4.746 -27.866 12.289 1.00 82.27 O ATOM 2236 CB LYS D 78 -6.039 -27.384 15.280 1.00 77.47 C ATOM 2237 CG LYS D 78 -6.042 -27.429 16.805 1.00 83.63 C ATOM 2238 CD LYS D 78 -4.858 -28.138 17.422 1.00 86.66 C ATOM 2239 CE LYS D 78 -3.955 -27.131 18.148 1.00 86.78 C ATOM 2240 NZ LYS D 78 -2.947 -27.719 19.081 1.00 96.25 N ATOM 2241 HZ1 LYS D 78 -3.437 -28.260 19.822 1.00 0.00 H ATOM 2242 HZ2 LYS D 78 -2.313 -28.351 18.551 1.00 0.00 H ATOM 2243 HZ3 LYS D 78 -2.392 -26.955 19.517 1.00 0.00 H ATOM 2244 H LYS D 78 -4.363 -25.502 15.908 1.00 0.00 H ATOM 2245 N VAL D 79 -5.120 -25.687 12.730 1.00 74.74 N ATOM 2246 CA VAL D 79 -5.193 -25.352 11.308 1.00 77.30 C ATOM 2247 C VAL D 79 -3.847 -25.609 10.648 1.00 76.82 C ATOM 2248 O VAL D 79 -3.755 -26.333 9.652 1.00 72.58 O ATOM 2249 CB VAL D 79 -5.651 -23.894 11.088 1.00 77.58 C ATOM 2250 CG1 VAL D 79 -5.374 -23.477 9.624 1.00 68.40 C ATOM 2251 CG2 VAL D 79 -7.135 -23.725 11.430 1.00 65.98 C ATOM 2252 H VAL D 79 -5.272 -24.949 13.447 1.00 0.00 H ATOM 2253 N VAL D 80 -2.784 -25.042 11.217 1.00 79.19 N ATOM 2254 CA VAL D 80 -1.464 -25.111 10.598 1.00 80.65 C ATOM 2255 C VAL D 80 -0.995 -26.558 10.495 1.00 83.56 C ATOM 2256 O VAL D 80 -0.381 -26.952 9.496 1.00 81.08 O ATOM 2257 CB VAL D 80 -0.471 -24.221 11.378 1.00 82.86 C ATOM 2258 CG1 VAL D 80 0.108 -24.930 12.587 1.00 83.40 C ATOM 2259 CG2 VAL D 80 0.646 -23.738 10.477 1.00 84.62 C ATOM 2260 H VAL D 80 -2.897 -24.540 12.121 1.00 0.00 H ATOM 2261 N ALA D 81 -1.316 -27.383 11.496 1.00 77.46 N ATOM 2262 CA ALA D 81 -0.918 -28.787 11.449 1.00 84.64 C ATOM 2263 C ALA D 81 -1.569 -29.499 10.267 1.00 82.10 C ATOM 2264 O ALA D 81 -0.890 -30.168 9.479 1.00 78.13 O ATOM 2265 CB ALA D 81 -1.273 -29.479 12.767 1.00 74.47 C ATOM 2266 H ALA D 81 -1.852 -27.024 12.312 1.00 0.00 H ATOM 2267 N LYS D 82 -2.886 -29.332 10.109 1.00 82.79 N ATOM 2268 CA LYS D 82 -3.647 -30.103 9.131 1.00 80.35 C ATOM 2269 C LYS D 82 -3.410 -29.649 7.692 1.00 85.26 C ATOM 2270 O LYS D 82 -3.579 -30.452 6.764 1.00 82.47 O ATOM 2271 CB LYS D 82 -5.145 -30.016 9.447 1.00 81.50 C ATOM 2272 CG LYS D 82 -5.704 -31.108 10.355 1.00 79.99 C ATOM 2273 CD LYS D 82 -5.448 -30.799 11.823 1.00 78.70 C ATOM 2274 CE LYS D 82 -6.639 -31.158 12.706 1.00 76.20 C ATOM 2275 NZ LYS D 82 -6.346 -30.827 14.134 1.00 75.60 N ATOM 2276 HZ1 LYS D 82 -5.514 -31.366 14.450 1.00 0.00 H ATOM 2277 HZ2 LYS D 82 -6.154 -29.809 14.220 1.00 0.00 H ATOM 2278 HZ3 LYS D 82 -7.166 -31.077 14.722 1.00 0.00 H ATOM 2279 H LYS D 82 -3.382 -28.634 10.699 1.00 0.00 H ATOM 2280 N TYR D 83 -3.035 -28.383 7.472 1.00 84.09 N ATOM 2281 CA TYR D 83 -3.106 -27.842 6.115 1.00 82.38 C ATOM 2282 C TYR D 83 -1.931 -26.975 5.675 1.00 72.54 C ATOM 2283 O TYR D 83 -1.832 -26.700 4.476 1.00 78.50 O ATOM 2284 CB TYR D 83 -4.403 -27.025 5.942 1.00 79.82 C ATOM 2285 CG TYR D 83 -5.661 -27.743 6.393 1.00 81.71 C ATOM 2286 CD1 TYR D 83 -6.190 -28.800 5.652 1.00 78.96 C ATOM 2287 CD2 TYR D 83 -6.319 -27.363 7.559 1.00 78.47 C ATOM 2288 CE1 TYR D 83 -7.340 -29.462 6.065 1.00 71.45 C ATOM 2289 CE2 TYR D 83 -7.464 -28.015 7.979 1.00 81.48 C ATOM 2290 CZ TYR D 83 -7.971 -29.065 7.232 1.00 83.83 C ATOM 2291 OH TYR D 83 -9.111 -29.710 7.661 1.00 81.84 O ATOM 2292 HH TYR D 83 -9.341 -30.431 7.022 1.00 0.00 H ATOM 2293 H TYR D 83 -2.697 -27.791 8.257 1.00 0.00 H ATOM 2294 N PHE D 84 -1.049 -26.526 6.566 1.00 67.27 N ATOM 2295 CA PHE D 84 -0.065 -25.530 6.156 1.00 82.01 C ATOM 2296 C PHE D 84 0.905 -26.090 5.124 1.00 87.32 C ATOM 2297 O PHE D 84 1.213 -25.424 4.127 1.00 85.80 O ATOM 2298 CB PHE D 84 0.701 -25.008 7.363 1.00 90.82 C ATOM 2299 CG PHE D 84 1.966 -24.280 7.005 1.00 93.34 C ATOM 2300 CD1 PHE D 84 3.184 -24.674 7.545 1.00 96.86 C ATOM 2301 CD2 PHE D 84 1.942 -23.199 6.129 1.00 91.31 C ATOM 2302 CE1 PHE D 84 4.357 -24.008 7.218 1.00 95.47 C ATOM 2303 CE2 PHE D 84 3.113 -22.525 5.797 1.00 96.47 C ATOM 2304 CZ PHE D 84 4.321 -22.932 6.344 1.00100.37 C ATOM 2305 H PHE D 84 -1.062 -26.881 7.543 1.00 0.00 H ATOM 2306 N ASP D 85 1.406 -27.310 5.353 1.00 93.86 N ATOM 2307 CA ASP D 85 2.391 -27.889 4.443 1.00 89.77 C ATOM 2308 C ASP D 85 1.802 -28.108 3.055 1.00 82.06 C ATOM 2309 O ASP D 85 2.480 -27.893 2.043 1.00 81.31 O ATOM 2310 CB ASP D 85 2.929 -29.200 5.020 1.00 95.50 C ATOM 2311 CG ASP D 85 4.226 -29.650 4.353 1.00103.75 C ATOM 2312 OD1 ASP D 85 5.152 -28.818 4.221 1.00100.75 O ATOM 2313 OD2 ASP D 85 4.330 -30.842 3.977 1.00104.58 O ATOM 2314 H ASP D 85 1.092 -27.849 6.185 1.00 0.00 H ATOM 2315 N ASP D 86 0.531 -28.503 2.986 1.00 84.42 N ATOM 2316 CA ASP D 86 -0.080 -28.878 1.716 1.00 83.70 C ATOM 2317 C ASP D 86 -0.815 -27.736 1.014 1.00 88.32 C ATOM 2318 O ASP D 86 -1.076 -27.847 -0.189 1.00 83.74 O ATOM 2319 CB ASP D 86 -1.048 -30.052 1.930 1.00 91.66 C ATOM 2320 CG ASP D 86 -0.328 -31.367 2.232 1.00 96.69 C ATOM 2321 OD1 ASP D 86 0.407 -31.868 1.352 1.00 97.25 O ATOM 2322 OD2 ASP D 86 -0.501 -31.906 3.347 1.00 96.33 O ATOM 2323 H ASP D 86 -0.037 -28.545 3.856 1.00 0.00 H ATOM 2324 N TYR D 87 -1.158 -26.646 1.715 1.00 86.73 N ATOM 2325 CA TYR D 87 -1.876 -25.529 1.111 1.00 81.25 C ATOM 2326 C TYR D 87 -1.140 -24.220 1.369 1.00 72.04 C ATOM 2327 O TYR D 87 -0.456 -24.064 2.384 1.00 72.45 O ATOM 2328 CB TYR D 87 -3.311 -25.426 1.651 1.00 77.97 C ATOM 2329 CG TYR D 87 -4.127 -26.681 1.465 1.00 82.64 C ATOM 2330 CD1 TYR D 87 -4.829 -26.910 0.289 1.00 89.74 C ATOM 2331 CD2 TYR D 87 -4.190 -27.645 2.466 1.00 89.78 C ATOM 2332 CE1 TYR D 87 -5.579 -28.067 0.117 1.00 90.73 C ATOM 2333 CE2 TYR D 87 -4.932 -28.802 2.307 1.00 86.47 C ATOM 2334 CZ TYR D 87 -5.626 -29.010 1.132 1.00 92.53 C ATOM 2335 OH TYR D 87 -6.365 -30.166 0.972 1.00 94.20 O ATOM 2336 HH TYR D 87 -6.797 -30.159 0.081 1.00 0.00 H ATOM 2337 H TYR D 87 -0.904 -26.595 2.722 1.00 0.00 H ATOM 2338 N SER D 88 -1.276 -23.276 0.436 1.00 71.27 N ATOM 2339 CA SER D 88 -0.716 -21.947 0.656 1.00 77.13 C ATOM 2340 C SER D 88 -1.538 -21.243 1.733 1.00 68.26 C ATOM 2341 O SER D 88 -2.758 -21.115 1.612 1.00 71.98 O ATOM 2342 CB SER D 88 -0.670 -21.139 -0.644 1.00 79.09 C ATOM 2343 OG SER D 88 -1.768 -21.403 -1.498 1.00 77.74 O ATOM 2344 HG SER D 88 -1.685 -20.855 -2.319 1.00 0.00 H ATOM 2345 H SER D 88 -1.781 -23.488 -0.448 1.00 0.00 H ATOM 2346 N CYS D 89 -0.873 -20.833 2.807 1.00 58.78 N ATOM 2347 CA CYS D 89 -1.562 -20.520 4.043 1.00 68.22 C ATOM 2348 C CYS D 89 -0.635 -19.735 4.956 1.00 73.00 C ATOM 2349 O CYS D 89 0.537 -20.095 5.098 1.00 70.09 O ATOM 2350 CB CYS D 89 -2.027 -21.800 4.730 1.00 72.07 C ATOM 2351 SG CYS D 89 -2.223 -21.605 6.500 1.00 91.28 S ATOM 2352 H CYS D 89 0.161 -20.735 2.760 1.00 0.00 H ATOM 2353 N ILE D 90 -1.154 -18.654 5.561 1.00 66.88 N ATOM 2354 CA ILE D 90 -0.401 -17.836 6.508 1.00 61.54 C ATOM 2355 C ILE D 90 -1.300 -17.436 7.669 1.00 60.52 C ATOM 2356 O ILE D 90 -2.528 -17.469 7.582 1.00 62.31 O ATOM 2357 CB ILE D 90 0.213 -16.562 5.869 1.00 66.26 C ATOM 2358 CG1 ILE D 90 -0.858 -15.488 5.646 1.00 71.64 C ATOM 2359 CG2 ILE D 90 0.927 -16.883 4.563 1.00 62.31 C ATOM 2360 CD1 ILE D 90 -0.284 -14.142 5.247 1.00 67.00 C ATOM 2361 H ILE D 90 -2.136 -18.388 5.345 1.00 0.00 H ATOM 2362 N THR D 91 -0.665 -17.028 8.757 1.00 57.94 N ATOM 2363 CA THR D 91 -1.385 -16.711 9.975 1.00 55.96 C ATOM 2364 C THR D 91 -0.560 -15.720 10.786 1.00 64.13 C ATOM 2365 O THR D 91 0.656 -15.620 10.607 1.00 67.96 O ATOM 2366 CB THR D 91 -1.680 -17.983 10.770 1.00 60.24 C ATOM 2367 OG1 THR D 91 -2.518 -17.662 11.877 1.00 66.39 O ATOM 2368 CG2 THR D 91 -0.378 -18.618 11.292 1.00 59.70 C ATOM 2369 HG1 THR D 91 -3.366 -17.273 11.546 1.00 0.00 H ATOM 2370 H THR D 91 0.370 -16.933 8.738 1.00 0.00 H ATOM 2371 N TYR D 92 -1.242 -14.973 11.661 1.00 55.17 N ATOM 2372 CA TYR D 92 -0.624 -14.043 12.602 1.00 61.75 C ATOM 2373 C TYR D 92 -1.664 -13.594 13.617 1.00 56.63 C ATOM 2374 O TYR D 92 -2.868 -13.661 13.368 1.00 60.91 O ATOM 2375 CB TYR D 92 -0.011 -12.821 11.909 1.00 63.83 C ATOM 2376 CG TYR D 92 -0.933 -12.086 10.964 1.00 60.09 C ATOM 2377 CD1 TYR D 92 -1.822 -11.109 11.426 1.00 67.46 C ATOM 2378 CD2 TYR D 92 -0.889 -12.340 9.606 1.00 62.62 C ATOM 2379 CE1 TYR D 92 -2.657 -10.422 10.538 1.00 56.66 C ATOM 2380 CE2 TYR D 92 -1.708 -11.677 8.725 1.00 62.91 C ATOM 2381 CZ TYR D 92 -2.590 -10.720 9.192 1.00 58.32 C ATOM 2382 OH TYR D 92 -3.388 -10.075 8.273 1.00 58.75 O ATOM 2383 HH TYR D 92 -3.966 -9.421 8.741 1.00 0.00 H ATOM 2384 H TYR D 92 -2.278 -15.060 11.672 1.00 0.00 H ATOM 2385 N ILE D 93 -1.187 -13.123 14.759 1.00 57.94 N ATOM 2386 CA ILE D 93 -2.060 -12.720 15.856 1.00 59.30 C ATOM 2387 C ILE D 93 -1.731 -11.287 16.260 1.00 65.48 C ATOM 2388 O ILE D 93 -0.565 -10.874 16.230 1.00 66.11 O ATOM 2389 CB ILE D 93 -1.912 -13.686 17.053 1.00 65.64 C ATOM 2390 CG1 ILE D 93 -2.449 -15.073 16.679 1.00 65.98 C ATOM 2391 CG2 ILE D 93 -2.599 -13.145 18.305 1.00 64.00 C ATOM 2392 CD1 ILE D 93 -2.177 -16.141 17.717 1.00 76.64 C ATOM 2393 H ILE D 93 -0.157 -13.038 14.878 1.00 0.00 H ATOM 2394 N SER D 94 -2.764 -10.523 16.622 1.00 55.59 N ATOM 2395 CA SER D 94 -2.592 -9.212 17.232 1.00 62.39 C ATOM 2396 C SER D 94 -3.609 -9.064 18.353 1.00 61.81 C ATOM 2397 O SER D 94 -4.386 -9.977 18.639 1.00 67.15 O ATOM 2398 CB SER D 94 -2.736 -8.076 16.212 1.00 60.91 C ATOM 2399 OG SER D 94 -3.889 -8.238 15.421 1.00 59.15 O ATOM 2400 HG SER D 94 -3.952 -7.491 14.775 1.00 0.00 H ATOM 2401 H SER D 94 -3.729 -10.878 16.462 1.00 0.00 H ATOM 2402 N THR D 95 -3.591 -7.913 19.007 1.00 59.13 N ATOM 2403 CA THR D 95 -4.572 -7.611 20.031 1.00 64.15 C ATOM 2404 C THR D 95 -5.382 -6.398 19.603 1.00 66.53 C ATOM 2405 O THR D 95 -4.901 -5.533 18.860 1.00 57.52 O ATOM 2406 CB THR D 95 -3.928 -7.351 21.403 1.00 70.49 C ATOM 2407 OG1 THR D 95 -3.406 -6.017 21.447 1.00 73.16 O ATOM 2408 CG2 THR D 95 -2.800 -8.349 21.675 1.00 74.15 C ATOM 2409 HG1 THR D 95 -4.142 -5.371 21.302 1.00 0.00 H ATOM 2410 H THR D 95 -2.858 -7.211 18.781 1.00 0.00 H ATOM 2411 N VAL D 96 -6.636 -6.370 20.066 1.00 60.42 N ATOM 2412 CA VAL D 96 -7.557 -5.265 19.839 1.00 60.68 C ATOM 2413 C VAL D 96 -8.360 -5.037 21.119 1.00 62.26 C ATOM 2414 O VAL D 96 -8.301 -5.823 22.064 1.00 67.07 O ATOM 2415 CB VAL D 96 -8.493 -5.535 18.649 1.00 57.18 C ATOM 2416 CG1 VAL D 96 -7.673 -5.911 17.377 1.00 53.48 C ATOM 2417 CG2 VAL D 96 -9.478 -6.626 19.005 1.00 53.80 C ATOM 2418 H VAL D 96 -6.973 -7.183 20.620 1.00 0.00 H ATOM 2419 N GLU D 97 -9.114 -3.941 21.147 1.00 51.69 N ATOM 2420 CA GLU D 97 -9.898 -3.556 22.318 1.00 66.89 C ATOM 2421 C GLU D 97 -11.385 -3.627 21.982 1.00 59.96 C ATOM 2422 O GLU D 97 -11.863 -2.875 21.125 1.00 59.91 O ATOM 2423 CB GLU D 97 -9.516 -2.152 22.791 1.00 58.70 C ATOM 2424 CG GLU D 97 -10.469 -1.540 23.812 1.00 77.98 C ATOM 2425 CD GLU D 97 -9.945 -0.226 24.375 1.00 80.89 C ATOM 2426 OE1 GLU D 97 -8.833 0.191 23.978 1.00 84.25 O ATOM 2427 OE2 GLU D 97 -10.637 0.396 25.210 1.00 81.02 O ATOM 2428 H GLU D 97 -9.146 -3.335 20.302 1.00 0.00 H ATOM 2429 N ALA D 98 -12.108 -4.523 22.657 1.00 61.23 N ATOM 2430 CA ALA D 98 -13.517 -4.784 22.393 1.00 60.50 C ATOM 2431 C ALA D 98 -14.379 -4.172 23.501 1.00 72.42 C ATOM 2432 O ALA D 98 -13.914 -3.332 24.278 1.00 74.77 O ATOM 2433 CB ALA D 98 -13.731 -6.298 22.236 1.00 57.29 C ATOM 2434 H ALA D 98 -11.641 -5.064 23.412 1.00 0.00 H ATOM 2435 N LEU D 99 -15.642 -4.571 23.578 1.00 77.68 N ATOM 2436 CA LEU D 99 -16.513 -3.995 24.591 1.00 72.87 C ATOM 2437 C LEU D 99 -16.996 -5.037 25.587 1.00 77.30 C ATOM 2438 O LEU D 99 -16.864 -4.849 26.794 1.00 77.09 O ATOM 2439 CB LEU D 99 -17.698 -3.301 23.928 1.00 79.45 C ATOM 2440 CG LEU D 99 -17.398 -1.878 23.455 1.00 76.56 C ATOM 2441 CD1 LEU D 99 -18.681 -1.161 23.075 1.00 68.90 C ATOM 2442 CD2 LEU D 99 -16.620 -1.095 24.514 1.00 81.29 C ATOM 2443 H LEU D 99 -16.006 -5.289 22.920 1.00 0.00 H TER 2444 LEU D 99 HETATM 2445 O HOH 1 -21.140 -5.194 0.163 1.00 59.09 O HETATM 2446 O HOH 2 -1.369 -0.432 -11.436 1.00 60.14 O HETATM 2447 O HOH 3 -14.321 5.303 -3.276 1.00 66.73 O HETATM 2448 O HOH 4 10.294 -9.514 5.324 1.00 59.34 O HETATM 2449 O HOH 5 6.987 9.291 3.160 1.00 58.87 O HETATM 2450 O HOH 6 -9.215 -6.434 6.450 1.00 54.42 O HETATM 2451 O HOH 7 12.883 1.582 10.450 1.00 57.06 O HETATM 2452 O HOH 8 0.054 3.089 21.813 1.00 62.58 O HETATM 2453 O HOH 9 -10.070 12.181 13.066 1.00 61.65 O HETATM 2454 O HOH 10 -23.112 3.334 23.289 1.00 58.20 O HETATM 2455 O HOH 11 -30.403 -1.572 18.251 1.00 64.27 O HETATM 2456 O HOH 12 -21.606 -7.071 1.425 1.00 58.24 O HETATM 2457 O HOH 13 -28.470 1.862 6.241 1.00 50.45 O HETATM 2458 O HOH 14 2.962 4.588 8.895 1.00 44.22 O HETATM 2459 O HOH 15 -27.805 0.845 3.105 1.00 50.70 O HETATM 2460 O HOH 16 -19.162 -10.691 8.818 1.00 49.69 O HETATM 2461 O HOH 17 7.647 -16.022 -1.334 1.00 70.11 O HETATM 2462 O HOH 18 -2.859 -26.066 21.130 1.00 72.78 O HETATM 2463 O HOH 19 -26.098 -11.833 9.300 1.00 73.88 O HETATM 2464 O HOH 20 2.600 -20.779 13.518 1.00 75.85 O HETATM 2465 P CMP A 21 -1.087 -17.015 -2.130 1.00 0.26 P HETATM 2466 O1P CMP A 21 -2.097 -17.448 -3.161 1.00 -0.62 O HETATM 2467 O2P CMP A 21 0.382 -16.904 -2.448 1.00 -0.62 O HETATM 2468 O5' CMP A 21 -1.166 -18.006 -0.874 1.00 -0.25 O HETATM 2469 C5' CMP A 21 -0.844 -17.569 0.446 1.00 0.11 C HETATM 2470 C4' CMP A 21 -1.298 -16.144 0.639 1.00 0.12 C HETATM 2471 O4' CMP A 21 -0.777 -15.542 1.845 1.00 -0.34 O HETATM 2472 C1' CMP A 21 -0.684 -14.134 1.653 1.00 0.20 C HETATM 2473 C2' CMP A 21 -1.092 -13.843 0.200 1.00 0.14 C HETATM 2474 C3' CMP A 21 -0.827 -15.204 -0.434 1.00 0.15 C HETATM 2475 O3' CMP A 21 -1.468 -15.490 -1.654 1.00 -0.25 O HETATM 2476 H4 CMP A 21 0.255 -15.318 -0.597 1.00 0.07 H HETATM 2477 O2' CMP A 21 -2.481 -13.531 0.180 1.00 -0.38 O HETATM 2478 H6 CMP A 21 -2.619 -12.680 0.580 1.00 0.21 H HETATM 2479 H5 CMP A 21 -0.501 -13.039 -0.263 1.00 0.07 H HETATM 2480 N9 CMP A 21 0.698 -13.702 1.939 1.00 -0.19 N HETATM 2481 C8 CMP A 21 1.823 -14.441 1.764 1.00 0.11 C HETATM 2482 N7 CMP A 21 2.934 -13.738 2.118 1.00 -0.30 N HETATM 2483 C5 CMP A 21 2.527 -12.517 2.544 1.00 0.10 C HETATM 2484 C6 CMP A 21 3.169 -11.273 3.054 1.00 0.13 C HETATM 2485 N6 CMP A 21 4.517 -11.145 3.229 1.00 -0.32 N HETATM 2486 H9 CMP A 21 4.909 -10.261 3.585 1.00 0.18 H HETATM 2487 H10 CMP A 21 5.143 -11.932 3.005 1.00 0.18 H HETATM 2488 N1 CMP A 21 2.352 -10.240 3.372 1.00 -0.27 N HETATM 2489 C2 CMP A 21 1.022 -10.316 3.230 1.00 0.05 C HETATM 2490 N3 CMP A 21 0.364 -11.382 2.768 1.00 -0.27 N HETATM 2491 C4 CMP A 21 1.051 -12.500 2.413 1.00 0.16 C HETATM 2492 H11 CMP A 21 0.437 -9.448 3.511 1.00 0.10 H HETATM 2493 H8 CMP A 21 1.835 -15.463 1.389 1.00 0.13 H HETATM 2494 H7 CMP A 21 -1.372 -13.614 2.336 1.00 0.10 H HETATM 2495 H3 CMP A 21 -2.398 -16.147 0.670 1.00 0.07 H HETATM 2496 H1 CMP A 21 0.244 -17.628 0.595 1.00 0.06 H HETATM 2497 H2 CMP A 21 -1.350 -18.215 1.178 1.00 0.06 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 360 361 365 366 367 CONECT 365 360 CONECT 366 360 CONECT 367 360 CONECT 782 783 789 790 791 CONECT 789 782 CONECT 790 782 CONECT 791 782 CONECT 1157 1158 1162 1163 1164 CONECT 1162 1157 CONECT 1163 1157 CONECT 1164 1157 CONECT 1647 1648 1654 1655 1656 CONECT 1654 1647 CONECT 1655 1647 CONECT 1656 1647 CONECT 2014 2015 2019 2020 2021 CONECT 2019 2014 CONECT 2020 2014 CONECT 2021 2014 CONECT 2465 2466 2467 2468 2475 CONECT 2466 2465 CONECT 2467 2465 CONECT 2468 2465 2469 CONECT 2469 2468 2470 2496 2497 CONECT 2470 2469 2471 2474 2495 CONECT 2471 2470 2472 CONECT 2472 2471 2473 2480 2494 CONECT 2473 2472 2474 2477 2479 CONECT 2474 2470 2473 2475 2476 CONECT 2475 2465 2474 CONECT 2476 2474 CONECT 2477 2473 2478 CONECT 2478 2477 CONECT 2479 2473 CONECT 2480 2472 2481 2491 CONECT 2481 2480 2482 2493 CONECT 2482 2481 2483 CONECT 2483 2482 2484 2491 CONECT 2484 2483 2485 2488 CONECT 2485 2484 2486 2487 CONECT 2486 2485 CONECT 2487 2485 CONECT 2488 2484 2489 CONECT 2489 2488 2490 2492 CONECT 2490 2489 2491 CONECT 2491 2480 2483 2490 CONECT 2492 2489 CONECT 2493 2481 CONECT 2494 2472 CONECT 2495 2470 CONECT 2496 2469 CONECT 2497 2469 MASTER 0 0 0 0 0 0 0 0 2491 6 57 23 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 6mmq
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%
6mmo
RCSB PDB
PDBbind
104aa, >6MMO_1|Chains... at 100%
6mmc
RCSB PDB
PDBbind
104aa, >6MMC_1|Chain... at 100%
6mm2
RCSB PDB
PDBbind
104aa, >6MM2_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6mmq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Carbon regulatory PII-like protein SbtB
Ligand Name
cAMP
EC.Number
E.C.-.-.-.-
Resolution
2.02(Å)
Affinity (Kd/Ki/IC50)
Kd=238uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Biorxiv Vol. 58: pp. 5030-5039
Ligand Properties
Formula
C
1
0
H
1
3
N
5
O
6
P
Molecular Weight
330.214
Exact Mass
330.060
No. of atoms
35
No. of bonds
38
Polar Surface Area
171.59
LOGP Value
-2.64 (
Computed with XLOGP3
)
-0.67 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H]2OP(O)(O)OC[C@H]2O[C@H]1n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H14N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16-18,22H,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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